USER MOD reduce.3.24.130724 H: found=0, std=0, add=659, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 660 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 41 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 111 GLN : amide:sc= -13.3! C(o=-24!,f=-35!) USER MOD Set 1.3: A 113 MET CE :methyl -144:sc= -11.2! (180deg=-14.4!) USER MOD Set 2.1: A 83 MET CE :methyl -129:sc= -11.1! (180deg=-15.1!) USER MOD Set 2.2: A 110 LYS NZ :NH3+ -139:sc= 0 (180deg=0) USER MOD Set 3.1: A 43 TYR OH : rot -25:sc= -0.419 USER MOD Set 3.2: A 75 CYS SG : rot 38:sc= -1.59 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= -3.61 X(o=-3.6,f=-3.7!) USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -159:sc= -0.339 (180deg=-1.72!) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 81:sc= 0.455 USER MOD Single : A 63 ASN : amide:sc= -0.295 K(o=-0.29,f=-4.3!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 MET CE :methyl -150:sc= -6.18! (180deg=-7.26!) USER MOD Single : A 74 ASN : amide:sc=-0.00537 K(o=-0.0054,f=-1.4!) USER MOD Single : A 79 THR OG1 : rot 75:sc= -1.11! USER MOD Single : A 80 TYR OH : rot -14:sc= -7.8! USER MOD Single : A 82 LYS NZ :NH3+ -137:sc= 0 (180deg=-0.0406) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 94 ASN : amide:sc= -0.543 K(o=-0.54,f=-5.5!) USER MOD Single : A 96 THR OG1 : rot -92:sc= 0.561 USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 100 SER OG : rot -60:sc= 0.639 USER MOD Single : A 102 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= -2.32! K(o=-2.3!,f=-0.94) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot 68:sc= 1.13 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 35 21.979 22.392 28.692 1.00 0.00 N ATOM 2 CA ALA A 35 22.038 22.490 27.207 1.00 0.00 C ATOM 3 C ALA A 35 21.500 23.853 26.763 1.00 0.00 C ATOM 4 O ALA A 35 20.535 23.940 26.031 1.00 0.00 O ATOM 5 CB ALA A 35 21.186 21.379 26.588 1.00 0.00 C ATOM 0 HA ALA A 35 23.071 22.382 26.877 1.00 0.00 H new ATOM 0 HB1 ALA A 35 21.229 21.450 25.501 1.00 0.00 H new ATOM 0 HB2 ALA A 35 21.569 20.408 26.903 1.00 0.00 H new ATOM 0 HB3 ALA A 35 20.153 21.486 26.918 1.00 0.00 H new ATOM 11 N PRO A 36 22.144 24.937 27.220 1.00 0.00 N ATOM 12 CA PRO A 36 21.738 26.306 26.876 1.00 0.00 C ATOM 13 C PRO A 36 22.013 26.626 25.403 1.00 0.00 C ATOM 14 O PRO A 36 21.598 27.648 24.893 1.00 0.00 O ATOM 15 CB PRO A 36 22.617 27.176 27.775 1.00 0.00 C ATOM 16 CG PRO A 36 23.813 26.332 28.062 1.00 0.00 C ATOM 17 CD PRO A 36 23.320 24.913 28.108 1.00 0.00 C ATOM 0 HA PRO A 36 20.669 26.466 27.020 1.00 0.00 H new ATOM 0 HB2 PRO A 36 22.897 28.104 27.277 1.00 0.00 H new ATOM 0 HB3 PRO A 36 22.096 27.451 28.692 1.00 0.00 H new ATOM 0 HG2 PRO A 36 24.572 26.456 27.290 1.00 0.00 H new ATOM 0 HG3 PRO A 36 24.272 26.616 29.009 1.00 0.00 H new ATOM 0 HD2 PRO A 36 24.077 24.212 27.756 1.00 0.00 H new ATOM 0 HD3 PRO A 36 23.054 24.612 29.121 1.00 0.00 H new ATOM 25 N ARG A 37 22.710 25.762 24.718 1.00 0.00 N ATOM 26 CA ARG A 37 23.011 26.020 23.282 1.00 0.00 C ATOM 27 C ARG A 37 22.472 24.867 22.431 1.00 0.00 C ATOM 28 O ARG A 37 22.565 23.713 22.801 1.00 0.00 O ATOM 29 CB ARG A 37 24.525 26.130 23.089 1.00 0.00 C ATOM 30 CG ARG A 37 25.044 27.358 23.840 1.00 0.00 C ATOM 31 CD ARG A 37 26.532 27.550 23.536 1.00 0.00 C ATOM 32 NE ARG A 37 27.091 28.596 24.437 1.00 0.00 N ATOM 33 CZ ARG A 37 28.079 29.346 24.032 1.00 0.00 C ATOM 34 NH1 ARG A 37 29.303 28.893 24.074 1.00 0.00 N ATOM 35 NH2 ARG A 37 27.845 30.550 23.586 1.00 0.00 N ATOM 0 H ARG A 37 23.084 24.889 25.090 1.00 0.00 H new ATOM 0 HA ARG A 37 22.536 26.952 22.974 1.00 0.00 H new ATOM 0 HB2 ARG A 37 25.016 25.230 23.458 1.00 0.00 H new ATOM 0 HB3 ARG A 37 24.763 26.211 22.028 1.00 0.00 H new ATOM 0 HG2 ARG A 37 24.484 28.244 23.542 1.00 0.00 H new ATOM 0 HG3 ARG A 37 24.894 27.232 24.912 1.00 0.00 H new ATOM 0 HD2 ARG A 37 27.067 26.611 23.676 1.00 0.00 H new ATOM 0 HD3 ARG A 37 26.667 27.842 22.494 1.00 0.00 H new ATOM 0 HE ARG A 37 26.701 28.726 25.371 1.00 0.00 H new ATOM 0 HH11 ARG A 37 29.487 27.953 24.423 1.00 0.00 H new ATOM 0 HH12 ARG A 37 30.075 29.480 23.757 1.00 0.00 H new ATOM 0 HH21 ARG A 37 26.889 30.905 23.554 1.00 0.00 H new ATOM 0 HH22 ARG A 37 28.618 31.136 23.270 1.00 0.00 H new ATOM 49 N LYS A 38 21.910 25.170 21.293 1.00 0.00 N ATOM 50 CA LYS A 38 21.367 24.092 20.419 1.00 0.00 C ATOM 51 C LYS A 38 22.219 23.987 19.151 1.00 0.00 C ATOM 52 O LYS A 38 23.325 24.486 19.095 1.00 0.00 O ATOM 53 CB LYS A 38 19.922 24.422 20.039 1.00 0.00 C ATOM 54 CG LYS A 38 19.122 24.735 21.305 1.00 0.00 C ATOM 55 CD LYS A 38 17.630 24.778 20.967 1.00 0.00 C ATOM 56 CE LYS A 38 16.827 25.045 22.243 1.00 0.00 C ATOM 57 NZ LYS A 38 16.129 26.355 22.124 1.00 0.00 N ATOM 0 H LYS A 38 21.803 26.117 20.931 1.00 0.00 H new ATOM 0 HA LYS A 38 21.393 23.142 20.953 1.00 0.00 H new ATOM 0 HB2 LYS A 38 19.899 25.275 19.361 1.00 0.00 H new ATOM 0 HB3 LYS A 38 19.473 23.582 19.510 1.00 0.00 H new ATOM 0 HG2 LYS A 38 19.312 23.977 22.065 1.00 0.00 H new ATOM 0 HG3 LYS A 38 19.439 25.691 21.722 1.00 0.00 H new ATOM 0 HD2 LYS A 38 17.435 25.558 20.231 1.00 0.00 H new ATOM 0 HD3 LYS A 38 17.320 23.834 20.520 1.00 0.00 H new ATOM 0 HE2 LYS A 38 16.102 24.247 22.403 1.00 0.00 H new ATOM 0 HE3 LYS A 38 17.490 25.051 23.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 15.583 26.537 22.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 16.830 27.111 21.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 15.485 26.332 21.308 1.00 0.00 H new ATOM 71 N GLY A 39 21.713 23.346 18.134 1.00 0.00 N ATOM 72 CA GLY A 39 22.499 23.216 16.873 1.00 0.00 C ATOM 73 C GLY A 39 21.659 22.489 15.818 1.00 0.00 C ATOM 74 O GLY A 39 20.552 22.064 16.077 1.00 0.00 O ATOM 0 H GLY A 39 20.792 22.907 18.120 1.00 0.00 H new ATOM 0 HA2 GLY A 39 22.786 24.202 16.508 1.00 0.00 H new ATOM 0 HA3 GLY A 39 23.421 22.665 17.062 1.00 0.00 H new ATOM 78 N ASN A 40 22.176 22.341 14.628 1.00 0.00 N ATOM 79 CA ASN A 40 21.408 21.638 13.561 1.00 0.00 C ATOM 80 C ASN A 40 22.382 21.062 12.531 1.00 0.00 C ATOM 81 O ASN A 40 23.015 21.787 11.790 1.00 0.00 O ATOM 82 CB ASN A 40 20.461 22.625 12.876 1.00 0.00 C ATOM 83 CG ASN A 40 19.396 21.850 12.096 1.00 0.00 C ATOM 84 OD1 ASN A 40 19.153 20.691 12.366 1.00 0.00 O ATOM 85 ND2 ASN A 40 18.749 22.446 11.134 1.00 0.00 N ATOM 0 H ASN A 40 23.098 22.677 14.349 1.00 0.00 H new ATOM 0 HA ASN A 40 20.826 20.829 14.004 1.00 0.00 H new ATOM 0 HB2 ASN A 40 19.988 23.267 13.619 1.00 0.00 H new ATOM 0 HB3 ASN A 40 21.020 23.275 12.203 1.00 0.00 H new ATOM 0 HD21 ASN A 40 18.038 21.939 10.607 1.00 0.00 H new ATOM 0 HD22 ASN A 40 18.954 23.419 10.908 1.00 0.00 H new ATOM 92 N THR A 41 22.512 19.765 12.483 1.00 0.00 N ATOM 93 CA THR A 41 23.451 19.145 11.505 1.00 0.00 C ATOM 94 C THR A 41 22.854 19.211 10.099 1.00 0.00 C ATOM 95 O THR A 41 21.687 18.945 9.896 1.00 0.00 O ATOM 96 CB THR A 41 23.692 17.683 11.889 1.00 0.00 C ATOM 97 OG1 THR A 41 24.140 17.616 13.236 1.00 0.00 O ATOM 98 CG2 THR A 41 24.753 17.081 10.966 1.00 0.00 C ATOM 0 H THR A 41 22.009 19.107 13.079 1.00 0.00 H new ATOM 0 HA THR A 41 24.396 19.688 11.519 1.00 0.00 H new ATOM 0 HB THR A 41 22.763 17.122 11.787 1.00 0.00 H new ATOM 0 HG1 THR A 41 24.293 16.680 13.484 1.00 0.00 H new ATOM 0 HG21 THR A 41 24.925 16.040 11.239 1.00 0.00 H new ATOM 0 HG22 THR A 41 24.409 17.133 9.933 1.00 0.00 H new ATOM 0 HG23 THR A 41 25.683 17.641 11.067 1.00 0.00 H new ATOM 106 N LEU A 42 23.651 19.560 9.125 1.00 0.00 N ATOM 107 CA LEU A 42 23.135 19.641 7.729 1.00 0.00 C ATOM 108 C LEU A 42 23.908 18.660 6.846 1.00 0.00 C ATOM 109 O LEU A 42 25.018 18.274 7.157 1.00 0.00 O ATOM 110 CB LEU A 42 23.325 21.063 7.196 1.00 0.00 C ATOM 111 CG LEU A 42 22.952 22.069 8.284 1.00 0.00 C ATOM 112 CD1 LEU A 42 23.116 23.490 7.744 1.00 0.00 C ATOM 113 CD2 LEU A 42 21.499 21.848 8.707 1.00 0.00 C ATOM 0 H LEU A 42 24.638 19.793 9.236 1.00 0.00 H new ATOM 0 HA LEU A 42 22.075 19.387 7.717 1.00 0.00 H new ATOM 0 HB2 LEU A 42 24.360 21.212 6.887 1.00 0.00 H new ATOM 0 HB3 LEU A 42 22.704 21.218 6.314 1.00 0.00 H new ATOM 0 HG LEU A 42 23.606 21.931 9.145 1.00 0.00 H new ATOM 0 HD11 LEU A 42 22.850 24.207 8.520 1.00 0.00 H new ATOM 0 HD12 LEU A 42 24.152 23.648 7.444 1.00 0.00 H new ATOM 0 HD13 LEU A 42 22.463 23.629 6.882 1.00 0.00 H new ATOM 0 HD21 LEU A 42 21.233 22.566 9.483 1.00 0.00 H new ATOM 0 HD22 LEU A 42 20.845 21.985 7.846 1.00 0.00 H new ATOM 0 HD23 LEU A 42 21.383 20.836 9.094 1.00 0.00 H new ATOM 125 N TYR A 43 23.333 18.254 5.747 1.00 0.00 N ATOM 126 CA TYR A 43 24.038 17.298 4.848 1.00 0.00 C ATOM 127 C TYR A 43 24.354 17.987 3.519 1.00 0.00 C ATOM 128 O TYR A 43 23.472 18.457 2.828 1.00 0.00 O ATOM 129 CB TYR A 43 23.144 16.084 4.593 1.00 0.00 C ATOM 130 CG TYR A 43 23.897 15.072 3.762 1.00 0.00 C ATOM 131 CD1 TYR A 43 24.731 14.137 4.385 1.00 0.00 C ATOM 132 CD2 TYR A 43 23.762 15.071 2.369 1.00 0.00 C ATOM 133 CE1 TYR A 43 25.430 13.199 3.615 1.00 0.00 C ATOM 134 CE2 TYR A 43 24.460 14.132 1.598 1.00 0.00 C ATOM 135 CZ TYR A 43 25.295 13.197 2.223 1.00 0.00 C ATOM 136 OH TYR A 43 25.984 12.273 1.463 1.00 0.00 O ATOM 0 H TYR A 43 22.406 18.543 5.433 1.00 0.00 H new ATOM 0 HA TYR A 43 24.966 16.973 5.319 1.00 0.00 H new ATOM 0 HB2 TYR A 43 22.838 15.638 5.540 1.00 0.00 H new ATOM 0 HB3 TYR A 43 22.234 16.390 4.077 1.00 0.00 H new ATOM 0 HD1 TYR A 43 24.836 14.139 5.460 1.00 0.00 H new ATOM 0 HD2 TYR A 43 23.120 15.794 1.888 1.00 0.00 H new ATOM 0 HE1 TYR A 43 26.073 12.477 4.096 1.00 0.00 H new ATOM 0 HE2 TYR A 43 24.354 14.129 0.523 1.00 0.00 H new ATOM 0 HH TYR A 43 26.783 11.980 1.949 1.00 0.00 H new ATOM 146 N VAL A 44 25.606 18.052 3.158 1.00 0.00 N ATOM 147 CA VAL A 44 25.977 18.710 1.873 1.00 0.00 C ATOM 148 C VAL A 44 26.592 17.673 0.931 1.00 0.00 C ATOM 149 O VAL A 44 27.405 16.864 1.328 1.00 0.00 O ATOM 150 CB VAL A 44 26.994 19.820 2.145 1.00 0.00 C ATOM 151 CG1 VAL A 44 27.318 20.546 0.838 1.00 0.00 C ATOM 152 CG2 VAL A 44 26.407 20.814 3.149 1.00 0.00 C ATOM 0 H VAL A 44 26.388 17.678 3.696 1.00 0.00 H new ATOM 0 HA VAL A 44 25.087 19.138 1.411 1.00 0.00 H new ATOM 0 HB VAL A 44 27.906 19.385 2.555 1.00 0.00 H new ATOM 0 HG11 VAL A 44 28.043 21.337 1.031 1.00 0.00 H new ATOM 0 HG12 VAL A 44 27.736 19.838 0.122 1.00 0.00 H new ATOM 0 HG13 VAL A 44 26.407 20.981 0.428 1.00 0.00 H new ATOM 0 HG21 VAL A 44 27.131 21.605 3.343 1.00 0.00 H new ATOM 0 HG22 VAL A 44 25.495 21.249 2.740 1.00 0.00 H new ATOM 0 HG23 VAL A 44 26.176 20.297 4.080 1.00 0.00 H new ATOM 162 N TYR A 45 26.210 17.693 -0.317 1.00 0.00 N ATOM 163 CA TYR A 45 26.773 16.706 -1.282 1.00 0.00 C ATOM 164 C TYR A 45 27.353 17.446 -2.489 1.00 0.00 C ATOM 165 O TYR A 45 26.713 18.298 -3.074 1.00 0.00 O ATOM 166 CB TYR A 45 25.664 15.760 -1.747 1.00 0.00 C ATOM 167 CG TYR A 45 26.251 14.710 -2.660 1.00 0.00 C ATOM 168 CD1 TYR A 45 26.812 13.546 -2.119 1.00 0.00 C ATOM 169 CD2 TYR A 45 26.234 14.899 -4.047 1.00 0.00 C ATOM 170 CE1 TYR A 45 27.355 12.573 -2.965 1.00 0.00 C ATOM 171 CE2 TYR A 45 26.778 13.926 -4.894 1.00 0.00 C ATOM 172 CZ TYR A 45 27.338 12.762 -4.352 1.00 0.00 C ATOM 173 OH TYR A 45 27.874 11.802 -5.185 1.00 0.00 O ATOM 0 H TYR A 45 25.534 18.348 -0.709 1.00 0.00 H new ATOM 0 HA TYR A 45 27.562 16.131 -0.796 1.00 0.00 H new ATOM 0 HB2 TYR A 45 25.190 15.286 -0.887 1.00 0.00 H new ATOM 0 HB3 TYR A 45 24.889 16.320 -2.270 1.00 0.00 H new ATOM 0 HD1 TYR A 45 26.825 13.400 -1.049 1.00 0.00 H new ATOM 0 HD2 TYR A 45 25.801 15.796 -4.464 1.00 0.00 H new ATOM 0 HE1 TYR A 45 27.788 11.676 -2.548 1.00 0.00 H new ATOM 0 HE2 TYR A 45 26.766 14.073 -5.964 1.00 0.00 H new ATOM 0 HH TYR A 45 27.780 12.089 -6.117 1.00 0.00 H new ATOM 183 N GLY A 46 28.561 17.128 -2.867 1.00 0.00 N ATOM 184 CA GLY A 46 29.180 17.814 -4.036 1.00 0.00 C ATOM 185 C GLY A 46 30.545 17.189 -4.330 1.00 0.00 C ATOM 186 O GLY A 46 30.930 16.205 -3.730 1.00 0.00 O ATOM 0 H GLY A 46 29.145 16.423 -2.417 1.00 0.00 H new ATOM 0 HA2 GLY A 46 28.532 17.725 -4.908 1.00 0.00 H new ATOM 0 HA3 GLY A 46 29.292 18.878 -3.829 1.00 0.00 H new ATOM 190 N GLU A 47 31.280 17.751 -5.250 1.00 0.00 N ATOM 191 CA GLU A 47 32.618 17.188 -5.583 1.00 0.00 C ATOM 192 C GLU A 47 33.703 18.207 -5.229 1.00 0.00 C ATOM 193 O GLU A 47 33.455 19.395 -5.162 1.00 0.00 O ATOM 194 CB GLU A 47 32.684 16.876 -7.079 1.00 0.00 C ATOM 195 CG GLU A 47 31.594 15.862 -7.437 1.00 0.00 C ATOM 196 CD GLU A 47 31.707 15.494 -8.917 1.00 0.00 C ATOM 197 OE1 GLU A 47 32.467 16.147 -9.613 1.00 0.00 O ATOM 198 OE2 GLU A 47 31.031 14.566 -9.330 1.00 0.00 O ATOM 0 H GLU A 47 31.011 18.576 -5.786 1.00 0.00 H new ATOM 0 HA GLU A 47 32.777 16.273 -5.013 1.00 0.00 H new ATOM 0 HB2 GLU A 47 32.550 17.790 -7.658 1.00 0.00 H new ATOM 0 HB3 GLU A 47 33.665 16.477 -7.335 1.00 0.00 H new ATOM 0 HG2 GLU A 47 31.696 14.969 -6.820 1.00 0.00 H new ATOM 0 HG3 GLU A 47 30.610 16.282 -7.230 1.00 0.00 H new ATOM 205 N ASP A 48 34.905 17.753 -5.002 1.00 0.00 N ATOM 206 CA ASP A 48 36.005 18.696 -4.654 1.00 0.00 C ATOM 207 C ASP A 48 35.502 19.713 -3.627 1.00 0.00 C ATOM 208 O ASP A 48 35.650 20.906 -3.796 1.00 0.00 O ATOM 209 CB ASP A 48 36.465 19.431 -5.915 1.00 0.00 C ATOM 210 CG ASP A 48 36.850 18.409 -6.987 1.00 0.00 C ATOM 211 OD1 ASP A 48 37.105 17.271 -6.628 1.00 0.00 O ATOM 212 OD2 ASP A 48 36.885 18.782 -8.148 1.00 0.00 O ATOM 0 H ASP A 48 35.173 16.770 -5.042 1.00 0.00 H new ATOM 0 HA ASP A 48 36.841 18.138 -4.232 1.00 0.00 H new ATOM 0 HB2 ASP A 48 35.669 20.078 -6.283 1.00 0.00 H new ATOM 0 HB3 ASP A 48 37.316 20.072 -5.686 1.00 0.00 H new ATOM 217 N MET A 49 34.909 19.248 -2.561 1.00 0.00 N ATOM 218 CA MET A 49 34.397 20.188 -1.523 1.00 0.00 C ATOM 219 C MET A 49 35.385 20.245 -0.356 1.00 0.00 C ATOM 220 O MET A 49 35.900 19.236 0.083 1.00 0.00 O ATOM 221 CB MET A 49 33.039 19.701 -1.020 1.00 0.00 C ATOM 222 CG MET A 49 32.028 19.733 -2.166 1.00 0.00 C ATOM 223 SD MET A 49 30.364 19.451 -1.512 1.00 0.00 S ATOM 224 CE MET A 49 30.716 17.892 -0.662 1.00 0.00 C ATOM 0 H MET A 49 34.757 18.259 -2.364 1.00 0.00 H new ATOM 0 HA MET A 49 34.288 21.183 -1.955 1.00 0.00 H new ATOM 0 HB2 MET A 49 33.127 18.688 -0.627 1.00 0.00 H new ATOM 0 HB3 MET A 49 32.695 20.332 -0.200 1.00 0.00 H new ATOM 0 HG2 MET A 49 32.071 20.695 -2.676 1.00 0.00 H new ATOM 0 HG3 MET A 49 32.274 18.969 -2.904 1.00 0.00 H new ATOM 0 HE1 MET A 49 29.786 17.346 -0.504 1.00 0.00 H new ATOM 0 HE2 MET A 49 31.391 17.290 -1.270 1.00 0.00 H new ATOM 0 HE3 MET A 49 31.183 18.100 0.301 1.00 0.00 H new ATOM 234 N THR A 50 35.652 21.418 0.150 1.00 0.00 N ATOM 235 CA THR A 50 36.606 21.539 1.289 1.00 0.00 C ATOM 236 C THR A 50 35.889 22.157 2.490 1.00 0.00 C ATOM 237 O THR A 50 34.833 22.742 2.359 1.00 0.00 O ATOM 238 CB THR A 50 37.779 22.431 0.877 1.00 0.00 C ATOM 239 OG1 THR A 50 37.372 23.286 -0.181 1.00 0.00 O ATOM 240 CG2 THR A 50 38.949 21.561 0.414 1.00 0.00 C ATOM 0 H THR A 50 35.251 22.297 -0.176 1.00 0.00 H new ATOM 0 HA THR A 50 36.979 20.551 1.559 1.00 0.00 H new ATOM 0 HB THR A 50 38.095 23.033 1.729 1.00 0.00 H new ATOM 0 HG1 THR A 50 38.122 23.859 -0.445 1.00 0.00 H new ATOM 0 HG21 THR A 50 39.783 22.199 0.121 1.00 0.00 H new ATOM 0 HG22 THR A 50 39.261 20.907 1.228 1.00 0.00 H new ATOM 0 HG23 THR A 50 38.638 20.956 -0.438 1.00 0.00 H new ATOM 248 N PRO A 51 36.483 22.021 3.685 1.00 0.00 N ATOM 249 CA PRO A 51 35.907 22.564 4.922 1.00 0.00 C ATOM 250 C PRO A 51 35.967 24.094 4.954 1.00 0.00 C ATOM 251 O PRO A 51 34.969 24.760 5.142 1.00 0.00 O ATOM 252 CB PRO A 51 36.798 21.982 6.018 1.00 0.00 C ATOM 253 CG PRO A 51 38.097 21.703 5.339 1.00 0.00 C ATOM 254 CD PRO A 51 37.760 21.327 3.924 1.00 0.00 C ATOM 0 HA PRO A 51 34.853 22.306 5.030 1.00 0.00 H new ATOM 0 HB2 PRO A 51 36.924 22.685 6.841 1.00 0.00 H new ATOM 0 HB3 PRO A 51 36.367 21.073 6.438 1.00 0.00 H new ATOM 0 HG2 PRO A 51 38.745 22.579 5.365 1.00 0.00 H new ATOM 0 HG3 PRO A 51 38.632 20.896 5.839 1.00 0.00 H new ATOM 0 HD2 PRO A 51 38.532 21.653 3.226 1.00 0.00 H new ATOM 0 HD3 PRO A 51 37.660 20.248 3.807 1.00 0.00 H new ATOM 262 N THR A 52 37.131 24.657 4.770 1.00 0.00 N ATOM 263 CA THR A 52 37.249 26.142 4.789 1.00 0.00 C ATOM 264 C THR A 52 36.246 26.742 3.802 1.00 0.00 C ATOM 265 O THR A 52 35.512 27.655 4.125 1.00 0.00 O ATOM 266 CB THR A 52 38.668 26.549 4.385 1.00 0.00 C ATOM 267 OG1 THR A 52 39.605 25.876 5.215 1.00 0.00 O ATOM 268 CG2 THR A 52 38.832 28.061 4.545 1.00 0.00 C ATOM 0 H THR A 52 38.003 24.153 4.608 1.00 0.00 H new ATOM 0 HA THR A 52 37.040 26.511 5.793 1.00 0.00 H new ATOM 0 HB THR A 52 38.843 26.277 3.344 1.00 0.00 H new ATOM 0 HG1 THR A 52 40.515 26.134 4.957 1.00 0.00 H new ATOM 0 HG21 THR A 52 39.843 28.350 4.257 1.00 0.00 H new ATOM 0 HG22 THR A 52 38.112 28.575 3.907 1.00 0.00 H new ATOM 0 HG23 THR A 52 38.658 28.338 5.585 1.00 0.00 H new ATOM 276 N LEU A 53 36.206 26.234 2.601 1.00 0.00 N ATOM 277 CA LEU A 53 35.248 26.773 1.597 1.00 0.00 C ATOM 278 C LEU A 53 33.823 26.637 2.135 1.00 0.00 C ATOM 279 O LEU A 53 33.046 27.571 2.110 1.00 0.00 O ATOM 280 CB LEU A 53 35.378 25.985 0.292 1.00 0.00 C ATOM 281 CG LEU A 53 34.472 26.607 -0.773 1.00 0.00 C ATOM 282 CD1 LEU A 53 35.124 27.880 -1.318 1.00 0.00 C ATOM 283 CD2 LEU A 53 34.267 25.610 -1.915 1.00 0.00 C ATOM 0 H LEU A 53 36.795 25.469 2.272 1.00 0.00 H new ATOM 0 HA LEU A 53 35.469 27.824 1.409 1.00 0.00 H new ATOM 0 HB2 LEU A 53 36.414 25.992 -0.048 1.00 0.00 H new ATOM 0 HB3 LEU A 53 35.103 24.943 0.455 1.00 0.00 H new ATOM 0 HG LEU A 53 33.508 26.854 -0.329 1.00 0.00 H new ATOM 0 HD11 LEU A 53 34.479 28.323 -2.077 1.00 0.00 H new ATOM 0 HD12 LEU A 53 35.269 28.591 -0.505 1.00 0.00 H new ATOM 0 HD13 LEU A 53 36.089 27.634 -1.761 1.00 0.00 H new ATOM 0 HD21 LEU A 53 33.622 26.053 -2.673 1.00 0.00 H new ATOM 0 HD22 LEU A 53 35.231 25.362 -2.359 1.00 0.00 H new ATOM 0 HD23 LEU A 53 33.802 24.704 -1.528 1.00 0.00 H new ATOM 295 N LEU A 54 33.474 25.479 2.627 1.00 0.00 N ATOM 296 CA LEU A 54 32.101 25.284 3.171 1.00 0.00 C ATOM 297 C LEU A 54 31.852 26.299 4.288 1.00 0.00 C ATOM 298 O LEU A 54 30.813 26.925 4.351 1.00 0.00 O ATOM 299 CB LEU A 54 31.970 23.866 3.731 1.00 0.00 C ATOM 300 CG LEU A 54 32.068 22.855 2.587 1.00 0.00 C ATOM 301 CD1 LEU A 54 32.566 21.515 3.134 1.00 0.00 C ATOM 302 CD2 LEU A 54 30.688 22.667 1.953 1.00 0.00 C ATOM 0 H LEU A 54 34.081 24.660 2.675 1.00 0.00 H new ATOM 0 HA LEU A 54 31.369 25.428 2.376 1.00 0.00 H new ATOM 0 HB2 LEU A 54 32.755 23.679 4.464 1.00 0.00 H new ATOM 0 HB3 LEU A 54 31.017 23.754 4.249 1.00 0.00 H new ATOM 0 HG LEU A 54 32.766 23.223 1.835 1.00 0.00 H new ATOM 0 HD11 LEU A 54 32.636 20.793 2.320 1.00 0.00 H new ATOM 0 HD12 LEU A 54 33.549 21.649 3.586 1.00 0.00 H new ATOM 0 HD13 LEU A 54 31.868 21.147 3.886 1.00 0.00 H new ATOM 0 HD21 LEU A 54 30.757 21.947 1.138 1.00 0.00 H new ATOM 0 HD22 LEU A 54 29.990 22.299 2.704 1.00 0.00 H new ATOM 0 HD23 LEU A 54 30.333 23.622 1.565 1.00 0.00 H new ATOM 314 N ARG A 55 32.800 26.470 5.169 1.00 0.00 N ATOM 315 CA ARG A 55 32.617 27.447 6.278 1.00 0.00 C ATOM 316 C ARG A 55 32.175 28.790 5.697 1.00 0.00 C ATOM 317 O ARG A 55 31.332 29.469 6.249 1.00 0.00 O ATOM 318 CB ARG A 55 33.940 27.624 7.026 1.00 0.00 C ATOM 319 CG ARG A 55 34.235 26.366 7.847 1.00 0.00 C ATOM 320 CD ARG A 55 35.502 26.584 8.675 1.00 0.00 C ATOM 321 NE ARG A 55 35.922 25.293 9.291 1.00 0.00 N ATOM 322 CZ ARG A 55 35.940 25.165 10.590 1.00 0.00 C ATOM 323 NH1 ARG A 55 35.067 25.805 11.321 1.00 0.00 N ATOM 324 NH2 ARG A 55 36.829 24.398 11.158 1.00 0.00 N ATOM 0 H ARG A 55 33.692 25.976 5.168 1.00 0.00 H new ATOM 0 HA ARG A 55 31.858 27.080 6.969 1.00 0.00 H new ATOM 0 HB2 ARG A 55 34.748 27.807 6.318 1.00 0.00 H new ATOM 0 HB3 ARG A 55 33.886 28.494 7.681 1.00 0.00 H new ATOM 0 HG2 ARG A 55 33.394 26.141 8.502 1.00 0.00 H new ATOM 0 HG3 ARG A 55 34.363 25.509 7.186 1.00 0.00 H new ATOM 0 HD2 ARG A 55 36.300 26.974 8.043 1.00 0.00 H new ATOM 0 HD3 ARG A 55 35.319 27.327 9.451 1.00 0.00 H new ATOM 0 HE ARG A 55 36.195 24.510 8.697 1.00 0.00 H new ATOM 0 HH11 ARG A 55 34.372 26.405 10.877 1.00 0.00 H new ATOM 0 HH12 ARG A 55 35.081 25.705 12.336 1.00 0.00 H new ATOM 0 HH21 ARG A 55 37.511 23.898 10.587 1.00 0.00 H new ATOM 0 HH22 ARG A 55 36.843 24.298 12.173 1.00 0.00 H new ATOM 338 N GLY A 56 32.736 29.178 4.584 1.00 0.00 N ATOM 339 CA GLY A 56 32.344 30.475 3.965 1.00 0.00 C ATOM 340 C GLY A 56 30.917 30.367 3.425 1.00 0.00 C ATOM 341 O GLY A 56 30.182 31.334 3.388 1.00 0.00 O ATOM 0 H GLY A 56 33.448 28.653 4.077 1.00 0.00 H new ATOM 0 HA2 GLY A 56 32.407 31.276 4.701 1.00 0.00 H new ATOM 0 HA3 GLY A 56 33.032 30.729 3.159 1.00 0.00 H new ATOM 345 N ALA A 57 30.519 29.198 3.004 1.00 0.00 N ATOM 346 CA ALA A 57 29.141 29.028 2.467 1.00 0.00 C ATOM 347 C ALA A 57 28.151 28.915 3.629 1.00 0.00 C ATOM 348 O ALA A 57 26.971 29.156 3.477 1.00 0.00 O ATOM 349 CB ALA A 57 29.077 27.758 1.616 1.00 0.00 C ATOM 0 H ALA A 57 31.090 28.353 3.009 1.00 0.00 H new ATOM 0 HA ALA A 57 28.882 29.890 1.852 1.00 0.00 H new ATOM 0 HB1 ALA A 57 28.068 27.634 1.223 1.00 0.00 H new ATOM 0 HB2 ALA A 57 29.781 27.839 0.788 1.00 0.00 H new ATOM 0 HB3 ALA A 57 29.336 26.895 2.230 1.00 0.00 H new ATOM 355 N PHE A 58 28.624 28.551 4.790 1.00 0.00 N ATOM 356 CA PHE A 58 27.711 28.424 5.962 1.00 0.00 C ATOM 357 C PHE A 58 28.152 29.399 7.058 1.00 0.00 C ATOM 358 O PHE A 58 27.651 29.370 8.165 1.00 0.00 O ATOM 359 CB PHE A 58 27.771 26.993 6.499 1.00 0.00 C ATOM 360 CG PHE A 58 27.187 26.046 5.479 1.00 0.00 C ATOM 361 CD1 PHE A 58 28.000 25.516 4.469 1.00 0.00 C ATOM 362 CD2 PHE A 58 25.833 25.696 5.543 1.00 0.00 C ATOM 363 CE1 PHE A 58 27.458 24.637 3.523 1.00 0.00 C ATOM 364 CE2 PHE A 58 25.292 24.817 4.597 1.00 0.00 C ATOM 365 CZ PHE A 58 26.104 24.287 3.587 1.00 0.00 C ATOM 0 H PHE A 58 29.603 28.336 4.978 1.00 0.00 H new ATOM 0 HA PHE A 58 26.691 28.656 5.657 1.00 0.00 H new ATOM 0 HB2 PHE A 58 28.803 26.718 6.717 1.00 0.00 H new ATOM 0 HB3 PHE A 58 27.218 26.921 7.436 1.00 0.00 H new ATOM 0 HD1 PHE A 58 29.045 25.785 4.420 1.00 0.00 H new ATOM 0 HD2 PHE A 58 25.206 26.104 6.322 1.00 0.00 H new ATOM 0 HE1 PHE A 58 28.085 24.229 2.744 1.00 0.00 H new ATOM 0 HE2 PHE A 58 24.247 24.548 4.646 1.00 0.00 H new ATOM 0 HZ PHE A 58 25.686 23.609 2.858 1.00 0.00 H new ATOM 375 N SER A 59 29.090 30.256 6.761 1.00 0.00 N ATOM 376 CA SER A 59 29.571 31.226 7.785 1.00 0.00 C ATOM 377 C SER A 59 28.540 32.345 7.980 1.00 0.00 C ATOM 378 O SER A 59 28.094 32.598 9.081 1.00 0.00 O ATOM 379 CB SER A 59 30.897 31.834 7.325 1.00 0.00 C ATOM 380 OG SER A 59 31.957 31.311 8.114 1.00 0.00 O ATOM 0 H SER A 59 29.545 30.326 5.851 1.00 0.00 H new ATOM 0 HA SER A 59 29.712 30.703 8.731 1.00 0.00 H new ATOM 0 HB2 SER A 59 31.067 31.608 6.272 1.00 0.00 H new ATOM 0 HB3 SER A 59 30.863 32.920 7.416 1.00 0.00 H new ATOM 0 HG SER A 59 32.207 30.424 7.780 1.00 0.00 H new ATOM 386 N PRO A 60 28.165 33.035 6.891 1.00 0.00 N ATOM 387 CA PRO A 60 27.195 34.138 6.949 1.00 0.00 C ATOM 388 C PRO A 60 25.778 33.647 7.260 1.00 0.00 C ATOM 389 O PRO A 60 24.985 34.351 7.852 1.00 0.00 O ATOM 390 CB PRO A 60 27.246 34.736 5.543 1.00 0.00 C ATOM 391 CG PRO A 60 27.717 33.619 4.676 1.00 0.00 C ATOM 392 CD PRO A 60 28.650 32.796 5.519 1.00 0.00 C ATOM 0 HA PRO A 60 27.437 34.848 7.739 1.00 0.00 H new ATOM 0 HB2 PRO A 60 26.266 35.095 5.229 1.00 0.00 H new ATOM 0 HB3 PRO A 60 27.926 35.586 5.498 1.00 0.00 H new ATOM 0 HG2 PRO A 60 26.878 33.018 4.325 1.00 0.00 H new ATOM 0 HG3 PRO A 60 28.227 34.001 3.792 1.00 0.00 H new ATOM 0 HD2 PRO A 60 28.605 31.739 5.255 1.00 0.00 H new ATOM 0 HD3 PRO A 60 29.686 33.111 5.398 1.00 0.00 H new ATOM 400 N PHE A 61 25.453 32.447 6.865 1.00 0.00 N ATOM 401 CA PHE A 61 24.086 31.921 7.143 1.00 0.00 C ATOM 402 C PHE A 61 23.913 31.717 8.649 1.00 0.00 C ATOM 403 O PHE A 61 22.822 31.805 9.176 1.00 0.00 O ATOM 404 CB PHE A 61 23.897 30.586 6.421 1.00 0.00 C ATOM 405 CG PHE A 61 23.646 30.838 4.953 1.00 0.00 C ATOM 406 CD1 PHE A 61 22.352 31.128 4.504 1.00 0.00 C ATOM 407 CD2 PHE A 61 24.708 30.780 4.043 1.00 0.00 C ATOM 408 CE1 PHE A 61 22.122 31.361 3.142 1.00 0.00 C ATOM 409 CE2 PHE A 61 24.476 31.012 2.682 1.00 0.00 C ATOM 410 CZ PHE A 61 23.183 31.302 2.231 1.00 0.00 C ATOM 0 H PHE A 61 26.072 31.810 6.364 1.00 0.00 H new ATOM 0 HA PHE A 61 23.343 32.635 6.787 1.00 0.00 H new ATOM 0 HB2 PHE A 61 24.783 29.963 6.548 1.00 0.00 H new ATOM 0 HB3 PHE A 61 23.059 30.041 6.856 1.00 0.00 H new ATOM 0 HD1 PHE A 61 21.533 31.172 5.206 1.00 0.00 H new ATOM 0 HD2 PHE A 61 25.706 30.556 4.391 1.00 0.00 H new ATOM 0 HE1 PHE A 61 21.125 31.586 2.794 1.00 0.00 H new ATOM 0 HE2 PHE A 61 25.295 30.967 1.980 1.00 0.00 H new ATOM 0 HZ PHE A 61 23.004 31.480 1.181 1.00 0.00 H new ATOM 420 N GLY A 62 24.982 31.445 9.347 1.00 0.00 N ATOM 421 CA GLY A 62 24.876 31.237 10.819 1.00 0.00 C ATOM 422 C GLY A 62 26.223 30.760 11.368 1.00 0.00 C ATOM 423 O GLY A 62 27.189 30.629 10.641 1.00 0.00 O ATOM 0 H GLY A 62 25.923 31.358 8.962 1.00 0.00 H new ATOM 0 HA2 GLY A 62 24.581 32.166 11.307 1.00 0.00 H new ATOM 0 HA3 GLY A 62 24.102 30.502 11.038 1.00 0.00 H new ATOM 427 N ASN A 63 26.295 30.499 12.644 1.00 0.00 N ATOM 428 CA ASN A 63 27.578 30.031 13.238 1.00 0.00 C ATOM 429 C ASN A 63 27.592 28.501 13.280 1.00 0.00 C ATOM 430 O ASN A 63 26.606 27.871 13.607 1.00 0.00 O ATOM 431 CB ASN A 63 27.715 30.582 14.659 1.00 0.00 C ATOM 432 CG ASN A 63 29.129 30.315 15.176 1.00 0.00 C ATOM 433 OD1 ASN A 63 29.992 29.891 14.432 1.00 0.00 O ATOM 434 ND2 ASN A 63 29.407 30.545 16.430 1.00 0.00 N ATOM 0 H ASN A 63 25.520 30.590 13.301 1.00 0.00 H new ATOM 0 HA ASN A 63 28.410 30.386 12.630 1.00 0.00 H new ATOM 0 HB2 ASN A 63 27.510 31.652 14.667 1.00 0.00 H new ATOM 0 HB3 ASN A 63 26.982 30.112 15.315 1.00 0.00 H new ATOM 0 HD21 ASN A 63 30.347 30.369 16.785 1.00 0.00 H new ATOM 0 HD22 ASN A 63 28.684 30.901 17.056 1.00 0.00 H new ATOM 441 N ILE A 64 28.702 27.899 12.952 1.00 0.00 N ATOM 442 CA ILE A 64 28.777 26.412 12.973 1.00 0.00 C ATOM 443 C ILE A 64 29.465 25.956 14.262 1.00 0.00 C ATOM 444 O ILE A 64 30.472 26.503 14.667 1.00 0.00 O ATOM 445 CB ILE A 64 29.579 25.927 11.764 1.00 0.00 C ATOM 446 CG1 ILE A 64 28.955 26.483 10.482 1.00 0.00 C ATOM 447 CG2 ILE A 64 29.560 24.398 11.718 1.00 0.00 C ATOM 448 CD1 ILE A 64 29.928 26.297 9.316 1.00 0.00 C ATOM 0 H ILE A 64 29.560 28.373 12.670 1.00 0.00 H new ATOM 0 HA ILE A 64 27.771 25.994 12.932 1.00 0.00 H new ATOM 0 HB ILE A 64 30.609 26.275 11.848 1.00 0.00 H new ATOM 0 HG12 ILE A 64 28.016 25.971 10.271 1.00 0.00 H new ATOM 0 HG13 ILE A 64 28.720 27.540 10.608 1.00 0.00 H new ATOM 0 HG21 ILE A 64 30.132 24.053 10.856 1.00 0.00 H new ATOM 0 HG22 ILE A 64 30.004 24.001 12.631 1.00 0.00 H new ATOM 0 HG23 ILE A 64 28.531 24.049 11.634 1.00 0.00 H new ATOM 0 HD11 ILE A 64 29.482 26.693 8.404 1.00 0.00 H new ATOM 0 HD12 ILE A 64 30.856 26.829 9.528 1.00 0.00 H new ATOM 0 HD13 ILE A 64 30.140 25.236 9.185 1.00 0.00 H new ATOM 460 N ILE A 65 28.928 24.958 14.909 1.00 0.00 N ATOM 461 CA ILE A 65 29.550 24.470 16.174 1.00 0.00 C ATOM 462 C ILE A 65 30.329 23.182 15.901 1.00 0.00 C ATOM 463 O ILE A 65 31.216 22.813 16.645 1.00 0.00 O ATOM 464 CB ILE A 65 28.453 24.194 17.205 1.00 0.00 C ATOM 465 CG1 ILE A 65 27.612 23.000 16.751 1.00 0.00 C ATOM 466 CG2 ILE A 65 27.557 25.428 17.337 1.00 0.00 C ATOM 467 CD1 ILE A 65 26.550 22.695 17.808 1.00 0.00 C ATOM 0 H ILE A 65 28.087 24.460 14.618 1.00 0.00 H new ATOM 0 HA ILE A 65 30.231 25.229 16.559 1.00 0.00 H new ATOM 0 HB ILE A 65 28.909 23.970 18.169 1.00 0.00 H new ATOM 0 HG12 ILE A 65 27.137 23.219 15.795 1.00 0.00 H new ATOM 0 HG13 ILE A 65 28.250 22.129 16.598 1.00 0.00 H new ATOM 0 HG21 ILE A 65 26.775 25.233 18.071 1.00 0.00 H new ATOM 0 HG22 ILE A 65 28.155 26.279 17.662 1.00 0.00 H new ATOM 0 HG23 ILE A 65 27.101 25.652 16.372 1.00 0.00 H new ATOM 0 HD11 ILE A 65 25.950 21.844 17.486 1.00 0.00 H new ATOM 0 HD12 ILE A 65 27.036 22.458 18.754 1.00 0.00 H new ATOM 0 HD13 ILE A 65 25.906 23.565 17.938 1.00 0.00 H new ATOM 479 N ASP A 66 30.006 22.491 14.841 1.00 0.00 N ATOM 480 CA ASP A 66 30.732 21.228 14.528 1.00 0.00 C ATOM 481 C ASP A 66 30.857 21.068 13.012 1.00 0.00 C ATOM 482 O ASP A 66 29.883 20.857 12.318 1.00 0.00 O ATOM 483 CB ASP A 66 29.960 20.040 15.104 1.00 0.00 C ATOM 484 CG ASP A 66 30.729 18.747 14.822 1.00 0.00 C ATOM 485 OD1 ASP A 66 31.863 18.840 14.381 1.00 0.00 O ATOM 486 OD2 ASP A 66 30.171 17.688 15.053 1.00 0.00 O ATOM 0 H ASP A 66 29.272 22.746 14.180 1.00 0.00 H new ATOM 0 HA ASP A 66 31.728 21.265 14.970 1.00 0.00 H new ATOM 0 HB2 ASP A 66 29.823 20.168 16.178 1.00 0.00 H new ATOM 0 HB3 ASP A 66 28.966 19.989 14.660 1.00 0.00 H new ATOM 491 N LEU A 67 32.051 21.166 12.494 1.00 0.00 N ATOM 492 CA LEU A 67 32.241 21.018 11.023 1.00 0.00 C ATOM 493 C LEU A 67 32.927 19.681 10.732 1.00 0.00 C ATOM 494 O LEU A 67 33.995 19.398 11.236 1.00 0.00 O ATOM 495 CB LEU A 67 33.114 22.164 10.507 1.00 0.00 C ATOM 496 CG LEU A 67 33.394 21.960 9.017 1.00 0.00 C ATOM 497 CD1 LEU A 67 32.120 22.233 8.216 1.00 0.00 C ATOM 498 CD2 LEU A 67 34.494 22.927 8.571 1.00 0.00 C ATOM 0 H LEU A 67 32.903 21.342 13.026 1.00 0.00 H new ATOM 0 HA LEU A 67 31.273 21.046 10.524 1.00 0.00 H new ATOM 0 HB2 LEU A 67 32.612 23.118 10.666 1.00 0.00 H new ATOM 0 HB3 LEU A 67 34.051 22.200 11.063 1.00 0.00 H new ATOM 0 HG LEU A 67 33.718 20.934 8.844 1.00 0.00 H new ATOM 0 HD11 LEU A 67 32.320 22.088 7.154 1.00 0.00 H new ATOM 0 HD12 LEU A 67 31.336 21.547 8.535 1.00 0.00 H new ATOM 0 HD13 LEU A 67 31.796 23.259 8.387 1.00 0.00 H new ATOM 0 HD21 LEU A 67 34.696 22.784 7.509 1.00 0.00 H new ATOM 0 HD22 LEU A 67 34.169 23.953 8.743 1.00 0.00 H new ATOM 0 HD23 LEU A 67 35.402 22.734 9.142 1.00 0.00 H new ATOM 510 N SER A 68 32.320 18.856 9.921 1.00 0.00 N ATOM 511 CA SER A 68 32.941 17.538 9.602 1.00 0.00 C ATOM 512 C SER A 68 32.867 17.290 8.094 1.00 0.00 C ATOM 513 O SER A 68 31.883 17.601 7.451 1.00 0.00 O ATOM 514 CB SER A 68 32.187 16.428 10.339 1.00 0.00 C ATOM 515 OG SER A 68 32.877 15.198 10.174 1.00 0.00 O ATOM 0 H SER A 68 31.425 19.037 9.467 1.00 0.00 H new ATOM 0 HA SER A 68 33.984 17.542 9.918 1.00 0.00 H new ATOM 0 HB2 SER A 68 32.104 16.671 11.398 1.00 0.00 H new ATOM 0 HB3 SER A 68 31.172 16.343 9.951 1.00 0.00 H new ATOM 0 HG SER A 68 32.396 14.487 10.647 1.00 0.00 H new ATOM 521 N MET A 69 33.900 16.731 7.525 1.00 0.00 N ATOM 522 CA MET A 69 33.890 16.461 6.060 1.00 0.00 C ATOM 523 C MET A 69 33.897 14.950 5.819 1.00 0.00 C ATOM 524 O MET A 69 34.401 14.187 6.620 1.00 0.00 O ATOM 525 CB MET A 69 35.130 17.084 5.417 1.00 0.00 C ATOM 526 CG MET A 69 35.128 18.594 5.661 1.00 0.00 C ATOM 527 SD MET A 69 33.680 19.332 4.866 1.00 0.00 S ATOM 528 CE MET A 69 34.027 18.757 3.185 1.00 0.00 C ATOM 0 H MET A 69 34.751 16.450 8.012 1.00 0.00 H new ATOM 0 HA MET A 69 32.994 16.896 5.618 1.00 0.00 H new ATOM 0 HB2 MET A 69 36.032 16.639 5.836 1.00 0.00 H new ATOM 0 HB3 MET A 69 35.140 16.878 4.347 1.00 0.00 H new ATOM 0 HG2 MET A 69 35.113 18.800 6.731 1.00 0.00 H new ATOM 0 HG3 MET A 69 36.040 19.039 5.264 1.00 0.00 H new ATOM 0 HE1 MET A 69 33.626 19.471 2.466 1.00 0.00 H new ATOM 0 HE2 MET A 69 35.104 18.668 3.046 1.00 0.00 H new ATOM 0 HE3 MET A 69 33.560 17.785 3.029 1.00 0.00 H new ATOM 538 N ASP A 70 33.342 14.512 4.724 1.00 0.00 N ATOM 539 CA ASP A 70 33.318 13.051 4.432 1.00 0.00 C ATOM 540 C ASP A 70 33.786 12.809 2.996 1.00 0.00 C ATOM 541 O ASP A 70 33.037 12.976 2.054 1.00 0.00 O ATOM 542 CB ASP A 70 31.891 12.524 4.600 1.00 0.00 C ATOM 543 CG ASP A 70 31.910 11.272 5.481 1.00 0.00 C ATOM 544 OD1 ASP A 70 32.235 11.400 6.650 1.00 0.00 O ATOM 545 OD2 ASP A 70 31.598 10.208 4.971 1.00 0.00 O ATOM 0 H ASP A 70 32.903 15.103 4.018 1.00 0.00 H new ATOM 0 HA ASP A 70 33.983 12.531 5.121 1.00 0.00 H new ATOM 0 HB2 ASP A 70 31.260 13.290 5.051 1.00 0.00 H new ATOM 0 HB3 ASP A 70 31.461 12.290 3.626 1.00 0.00 H new ATOM 550 N PRO A 71 35.056 12.409 2.832 1.00 0.00 N ATOM 551 CA PRO A 71 35.633 12.144 1.513 1.00 0.00 C ATOM 552 C PRO A 71 35.150 10.822 0.881 1.00 0.00 C ATOM 553 O PRO A 71 35.114 10.704 -0.327 1.00 0.00 O ATOM 554 CB PRO A 71 37.136 12.091 1.780 1.00 0.00 C ATOM 555 CG PRO A 71 37.271 11.718 3.219 1.00 0.00 C ATOM 556 CD PRO A 71 36.024 12.190 3.923 1.00 0.00 C ATOM 0 HA PRO A 71 35.335 12.909 0.796 1.00 0.00 H new ATOM 0 HB2 PRO A 71 37.623 11.358 1.137 1.00 0.00 H new ATOM 0 HB3 PRO A 71 37.605 13.054 1.578 1.00 0.00 H new ATOM 0 HG2 PRO A 71 37.389 10.640 3.327 1.00 0.00 H new ATOM 0 HG3 PRO A 71 38.157 12.181 3.655 1.00 0.00 H new ATOM 0 HD2 PRO A 71 35.662 11.447 4.634 1.00 0.00 H new ATOM 0 HD3 PRO A 71 36.206 13.106 4.485 1.00 0.00 H new ATOM 564 N PRO A 72 34.772 9.803 1.686 1.00 0.00 N ATOM 565 CA PRO A 72 34.307 8.524 1.135 1.00 0.00 C ATOM 566 C PRO A 72 32.882 8.631 0.584 1.00 0.00 C ATOM 567 O PRO A 72 32.527 7.977 -0.375 1.00 0.00 O ATOM 568 CB PRO A 72 34.330 7.580 2.333 1.00 0.00 C ATOM 569 CG PRO A 72 34.181 8.464 3.526 1.00 0.00 C ATOM 570 CD PRO A 72 34.765 9.802 3.163 1.00 0.00 C ATOM 0 HA PRO A 72 34.928 8.190 0.304 1.00 0.00 H new ATOM 0 HB2 PRO A 72 33.520 6.853 2.278 1.00 0.00 H new ATOM 0 HB3 PRO A 72 35.262 7.017 2.373 1.00 0.00 H new ATOM 0 HG2 PRO A 72 33.131 8.564 3.802 1.00 0.00 H new ATOM 0 HG3 PRO A 72 34.698 8.039 4.387 1.00 0.00 H new ATOM 0 HD2 PRO A 72 34.164 10.620 3.559 1.00 0.00 H new ATOM 0 HD3 PRO A 72 35.771 9.921 3.567 1.00 0.00 H new ATOM 578 N ARG A 73 32.064 9.454 1.183 1.00 0.00 N ATOM 579 CA ARG A 73 30.664 9.602 0.694 1.00 0.00 C ATOM 580 C ARG A 73 30.544 10.884 -0.133 1.00 0.00 C ATOM 581 O ARG A 73 29.511 11.168 -0.707 1.00 0.00 O ATOM 582 CB ARG A 73 29.713 9.677 1.890 1.00 0.00 C ATOM 583 CG ARG A 73 28.268 9.564 1.400 1.00 0.00 C ATOM 584 CD ARG A 73 27.999 8.132 0.933 1.00 0.00 C ATOM 585 NE ARG A 73 26.601 8.030 0.428 1.00 0.00 N ATOM 586 CZ ARG A 73 26.376 7.646 -0.798 1.00 0.00 C ATOM 587 NH1 ARG A 73 26.675 8.435 -1.794 1.00 0.00 N ATOM 588 NH2 ARG A 73 25.853 6.473 -1.030 1.00 0.00 N ATOM 0 H ARG A 73 32.305 10.030 1.990 1.00 0.00 H new ATOM 0 HA ARG A 73 30.403 8.744 0.074 1.00 0.00 H new ATOM 0 HB2 ARG A 73 29.933 8.875 2.594 1.00 0.00 H new ATOM 0 HB3 ARG A 73 29.855 10.617 2.423 1.00 0.00 H new ATOM 0 HG2 ARG A 73 27.579 9.832 2.201 1.00 0.00 H new ATOM 0 HG3 ARG A 73 28.094 10.263 0.582 1.00 0.00 H new ATOM 0 HD2 ARG A 73 28.702 7.856 0.147 1.00 0.00 H new ATOM 0 HD3 ARG A 73 28.152 7.435 1.757 1.00 0.00 H new ATOM 0 HE ARG A 73 25.819 8.261 1.041 1.00 0.00 H new ATOM 0 HH11 ARG A 73 27.085 9.352 -1.613 1.00 0.00 H new ATOM 0 HH12 ARG A 73 26.499 8.135 -2.753 1.00 0.00 H new ATOM 0 HH21 ARG A 73 25.620 5.856 -0.252 1.00 0.00 H new ATOM 0 HH22 ARG A 73 25.677 6.174 -1.989 1.00 0.00 H new ATOM 602 N ASN A 74 31.590 11.662 -0.199 1.00 0.00 N ATOM 603 CA ASN A 74 31.530 12.925 -0.987 1.00 0.00 C ATOM 604 C ASN A 74 30.466 13.849 -0.391 1.00 0.00 C ATOM 605 O ASN A 74 29.686 14.452 -1.100 1.00 0.00 O ATOM 606 CB ASN A 74 31.169 12.602 -2.439 1.00 0.00 C ATOM 607 CG ASN A 74 32.261 11.723 -3.053 1.00 0.00 C ATOM 608 OD1 ASN A 74 33.352 11.633 -2.525 1.00 0.00 O ATOM 609 ND2 ASN A 74 32.013 11.068 -4.154 1.00 0.00 N ATOM 0 H ASN A 74 32.483 11.477 0.259 1.00 0.00 H new ATOM 0 HA ASN A 74 32.500 13.420 -0.954 1.00 0.00 H new ATOM 0 HB2 ASN A 74 30.208 12.089 -2.481 1.00 0.00 H new ATOM 0 HB3 ASN A 74 31.064 13.523 -3.012 1.00 0.00 H new ATOM 0 HD21 ASN A 74 32.735 10.480 -4.571 1.00 0.00 H new ATOM 0 HD22 ASN A 74 31.097 11.144 -4.597 1.00 0.00 H new ATOM 616 N CYS A 75 30.430 13.965 0.909 1.00 0.00 N ATOM 617 CA CYS A 75 29.416 14.849 1.549 1.00 0.00 C ATOM 618 C CYS A 75 30.002 15.457 2.826 1.00 0.00 C ATOM 619 O CYS A 75 30.735 14.814 3.551 1.00 0.00 O ATOM 620 CB CYS A 75 28.172 14.030 1.899 1.00 0.00 C ATOM 621 SG CYS A 75 28.594 12.802 3.160 1.00 0.00 S ATOM 0 H CYS A 75 31.058 13.486 1.554 1.00 0.00 H new ATOM 0 HA CYS A 75 29.143 15.647 0.858 1.00 0.00 H new ATOM 0 HB2 CYS A 75 27.382 14.686 2.265 1.00 0.00 H new ATOM 0 HB3 CYS A 75 27.787 13.534 1.008 1.00 0.00 H new ATOM 0 HG CYS A 75 29.427 13.323 4.011 1.00 0.00 H new ATOM 627 N ALA A 76 29.684 16.690 3.106 1.00 0.00 N ATOM 628 CA ALA A 76 30.222 17.338 4.335 1.00 0.00 C ATOM 629 C ALA A 76 29.103 17.477 5.370 1.00 0.00 C ATOM 630 O ALA A 76 27.935 17.377 5.051 1.00 0.00 O ATOM 631 CB ALA A 76 30.768 18.724 3.986 1.00 0.00 C ATOM 0 H ALA A 76 29.075 17.277 2.537 1.00 0.00 H new ATOM 0 HA ALA A 76 31.024 16.725 4.746 1.00 0.00 H new ATOM 0 HB1 ALA A 76 31.161 19.197 4.886 1.00 0.00 H new ATOM 0 HB2 ALA A 76 31.565 18.626 3.249 1.00 0.00 H new ATOM 0 HB3 ALA A 76 29.967 19.338 3.574 1.00 0.00 H new ATOM 637 N PHE A 77 29.451 17.706 6.606 1.00 0.00 N ATOM 638 CA PHE A 77 28.405 17.850 7.658 1.00 0.00 C ATOM 639 C PHE A 77 28.557 19.208 8.349 1.00 0.00 C ATOM 640 O PHE A 77 29.634 19.588 8.761 1.00 0.00 O ATOM 641 CB PHE A 77 28.566 16.733 8.691 1.00 0.00 C ATOM 642 CG PHE A 77 28.364 15.394 8.023 1.00 0.00 C ATOM 643 CD1 PHE A 77 27.068 14.937 7.751 1.00 0.00 C ATOM 644 CD2 PHE A 77 29.469 14.610 7.674 1.00 0.00 C ATOM 645 CE1 PHE A 77 26.879 13.695 7.133 1.00 0.00 C ATOM 646 CE2 PHE A 77 29.281 13.368 7.055 1.00 0.00 C ATOM 647 CZ PHE A 77 27.984 12.911 6.785 1.00 0.00 C ATOM 0 H PHE A 77 30.413 17.800 6.933 1.00 0.00 H new ATOM 0 HA PHE A 77 27.418 17.785 7.200 1.00 0.00 H new ATOM 0 HB2 PHE A 77 29.557 16.780 9.141 1.00 0.00 H new ATOM 0 HB3 PHE A 77 27.843 16.862 9.497 1.00 0.00 H new ATOM 0 HD1 PHE A 77 26.215 15.543 8.018 1.00 0.00 H new ATOM 0 HD2 PHE A 77 30.468 14.963 7.882 1.00 0.00 H new ATOM 0 HE1 PHE A 77 25.880 13.342 6.925 1.00 0.00 H new ATOM 0 HE2 PHE A 77 30.134 12.763 6.786 1.00 0.00 H new ATOM 0 HZ PHE A 77 27.838 11.953 6.308 1.00 0.00 H new ATOM 657 N VAL A 78 27.485 19.940 8.480 1.00 0.00 N ATOM 658 CA VAL A 78 27.568 21.271 9.147 1.00 0.00 C ATOM 659 C VAL A 78 26.537 21.337 10.276 1.00 0.00 C ATOM 660 O VAL A 78 25.429 20.861 10.143 1.00 0.00 O ATOM 661 CB VAL A 78 27.275 22.373 8.127 1.00 0.00 C ATOM 662 CG1 VAL A 78 27.442 23.741 8.794 1.00 0.00 C ATOM 663 CG2 VAL A 78 28.251 22.255 6.955 1.00 0.00 C ATOM 0 H VAL A 78 26.556 19.675 8.154 1.00 0.00 H new ATOM 0 HA VAL A 78 28.569 21.411 9.556 1.00 0.00 H new ATOM 0 HB VAL A 78 26.254 22.268 7.761 1.00 0.00 H new ATOM 0 HG11 VAL A 78 27.234 24.527 8.069 1.00 0.00 H new ATOM 0 HG12 VAL A 78 26.748 23.825 9.630 1.00 0.00 H new ATOM 0 HG13 VAL A 78 28.464 23.846 9.159 1.00 0.00 H new ATOM 0 HG21 VAL A 78 28.043 23.040 6.228 1.00 0.00 H new ATOM 0 HG22 VAL A 78 29.273 22.360 7.320 1.00 0.00 H new ATOM 0 HG23 VAL A 78 28.134 21.281 6.481 1.00 0.00 H new ATOM 673 N THR A 79 26.894 21.920 11.388 1.00 0.00 N ATOM 674 CA THR A 79 25.930 22.009 12.521 1.00 0.00 C ATOM 675 C THR A 79 25.592 23.477 12.793 1.00 0.00 C ATOM 676 O THR A 79 26.426 24.247 13.225 1.00 0.00 O ATOM 677 CB THR A 79 26.558 21.390 13.772 1.00 0.00 C ATOM 678 OG1 THR A 79 27.302 20.236 13.405 1.00 0.00 O ATOM 679 CG2 THR A 79 25.457 20.996 14.759 1.00 0.00 C ATOM 0 H THR A 79 27.809 22.337 11.560 1.00 0.00 H new ATOM 0 HA THR A 79 25.018 21.469 12.265 1.00 0.00 H new ATOM 0 HB THR A 79 27.220 22.117 14.242 1.00 0.00 H new ATOM 0 HG1 THR A 79 28.142 20.510 12.982 1.00 0.00 H new ATOM 0 HG21 THR A 79 25.907 20.555 15.649 1.00 0.00 H new ATOM 0 HG22 THR A 79 24.887 21.881 15.041 1.00 0.00 H new ATOM 0 HG23 THR A 79 24.792 20.270 14.291 1.00 0.00 H new ATOM 687 N TYR A 80 24.371 23.870 12.544 1.00 0.00 N ATOM 688 CA TYR A 80 23.980 25.288 12.790 1.00 0.00 C ATOM 689 C TYR A 80 23.390 25.416 14.196 1.00 0.00 C ATOM 690 O TYR A 80 22.439 24.745 14.540 1.00 0.00 O ATOM 691 CB TYR A 80 22.934 25.717 11.760 1.00 0.00 C ATOM 692 CG TYR A 80 23.622 26.375 10.589 1.00 0.00 C ATOM 693 CD1 TYR A 80 24.644 27.306 10.807 1.00 0.00 C ATOM 694 CD2 TYR A 80 23.238 26.053 9.282 1.00 0.00 C ATOM 695 CE1 TYR A 80 25.282 27.915 9.719 1.00 0.00 C ATOM 696 CE2 TYR A 80 23.875 26.661 8.194 1.00 0.00 C ATOM 697 CZ TYR A 80 24.897 27.591 8.413 1.00 0.00 C ATOM 698 OH TYR A 80 25.525 28.191 7.341 1.00 0.00 O ATOM 0 H TYR A 80 23.629 23.271 12.182 1.00 0.00 H new ATOM 0 HA TYR A 80 24.859 25.927 12.702 1.00 0.00 H new ATOM 0 HB2 TYR A 80 22.365 24.851 11.422 1.00 0.00 H new ATOM 0 HB3 TYR A 80 22.224 26.408 12.213 1.00 0.00 H new ATOM 0 HD1 TYR A 80 24.941 27.555 11.815 1.00 0.00 H new ATOM 0 HD2 TYR A 80 22.449 25.335 9.113 1.00 0.00 H new ATOM 0 HE1 TYR A 80 26.070 28.634 9.888 1.00 0.00 H new ATOM 0 HE2 TYR A 80 23.578 26.412 7.186 1.00 0.00 H new ATOM 0 HH TYR A 80 26.042 28.963 7.654 1.00 0.00 H new ATOM 708 N GLU A 81 23.954 26.270 15.009 1.00 0.00 N ATOM 709 CA GLU A 81 23.442 26.448 16.400 1.00 0.00 C ATOM 710 C GLU A 81 21.912 26.386 16.415 1.00 0.00 C ATOM 711 O GLU A 81 21.312 25.900 17.353 1.00 0.00 O ATOM 712 CB GLU A 81 23.899 27.807 16.937 1.00 0.00 C ATOM 713 CG GLU A 81 23.457 27.955 18.394 1.00 0.00 C ATOM 714 CD GLU A 81 23.854 29.340 18.909 1.00 0.00 C ATOM 715 OE1 GLU A 81 24.367 30.119 18.120 1.00 0.00 O ATOM 716 OE2 GLU A 81 23.641 29.599 20.081 1.00 0.00 O ATOM 0 H GLU A 81 24.753 26.856 14.767 1.00 0.00 H new ATOM 0 HA GLU A 81 23.835 25.648 17.028 1.00 0.00 H new ATOM 0 HB2 GLU A 81 24.983 27.893 16.864 1.00 0.00 H new ATOM 0 HB3 GLU A 81 23.475 28.610 16.334 1.00 0.00 H new ATOM 0 HG2 GLU A 81 22.378 27.821 18.473 1.00 0.00 H new ATOM 0 HG3 GLU A 81 23.920 27.181 19.006 1.00 0.00 H new ATOM 723 N LYS A 82 21.274 26.873 15.388 1.00 0.00 N ATOM 724 CA LYS A 82 19.784 26.839 15.354 1.00 0.00 C ATOM 725 C LYS A 82 19.315 26.216 14.038 1.00 0.00 C ATOM 726 O LYS A 82 20.035 26.189 13.059 1.00 0.00 O ATOM 727 CB LYS A 82 19.240 28.264 15.467 1.00 0.00 C ATOM 728 CG LYS A 82 19.662 28.866 16.810 1.00 0.00 C ATOM 729 CD LYS A 82 19.057 30.265 16.953 1.00 0.00 C ATOM 730 CE LYS A 82 19.538 30.899 18.260 1.00 0.00 C ATOM 731 NZ LYS A 82 20.932 31.397 18.087 1.00 0.00 N ATOM 0 H LYS A 82 21.718 27.293 14.571 1.00 0.00 H new ATOM 0 HA LYS A 82 19.416 26.241 16.188 1.00 0.00 H new ATOM 0 HB2 LYS A 82 19.618 28.875 14.647 1.00 0.00 H new ATOM 0 HB3 LYS A 82 18.153 28.257 15.385 1.00 0.00 H new ATOM 0 HG2 LYS A 82 19.328 28.228 17.628 1.00 0.00 H new ATOM 0 HG3 LYS A 82 20.749 28.920 16.871 1.00 0.00 H new ATOM 0 HD2 LYS A 82 19.348 30.887 16.106 1.00 0.00 H new ATOM 0 HD3 LYS A 82 17.969 30.205 16.945 1.00 0.00 H new ATOM 0 HE2 LYS A 82 18.879 31.720 18.542 1.00 0.00 H new ATOM 0 HE3 LYS A 82 19.499 30.168 19.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 21.495 31.151 18.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 21.355 30.958 17.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 20.919 32.430 17.969 1.00 0.00 H new ATOM 745 N MET A 83 18.110 25.715 14.007 1.00 0.00 N ATOM 746 CA MET A 83 17.592 25.095 12.756 1.00 0.00 C ATOM 747 C MET A 83 17.243 26.193 11.750 1.00 0.00 C ATOM 748 O MET A 83 17.177 25.961 10.560 1.00 0.00 O ATOM 749 CB MET A 83 16.338 24.278 13.075 1.00 0.00 C ATOM 750 CG MET A 83 16.692 23.158 14.056 1.00 0.00 C ATOM 751 SD MET A 83 15.219 22.162 14.393 1.00 0.00 S ATOM 752 CE MET A 83 15.851 21.307 15.859 1.00 0.00 C ATOM 0 H MET A 83 17.462 25.709 14.795 1.00 0.00 H new ATOM 0 HA MET A 83 18.354 24.442 12.331 1.00 0.00 H new ATOM 0 HB2 MET A 83 15.571 24.923 13.504 1.00 0.00 H new ATOM 0 HB3 MET A 83 15.924 23.856 12.159 1.00 0.00 H new ATOM 0 HG2 MET A 83 17.480 22.531 13.639 1.00 0.00 H new ATOM 0 HG3 MET A 83 17.078 23.581 14.983 1.00 0.00 H new ATOM 0 HE1 MET A 83 15.707 20.233 15.744 1.00 0.00 H new ATOM 0 HE2 MET A 83 16.914 21.520 15.975 1.00 0.00 H new ATOM 0 HE3 MET A 83 15.314 21.653 16.742 1.00 0.00 H new ATOM 762 N GLU A 84 17.018 27.389 12.222 1.00 0.00 N ATOM 763 CA GLU A 84 16.672 28.503 11.293 1.00 0.00 C ATOM 764 C GLU A 84 17.891 28.849 10.435 1.00 0.00 C ATOM 765 O GLU A 84 17.794 28.992 9.233 1.00 0.00 O ATOM 766 CB GLU A 84 16.254 29.731 12.103 1.00 0.00 C ATOM 767 CG GLU A 84 14.948 29.432 12.844 1.00 0.00 C ATOM 768 CD GLU A 84 13.848 29.110 11.830 1.00 0.00 C ATOM 769 OE1 GLU A 84 14.027 29.435 10.668 1.00 0.00 O ATOM 770 OE2 GLU A 84 12.846 28.544 12.233 1.00 0.00 O ATOM 0 H GLU A 84 17.059 27.643 13.209 1.00 0.00 H new ATOM 0 HA GLU A 84 15.849 28.196 10.648 1.00 0.00 H new ATOM 0 HB2 GLU A 84 17.037 29.994 12.815 1.00 0.00 H new ATOM 0 HB3 GLU A 84 16.122 30.588 11.443 1.00 0.00 H new ATOM 0 HG2 GLU A 84 15.088 28.592 13.524 1.00 0.00 H new ATOM 0 HG3 GLU A 84 14.658 30.289 13.452 1.00 0.00 H new ATOM 777 N SER A 85 19.037 28.985 11.043 1.00 0.00 N ATOM 778 CA SER A 85 20.260 29.323 10.260 1.00 0.00 C ATOM 779 C SER A 85 20.454 28.288 9.150 1.00 0.00 C ATOM 780 O SER A 85 20.909 28.601 8.068 1.00 0.00 O ATOM 781 CB SER A 85 21.478 29.310 11.187 1.00 0.00 C ATOM 782 OG SER A 85 21.204 30.096 12.338 1.00 0.00 O ATOM 0 H SER A 85 19.180 28.877 12.047 1.00 0.00 H new ATOM 0 HA SER A 85 20.149 30.314 9.820 1.00 0.00 H new ATOM 0 HB2 SER A 85 21.715 28.287 11.480 1.00 0.00 H new ATOM 0 HB3 SER A 85 22.351 29.702 10.665 1.00 0.00 H new ATOM 0 HG SER A 85 21.983 30.087 12.933 1.00 0.00 H new ATOM 788 N ALA A 86 20.114 27.056 9.412 1.00 0.00 N ATOM 789 CA ALA A 86 20.279 26.000 8.373 1.00 0.00 C ATOM 790 C ALA A 86 19.178 26.141 7.320 1.00 0.00 C ATOM 791 O ALA A 86 19.358 25.792 6.170 1.00 0.00 O ATOM 792 CB ALA A 86 20.179 24.622 9.030 1.00 0.00 C ATOM 0 H ALA A 86 19.729 26.735 10.300 1.00 0.00 H new ATOM 0 HA ALA A 86 21.253 26.109 7.896 1.00 0.00 H new ATOM 0 HB1 ALA A 86 20.299 23.848 8.272 1.00 0.00 H new ATOM 0 HB2 ALA A 86 20.962 24.519 9.781 1.00 0.00 H new ATOM 0 HB3 ALA A 86 19.204 24.516 9.506 1.00 0.00 H new ATOM 798 N ASP A 87 18.040 26.651 7.702 1.00 0.00 N ATOM 799 CA ASP A 87 16.928 26.812 6.721 1.00 0.00 C ATOM 800 C ASP A 87 17.322 27.847 5.666 1.00 0.00 C ATOM 801 O ASP A 87 17.044 27.688 4.494 1.00 0.00 O ATOM 802 CB ASP A 87 15.669 27.282 7.452 1.00 0.00 C ATOM 803 CG ASP A 87 14.486 27.282 6.481 1.00 0.00 C ATOM 804 OD1 ASP A 87 14.651 26.790 5.377 1.00 0.00 O ATOM 805 OD2 ASP A 87 13.435 27.773 6.858 1.00 0.00 O ATOM 0 H ASP A 87 17.831 26.963 8.650 1.00 0.00 H new ATOM 0 HA ASP A 87 16.732 25.856 6.235 1.00 0.00 H new ATOM 0 HB2 ASP A 87 15.460 26.626 8.297 1.00 0.00 H new ATOM 0 HB3 ASP A 87 15.822 28.283 7.856 1.00 0.00 H new ATOM 810 N GLN A 88 17.966 28.907 6.071 1.00 0.00 N ATOM 811 CA GLN A 88 18.374 29.951 5.089 1.00 0.00 C ATOM 812 C GLN A 88 19.571 29.448 4.279 1.00 0.00 C ATOM 813 O GLN A 88 19.699 29.731 3.104 1.00 0.00 O ATOM 814 CB GLN A 88 18.765 31.228 5.835 1.00 0.00 C ATOM 815 CG GLN A 88 19.085 32.332 4.826 1.00 0.00 C ATOM 816 CD GLN A 88 19.723 33.518 5.552 1.00 0.00 C ATOM 817 OE1 GLN A 88 20.704 33.361 6.250 1.00 0.00 O ATOM 818 NE2 GLN A 88 19.204 34.708 5.416 1.00 0.00 N ATOM 0 H GLN A 88 18.227 29.095 7.039 1.00 0.00 H new ATOM 0 HA GLN A 88 17.542 30.163 4.417 1.00 0.00 H new ATOM 0 HB2 GLN A 88 17.952 31.543 6.489 1.00 0.00 H new ATOM 0 HB3 GLN A 88 19.630 31.040 6.471 1.00 0.00 H new ATOM 0 HG2 GLN A 88 19.762 31.954 4.060 1.00 0.00 H new ATOM 0 HG3 GLN A 88 18.175 32.650 4.318 1.00 0.00 H new ATOM 0 HE21 GLN A 88 18.380 34.841 4.830 1.00 0.00 H new ATOM 0 HE22 GLN A 88 19.623 35.505 5.896 1.00 0.00 H new ATOM 827 N ALA A 89 20.450 28.707 4.896 1.00 0.00 N ATOM 828 CA ALA A 89 21.637 28.190 4.160 1.00 0.00 C ATOM 829 C ALA A 89 21.224 27.000 3.290 1.00 0.00 C ATOM 830 O ALA A 89 21.650 26.868 2.160 1.00 0.00 O ATOM 831 CB ALA A 89 22.703 27.742 5.162 1.00 0.00 C ATOM 0 H ALA A 89 20.397 28.437 5.878 1.00 0.00 H new ATOM 0 HA ALA A 89 22.041 28.979 3.526 1.00 0.00 H new ATOM 0 HB1 ALA A 89 23.572 27.363 4.624 1.00 0.00 H new ATOM 0 HB2 ALA A 89 23.000 28.589 5.781 1.00 0.00 H new ATOM 0 HB3 ALA A 89 22.298 26.954 5.797 1.00 0.00 H new ATOM 837 N VAL A 90 20.399 26.132 3.808 1.00 0.00 N ATOM 838 CA VAL A 90 19.963 24.951 3.009 1.00 0.00 C ATOM 839 C VAL A 90 19.141 25.419 1.806 1.00 0.00 C ATOM 840 O VAL A 90 19.357 24.989 0.691 1.00 0.00 O ATOM 841 CB VAL A 90 19.105 24.033 3.884 1.00 0.00 C ATOM 842 CG1 VAL A 90 18.487 22.934 3.018 1.00 0.00 C ATOM 843 CG2 VAL A 90 19.979 23.398 4.967 1.00 0.00 C ATOM 0 H VAL A 90 20.008 26.189 4.748 1.00 0.00 H new ATOM 0 HA VAL A 90 20.841 24.408 2.659 1.00 0.00 H new ATOM 0 HB VAL A 90 18.312 24.615 4.352 1.00 0.00 H new ATOM 0 HG11 VAL A 90 17.876 22.280 3.641 1.00 0.00 H new ATOM 0 HG12 VAL A 90 17.864 23.386 2.246 1.00 0.00 H new ATOM 0 HG13 VAL A 90 19.280 22.351 2.549 1.00 0.00 H new ATOM 0 HG21 VAL A 90 19.369 22.744 5.590 1.00 0.00 H new ATOM 0 HG22 VAL A 90 20.773 22.816 4.499 1.00 0.00 H new ATOM 0 HG23 VAL A 90 20.419 24.181 5.585 1.00 0.00 H new ATOM 853 N ALA A 91 18.199 26.296 2.022 1.00 0.00 N ATOM 854 CA ALA A 91 17.365 26.787 0.889 1.00 0.00 C ATOM 855 C ALA A 91 18.193 27.731 0.014 1.00 0.00 C ATOM 856 O ALA A 91 18.099 27.710 -1.197 1.00 0.00 O ATOM 857 CB ALA A 91 16.150 27.536 1.440 1.00 0.00 C ATOM 0 H ALA A 91 17.971 26.693 2.933 1.00 0.00 H new ATOM 0 HA ALA A 91 17.031 25.940 0.290 1.00 0.00 H new ATOM 0 HB1 ALA A 91 15.539 27.896 0.613 1.00 0.00 H new ATOM 0 HB2 ALA A 91 15.559 26.863 2.062 1.00 0.00 H new ATOM 0 HB3 ALA A 91 16.485 28.383 2.039 1.00 0.00 H new ATOM 863 N GLU A 92 19.000 28.560 0.616 1.00 0.00 N ATOM 864 CA GLU A 92 19.831 29.504 -0.183 1.00 0.00 C ATOM 865 C GLU A 92 20.979 28.743 -0.849 1.00 0.00 C ATOM 866 O GLU A 92 21.209 28.861 -2.036 1.00 0.00 O ATOM 867 CB GLU A 92 20.401 30.585 0.738 1.00 0.00 C ATOM 868 CG GLU A 92 21.061 31.677 -0.104 1.00 0.00 C ATOM 869 CD GLU A 92 20.017 32.311 -1.027 1.00 0.00 C ATOM 870 OE1 GLU A 92 18.850 32.292 -0.670 1.00 0.00 O ATOM 871 OE2 GLU A 92 20.402 32.804 -2.073 1.00 0.00 O ATOM 0 H GLU A 92 19.120 28.625 1.627 1.00 0.00 H new ATOM 0 HA GLU A 92 19.213 29.968 -0.952 1.00 0.00 H new ATOM 0 HB2 GLU A 92 19.606 31.013 1.349 1.00 0.00 H new ATOM 0 HB3 GLU A 92 21.129 30.148 1.422 1.00 0.00 H new ATOM 0 HG2 GLU A 92 21.498 32.437 0.544 1.00 0.00 H new ATOM 0 HG3 GLU A 92 21.875 31.255 -0.694 1.00 0.00 H new ATOM 878 N LEU A 93 21.704 27.964 -0.094 1.00 0.00 N ATOM 879 CA LEU A 93 22.838 27.200 -0.685 1.00 0.00 C ATOM 880 C LEU A 93 22.298 26.175 -1.687 1.00 0.00 C ATOM 881 O LEU A 93 22.877 25.948 -2.730 1.00 0.00 O ATOM 882 CB LEU A 93 23.600 26.475 0.426 1.00 0.00 C ATOM 883 CG LEU A 93 24.101 27.497 1.449 1.00 0.00 C ATOM 884 CD1 LEU A 93 24.567 26.771 2.711 1.00 0.00 C ATOM 885 CD2 LEU A 93 25.269 28.283 0.852 1.00 0.00 C ATOM 0 H LEU A 93 21.560 27.824 0.906 1.00 0.00 H new ATOM 0 HA LEU A 93 23.510 27.888 -1.197 1.00 0.00 H new ATOM 0 HB2 LEU A 93 22.951 25.746 0.911 1.00 0.00 H new ATOM 0 HB3 LEU A 93 24.440 25.923 0.005 1.00 0.00 H new ATOM 0 HG LEU A 93 23.293 28.183 1.703 1.00 0.00 H new ATOM 0 HD11 LEU A 93 24.924 27.500 3.439 1.00 0.00 H new ATOM 0 HD12 LEU A 93 23.735 26.210 3.136 1.00 0.00 H new ATOM 0 HD13 LEU A 93 25.375 26.085 2.458 1.00 0.00 H new ATOM 0 HD21 LEU A 93 25.627 29.011 1.580 1.00 0.00 H new ATOM 0 HD22 LEU A 93 26.077 27.597 0.598 1.00 0.00 H new ATOM 0 HD23 LEU A 93 24.937 28.802 -0.047 1.00 0.00 H new ATOM 897 N ASN A 94 21.192 25.555 -1.378 1.00 0.00 N ATOM 898 CA ASN A 94 20.618 24.547 -2.313 1.00 0.00 C ATOM 899 C ASN A 94 20.128 25.247 -3.582 1.00 0.00 C ATOM 900 O ASN A 94 19.397 26.216 -3.524 1.00 0.00 O ATOM 901 CB ASN A 94 19.445 23.835 -1.639 1.00 0.00 C ATOM 902 CG ASN A 94 18.970 22.680 -2.524 1.00 0.00 C ATOM 903 OD1 ASN A 94 19.514 22.451 -3.586 1.00 0.00 O ATOM 904 ND2 ASN A 94 17.972 21.940 -2.128 1.00 0.00 N ATOM 0 H ASN A 94 20.662 25.703 -0.519 1.00 0.00 H new ATOM 0 HA ASN A 94 21.385 23.817 -2.574 1.00 0.00 H new ATOM 0 HB2 ASN A 94 19.748 23.458 -0.662 1.00 0.00 H new ATOM 0 HB3 ASN A 94 18.628 24.537 -1.470 1.00 0.00 H new ATOM 0 HD21 ASN A 94 17.647 21.168 -2.710 1.00 0.00 H new ATOM 0 HD22 ASN A 94 17.516 22.133 -1.236 1.00 0.00 H new ATOM 911 N GLY A 95 20.523 24.765 -4.728 1.00 0.00 N ATOM 912 CA GLY A 95 20.079 25.404 -5.999 1.00 0.00 C ATOM 913 C GLY A 95 21.182 26.328 -6.520 1.00 0.00 C ATOM 914 O GLY A 95 20.949 27.179 -7.354 1.00 0.00 O ATOM 0 H GLY A 95 21.134 23.956 -4.839 1.00 0.00 H new ATOM 0 HA2 GLY A 95 19.850 24.640 -6.742 1.00 0.00 H new ATOM 0 HA3 GLY A 95 19.163 25.972 -5.832 1.00 0.00 H new ATOM 918 N THR A 96 22.384 26.164 -6.037 1.00 0.00 N ATOM 919 CA THR A 96 23.500 27.033 -6.507 1.00 0.00 C ATOM 920 C THR A 96 24.546 26.177 -7.223 1.00 0.00 C ATOM 921 O THR A 96 24.620 24.980 -7.030 1.00 0.00 O ATOM 922 CB THR A 96 24.145 27.729 -5.306 1.00 0.00 C ATOM 923 OG1 THR A 96 24.950 26.797 -4.598 1.00 0.00 O ATOM 924 CG2 THR A 96 23.055 28.272 -4.382 1.00 0.00 C ATOM 0 H THR A 96 22.641 25.467 -5.338 1.00 0.00 H new ATOM 0 HA THR A 96 23.111 27.783 -7.196 1.00 0.00 H new ATOM 0 HB THR A 96 24.766 28.555 -5.654 1.00 0.00 H new ATOM 0 HG1 THR A 96 24.419 26.378 -3.889 1.00 0.00 H new ATOM 0 HG21 THR A 96 23.516 28.767 -3.527 1.00 0.00 H new ATOM 0 HG22 THR A 96 22.439 28.987 -4.927 1.00 0.00 H new ATOM 0 HG23 THR A 96 22.432 27.449 -4.032 1.00 0.00 H new ATOM 932 N GLN A 97 25.355 26.781 -8.051 1.00 0.00 N ATOM 933 CA GLN A 97 26.395 26.000 -8.778 1.00 0.00 C ATOM 934 C GLN A 97 27.777 26.582 -8.473 1.00 0.00 C ATOM 935 O GLN A 97 27.955 27.781 -8.406 1.00 0.00 O ATOM 936 CB GLN A 97 26.131 26.076 -10.283 1.00 0.00 C ATOM 937 CG GLN A 97 27.167 25.229 -11.026 1.00 0.00 C ATOM 938 CD GLN A 97 26.947 25.362 -12.534 1.00 0.00 C ATOM 939 OE1 GLN A 97 25.973 25.942 -12.970 1.00 0.00 O ATOM 940 NE2 GLN A 97 27.821 24.846 -13.356 1.00 0.00 N ATOM 0 H GLN A 97 25.340 27.780 -8.255 1.00 0.00 H new ATOM 0 HA GLN A 97 26.359 24.960 -8.455 1.00 0.00 H new ATOM 0 HB2 GLN A 97 25.126 25.718 -10.505 1.00 0.00 H new ATOM 0 HB3 GLN A 97 26.182 27.111 -10.620 1.00 0.00 H new ATOM 0 HG2 GLN A 97 28.174 25.555 -10.764 1.00 0.00 H new ATOM 0 HG3 GLN A 97 27.082 24.185 -10.726 1.00 0.00 H new ATOM 0 HE21 GLN A 97 28.639 24.359 -12.991 1.00 0.00 H new ATOM 0 HE22 GLN A 97 27.685 24.930 -14.363 1.00 0.00 H new ATOM 949 N VAL A 98 28.757 25.741 -8.288 1.00 0.00 N ATOM 950 CA VAL A 98 30.127 26.247 -7.987 1.00 0.00 C ATOM 951 C VAL A 98 30.817 26.648 -9.294 1.00 0.00 C ATOM 952 O VAL A 98 30.172 26.927 -10.285 1.00 0.00 O ATOM 953 CB VAL A 98 30.941 25.149 -7.295 1.00 0.00 C ATOM 954 CG1 VAL A 98 31.965 25.790 -6.355 1.00 0.00 C ATOM 955 CG2 VAL A 98 30.008 24.246 -6.486 1.00 0.00 C ATOM 0 H VAL A 98 28.669 24.726 -8.332 1.00 0.00 H new ATOM 0 HA VAL A 98 30.058 27.113 -7.329 1.00 0.00 H new ATOM 0 HB VAL A 98 31.456 24.554 -8.049 1.00 0.00 H new ATOM 0 HG11 VAL A 98 32.545 25.010 -5.862 1.00 0.00 H new ATOM 0 HG12 VAL A 98 32.634 26.431 -6.929 1.00 0.00 H new ATOM 0 HG13 VAL A 98 31.446 26.386 -5.604 1.00 0.00 H new ATOM 0 HG21 VAL A 98 30.591 23.467 -5.996 1.00 0.00 H new ATOM 0 HG22 VAL A 98 29.490 24.840 -5.733 1.00 0.00 H new ATOM 0 HG23 VAL A 98 29.277 23.787 -7.152 1.00 0.00 H new ATOM 965 N GLU A 99 32.121 26.682 -9.304 1.00 0.00 N ATOM 966 CA GLU A 99 32.846 27.066 -10.547 1.00 0.00 C ATOM 967 C GLU A 99 32.507 26.077 -11.665 1.00 0.00 C ATOM 968 O GLU A 99 32.356 26.450 -12.811 1.00 0.00 O ATOM 969 CB GLU A 99 34.354 27.043 -10.287 1.00 0.00 C ATOM 970 CG GLU A 99 34.698 28.051 -9.189 1.00 0.00 C ATOM 971 CD GLU A 99 34.419 29.469 -9.693 1.00 0.00 C ATOM 972 OE1 GLU A 99 34.254 29.629 -10.892 1.00 0.00 O ATOM 973 OE2 GLU A 99 34.375 30.370 -8.873 1.00 0.00 O ATOM 0 H GLU A 99 32.715 26.460 -8.505 1.00 0.00 H new ATOM 0 HA GLU A 99 32.543 28.069 -10.846 1.00 0.00 H new ATOM 0 HB2 GLU A 99 34.667 26.043 -9.988 1.00 0.00 H new ATOM 0 HB3 GLU A 99 34.895 27.286 -11.201 1.00 0.00 H new ATOM 0 HG2 GLU A 99 34.107 27.848 -8.296 1.00 0.00 H new ATOM 0 HG3 GLU A 99 35.746 27.954 -8.906 1.00 0.00 H new ATOM 980 N SER A 100 32.386 24.818 -11.341 1.00 0.00 N ATOM 981 CA SER A 100 32.056 23.809 -12.385 1.00 0.00 C ATOM 982 C SER A 100 31.377 22.602 -11.736 1.00 0.00 C ATOM 983 O SER A 100 31.401 21.507 -12.262 1.00 0.00 O ATOM 984 CB SER A 100 33.342 23.357 -13.081 1.00 0.00 C ATOM 985 OG SER A 100 33.118 22.114 -13.731 1.00 0.00 O ATOM 0 H SER A 100 32.502 24.446 -10.398 1.00 0.00 H new ATOM 0 HA SER A 100 31.382 24.253 -13.117 1.00 0.00 H new ATOM 0 HB2 SER A 100 33.658 24.107 -13.806 1.00 0.00 H new ATOM 0 HB3 SER A 100 34.147 23.259 -12.353 1.00 0.00 H new ATOM 0 HG SER A 100 32.857 21.441 -13.068 1.00 0.00 H new ATOM 991 N VAL A 101 30.770 22.792 -10.597 1.00 0.00 N ATOM 992 CA VAL A 101 30.088 21.655 -9.917 1.00 0.00 C ATOM 993 C VAL A 101 28.780 22.144 -9.291 1.00 0.00 C ATOM 994 O VAL A 101 28.621 23.312 -8.997 1.00 0.00 O ATOM 995 CB VAL A 101 30.999 21.095 -8.823 1.00 0.00 C ATOM 996 CG1 VAL A 101 30.317 19.898 -8.156 1.00 0.00 C ATOM 997 CG2 VAL A 101 32.325 20.647 -9.441 1.00 0.00 C ATOM 0 H VAL A 101 30.717 23.685 -10.108 1.00 0.00 H new ATOM 0 HA VAL A 101 29.872 20.874 -10.645 1.00 0.00 H new ATOM 0 HB VAL A 101 31.189 21.868 -8.078 1.00 0.00 H new ATOM 0 HG11 VAL A 101 30.965 19.498 -7.376 1.00 0.00 H new ATOM 0 HG12 VAL A 101 29.373 20.217 -7.715 1.00 0.00 H new ATOM 0 HG13 VAL A 101 30.127 19.126 -8.901 1.00 0.00 H new ATOM 0 HG21 VAL A 101 32.974 20.248 -8.661 1.00 0.00 H new ATOM 0 HG22 VAL A 101 32.136 19.874 -10.186 1.00 0.00 H new ATOM 0 HG23 VAL A 101 32.811 21.499 -9.917 1.00 0.00 H new ATOM 1007 N GLN A 102 27.842 21.261 -9.086 1.00 0.00 N ATOM 1008 CA GLN A 102 26.546 21.677 -8.480 1.00 0.00 C ATOM 1009 C GLN A 102 26.561 21.366 -6.982 1.00 0.00 C ATOM 1010 O GLN A 102 27.100 20.365 -6.552 1.00 0.00 O ATOM 1011 CB GLN A 102 25.402 20.914 -9.149 1.00 0.00 C ATOM 1012 CG GLN A 102 25.346 21.276 -10.634 1.00 0.00 C ATOM 1013 CD GLN A 102 24.223 20.488 -11.309 1.00 0.00 C ATOM 1014 OE1 GLN A 102 23.727 19.524 -10.762 1.00 0.00 O ATOM 1015 NE2 GLN A 102 23.796 20.862 -12.485 1.00 0.00 N ATOM 0 H GLN A 102 27.917 20.269 -9.312 1.00 0.00 H new ATOM 0 HA GLN A 102 26.403 22.747 -8.627 1.00 0.00 H new ATOM 0 HB2 GLN A 102 25.549 19.840 -9.031 1.00 0.00 H new ATOM 0 HB3 GLN A 102 24.456 21.161 -8.668 1.00 0.00 H new ATOM 0 HG2 GLN A 102 25.176 22.346 -10.752 1.00 0.00 H new ATOM 0 HG3 GLN A 102 26.300 21.051 -11.110 1.00 0.00 H new ATOM 0 HE21 GLN A 102 24.212 21.672 -12.945 1.00 0.00 H new ATOM 0 HE22 GLN A 102 23.046 20.344 -12.944 1.00 0.00 H new ATOM 1024 N LEU A 103 25.971 22.213 -6.184 1.00 0.00 N ATOM 1025 CA LEU A 103 25.952 21.964 -4.715 1.00 0.00 C ATOM 1026 C LEU A 103 24.582 21.415 -4.309 1.00 0.00 C ATOM 1027 O LEU A 103 23.560 21.829 -4.819 1.00 0.00 O ATOM 1028 CB LEU A 103 26.216 23.274 -3.971 1.00 0.00 C ATOM 1029 CG LEU A 103 27.636 23.755 -4.275 1.00 0.00 C ATOM 1030 CD1 LEU A 103 27.883 25.092 -3.572 1.00 0.00 C ATOM 1031 CD2 LEU A 103 28.644 22.720 -3.771 1.00 0.00 C ATOM 0 H LEU A 103 25.501 23.067 -6.486 1.00 0.00 H new ATOM 0 HA LEU A 103 26.725 21.239 -4.460 1.00 0.00 H new ATOM 0 HB2 LEU A 103 25.492 24.030 -4.275 1.00 0.00 H new ATOM 0 HB3 LEU A 103 26.092 23.127 -2.898 1.00 0.00 H new ATOM 0 HG LEU A 103 27.754 23.883 -5.351 1.00 0.00 H new ATOM 0 HD11 LEU A 103 28.895 25.435 -3.788 1.00 0.00 H new ATOM 0 HD12 LEU A 103 27.165 25.830 -3.931 1.00 0.00 H new ATOM 0 HD13 LEU A 103 27.765 24.964 -2.496 1.00 0.00 H new ATOM 0 HD21 LEU A 103 29.656 23.062 -3.987 1.00 0.00 H new ATOM 0 HD22 LEU A 103 28.527 22.592 -2.695 1.00 0.00 H new ATOM 0 HD23 LEU A 103 28.468 21.768 -4.271 1.00 0.00 H new ATOM 1043 N LYS A 104 24.554 20.487 -3.393 1.00 0.00 N ATOM 1044 CA LYS A 104 23.251 19.913 -2.953 1.00 0.00 C ATOM 1045 C LYS A 104 23.190 19.904 -1.425 1.00 0.00 C ATOM 1046 O LYS A 104 24.129 19.517 -0.758 1.00 0.00 O ATOM 1047 CB LYS A 104 23.121 18.481 -3.477 1.00 0.00 C ATOM 1048 CG LYS A 104 23.178 18.492 -5.007 1.00 0.00 C ATOM 1049 CD LYS A 104 22.966 17.072 -5.536 1.00 0.00 C ATOM 1050 CE LYS A 104 21.534 16.624 -5.232 1.00 0.00 C ATOM 1051 NZ LYS A 104 21.566 15.444 -4.322 1.00 0.00 N ATOM 0 H LYS A 104 25.377 20.101 -2.930 1.00 0.00 H new ATOM 0 HA LYS A 104 22.435 20.519 -3.347 1.00 0.00 H new ATOM 0 HB2 LYS A 104 23.923 17.861 -3.077 1.00 0.00 H new ATOM 0 HB3 LYS A 104 22.182 18.043 -3.140 1.00 0.00 H new ATOM 0 HG2 LYS A 104 22.412 19.158 -5.405 1.00 0.00 H new ATOM 0 HG3 LYS A 104 24.141 18.877 -5.343 1.00 0.00 H new ATOM 0 HD2 LYS A 104 23.148 17.041 -6.610 1.00 0.00 H new ATOM 0 HD3 LYS A 104 23.678 16.389 -5.073 1.00 0.00 H new ATOM 0 HE2 LYS A 104 20.977 17.439 -4.769 1.00 0.00 H new ATOM 0 HE3 LYS A 104 21.017 16.369 -6.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 20.594 15.139 -4.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 22.083 14.666 -4.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 22.044 15.702 -3.435 1.00 0.00 H new ATOM 1065 N VAL A 105 22.091 20.331 -0.862 1.00 0.00 N ATOM 1066 CA VAL A 105 21.974 20.347 0.623 1.00 0.00 C ATOM 1067 C VAL A 105 20.831 19.428 1.059 1.00 0.00 C ATOM 1068 O VAL A 105 19.760 19.438 0.485 1.00 0.00 O ATOM 1069 CB VAL A 105 21.688 21.775 1.095 1.00 0.00 C ATOM 1070 CG1 VAL A 105 21.801 21.839 2.620 1.00 0.00 C ATOM 1071 CG2 VAL A 105 22.703 22.733 0.467 1.00 0.00 C ATOM 0 H VAL A 105 21.271 20.669 -1.366 1.00 0.00 H new ATOM 0 HA VAL A 105 22.907 19.996 1.063 1.00 0.00 H new ATOM 0 HB VAL A 105 20.681 22.064 0.792 1.00 0.00 H new ATOM 0 HG11 VAL A 105 21.598 22.855 2.958 1.00 0.00 H new ATOM 0 HG12 VAL A 105 21.078 21.157 3.067 1.00 0.00 H new ATOM 0 HG13 VAL A 105 22.808 21.551 2.923 1.00 0.00 H new ATOM 0 HG21 VAL A 105 22.500 23.750 0.803 1.00 0.00 H new ATOM 0 HG22 VAL A 105 23.710 22.446 0.769 1.00 0.00 H new ATOM 0 HG23 VAL A 105 22.623 22.687 -0.619 1.00 0.00 H new ATOM 1081 N ASN A 106 21.051 18.636 2.071 1.00 0.00 N ATOM 1082 CA ASN A 106 19.979 17.719 2.549 1.00 0.00 C ATOM 1083 C ASN A 106 19.897 17.785 4.075 1.00 0.00 C ATOM 1084 O ASN A 106 20.618 18.527 4.712 1.00 0.00 O ATOM 1085 CB ASN A 106 20.301 16.286 2.116 1.00 0.00 C ATOM 1086 CG ASN A 106 20.396 16.220 0.592 1.00 0.00 C ATOM 1087 OD1 ASN A 106 21.170 15.454 0.054 1.00 0.00 O ATOM 1088 ND2 ASN A 106 19.638 16.994 -0.128 1.00 0.00 N ATOM 0 H ASN A 106 21.928 18.584 2.589 1.00 0.00 H new ATOM 0 HA ASN A 106 19.024 18.021 2.120 1.00 0.00 H new ATOM 0 HB2 ASN A 106 21.241 15.963 2.563 1.00 0.00 H new ATOM 0 HB3 ASN A 106 19.528 15.605 2.472 1.00 0.00 H new ATOM 0 HD21 ASN A 106 19.693 16.958 -1.146 1.00 0.00 H new ATOM 0 HD22 ASN A 106 18.989 17.637 0.325 1.00 0.00 H new ATOM 1095 N ILE A 107 19.026 17.016 4.667 1.00 0.00 N ATOM 1096 CA ILE A 107 18.902 17.040 6.152 1.00 0.00 C ATOM 1097 C ILE A 107 19.461 15.738 6.733 1.00 0.00 C ATOM 1098 O ILE A 107 19.171 14.659 6.256 1.00 0.00 O ATOM 1099 CB ILE A 107 17.429 17.181 6.539 1.00 0.00 C ATOM 1100 CG1 ILE A 107 16.854 18.449 5.908 1.00 0.00 C ATOM 1101 CG2 ILE A 107 17.308 17.268 8.062 1.00 0.00 C ATOM 1102 CD1 ILE A 107 15.408 18.640 6.371 1.00 0.00 C ATOM 0 H ILE A 107 18.396 16.373 4.188 1.00 0.00 H new ATOM 0 HA ILE A 107 19.464 17.885 6.549 1.00 0.00 H new ATOM 0 HB ILE A 107 16.875 16.314 6.179 1.00 0.00 H new ATOM 0 HG12 ILE A 107 17.455 19.313 6.191 1.00 0.00 H new ATOM 0 HG13 ILE A 107 16.892 18.376 4.821 1.00 0.00 H new ATOM 0 HG21 ILE A 107 16.258 17.369 8.338 1.00 0.00 H new ATOM 0 HG22 ILE A 107 17.717 16.363 8.512 1.00 0.00 H new ATOM 0 HG23 ILE A 107 17.863 18.134 8.422 1.00 0.00 H new ATOM 0 HD11 ILE A 107 14.998 19.544 5.921 1.00 0.00 H new ATOM 0 HD12 ILE A 107 14.812 17.780 6.066 1.00 0.00 H new ATOM 0 HD13 ILE A 107 15.383 18.732 7.457 1.00 0.00 H new ATOM 1114 N ALA A 108 20.260 15.832 7.761 1.00 0.00 N ATOM 1115 CA ALA A 108 20.837 14.602 8.372 1.00 0.00 C ATOM 1116 C ALA A 108 20.263 14.414 9.778 1.00 0.00 C ATOM 1117 O ALA A 108 19.739 15.335 10.374 1.00 0.00 O ATOM 1118 CB ALA A 108 22.359 14.741 8.459 1.00 0.00 C ATOM 0 H ALA A 108 20.538 16.708 8.204 1.00 0.00 H new ATOM 0 HA ALA A 108 20.585 13.738 7.757 1.00 0.00 H new ATOM 0 HB1 ALA A 108 22.782 13.841 8.906 1.00 0.00 H new ATOM 0 HB2 ALA A 108 22.770 14.876 7.458 1.00 0.00 H new ATOM 0 HB3 ALA A 108 22.611 15.605 9.075 1.00 0.00 H new ATOM 1124 N ARG A 109 20.357 13.228 10.315 1.00 0.00 N ATOM 1125 CA ARG A 109 19.816 12.984 11.681 1.00 0.00 C ATOM 1126 C ARG A 109 20.250 14.118 12.610 1.00 0.00 C ATOM 1127 O ARG A 109 21.337 14.650 12.490 1.00 0.00 O ATOM 1128 CB ARG A 109 20.353 11.655 12.214 1.00 0.00 C ATOM 1129 CG ARG A 109 19.587 11.267 13.480 1.00 0.00 C ATOM 1130 CD ARG A 109 20.179 9.983 14.062 1.00 0.00 C ATOM 1131 NE ARG A 109 19.328 9.507 15.189 1.00 0.00 N ATOM 1132 CZ ARG A 109 18.081 9.188 14.975 1.00 0.00 C ATOM 1133 NH1 ARG A 109 17.693 8.840 13.779 1.00 0.00 N ATOM 1134 NH2 ARG A 109 17.223 9.216 15.958 1.00 0.00 N ATOM 0 H ARG A 109 20.785 12.418 9.866 1.00 0.00 H new ATOM 0 HA ARG A 109 18.728 12.944 11.638 1.00 0.00 H new ATOM 0 HB2 ARG A 109 20.245 10.877 11.458 1.00 0.00 H new ATOM 0 HB3 ARG A 109 21.417 11.742 12.432 1.00 0.00 H new ATOM 0 HG2 ARG A 109 19.645 12.071 14.213 1.00 0.00 H new ATOM 0 HG3 ARG A 109 18.532 11.121 13.249 1.00 0.00 H new ATOM 0 HD2 ARG A 109 20.240 9.216 13.290 1.00 0.00 H new ATOM 0 HD3 ARG A 109 21.195 10.165 14.412 1.00 0.00 H new ATOM 0 HE ARG A 109 19.720 9.431 16.127 1.00 0.00 H new ATOM 0 HH11 ARG A 109 18.364 8.817 13.011 1.00 0.00 H new ATOM 0 HH12 ARG A 109 16.718 8.591 13.611 1.00 0.00 H new ATOM 0 HH21 ARG A 109 17.527 9.487 16.893 1.00 0.00 H new ATOM 0 HH22 ARG A 109 16.248 8.967 15.791 1.00 0.00 H new ATOM 1148 N LYS A 110 19.412 14.495 13.536 1.00 0.00 N ATOM 1149 CA LYS A 110 19.778 15.596 14.470 1.00 0.00 C ATOM 1150 C LYS A 110 20.960 15.158 15.339 1.00 0.00 C ATOM 1151 O LYS A 110 21.133 13.989 15.623 1.00 0.00 O ATOM 1152 CB LYS A 110 18.580 15.926 15.363 1.00 0.00 C ATOM 1153 CG LYS A 110 17.402 16.364 14.489 1.00 0.00 C ATOM 1154 CD LYS A 110 16.232 16.784 15.381 1.00 0.00 C ATOM 1155 CE LYS A 110 15.014 17.091 14.509 1.00 0.00 C ATOM 1156 NZ LYS A 110 14.054 17.936 15.275 1.00 0.00 N ATOM 0 H LYS A 110 18.489 14.088 13.686 1.00 0.00 H new ATOM 0 HA LYS A 110 20.058 16.480 13.898 1.00 0.00 H new ATOM 0 HB2 LYS A 110 18.303 15.054 15.956 1.00 0.00 H new ATOM 0 HB3 LYS A 110 18.842 16.719 16.064 1.00 0.00 H new ATOM 0 HG2 LYS A 110 17.700 17.193 13.848 1.00 0.00 H new ATOM 0 HG3 LYS A 110 17.099 15.548 13.834 1.00 0.00 H new ATOM 0 HD2 LYS A 110 15.996 15.989 16.088 1.00 0.00 H new ATOM 0 HD3 LYS A 110 16.504 17.662 15.967 1.00 0.00 H new ATOM 0 HE2 LYS A 110 15.325 17.607 13.601 1.00 0.00 H new ATOM 0 HE3 LYS A 110 14.532 16.164 14.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 13.083 17.612 15.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 14.258 17.859 16.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 14.150 18.928 14.977 1.00 0.00 H new ATOM 1170 N GLN A 111 21.774 16.087 15.758 1.00 0.00 N ATOM 1171 CA GLN A 111 22.947 15.723 16.604 1.00 0.00 C ATOM 1172 C GLN A 111 22.467 15.298 17.994 1.00 0.00 C ATOM 1173 O GLN A 111 21.447 15.750 18.476 1.00 0.00 O ATOM 1174 CB GLN A 111 23.875 16.930 16.730 1.00 0.00 C ATOM 1175 CG GLN A 111 23.077 18.136 17.232 1.00 0.00 C ATOM 1176 CD GLN A 111 23.483 19.382 16.443 1.00 0.00 C ATOM 1177 OE1 GLN A 111 24.294 20.165 16.895 1.00 0.00 O ATOM 1178 NE2 GLN A 111 22.945 19.598 15.275 1.00 0.00 N ATOM 0 H GLN A 111 21.679 17.081 15.552 1.00 0.00 H new ATOM 0 HA GLN A 111 23.486 14.896 16.141 1.00 0.00 H new ATOM 0 HB2 GLN A 111 24.689 16.706 17.420 1.00 0.00 H new ATOM 0 HB3 GLN A 111 24.328 17.156 15.765 1.00 0.00 H new ATOM 0 HG2 GLN A 111 22.009 17.952 17.117 1.00 0.00 H new ATOM 0 HG3 GLN A 111 23.261 18.290 18.295 1.00 0.00 H new ATOM 0 HE21 GLN A 111 22.264 18.939 14.897 1.00 0.00 H new ATOM 0 HE22 GLN A 111 23.205 20.426 14.739 1.00 0.00 H new ATOM 1187 N PRO A 112 23.222 14.397 18.642 1.00 0.00 N ATOM 1188 CA PRO A 112 22.881 13.888 19.977 1.00 0.00 C ATOM 1189 C PRO A 112 23.144 14.912 21.087 1.00 0.00 C ATOM 1190 O PRO A 112 22.556 14.848 22.149 1.00 0.00 O ATOM 1191 CB PRO A 112 23.816 12.693 20.152 1.00 0.00 C ATOM 1192 CG PRO A 112 24.983 12.987 19.267 1.00 0.00 C ATOM 1193 CD PRO A 112 24.464 13.805 18.118 1.00 0.00 C ATOM 0 HA PRO A 112 21.821 13.646 20.050 1.00 0.00 H new ATOM 0 HB2 PRO A 112 24.126 12.582 21.191 1.00 0.00 H new ATOM 0 HB3 PRO A 112 23.326 11.763 19.865 1.00 0.00 H new ATOM 0 HG2 PRO A 112 25.753 13.532 19.812 1.00 0.00 H new ATOM 0 HG3 PRO A 112 25.439 12.064 18.909 1.00 0.00 H new ATOM 0 HD2 PRO A 112 25.178 14.572 17.819 1.00 0.00 H new ATOM 0 HD3 PRO A 112 24.274 13.187 17.241 1.00 0.00 H new ATOM 1201 N MET A 113 24.024 15.848 20.864 1.00 0.00 N ATOM 1202 CA MET A 113 24.313 16.857 21.926 1.00 0.00 C ATOM 1203 C MET A 113 23.010 17.527 22.362 1.00 0.00 C ATOM 1204 O MET A 113 22.901 18.039 23.457 1.00 0.00 O ATOM 1205 CB MET A 113 25.272 17.921 21.387 1.00 0.00 C ATOM 1206 CG MET A 113 26.520 17.249 20.810 1.00 0.00 C ATOM 1207 SD MET A 113 27.227 18.297 19.514 1.00 0.00 S ATOM 1208 CE MET A 113 25.730 18.454 18.508 1.00 0.00 C ATOM 0 H MET A 113 24.553 15.959 19.999 1.00 0.00 H new ATOM 0 HA MET A 113 24.772 16.356 22.778 1.00 0.00 H new ATOM 0 HB2 MET A 113 24.777 18.513 20.617 1.00 0.00 H new ATOM 0 HB3 MET A 113 25.554 18.608 22.185 1.00 0.00 H new ATOM 0 HG2 MET A 113 27.254 17.083 21.599 1.00 0.00 H new ATOM 0 HG3 MET A 113 26.264 16.271 20.402 1.00 0.00 H new ATOM 0 HE1 MET A 113 26.001 18.469 17.452 1.00 0.00 H new ATOM 0 HE2 MET A 113 25.071 17.608 18.702 1.00 0.00 H new ATOM 0 HE3 MET A 113 25.215 19.380 18.764 1.00 0.00 H new ATOM 1218 N LEU A 114 22.021 17.530 21.512 1.00 0.00 N ATOM 1219 CA LEU A 114 20.728 18.172 21.880 1.00 0.00 C ATOM 1220 C LEU A 114 19.710 17.954 20.760 1.00 0.00 C ATOM 1221 O LEU A 114 18.832 18.764 20.542 1.00 0.00 O ATOM 1222 CB LEU A 114 20.946 19.672 22.070 1.00 0.00 C ATOM 1223 CG LEU A 114 19.645 20.318 22.550 1.00 0.00 C ATOM 1224 CD1 LEU A 114 19.932 21.201 23.765 1.00 0.00 C ATOM 1225 CD2 LEU A 114 19.055 21.172 21.426 1.00 0.00 C ATOM 0 H LEU A 114 22.052 17.116 20.580 1.00 0.00 H new ATOM 0 HA LEU A 114 20.355 17.731 22.804 1.00 0.00 H new ATOM 0 HB2 LEU A 114 21.741 19.846 22.796 1.00 0.00 H new ATOM 0 HB3 LEU A 114 21.266 20.126 21.132 1.00 0.00 H new ATOM 0 HG LEU A 114 18.933 19.540 22.827 1.00 0.00 H new ATOM 0 HD11 LEU A 114 19.005 21.661 24.107 1.00 0.00 H new ATOM 0 HD12 LEU A 114 20.352 20.593 24.566 1.00 0.00 H new ATOM 0 HD13 LEU A 114 20.644 21.979 23.489 1.00 0.00 H new ATOM 0 HD21 LEU A 114 18.128 21.633 21.767 1.00 0.00 H new ATOM 0 HD22 LEU A 114 19.766 21.950 21.149 1.00 0.00 H new ATOM 0 HD23 LEU A 114 18.850 20.543 20.560 1.00 0.00 H new ATOM 1237 N ASP A 115 19.823 16.872 20.044 1.00 0.00 N ATOM 1238 CA ASP A 115 18.862 16.618 18.937 1.00 0.00 C ATOM 1239 C ASP A 115 18.743 17.882 18.086 1.00 0.00 C ATOM 1240 O ASP A 115 17.683 18.220 17.598 1.00 0.00 O ATOM 1241 CB ASP A 115 17.494 16.257 19.518 1.00 0.00 C ATOM 1242 CG ASP A 115 17.608 14.962 20.324 1.00 0.00 C ATOM 1243 OD1 ASP A 115 18.593 14.263 20.148 1.00 0.00 O ATOM 1244 OD2 ASP A 115 16.711 14.691 21.105 1.00 0.00 O ATOM 0 H ASP A 115 20.536 16.155 20.176 1.00 0.00 H new ATOM 0 HA ASP A 115 19.216 15.791 18.321 1.00 0.00 H new ATOM 0 HB2 ASP A 115 17.133 17.064 20.156 1.00 0.00 H new ATOM 0 HB3 ASP A 115 16.767 16.136 18.715 1.00 0.00 H new ATOM 1249 N ALA A 116 19.829 18.585 17.911 1.00 0.00 N ATOM 1250 CA ALA A 116 19.796 19.833 17.098 1.00 0.00 C ATOM 1251 C ALA A 116 19.142 20.954 17.904 1.00 0.00 C ATOM 1252 O ALA A 116 19.813 21.774 18.499 1.00 0.00 O ATOM 1253 CB ALA A 116 18.999 19.593 15.817 1.00 0.00 C ATOM 0 H ALA A 116 20.742 18.347 18.298 1.00 0.00 H new ATOM 0 HA ALA A 116 20.815 20.120 16.840 1.00 0.00 H new ATOM 0 HB1 ALA A 116 18.977 20.508 15.225 1.00 0.00 H new ATOM 0 HB2 ALA A 116 19.470 18.798 15.239 1.00 0.00 H new ATOM 0 HB3 ALA A 116 17.980 19.301 16.072 1.00 0.00 H new ATOM 1259 N ALA A 117 17.838 21.005 17.927 1.00 0.00 N ATOM 1260 CA ALA A 117 17.156 22.080 18.696 1.00 0.00 C ATOM 1261 C ALA A 117 15.670 21.746 18.838 1.00 0.00 C ATOM 1262 O ALA A 117 15.248 20.634 18.590 1.00 0.00 O ATOM 1263 CB ALA A 117 17.315 23.413 17.959 1.00 0.00 C ATOM 0 H ALA A 117 17.219 20.351 17.448 1.00 0.00 H new ATOM 0 HA ALA A 117 17.604 22.157 19.687 1.00 0.00 H new ATOM 0 HB1 ALA A 117 16.816 24.202 18.522 1.00 0.00 H new ATOM 0 HB2 ALA A 117 18.374 23.651 17.862 1.00 0.00 H new ATOM 0 HB3 ALA A 117 16.869 23.336 16.968 1.00 0.00 H new ATOM 1269 N THR A 118 14.873 22.701 19.236 1.00 0.00 N ATOM 1270 CA THR A 118 13.415 22.438 19.394 1.00 0.00 C ATOM 1271 C THR A 118 12.623 23.429 18.540 1.00 0.00 C ATOM 1272 O THR A 118 13.101 24.496 18.205 1.00 0.00 O ATOM 1273 CB THR A 118 13.023 22.603 20.865 1.00 0.00 C ATOM 1274 OG1 THR A 118 13.028 23.984 21.202 1.00 0.00 O ATOM 1275 CG2 THR A 118 14.022 21.855 21.748 1.00 0.00 C ATOM 0 H THR A 118 15.169 23.651 19.458 1.00 0.00 H new ATOM 0 HA THR A 118 13.192 21.421 19.071 1.00 0.00 H new ATOM 0 HB THR A 118 12.025 22.194 21.025 1.00 0.00 H new ATOM 0 HG1 THR A 118 12.776 24.092 22.143 1.00 0.00 H new ATOM 0 HG21 THR A 118 13.742 21.973 22.795 1.00 0.00 H new ATOM 0 HG22 THR A 118 14.016 20.796 21.488 1.00 0.00 H new ATOM 0 HG23 THR A 118 15.021 22.261 21.592 1.00 0.00 H new ATOM 1283 N GLY A 119 11.416 23.087 18.183 1.00 0.00 N ATOM 1284 CA GLY A 119 10.595 24.011 17.350 1.00 0.00 C ATOM 1285 C GLY A 119 9.217 23.393 17.109 1.00 0.00 C ATOM 1286 O GLY A 119 8.876 22.370 17.671 1.00 0.00 O ATOM 0 H GLY A 119 10.962 22.208 18.432 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.491 24.974 17.851 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.092 24.199 16.398 1.00 0.00 H new ATOM 1290 N LYS A 120 8.420 24.007 16.277 1.00 0.00 N ATOM 1291 CA LYS A 120 7.064 23.455 15.999 1.00 0.00 C ATOM 1292 C LYS A 120 7.195 22.031 15.455 1.00 0.00 C ATOM 1293 O LYS A 120 6.389 21.170 15.745 1.00 0.00 O ATOM 1294 CB LYS A 120 6.359 24.335 14.964 1.00 0.00 C ATOM 1295 CG LYS A 120 4.930 23.831 14.755 1.00 0.00 C ATOM 1296 CD LYS A 120 4.084 24.174 15.983 1.00 0.00 C ATOM 1297 CE LYS A 120 2.637 23.738 15.744 1.00 0.00 C ATOM 1298 NZ LYS A 120 2.222 22.784 16.810 1.00 0.00 N ATOM 0 H LYS A 120 8.649 24.867 15.778 1.00 0.00 H new ATOM 0 HA LYS A 120 6.481 23.439 16.920 1.00 0.00 H new ATOM 0 HB2 LYS A 120 6.345 25.371 15.301 1.00 0.00 H new ATOM 0 HB3 LYS A 120 6.905 24.314 14.021 1.00 0.00 H new ATOM 0 HG2 LYS A 120 4.499 24.287 13.864 1.00 0.00 H new ATOM 0 HG3 LYS A 120 4.933 22.753 14.592 1.00 0.00 H new ATOM 0 HD2 LYS A 120 4.485 23.674 16.865 1.00 0.00 H new ATOM 0 HD3 LYS A 120 4.125 25.246 16.178 1.00 0.00 H new ATOM 0 HE2 LYS A 120 1.980 24.607 15.743 1.00 0.00 H new ATOM 0 HE3 LYS A 120 2.545 23.268 14.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 1.238 22.488 16.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 2.843 21.950 16.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 2.295 23.247 17.738 1.00 0.00 H new ATOM 1312 N SER A 121 8.205 21.777 14.669 1.00 0.00 N ATOM 1313 CA SER A 121 8.387 20.409 14.108 1.00 0.00 C ATOM 1314 C SER A 121 9.814 19.930 14.384 1.00 0.00 C ATOM 1315 O SER A 121 10.125 19.692 15.539 1.00 0.00 O ATOM 1316 CB SER A 121 8.143 20.440 12.598 1.00 0.00 C ATOM 1317 OG SER A 121 9.141 21.234 11.973 1.00 0.00 O ATOM 1318 OXT SER A 121 10.571 19.809 13.435 1.00 0.00 O ATOM 0 H SER A 121 8.912 22.458 14.391 1.00 0.00 H new ATOM 0 HA SER A 121 7.678 19.727 14.577 1.00 0.00 H new ATOM 0 HB2 SER A 121 8.163 19.428 12.195 1.00 0.00 H new ATOM 0 HB3 SER A 121 7.154 20.847 12.387 1.00 0.00 H new ATOM 0 HG SER A 121 10.010 20.786 12.048 1.00 0.00 H new TER 1324 SER A 121