USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 586 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 60 ASN : amide:sc= -0.0258 K(o=-0.51,f=0.042) USER MOD Set 1.2: A 62 GLN : amide:sc= -0.482 K(o=-0.51,f=0.62) USER MOD Set 2.1: A 6 LYS NZ :NH3+ 180:sc= 1.31 (180deg=0) USER MOD Set 2.2: A 12 THR OG1 : rot 11:sc= 1.03 USER MOD Set 3.1: A 7 THR OG1 : rot 117:sc= 0.233 USER MOD Set 3.2: A 9 THR OG1 : rot 180:sc= 0.325 USER MOD Single : A 1 MET CE :methyl 152:sc= -0.0582 (180deg=-0.349) USER MOD Single : A 1 MET N :NH3+ 149:sc= 1.66 (180deg=1.36) USER MOD Single : A 2 GLN : amide:sc= -0.6 K(o=-0.6,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 163:sc= 0.876 (180deg=0.38) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 52:sc= 0.137 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0501 USER MOD Single : A 25 ASN : amide:sc= -0.0164 K(o=-0.016,f=-0.56) USER MOD Single : A 27 LYS NZ :NH3+ -175:sc= 1.2 (180deg=1.18) USER MOD Single : A 29 LYS NZ :NH3+ 175:sc= 2.27 (180deg=1.96) USER MOD Single : A 31 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 33 LYS NZ :NH3+ -169:sc= 1.29 (180deg=1.12) USER MOD Single : A 40 GLN : amide:sc= -0.408 X(o=-0.41,f=0) USER MOD Single : A 41 GLN : amide:sc= 0.541 K(o=0.54,f=-1.5) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 1.01 K(o=1,f=-0.34) USER MOD Single : A 55 THR OG1 : rot -83:sc= 1.37 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 90:sc= 0.546 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 95:sc= 1.22 USER MOD Single : A 66 THR OG1 : rot 19:sc= 0.337 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=-0.042) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.481 31.196 16.313 1.00 0.00 N ATOM 2 CA MET A 1 13.455 31.360 17.769 1.00 0.00 C ATOM 3 C MET A 1 14.861 31.715 18.252 1.00 0.00 C ATOM 4 O MET A 1 15.760 31.663 17.416 1.00 0.00 O ATOM 5 CB MET A 1 13.031 30.038 18.409 1.00 0.00 C ATOM 6 CG MET A 1 14.069 28.917 18.408 1.00 0.00 C ATOM 7 SD MET A 1 13.615 27.342 19.172 1.00 0.00 S ATOM 8 CE MET A 1 15.257 26.653 19.510 1.00 0.00 C ATOM 0 H1 MET A 1 12.769 30.492 16.030 1.00 0.00 H new ATOM 0 H2 MET A 1 13.268 32.106 15.857 1.00 0.00 H new ATOM 0 H3 MET A 1 14.424 30.873 16.017 1.00 0.00 H new ATOM 0 HA MET A 1 12.755 32.149 18.043 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.743 30.236 19.442 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.141 29.679 17.893 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.346 28.719 17.373 1.00 0.00 H new ATOM 0 HG3 MET A 1 14.962 29.288 18.911 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.202 25.986 20.370 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.604 26.095 18.640 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.955 27.463 19.723 1.00 0.00 H new ATOM 20 N GLN A 2 15.132 32.137 19.495 1.00 0.00 N ATOM 21 CA GLN A 2 16.449 32.519 19.953 1.00 0.00 C ATOM 22 C GLN A 2 17.036 31.571 21.002 1.00 0.00 C ATOM 23 O GLN A 2 16.292 31.126 21.874 1.00 0.00 O ATOM 24 CB GLN A 2 16.450 33.951 20.492 1.00 0.00 C ATOM 25 CG GLN A 2 15.795 34.794 19.387 1.00 0.00 C ATOM 26 CD GLN A 2 15.662 36.265 19.724 1.00 0.00 C ATOM 27 OE1 GLN A 2 15.328 37.009 18.800 1.00 0.00 O ATOM 28 NE2 GLN A 2 15.799 36.667 20.982 1.00 0.00 N ATOM 0 H GLN A 2 14.416 32.219 20.217 1.00 0.00 H new ATOM 0 HA GLN A 2 17.091 32.455 19.075 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.891 34.021 21.425 1.00 0.00 H new ATOM 0 HB3 GLN A 2 17.464 34.293 20.701 1.00 0.00 H new ATOM 0 HG2 GLN A 2 16.381 34.694 18.474 1.00 0.00 H new ATOM 0 HG3 GLN A 2 14.805 34.390 19.176 1.00 0.00 H new ATOM 0 HE21 GLN A 2 16.079 36.001 21.703 1.00 0.00 H new ATOM 0 HE22 GLN A 2 15.625 37.641 21.228 1.00 0.00 H new ATOM 37 N ILE A 3 18.341 31.308 21.059 1.00 0.00 N ATOM 38 CA ILE A 3 19.074 30.645 22.122 1.00 0.00 C ATOM 39 C ILE A 3 20.362 31.416 22.404 1.00 0.00 C ATOM 40 O ILE A 3 20.846 32.173 21.569 1.00 0.00 O ATOM 41 CB ILE A 3 19.401 29.197 21.747 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.183 29.026 20.436 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.135 28.350 21.775 1.00 0.00 C ATOM 44 CD1 ILE A 3 20.542 27.609 19.989 1.00 0.00 C ATOM 0 H ILE A 3 18.960 31.579 20.295 1.00 0.00 H new ATOM 0 HA ILE A 3 18.451 30.627 23.016 1.00 0.00 H new ATOM 0 HB ILE A 3 20.092 28.837 22.509 1.00 0.00 H new ATOM 0 HG12 ILE A 3 19.602 29.489 19.639 1.00 0.00 H new ATOM 0 HG13 ILE A 3 21.110 29.592 20.525 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.379 27.322 21.507 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.705 28.371 22.776 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.414 28.750 21.062 1.00 0.00 H new ATOM 0 HD11 ILE A 3 21.092 27.652 19.049 1.00 0.00 H new ATOM 0 HD12 ILE A 3 21.161 27.133 20.750 1.00 0.00 H new ATOM 0 HD13 ILE A 3 19.630 27.029 19.850 1.00 0.00 H new ATOM 56 N PHE A 4 20.912 31.303 23.614 1.00 0.00 N ATOM 57 CA PHE A 4 22.075 31.940 24.200 1.00 0.00 C ATOM 58 C PHE A 4 23.161 30.883 24.413 1.00 0.00 C ATOM 59 O PHE A 4 22.881 29.801 24.927 1.00 0.00 O ATOM 60 CB PHE A 4 21.583 32.455 25.552 1.00 0.00 C ATOM 61 CG PHE A 4 20.494 33.494 25.683 1.00 0.00 C ATOM 62 CD1 PHE A 4 19.137 33.161 25.493 1.00 0.00 C ATOM 63 CD2 PHE A 4 20.864 34.835 25.761 1.00 0.00 C ATOM 64 CE1 PHE A 4 18.177 34.170 25.420 1.00 0.00 C ATOM 65 CE2 PHE A 4 19.914 35.856 25.786 1.00 0.00 C ATOM 66 CZ PHE A 4 18.576 35.499 25.618 1.00 0.00 C ATOM 0 H PHE A 4 20.485 30.672 24.293 1.00 0.00 H new ATOM 0 HA PHE A 4 22.490 32.734 23.579 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.249 31.583 26.114 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.456 32.853 26.069 1.00 0.00 H new ATOM 0 HD1 PHE A 4 18.842 32.126 25.404 1.00 0.00 H new ATOM 0 HD2 PHE A 4 21.913 35.090 25.803 1.00 0.00 H new ATOM 0 HE1 PHE A 4 17.144 33.931 25.214 1.00 0.00 H new ATOM 0 HE2 PHE A 4 20.204 36.886 25.930 1.00 0.00 H new ATOM 0 HZ PHE A 4 17.822 36.272 25.641 1.00 0.00 H new ATOM 76 N VAL A 5 24.394 31.165 24.000 1.00 0.00 N ATOM 77 CA VAL A 5 25.590 30.385 24.228 1.00 0.00 C ATOM 78 C VAL A 5 26.500 31.378 24.959 1.00 0.00 C ATOM 79 O VAL A 5 26.760 32.518 24.552 1.00 0.00 O ATOM 80 CB VAL A 5 26.200 29.745 22.985 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.506 28.963 23.127 1.00 0.00 C ATOM 82 CG2 VAL A 5 25.204 28.862 22.221 1.00 0.00 C ATOM 0 H VAL A 5 24.589 32.007 23.459 1.00 0.00 H new ATOM 0 HA VAL A 5 25.395 29.484 24.809 1.00 0.00 H new ATOM 0 HB VAL A 5 26.463 30.646 22.431 1.00 0.00 H new ATOM 0 HG11 VAL A 5 27.804 28.573 22.154 1.00 0.00 H new ATOM 0 HG12 VAL A 5 28.285 29.623 23.508 1.00 0.00 H new ATOM 0 HG13 VAL A 5 27.361 28.135 23.820 1.00 0.00 H new ATOM 0 HG21 VAL A 5 25.694 28.434 21.347 1.00 0.00 H new ATOM 0 HG22 VAL A 5 24.856 28.060 22.871 1.00 0.00 H new ATOM 0 HG23 VAL A 5 24.354 29.465 21.902 1.00 0.00 H new ATOM 92 N LYS A 6 27.057 30.991 26.094 1.00 0.00 N ATOM 93 CA LYS A 6 28.184 31.634 26.740 1.00 0.00 C ATOM 94 C LYS A 6 29.478 30.904 26.404 1.00 0.00 C ATOM 95 O LYS A 6 29.609 29.684 26.307 1.00 0.00 O ATOM 96 CB LYS A 6 28.016 31.364 28.236 1.00 0.00 C ATOM 97 CG LYS A 6 26.719 31.818 28.906 1.00 0.00 C ATOM 98 CD LYS A 6 26.564 33.333 29.013 1.00 0.00 C ATOM 99 CE LYS A 6 25.595 33.816 30.091 1.00 0.00 C ATOM 100 NZ LYS A 6 25.699 35.279 30.274 1.00 0.00 N ATOM 0 H LYS A 6 26.718 30.181 26.613 1.00 0.00 H new ATOM 0 HA LYS A 6 28.220 32.682 26.443 1.00 0.00 H new ATOM 0 HB2 LYS A 6 28.116 30.290 28.395 1.00 0.00 H new ATOM 0 HB3 LYS A 6 28.846 31.842 28.757 1.00 0.00 H new ATOM 0 HG2 LYS A 6 25.875 31.417 28.346 1.00 0.00 H new ATOM 0 HG3 LYS A 6 26.671 31.388 29.906 1.00 0.00 H new ATOM 0 HD2 LYS A 6 27.544 33.769 29.207 1.00 0.00 H new ATOM 0 HD3 LYS A 6 26.230 33.716 28.049 1.00 0.00 H new ATOM 0 HE2 LYS A 6 24.575 33.551 29.814 1.00 0.00 H new ATOM 0 HE3 LYS A 6 25.811 33.311 31.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 25.032 35.585 31.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 26.668 35.525 30.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 25.470 35.758 29.380 1.00 0.00 H new ATOM 114 N THR A 7 30.530 31.700 26.195 1.00 0.00 N ATOM 115 CA THR A 7 31.902 31.414 25.863 1.00 0.00 C ATOM 116 C THR A 7 32.599 31.186 27.210 1.00 0.00 C ATOM 117 O THR A 7 32.010 31.408 28.265 1.00 0.00 O ATOM 118 CB THR A 7 32.589 32.561 25.112 1.00 0.00 C ATOM 119 OG1 THR A 7 32.808 33.753 25.813 1.00 0.00 O ATOM 120 CG2 THR A 7 31.883 32.979 23.824 1.00 0.00 C ATOM 0 H THR A 7 30.401 32.709 26.270 1.00 0.00 H new ATOM 0 HA THR A 7 31.956 30.554 25.196 1.00 0.00 H new ATOM 0 HB THR A 7 33.549 32.081 24.925 1.00 0.00 H new ATOM 0 HG1 THR A 7 33.771 33.915 25.889 1.00 0.00 H new ATOM 0 HG21 THR A 7 32.434 33.795 23.356 1.00 0.00 H new ATOM 0 HG22 THR A 7 31.840 32.131 23.141 1.00 0.00 H new ATOM 0 HG23 THR A 7 30.871 33.310 24.055 1.00 0.00 H new ATOM 128 N LEU A 8 33.903 30.971 27.141 1.00 0.00 N ATOM 129 CA LEU A 8 34.826 30.700 28.225 1.00 0.00 C ATOM 130 C LEU A 8 34.976 32.035 28.972 1.00 0.00 C ATOM 131 O LEU A 8 35.133 32.013 30.191 1.00 0.00 O ATOM 132 CB LEU A 8 36.113 30.053 27.715 1.00 0.00 C ATOM 133 CG LEU A 8 35.950 28.602 27.278 1.00 0.00 C ATOM 134 CD1 LEU A 8 35.221 28.421 25.955 1.00 0.00 C ATOM 135 CD2 LEU A 8 37.333 27.941 27.307 1.00 0.00 C ATOM 0 H LEU A 8 34.383 30.984 26.241 1.00 0.00 H new ATOM 0 HA LEU A 8 34.467 29.951 28.931 1.00 0.00 H new ATOM 0 HB2 LEU A 8 36.490 30.634 26.874 1.00 0.00 H new ATOM 0 HB3 LEU A 8 36.867 30.102 28.500 1.00 0.00 H new ATOM 0 HG LEU A 8 35.288 28.100 27.983 1.00 0.00 H new ATOM 0 HD11 LEU A 8 35.150 27.359 25.721 1.00 0.00 H new ATOM 0 HD12 LEU A 8 34.219 28.844 26.031 1.00 0.00 H new ATOM 0 HD13 LEU A 8 35.771 28.931 25.164 1.00 0.00 H new ATOM 0 HD21 LEU A 8 37.245 26.899 26.998 1.00 0.00 H new ATOM 0 HD22 LEU A 8 38.002 28.467 26.625 1.00 0.00 H new ATOM 0 HD23 LEU A 8 37.737 27.986 28.318 1.00 0.00 H new ATOM 147 N THR A 9 35.177 33.138 28.252 1.00 0.00 N ATOM 148 CA THR A 9 35.479 34.458 28.787 1.00 0.00 C ATOM 149 C THR A 9 34.231 35.168 29.321 1.00 0.00 C ATOM 150 O THR A 9 34.329 36.185 30.015 1.00 0.00 O ATOM 151 CB THR A 9 36.155 35.210 27.645 1.00 0.00 C ATOM 152 OG1 THR A 9 35.526 35.021 26.402 1.00 0.00 O ATOM 153 CG2 THR A 9 37.561 34.688 27.358 1.00 0.00 C ATOM 0 H THR A 9 35.131 33.132 27.233 1.00 0.00 H new ATOM 0 HA THR A 9 36.134 34.402 29.656 1.00 0.00 H new ATOM 0 HB THR A 9 36.123 36.244 27.990 1.00 0.00 H new ATOM 0 HG1 THR A 9 36.004 35.528 25.713 1.00 0.00 H new ATOM 0 HG21 THR A 9 37.999 35.256 26.537 1.00 0.00 H new ATOM 0 HG22 THR A 9 38.180 34.801 28.248 1.00 0.00 H new ATOM 0 HG23 THR A 9 37.509 33.634 27.083 1.00 0.00 H new ATOM 161 N GLY A 10 33.064 34.621 29.001 1.00 0.00 N ATOM 162 CA GLY A 10 31.862 34.920 29.754 1.00 0.00 C ATOM 163 C GLY A 10 30.992 35.791 28.839 1.00 0.00 C ATOM 164 O GLY A 10 30.015 36.348 29.338 1.00 0.00 O ATOM 0 H GLY A 10 32.929 33.971 28.227 1.00 0.00 H new ATOM 0 HA2 GLY A 10 31.339 34.005 30.033 1.00 0.00 H new ATOM 0 HA3 GLY A 10 32.102 35.445 30.679 1.00 0.00 H new ATOM 168 N LYS A 11 31.293 35.983 27.566 1.00 0.00 N ATOM 169 CA LYS A 11 30.469 36.617 26.553 1.00 0.00 C ATOM 170 C LYS A 11 29.297 35.711 26.183 1.00 0.00 C ATOM 171 O LYS A 11 29.529 34.508 26.109 1.00 0.00 O ATOM 172 CB LYS A 11 31.234 36.931 25.262 1.00 0.00 C ATOM 173 CG LYS A 11 30.484 37.590 24.109 1.00 0.00 C ATOM 174 CD LYS A 11 31.412 38.001 22.961 1.00 0.00 C ATOM 175 CE LYS A 11 30.988 39.123 22.011 1.00 0.00 C ATOM 176 NZ LYS A 11 32.152 39.700 21.316 1.00 0.00 N ATOM 0 H LYS A 11 32.188 35.676 27.186 1.00 0.00 H new ATOM 0 HA LYS A 11 30.129 37.555 26.992 1.00 0.00 H new ATOM 0 HB2 LYS A 11 32.072 37.577 25.523 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.655 35.996 24.891 1.00 0.00 H new ATOM 0 HG2 LYS A 11 29.728 36.901 23.731 1.00 0.00 H new ATOM 0 HG3 LYS A 11 29.958 38.470 24.479 1.00 0.00 H new ATOM 0 HD2 LYS A 11 32.367 38.289 23.401 1.00 0.00 H new ATOM 0 HD3 LYS A 11 31.595 37.113 22.356 1.00 0.00 H new ATOM 0 HE2 LYS A 11 30.279 38.735 21.279 1.00 0.00 H new ATOM 0 HE3 LYS A 11 30.472 39.903 22.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 31.829 40.240 20.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 32.665 40.332 21.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 32.785 38.935 21.005 1.00 0.00 H new ATOM 190 N THR A 12 28.118 36.331 26.073 1.00 0.00 N ATOM 191 CA THR A 12 26.826 35.771 25.727 1.00 0.00 C ATOM 192 C THR A 12 26.624 36.023 24.238 1.00 0.00 C ATOM 193 O THR A 12 26.631 37.182 23.824 1.00 0.00 O ATOM 194 CB THR A 12 25.757 36.549 26.494 1.00 0.00 C ATOM 195 OG1 THR A 12 25.882 36.580 27.904 1.00 0.00 O ATOM 196 CG2 THR A 12 24.310 36.120 26.283 1.00 0.00 C ATOM 0 H THR A 12 28.048 37.334 26.242 1.00 0.00 H new ATOM 0 HA THR A 12 26.767 34.709 25.964 1.00 0.00 H new ATOM 0 HB THR A 12 25.962 37.521 26.044 1.00 0.00 H new ATOM 0 HG1 THR A 12 26.758 36.225 28.163 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.653 36.750 26.882 1.00 0.00 H new ATOM 0 HG22 THR A 12 24.050 36.223 25.230 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.191 35.080 26.586 1.00 0.00 H new ATOM 204 N ILE A 13 26.474 34.928 23.511 1.00 0.00 N ATOM 205 CA ILE A 13 26.235 34.857 22.092 1.00 0.00 C ATOM 206 C ILE A 13 24.742 34.533 21.905 1.00 0.00 C ATOM 207 O ILE A 13 24.334 33.540 22.487 1.00 0.00 O ATOM 208 CB ILE A 13 27.026 33.804 21.329 1.00 0.00 C ATOM 209 CG1 ILE A 13 28.510 33.794 21.706 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.861 34.043 19.825 1.00 0.00 C ATOM 211 CD1 ILE A 13 29.279 32.650 21.030 1.00 0.00 C ATOM 0 H ILE A 13 26.521 34.002 23.935 1.00 0.00 H new ATOM 0 HA ILE A 13 26.555 35.816 21.685 1.00 0.00 H new ATOM 0 HB ILE A 13 26.629 32.826 21.601 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.960 34.746 21.425 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.606 33.703 22.788 1.00 0.00 H new ATOM 0 HG21 ILE A 13 27.426 33.292 19.273 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.806 33.972 19.559 1.00 0.00 H new ATOM 0 HG23 ILE A 13 27.234 35.035 19.571 1.00 0.00 H new ATOM 0 HD11 ILE A 13 30.326 32.688 21.330 1.00 0.00 H new ATOM 0 HD12 ILE A 13 28.849 31.695 21.332 1.00 0.00 H new ATOM 0 HD13 ILE A 13 29.208 32.754 19.947 1.00 0.00 H new ATOM 223 N THR A 14 23.980 35.323 21.153 1.00 0.00 N ATOM 224 CA THR A 14 22.631 34.983 20.771 1.00 0.00 C ATOM 225 C THR A 14 22.593 34.675 19.274 1.00 0.00 C ATOM 226 O THR A 14 23.123 35.459 18.489 1.00 0.00 O ATOM 227 CB THR A 14 21.726 36.122 21.230 1.00 0.00 C ATOM 228 OG1 THR A 14 22.116 37.420 20.846 1.00 0.00 O ATOM 229 CG2 THR A 14 21.326 35.989 22.703 1.00 0.00 C ATOM 0 H THR A 14 24.294 36.224 20.793 1.00 0.00 H new ATOM 0 HA THR A 14 22.263 34.076 21.251 1.00 0.00 H new ATOM 0 HB THR A 14 20.813 35.990 20.649 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.469 38.071 21.189 1.00 0.00 H new ATOM 0 HG21 THR A 14 20.682 36.823 22.982 1.00 0.00 H new ATOM 0 HG22 THR A 14 20.790 35.052 22.851 1.00 0.00 H new ATOM 0 HG23 THR A 14 22.221 35.998 23.325 1.00 0.00 H new ATOM 237 N LEU A 15 22.112 33.510 18.863 1.00 0.00 N ATOM 238 CA LEU A 15 21.925 33.095 17.494 1.00 0.00 C ATOM 239 C LEU A 15 20.414 33.038 17.239 1.00 0.00 C ATOM 240 O LEU A 15 19.618 32.759 18.133 1.00 0.00 O ATOM 241 CB LEU A 15 22.520 31.707 17.264 1.00 0.00 C ATOM 242 CG LEU A 15 24.017 31.548 17.573 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.911 32.667 17.055 1.00 0.00 C ATOM 244 CD2 LEU A 15 24.322 31.205 19.037 1.00 0.00 C ATOM 0 H LEU A 15 21.826 32.789 19.525 1.00 0.00 H new ATOM 0 HA LEU A 15 22.421 33.795 16.822 1.00 0.00 H new ATOM 0 HB2 LEU A 15 21.967 30.992 17.874 1.00 0.00 H new ATOM 0 HB3 LEU A 15 22.355 31.432 16.222 1.00 0.00 H new ATOM 0 HG LEU A 15 24.286 30.671 16.984 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.947 32.460 17.325 1.00 0.00 H new ATOM 0 HD12 LEU A 15 24.824 32.729 15.970 1.00 0.00 H new ATOM 0 HD13 LEU A 15 24.603 33.614 17.499 1.00 0.00 H new ATOM 0 HD21 LEU A 15 25.399 31.110 19.172 1.00 0.00 H new ATOM 0 HD22 LEU A 15 23.944 31.998 19.683 1.00 0.00 H new ATOM 0 HD23 LEU A 15 23.839 30.263 19.298 1.00 0.00 H new ATOM 256 N GLU A 16 20.083 33.282 15.975 1.00 0.00 N ATOM 257 CA GLU A 16 18.833 33.088 15.263 1.00 0.00 C ATOM 258 C GLU A 16 18.918 31.624 14.819 1.00 0.00 C ATOM 259 O GLU A 16 19.652 31.315 13.889 1.00 0.00 O ATOM 260 CB GLU A 16 18.830 33.985 14.039 1.00 0.00 C ATOM 261 CG GLU A 16 18.191 35.324 14.392 1.00 0.00 C ATOM 262 CD GLU A 16 18.162 36.214 13.153 1.00 0.00 C ATOM 263 OE1 GLU A 16 17.166 36.192 12.409 1.00 0.00 O ATOM 264 OE2 GLU A 16 19.126 37.004 12.996 1.00 0.00 O ATOM 0 H GLU A 16 20.784 33.673 15.346 1.00 0.00 H new ATOM 0 HA GLU A 16 17.944 33.312 15.852 1.00 0.00 H new ATOM 0 HB2 GLU A 16 19.849 34.138 13.685 1.00 0.00 H new ATOM 0 HB3 GLU A 16 18.279 33.509 13.228 1.00 0.00 H new ATOM 0 HG2 GLU A 16 17.179 35.169 14.766 1.00 0.00 H new ATOM 0 HG3 GLU A 16 18.754 35.809 15.189 1.00 0.00 H new ATOM 271 N VAL A 17 18.085 30.791 15.452 1.00 0.00 N ATOM 272 CA VAL A 17 18.024 29.408 15.030 1.00 0.00 C ATOM 273 C VAL A 17 16.543 29.055 14.941 1.00 0.00 C ATOM 274 O VAL A 17 15.688 29.787 15.448 1.00 0.00 O ATOM 275 CB VAL A 17 18.671 28.517 16.093 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.191 28.442 16.153 1.00 0.00 C ATOM 277 CG2 VAL A 17 17.970 28.359 17.438 1.00 0.00 C ATOM 0 H VAL A 17 17.471 31.045 16.226 1.00 0.00 H new ATOM 0 HA VAL A 17 18.541 29.263 14.082 1.00 0.00 H new ATOM 0 HB VAL A 17 18.419 27.579 15.598 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.491 27.771 16.958 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.574 28.066 15.205 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.597 29.436 16.340 1.00 0.00 H new ATOM 0 HG21 VAL A 17 18.555 27.698 18.078 1.00 0.00 H new ATOM 0 HG22 VAL A 17 17.874 29.334 17.915 1.00 0.00 H new ATOM 0 HG23 VAL A 17 16.979 27.931 17.284 1.00 0.00 H new ATOM 287 N GLU A 18 16.198 28.003 14.197 1.00 0.00 N ATOM 288 CA GLU A 18 14.960 27.254 14.105 1.00 0.00 C ATOM 289 C GLU A 18 15.163 25.775 14.431 1.00 0.00 C ATOM 290 O GLU A 18 16.267 25.260 14.328 1.00 0.00 O ATOM 291 CB GLU A 18 14.296 27.447 12.741 1.00 0.00 C ATOM 292 CG GLU A 18 13.467 28.730 12.707 1.00 0.00 C ATOM 293 CD GLU A 18 12.120 28.791 13.403 1.00 0.00 C ATOM 294 OE1 GLU A 18 11.328 27.871 13.088 1.00 0.00 O ATOM 295 OE2 GLU A 18 11.970 29.701 14.250 1.00 0.00 O ATOM 0 H GLU A 18 16.886 27.608 13.557 1.00 0.00 H new ATOM 0 HA GLU A 18 14.282 27.653 14.860 1.00 0.00 H new ATOM 0 HB2 GLU A 18 15.059 27.483 11.964 1.00 0.00 H new ATOM 0 HB3 GLU A 18 13.657 26.592 12.520 1.00 0.00 H new ATOM 0 HG2 GLU A 18 14.084 29.524 13.128 1.00 0.00 H new ATOM 0 HG3 GLU A 18 13.300 28.978 11.659 1.00 0.00 H new ATOM 302 N PRO A 19 14.109 25.046 14.792 1.00 0.00 N ATOM 303 CA PRO A 19 14.235 23.677 15.273 1.00 0.00 C ATOM 304 C PRO A 19 14.837 22.642 14.334 1.00 0.00 C ATOM 305 O PRO A 19 15.162 21.549 14.801 1.00 0.00 O ATOM 306 CB PRO A 19 12.815 23.146 15.420 1.00 0.00 C ATOM 307 CG PRO A 19 12.042 24.381 15.889 1.00 0.00 C ATOM 308 CD PRO A 19 12.772 25.486 15.127 1.00 0.00 C ATOM 0 HA PRO A 19 14.877 23.769 16.149 1.00 0.00 H new ATOM 0 HB2 PRO A 19 12.427 22.759 14.477 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.759 22.334 16.145 1.00 0.00 H new ATOM 0 HG2 PRO A 19 10.985 24.329 15.629 1.00 0.00 H new ATOM 0 HG3 PRO A 19 12.098 24.518 16.969 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.224 25.738 14.219 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.818 26.390 15.734 1.00 0.00 H new ATOM 316 N SER A 20 14.918 22.785 13.013 1.00 0.00 N ATOM 317 CA SER A 20 15.469 21.934 11.982 1.00 0.00 C ATOM 318 C SER A 20 16.943 22.180 11.648 1.00 0.00 C ATOM 319 O SER A 20 17.492 21.463 10.817 1.00 0.00 O ATOM 320 CB SER A 20 14.746 22.328 10.696 1.00 0.00 C ATOM 321 OG SER A 20 14.222 23.640 10.618 1.00 0.00 O ATOM 0 H SER A 20 14.538 23.631 12.589 1.00 0.00 H new ATOM 0 HA SER A 20 15.359 20.909 12.335 1.00 0.00 H new ATOM 0 HB2 SER A 20 15.439 22.192 9.865 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.925 21.628 10.544 1.00 0.00 H new ATOM 0 HG SER A 20 14.923 24.286 10.843 1.00 0.00 H new ATOM 327 N ASP A 21 17.652 23.138 12.228 1.00 0.00 N ATOM 328 CA ASP A 21 19.097 23.300 12.151 1.00 0.00 C ATOM 329 C ASP A 21 19.845 22.241 12.943 1.00 0.00 C ATOM 330 O ASP A 21 19.576 22.028 14.130 1.00 0.00 O ATOM 331 CB ASP A 21 19.711 24.625 12.599 1.00 0.00 C ATOM 332 CG ASP A 21 19.383 25.916 11.848 1.00 0.00 C ATOM 333 OD1 ASP A 21 18.724 25.770 10.797 1.00 0.00 O ATOM 334 OD2 ASP A 21 19.652 27.052 12.288 1.00 0.00 O ATOM 0 H ASP A 21 17.211 23.862 12.795 1.00 0.00 H new ATOM 0 HA ASP A 21 19.219 23.226 11.070 1.00 0.00 H new ATOM 0 HB2 ASP A 21 19.429 24.776 13.641 1.00 0.00 H new ATOM 0 HB3 ASP A 21 20.794 24.504 12.576 1.00 0.00 H new ATOM 339 N THR A 22 20.889 21.699 12.321 1.00 0.00 N ATOM 340 CA THR A 22 21.768 20.713 12.913 1.00 0.00 C ATOM 341 C THR A 22 22.858 21.302 13.813 1.00 0.00 C ATOM 342 O THR A 22 23.182 22.484 13.767 1.00 0.00 O ATOM 343 CB THR A 22 22.357 19.920 11.745 1.00 0.00 C ATOM 344 OG1 THR A 22 22.866 20.805 10.779 1.00 0.00 O ATOM 345 CG2 THR A 22 21.335 18.991 11.090 1.00 0.00 C ATOM 0 H THR A 22 21.148 21.945 11.366 1.00 0.00 H new ATOM 0 HA THR A 22 21.200 20.077 13.592 1.00 0.00 H new ATOM 0 HB THR A 22 23.154 19.297 12.151 1.00 0.00 H new ATOM 0 HG1 THR A 22 23.244 20.293 10.033 1.00 0.00 H new ATOM 0 HG21 THR A 22 21.807 18.453 10.268 1.00 0.00 H new ATOM 0 HG22 THR A 22 20.967 18.277 11.827 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.501 19.579 10.708 1.00 0.00 H new ATOM 353 N ILE A 23 23.539 20.521 14.658 1.00 0.00 N ATOM 354 CA ILE A 23 24.568 20.943 15.586 1.00 0.00 C ATOM 355 C ILE A 23 25.736 21.667 14.909 1.00 0.00 C ATOM 356 O ILE A 23 26.308 22.536 15.546 1.00 0.00 O ATOM 357 CB ILE A 23 25.102 19.820 16.471 1.00 0.00 C ATOM 358 CG1 ILE A 23 24.070 18.981 17.221 1.00 0.00 C ATOM 359 CG2 ILE A 23 26.153 20.286 17.483 1.00 0.00 C ATOM 360 CD1 ILE A 23 22.979 19.834 17.862 1.00 0.00 C ATOM 0 H ILE A 23 23.368 19.517 14.707 1.00 0.00 H new ATOM 0 HA ILE A 23 24.052 21.654 16.231 1.00 0.00 H new ATOM 0 HB ILE A 23 25.550 19.173 15.717 1.00 0.00 H new ATOM 0 HG12 ILE A 23 23.614 18.271 16.532 1.00 0.00 H new ATOM 0 HG13 ILE A 23 24.572 18.398 17.993 1.00 0.00 H new ATOM 0 HG21 ILE A 23 26.488 19.436 18.078 1.00 0.00 H new ATOM 0 HG22 ILE A 23 27.003 20.715 16.953 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.717 21.039 18.140 1.00 0.00 H new ATOM 0 HD11 ILE A 23 22.271 19.189 18.382 1.00 0.00 H new ATOM 0 HD12 ILE A 23 23.429 20.527 18.573 1.00 0.00 H new ATOM 0 HD13 ILE A 23 22.456 20.397 17.089 1.00 0.00 H new ATOM 372 N GLU A 24 26.076 21.193 13.714 1.00 0.00 N ATOM 373 CA GLU A 24 27.132 21.762 12.899 1.00 0.00 C ATOM 374 C GLU A 24 26.755 23.160 12.402 1.00 0.00 C ATOM 375 O GLU A 24 27.577 24.077 12.400 1.00 0.00 O ATOM 376 CB GLU A 24 27.260 20.976 11.594 1.00 0.00 C ATOM 377 CG GLU A 24 28.519 21.275 10.781 1.00 0.00 C ATOM 378 CD GLU A 24 29.723 20.417 11.138 1.00 0.00 C ATOM 379 OE1 GLU A 24 29.534 19.285 11.644 1.00 0.00 O ATOM 380 OE2 GLU A 24 30.893 20.805 10.900 1.00 0.00 O ATOM 0 H GLU A 24 25.616 20.391 13.283 1.00 0.00 H new ATOM 0 HA GLU A 24 28.028 21.755 13.519 1.00 0.00 H new ATOM 0 HB2 GLU A 24 27.239 19.911 11.825 1.00 0.00 H new ATOM 0 HB3 GLU A 24 26.388 21.185 10.975 1.00 0.00 H new ATOM 0 HG2 GLU A 24 28.293 21.139 9.723 1.00 0.00 H new ATOM 0 HG3 GLU A 24 28.783 22.324 10.918 1.00 0.00 H new ATOM 387 N ASN A 25 25.482 23.331 12.072 1.00 0.00 N ATOM 388 CA ASN A 25 24.846 24.556 11.616 1.00 0.00 C ATOM 389 C ASN A 25 24.998 25.681 12.633 1.00 0.00 C ATOM 390 O ASN A 25 25.224 26.824 12.240 1.00 0.00 O ATOM 391 CB ASN A 25 23.385 24.284 11.265 1.00 0.00 C ATOM 392 CG ASN A 25 22.859 25.293 10.264 1.00 0.00 C ATOM 393 OD1 ASN A 25 22.196 26.290 10.568 1.00 0.00 O ATOM 394 ND2 ASN A 25 23.057 25.033 8.973 1.00 0.00 N ATOM 0 H ASN A 25 24.819 22.558 12.120 1.00 0.00 H new ATOM 0 HA ASN A 25 25.351 24.896 10.712 1.00 0.00 H new ATOM 0 HB2 ASN A 25 23.289 23.279 10.855 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.779 24.318 12.171 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.665 25.651 8.262 1.00 0.00 H new ATOM 0 HD22 ASN A 25 23.601 24.216 8.695 1.00 0.00 H new ATOM 401 N VAL A 26 24.675 25.305 13.875 1.00 0.00 N ATOM 402 CA VAL A 26 24.778 26.193 15.017 1.00 0.00 C ATOM 403 C VAL A 26 26.209 26.683 15.243 1.00 0.00 C ATOM 404 O VAL A 26 26.437 27.839 15.579 1.00 0.00 O ATOM 405 CB VAL A 26 24.144 25.521 16.230 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.173 26.583 17.325 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.757 24.922 15.944 1.00 0.00 C ATOM 0 H VAL A 26 24.335 24.372 14.108 1.00 0.00 H new ATOM 0 HA VAL A 26 24.218 27.107 14.822 1.00 0.00 H new ATOM 0 HB VAL A 26 24.698 24.636 16.543 1.00 0.00 H new ATOM 0 HG11 VAL A 26 23.733 26.178 18.236 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.204 26.877 17.520 1.00 0.00 H new ATOM 0 HG13 VAL A 26 23.603 27.454 17.002 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.366 24.460 16.851 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.080 25.711 15.618 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.840 24.169 15.161 1.00 0.00 H new ATOM 417 N LYS A 27 27.239 25.852 15.063 1.00 0.00 N ATOM 418 CA LYS A 27 28.608 26.234 15.308 1.00 0.00 C ATOM 419 C LYS A 27 29.157 27.023 14.119 1.00 0.00 C ATOM 420 O LYS A 27 30.068 27.840 14.244 1.00 0.00 O ATOM 421 CB LYS A 27 29.569 25.053 15.514 1.00 0.00 C ATOM 422 CG LYS A 27 29.381 24.359 16.856 1.00 0.00 C ATOM 423 CD LYS A 27 30.280 23.150 17.140 1.00 0.00 C ATOM 424 CE LYS A 27 30.305 21.978 16.153 1.00 0.00 C ATOM 425 NZ LYS A 27 31.469 21.100 16.302 1.00 0.00 N ATOM 0 H LYS A 27 27.132 24.890 14.740 1.00 0.00 H new ATOM 0 HA LYS A 27 28.568 26.819 16.227 1.00 0.00 H new ATOM 0 HB2 LYS A 27 29.422 24.328 14.713 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.596 25.410 15.437 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.541 25.094 17.644 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.343 24.035 16.929 1.00 0.00 H new ATOM 0 HD2 LYS A 27 31.301 23.518 17.235 1.00 0.00 H new ATOM 0 HD3 LYS A 27 29.993 22.751 18.113 1.00 0.00 H new ATOM 0 HE2 LYS A 27 29.398 21.387 16.283 1.00 0.00 H new ATOM 0 HE3 LYS A 27 30.287 22.371 15.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 31.461 20.383 15.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 32.340 21.664 16.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 31.433 20.630 17.229 1.00 0.00 H new ATOM 439 N ALA A 28 28.555 26.898 12.939 1.00 0.00 N ATOM 440 CA ALA A 28 28.860 27.680 11.760 1.00 0.00 C ATOM 441 C ALA A 28 28.202 29.055 11.816 1.00 0.00 C ATOM 442 O ALA A 28 28.910 29.989 11.449 1.00 0.00 O ATOM 443 CB ALA A 28 28.295 26.871 10.588 1.00 0.00 C ATOM 0 H ALA A 28 27.811 26.219 12.779 1.00 0.00 H new ATOM 0 HA ALA A 28 29.932 27.857 11.668 1.00 0.00 H new ATOM 0 HB1 ALA A 28 28.487 27.400 9.655 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.775 25.893 10.556 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.220 26.744 10.718 1.00 0.00 H new ATOM 449 N LYS A 29 27.050 29.213 12.477 1.00 0.00 N ATOM 450 CA LYS A 29 26.524 30.531 12.767 1.00 0.00 C ATOM 451 C LYS A 29 27.282 31.286 13.864 1.00 0.00 C ATOM 452 O LYS A 29 27.240 32.512 13.909 1.00 0.00 O ATOM 453 CB LYS A 29 25.103 30.185 13.209 1.00 0.00 C ATOM 454 CG LYS A 29 24.114 30.010 12.060 1.00 0.00 C ATOM 455 CD LYS A 29 22.691 29.686 12.513 1.00 0.00 C ATOM 456 CE LYS A 29 21.673 29.629 11.374 1.00 0.00 C ATOM 457 NZ LYS A 29 20.304 29.467 11.875 1.00 0.00 N ATOM 0 H LYS A 29 26.474 28.442 12.816 1.00 0.00 H new ATOM 0 HA LYS A 29 26.600 31.210 11.918 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.130 29.265 13.793 1.00 0.00 H new ATOM 0 HB3 LYS A 29 24.739 30.971 13.870 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.097 30.924 11.466 1.00 0.00 H new ATOM 0 HG3 LYS A 29 24.468 29.212 11.407 1.00 0.00 H new ATOM 0 HD2 LYS A 29 22.695 28.727 13.031 1.00 0.00 H new ATOM 0 HD3 LYS A 29 22.371 30.437 13.235 1.00 0.00 H new ATOM 0 HE2 LYS A 29 21.738 30.542 10.782 1.00 0.00 H new ATOM 0 HE3 LYS A 29 21.917 28.800 10.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 19.635 29.517 11.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.213 28.544 12.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.091 30.225 12.555 1.00 0.00 H new ATOM 471 N ILE A 30 27.975 30.575 14.752 1.00 0.00 N ATOM 472 CA ILE A 30 28.918 31.014 15.758 1.00 0.00 C ATOM 473 C ILE A 30 30.237 31.439 15.123 1.00 0.00 C ATOM 474 O ILE A 30 30.719 32.523 15.451 1.00 0.00 O ATOM 475 CB ILE A 30 29.065 29.999 16.900 1.00 0.00 C ATOM 476 CG1 ILE A 30 27.780 29.901 17.716 1.00 0.00 C ATOM 477 CG2 ILE A 30 30.342 30.119 17.727 1.00 0.00 C ATOM 478 CD1 ILE A 30 27.740 28.695 18.663 1.00 0.00 C ATOM 0 H ILE A 30 27.870 29.561 14.779 1.00 0.00 H new ATOM 0 HA ILE A 30 28.515 31.907 16.237 1.00 0.00 H new ATOM 0 HB ILE A 30 29.210 29.030 16.423 1.00 0.00 H new ATOM 0 HG12 ILE A 30 27.660 30.814 18.300 1.00 0.00 H new ATOM 0 HG13 ILE A 30 26.931 29.845 17.035 1.00 0.00 H new ATOM 0 HG21 ILE A 30 30.344 29.356 18.505 1.00 0.00 H new ATOM 0 HG22 ILE A 30 31.209 29.981 17.080 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.386 31.106 18.187 1.00 0.00 H new ATOM 0 HD11 ILE A 30 26.797 28.692 19.209 1.00 0.00 H new ATOM 0 HD12 ILE A 30 27.827 27.775 18.085 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.568 28.759 19.369 1.00 0.00 H new ATOM 490 N GLN A 31 30.746 30.688 14.152 1.00 0.00 N ATOM 491 CA GLN A 31 31.907 31.025 13.342 1.00 0.00 C ATOM 492 C GLN A 31 31.607 32.272 12.503 1.00 0.00 C ATOM 493 O GLN A 31 32.449 33.164 12.523 1.00 0.00 O ATOM 494 CB GLN A 31 32.230 29.795 12.490 1.00 0.00 C ATOM 495 CG GLN A 31 33.624 29.753 11.868 1.00 0.00 C ATOM 496 CD GLN A 31 33.921 30.467 10.555 1.00 0.00 C ATOM 497 OE1 GLN A 31 33.006 30.667 9.761 1.00 0.00 O ATOM 498 NE2 GLN A 31 35.134 30.873 10.192 1.00 0.00 N ATOM 0 H GLN A 31 30.341 29.787 13.898 1.00 0.00 H new ATOM 0 HA GLN A 31 32.777 31.271 13.951 1.00 0.00 H new ATOM 0 HB2 GLN A 31 32.104 28.907 13.109 1.00 0.00 H new ATOM 0 HB3 GLN A 31 31.495 29.731 11.688 1.00 0.00 H new ATOM 0 HG2 GLN A 31 34.317 30.150 12.610 1.00 0.00 H new ATOM 0 HG3 GLN A 31 33.878 28.703 11.724 1.00 0.00 H new ATOM 0 HE21 GLN A 31 35.928 30.730 10.816 1.00 0.00 H new ATOM 0 HE22 GLN A 31 35.271 31.327 9.289 1.00 0.00 H new ATOM 507 N ASP A 32 30.442 32.439 11.889 1.00 0.00 N ATOM 508 CA ASP A 32 29.997 33.634 11.183 1.00 0.00 C ATOM 509 C ASP A 32 30.018 34.887 12.049 1.00 0.00 C ATOM 510 O ASP A 32 30.668 35.885 11.745 1.00 0.00 O ATOM 511 CB ASP A 32 28.675 33.399 10.452 1.00 0.00 C ATOM 512 CG ASP A 32 28.324 34.599 9.582 1.00 0.00 C ATOM 513 OD1 ASP A 32 28.673 34.664 8.377 1.00 0.00 O ATOM 514 OD2 ASP A 32 27.586 35.514 9.978 1.00 0.00 O ATOM 0 H ASP A 32 29.740 31.699 11.870 1.00 0.00 H new ATOM 0 HA ASP A 32 30.734 33.838 10.406 1.00 0.00 H new ATOM 0 HB2 ASP A 32 28.749 32.504 9.834 1.00 0.00 H new ATOM 0 HB3 ASP A 32 27.879 33.222 11.176 1.00 0.00 H new ATOM 519 N LYS A 33 29.301 34.763 13.156 1.00 0.00 N ATOM 520 CA LYS A 33 29.098 35.918 14.006 1.00 0.00 C ATOM 521 C LYS A 33 30.283 36.301 14.895 1.00 0.00 C ATOM 522 O LYS A 33 30.454 37.458 15.267 1.00 0.00 O ATOM 523 CB LYS A 33 27.914 35.618 14.919 1.00 0.00 C ATOM 524 CG LYS A 33 27.360 36.831 15.663 1.00 0.00 C ATOM 525 CD LYS A 33 25.862 36.743 15.977 1.00 0.00 C ATOM 526 CE LYS A 33 25.269 37.893 16.800 1.00 0.00 C ATOM 527 NZ LYS A 33 23.834 37.644 17.007 1.00 0.00 N ATOM 0 H LYS A 33 28.863 33.900 13.477 1.00 0.00 H new ATOM 0 HA LYS A 33 28.941 36.762 13.334 1.00 0.00 H new ATOM 0 HB2 LYS A 33 27.115 35.178 14.323 1.00 0.00 H new ATOM 0 HB3 LYS A 33 28.217 34.868 15.649 1.00 0.00 H new ATOM 0 HG2 LYS A 33 27.909 36.953 16.597 1.00 0.00 H new ATOM 0 HG3 LYS A 33 27.543 37.725 15.066 1.00 0.00 H new ATOM 0 HD2 LYS A 33 25.318 36.682 15.034 1.00 0.00 H new ATOM 0 HD3 LYS A 33 25.679 35.811 16.511 1.00 0.00 H new ATOM 0 HE2 LYS A 33 25.780 37.971 17.760 1.00 0.00 H new ATOM 0 HE3 LYS A 33 25.416 38.841 16.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 23.386 38.498 17.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 23.389 37.405 16.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 23.711 36.854 17.672 1.00 0.00 H new ATOM 541 N GLU A 34 31.109 35.363 15.367 1.00 0.00 N ATOM 542 CA GLU A 34 32.077 35.637 16.416 1.00 0.00 C ATOM 543 C GLU A 34 33.375 34.876 16.173 1.00 0.00 C ATOM 544 O GLU A 34 34.324 35.203 16.878 1.00 0.00 O ATOM 545 CB GLU A 34 31.466 35.338 17.784 1.00 0.00 C ATOM 546 CG GLU A 34 32.279 35.637 19.044 1.00 0.00 C ATOM 547 CD GLU A 34 32.567 37.116 19.253 1.00 0.00 C ATOM 548 OE1 GLU A 34 32.033 38.033 18.579 1.00 0.00 O ATOM 549 OE2 GLU A 34 33.333 37.330 20.207 1.00 0.00 O ATOM 0 H GLU A 34 31.121 34.400 15.031 1.00 0.00 H new ATOM 0 HA GLU A 34 32.334 36.696 16.399 1.00 0.00 H new ATOM 0 HB2 GLU A 34 30.532 35.896 17.856 1.00 0.00 H new ATOM 0 HB3 GLU A 34 31.207 34.279 17.804 1.00 0.00 H new ATOM 0 HG2 GLU A 34 31.741 35.255 19.911 1.00 0.00 H new ATOM 0 HG3 GLU A 34 33.224 35.096 18.992 1.00 0.00 H new ATOM 556 N GLY A 35 33.455 33.977 15.193 1.00 0.00 N ATOM 557 CA GLY A 35 34.667 33.533 14.521 1.00 0.00 C ATOM 558 C GLY A 35 35.238 32.257 15.134 1.00 0.00 C ATOM 559 O GLY A 35 36.318 31.800 14.755 1.00 0.00 O ATOM 0 H GLY A 35 32.623 33.514 14.828 1.00 0.00 H new ATOM 0 HA2 GLY A 35 34.452 33.362 13.466 1.00 0.00 H new ATOM 0 HA3 GLY A 35 35.416 34.323 14.570 1.00 0.00 H new ATOM 563 N ILE A 36 34.521 31.526 15.987 1.00 0.00 N ATOM 564 CA ILE A 36 34.989 30.322 16.637 1.00 0.00 C ATOM 565 C ILE A 36 34.672 29.116 15.741 1.00 0.00 C ATOM 566 O ILE A 36 33.527 28.879 15.365 1.00 0.00 O ATOM 567 CB ILE A 36 34.451 30.254 18.067 1.00 0.00 C ATOM 568 CG1 ILE A 36 34.625 31.557 18.849 1.00 0.00 C ATOM 569 CG2 ILE A 36 34.995 29.098 18.911 1.00 0.00 C ATOM 570 CD1 ILE A 36 33.707 31.551 20.076 1.00 0.00 C ATOM 0 H ILE A 36 33.566 31.772 16.247 1.00 0.00 H new ATOM 0 HA ILE A 36 36.072 30.319 16.757 1.00 0.00 H new ATOM 0 HB ILE A 36 33.389 30.071 17.902 1.00 0.00 H new ATOM 0 HG12 ILE A 36 35.663 31.669 19.161 1.00 0.00 H new ATOM 0 HG13 ILE A 36 34.390 32.409 18.211 1.00 0.00 H new ATOM 0 HG21 ILE A 36 34.554 29.136 19.907 1.00 0.00 H new ATOM 0 HG22 ILE A 36 34.740 28.150 18.437 1.00 0.00 H new ATOM 0 HG23 ILE A 36 36.079 29.184 18.990 1.00 0.00 H new ATOM 0 HD11 ILE A 36 33.834 32.481 20.630 1.00 0.00 H new ATOM 0 HD12 ILE A 36 32.670 31.459 19.754 1.00 0.00 H new ATOM 0 HD13 ILE A 36 33.963 30.708 20.718 1.00 0.00 H new ATOM 582 N PRO A 37 35.641 28.265 15.410 1.00 0.00 N ATOM 583 CA PRO A 37 35.484 27.298 14.339 1.00 0.00 C ATOM 584 C PRO A 37 34.695 26.118 14.915 1.00 0.00 C ATOM 585 O PRO A 37 34.615 25.976 16.131 1.00 0.00 O ATOM 586 CB PRO A 37 36.924 26.932 13.973 1.00 0.00 C ATOM 587 CG PRO A 37 37.769 27.145 15.226 1.00 0.00 C ATOM 588 CD PRO A 37 37.023 28.319 15.846 1.00 0.00 C ATOM 0 HA PRO A 37 34.945 27.644 13.457 1.00 0.00 H new ATOM 0 HB2 PRO A 37 36.986 25.897 13.637 1.00 0.00 H new ATOM 0 HB3 PRO A 37 37.284 27.555 13.154 1.00 0.00 H new ATOM 0 HG2 PRO A 37 37.782 26.269 15.875 1.00 0.00 H new ATOM 0 HG3 PRO A 37 38.807 27.385 14.994 1.00 0.00 H new ATOM 0 HD2 PRO A 37 37.080 28.273 16.934 1.00 0.00 H new ATOM 0 HD3 PRO A 37 37.480 29.261 15.543 1.00 0.00 H new ATOM 596 N PRO A 38 33.977 25.331 14.116 1.00 0.00 N ATOM 597 CA PRO A 38 33.291 24.172 14.648 1.00 0.00 C ATOM 598 C PRO A 38 34.265 23.071 15.095 1.00 0.00 C ATOM 599 O PRO A 38 33.942 22.465 16.109 1.00 0.00 O ATOM 600 CB PRO A 38 32.404 23.681 13.511 1.00 0.00 C ATOM 601 CG PRO A 38 32.782 24.484 12.259 1.00 0.00 C ATOM 602 CD PRO A 38 33.716 25.599 12.720 1.00 0.00 C ATOM 0 HA PRO A 38 32.721 24.431 15.540 1.00 0.00 H new ATOM 0 HB2 PRO A 38 32.551 22.614 13.342 1.00 0.00 H new ATOM 0 HB3 PRO A 38 31.351 23.823 13.756 1.00 0.00 H new ATOM 0 HG2 PRO A 38 33.273 23.847 11.524 1.00 0.00 H new ATOM 0 HG3 PRO A 38 31.894 24.896 11.780 1.00 0.00 H new ATOM 0 HD2 PRO A 38 34.640 25.602 12.141 1.00 0.00 H new ATOM 0 HD3 PRO A 38 33.254 26.578 12.588 1.00 0.00 H new ATOM 610 N ASP A 39 35.456 22.891 14.525 1.00 0.00 N ATOM 611 CA ASP A 39 36.467 21.982 15.035 1.00 0.00 C ATOM 612 C ASP A 39 37.047 22.359 16.407 1.00 0.00 C ATOM 613 O ASP A 39 37.461 23.512 16.468 1.00 0.00 O ATOM 614 CB ASP A 39 37.552 21.880 13.969 1.00 0.00 C ATOM 615 CG ASP A 39 38.768 21.073 14.381 1.00 0.00 C ATOM 616 OD1 ASP A 39 38.573 19.845 14.476 1.00 0.00 O ATOM 617 OD2 ASP A 39 39.862 21.662 14.476 1.00 0.00 O ATOM 0 H ASP A 39 35.745 23.385 13.680 1.00 0.00 H new ATOM 0 HA ASP A 39 35.996 21.017 15.224 1.00 0.00 H new ATOM 0 HB2 ASP A 39 37.122 21.432 13.073 1.00 0.00 H new ATOM 0 HB3 ASP A 39 37.874 22.886 13.700 1.00 0.00 H new ATOM 622 N GLN A 40 36.917 21.566 17.456 1.00 0.00 N ATOM 623 CA GLN A 40 37.373 21.685 18.828 1.00 0.00 C ATOM 624 C GLN A 40 36.459 22.563 19.687 1.00 0.00 C ATOM 625 O GLN A 40 36.749 22.796 20.853 1.00 0.00 O ATOM 626 CB GLN A 40 38.807 22.223 18.920 1.00 0.00 C ATOM 627 CG GLN A 40 40.009 21.466 18.346 1.00 0.00 C ATOM 628 CD GLN A 40 41.275 22.313 18.318 1.00 0.00 C ATOM 629 OE1 GLN A 40 42.296 21.993 17.703 1.00 0.00 O ATOM 630 NE2 GLN A 40 41.384 23.382 19.090 1.00 0.00 N ATOM 0 H GLN A 40 36.410 20.688 17.343 1.00 0.00 H new ATOM 0 HA GLN A 40 37.345 20.668 19.220 1.00 0.00 H new ATOM 0 HB2 GLN A 40 38.802 23.205 18.447 1.00 0.00 H new ATOM 0 HB3 GLN A 40 39.014 22.380 19.979 1.00 0.00 H new ATOM 0 HG2 GLN A 40 40.188 20.571 18.942 1.00 0.00 H new ATOM 0 HG3 GLN A 40 39.776 21.134 17.334 1.00 0.00 H new ATOM 0 HE21 GLN A 40 40.581 23.706 19.629 1.00 0.00 H new ATOM 0 HE22 GLN A 40 42.271 23.882 19.146 1.00 0.00 H new ATOM 639 N GLN A 41 35.383 23.053 19.078 1.00 0.00 N ATOM 640 CA GLN A 41 34.361 23.777 19.811 1.00 0.00 C ATOM 641 C GLN A 41 33.308 22.678 19.997 1.00 0.00 C ATOM 642 O GLN A 41 32.743 22.053 19.097 1.00 0.00 O ATOM 643 CB GLN A 41 33.869 24.980 18.998 1.00 0.00 C ATOM 644 CG GLN A 41 32.570 25.622 19.490 1.00 0.00 C ATOM 645 CD GLN A 41 31.853 26.675 18.669 1.00 0.00 C ATOM 646 OE1 GLN A 41 30.725 27.034 19.017 1.00 0.00 O ATOM 647 NE2 GLN A 41 32.371 26.980 17.479 1.00 0.00 N ATOM 0 H GLN A 41 35.200 22.960 18.079 1.00 0.00 H new ATOM 0 HA GLN A 41 34.674 24.222 20.755 1.00 0.00 H new ATOM 0 HB2 GLN A 41 34.651 25.739 18.996 1.00 0.00 H new ATOM 0 HB3 GLN A 41 33.729 24.665 17.964 1.00 0.00 H new ATOM 0 HG2 GLN A 41 31.860 24.813 19.659 1.00 0.00 H new ATOM 0 HG3 GLN A 41 32.784 26.067 20.462 1.00 0.00 H new ATOM 0 HE21 GLN A 41 33.309 26.661 17.234 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.830 27.532 16.814 1.00 0.00 H new ATOM 656 N ARG A 42 33.046 22.456 21.280 1.00 0.00 N ATOM 657 CA ARG A 42 31.968 21.645 21.808 1.00 0.00 C ATOM 658 C ARG A 42 30.902 22.598 22.352 1.00 0.00 C ATOM 659 O ARG A 42 31.291 23.629 22.890 1.00 0.00 O ATOM 660 CB ARG A 42 32.451 20.777 22.974 1.00 0.00 C ATOM 661 CG ARG A 42 33.286 19.621 22.417 1.00 0.00 C ATOM 662 CD ARG A 42 33.548 18.645 23.567 1.00 0.00 C ATOM 663 NE ARG A 42 33.375 17.346 22.924 1.00 0.00 N ATOM 664 CZ ARG A 42 33.451 16.074 23.357 1.00 0.00 C ATOM 665 NH1 ARG A 42 33.747 15.749 24.621 1.00 0.00 N ATOM 666 NH2 ARG A 42 33.110 15.058 22.547 1.00 0.00 N ATOM 0 H ARG A 42 33.618 22.864 22.019 1.00 0.00 H new ATOM 0 HA ARG A 42 31.587 20.998 21.018 1.00 0.00 H new ATOM 0 HB2 ARG A 42 33.046 21.373 23.666 1.00 0.00 H new ATOM 0 HB3 ARG A 42 31.600 20.391 23.535 1.00 0.00 H new ATOM 0 HG2 ARG A 42 32.757 19.123 21.605 1.00 0.00 H new ATOM 0 HG3 ARG A 42 34.226 19.990 22.006 1.00 0.00 H new ATOM 0 HD2 ARG A 42 34.550 18.763 23.980 1.00 0.00 H new ATOM 0 HD3 ARG A 42 32.846 18.788 24.389 1.00 0.00 H new ATOM 0 HE ARG A 42 33.147 17.418 21.932 1.00 0.00 H new ATOM 0 HH11 ARG A 42 33.928 16.482 25.307 1.00 0.00 H new ATOM 0 HH12 ARG A 42 33.792 14.768 24.898 1.00 0.00 H new ATOM 0 HH21 ARG A 42 32.791 15.248 21.597 1.00 0.00 H new ATOM 0 HH22 ARG A 42 33.170 14.096 22.882 1.00 0.00 H new ATOM 680 N LEU A 43 29.656 22.124 22.336 1.00 0.00 N ATOM 681 CA LEU A 43 28.493 22.786 22.894 1.00 0.00 C ATOM 682 C LEU A 43 27.784 21.956 23.967 1.00 0.00 C ATOM 683 O LEU A 43 27.414 20.829 23.655 1.00 0.00 O ATOM 684 CB LEU A 43 27.500 23.013 21.746 1.00 0.00 C ATOM 685 CG LEU A 43 27.913 24.100 20.756 1.00 0.00 C ATOM 686 CD1 LEU A 43 26.932 24.068 19.581 1.00 0.00 C ATOM 687 CD2 LEU A 43 28.060 25.518 21.320 1.00 0.00 C ATOM 0 H LEU A 43 29.427 21.225 21.912 1.00 0.00 H new ATOM 0 HA LEU A 43 28.828 23.711 23.363 1.00 0.00 H new ATOM 0 HB2 LEU A 43 27.370 22.076 21.204 1.00 0.00 H new ATOM 0 HB3 LEU A 43 26.530 23.274 22.168 1.00 0.00 H new ATOM 0 HG LEU A 43 28.930 23.860 20.446 1.00 0.00 H new ATOM 0 HD11 LEU A 43 27.205 24.836 18.858 1.00 0.00 H new ATOM 0 HD12 LEU A 43 26.969 23.089 19.102 1.00 0.00 H new ATOM 0 HD13 LEU A 43 25.922 24.255 19.945 1.00 0.00 H new ATOM 0 HD21 LEU A 43 28.356 26.198 20.522 1.00 0.00 H new ATOM 0 HD22 LEU A 43 27.108 25.843 21.739 1.00 0.00 H new ATOM 0 HD23 LEU A 43 28.821 25.522 22.101 1.00 0.00 H new ATOM 699 N ILE A 44 27.842 22.380 25.226 1.00 0.00 N ATOM 700 CA ILE A 44 27.060 21.690 26.229 1.00 0.00 C ATOM 701 C ILE A 44 25.715 22.393 26.419 1.00 0.00 C ATOM 702 O ILE A 44 25.520 23.590 26.249 1.00 0.00 O ATOM 703 CB ILE A 44 27.893 21.434 27.480 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.125 20.564 27.241 1.00 0.00 C ATOM 705 CG2 ILE A 44 27.047 20.814 28.598 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.112 20.324 28.385 1.00 0.00 C ATOM 0 H ILE A 44 28.400 23.166 25.561 1.00 0.00 H new ATOM 0 HA ILE A 44 26.789 20.687 25.901 1.00 0.00 H new ATOM 0 HB ILE A 44 28.249 22.419 27.783 1.00 0.00 H new ATOM 0 HG12 ILE A 44 28.775 19.589 26.902 1.00 0.00 H new ATOM 0 HG13 ILE A 44 29.683 21.007 26.416 1.00 0.00 H new ATOM 0 HG21 ILE A 44 27.671 20.644 29.475 1.00 0.00 H new ATOM 0 HG22 ILE A 44 26.234 21.492 28.857 1.00 0.00 H new ATOM 0 HG23 ILE A 44 26.634 19.865 28.258 1.00 0.00 H new ATOM 0 HD11 ILE A 44 30.924 19.685 28.037 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.519 21.278 28.721 1.00 0.00 H new ATOM 0 HD13 ILE A 44 29.597 19.837 29.214 1.00 0.00 H new ATOM 718 N PHE A 45 24.767 21.510 26.742 1.00 0.00 N ATOM 719 CA PHE A 45 23.412 21.828 27.132 1.00 0.00 C ATOM 720 C PHE A 45 23.317 21.061 28.455 1.00 0.00 C ATOM 721 O PHE A 45 23.379 19.837 28.479 1.00 0.00 O ATOM 722 CB PHE A 45 22.379 21.384 26.097 1.00 0.00 C ATOM 723 CG PHE A 45 20.955 21.771 26.426 1.00 0.00 C ATOM 724 CD1 PHE A 45 20.140 20.914 27.184 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.365 22.767 25.642 1.00 0.00 C ATOM 726 CE1 PHE A 45 18.760 21.113 27.289 1.00 0.00 C ATOM 727 CE2 PHE A 45 18.975 22.939 25.717 1.00 0.00 C ATOM 728 CZ PHE A 45 18.206 22.202 26.621 1.00 0.00 C ATOM 0 H PHE A 45 24.944 20.505 26.735 1.00 0.00 H new ATOM 0 HA PHE A 45 23.202 22.894 27.220 1.00 0.00 H new ATOM 0 HB2 PHE A 45 22.644 21.812 25.131 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.432 20.300 25.991 1.00 0.00 H new ATOM 0 HD1 PHE A 45 20.591 20.079 27.699 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.965 23.389 24.994 1.00 0.00 H new ATOM 0 HE1 PHE A 45 18.143 20.443 27.870 1.00 0.00 H new ATOM 0 HE2 PHE A 45 18.492 23.652 25.066 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.178 22.478 26.802 1.00 0.00 H new ATOM 738 N ALA A 46 23.323 21.836 29.536 1.00 0.00 N ATOM 739 CA ALA A 46 23.220 21.319 30.887 1.00 0.00 C ATOM 740 C ALA A 46 24.632 20.759 31.121 1.00 0.00 C ATOM 741 O ALA A 46 25.571 21.505 31.399 1.00 0.00 O ATOM 742 CB ALA A 46 22.072 20.353 31.185 1.00 0.00 C ATOM 0 H ALA A 46 23.401 22.852 29.492 1.00 0.00 H new ATOM 0 HA ALA A 46 22.930 22.094 31.596 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.116 20.047 32.230 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.120 20.848 30.992 1.00 0.00 H new ATOM 0 HB3 ALA A 46 22.160 19.475 30.546 1.00 0.00 H new ATOM 748 N GLY A 47 24.737 19.433 31.062 1.00 0.00 N ATOM 749 CA GLY A 47 25.922 18.601 31.110 1.00 0.00 C ATOM 750 C GLY A 47 25.994 17.609 29.949 1.00 0.00 C ATOM 751 O GLY A 47 26.938 16.828 29.849 1.00 0.00 O ATOM 0 H GLY A 47 23.898 18.860 30.969 1.00 0.00 H new ATOM 0 HA2 GLY A 47 26.808 19.236 31.095 1.00 0.00 H new ATOM 0 HA3 GLY A 47 25.938 18.053 32.052 1.00 0.00 H new ATOM 755 N LYS A 48 25.128 17.687 28.949 1.00 0.00 N ATOM 756 CA LYS A 48 25.020 16.990 27.673 1.00 0.00 C ATOM 757 C LYS A 48 25.848 17.661 26.582 1.00 0.00 C ATOM 758 O LYS A 48 25.426 18.594 25.891 1.00 0.00 O ATOM 759 CB LYS A 48 23.548 16.846 27.275 1.00 0.00 C ATOM 760 CG LYS A 48 22.813 15.689 27.952 1.00 0.00 C ATOM 761 CD LYS A 48 21.292 15.771 28.052 1.00 0.00 C ATOM 762 CE LYS A 48 20.905 16.782 29.149 1.00 0.00 C ATOM 763 NZ LYS A 48 19.445 16.818 29.271 1.00 0.00 N ATOM 0 H LYS A 48 24.359 18.352 29.031 1.00 0.00 H new ATOM 0 HA LYS A 48 25.437 15.990 27.794 1.00 0.00 H new ATOM 0 HB2 LYS A 48 23.030 17.775 27.511 1.00 0.00 H new ATOM 0 HB3 LYS A 48 23.489 16.713 26.195 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.064 14.774 27.416 1.00 0.00 H new ATOM 0 HG3 LYS A 48 23.210 15.586 28.962 1.00 0.00 H new ATOM 0 HD2 LYS A 48 20.870 16.077 27.095 1.00 0.00 H new ATOM 0 HD3 LYS A 48 20.878 14.790 28.284 1.00 0.00 H new ATOM 0 HE2 LYS A 48 21.355 16.497 30.100 1.00 0.00 H new ATOM 0 HE3 LYS A 48 21.287 17.772 28.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 19.175 17.498 30.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 19.028 17.108 28.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 19.095 15.873 29.526 1.00 0.00 H new ATOM 777 N GLN A 49 26.966 17.023 26.252 1.00 0.00 N ATOM 778 CA GLN A 49 27.680 17.184 25.007 1.00 0.00 C ATOM 779 C GLN A 49 26.912 16.682 23.776 1.00 0.00 C ATOM 780 O GLN A 49 26.388 15.582 23.896 1.00 0.00 O ATOM 781 CB GLN A 49 29.060 16.573 25.220 1.00 0.00 C ATOM 782 CG GLN A 49 29.661 15.572 24.224 1.00 0.00 C ATOM 783 CD GLN A 49 30.064 16.197 22.899 1.00 0.00 C ATOM 784 OE1 GLN A 49 30.279 17.374 22.651 1.00 0.00 O ATOM 785 NE2 GLN A 49 30.003 15.314 21.908 1.00 0.00 N ATOM 0 H GLN A 49 27.412 16.352 26.878 1.00 0.00 H new ATOM 0 HA GLN A 49 27.792 18.239 24.756 1.00 0.00 H new ATOM 0 HB2 GLN A 49 29.764 17.402 25.298 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.040 16.079 26.191 1.00 0.00 H new ATOM 0 HG2 GLN A 49 30.536 15.104 24.676 1.00 0.00 H new ATOM 0 HG3 GLN A 49 28.936 14.780 24.037 1.00 0.00 H new ATOM 0 HE21 GLN A 49 29.824 14.331 22.111 1.00 0.00 H new ATOM 0 HE22 GLN A 49 30.135 15.619 20.944 1.00 0.00 H new ATOM 794 N LEU A 50 26.894 17.478 22.712 1.00 0.00 N ATOM 795 CA LEU A 50 25.991 17.419 21.582 1.00 0.00 C ATOM 796 C LEU A 50 26.742 16.877 20.354 1.00 0.00 C ATOM 797 O LEU A 50 27.637 17.518 19.819 1.00 0.00 O ATOM 798 CB LEU A 50 25.414 18.820 21.385 1.00 0.00 C ATOM 799 CG LEU A 50 24.561 19.419 22.510 1.00 0.00 C ATOM 800 CD1 LEU A 50 23.993 20.794 22.145 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.451 18.470 22.980 1.00 0.00 C ATOM 0 H LEU A 50 27.566 18.239 22.616 1.00 0.00 H new ATOM 0 HA LEU A 50 25.160 16.734 21.748 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.246 19.500 21.201 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.808 18.806 20.479 1.00 0.00 H new ATOM 0 HG LEU A 50 25.241 19.560 23.350 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.397 21.174 22.975 1.00 0.00 H new ATOM 0 HD12 LEU A 50 24.812 21.484 21.941 1.00 0.00 H new ATOM 0 HD13 LEU A 50 23.365 20.705 21.259 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.879 18.945 23.777 1.00 0.00 H new ATOM 0 HD22 LEU A 50 22.789 18.242 22.144 1.00 0.00 H new ATOM 0 HD23 LEU A 50 23.895 17.547 23.353 1.00 0.00 H new ATOM 813 N GLU A 51 26.364 15.667 19.954 1.00 0.00 N ATOM 814 CA GLU A 51 26.787 14.868 18.828 1.00 0.00 C ATOM 815 C GLU A 51 26.340 15.479 17.489 1.00 0.00 C ATOM 816 O GLU A 51 25.170 15.710 17.197 1.00 0.00 O ATOM 817 CB GLU A 51 26.365 13.432 19.155 1.00 0.00 C ATOM 818 CG GLU A 51 26.980 12.866 20.431 1.00 0.00 C ATOM 819 CD GLU A 51 28.444 12.446 20.400 1.00 0.00 C ATOM 820 OE1 GLU A 51 28.914 11.791 19.445 1.00 0.00 O ATOM 821 OE2 GLU A 51 29.186 12.858 21.313 1.00 0.00 O ATOM 0 H GLU A 51 25.658 15.165 20.492 1.00 0.00 H new ATOM 0 HA GLU A 51 27.866 14.851 18.674 1.00 0.00 H new ATOM 0 HB2 GLU A 51 25.279 13.397 19.244 1.00 0.00 H new ATOM 0 HB3 GLU A 51 26.637 12.788 18.319 1.00 0.00 H new ATOM 0 HG2 GLU A 51 26.865 13.613 21.216 1.00 0.00 H new ATOM 0 HG3 GLU A 51 26.391 11.998 20.728 1.00 0.00 H new ATOM 828 N ASP A 52 27.343 15.712 16.654 1.00 0.00 N ATOM 829 CA ASP A 52 27.403 16.648 15.548 1.00 0.00 C ATOM 830 C ASP A 52 26.329 16.602 14.458 1.00 0.00 C ATOM 831 O ASP A 52 26.136 17.495 13.643 1.00 0.00 O ATOM 832 CB ASP A 52 28.753 16.524 14.840 1.00 0.00 C ATOM 833 CG ASP A 52 29.956 16.997 15.650 1.00 0.00 C ATOM 834 OD1 ASP A 52 30.112 16.725 16.859 1.00 0.00 O ATOM 835 OD2 ASP A 52 30.820 17.710 15.088 1.00 0.00 O ATOM 0 H ASP A 52 28.219 15.198 16.746 1.00 0.00 H new ATOM 0 HA ASP A 52 27.228 17.593 16.063 1.00 0.00 H new ATOM 0 HB2 ASP A 52 28.907 15.480 14.566 1.00 0.00 H new ATOM 0 HB3 ASP A 52 28.713 17.095 13.912 1.00 0.00 H new ATOM 840 N GLY A 53 25.607 15.484 14.372 1.00 0.00 N ATOM 841 CA GLY A 53 24.608 15.197 13.362 1.00 0.00 C ATOM 842 C GLY A 53 23.123 15.383 13.695 1.00 0.00 C ATOM 843 O GLY A 53 22.276 15.059 12.875 1.00 0.00 O ATOM 0 H GLY A 53 25.714 14.722 15.041 1.00 0.00 H new ATOM 0 HA2 GLY A 53 24.829 15.822 12.497 1.00 0.00 H new ATOM 0 HA3 GLY A 53 24.746 14.161 13.051 1.00 0.00 H new ATOM 847 N ARG A 54 22.800 15.782 14.920 1.00 0.00 N ATOM 848 CA ARG A 54 21.457 15.892 15.481 1.00 0.00 C ATOM 849 C ARG A 54 20.835 17.276 15.328 1.00 0.00 C ATOM 850 O ARG A 54 21.604 18.190 15.030 1.00 0.00 O ATOM 851 CB ARG A 54 21.601 15.541 16.957 1.00 0.00 C ATOM 852 CG ARG A 54 22.175 14.165 17.291 1.00 0.00 C ATOM 853 CD ARG A 54 21.177 13.043 17.024 1.00 0.00 C ATOM 854 NE ARG A 54 21.764 11.755 17.392 1.00 0.00 N ATOM 855 CZ ARG A 54 21.366 10.557 16.957 1.00 0.00 C ATOM 856 NH1 ARG A 54 20.292 10.469 16.155 1.00 0.00 N ATOM 857 NH2 ARG A 54 22.116 9.505 17.312 1.00 0.00 N ATOM 0 H ARG A 54 23.516 16.055 15.593 1.00 0.00 H new ATOM 0 HA ARG A 54 20.784 15.224 14.944 1.00 0.00 H new ATOM 0 HB2 ARG A 54 22.235 16.295 17.424 1.00 0.00 H new ATOM 0 HB3 ARG A 54 20.618 15.619 17.421 1.00 0.00 H new ATOM 0 HG2 ARG A 54 23.075 13.996 16.700 1.00 0.00 H new ATOM 0 HG3 ARG A 54 22.472 14.142 18.339 1.00 0.00 H new ATOM 0 HD2 ARG A 54 20.264 13.213 17.595 1.00 0.00 H new ATOM 0 HD3 ARG A 54 20.897 13.037 15.971 1.00 0.00 H new ATOM 0 HE ARG A 54 22.550 11.774 18.041 1.00 0.00 H new ATOM 0 HH11 ARG A 54 19.788 11.313 15.883 1.00 0.00 H new ATOM 0 HH12 ARG A 54 19.981 9.558 15.818 1.00 0.00 H new ATOM 0 HH21 ARG A 54 22.947 9.642 17.888 1.00 0.00 H new ATOM 0 HH22 ARG A 54 21.856 8.567 17.006 1.00 0.00 H new ATOM 871 N THR A 55 19.531 17.423 15.555 1.00 0.00 N ATOM 872 CA THR A 55 18.909 18.728 15.444 1.00 0.00 C ATOM 873 C THR A 55 18.509 19.238 16.826 1.00 0.00 C ATOM 874 O THR A 55 18.609 18.516 17.813 1.00 0.00 O ATOM 875 CB THR A 55 17.729 18.558 14.497 1.00 0.00 C ATOM 876 OG1 THR A 55 16.688 17.745 15.024 1.00 0.00 O ATOM 877 CG2 THR A 55 18.122 17.977 13.144 1.00 0.00 C ATOM 0 H THR A 55 18.899 16.665 15.812 1.00 0.00 H new ATOM 0 HA THR A 55 19.586 19.482 15.043 1.00 0.00 H new ATOM 0 HB THR A 55 17.364 19.577 14.370 1.00 0.00 H new ATOM 0 HG1 THR A 55 16.905 16.800 14.879 1.00 0.00 H new ATOM 0 HG21 THR A 55 17.235 17.882 12.517 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.840 18.638 12.659 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.572 16.995 13.287 1.00 0.00 H new ATOM 885 N LEU A 56 18.185 20.525 16.931 1.00 0.00 N ATOM 886 CA LEU A 56 17.545 21.138 18.075 1.00 0.00 C ATOM 887 C LEU A 56 16.160 20.521 18.308 1.00 0.00 C ATOM 888 O LEU A 56 15.750 20.363 19.462 1.00 0.00 O ATOM 889 CB LEU A 56 17.338 22.641 17.887 1.00 0.00 C ATOM 890 CG LEU A 56 18.375 23.460 17.139 1.00 0.00 C ATOM 891 CD1 LEU A 56 18.022 24.950 17.270 1.00 0.00 C ATOM 892 CD2 LEU A 56 19.820 23.155 17.551 1.00 0.00 C ATOM 0 H LEU A 56 18.373 21.192 16.183 1.00 0.00 H new ATOM 0 HA LEU A 56 18.208 20.963 18.922 1.00 0.00 H new ATOM 0 HB2 LEU A 56 16.386 22.776 17.374 1.00 0.00 H new ATOM 0 HB3 LEU A 56 17.231 23.081 18.879 1.00 0.00 H new ATOM 0 HG LEU A 56 18.338 23.173 16.088 1.00 0.00 H new ATOM 0 HD11 LEU A 56 18.761 25.547 16.736 1.00 0.00 H new ATOM 0 HD12 LEU A 56 17.035 25.129 16.844 1.00 0.00 H new ATOM 0 HD13 LEU A 56 18.020 25.232 18.323 1.00 0.00 H new ATOM 0 HD21 LEU A 56 20.502 23.779 16.974 1.00 0.00 H new ATOM 0 HD22 LEU A 56 19.948 23.365 18.613 1.00 0.00 H new ATOM 0 HD23 LEU A 56 20.039 22.104 17.360 1.00 0.00 H new ATOM 904 N SER A 57 15.377 20.122 17.315 1.00 0.00 N ATOM 905 CA SER A 57 14.284 19.199 17.496 1.00 0.00 C ATOM 906 C SER A 57 14.581 17.863 18.180 1.00 0.00 C ATOM 907 O SER A 57 13.847 17.485 19.083 1.00 0.00 O ATOM 908 CB SER A 57 13.518 18.980 16.195 1.00 0.00 C ATOM 909 OG SER A 57 12.302 18.300 16.419 1.00 0.00 O ATOM 0 H SER A 57 15.491 20.439 16.352 1.00 0.00 H new ATOM 0 HA SER A 57 13.664 19.718 18.228 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.317 19.942 15.724 1.00 0.00 H new ATOM 0 HB3 SER A 57 14.134 18.408 15.501 1.00 0.00 H new ATOM 0 HG SER A 57 11.834 18.177 15.567 1.00 0.00 H new ATOM 915 N ASP A 58 15.716 17.277 17.816 1.00 0.00 N ATOM 916 CA ASP A 58 16.053 15.990 18.387 1.00 0.00 C ATOM 917 C ASP A 58 16.555 16.055 19.830 1.00 0.00 C ATOM 918 O ASP A 58 16.152 15.117 20.520 1.00 0.00 O ATOM 919 CB ASP A 58 17.164 15.244 17.634 1.00 0.00 C ATOM 920 CG ASP A 58 16.989 14.753 16.201 1.00 0.00 C ATOM 921 OD1 ASP A 58 16.256 13.778 15.917 1.00 0.00 O ATOM 922 OD2 ASP A 58 17.668 15.440 15.417 1.00 0.00 O ATOM 0 H ASP A 58 16.392 17.658 17.154 1.00 0.00 H new ATOM 0 HA ASP A 58 15.097 15.470 18.318 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.037 15.897 17.637 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.418 14.371 18.235 1.00 0.00 H new ATOM 927 N TYR A 59 17.392 16.997 20.241 1.00 0.00 N ATOM 928 CA TYR A 59 17.977 17.019 21.567 1.00 0.00 C ATOM 929 C TYR A 59 16.982 17.748 22.478 1.00 0.00 C ATOM 930 O TYR A 59 17.092 17.673 23.703 1.00 0.00 O ATOM 931 CB TYR A 59 19.280 17.805 21.467 1.00 0.00 C ATOM 932 CG TYR A 59 20.497 16.907 21.392 1.00 0.00 C ATOM 933 CD1 TYR A 59 20.792 16.055 22.462 1.00 0.00 C ATOM 934 CD2 TYR A 59 21.288 17.056 20.247 1.00 0.00 C ATOM 935 CE1 TYR A 59 21.970 15.313 22.290 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.502 16.379 20.122 1.00 0.00 C ATOM 937 CZ TYR A 59 22.775 15.476 21.154 1.00 0.00 C ATOM 938 OH TYR A 59 23.903 14.717 21.138 1.00 0.00 O ATOM 0 H TYR A 59 17.686 17.776 19.652 1.00 0.00 H new ATOM 0 HA TYR A 59 18.179 16.023 21.961 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.249 18.443 20.584 1.00 0.00 H new ATOM 0 HB3 TYR A 59 19.371 18.462 22.332 1.00 0.00 H new ATOM 0 HD1 TYR A 59 20.169 15.976 23.341 1.00 0.00 H new ATOM 0 HD2 TYR A 59 20.954 17.704 19.450 1.00 0.00 H new ATOM 0 HE1 TYR A 59 22.263 14.602 23.048 1.00 0.00 H new ATOM 0 HE2 TYR A 59 23.177 16.540 19.294 1.00 0.00 H new ATOM 0 HH TYR A 59 23.712 13.856 20.710 1.00 0.00 H new ATOM 948 N ASN A 60 16.064 18.565 21.960 1.00 0.00 N ATOM 949 CA ASN A 60 15.087 19.285 22.743 1.00 0.00 C ATOM 950 C ASN A 60 15.760 20.535 23.314 1.00 0.00 C ATOM 951 O ASN A 60 15.852 20.795 24.517 1.00 0.00 O ATOM 952 CB ASN A 60 14.261 18.448 23.714 1.00 0.00 C ATOM 953 CG ASN A 60 13.080 19.237 24.255 1.00 0.00 C ATOM 954 OD1 ASN A 60 12.214 19.626 23.463 1.00 0.00 O ATOM 955 ND2 ASN A 60 13.114 19.565 25.544 1.00 0.00 N ATOM 0 H ASN A 60 15.986 18.742 20.958 1.00 0.00 H new ATOM 0 HA ASN A 60 14.280 19.609 22.086 1.00 0.00 H new ATOM 0 HB2 ASN A 60 13.902 17.551 23.210 1.00 0.00 H new ATOM 0 HB3 ASN A 60 14.891 18.119 24.541 1.00 0.00 H new ATOM 0 HD21 ASN A 60 12.395 20.174 25.934 1.00 0.00 H new ATOM 0 HD22 ASN A 60 13.859 19.207 26.142 1.00 0.00 H new ATOM 962 N ILE A 61 16.189 21.382 22.381 1.00 0.00 N ATOM 963 CA ILE A 61 16.815 22.647 22.718 1.00 0.00 C ATOM 964 C ILE A 61 15.726 23.617 22.269 1.00 0.00 C ATOM 965 O ILE A 61 15.396 23.548 21.086 1.00 0.00 O ATOM 966 CB ILE A 61 18.047 22.774 21.813 1.00 0.00 C ATOM 967 CG1 ILE A 61 19.161 21.833 22.266 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.670 24.170 21.819 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.073 21.271 21.164 1.00 0.00 C ATOM 0 H ILE A 61 16.111 21.208 21.379 1.00 0.00 H new ATOM 0 HA ILE A 61 17.131 22.789 23.751 1.00 0.00 H new ATOM 0 HB ILE A 61 17.674 22.535 20.817 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.783 22.363 22.987 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.706 20.994 22.793 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.536 24.185 21.157 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.936 24.898 21.473 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.983 24.424 22.832 1.00 0.00 H new ATOM 0 HD11 ILE A 61 20.823 20.618 21.610 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.475 20.703 20.451 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.569 22.093 20.648 1.00 0.00 H new ATOM 981 N GLN A 62 15.062 24.274 23.205 1.00 0.00 N ATOM 982 CA GLN A 62 13.848 25.056 23.047 1.00 0.00 C ATOM 983 C GLN A 62 14.163 26.555 23.076 1.00 0.00 C ATOM 984 O GLN A 62 15.274 26.975 23.394 1.00 0.00 O ATOM 985 CB GLN A 62 12.847 24.588 24.105 1.00 0.00 C ATOM 986 CG GLN A 62 12.116 23.259 23.901 1.00 0.00 C ATOM 987 CD GLN A 62 11.154 22.878 25.008 1.00 0.00 C ATOM 988 OE1 GLN A 62 10.724 21.725 24.995 1.00 0.00 O ATOM 989 NE2 GLN A 62 10.836 23.775 25.944 1.00 0.00 N ATOM 0 H GLN A 62 15.384 24.274 24.173 1.00 0.00 H new ATOM 0 HA GLN A 62 13.387 24.896 22.072 1.00 0.00 H new ATOM 0 HB2 GLN A 62 13.377 24.529 25.056 1.00 0.00 H new ATOM 0 HB3 GLN A 62 12.091 25.366 24.209 1.00 0.00 H new ATOM 0 HG2 GLN A 62 11.565 23.306 22.962 1.00 0.00 H new ATOM 0 HG3 GLN A 62 12.857 22.467 23.796 1.00 0.00 H new ATOM 0 HE21 GLN A 62 11.225 24.717 25.901 1.00 0.00 H new ATOM 0 HE22 GLN A 62 10.204 23.519 26.702 1.00 0.00 H new ATOM 998 N LYS A 63 13.254 27.426 22.658 1.00 0.00 N ATOM 999 CA LYS A 63 13.403 28.864 22.798 1.00 0.00 C ATOM 1000 C LYS A 63 13.909 29.356 24.155 1.00 0.00 C ATOM 1001 O LYS A 63 13.314 29.005 25.173 1.00 0.00 O ATOM 1002 CB LYS A 63 12.287 29.670 22.132 1.00 0.00 C ATOM 1003 CG LYS A 63 11.128 29.920 23.103 1.00 0.00 C ATOM 1004 CD LYS A 63 9.881 30.338 22.313 1.00 0.00 C ATOM 1005 CE LYS A 63 8.708 30.096 23.258 1.00 0.00 C ATOM 1006 NZ LYS A 63 8.633 31.099 24.337 1.00 0.00 N ATOM 0 H LYS A 63 12.383 27.148 22.207 1.00 0.00 H new ATOM 0 HA LYS A 63 14.270 29.108 22.184 1.00 0.00 H new ATOM 0 HB2 LYS A 63 12.683 30.623 21.781 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.922 29.135 21.256 1.00 0.00 H new ATOM 0 HG2 LYS A 63 10.921 29.018 23.679 1.00 0.00 H new ATOM 0 HG3 LYS A 63 11.398 30.699 23.816 1.00 0.00 H new ATOM 0 HD2 LYS A 63 9.937 31.385 22.015 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.778 29.751 21.400 1.00 0.00 H new ATOM 0 HE2 LYS A 63 7.779 30.110 22.689 1.00 0.00 H new ATOM 0 HE3 LYS A 63 8.798 29.102 23.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 7.820 30.889 24.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 9.507 31.070 24.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 8.519 32.046 23.923 1.00 0.00 H new ATOM 1020 N GLU A 64 14.986 30.133 24.201 1.00 0.00 N ATOM 1021 CA GLU A 64 15.564 30.679 25.406 1.00 0.00 C ATOM 1022 C GLU A 64 16.538 29.823 26.219 1.00 0.00 C ATOM 1023 O GLU A 64 16.878 30.057 27.380 1.00 0.00 O ATOM 1024 CB GLU A 64 14.506 31.470 26.168 1.00 0.00 C ATOM 1025 CG GLU A 64 14.837 32.933 26.413 1.00 0.00 C ATOM 1026 CD GLU A 64 13.633 33.713 26.917 1.00 0.00 C ATOM 1027 OE1 GLU A 64 13.176 33.595 28.069 1.00 0.00 O ATOM 1028 OE2 GLU A 64 13.026 34.499 26.150 1.00 0.00 O ATOM 0 H GLU A 64 15.495 30.406 23.360 1.00 0.00 H new ATOM 0 HA GLU A 64 16.331 31.381 25.077 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.568 31.415 25.616 1.00 0.00 H new ATOM 0 HB3 GLU A 64 14.338 30.987 27.131 1.00 0.00 H new ATOM 0 HG2 GLU A 64 15.646 33.005 27.140 1.00 0.00 H new ATOM 0 HG3 GLU A 64 15.199 33.383 25.488 1.00 0.00 H new ATOM 1035 N SER A 65 16.953 28.679 25.676 1.00 0.00 N ATOM 1036 CA SER A 65 17.973 27.791 26.180 1.00 0.00 C ATOM 1037 C SER A 65 19.357 28.427 26.328 1.00 0.00 C ATOM 1038 O SER A 65 19.696 29.310 25.552 1.00 0.00 O ATOM 1039 CB SER A 65 18.016 26.570 25.271 1.00 0.00 C ATOM 1040 OG SER A 65 16.771 25.927 25.422 1.00 0.00 O ATOM 0 H SER A 65 16.547 28.332 24.807 1.00 0.00 H new ATOM 0 HA SER A 65 17.702 27.516 27.199 1.00 0.00 H new ATOM 0 HB2 SER A 65 18.181 26.862 24.234 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.834 25.906 25.549 1.00 0.00 H new ATOM 0 HG SER A 65 16.164 26.219 24.710 1.00 0.00 H new ATOM 1046 N THR A 66 20.062 27.939 27.347 1.00 0.00 N ATOM 1047 CA THR A 66 21.313 28.511 27.796 1.00 0.00 C ATOM 1048 C THR A 66 22.346 27.383 27.746 1.00 0.00 C ATOM 1049 O THR A 66 22.246 26.375 28.446 1.00 0.00 O ATOM 1050 CB THR A 66 21.094 29.147 29.171 1.00 0.00 C ATOM 1051 OG1 THR A 66 20.820 28.167 30.153 1.00 0.00 O ATOM 1052 CG2 THR A 66 20.091 30.294 29.240 1.00 0.00 C ATOM 0 H THR A 66 19.769 27.124 27.886 1.00 0.00 H new ATOM 0 HA THR A 66 21.688 29.320 27.169 1.00 0.00 H new ATOM 0 HB THR A 66 22.049 29.628 29.385 1.00 0.00 H new ATOM 0 HG1 THR A 66 21.119 27.290 29.833 1.00 0.00 H new ATOM 0 HG21 THR A 66 20.025 30.659 30.265 1.00 0.00 H new ATOM 0 HG22 THR A 66 20.418 31.103 28.587 1.00 0.00 H new ATOM 0 HG23 THR A 66 19.112 29.941 28.917 1.00 0.00 H new ATOM 1060 N LEU A 67 23.287 27.498 26.813 1.00 0.00 N ATOM 1061 CA LEU A 67 24.309 26.540 26.428 1.00 0.00 C ATOM 1062 C LEU A 67 25.677 27.074 26.840 1.00 0.00 C ATOM 1063 O LEU A 67 25.749 28.246 27.190 1.00 0.00 O ATOM 1064 CB LEU A 67 24.243 26.275 24.916 1.00 0.00 C ATOM 1065 CG LEU A 67 23.086 25.411 24.417 1.00 0.00 C ATOM 1066 CD1 LEU A 67 21.877 26.307 24.151 1.00 0.00 C ATOM 1067 CD2 LEU A 67 23.354 24.379 23.309 1.00 0.00 C ATOM 0 H LEU A 67 23.356 28.349 26.255 1.00 0.00 H new ATOM 0 HA LEU A 67 24.138 25.591 26.937 1.00 0.00 H new ATOM 0 HB2 LEU A 67 24.194 27.236 24.405 1.00 0.00 H new ATOM 0 HB3 LEU A 67 25.176 25.800 24.613 1.00 0.00 H new ATOM 0 HG LEU A 67 22.884 24.719 25.235 1.00 0.00 H new ATOM 0 HD11 LEU A 67 21.045 25.699 23.794 1.00 0.00 H new ATOM 0 HD12 LEU A 67 21.588 26.812 25.073 1.00 0.00 H new ATOM 0 HD13 LEU A 67 22.134 27.050 23.396 1.00 0.00 H new ATOM 0 HD21 LEU A 67 22.430 23.852 23.072 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.720 24.889 22.418 1.00 0.00 H new ATOM 0 HD23 LEU A 67 24.102 23.664 23.651 1.00 0.00 H new ATOM 1079 N HIS A 68 26.684 26.219 26.980 1.00 0.00 N ATOM 1080 CA HIS A 68 28.034 26.559 27.362 1.00 0.00 C ATOM 1081 C HIS A 68 28.916 26.068 26.211 1.00 0.00 C ATOM 1082 O HIS A 68 28.619 25.033 25.622 1.00 0.00 O ATOM 1083 CB HIS A 68 28.406 25.951 28.705 1.00 0.00 C ATOM 1084 CG HIS A 68 29.818 26.250 29.144 1.00 0.00 C ATOM 1085 ND1 HIS A 68 30.393 27.517 29.117 1.00 0.00 N ATOM 1086 CD2 HIS A 68 30.623 25.392 29.837 1.00 0.00 C ATOM 1087 CE1 HIS A 68 31.599 27.331 29.651 1.00 0.00 C ATOM 1088 NE2 HIS A 68 31.796 26.077 30.074 1.00 0.00 N ATOM 0 H HIS A 68 26.566 25.219 26.820 1.00 0.00 H new ATOM 0 HA HIS A 68 28.162 27.631 27.511 1.00 0.00 H new ATOM 0 HB2 HIS A 68 27.715 26.320 29.463 1.00 0.00 H new ATOM 0 HB3 HIS A 68 28.274 24.870 28.652 1.00 0.00 H new ATOM 0 HD2 HIS A 68 30.389 24.382 30.138 1.00 0.00 H new ATOM 0 HE1 HIS A 68 32.341 28.111 29.734 1.00 0.00 H new ATOM 0 HE2 HIS A 68 32.648 25.701 30.491 1.00 0.00 H new ATOM 1096 N LEU A 69 29.923 26.856 25.837 1.00 0.00 N ATOM 1097 CA LEU A 69 30.866 26.505 24.796 1.00 0.00 C ATOM 1098 C LEU A 69 32.127 26.109 25.572 1.00 0.00 C ATOM 1099 O LEU A 69 32.539 26.676 26.579 1.00 0.00 O ATOM 1100 CB LEU A 69 31.144 27.797 24.013 1.00 0.00 C ATOM 1101 CG LEU A 69 31.773 27.716 22.629 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.607 29.012 21.845 1.00 0.00 C ATOM 1103 CD2 LEU A 69 33.262 27.363 22.684 1.00 0.00 C ATOM 0 H LEU A 69 30.102 27.767 26.259 1.00 0.00 H new ATOM 0 HA LEU A 69 30.531 25.721 24.116 1.00 0.00 H new ATOM 0 HB2 LEU A 69 30.197 28.327 23.910 1.00 0.00 H new ATOM 0 HB3 LEU A 69 31.792 28.419 24.630 1.00 0.00 H new ATOM 0 HG LEU A 69 31.238 26.916 22.117 1.00 0.00 H new ATOM 0 HD11 LEU A 69 32.071 28.906 20.865 1.00 0.00 H new ATOM 0 HD12 LEU A 69 30.546 29.230 21.722 1.00 0.00 H new ATOM 0 HD13 LEU A 69 32.085 29.829 22.387 1.00 0.00 H new ATOM 0 HD21 LEU A 69 33.663 27.318 21.671 1.00 0.00 H new ATOM 0 HD22 LEU A 69 33.796 28.125 23.252 1.00 0.00 H new ATOM 0 HD23 LEU A 69 33.389 26.395 23.168 1.00 0.00 H new ATOM 1115 N VAL A 70 32.670 24.968 25.160 1.00 0.00 N ATOM 1116 CA VAL A 70 33.903 24.331 25.576 1.00 0.00 C ATOM 1117 C VAL A 70 34.928 24.300 24.433 1.00 0.00 C ATOM 1118 O VAL A 70 34.559 23.850 23.351 1.00 0.00 O ATOM 1119 CB VAL A 70 33.431 23.044 26.260 1.00 0.00 C ATOM 1120 CG1 VAL A 70 34.639 22.175 26.596 1.00 0.00 C ATOM 1121 CG2 VAL A 70 32.429 23.204 27.399 1.00 0.00 C ATOM 0 H VAL A 70 32.200 24.410 24.447 1.00 0.00 H new ATOM 0 HA VAL A 70 34.517 24.857 26.307 1.00 0.00 H new ATOM 0 HB VAL A 70 32.812 22.519 25.533 1.00 0.00 H new ATOM 0 HG11 VAL A 70 34.304 21.259 27.083 1.00 0.00 H new ATOM 0 HG12 VAL A 70 35.173 21.925 25.680 1.00 0.00 H new ATOM 0 HG13 VAL A 70 35.304 22.720 27.266 1.00 0.00 H new ATOM 0 HG21 VAL A 70 32.174 22.223 27.800 1.00 0.00 H new ATOM 0 HG22 VAL A 70 32.869 23.815 28.187 1.00 0.00 H new ATOM 0 HG23 VAL A 70 31.527 23.689 27.025 1.00 0.00 H new ATOM 1131 N LEU A 71 36.161 24.697 24.738 1.00 0.00 N ATOM 1132 CA LEU A 71 37.297 24.503 23.859 1.00 0.00 C ATOM 1133 C LEU A 71 37.945 23.157 24.214 1.00 0.00 C ATOM 1134 O LEU A 71 38.464 23.005 25.313 1.00 0.00 O ATOM 1135 CB LEU A 71 38.254 25.663 24.094 1.00 0.00 C ATOM 1136 CG LEU A 71 37.904 26.974 23.390 1.00 0.00 C ATOM 1137 CD1 LEU A 71 39.061 27.959 23.559 1.00 0.00 C ATOM 1138 CD2 LEU A 71 37.506 26.715 21.930 1.00 0.00 C ATOM 0 H LEU A 71 36.395 25.167 25.613 1.00 0.00 H new ATOM 0 HA LEU A 71 37.014 24.482 22.807 1.00 0.00 H new ATOM 0 HB2 LEU A 71 38.307 25.852 25.166 1.00 0.00 H new ATOM 0 HB3 LEU A 71 39.250 25.357 23.774 1.00 0.00 H new ATOM 0 HG LEU A 71 37.028 27.434 23.848 1.00 0.00 H new ATOM 0 HD11 LEU A 71 38.817 28.896 23.059 1.00 0.00 H new ATOM 0 HD12 LEU A 71 39.227 28.146 24.620 1.00 0.00 H new ATOM 0 HD13 LEU A 71 39.965 27.538 23.119 1.00 0.00 H new ATOM 0 HD21 LEU A 71 37.261 27.661 21.447 1.00 0.00 H new ATOM 0 HD22 LEU A 71 38.337 26.244 21.405 1.00 0.00 H new ATOM 0 HD23 LEU A 71 36.638 26.057 21.901 1.00 0.00 H new