USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=19 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 Single : A 1 MET CE :methyl -159:sc= -0.0208 (180deg=-0.488) USER MOD Single : A 1 MET N :NH3+ -176:sc= 1.24 (180deg=1.12) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0456 USER MOD Single : A 11 LYS NZ :NH3+ -163:sc= 1.2 (180deg=1.17) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 56:sc= 0.592 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= -0.0872 K(o=-0.087,f=-0.7) USER MOD Single : A 27 LYS NZ :NH3+ -156:sc= 0.843 (180deg=0.21) USER MOD Single : A 29 LYS NZ :NH3+ -169:sc= 1.02 (180deg=0.675) USER MOD Single : A 31 GLN : amide:sc=-0.00985 X(o=-0.0098,f=-0.3) USER MOD Single : A 33 LYS NZ :NH3+ 161:sc= 0.558 (180deg=0.382) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.089) USER MOD Single : A 41 GLN : amide:sc= 0.348 K(o=0.35,f=-3.1) USER MOD Single : A 48 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0539) USER MOD Single : A 49 GLN : amide:sc= -0.632 K(o=-0.63,f=0) USER MOD Single : A 55 THR OG1 : rot -64:sc= 1.15 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -110:sc= 0.342 USER MOD Single : A 60 ASN : amide:sc= -0.319 X(o=-0.32,f=-0.17) USER MOD Single : A 62 GLN : amide:sc= -1.15 K(o=-1.2,f=-0.079) USER MOD Single : A 63 LYS NZ :NH3+ 162:sc= 1.14 (180deg=1.07) USER MOD Single : A 65 SER OG : rot 89:sc= 0.654 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.065 31.158 15.641 1.00 0.00 N ATOM 2 CA MET A 1 14.002 30.874 17.086 1.00 0.00 C ATOM 3 C MET A 1 15.209 31.434 17.836 1.00 0.00 C ATOM 4 O MET A 1 16.293 31.026 17.412 1.00 0.00 O ATOM 5 CB MET A 1 13.874 29.379 17.386 1.00 0.00 C ATOM 6 CG MET A 1 13.591 28.928 18.823 1.00 0.00 C ATOM 7 SD MET A 1 13.551 27.139 19.043 1.00 0.00 S ATOM 8 CE MET A 1 15.311 26.811 19.342 1.00 0.00 C ATOM 0 H1 MET A 1 13.195 30.820 15.183 1.00 0.00 H new ATOM 0 H2 MET A 1 14.159 32.183 15.492 1.00 0.00 H new ATOM 0 H3 MET A 1 14.886 30.672 15.227 1.00 0.00 H new ATOM 0 HA MET A 1 13.101 31.376 17.439 1.00 0.00 H new ATOM 0 HB2 MET A 1 13.077 28.984 16.755 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.800 28.900 17.068 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.354 29.346 19.480 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.634 29.343 19.140 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.527 25.764 19.131 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.915 27.444 18.692 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.550 27.028 20.383 1.00 0.00 H new ATOM 20 N GLN A 2 15.061 32.095 18.976 1.00 0.00 N ATOM 21 CA GLN A 2 16.244 32.655 19.598 1.00 0.00 C ATOM 22 C GLN A 2 16.684 31.683 20.694 1.00 0.00 C ATOM 23 O GLN A 2 15.856 31.005 21.293 1.00 0.00 O ATOM 24 CB GLN A 2 15.962 34.002 20.274 1.00 0.00 C ATOM 25 CG GLN A 2 16.429 35.323 19.680 1.00 0.00 C ATOM 26 CD GLN A 2 15.799 35.532 18.299 1.00 0.00 C ATOM 27 OE1 GLN A 2 14.775 35.006 17.881 1.00 0.00 O ATOM 28 NE2 GLN A 2 16.541 36.342 17.559 1.00 0.00 N ATOM 0 H GLN A 2 14.180 32.250 19.466 1.00 0.00 H new ATOM 0 HA GLN A 2 16.999 32.807 18.827 1.00 0.00 H new ATOM 0 HB2 GLN A 2 14.880 34.075 20.387 1.00 0.00 H new ATOM 0 HB3 GLN A 2 16.384 33.943 21.277 1.00 0.00 H new ATOM 0 HG2 GLN A 2 16.155 36.145 20.341 1.00 0.00 H new ATOM 0 HG3 GLN A 2 17.516 35.329 19.597 1.00 0.00 H new ATOM 0 HE21 GLN A 2 17.387 36.758 17.949 1.00 0.00 H new ATOM 0 HE22 GLN A 2 16.267 36.550 16.599 1.00 0.00 H new ATOM 37 N ILE A 3 17.987 31.656 20.939 1.00 0.00 N ATOM 38 CA ILE A 3 18.642 30.919 21.998 1.00 0.00 C ATOM 39 C ILE A 3 19.932 31.666 22.366 1.00 0.00 C ATOM 40 O ILE A 3 20.335 32.532 21.575 1.00 0.00 O ATOM 41 CB ILE A 3 18.950 29.496 21.546 1.00 0.00 C ATOM 42 CG1 ILE A 3 19.955 29.426 20.403 1.00 0.00 C ATOM 43 CG2 ILE A 3 17.739 28.585 21.302 1.00 0.00 C ATOM 44 CD1 ILE A 3 20.678 28.075 20.307 1.00 0.00 C ATOM 0 H ILE A 3 18.649 32.181 20.367 1.00 0.00 H new ATOM 0 HA ILE A 3 17.991 30.850 22.869 1.00 0.00 H new ATOM 0 HB ILE A 3 19.428 29.072 22.429 1.00 0.00 H new ATOM 0 HG12 ILE A 3 19.439 29.621 19.463 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.694 30.217 20.530 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.082 27.600 20.985 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.164 28.490 22.223 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.109 29.017 20.524 1.00 0.00 H new ATOM 0 HD11 ILE A 3 21.378 28.096 19.472 1.00 0.00 H new ATOM 0 HD12 ILE A 3 21.222 27.887 21.232 1.00 0.00 H new ATOM 0 HD13 ILE A 3 19.947 27.282 20.148 1.00 0.00 H new ATOM 56 N PHE A 4 20.537 31.545 23.542 1.00 0.00 N ATOM 57 CA PHE A 4 21.690 32.238 24.077 1.00 0.00 C ATOM 58 C PHE A 4 22.810 31.200 24.133 1.00 0.00 C ATOM 59 O PHE A 4 22.620 30.018 24.389 1.00 0.00 O ATOM 60 CB PHE A 4 21.492 32.823 25.489 1.00 0.00 C ATOM 61 CG PHE A 4 20.511 33.963 25.635 1.00 0.00 C ATOM 62 CD1 PHE A 4 20.789 35.205 25.064 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.347 33.869 26.401 1.00 0.00 C ATOM 64 CE1 PHE A 4 19.847 36.253 25.060 1.00 0.00 C ATOM 65 CE2 PHE A 4 18.382 34.895 26.441 1.00 0.00 C ATOM 66 CZ PHE A 4 18.614 36.039 25.680 1.00 0.00 C ATOM 0 H PHE A 4 20.181 30.874 24.222 1.00 0.00 H new ATOM 0 HA PHE A 4 21.901 33.094 23.436 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.171 32.015 26.147 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.462 33.164 25.852 1.00 0.00 H new ATOM 0 HD1 PHE A 4 21.756 35.368 24.611 1.00 0.00 H new ATOM 0 HD2 PHE A 4 19.180 32.976 26.985 1.00 0.00 H new ATOM 0 HE1 PHE A 4 20.073 37.198 24.589 1.00 0.00 H new ATOM 0 HE2 PHE A 4 17.490 34.798 27.043 1.00 0.00 H new ATOM 0 HZ PHE A 4 17.828 36.771 25.568 1.00 0.00 H new ATOM 76 N VAL A 5 24.024 31.640 23.843 1.00 0.00 N ATOM 77 CA VAL A 5 25.218 30.846 24.078 1.00 0.00 C ATOM 78 C VAL A 5 25.997 31.588 25.161 1.00 0.00 C ATOM 79 O VAL A 5 26.180 32.798 25.075 1.00 0.00 O ATOM 80 CB VAL A 5 26.065 30.846 22.805 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.454 30.255 23.057 1.00 0.00 C ATOM 82 CG2 VAL A 5 25.429 30.150 21.604 1.00 0.00 C ATOM 0 H VAL A 5 24.209 32.558 23.438 1.00 0.00 H new ATOM 0 HA VAL A 5 24.977 29.821 24.361 1.00 0.00 H new ATOM 0 HB VAL A 5 26.144 31.901 22.541 1.00 0.00 H new ATOM 0 HG11 VAL A 5 28.029 30.270 22.131 1.00 0.00 H new ATOM 0 HG12 VAL A 5 27.969 30.846 23.814 1.00 0.00 H new ATOM 0 HG13 VAL A 5 27.354 29.227 23.405 1.00 0.00 H new ATOM 0 HG21 VAL A 5 26.106 30.204 20.752 1.00 0.00 H new ATOM 0 HG22 VAL A 5 25.236 29.106 21.849 1.00 0.00 H new ATOM 0 HG23 VAL A 5 24.490 30.643 21.353 1.00 0.00 H new ATOM 92 N LYS A 6 26.592 30.930 26.161 1.00 0.00 N ATOM 93 CA LYS A 6 27.629 31.429 27.032 1.00 0.00 C ATOM 94 C LYS A 6 29.004 30.904 26.597 1.00 0.00 C ATOM 95 O LYS A 6 29.087 29.815 26.034 1.00 0.00 O ATOM 96 CB LYS A 6 27.222 31.049 28.457 1.00 0.00 C ATOM 97 CG LYS A 6 26.287 32.115 29.015 1.00 0.00 C ATOM 98 CD LYS A 6 25.816 31.735 30.416 1.00 0.00 C ATOM 99 CE LYS A 6 25.833 32.996 31.289 1.00 0.00 C ATOM 100 NZ LYS A 6 25.077 32.837 32.533 1.00 0.00 N ATOM 0 H LYS A 6 26.335 29.969 26.388 1.00 0.00 H new ATOM 0 HA LYS A 6 27.732 32.513 26.980 1.00 0.00 H new ATOM 0 HB2 LYS A 6 26.727 30.078 28.459 1.00 0.00 H new ATOM 0 HB3 LYS A 6 28.106 30.958 29.088 1.00 0.00 H new ATOM 0 HG2 LYS A 6 26.800 33.076 29.046 1.00 0.00 H new ATOM 0 HG3 LYS A 6 25.427 32.234 28.356 1.00 0.00 H new ATOM 0 HD2 LYS A 6 24.812 31.314 30.377 1.00 0.00 H new ATOM 0 HD3 LYS A 6 26.466 30.970 30.841 1.00 0.00 H new ATOM 0 HE2 LYS A 6 26.865 33.253 31.527 1.00 0.00 H new ATOM 0 HE3 LYS A 6 25.419 33.830 30.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 25.123 33.719 33.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 24.085 32.619 32.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 25.486 32.060 33.091 1.00 0.00 H new ATOM 114 N THR A 7 30.093 31.658 26.712 1.00 0.00 N ATOM 115 CA THR A 7 31.444 31.362 26.284 1.00 0.00 C ATOM 116 C THR A 7 32.254 31.248 27.581 1.00 0.00 C ATOM 117 O THR A 7 31.967 31.998 28.508 1.00 0.00 O ATOM 118 CB THR A 7 31.948 32.492 25.386 1.00 0.00 C ATOM 119 OG1 THR A 7 31.127 32.581 24.234 1.00 0.00 O ATOM 120 CG2 THR A 7 33.409 32.396 24.945 1.00 0.00 C ATOM 0 H THR A 7 30.040 32.578 27.150 1.00 0.00 H new ATOM 0 HA THR A 7 31.523 30.445 25.700 1.00 0.00 H new ATOM 0 HB THR A 7 31.892 33.386 26.007 1.00 0.00 H new ATOM 0 HG1 THR A 7 31.448 33.306 23.659 1.00 0.00 H new ATOM 0 HG21 THR A 7 33.655 33.249 24.313 1.00 0.00 H new ATOM 0 HG22 THR A 7 34.055 32.396 25.823 1.00 0.00 H new ATOM 0 HG23 THR A 7 33.560 31.474 24.384 1.00 0.00 H new ATOM 128 N LEU A 8 33.204 30.315 27.627 1.00 0.00 N ATOM 129 CA LEU A 8 33.982 29.906 28.784 1.00 0.00 C ATOM 130 C LEU A 8 34.534 31.114 29.547 1.00 0.00 C ATOM 131 O LEU A 8 34.237 31.247 30.737 1.00 0.00 O ATOM 132 CB LEU A 8 34.919 28.813 28.298 1.00 0.00 C ATOM 133 CG LEU A 8 35.806 28.027 29.277 1.00 0.00 C ATOM 134 CD1 LEU A 8 36.956 28.816 29.907 1.00 0.00 C ATOM 135 CD2 LEU A 8 35.013 27.213 30.294 1.00 0.00 C ATOM 0 H LEU A 8 33.465 29.790 26.793 1.00 0.00 H new ATOM 0 HA LEU A 8 33.407 29.449 29.589 1.00 0.00 H new ATOM 0 HB2 LEU A 8 34.308 28.083 27.767 1.00 0.00 H new ATOM 0 HB3 LEU A 8 35.583 29.268 27.563 1.00 0.00 H new ATOM 0 HG LEU A 8 36.310 27.307 28.632 1.00 0.00 H new ATOM 0 HD11 LEU A 8 37.517 28.167 30.580 1.00 0.00 H new ATOM 0 HD12 LEU A 8 37.617 29.184 29.123 1.00 0.00 H new ATOM 0 HD13 LEU A 8 36.554 29.660 30.468 1.00 0.00 H new ATOM 0 HD21 LEU A 8 35.701 26.684 30.953 1.00 0.00 H new ATOM 0 HD22 LEU A 8 34.386 27.881 30.885 1.00 0.00 H new ATOM 0 HD23 LEU A 8 34.384 26.492 29.772 1.00 0.00 H new ATOM 147 N THR A 9 35.159 32.049 28.841 1.00 0.00 N ATOM 148 CA THR A 9 35.783 33.238 29.397 1.00 0.00 C ATOM 149 C THR A 9 34.859 34.407 29.736 1.00 0.00 C ATOM 150 O THR A 9 35.304 35.443 30.219 1.00 0.00 O ATOM 151 CB THR A 9 36.750 33.733 28.323 1.00 0.00 C ATOM 152 OG1 THR A 9 36.187 33.835 27.033 1.00 0.00 O ATOM 153 CG2 THR A 9 37.985 32.855 28.166 1.00 0.00 C ATOM 0 H THR A 9 35.247 31.995 27.826 1.00 0.00 H new ATOM 0 HA THR A 9 36.224 32.940 30.348 1.00 0.00 H new ATOM 0 HB THR A 9 37.014 34.722 28.698 1.00 0.00 H new ATOM 0 HG1 THR A 9 36.866 34.159 26.405 1.00 0.00 H new ATOM 0 HG21 THR A 9 38.627 33.266 27.387 1.00 0.00 H new ATOM 0 HG22 THR A 9 38.532 32.825 29.108 1.00 0.00 H new ATOM 0 HG23 THR A 9 37.681 31.845 27.890 1.00 0.00 H new ATOM 161 N GLY A 10 33.563 34.125 29.581 1.00 0.00 N ATOM 162 CA GLY A 10 32.528 34.868 30.271 1.00 0.00 C ATOM 163 C GLY A 10 31.446 35.624 29.514 1.00 0.00 C ATOM 164 O GLY A 10 30.545 36.182 30.142 1.00 0.00 O ATOM 0 H GLY A 10 33.213 33.381 28.978 1.00 0.00 H new ATOM 0 HA2 GLY A 10 32.019 34.164 30.929 1.00 0.00 H new ATOM 0 HA3 GLY A 10 33.032 35.594 30.909 1.00 0.00 H new ATOM 168 N LYS A 11 31.599 35.746 28.192 1.00 0.00 N ATOM 169 CA LYS A 11 30.694 36.432 27.292 1.00 0.00 C ATOM 170 C LYS A 11 29.494 35.529 26.976 1.00 0.00 C ATOM 171 O LYS A 11 29.671 34.323 26.824 1.00 0.00 O ATOM 172 CB LYS A 11 31.402 36.711 25.965 1.00 0.00 C ATOM 173 CG LYS A 11 30.749 37.696 24.989 1.00 0.00 C ATOM 174 CD LYS A 11 31.519 37.783 23.679 1.00 0.00 C ATOM 175 CE LYS A 11 31.111 38.964 22.797 1.00 0.00 C ATOM 176 NZ LYS A 11 31.841 39.138 21.525 1.00 0.00 N ATOM 0 H LYS A 11 32.401 35.345 27.705 1.00 0.00 H new ATOM 0 HA LYS A 11 30.372 37.358 27.768 1.00 0.00 H new ATOM 0 HB2 LYS A 11 32.402 37.081 26.192 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.524 35.760 25.446 1.00 0.00 H new ATOM 0 HG2 LYS A 11 29.724 37.384 24.789 1.00 0.00 H new ATOM 0 HG3 LYS A 11 30.698 38.683 25.448 1.00 0.00 H new ATOM 0 HD2 LYS A 11 32.584 37.858 23.899 1.00 0.00 H new ATOM 0 HD3 LYS A 11 31.373 36.858 23.121 1.00 0.00 H new ATOM 0 HE2 LYS A 11 30.050 38.864 22.567 1.00 0.00 H new ATOM 0 HE3 LYS A 11 31.226 39.877 23.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 31.687 40.101 21.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 32.857 38.987 21.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 31.494 38.448 20.828 1.00 0.00 H new ATOM 190 N THR A 12 28.363 36.181 26.744 1.00 0.00 N ATOM 191 CA THR A 12 27.050 35.664 26.395 1.00 0.00 C ATOM 192 C THR A 12 26.653 36.225 25.029 1.00 0.00 C ATOM 193 O THR A 12 26.944 37.407 24.863 1.00 0.00 O ATOM 194 CB THR A 12 26.082 36.232 27.441 1.00 0.00 C ATOM 195 OG1 THR A 12 26.569 36.251 28.761 1.00 0.00 O ATOM 196 CG2 THR A 12 24.740 35.513 27.390 1.00 0.00 C ATOM 0 H THR A 12 28.343 37.199 26.803 1.00 0.00 H new ATOM 0 HA THR A 12 27.037 34.574 26.367 1.00 0.00 H new ATOM 0 HB THR A 12 25.961 37.278 27.160 1.00 0.00 H new ATOM 0 HG1 THR A 12 25.888 36.629 29.356 1.00 0.00 H new ATOM 0 HG21 THR A 12 24.072 35.935 28.141 1.00 0.00 H new ATOM 0 HG22 THR A 12 24.298 35.637 26.401 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.888 34.452 27.591 1.00 0.00 H new ATOM 204 N ILE A 13 26.325 35.395 24.037 1.00 0.00 N ATOM 205 CA ILE A 13 25.855 35.805 22.728 1.00 0.00 C ATOM 206 C ILE A 13 24.450 35.266 22.440 1.00 0.00 C ATOM 207 O ILE A 13 23.823 34.663 23.306 1.00 0.00 O ATOM 208 CB ILE A 13 26.944 35.580 21.678 1.00 0.00 C ATOM 209 CG1 ILE A 13 27.307 34.140 21.321 1.00 0.00 C ATOM 210 CG2 ILE A 13 28.207 36.363 22.035 1.00 0.00 C ATOM 211 CD1 ILE A 13 26.300 33.421 20.421 1.00 0.00 C ATOM 0 H ILE A 13 26.385 34.381 24.135 1.00 0.00 H new ATOM 0 HA ILE A 13 25.691 36.882 22.689 1.00 0.00 H new ATOM 0 HB ILE A 13 26.477 35.956 20.768 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.278 34.138 20.827 1.00 0.00 H new ATOM 0 HG13 ILE A 13 27.418 33.570 22.244 1.00 0.00 H new ATOM 0 HG21 ILE A 13 28.970 36.189 21.276 1.00 0.00 H new ATOM 0 HG22 ILE A 13 27.975 37.427 22.080 1.00 0.00 H new ATOM 0 HG23 ILE A 13 28.579 36.032 23.005 1.00 0.00 H new ATOM 0 HD11 ILE A 13 26.647 32.406 20.225 1.00 0.00 H new ATOM 0 HD12 ILE A 13 25.330 33.383 20.917 1.00 0.00 H new ATOM 0 HD13 ILE A 13 26.204 33.960 19.479 1.00 0.00 H new ATOM 223 N THR A 14 23.845 35.398 21.273 1.00 0.00 N ATOM 224 CA THR A 14 22.563 34.921 20.797 1.00 0.00 C ATOM 225 C THR A 14 22.584 34.769 19.284 1.00 0.00 C ATOM 226 O THR A 14 23.152 35.593 18.550 1.00 0.00 O ATOM 227 CB THR A 14 21.372 35.751 21.285 1.00 0.00 C ATOM 228 OG1 THR A 14 20.145 35.318 20.720 1.00 0.00 O ATOM 229 CG2 THR A 14 21.405 37.240 20.954 1.00 0.00 C ATOM 0 H THR A 14 24.314 35.919 20.532 1.00 0.00 H new ATOM 0 HA THR A 14 22.408 33.937 21.240 1.00 0.00 H new ATOM 0 HB THR A 14 21.448 35.602 22.362 1.00 0.00 H new ATOM 0 HG1 THR A 14 20.019 34.364 20.904 1.00 0.00 H new ATOM 0 HG21 THR A 14 20.511 37.721 21.350 1.00 0.00 H new ATOM 0 HG22 THR A 14 22.289 37.693 21.402 1.00 0.00 H new ATOM 0 HG23 THR A 14 21.439 37.372 19.873 1.00 0.00 H new ATOM 237 N LEU A 15 21.912 33.766 18.731 1.00 0.00 N ATOM 238 CA LEU A 15 21.862 33.366 17.341 1.00 0.00 C ATOM 239 C LEU A 15 20.422 33.000 16.975 1.00 0.00 C ATOM 240 O LEU A 15 19.709 32.588 17.888 1.00 0.00 O ATOM 241 CB LEU A 15 22.930 32.394 16.834 1.00 0.00 C ATOM 242 CG LEU A 15 23.488 31.396 17.860 1.00 0.00 C ATOM 243 CD1 LEU A 15 22.385 30.512 18.450 1.00 0.00 C ATOM 244 CD2 LEU A 15 24.523 30.445 17.254 1.00 0.00 C ATOM 0 H LEU A 15 21.333 33.156 19.308 1.00 0.00 H new ATOM 0 HA LEU A 15 22.168 34.242 16.769 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.510 31.829 16.001 1.00 0.00 H new ATOM 0 HB3 LEU A 15 23.761 32.977 16.437 1.00 0.00 H new ATOM 0 HG LEU A 15 23.949 32.017 18.628 1.00 0.00 H new ATOM 0 HD11 LEU A 15 22.820 29.820 19.171 1.00 0.00 H new ATOM 0 HD12 LEU A 15 21.645 31.138 18.949 1.00 0.00 H new ATOM 0 HD13 LEU A 15 21.904 29.948 17.651 1.00 0.00 H new ATOM 0 HD21 LEU A 15 24.884 29.762 18.023 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.064 29.873 16.447 1.00 0.00 H new ATOM 0 HD23 LEU A 15 25.360 31.021 16.859 1.00 0.00 H new ATOM 256 N GLU A 16 20.062 33.186 15.709 1.00 0.00 N ATOM 257 CA GLU A 16 18.757 32.786 15.221 1.00 0.00 C ATOM 258 C GLU A 16 18.818 31.413 14.527 1.00 0.00 C ATOM 259 O GLU A 16 19.573 31.252 13.577 1.00 0.00 O ATOM 260 CB GLU A 16 18.496 33.742 14.057 1.00 0.00 C ATOM 261 CG GLU A 16 18.406 35.216 14.445 1.00 0.00 C ATOM 262 CD GLU A 16 19.714 35.977 14.618 1.00 0.00 C ATOM 263 OE1 GLU A 16 20.582 35.907 13.720 1.00 0.00 O ATOM 264 OE2 GLU A 16 19.931 36.590 15.685 1.00 0.00 O ATOM 0 H GLU A 16 20.662 33.613 15.004 1.00 0.00 H new ATOM 0 HA GLU A 16 18.038 32.777 16.040 1.00 0.00 H new ATOM 0 HB2 GLU A 16 19.292 33.623 13.322 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.565 33.452 13.569 1.00 0.00 H new ATOM 0 HG2 GLU A 16 17.816 35.729 13.685 1.00 0.00 H new ATOM 0 HG3 GLU A 16 17.850 35.285 15.380 1.00 0.00 H new ATOM 271 N VAL A 17 18.076 30.430 15.027 1.00 0.00 N ATOM 272 CA VAL A 17 18.231 29.012 14.761 1.00 0.00 C ATOM 273 C VAL A 17 16.803 28.461 14.707 1.00 0.00 C ATOM 274 O VAL A 17 15.830 29.190 14.908 1.00 0.00 O ATOM 275 CB VAL A 17 19.217 28.226 15.619 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.688 28.637 15.587 1.00 0.00 C ATOM 277 CG2 VAL A 17 18.786 28.240 17.091 1.00 0.00 C ATOM 0 H VAL A 17 17.305 30.618 15.667 1.00 0.00 H new ATOM 0 HA VAL A 17 18.754 28.876 13.814 1.00 0.00 H new ATOM 0 HB VAL A 17 19.173 27.242 15.152 1.00 0.00 H new ATOM 0 HG11 VAL A 17 21.262 27.986 16.247 1.00 0.00 H new ATOM 0 HG12 VAL A 17 21.068 28.549 14.569 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.785 29.670 15.922 1.00 0.00 H new ATOM 0 HG21 VAL A 17 19.503 27.674 17.685 1.00 0.00 H new ATOM 0 HG22 VAL A 17 18.749 29.269 17.450 1.00 0.00 H new ATOM 0 HG23 VAL A 17 17.799 27.788 17.185 1.00 0.00 H new ATOM 287 N GLU A 18 16.629 27.166 14.485 1.00 0.00 N ATOM 288 CA GLU A 18 15.381 26.424 14.506 1.00 0.00 C ATOM 289 C GLU A 18 15.557 25.033 15.122 1.00 0.00 C ATOM 290 O GLU A 18 16.677 24.545 15.011 1.00 0.00 O ATOM 291 CB GLU A 18 14.935 26.233 13.052 1.00 0.00 C ATOM 292 CG GLU A 18 13.478 25.976 12.670 1.00 0.00 C ATOM 293 CD GLU A 18 13.308 25.876 11.163 1.00 0.00 C ATOM 294 OE1 GLU A 18 14.194 25.901 10.277 1.00 0.00 O ATOM 295 OE2 GLU A 18 12.134 25.643 10.801 1.00 0.00 O ATOM 0 H GLU A 18 17.421 26.561 14.269 1.00 0.00 H new ATOM 0 HA GLU A 18 14.655 26.978 15.101 1.00 0.00 H new ATOM 0 HB2 GLU A 18 15.247 27.125 12.510 1.00 0.00 H new ATOM 0 HB3 GLU A 18 15.514 25.399 12.655 1.00 0.00 H new ATOM 0 HG2 GLU A 18 13.135 25.053 13.138 1.00 0.00 H new ATOM 0 HG3 GLU A 18 12.852 26.781 13.055 1.00 0.00 H new ATOM 302 N PRO A 19 14.693 24.378 15.894 1.00 0.00 N ATOM 303 CA PRO A 19 15.003 23.108 16.509 1.00 0.00 C ATOM 304 C PRO A 19 15.378 21.966 15.558 1.00 0.00 C ATOM 305 O PRO A 19 16.223 21.142 15.910 1.00 0.00 O ATOM 306 CB PRO A 19 13.858 22.659 17.417 1.00 0.00 C ATOM 307 CG PRO A 19 12.784 23.751 17.293 1.00 0.00 C ATOM 308 CD PRO A 19 13.317 24.705 16.232 1.00 0.00 C ATOM 0 HA PRO A 19 15.910 23.309 17.079 1.00 0.00 H new ATOM 0 HB2 PRO A 19 13.469 21.689 17.108 1.00 0.00 H new ATOM 0 HB3 PRO A 19 14.193 22.554 18.449 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.823 23.329 16.998 1.00 0.00 H new ATOM 0 HG3 PRO A 19 12.629 24.263 18.243 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.694 24.649 15.339 1.00 0.00 H new ATOM 0 HD3 PRO A 19 13.260 25.731 16.596 1.00 0.00 H new ATOM 316 N SER A 20 14.874 21.989 14.328 1.00 0.00 N ATOM 317 CA SER A 20 15.209 20.961 13.364 1.00 0.00 C ATOM 318 C SER A 20 16.520 21.335 12.666 1.00 0.00 C ATOM 319 O SER A 20 16.743 20.633 11.682 1.00 0.00 O ATOM 320 CB SER A 20 14.074 20.996 12.337 1.00 0.00 C ATOM 321 OG SER A 20 12.849 20.766 13.007 1.00 0.00 O ATOM 0 H SER A 20 14.236 22.706 13.982 1.00 0.00 H new ATOM 0 HA SER A 20 15.326 19.981 13.827 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.052 21.961 11.830 1.00 0.00 H new ATOM 0 HB3 SER A 20 14.234 20.237 11.571 1.00 0.00 H new ATOM 0 HG SER A 20 12.113 20.788 12.360 1.00 0.00 H new ATOM 327 N ASP A 21 17.344 22.211 13.222 1.00 0.00 N ATOM 328 CA ASP A 21 18.577 22.584 12.552 1.00 0.00 C ATOM 329 C ASP A 21 19.582 21.540 13.042 1.00 0.00 C ATOM 330 O ASP A 21 19.425 21.125 14.192 1.00 0.00 O ATOM 331 CB ASP A 21 19.090 23.987 12.863 1.00 0.00 C ATOM 332 CG ASP A 21 18.550 25.084 11.950 1.00 0.00 C ATOM 333 OD1 ASP A 21 18.211 24.912 10.757 1.00 0.00 O ATOM 334 OD2 ASP A 21 18.500 26.236 12.445 1.00 0.00 O ATOM 0 H ASP A 21 17.184 22.669 14.119 1.00 0.00 H new ATOM 0 HA ASP A 21 18.419 22.606 11.474 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.833 24.232 13.893 1.00 0.00 H new ATOM 0 HB3 ASP A 21 20.178 23.983 12.798 1.00 0.00 H new ATOM 339 N THR A 22 20.514 21.257 12.142 1.00 0.00 N ATOM 340 CA THR A 22 21.559 20.324 12.501 1.00 0.00 C ATOM 341 C THR A 22 22.754 20.990 13.185 1.00 0.00 C ATOM 342 O THR A 22 22.972 22.155 12.887 1.00 0.00 O ATOM 343 CB THR A 22 21.974 19.469 11.296 1.00 0.00 C ATOM 344 OG1 THR A 22 22.595 20.205 10.271 1.00 0.00 O ATOM 345 CG2 THR A 22 20.835 18.550 10.864 1.00 0.00 C ATOM 0 H THR A 22 20.566 21.643 11.199 1.00 0.00 H new ATOM 0 HA THR A 22 21.138 19.654 13.251 1.00 0.00 H new ATOM 0 HB THR A 22 22.776 18.802 11.612 1.00 0.00 H new ATOM 0 HG1 THR A 22 22.836 19.603 9.536 1.00 0.00 H new ATOM 0 HG21 THR A 22 21.153 17.954 10.008 1.00 0.00 H new ATOM 0 HG22 THR A 22 20.569 17.888 11.688 1.00 0.00 H new ATOM 0 HG23 THR A 22 19.969 19.150 10.586 1.00 0.00 H new ATOM 353 N ILE A 23 23.563 20.347 14.022 1.00 0.00 N ATOM 354 CA ILE A 23 24.655 20.941 14.781 1.00 0.00 C ATOM 355 C ILE A 23 25.701 21.747 14.021 1.00 0.00 C ATOM 356 O ILE A 23 26.224 22.689 14.623 1.00 0.00 O ATOM 357 CB ILE A 23 25.271 19.897 15.714 1.00 0.00 C ATOM 358 CG1 ILE A 23 24.348 18.948 16.471 1.00 0.00 C ATOM 359 CG2 ILE A 23 26.199 20.559 16.747 1.00 0.00 C ATOM 360 CD1 ILE A 23 23.216 19.610 17.266 1.00 0.00 C ATOM 0 H ILE A 23 23.468 19.347 14.197 1.00 0.00 H new ATOM 0 HA ILE A 23 24.177 21.732 15.359 1.00 0.00 H new ATOM 0 HB ILE A 23 25.792 19.265 14.995 1.00 0.00 H new ATOM 0 HG12 ILE A 23 23.906 18.254 15.756 1.00 0.00 H new ATOM 0 HG13 ILE A 23 24.952 18.356 17.159 1.00 0.00 H new ATOM 0 HG21 ILE A 23 26.623 19.794 17.398 1.00 0.00 H new ATOM 0 HG22 ILE A 23 27.003 21.083 16.231 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.629 21.269 17.346 1.00 0.00 H new ATOM 0 HD11 ILE A 23 22.623 18.842 17.764 1.00 0.00 H new ATOM 0 HD12 ILE A 23 23.640 20.282 18.012 1.00 0.00 H new ATOM 0 HD13 ILE A 23 22.579 20.177 16.588 1.00 0.00 H new ATOM 372 N GLU A 24 25.990 21.417 12.765 1.00 0.00 N ATOM 373 CA GLU A 24 27.027 22.090 12.014 1.00 0.00 C ATOM 374 C GLU A 24 26.581 23.513 11.675 1.00 0.00 C ATOM 375 O GLU A 24 27.455 24.380 11.663 1.00 0.00 O ATOM 376 CB GLU A 24 27.103 21.407 10.651 1.00 0.00 C ATOM 377 CG GLU A 24 28.271 21.676 9.702 1.00 0.00 C ATOM 378 CD GLU A 24 28.544 20.460 8.836 1.00 0.00 C ATOM 379 OE1 GLU A 24 27.833 20.380 7.804 1.00 0.00 O ATOM 380 OE2 GLU A 24 29.424 19.619 9.115 1.00 0.00 O ATOM 0 H GLU A 24 25.511 20.679 12.249 1.00 0.00 H new ATOM 0 HA GLU A 24 27.953 22.073 12.589 1.00 0.00 H new ATOM 0 HB2 GLU A 24 27.078 20.332 10.830 1.00 0.00 H new ATOM 0 HB3 GLU A 24 26.189 21.662 10.114 1.00 0.00 H new ATOM 0 HG2 GLU A 24 28.044 22.535 9.071 1.00 0.00 H new ATOM 0 HG3 GLU A 24 29.163 21.929 10.276 1.00 0.00 H new ATOM 387 N ASN A 25 25.318 23.712 11.284 1.00 0.00 N ATOM 388 CA ASN A 25 24.703 24.940 10.803 1.00 0.00 C ATOM 389 C ASN A 25 24.479 25.953 11.929 1.00 0.00 C ATOM 390 O ASN A 25 24.256 27.144 11.723 1.00 0.00 O ATOM 391 CB ASN A 25 23.387 24.549 10.134 1.00 0.00 C ATOM 392 CG ASN A 25 23.530 24.276 8.647 1.00 0.00 C ATOM 393 OD1 ASN A 25 24.367 24.818 7.934 1.00 0.00 O ATOM 394 ND2 ASN A 25 22.803 23.276 8.149 1.00 0.00 N ATOM 0 H ASN A 25 24.645 22.945 11.300 1.00 0.00 H new ATOM 0 HA ASN A 25 25.365 25.436 10.093 1.00 0.00 H new ATOM 0 HB2 ASN A 25 22.988 23.660 10.623 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.660 25.348 10.282 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.947 22.971 7.186 1.00 0.00 H new ATOM 0 HD22 ASN A 25 22.103 22.816 8.731 1.00 0.00 H new ATOM 401 N VAL A 26 24.450 25.502 13.179 1.00 0.00 N ATOM 402 CA VAL A 26 24.550 26.267 14.409 1.00 0.00 C ATOM 403 C VAL A 26 26.002 26.631 14.704 1.00 0.00 C ATOM 404 O VAL A 26 26.248 27.835 14.713 1.00 0.00 O ATOM 405 CB VAL A 26 24.007 25.459 15.582 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.020 26.155 16.946 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.630 24.812 15.489 1.00 0.00 C ATOM 0 H VAL A 26 24.347 24.505 13.369 1.00 0.00 H new ATOM 0 HA VAL A 26 23.964 27.177 14.280 1.00 0.00 H new ATOM 0 HB VAL A 26 24.760 24.676 15.498 1.00 0.00 H new ATOM 0 HG11 VAL A 26 23.611 25.484 17.701 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.044 26.418 17.211 1.00 0.00 H new ATOM 0 HG13 VAL A 26 23.414 27.060 16.899 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.414 24.280 16.416 1.00 0.00 H new ATOM 0 HG22 VAL A 26 21.876 25.583 15.329 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.614 24.110 14.656 1.00 0.00 H new ATOM 417 N LYS A 27 26.953 25.704 14.679 1.00 0.00 N ATOM 418 CA LYS A 27 28.322 26.131 14.858 1.00 0.00 C ATOM 419 C LYS A 27 28.845 27.083 13.788 1.00 0.00 C ATOM 420 O LYS A 27 29.767 27.850 14.080 1.00 0.00 O ATOM 421 CB LYS A 27 29.240 24.906 14.855 1.00 0.00 C ATOM 422 CG LYS A 27 28.878 23.963 16.009 1.00 0.00 C ATOM 423 CD LYS A 27 29.651 22.652 16.138 1.00 0.00 C ATOM 424 CE LYS A 27 29.712 21.760 14.900 1.00 0.00 C ATOM 425 NZ LYS A 27 30.504 20.534 15.051 1.00 0.00 N ATOM 0 H LYS A 27 26.808 24.703 14.543 1.00 0.00 H new ATOM 0 HA LYS A 27 28.327 26.670 15.805 1.00 0.00 H new ATOM 0 HB2 LYS A 27 29.151 24.379 13.905 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.279 25.222 14.948 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.000 24.515 16.941 1.00 0.00 H new ATOM 0 HG3 LYS A 27 27.820 23.718 15.920 1.00 0.00 H new ATOM 0 HD2 LYS A 27 30.672 22.889 16.436 1.00 0.00 H new ATOM 0 HD3 LYS A 27 29.208 22.075 16.950 1.00 0.00 H new ATOM 0 HE2 LYS A 27 28.695 21.484 14.620 1.00 0.00 H new ATOM 0 HE3 LYS A 27 30.124 22.340 14.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 30.828 20.213 14.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 31.328 20.725 15.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 29.918 19.794 15.487 1.00 0.00 H new ATOM 439 N ALA A 28 28.243 27.042 12.602 1.00 0.00 N ATOM 440 CA ALA A 28 28.400 27.944 11.471 1.00 0.00 C ATOM 441 C ALA A 28 28.227 29.414 11.836 1.00 0.00 C ATOM 442 O ALA A 28 28.924 30.256 11.280 1.00 0.00 O ATOM 443 CB ALA A 28 27.557 27.480 10.285 1.00 0.00 C ATOM 0 H ALA A 28 27.570 26.305 12.392 1.00 0.00 H new ATOM 0 HA ALA A 28 29.440 27.889 11.148 1.00 0.00 H new ATOM 0 HB1 ALA A 28 27.691 28.170 9.452 1.00 0.00 H new ATOM 0 HB2 ALA A 28 27.872 26.481 9.983 1.00 0.00 H new ATOM 0 HB3 ALA A 28 26.506 27.458 10.572 1.00 0.00 H new ATOM 449 N LYS A 29 27.282 29.654 12.741 1.00 0.00 N ATOM 450 CA LYS A 29 26.854 30.948 13.224 1.00 0.00 C ATOM 451 C LYS A 29 27.773 31.511 14.315 1.00 0.00 C ATOM 452 O LYS A 29 27.911 32.708 14.536 1.00 0.00 O ATOM 453 CB LYS A 29 25.437 30.906 13.790 1.00 0.00 C ATOM 454 CG LYS A 29 24.472 30.848 12.601 1.00 0.00 C ATOM 455 CD LYS A 29 22.990 30.548 12.869 1.00 0.00 C ATOM 456 CE LYS A 29 22.161 30.731 11.590 1.00 0.00 C ATOM 457 NZ LYS A 29 20.771 30.272 11.637 1.00 0.00 N ATOM 0 H LYS A 29 26.765 28.893 13.181 1.00 0.00 H new ATOM 0 HA LYS A 29 26.893 31.597 12.349 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.306 30.036 14.434 1.00 0.00 H new ATOM 0 HB3 LYS A 29 25.241 31.787 14.401 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.527 31.806 12.083 1.00 0.00 H new ATOM 0 HG3 LYS A 29 24.843 30.091 11.911 1.00 0.00 H new ATOM 0 HD2 LYS A 29 22.881 29.528 13.237 1.00 0.00 H new ATOM 0 HD3 LYS A 29 22.615 31.210 13.650 1.00 0.00 H new ATOM 0 HE2 LYS A 29 22.161 31.790 11.333 1.00 0.00 H new ATOM 0 HE3 LYS A 29 22.666 30.206 10.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.372 30.274 10.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.737 29.307 12.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.216 30.909 12.244 1.00 0.00 H new ATOM 471 N ILE A 30 28.509 30.657 15.021 1.00 0.00 N ATOM 472 CA ILE A 30 29.449 30.928 16.088 1.00 0.00 C ATOM 473 C ILE A 30 30.766 31.251 15.363 1.00 0.00 C ATOM 474 O ILE A 30 31.410 32.231 15.729 1.00 0.00 O ATOM 475 CB ILE A 30 29.469 29.730 17.030 1.00 0.00 C ATOM 476 CG1 ILE A 30 28.191 29.702 17.863 1.00 0.00 C ATOM 477 CG2 ILE A 30 30.585 29.884 18.056 1.00 0.00 C ATOM 478 CD1 ILE A 30 27.935 28.479 18.763 1.00 0.00 C ATOM 0 H ILE A 30 28.450 29.656 14.835 1.00 0.00 H new ATOM 0 HA ILE A 30 29.206 31.768 16.738 1.00 0.00 H new ATOM 0 HB ILE A 30 29.590 28.839 16.414 1.00 0.00 H new ATOM 0 HG12 ILE A 30 28.188 30.588 18.497 1.00 0.00 H new ATOM 0 HG13 ILE A 30 27.347 29.795 17.180 1.00 0.00 H new ATOM 0 HG21 ILE A 30 30.588 29.022 18.723 1.00 0.00 H new ATOM 0 HG22 ILE A 30 31.544 29.949 17.543 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.422 30.791 18.638 1.00 0.00 H new ATOM 0 HD11 ILE A 30 26.989 28.607 19.290 1.00 0.00 H new ATOM 0 HD12 ILE A 30 27.890 27.579 18.150 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.744 28.384 19.487 1.00 0.00 H new ATOM 490 N GLN A 31 31.149 30.520 14.324 1.00 0.00 N ATOM 491 CA GLN A 31 32.154 30.833 13.338 1.00 0.00 C ATOM 492 C GLN A 31 31.987 32.215 12.702 1.00 0.00 C ATOM 493 O GLN A 31 32.779 33.147 12.865 1.00 0.00 O ATOM 494 CB GLN A 31 32.310 29.722 12.296 1.00 0.00 C ATOM 495 CG GLN A 31 33.479 29.981 11.348 1.00 0.00 C ATOM 496 CD GLN A 31 33.814 28.871 10.359 1.00 0.00 C ATOM 497 OE1 GLN A 31 33.029 27.982 10.041 1.00 0.00 O ATOM 498 NE2 GLN A 31 35.100 28.934 10.015 1.00 0.00 N ATOM 0 H GLN A 31 30.720 29.613 14.141 1.00 0.00 H new ATOM 0 HA GLN A 31 33.093 30.886 13.888 1.00 0.00 H new ATOM 0 HB2 GLN A 31 32.460 28.769 12.803 1.00 0.00 H new ATOM 0 HB3 GLN A 31 31.389 29.635 11.719 1.00 0.00 H new ATOM 0 HG2 GLN A 31 33.265 30.888 10.783 1.00 0.00 H new ATOM 0 HG3 GLN A 31 34.366 30.182 11.948 1.00 0.00 H new ATOM 0 HE21 GLN A 31 35.674 29.716 10.329 1.00 0.00 H new ATOM 0 HE22 GLN A 31 35.510 28.200 9.437 1.00 0.00 H new ATOM 507 N ASP A 32 30.799 32.478 12.159 1.00 0.00 N ATOM 508 CA ASP A 32 30.294 33.631 11.460 1.00 0.00 C ATOM 509 C ASP A 32 30.332 34.981 12.195 1.00 0.00 C ATOM 510 O ASP A 32 30.619 35.999 11.577 1.00 0.00 O ATOM 511 CB ASP A 32 28.926 33.247 10.886 1.00 0.00 C ATOM 512 CG ASP A 32 28.057 34.453 10.562 1.00 0.00 C ATOM 513 OD1 ASP A 32 28.364 35.290 9.693 1.00 0.00 O ATOM 514 OD2 ASP A 32 26.969 34.556 11.178 1.00 0.00 O ATOM 0 H ASP A 32 30.068 31.769 12.217 1.00 0.00 H new ATOM 0 HA ASP A 32 30.996 33.866 10.660 1.00 0.00 H new ATOM 0 HB2 ASP A 32 29.071 32.657 9.981 1.00 0.00 H new ATOM 0 HB3 ASP A 32 28.404 32.611 11.601 1.00 0.00 H new ATOM 519 N LYS A 33 29.937 34.950 13.465 1.00 0.00 N ATOM 520 CA LYS A 33 30.087 36.004 14.440 1.00 0.00 C ATOM 521 C LYS A 33 31.524 36.032 14.969 1.00 0.00 C ATOM 522 O LYS A 33 32.268 36.875 14.479 1.00 0.00 O ATOM 523 CB LYS A 33 29.117 35.797 15.607 1.00 0.00 C ATOM 524 CG LYS A 33 27.703 36.235 15.196 1.00 0.00 C ATOM 525 CD LYS A 33 26.727 36.402 16.360 1.00 0.00 C ATOM 526 CE LYS A 33 25.405 36.801 15.710 1.00 0.00 C ATOM 527 NZ LYS A 33 24.549 37.504 16.667 1.00 0.00 N ATOM 0 H LYS A 33 29.474 34.130 13.857 1.00 0.00 H new ATOM 0 HA LYS A 33 29.862 36.954 13.955 1.00 0.00 H new ATOM 0 HB2 LYS A 33 29.110 34.748 15.904 1.00 0.00 H new ATOM 0 HB3 LYS A 33 29.448 36.371 16.472 1.00 0.00 H new ATOM 0 HG2 LYS A 33 27.771 37.180 14.658 1.00 0.00 H new ATOM 0 HG3 LYS A 33 27.297 35.501 14.500 1.00 0.00 H new ATOM 0 HD2 LYS A 33 26.625 35.476 16.926 1.00 0.00 H new ATOM 0 HD3 LYS A 33 27.071 37.166 17.057 1.00 0.00 H new ATOM 0 HE2 LYS A 33 25.596 37.440 14.848 1.00 0.00 H new ATOM 0 HE3 LYS A 33 24.893 35.912 15.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 23.821 38.040 16.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 24.092 36.814 17.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 25.126 38.159 17.233 1.00 0.00 H new ATOM 541 N GLU A 34 31.822 35.163 15.932 1.00 0.00 N ATOM 542 CA GLU A 34 32.962 35.204 16.833 1.00 0.00 C ATOM 543 C GLU A 34 34.308 34.768 16.254 1.00 0.00 C ATOM 544 O GLU A 34 35.362 35.277 16.650 1.00 0.00 O ATOM 545 CB GLU A 34 32.702 34.289 18.026 1.00 0.00 C ATOM 546 CG GLU A 34 31.754 34.761 19.127 1.00 0.00 C ATOM 547 CD GLU A 34 32.119 36.068 19.812 1.00 0.00 C ATOM 548 OE1 GLU A 34 33.273 36.180 20.284 1.00 0.00 O ATOM 549 OE2 GLU A 34 31.317 37.024 19.760 1.00 0.00 O ATOM 0 H GLU A 34 31.227 34.354 16.113 1.00 0.00 H new ATOM 0 HA GLU A 34 33.048 36.261 17.084 1.00 0.00 H new ATOM 0 HB2 GLU A 34 32.315 33.346 17.640 1.00 0.00 H new ATOM 0 HB3 GLU A 34 33.664 34.072 18.490 1.00 0.00 H new ATOM 0 HG2 GLU A 34 30.757 34.865 18.699 1.00 0.00 H new ATOM 0 HG3 GLU A 34 31.695 33.981 19.886 1.00 0.00 H new ATOM 556 N GLY A 35 34.358 33.790 15.355 1.00 0.00 N ATOM 557 CA GLY A 35 35.611 33.399 14.742 1.00 0.00 C ATOM 558 C GLY A 35 36.196 32.052 15.153 1.00 0.00 C ATOM 559 O GLY A 35 37.346 31.712 14.869 1.00 0.00 O ATOM 0 H GLY A 35 33.546 33.259 15.040 1.00 0.00 H new ATOM 0 HA2 GLY A 35 35.471 33.391 13.661 1.00 0.00 H new ATOM 0 HA3 GLY A 35 36.350 34.170 14.962 1.00 0.00 H new ATOM 563 N ILE A 36 35.385 31.270 15.858 1.00 0.00 N ATOM 564 CA ILE A 36 35.857 29.990 16.357 1.00 0.00 C ATOM 565 C ILE A 36 35.577 28.960 15.253 1.00 0.00 C ATOM 566 O ILE A 36 34.400 28.830 14.915 1.00 0.00 O ATOM 567 CB ILE A 36 35.028 29.636 17.590 1.00 0.00 C ATOM 568 CG1 ILE A 36 35.124 30.717 18.669 1.00 0.00 C ATOM 569 CG2 ILE A 36 35.658 28.374 18.162 1.00 0.00 C ATOM 570 CD1 ILE A 36 33.934 30.750 19.641 1.00 0.00 C ATOM 0 H ILE A 36 34.418 31.496 16.092 1.00 0.00 H new ATOM 0 HA ILE A 36 36.916 30.012 16.614 1.00 0.00 H new ATOM 0 HB ILE A 36 33.981 29.524 17.309 1.00 0.00 H new ATOM 0 HG12 ILE A 36 36.040 30.563 19.240 1.00 0.00 H new ATOM 0 HG13 ILE A 36 35.210 31.690 18.185 1.00 0.00 H new ATOM 0 HG21 ILE A 36 35.110 28.065 19.052 1.00 0.00 H new ATOM 0 HG22 ILE A 36 35.620 27.579 17.418 1.00 0.00 H new ATOM 0 HG23 ILE A 36 36.696 28.574 18.427 1.00 0.00 H new ATOM 0 HD11 ILE A 36 34.083 31.545 20.372 1.00 0.00 H new ATOM 0 HD12 ILE A 36 33.015 30.936 19.085 1.00 0.00 H new ATOM 0 HD13 ILE A 36 33.858 29.792 20.156 1.00 0.00 H new ATOM 582 N PRO A 37 36.444 28.042 14.843 1.00 0.00 N ATOM 583 CA PRO A 37 36.164 26.989 13.891 1.00 0.00 C ATOM 584 C PRO A 37 35.228 25.917 14.456 1.00 0.00 C ATOM 585 O PRO A 37 35.412 25.443 15.576 1.00 0.00 O ATOM 586 CB PRO A 37 37.494 26.272 13.613 1.00 0.00 C ATOM 587 CG PRO A 37 38.650 27.127 14.118 1.00 0.00 C ATOM 588 CD PRO A 37 37.878 28.103 15.018 1.00 0.00 C ATOM 0 HA PRO A 37 35.700 27.443 13.015 1.00 0.00 H new ATOM 0 HB2 PRO A 37 37.505 25.300 14.106 1.00 0.00 H new ATOM 0 HB3 PRO A 37 37.604 26.089 12.544 1.00 0.00 H new ATOM 0 HG2 PRO A 37 39.390 26.546 14.669 1.00 0.00 H new ATOM 0 HG3 PRO A 37 39.179 27.633 13.311 1.00 0.00 H new ATOM 0 HD2 PRO A 37 38.118 27.890 16.060 1.00 0.00 H new ATOM 0 HD3 PRO A 37 38.218 29.118 14.814 1.00 0.00 H new ATOM 596 N PRO A 38 34.327 25.372 13.644 1.00 0.00 N ATOM 597 CA PRO A 38 33.482 24.277 14.071 1.00 0.00 C ATOM 598 C PRO A 38 34.287 23.020 14.394 1.00 0.00 C ATOM 599 O PRO A 38 33.870 22.226 15.241 1.00 0.00 O ATOM 600 CB PRO A 38 32.466 23.893 12.998 1.00 0.00 C ATOM 601 CG PRO A 38 33.045 24.645 11.795 1.00 0.00 C ATOM 602 CD PRO A 38 34.036 25.694 12.263 1.00 0.00 C ATOM 0 HA PRO A 38 32.975 24.639 14.966 1.00 0.00 H new ATOM 0 HB2 PRO A 38 32.422 22.816 12.833 1.00 0.00 H new ATOM 0 HB3 PRO A 38 31.456 24.219 13.246 1.00 0.00 H new ATOM 0 HG2 PRO A 38 33.537 23.944 11.121 1.00 0.00 H new ATOM 0 HG3 PRO A 38 32.241 25.119 11.231 1.00 0.00 H new ATOM 0 HD2 PRO A 38 34.942 25.674 11.657 1.00 0.00 H new ATOM 0 HD3 PRO A 38 33.616 26.696 12.175 1.00 0.00 H new ATOM 610 N ASP A 39 35.513 22.845 13.920 1.00 0.00 N ATOM 611 CA ASP A 39 36.428 21.770 14.281 1.00 0.00 C ATOM 612 C ASP A 39 36.984 21.936 15.695 1.00 0.00 C ATOM 613 O ASP A 39 37.627 21.029 16.223 1.00 0.00 O ATOM 614 CB ASP A 39 37.472 21.667 13.177 1.00 0.00 C ATOM 615 CG ASP A 39 38.281 20.376 13.199 1.00 0.00 C ATOM 616 OD1 ASP A 39 37.748 19.339 12.755 1.00 0.00 O ATOM 617 OD2 ASP A 39 39.498 20.359 13.512 1.00 0.00 O ATOM 0 H ASP A 39 35.918 23.484 13.236 1.00 0.00 H new ATOM 0 HA ASP A 39 35.910 20.813 14.339 1.00 0.00 H new ATOM 0 HB2 ASP A 39 36.973 21.753 12.212 1.00 0.00 H new ATOM 0 HB3 ASP A 39 38.156 22.512 13.259 1.00 0.00 H new ATOM 622 N GLN A 40 36.688 23.037 16.369 1.00 0.00 N ATOM 623 CA GLN A 40 37.159 23.429 17.686 1.00 0.00 C ATOM 624 C GLN A 40 36.080 23.776 18.718 1.00 0.00 C ATOM 625 O GLN A 40 36.475 24.005 19.862 1.00 0.00 O ATOM 626 CB GLN A 40 38.050 24.664 17.498 1.00 0.00 C ATOM 627 CG GLN A 40 39.353 24.336 16.775 1.00 0.00 C ATOM 628 CD GLN A 40 40.358 23.519 17.574 1.00 0.00 C ATOM 629 OE1 GLN A 40 40.539 23.668 18.785 1.00 0.00 O ATOM 630 NE2 GLN A 40 41.057 22.538 17.023 1.00 0.00 N ATOM 0 H GLN A 40 36.059 23.737 15.974 1.00 0.00 H new ATOM 0 HA GLN A 40 37.671 22.557 18.093 1.00 0.00 H new ATOM 0 HB2 GLN A 40 37.504 25.420 16.933 1.00 0.00 H new ATOM 0 HB3 GLN A 40 38.277 25.097 18.472 1.00 0.00 H new ATOM 0 HG2 GLN A 40 39.114 23.792 15.861 1.00 0.00 H new ATOM 0 HG3 GLN A 40 39.827 25.271 16.475 1.00 0.00 H new ATOM 0 HE21 GLN A 40 40.967 22.346 16.025 1.00 0.00 H new ATOM 0 HE22 GLN A 40 41.685 21.975 17.596 1.00 0.00 H new ATOM 639 N GLN A 41 34.787 23.711 18.438 1.00 0.00 N ATOM 640 CA GLN A 41 33.757 24.132 19.370 1.00 0.00 C ATOM 641 C GLN A 41 33.215 22.840 19.970 1.00 0.00 C ATOM 642 O GLN A 41 33.042 21.856 19.255 1.00 0.00 O ATOM 643 CB GLN A 41 32.612 24.723 18.549 1.00 0.00 C ATOM 644 CG GLN A 41 32.874 26.151 18.089 1.00 0.00 C ATOM 645 CD GLN A 41 31.835 26.545 17.039 1.00 0.00 C ATOM 646 OE1 GLN A 41 30.644 26.297 17.254 1.00 0.00 O ATOM 647 NE2 GLN A 41 32.226 27.108 15.907 1.00 0.00 N ATOM 0 H GLN A 41 34.423 23.362 17.551 1.00 0.00 H new ATOM 0 HA GLN A 41 34.130 24.840 20.111 1.00 0.00 H new ATOM 0 HB2 GLN A 41 32.438 24.094 17.676 1.00 0.00 H new ATOM 0 HB3 GLN A 41 31.699 24.702 19.144 1.00 0.00 H new ATOM 0 HG2 GLN A 41 32.826 26.833 18.938 1.00 0.00 H new ATOM 0 HG3 GLN A 41 33.878 26.232 17.672 1.00 0.00 H new ATOM 0 HE21 GLN A 41 33.215 27.304 15.750 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.539 27.346 15.192 1.00 0.00 H new ATOM 656 N ARG A 42 32.777 22.944 21.225 1.00 0.00 N ATOM 657 CA ARG A 42 31.854 22.018 21.830 1.00 0.00 C ATOM 658 C ARG A 42 30.792 22.878 22.525 1.00 0.00 C ATOM 659 O ARG A 42 31.075 23.886 23.157 1.00 0.00 O ATOM 660 CB ARG A 42 32.635 21.102 22.768 1.00 0.00 C ATOM 661 CG ARG A 42 33.579 20.131 22.061 1.00 0.00 C ATOM 662 CD ARG A 42 35.004 20.686 21.995 1.00 0.00 C ATOM 663 NE ARG A 42 35.895 19.892 21.141 1.00 0.00 N ATOM 664 CZ ARG A 42 37.133 20.283 20.812 1.00 0.00 C ATOM 665 NH1 ARG A 42 37.767 21.360 21.314 1.00 0.00 N ATOM 666 NH2 ARG A 42 37.710 19.635 19.799 1.00 0.00 N ATOM 0 H ARG A 42 33.067 23.694 21.852 1.00 0.00 H new ATOM 0 HA ARG A 42 31.352 21.359 21.122 1.00 0.00 H new ATOM 0 HB2 ARG A 42 33.215 21.717 23.457 1.00 0.00 H new ATOM 0 HB3 ARG A 42 31.928 20.530 23.369 1.00 0.00 H new ATOM 0 HG2 ARG A 42 33.583 19.176 22.587 1.00 0.00 H new ATOM 0 HG3 ARG A 42 33.215 19.937 21.052 1.00 0.00 H new ATOM 0 HD2 ARG A 42 34.971 21.710 21.622 1.00 0.00 H new ATOM 0 HD3 ARG A 42 35.418 20.727 23.002 1.00 0.00 H new ATOM 0 HE ARG A 42 35.555 19.000 20.781 1.00 0.00 H new ATOM 0 HH11 ARG A 42 37.301 21.951 22.002 1.00 0.00 H new ATOM 0 HH12 ARG A 42 38.713 21.584 21.006 1.00 0.00 H new ATOM 0 HH21 ARG A 42 37.209 18.886 19.321 1.00 0.00 H new ATOM 0 HH22 ARG A 42 38.653 19.888 19.502 1.00 0.00 H new ATOM 680 N LEU A 43 29.557 22.487 22.220 1.00 0.00 N ATOM 681 CA LEU A 43 28.299 22.974 22.737 1.00 0.00 C ATOM 682 C LEU A 43 27.854 21.995 23.831 1.00 0.00 C ATOM 683 O LEU A 43 27.887 20.775 23.644 1.00 0.00 O ATOM 684 CB LEU A 43 27.252 22.968 21.623 1.00 0.00 C ATOM 685 CG LEU A 43 27.531 23.907 20.447 1.00 0.00 C ATOM 686 CD1 LEU A 43 26.381 23.790 19.451 1.00 0.00 C ATOM 687 CD2 LEU A 43 27.671 25.324 20.996 1.00 0.00 C ATOM 0 H LEU A 43 29.408 21.746 21.535 1.00 0.00 H new ATOM 0 HA LEU A 43 28.407 23.987 23.123 1.00 0.00 H new ATOM 0 HB2 LEU A 43 27.162 21.952 21.239 1.00 0.00 H new ATOM 0 HB3 LEU A 43 26.287 23.233 22.055 1.00 0.00 H new ATOM 0 HG LEU A 43 28.453 23.647 19.928 1.00 0.00 H new ATOM 0 HD11 LEU A 43 26.563 24.453 18.605 1.00 0.00 H new ATOM 0 HD12 LEU A 43 26.310 22.762 19.097 1.00 0.00 H new ATOM 0 HD13 LEU A 43 25.448 24.072 19.938 1.00 0.00 H new ATOM 0 HD21 LEU A 43 27.871 26.014 20.176 1.00 0.00 H new ATOM 0 HD22 LEU A 43 26.747 25.613 21.497 1.00 0.00 H new ATOM 0 HD23 LEU A 43 28.496 25.359 21.708 1.00 0.00 H new ATOM 699 N ILE A 44 27.422 22.520 24.978 1.00 0.00 N ATOM 700 CA ILE A 44 26.897 21.741 26.077 1.00 0.00 C ATOM 701 C ILE A 44 25.533 22.363 26.374 1.00 0.00 C ATOM 702 O ILE A 44 25.305 23.556 26.219 1.00 0.00 O ATOM 703 CB ILE A 44 27.927 21.735 27.203 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.192 20.917 26.939 1.00 0.00 C ATOM 705 CG2 ILE A 44 27.221 21.281 28.491 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.359 21.709 26.339 1.00 0.00 C ATOM 0 H ILE A 44 27.432 23.523 25.163 1.00 0.00 H new ATOM 0 HA ILE A 44 26.733 20.681 25.883 1.00 0.00 H new ATOM 0 HB ILE A 44 28.305 22.753 27.293 1.00 0.00 H new ATOM 0 HG12 ILE A 44 29.520 20.469 27.877 1.00 0.00 H new ATOM 0 HG13 ILE A 44 28.943 20.098 26.265 1.00 0.00 H new ATOM 0 HG21 ILE A 44 27.937 21.268 29.313 1.00 0.00 H new ATOM 0 HG22 ILE A 44 26.412 21.972 28.725 1.00 0.00 H new ATOM 0 HG23 ILE A 44 26.813 20.280 28.349 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.210 21.045 26.188 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.056 22.134 25.382 1.00 0.00 H new ATOM 0 HD13 ILE A 44 30.642 22.512 27.020 1.00 0.00 H new ATOM 718 N PHE A 45 24.576 21.555 26.824 1.00 0.00 N ATOM 719 CA PHE A 45 23.279 21.817 27.419 1.00 0.00 C ATOM 720 C PHE A 45 22.819 20.631 28.266 1.00 0.00 C ATOM 721 O PHE A 45 22.786 19.515 27.727 1.00 0.00 O ATOM 722 CB PHE A 45 22.239 22.128 26.345 1.00 0.00 C ATOM 723 CG PHE A 45 20.887 22.647 26.788 1.00 0.00 C ATOM 724 CD1 PHE A 45 20.770 23.959 27.259 1.00 0.00 C ATOM 725 CD2 PHE A 45 19.773 21.832 26.549 1.00 0.00 C ATOM 726 CE1 PHE A 45 19.525 24.473 27.662 1.00 0.00 C ATOM 727 CE2 PHE A 45 18.558 22.334 27.020 1.00 0.00 C ATOM 728 CZ PHE A 45 18.420 23.625 27.545 1.00 0.00 C ATOM 0 H PHE A 45 24.724 20.547 26.767 1.00 0.00 H new ATOM 0 HA PHE A 45 23.381 22.688 28.066 1.00 0.00 H new ATOM 0 HB2 PHE A 45 22.671 22.862 25.665 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.074 21.218 25.768 1.00 0.00 H new ATOM 0 HD1 PHE A 45 21.648 24.586 27.314 1.00 0.00 H new ATOM 0 HD2 PHE A 45 19.848 20.884 26.037 1.00 0.00 H new ATOM 0 HE1 PHE A 45 19.427 25.478 28.045 1.00 0.00 H new ATOM 0 HE2 PHE A 45 17.686 21.698 26.978 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.447 23.970 27.864 1.00 0.00 H new ATOM 738 N ALA A 46 22.610 20.853 29.552 1.00 0.00 N ATOM 739 CA ALA A 46 22.130 19.893 30.527 1.00 0.00 C ATOM 740 C ALA A 46 23.150 18.848 30.966 1.00 0.00 C ATOM 741 O ALA A 46 22.782 17.757 31.395 1.00 0.00 O ATOM 742 CB ALA A 46 20.761 19.326 30.156 1.00 0.00 C ATOM 0 H ALA A 46 22.783 21.768 29.968 1.00 0.00 H new ATOM 0 HA ALA A 46 21.979 20.468 31.441 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.445 18.612 30.916 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.035 20.137 30.096 1.00 0.00 H new ATOM 0 HB3 ALA A 46 20.825 18.824 29.191 1.00 0.00 H new ATOM 748 N GLY A 47 24.414 19.121 30.622 1.00 0.00 N ATOM 749 CA GLY A 47 25.553 18.271 30.935 1.00 0.00 C ATOM 750 C GLY A 47 26.159 17.815 29.605 1.00 0.00 C ATOM 751 O GLY A 47 27.359 17.552 29.704 1.00 0.00 O ATOM 0 H GLY A 47 24.672 19.962 30.106 1.00 0.00 H new ATOM 0 HA2 GLY A 47 26.289 18.817 31.526 1.00 0.00 H new ATOM 0 HA3 GLY A 47 25.240 17.413 31.529 1.00 0.00 H new ATOM 755 N LYS A 48 25.385 17.712 28.531 1.00 0.00 N ATOM 756 CA LYS A 48 25.749 16.853 27.412 1.00 0.00 C ATOM 757 C LYS A 48 26.367 17.665 26.281 1.00 0.00 C ATOM 758 O LYS A 48 25.785 18.680 25.901 1.00 0.00 O ATOM 759 CB LYS A 48 24.427 16.210 26.991 1.00 0.00 C ATOM 760 CG LYS A 48 23.773 15.307 28.040 1.00 0.00 C ATOM 761 CD LYS A 48 24.774 14.362 28.717 1.00 0.00 C ATOM 762 CE LYS A 48 24.102 13.349 29.634 1.00 0.00 C ATOM 763 NZ LYS A 48 23.319 12.349 28.900 1.00 0.00 N ATOM 0 H LYS A 48 24.504 18.211 28.412 1.00 0.00 H new ATOM 0 HA LYS A 48 26.500 16.109 27.677 1.00 0.00 H new ATOM 0 HB2 LYS A 48 23.725 17.001 26.729 1.00 0.00 H new ATOM 0 HB3 LYS A 48 24.599 15.624 26.088 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.295 15.926 28.799 1.00 0.00 H new ATOM 0 HG3 LYS A 48 22.987 14.718 27.567 1.00 0.00 H new ATOM 0 HD2 LYS A 48 25.341 13.832 27.952 1.00 0.00 H new ATOM 0 HD3 LYS A 48 25.488 14.949 29.294 1.00 0.00 H new ATOM 0 HE2 LYS A 48 24.863 12.843 30.228 1.00 0.00 H new ATOM 0 HE3 LYS A 48 23.450 13.874 30.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 22.997 11.610 29.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 22.494 12.807 28.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 23.910 11.920 28.159 1.00 0.00 H new ATOM 777 N GLN A 49 27.478 17.184 25.728 1.00 0.00 N ATOM 778 CA GLN A 49 27.969 17.655 24.451 1.00 0.00 C ATOM 779 C GLN A 49 26.944 17.330 23.365 1.00 0.00 C ATOM 780 O GLN A 49 26.450 16.208 23.346 1.00 0.00 O ATOM 781 CB GLN A 49 29.374 17.111 24.165 1.00 0.00 C ATOM 782 CG GLN A 49 29.451 15.679 23.635 1.00 0.00 C ATOM 783 CD GLN A 49 30.857 15.175 23.326 1.00 0.00 C ATOM 784 OE1 GLN A 49 31.019 14.071 22.807 1.00 0.00 O ATOM 785 NE2 GLN A 49 31.892 15.950 23.626 1.00 0.00 N ATOM 0 H GLN A 49 28.055 16.460 26.156 1.00 0.00 H new ATOM 0 HA GLN A 49 28.083 18.739 24.469 1.00 0.00 H new ATOM 0 HB2 GLN A 49 29.855 17.770 23.442 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.956 17.167 25.085 1.00 0.00 H new ATOM 0 HG2 GLN A 49 28.996 15.013 24.368 1.00 0.00 H new ATOM 0 HG3 GLN A 49 28.851 15.612 22.728 1.00 0.00 H new ATOM 0 HE21 GLN A 49 31.738 16.862 24.056 1.00 0.00 H new ATOM 0 HE22 GLN A 49 32.841 15.633 23.427 1.00 0.00 H new ATOM 794 N LEU A 50 26.594 18.320 22.561 1.00 0.00 N ATOM 795 CA LEU A 50 25.781 18.185 21.362 1.00 0.00 C ATOM 796 C LEU A 50 26.540 17.469 20.235 1.00 0.00 C ATOM 797 O LEU A 50 27.495 18.039 19.710 1.00 0.00 O ATOM 798 CB LEU A 50 25.143 19.490 20.868 1.00 0.00 C ATOM 799 CG LEU A 50 24.019 20.113 21.685 1.00 0.00 C ATOM 800 CD1 LEU A 50 24.487 20.288 23.138 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.595 21.423 21.019 1.00 0.00 C ATOM 0 H LEU A 50 26.881 19.283 22.733 1.00 0.00 H new ATOM 0 HA LEU A 50 24.943 17.558 21.667 1.00 0.00 H new ATOM 0 HB2 LEU A 50 25.936 20.232 20.779 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.760 19.310 19.863 1.00 0.00 H new ATOM 0 HG LEU A 50 23.140 19.469 21.715 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.686 20.734 23.727 1.00 0.00 H new ATOM 0 HD12 LEU A 50 24.747 19.316 23.556 1.00 0.00 H new ATOM 0 HD13 LEU A 50 25.361 20.939 23.163 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.790 21.880 21.595 1.00 0.00 H new ATOM 0 HD22 LEU A 50 24.445 22.104 20.981 1.00 0.00 H new ATOM 0 HD23 LEU A 50 23.247 21.220 20.006 1.00 0.00 H new ATOM 813 N GLU A 51 26.116 16.261 19.891 1.00 0.00 N ATOM 814 CA GLU A 51 26.860 15.440 18.954 1.00 0.00 C ATOM 815 C GLU A 51 26.431 15.606 17.495 1.00 0.00 C ATOM 816 O GLU A 51 25.250 15.834 17.246 1.00 0.00 O ATOM 817 CB GLU A 51 26.281 14.068 19.291 1.00 0.00 C ATOM 818 CG GLU A 51 27.163 12.870 18.908 1.00 0.00 C ATOM 819 CD GLU A 51 26.730 11.568 19.568 1.00 0.00 C ATOM 820 OE1 GLU A 51 25.510 11.300 19.667 1.00 0.00 O ATOM 821 OE2 GLU A 51 27.634 10.862 20.057 1.00 0.00 O ATOM 0 H GLU A 51 25.262 15.831 20.247 1.00 0.00 H new ATOM 0 HA GLU A 51 27.928 15.644 19.033 1.00 0.00 H new ATOM 0 HB2 GLU A 51 26.087 14.027 20.363 1.00 0.00 H new ATOM 0 HB3 GLU A 51 25.319 13.965 18.789 1.00 0.00 H new ATOM 0 HG2 GLU A 51 27.143 12.745 17.825 1.00 0.00 H new ATOM 0 HG3 GLU A 51 28.195 13.084 19.185 1.00 0.00 H new ATOM 828 N ASP A 52 27.320 15.474 16.509 1.00 0.00 N ATOM 829 CA ASP A 52 27.083 15.918 15.145 1.00 0.00 C ATOM 830 C ASP A 52 26.231 14.935 14.356 1.00 0.00 C ATOM 831 O ASP A 52 26.383 13.716 14.430 1.00 0.00 O ATOM 832 CB ASP A 52 28.395 16.199 14.412 1.00 0.00 C ATOM 833 CG ASP A 52 28.867 17.639 14.584 1.00 0.00 C ATOM 834 OD1 ASP A 52 29.552 17.937 15.585 1.00 0.00 O ATOM 835 OD2 ASP A 52 28.697 18.544 13.727 1.00 0.00 O ATOM 0 H ASP A 52 28.237 15.048 16.643 1.00 0.00 H new ATOM 0 HA ASP A 52 26.523 16.850 15.218 1.00 0.00 H new ATOM 0 HB2 ASP A 52 29.165 15.522 14.781 1.00 0.00 H new ATOM 0 HB3 ASP A 52 28.266 15.987 13.351 1.00 0.00 H new ATOM 840 N GLY A 53 25.380 15.521 13.527 1.00 0.00 N ATOM 841 CA GLY A 53 24.396 14.879 12.669 1.00 0.00 C ATOM 842 C GLY A 53 22.954 15.170 13.096 1.00 0.00 C ATOM 843 O GLY A 53 21.976 15.183 12.357 1.00 0.00 O ATOM 0 H GLY A 53 25.358 16.536 13.430 1.00 0.00 H new ATOM 0 HA2 GLY A 53 24.541 15.216 11.643 1.00 0.00 H new ATOM 0 HA3 GLY A 53 24.562 13.802 12.677 1.00 0.00 H new ATOM 847 N ARG A 54 22.849 15.279 14.419 1.00 0.00 N ATOM 848 CA ARG A 54 21.618 15.466 15.144 1.00 0.00 C ATOM 849 C ARG A 54 21.178 16.935 15.113 1.00 0.00 C ATOM 850 O ARG A 54 21.887 17.781 14.585 1.00 0.00 O ATOM 851 CB ARG A 54 21.836 14.992 16.582 1.00 0.00 C ATOM 852 CG ARG A 54 22.299 13.554 16.770 1.00 0.00 C ATOM 853 CD ARG A 54 22.272 13.104 18.231 1.00 0.00 C ATOM 854 NE ARG A 54 23.029 11.890 18.536 1.00 0.00 N ATOM 855 CZ ARG A 54 22.667 10.604 18.474 1.00 0.00 C ATOM 856 NH1 ARG A 54 21.400 10.239 18.190 1.00 0.00 N ATOM 857 NH2 ARG A 54 23.540 9.653 18.811 1.00 0.00 N ATOM 0 H ARG A 54 23.663 15.236 15.032 1.00 0.00 H new ATOM 0 HA ARG A 54 20.822 14.885 14.677 1.00 0.00 H new ATOM 0 HB2 ARG A 54 22.571 15.649 17.048 1.00 0.00 H new ATOM 0 HB3 ARG A 54 20.901 15.122 17.127 1.00 0.00 H new ATOM 0 HG2 ARG A 54 21.663 12.893 16.180 1.00 0.00 H new ATOM 0 HG3 ARG A 54 23.313 13.451 16.382 1.00 0.00 H new ATOM 0 HD2 ARG A 54 22.658 13.915 18.849 1.00 0.00 H new ATOM 0 HD3 ARG A 54 21.234 12.946 18.524 1.00 0.00 H new ATOM 0 HE ARG A 54 23.987 12.050 18.846 1.00 0.00 H new ATOM 0 HH11 ARG A 54 20.691 10.951 18.016 1.00 0.00 H new ATOM 0 HH12 ARG A 54 21.151 9.251 18.149 1.00 0.00 H new ATOM 0 HH21 ARG A 54 24.480 9.908 19.115 1.00 0.00 H new ATOM 0 HH22 ARG A 54 23.268 8.671 18.765 1.00 0.00 H new ATOM 871 N THR A 55 19.963 17.234 15.577 1.00 0.00 N ATOM 872 CA THR A 55 19.275 18.501 15.514 1.00 0.00 C ATOM 873 C THR A 55 19.077 19.026 16.940 1.00 0.00 C ATOM 874 O THR A 55 19.316 18.257 17.872 1.00 0.00 O ATOM 875 CB THR A 55 18.014 18.243 14.690 1.00 0.00 C ATOM 876 OG1 THR A 55 17.167 17.332 15.356 1.00 0.00 O ATOM 877 CG2 THR A 55 18.187 17.974 13.199 1.00 0.00 C ATOM 0 H THR A 55 19.396 16.526 16.045 1.00 0.00 H new ATOM 0 HA THR A 55 19.820 19.304 15.018 1.00 0.00 H new ATOM 0 HB THR A 55 17.513 19.210 14.641 1.00 0.00 H new ATOM 0 HG1 THR A 55 17.616 16.464 15.432 1.00 0.00 H new ATOM 0 HG21 THR A 55 17.211 17.809 12.743 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.667 18.832 12.728 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.807 17.089 13.059 1.00 0.00 H new ATOM 885 N LEU A 56 18.849 20.293 17.264 1.00 0.00 N ATOM 886 CA LEU A 56 18.648 20.832 18.589 1.00 0.00 C ATOM 887 C LEU A 56 17.397 20.211 19.216 1.00 0.00 C ATOM 888 O LEU A 56 17.264 20.148 20.432 1.00 0.00 O ATOM 889 CB LEU A 56 18.567 22.359 18.569 1.00 0.00 C ATOM 890 CG LEU A 56 19.749 23.123 17.969 1.00 0.00 C ATOM 891 CD1 LEU A 56 19.419 24.621 17.956 1.00 0.00 C ATOM 892 CD2 LEU A 56 21.146 22.904 18.539 1.00 0.00 C ATOM 0 H LEU A 56 18.797 21.018 16.549 1.00 0.00 H new ATOM 0 HA LEU A 56 19.510 20.573 19.203 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.670 22.641 18.017 1.00 0.00 H new ATOM 0 HB3 LEU A 56 18.431 22.702 19.595 1.00 0.00 H new ATOM 0 HG LEU A 56 19.843 22.685 16.975 1.00 0.00 H new ATOM 0 HD11 LEU A 56 20.256 25.174 17.530 1.00 0.00 H new ATOM 0 HD12 LEU A 56 18.527 24.792 17.354 1.00 0.00 H new ATOM 0 HD13 LEU A 56 19.239 24.963 18.975 1.00 0.00 H new ATOM 0 HD21 LEU A 56 21.861 23.523 17.997 1.00 0.00 H new ATOM 0 HD22 LEU A 56 21.155 23.177 19.594 1.00 0.00 H new ATOM 0 HD23 LEU A 56 21.422 21.855 18.434 1.00 0.00 H new ATOM 904 N SER A 57 16.455 19.779 18.381 1.00 0.00 N ATOM 905 CA SER A 57 15.234 19.077 18.709 1.00 0.00 C ATOM 906 C SER A 57 15.465 17.816 19.542 1.00 0.00 C ATOM 907 O SER A 57 14.812 17.560 20.560 1.00 0.00 O ATOM 908 CB SER A 57 14.371 18.670 17.512 1.00 0.00 C ATOM 909 OG SER A 57 13.147 18.080 17.873 1.00 0.00 O ATOM 0 H SER A 57 16.541 19.928 17.376 1.00 0.00 H new ATOM 0 HA SER A 57 14.697 19.830 19.286 1.00 0.00 H new ATOM 0 HB2 SER A 57 14.174 19.551 16.901 1.00 0.00 H new ATOM 0 HB3 SER A 57 14.932 17.971 16.891 1.00 0.00 H new ATOM 0 HG SER A 57 12.646 17.846 17.064 1.00 0.00 H new ATOM 915 N ASP A 58 16.380 16.992 19.041 1.00 0.00 N ATOM 916 CA ASP A 58 16.912 15.798 19.649 1.00 0.00 C ATOM 917 C ASP A 58 17.371 15.901 21.107 1.00 0.00 C ATOM 918 O ASP A 58 17.566 14.900 21.777 1.00 0.00 O ATOM 919 CB ASP A 58 18.111 15.249 18.870 1.00 0.00 C ATOM 920 CG ASP A 58 17.817 14.512 17.577 1.00 0.00 C ATOM 921 OD1 ASP A 58 17.322 13.361 17.600 1.00 0.00 O ATOM 922 OD2 ASP A 58 18.006 15.085 16.474 1.00 0.00 O ATOM 0 H ASP A 58 16.796 17.165 18.126 1.00 0.00 H new ATOM 0 HA ASP A 58 16.041 15.143 19.623 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.775 16.082 18.641 1.00 0.00 H new ATOM 0 HB3 ASP A 58 18.660 14.574 19.526 1.00 0.00 H new ATOM 927 N TYR A 59 17.589 17.087 21.674 1.00 0.00 N ATOM 928 CA TYR A 59 18.016 17.332 23.035 1.00 0.00 C ATOM 929 C TYR A 59 17.059 18.272 23.775 1.00 0.00 C ATOM 930 O TYR A 59 17.205 18.324 24.996 1.00 0.00 O ATOM 931 CB TYR A 59 19.405 17.925 23.252 1.00 0.00 C ATOM 932 CG TYR A 59 20.512 17.174 22.566 1.00 0.00 C ATOM 933 CD1 TYR A 59 20.657 17.291 21.174 1.00 0.00 C ATOM 934 CD2 TYR A 59 21.323 16.368 23.383 1.00 0.00 C ATOM 935 CE1 TYR A 59 21.714 16.596 20.570 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.395 15.706 22.775 1.00 0.00 C ATOM 937 CZ TYR A 59 22.534 15.802 21.385 1.00 0.00 C ATOM 938 OH TYR A 59 23.520 15.057 20.811 1.00 0.00 O ATOM 0 H TYR A 59 17.461 17.954 21.153 1.00 0.00 H new ATOM 0 HA TYR A 59 18.027 16.313 23.421 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.407 18.956 22.897 1.00 0.00 H new ATOM 0 HB3 TYR A 59 19.611 17.956 24.322 1.00 0.00 H new ATOM 0 HD1 TYR A 59 19.978 17.895 20.590 1.00 0.00 H new ATOM 0 HD2 TYR A 59 21.126 16.264 24.440 1.00 0.00 H new ATOM 0 HE1 TYR A 59 21.892 16.670 19.507 1.00 0.00 H new ATOM 0 HE2 TYR A 59 23.098 15.135 23.363 1.00 0.00 H new ATOM 0 HH TYR A 59 23.288 14.107 20.869 1.00 0.00 H new ATOM 948 N ASN A 60 16.051 18.800 23.096 1.00 0.00 N ATOM 949 CA ASN A 60 14.869 19.423 23.667 1.00 0.00 C ATOM 950 C ASN A 60 15.131 20.929 23.776 1.00 0.00 C ATOM 951 O ASN A 60 14.627 21.564 24.702 1.00 0.00 O ATOM 952 CB ASN A 60 14.386 18.782 24.965 1.00 0.00 C ATOM 953 CG ASN A 60 12.974 19.216 25.309 1.00 0.00 C ATOM 954 OD1 ASN A 60 12.731 19.914 26.286 1.00 0.00 O ATOM 955 ND2 ASN A 60 12.054 18.717 24.486 1.00 0.00 N ATOM 0 H ASN A 60 16.037 18.805 22.076 1.00 0.00 H new ATOM 0 HA ASN A 60 14.025 19.254 22.999 1.00 0.00 H new ATOM 0 HB2 ASN A 60 14.421 17.697 24.871 1.00 0.00 H new ATOM 0 HB3 ASN A 60 15.059 19.053 25.778 1.00 0.00 H new ATOM 0 HD21 ASN A 60 11.066 18.909 24.650 1.00 0.00 H new ATOM 0 HD22 ASN A 60 12.338 18.143 23.692 1.00 0.00 H new ATOM 962 N ILE A 61 15.908 21.545 22.894 1.00 0.00 N ATOM 963 CA ILE A 61 16.332 22.924 23.015 1.00 0.00 C ATOM 964 C ILE A 61 15.246 23.743 22.305 1.00 0.00 C ATOM 965 O ILE A 61 14.882 23.559 21.144 1.00 0.00 O ATOM 966 CB ILE A 61 17.632 23.110 22.229 1.00 0.00 C ATOM 967 CG1 ILE A 61 18.676 22.147 22.811 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.216 24.516 22.161 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.078 22.114 22.190 1.00 0.00 C ATOM 0 H ILE A 61 16.266 21.084 22.057 1.00 0.00 H new ATOM 0 HA ILE A 61 16.480 23.216 24.055 1.00 0.00 H new ATOM 0 HB ILE A 61 17.370 22.898 21.192 1.00 0.00 H new ATOM 0 HG12 ILE A 61 18.789 22.383 23.869 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.265 21.139 22.752 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.134 24.501 21.574 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.496 25.187 21.691 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.436 24.868 23.169 1.00 0.00 H new ATOM 0 HD11 ILE A 61 20.692 21.383 22.716 1.00 0.00 H new ATOM 0 HD12 ILE A 61 20.004 21.836 21.139 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.536 23.099 22.274 1.00 0.00 H new ATOM 981 N GLN A 62 14.669 24.634 23.100 1.00 0.00 N ATOM 982 CA GLN A 62 13.555 25.497 22.763 1.00 0.00 C ATOM 983 C GLN A 62 13.959 26.967 22.729 1.00 0.00 C ATOM 984 O GLN A 62 15.110 27.304 23.026 1.00 0.00 O ATOM 985 CB GLN A 62 12.433 25.320 23.792 1.00 0.00 C ATOM 986 CG GLN A 62 11.638 24.011 23.825 1.00 0.00 C ATOM 987 CD GLN A 62 10.968 23.759 25.166 1.00 0.00 C ATOM 988 OE1 GLN A 62 10.326 22.749 25.436 1.00 0.00 O ATOM 989 NE2 GLN A 62 11.050 24.661 26.148 1.00 0.00 N ATOM 0 H GLN A 62 14.990 24.779 24.057 1.00 0.00 H new ATOM 0 HA GLN A 62 13.214 25.212 21.768 1.00 0.00 H new ATOM 0 HB2 GLN A 62 12.871 25.461 24.780 1.00 0.00 H new ATOM 0 HB3 GLN A 62 11.720 26.131 23.641 1.00 0.00 H new ATOM 0 HG2 GLN A 62 10.878 24.033 23.044 1.00 0.00 H new ATOM 0 HG3 GLN A 62 12.306 23.180 23.597 1.00 0.00 H new ATOM 0 HE21 GLN A 62 11.567 25.528 26.002 1.00 0.00 H new ATOM 0 HE22 GLN A 62 10.596 24.482 27.044 1.00 0.00 H new ATOM 998 N LYS A 63 13.112 27.931 22.368 1.00 0.00 N ATOM 999 CA LYS A 63 13.145 29.373 22.524 1.00 0.00 C ATOM 1000 C LYS A 63 13.711 29.782 23.892 1.00 0.00 C ATOM 1001 O LYS A 63 13.155 29.431 24.926 1.00 0.00 O ATOM 1002 CB LYS A 63 11.711 29.892 22.412 1.00 0.00 C ATOM 1003 CG LYS A 63 11.573 31.337 21.940 1.00 0.00 C ATOM 1004 CD LYS A 63 12.118 32.469 22.820 1.00 0.00 C ATOM 1005 CE LYS A 63 11.788 33.909 22.448 1.00 0.00 C ATOM 1006 NZ LYS A 63 11.890 34.813 23.608 1.00 0.00 N ATOM 0 H LYS A 63 12.255 27.665 21.883 1.00 0.00 H new ATOM 0 HA LYS A 63 13.789 29.795 21.752 1.00 0.00 H new ATOM 0 HB2 LYS A 63 11.163 29.249 21.724 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.232 29.798 23.386 1.00 0.00 H new ATOM 0 HG2 LYS A 63 12.062 31.413 20.969 1.00 0.00 H new ATOM 0 HG3 LYS A 63 10.512 31.529 21.779 1.00 0.00 H new ATOM 0 HD2 LYS A 63 11.760 32.300 23.835 1.00 0.00 H new ATOM 0 HD3 LYS A 63 13.204 32.375 22.845 1.00 0.00 H new ATOM 0 HE2 LYS A 63 12.466 34.246 21.664 1.00 0.00 H new ATOM 0 HE3 LYS A 63 10.779 33.956 22.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 11.962 35.796 23.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 11.044 34.710 24.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 12.736 34.572 24.163 1.00 0.00 H new ATOM 1020 N GLU A 64 14.750 30.611 23.846 1.00 0.00 N ATOM 1021 CA GLU A 64 15.488 31.275 24.908 1.00 0.00 C ATOM 1022 C GLU A 64 16.523 30.377 25.598 1.00 0.00 C ATOM 1023 O GLU A 64 17.125 30.852 26.554 1.00 0.00 O ATOM 1024 CB GLU A 64 14.458 31.987 25.780 1.00 0.00 C ATOM 1025 CG GLU A 64 14.931 33.316 26.372 1.00 0.00 C ATOM 1026 CD GLU A 64 14.762 34.555 25.514 1.00 0.00 C ATOM 1027 OE1 GLU A 64 14.328 34.430 24.347 1.00 0.00 O ATOM 1028 OE2 GLU A 64 14.853 35.680 26.047 1.00 0.00 O ATOM 0 H GLU A 64 15.143 30.864 22.939 1.00 0.00 H new ATOM 0 HA GLU A 64 16.163 32.039 24.522 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.562 32.168 25.186 1.00 0.00 H new ATOM 0 HB3 GLU A 64 14.171 31.323 26.596 1.00 0.00 H new ATOM 0 HG2 GLU A 64 14.397 33.478 27.308 1.00 0.00 H new ATOM 0 HG3 GLU A 64 15.988 33.218 26.620 1.00 0.00 H new ATOM 1035 N SER A 65 16.705 29.110 25.228 1.00 0.00 N ATOM 1036 CA SER A 65 17.553 28.237 26.005 1.00 0.00 C ATOM 1037 C SER A 65 18.982 28.795 25.988 1.00 0.00 C ATOM 1038 O SER A 65 19.388 29.347 24.976 1.00 0.00 O ATOM 1039 CB SER A 65 17.637 26.843 25.402 1.00 0.00 C ATOM 1040 OG SER A 65 16.305 26.397 25.533 1.00 0.00 O ATOM 0 H SER A 65 16.280 28.680 24.407 1.00 0.00 H new ATOM 0 HA SER A 65 17.129 28.182 27.008 1.00 0.00 H new ATOM 0 HB2 SER A 65 17.961 26.865 24.362 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.338 26.205 25.941 1.00 0.00 H new ATOM 0 HG SER A 65 15.795 26.651 24.735 1.00 0.00 H new ATOM 1046 N THR A 66 19.644 28.824 27.149 1.00 0.00 N ATOM 1047 CA THR A 66 21.021 29.278 27.255 1.00 0.00 C ATOM 1048 C THR A 66 21.897 28.024 27.198 1.00 0.00 C ATOM 1049 O THR A 66 21.776 27.166 28.071 1.00 0.00 O ATOM 1050 CB THR A 66 21.222 30.081 28.532 1.00 0.00 C ATOM 1051 OG1 THR A 66 20.238 31.088 28.646 1.00 0.00 O ATOM 1052 CG2 THR A 66 22.576 30.778 28.484 1.00 0.00 C ATOM 0 H THR A 66 19.235 28.532 28.037 1.00 0.00 H new ATOM 0 HA THR A 66 21.292 29.952 26.442 1.00 0.00 H new ATOM 0 HB THR A 66 21.158 29.394 29.376 1.00 0.00 H new ATOM 0 HG1 THR A 66 20.381 31.593 29.473 1.00 0.00 H new ATOM 0 HG21 THR A 66 22.721 31.354 29.398 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.366 30.032 28.395 1.00 0.00 H new ATOM 0 HG23 THR A 66 22.610 31.447 27.624 1.00 0.00 H new ATOM 1060 N LEU A 67 22.769 27.919 26.191 1.00 0.00 N ATOM 1061 CA LEU A 67 23.743 26.874 25.930 1.00 0.00 C ATOM 1062 C LEU A 67 25.064 27.285 26.578 1.00 0.00 C ATOM 1063 O LEU A 67 25.288 28.490 26.669 1.00 0.00 O ATOM 1064 CB LEU A 67 23.886 26.540 24.447 1.00 0.00 C ATOM 1065 CG LEU A 67 22.879 25.479 24.001 1.00 0.00 C ATOM 1066 CD1 LEU A 67 21.437 25.964 24.043 1.00 0.00 C ATOM 1067 CD2 LEU A 67 23.269 25.035 22.581 1.00 0.00 C ATOM 0 H LEU A 67 22.808 28.640 25.471 1.00 0.00 H new ATOM 0 HA LEU A 67 23.395 25.942 26.375 1.00 0.00 H new ATOM 0 HB2 LEU A 67 23.745 27.445 23.856 1.00 0.00 H new ATOM 0 HB3 LEU A 67 24.898 26.185 24.251 1.00 0.00 H new ATOM 0 HG LEU A 67 22.920 24.643 24.699 1.00 0.00 H new ATOM 0 HD11 LEU A 67 20.774 25.163 23.715 1.00 0.00 H new ATOM 0 HD12 LEU A 67 21.180 26.253 25.062 1.00 0.00 H new ATOM 0 HD13 LEU A 67 21.323 26.823 23.382 1.00 0.00 H new ATOM 0 HD21 LEU A 67 22.569 24.276 22.232 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.238 25.893 21.910 1.00 0.00 H new ATOM 0 HD23 LEU A 67 24.277 24.620 22.593 1.00 0.00 H new ATOM 1079 N HIS A 68 25.963 26.368 26.920 1.00 0.00 N ATOM 1080 CA HIS A 68 27.348 26.641 27.217 1.00 0.00 C ATOM 1081 C HIS A 68 28.155 26.151 26.011 1.00 0.00 C ATOM 1082 O HIS A 68 27.907 25.036 25.553 1.00 0.00 O ATOM 1083 CB HIS A 68 27.720 25.806 28.442 1.00 0.00 C ATOM 1084 CG HIS A 68 27.494 26.543 29.727 1.00 0.00 C ATOM 1085 ND1 HIS A 68 26.196 26.777 30.183 1.00 0.00 N ATOM 1086 CD2 HIS A 68 28.375 27.178 30.565 1.00 0.00 C ATOM 1087 CE1 HIS A 68 26.298 27.555 31.261 1.00 0.00 C ATOM 1088 NE2 HIS A 68 27.587 27.572 31.625 1.00 0.00 N ATOM 0 H HIS A 68 25.729 25.378 26.998 1.00 0.00 H new ATOM 0 HA HIS A 68 27.538 27.697 27.409 1.00 0.00 H new ATOM 0 HB2 HIS A 68 27.132 24.888 28.445 1.00 0.00 H new ATOM 0 HB3 HIS A 68 28.768 25.513 28.374 1.00 0.00 H new ATOM 0 HD2 HIS A 68 29.435 27.333 30.427 1.00 0.00 H new ATOM 0 HE1 HIS A 68 25.489 28.076 31.751 1.00 0.00 H new ATOM 0 HE2 HIS A 68 27.933 27.837 32.547 1.00 0.00 H new ATOM 1096 N LEU A 69 29.089 26.931 25.495 1.00 0.00 N ATOM 1097 CA LEU A 69 30.212 26.669 24.614 1.00 0.00 C ATOM 1098 C LEU A 69 31.572 26.582 25.300 1.00 0.00 C ATOM 1099 O LEU A 69 31.855 27.495 26.079 1.00 0.00 O ATOM 1100 CB LEU A 69 30.232 27.851 23.640 1.00 0.00 C ATOM 1101 CG LEU A 69 31.496 28.203 22.847 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.804 27.107 21.820 1.00 0.00 C ATOM 1103 CD2 LEU A 69 31.276 29.510 22.090 1.00 0.00 C ATOM 0 H LEU A 69 29.069 27.924 25.725 1.00 0.00 H new ATOM 0 HA LEU A 69 30.069 25.691 24.154 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.438 27.679 22.914 1.00 0.00 H new ATOM 0 HB3 LEU A 69 29.956 28.738 24.210 1.00 0.00 H new ATOM 0 HG LEU A 69 32.325 28.298 23.548 1.00 0.00 H new ATOM 0 HD11 LEU A 69 32.704 27.371 21.265 1.00 0.00 H new ATOM 0 HD12 LEU A 69 31.960 26.159 22.335 1.00 0.00 H new ATOM 0 HD13 LEU A 69 30.967 27.010 21.129 1.00 0.00 H new ATOM 0 HD21 LEU A 69 32.175 29.760 21.526 1.00 0.00 H new ATOM 0 HD22 LEU A 69 30.437 29.396 21.403 1.00 0.00 H new ATOM 0 HD23 LEU A 69 31.059 30.309 22.799 1.00 0.00 H new ATOM 1115 N VAL A 70 32.350 25.545 25.018 1.00 0.00 N ATOM 1116 CA VAL A 70 33.669 25.177 25.504 1.00 0.00 C ATOM 1117 C VAL A 70 34.488 24.960 24.228 1.00 0.00 C ATOM 1118 O VAL A 70 34.093 24.275 23.294 1.00 0.00 O ATOM 1119 CB VAL A 70 33.587 23.897 26.330 1.00 0.00 C ATOM 1120 CG1 VAL A 70 34.937 23.219 26.571 1.00 0.00 C ATOM 1121 CG2 VAL A 70 33.020 24.150 27.729 1.00 0.00 C ATOM 0 H VAL A 70 32.021 24.848 24.350 1.00 0.00 H new ATOM 0 HA VAL A 70 34.112 25.932 26.154 1.00 0.00 H new ATOM 0 HB VAL A 70 32.943 23.258 25.726 1.00 0.00 H new ATOM 0 HG11 VAL A 70 34.790 22.317 27.165 1.00 0.00 H new ATOM 0 HG12 VAL A 70 35.387 22.954 25.614 1.00 0.00 H new ATOM 0 HG13 VAL A 70 35.597 23.902 27.105 1.00 0.00 H new ATOM 0 HG21 VAL A 70 32.980 23.211 28.281 1.00 0.00 H new ATOM 0 HG22 VAL A 70 33.660 24.855 28.259 1.00 0.00 H new ATOM 0 HG23 VAL A 70 32.015 24.564 27.645 1.00 0.00 H new ATOM 1131 N LEU A 71 35.669 25.578 24.161 1.00 0.00 N ATOM 1132 CA LEU A 71 36.597 25.568 23.053 1.00 0.00 C ATOM 1133 C LEU A 71 38.005 25.088 23.447 1.00 0.00 C ATOM 1134 O LEU A 71 38.346 25.350 24.604 1.00 0.00 O ATOM 1135 CB LEU A 71 36.743 26.925 22.357 1.00 0.00 C ATOM 1136 CG LEU A 71 36.899 28.242 23.102 1.00 0.00 C ATOM 1137 CD1 LEU A 71 37.881 29.151 22.362 1.00 0.00 C ATOM 1138 CD2 LEU A 71 35.582 28.869 23.556 1.00 0.00 C ATOM 0 H LEU A 71 36.017 26.136 24.941 1.00 0.00 H new ATOM 0 HA LEU A 71 36.147 24.858 22.359 1.00 0.00 H new ATOM 0 HB2 LEU A 71 37.609 26.841 21.700 1.00 0.00 H new ATOM 0 HB3 LEU A 71 35.867 27.037 21.718 1.00 0.00 H new ATOM 0 HG LEU A 71 37.360 28.043 24.069 1.00 0.00 H new ATOM 0 HD11 LEU A 71 37.985 30.091 22.904 1.00 0.00 H new ATOM 0 HD12 LEU A 71 38.852 28.660 22.296 1.00 0.00 H new ATOM 0 HD13 LEU A 71 37.506 29.350 21.358 1.00 0.00 H new ATOM 0 HD21 LEU A 71 35.785 29.804 24.078 1.00 0.00 H new ATOM 0 HD22 LEU A 71 34.955 29.068 22.687 1.00 0.00 H new ATOM 0 HD23 LEU A 71 35.065 28.183 24.227 1.00 0.00 H new