USER MOD reduce.3.24.130724 H: found=0, std=0, add=659, rem=0, adj=22 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 83 MET CE :methyl -113:sc= -15.3! (180deg=-16.7!) USER MOD Set 1.2: A 118 THR OG1 : rot 180:sc= -0.018 USER MOD Set 2.1: A 41 THR OG1 : rot -118:sc= -2.4! USER MOD Set 2.2: A 79 THR OG1 : rot 75:sc= -0.888 USER MOD Set 2.3: A 111 GLN : amide:sc= -4.1! C(o=-7.4!,f=-14!) USER MOD Single : A 38 LYS NZ :NH3+ -164:sc=-0.00785 (180deg=-0.246) USER MOD Single : A 40 ASN : amide:sc= -2.42 K(o=-2.4,f=-4.3!) USER MOD Single : A 43 TYR OH : rot 180:sc= -0.599 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -160:sc= -0.394 (180deg=-2.36!) USER MOD Single : A 50 THR OG1 : rot 180:sc=-0.00734 USER MOD Single : A 52 THR OG1 : rot 180:sc=0.000477 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 ASN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 MET CE :methyl 152:sc= -4.63! (180deg=-8.7!) USER MOD Single : A 74 ASN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : A 75 CYS SG : rot 94:sc= -1.13 USER MOD Single : A 80 TYR OH : rot -24:sc= -6.5! USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 94 ASN : amide:sc= -1.71 K(o=-1.7,f=-8.7!) USER MOD Single : A 96 THR OG1 : rot -95:sc= 0.297 USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 100 SER OG : rot -49:sc= 0.619 USER MOD Single : A 102 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= -2.21! C(o=-2.2!,f=-3.8!) USER MOD Single : A 110 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0509) USER MOD Single : A 113 MET CE :methyl -171:sc= -4.14! (180deg=-4.3!) USER MOD Single : A 120 LYS NZ :NH3+ 164:sc=-0.000218 (180deg=-0.174) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 35 29.722 24.226 20.428 1.00 0.00 N ATOM 2 CA ALA A 35 29.749 24.903 21.756 1.00 0.00 C ATOM 3 C ALA A 35 28.359 24.835 22.391 1.00 0.00 C ATOM 4 O ALA A 35 28.172 24.248 23.438 1.00 0.00 O ATOM 5 CB ALA A 35 30.157 26.366 21.575 1.00 0.00 C ATOM 0 HA ALA A 35 30.469 24.403 22.404 1.00 0.00 H new ATOM 0 HB1 ALA A 35 30.177 26.861 22.546 1.00 0.00 H new ATOM 0 HB2 ALA A 35 31.148 26.414 21.123 1.00 0.00 H new ATOM 0 HB3 ALA A 35 29.438 26.867 20.927 1.00 0.00 H new ATOM 11 N PRO A 36 27.363 25.453 21.738 1.00 0.00 N ATOM 12 CA PRO A 36 25.980 25.471 22.230 1.00 0.00 C ATOM 13 C PRO A 36 25.324 24.089 22.137 1.00 0.00 C ATOM 14 O PRO A 36 25.651 23.292 21.279 1.00 0.00 O ATOM 15 CB PRO A 36 25.278 26.448 21.287 1.00 0.00 C ATOM 16 CG PRO A 36 26.090 26.412 20.037 1.00 0.00 C ATOM 17 CD PRO A 36 27.511 26.184 20.467 1.00 0.00 C ATOM 0 HA PRO A 36 25.923 25.756 23.281 1.00 0.00 H new ATOM 0 HB2 PRO A 36 24.247 26.147 21.099 1.00 0.00 H new ATOM 0 HB3 PRO A 36 25.245 27.452 21.709 1.00 0.00 H new ATOM 0 HG2 PRO A 36 25.751 25.615 19.375 1.00 0.00 H new ATOM 0 HG3 PRO A 36 25.996 27.347 19.484 1.00 0.00 H new ATOM 0 HD2 PRO A 36 28.067 25.603 19.731 1.00 0.00 H new ATOM 0 HD3 PRO A 36 28.047 27.124 20.602 1.00 0.00 H new ATOM 25 N ARG A 37 24.401 23.799 23.014 1.00 0.00 N ATOM 26 CA ARG A 37 23.725 22.471 22.976 1.00 0.00 C ATOM 27 C ARG A 37 22.992 22.306 21.644 1.00 0.00 C ATOM 28 O ARG A 37 22.941 21.230 21.081 1.00 0.00 O ATOM 29 CB ARG A 37 22.719 22.376 24.125 1.00 0.00 C ATOM 30 CG ARG A 37 23.457 22.498 25.460 1.00 0.00 C ATOM 31 CD ARG A 37 22.472 22.275 26.609 1.00 0.00 C ATOM 32 NE ARG A 37 23.173 22.466 27.909 1.00 0.00 N ATOM 33 CZ ARG A 37 23.280 23.660 28.423 1.00 0.00 C ATOM 34 NH1 ARG A 37 22.215 24.288 28.844 1.00 0.00 N ATOM 35 NH2 ARG A 37 24.451 24.229 28.519 1.00 0.00 N ATOM 0 H ARG A 37 24.086 24.425 23.755 1.00 0.00 H new ATOM 0 HA ARG A 37 24.471 21.683 23.079 1.00 0.00 H new ATOM 0 HB2 ARG A 37 21.973 23.166 24.036 1.00 0.00 H new ATOM 0 HB3 ARG A 37 22.185 21.427 24.078 1.00 0.00 H new ATOM 0 HG2 ARG A 37 24.263 21.766 25.510 1.00 0.00 H new ATOM 0 HG3 ARG A 37 23.915 23.483 25.546 1.00 0.00 H new ATOM 0 HD2 ARG A 37 21.638 22.972 26.528 1.00 0.00 H new ATOM 0 HD3 ARG A 37 22.054 21.270 26.554 1.00 0.00 H new ATOM 0 HE ARG A 37 23.569 21.663 28.397 1.00 0.00 H new ATOM 0 HH11 ARG A 37 21.299 23.845 28.771 1.00 0.00 H new ATOM 0 HH12 ARG A 37 22.299 25.222 29.246 1.00 0.00 H new ATOM 0 HH21 ARG A 37 25.284 23.740 28.192 1.00 0.00 H new ATOM 0 HH22 ARG A 37 24.533 25.163 28.921 1.00 0.00 H new ATOM 49 N LYS A 38 22.424 23.364 21.132 1.00 0.00 N ATOM 50 CA LYS A 38 21.696 23.265 19.836 1.00 0.00 C ATOM 51 C LYS A 38 22.685 22.901 18.728 1.00 0.00 C ATOM 52 O LYS A 38 23.840 22.621 18.982 1.00 0.00 O ATOM 53 CB LYS A 38 21.041 24.610 19.512 1.00 0.00 C ATOM 54 CG LYS A 38 20.225 25.084 20.718 1.00 0.00 C ATOM 55 CD LYS A 38 19.589 26.440 20.402 1.00 0.00 C ATOM 56 CE LYS A 38 18.776 26.914 21.608 1.00 0.00 C ATOM 57 NZ LYS A 38 17.565 26.057 21.760 1.00 0.00 N ATOM 0 H LYS A 38 22.433 24.292 21.555 1.00 0.00 H new ATOM 0 HA LYS A 38 20.927 22.496 19.908 1.00 0.00 H new ATOM 0 HB2 LYS A 38 21.804 25.348 19.263 1.00 0.00 H new ATOM 0 HB3 LYS A 38 20.396 24.512 18.639 1.00 0.00 H new ATOM 0 HG2 LYS A 38 19.451 24.354 20.957 1.00 0.00 H new ATOM 0 HG3 LYS A 38 20.867 25.167 21.595 1.00 0.00 H new ATOM 0 HD2 LYS A 38 20.362 27.169 20.162 1.00 0.00 H new ATOM 0 HD3 LYS A 38 18.946 26.357 19.526 1.00 0.00 H new ATOM 0 HE2 LYS A 38 19.384 26.866 22.511 1.00 0.00 H new ATOM 0 HE3 LYS A 38 18.483 27.956 21.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 16.884 26.527 22.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 17.128 25.905 20.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 17.838 25.140 22.168 1.00 0.00 H new ATOM 71 N GLY A 39 22.245 22.902 17.499 1.00 0.00 N ATOM 72 CA GLY A 39 23.166 22.556 16.379 1.00 0.00 C ATOM 73 C GLY A 39 22.401 21.778 15.306 1.00 0.00 C ATOM 74 O GLY A 39 22.204 20.584 15.413 1.00 0.00 O ATOM 0 H GLY A 39 21.289 23.127 17.222 1.00 0.00 H new ATOM 0 HA2 GLY A 39 23.591 23.464 15.951 1.00 0.00 H new ATOM 0 HA3 GLY A 39 23.999 21.959 16.751 1.00 0.00 H new ATOM 78 N ASN A 40 21.971 22.446 14.269 1.00 0.00 N ATOM 79 CA ASN A 40 21.222 21.742 13.190 1.00 0.00 C ATOM 80 C ASN A 40 22.214 21.175 12.172 1.00 0.00 C ATOM 81 O ASN A 40 22.732 21.886 11.332 1.00 0.00 O ATOM 82 CB ASN A 40 20.285 22.730 12.493 1.00 0.00 C ATOM 83 CG ASN A 40 19.264 21.959 11.653 1.00 0.00 C ATOM 84 OD1 ASN A 40 19.147 20.755 11.772 1.00 0.00 O ATOM 85 ND2 ASN A 40 18.514 22.605 10.804 1.00 0.00 N ATOM 0 H ASN A 40 22.106 23.446 14.123 1.00 0.00 H new ATOM 0 HA ASN A 40 20.637 20.930 13.621 1.00 0.00 H new ATOM 0 HB2 ASN A 40 19.773 23.346 13.233 1.00 0.00 H new ATOM 0 HB3 ASN A 40 20.858 23.405 11.858 1.00 0.00 H new ATOM 0 HD21 ASN A 40 17.830 22.100 10.241 1.00 0.00 H new ATOM 0 HD22 ASN A 40 18.611 23.615 10.703 1.00 0.00 H new ATOM 92 N THR A 41 22.484 19.900 12.239 1.00 0.00 N ATOM 93 CA THR A 41 23.444 19.290 11.275 1.00 0.00 C ATOM 94 C THR A 41 22.865 19.360 9.861 1.00 0.00 C ATOM 95 O THR A 41 21.730 18.996 9.625 1.00 0.00 O ATOM 96 CB THR A 41 23.688 17.828 11.655 1.00 0.00 C ATOM 97 OG1 THR A 41 24.164 17.760 12.991 1.00 0.00 O ATOM 98 CG2 THR A 41 24.727 17.221 10.710 1.00 0.00 C ATOM 0 H THR A 41 22.082 19.255 12.919 1.00 0.00 H new ATOM 0 HA THR A 41 24.386 19.837 11.307 1.00 0.00 H new ATOM 0 HB THR A 41 22.755 17.270 11.573 1.00 0.00 H new ATOM 0 HG1 THR A 41 25.062 17.368 12.999 1.00 0.00 H new ATOM 0 HG21 THR A 41 24.901 16.180 10.981 1.00 0.00 H new ATOM 0 HG22 THR A 41 24.361 17.273 9.685 1.00 0.00 H new ATOM 0 HG23 THR A 41 25.661 17.777 10.790 1.00 0.00 H new ATOM 106 N LEU A 42 23.637 19.827 8.917 1.00 0.00 N ATOM 107 CA LEU A 42 23.133 19.920 7.519 1.00 0.00 C ATOM 108 C LEU A 42 23.876 18.911 6.641 1.00 0.00 C ATOM 109 O LEU A 42 25.042 18.637 6.844 1.00 0.00 O ATOM 110 CB LEU A 42 23.371 21.333 6.984 1.00 0.00 C ATOM 111 CG LEU A 42 22.868 22.356 8.003 1.00 0.00 C ATOM 112 CD1 LEU A 42 22.864 23.749 7.370 1.00 0.00 C ATOM 113 CD2 LEU A 42 21.447 21.988 8.435 1.00 0.00 C ATOM 0 H LEU A 42 24.595 20.148 9.055 1.00 0.00 H new ATOM 0 HA LEU A 42 22.066 19.700 7.502 1.00 0.00 H new ATOM 0 HB2 LEU A 42 24.433 21.487 6.793 1.00 0.00 H new ATOM 0 HB3 LEU A 42 22.853 21.466 6.034 1.00 0.00 H new ATOM 0 HG LEU A 42 23.525 22.355 8.873 1.00 0.00 H new ATOM 0 HD11 LEU A 42 22.505 24.478 8.097 1.00 0.00 H new ATOM 0 HD12 LEU A 42 23.876 24.012 7.062 1.00 0.00 H new ATOM 0 HD13 LEU A 42 22.208 23.751 6.500 1.00 0.00 H new ATOM 0 HD21 LEU A 42 21.087 22.717 9.162 1.00 0.00 H new ATOM 0 HD22 LEU A 42 20.791 21.989 7.565 1.00 0.00 H new ATOM 0 HD23 LEU A 42 21.449 20.996 8.887 1.00 0.00 H new ATOM 125 N TYR A 43 23.211 18.354 5.665 1.00 0.00 N ATOM 126 CA TYR A 43 23.882 17.364 4.777 1.00 0.00 C ATOM 127 C TYR A 43 24.190 18.016 3.428 1.00 0.00 C ATOM 128 O TYR A 43 23.310 18.509 2.750 1.00 0.00 O ATOM 129 CB TYR A 43 22.961 16.162 4.565 1.00 0.00 C ATOM 130 CG TYR A 43 23.639 15.162 3.659 1.00 0.00 C ATOM 131 CD1 TYR A 43 24.472 14.177 4.203 1.00 0.00 C ATOM 132 CD2 TYR A 43 23.434 15.218 2.275 1.00 0.00 C ATOM 133 CE1 TYR A 43 25.099 13.248 3.364 1.00 0.00 C ATOM 134 CE2 TYR A 43 24.062 14.291 1.436 1.00 0.00 C ATOM 135 CZ TYR A 43 24.895 13.306 1.980 1.00 0.00 C ATOM 136 OH TYR A 43 25.513 12.390 1.154 1.00 0.00 O ATOM 0 H TYR A 43 22.233 18.542 5.445 1.00 0.00 H new ATOM 0 HA TYR A 43 24.811 17.031 5.240 1.00 0.00 H new ATOM 0 HB2 TYR A 43 22.724 15.699 5.523 1.00 0.00 H new ATOM 0 HB3 TYR A 43 22.018 16.486 4.125 1.00 0.00 H new ATOM 0 HD1 TYR A 43 24.631 14.134 5.270 1.00 0.00 H new ATOM 0 HD2 TYR A 43 22.791 15.977 1.855 1.00 0.00 H new ATOM 0 HE1 TYR A 43 25.740 12.487 3.784 1.00 0.00 H new ATOM 0 HE2 TYR A 43 23.904 14.335 0.369 1.00 0.00 H new ATOM 0 HH TYR A 43 25.265 12.570 0.223 1.00 0.00 H new ATOM 146 N VAL A 44 25.434 18.024 3.032 1.00 0.00 N ATOM 147 CA VAL A 44 25.796 18.644 1.727 1.00 0.00 C ATOM 148 C VAL A 44 26.473 17.601 0.837 1.00 0.00 C ATOM 149 O VAL A 44 27.291 16.823 1.287 1.00 0.00 O ATOM 150 CB VAL A 44 26.757 19.810 1.966 1.00 0.00 C ATOM 151 CG1 VAL A 44 27.073 20.493 0.634 1.00 0.00 C ATOM 152 CG2 VAL A 44 26.107 20.821 2.915 1.00 0.00 C ATOM 0 H VAL A 44 26.214 17.628 3.556 1.00 0.00 H new ATOM 0 HA VAL A 44 24.894 19.010 1.236 1.00 0.00 H new ATOM 0 HB VAL A 44 27.679 19.435 2.410 1.00 0.00 H new ATOM 0 HG11 VAL A 44 27.758 21.324 0.805 1.00 0.00 H new ATOM 0 HG12 VAL A 44 27.536 19.774 -0.043 1.00 0.00 H new ATOM 0 HG13 VAL A 44 26.151 20.868 0.190 1.00 0.00 H new ATOM 0 HG21 VAL A 44 26.791 21.652 3.086 1.00 0.00 H new ATOM 0 HG22 VAL A 44 25.185 21.196 2.471 1.00 0.00 H new ATOM 0 HG23 VAL A 44 25.882 20.336 3.865 1.00 0.00 H new ATOM 162 N TYR A 45 26.139 17.577 -0.424 1.00 0.00 N ATOM 163 CA TYR A 45 26.763 16.583 -1.342 1.00 0.00 C ATOM 164 C TYR A 45 27.530 17.318 -2.443 1.00 0.00 C ATOM 165 O TYR A 45 27.075 18.311 -2.973 1.00 0.00 O ATOM 166 CB TYR A 45 25.672 15.715 -1.972 1.00 0.00 C ATOM 167 CG TYR A 45 26.311 14.647 -2.828 1.00 0.00 C ATOM 168 CD1 TYR A 45 26.746 13.451 -2.246 1.00 0.00 C ATOM 169 CD2 TYR A 45 26.469 14.855 -4.203 1.00 0.00 C ATOM 170 CE1 TYR A 45 27.340 12.462 -3.039 1.00 0.00 C ATOM 171 CE2 TYR A 45 27.062 13.865 -4.997 1.00 0.00 C ATOM 172 CZ TYR A 45 27.497 12.669 -4.415 1.00 0.00 C ATOM 173 OH TYR A 45 28.082 11.694 -5.197 1.00 0.00 O ATOM 0 H TYR A 45 25.461 18.203 -0.858 1.00 0.00 H new ATOM 0 HA TYR A 45 27.450 15.951 -0.780 1.00 0.00 H new ATOM 0 HB2 TYR A 45 25.063 15.256 -1.194 1.00 0.00 H new ATOM 0 HB3 TYR A 45 25.006 16.331 -2.577 1.00 0.00 H new ATOM 0 HD1 TYR A 45 26.623 13.291 -1.185 1.00 0.00 H new ATOM 0 HD2 TYR A 45 26.134 15.778 -4.652 1.00 0.00 H new ATOM 0 HE1 TYR A 45 27.677 11.540 -2.590 1.00 0.00 H new ATOM 0 HE2 TYR A 45 27.183 14.025 -6.058 1.00 0.00 H new ATOM 0 HH TYR A 45 28.113 11.997 -6.129 1.00 0.00 H new ATOM 183 N GLY A 46 28.692 16.835 -2.792 1.00 0.00 N ATOM 184 CA GLY A 46 29.486 17.505 -3.859 1.00 0.00 C ATOM 185 C GLY A 46 30.837 16.801 -4.007 1.00 0.00 C ATOM 186 O GLY A 46 31.119 15.832 -3.332 1.00 0.00 O ATOM 0 H GLY A 46 29.125 16.006 -2.384 1.00 0.00 H new ATOM 0 HA2 GLY A 46 28.943 17.476 -4.804 1.00 0.00 H new ATOM 0 HA3 GLY A 46 29.636 18.555 -3.610 1.00 0.00 H new ATOM 190 N GLU A 47 31.673 17.283 -4.885 1.00 0.00 N ATOM 191 CA GLU A 47 33.004 16.640 -5.074 1.00 0.00 C ATOM 192 C GLU A 47 34.106 17.685 -4.892 1.00 0.00 C ATOM 193 O GLU A 47 33.887 18.869 -5.059 1.00 0.00 O ATOM 194 CB GLU A 47 33.089 16.050 -6.483 1.00 0.00 C ATOM 195 CG GLU A 47 31.987 15.005 -6.665 1.00 0.00 C ATOM 196 CD GLU A 47 32.139 14.336 -8.032 1.00 0.00 C ATOM 197 OE1 GLU A 47 32.966 14.791 -8.805 1.00 0.00 O ATOM 198 OE2 GLU A 47 31.425 13.379 -8.283 1.00 0.00 O ATOM 0 H GLU A 47 31.493 18.093 -5.479 1.00 0.00 H new ATOM 0 HA GLU A 47 33.132 15.846 -4.338 1.00 0.00 H new ATOM 0 HB2 GLU A 47 32.983 16.840 -7.227 1.00 0.00 H new ATOM 0 HB3 GLU A 47 34.067 15.594 -6.640 1.00 0.00 H new ATOM 0 HG2 GLU A 47 32.046 14.257 -5.874 1.00 0.00 H new ATOM 0 HG3 GLU A 47 31.007 15.476 -6.586 1.00 0.00 H new ATOM 205 N ASP A 48 35.290 17.258 -4.548 1.00 0.00 N ATOM 206 CA ASP A 48 36.406 18.228 -4.355 1.00 0.00 C ATOM 207 C ASP A 48 35.925 19.393 -3.488 1.00 0.00 C ATOM 208 O ASP A 48 36.099 20.546 -3.829 1.00 0.00 O ATOM 209 CB ASP A 48 36.861 18.759 -5.716 1.00 0.00 C ATOM 210 CG ASP A 48 38.115 19.618 -5.534 1.00 0.00 C ATOM 211 OD1 ASP A 48 39.195 19.053 -5.490 1.00 0.00 O ATOM 212 OD2 ASP A 48 37.972 20.827 -5.441 1.00 0.00 O ATOM 0 H ASP A 48 35.533 16.280 -4.392 1.00 0.00 H new ATOM 0 HA ASP A 48 37.240 17.729 -3.862 1.00 0.00 H new ATOM 0 HB2 ASP A 48 37.070 17.929 -6.391 1.00 0.00 H new ATOM 0 HB3 ASP A 48 36.066 19.349 -6.173 1.00 0.00 H new ATOM 217 N MET A 49 35.320 19.102 -2.369 1.00 0.00 N ATOM 218 CA MET A 49 34.828 20.194 -1.482 1.00 0.00 C ATOM 219 C MET A 49 35.747 20.317 -0.265 1.00 0.00 C ATOM 220 O MET A 49 36.269 19.339 0.233 1.00 0.00 O ATOM 221 CB MET A 49 33.408 19.871 -1.019 1.00 0.00 C ATOM 222 CG MET A 49 32.454 19.934 -2.214 1.00 0.00 C ATOM 223 SD MET A 49 30.747 19.783 -1.633 1.00 0.00 S ATOM 224 CE MET A 49 30.931 18.189 -0.797 1.00 0.00 C ATOM 0 H MET A 49 35.145 18.156 -2.031 1.00 0.00 H new ATOM 0 HA MET A 49 34.826 21.136 -2.031 1.00 0.00 H new ATOM 0 HB2 MET A 49 33.378 18.879 -0.568 1.00 0.00 H new ATOM 0 HB3 MET A 49 33.094 20.579 -0.252 1.00 0.00 H new ATOM 0 HG2 MET A 49 32.585 20.875 -2.748 1.00 0.00 H new ATOM 0 HG3 MET A 49 32.682 19.133 -2.917 1.00 0.00 H new ATOM 0 HE1 MET A 49 29.951 17.729 -0.671 1.00 0.00 H new ATOM 0 HE2 MET A 49 31.564 17.535 -1.396 1.00 0.00 H new ATOM 0 HE3 MET A 49 31.389 18.341 0.180 1.00 0.00 H new ATOM 234 N THR A 50 35.948 21.513 0.219 1.00 0.00 N ATOM 235 CA THR A 50 36.833 21.697 1.404 1.00 0.00 C ATOM 236 C THR A 50 36.028 22.317 2.548 1.00 0.00 C ATOM 237 O THR A 50 34.972 22.881 2.343 1.00 0.00 O ATOM 238 CB THR A 50 37.993 22.626 1.035 1.00 0.00 C ATOM 239 OG1 THR A 50 37.507 23.687 0.224 1.00 0.00 O ATOM 240 CG2 THR A 50 39.055 21.839 0.267 1.00 0.00 C ATOM 0 H THR A 50 35.538 22.369 -0.155 1.00 0.00 H new ATOM 0 HA THR A 50 37.227 20.730 1.718 1.00 0.00 H new ATOM 0 HB THR A 50 38.435 23.035 1.943 1.00 0.00 H new ATOM 0 HG1 THR A 50 38.248 24.284 -0.012 1.00 0.00 H new ATOM 0 HG21 THR A 50 39.880 22.501 0.005 1.00 0.00 H new ATOM 0 HG22 THR A 50 39.427 21.026 0.890 1.00 0.00 H new ATOM 0 HG23 THR A 50 38.617 21.428 -0.642 1.00 0.00 H new ATOM 248 N PRO A 51 36.544 22.206 3.782 1.00 0.00 N ATOM 249 CA PRO A 51 35.880 22.752 4.972 1.00 0.00 C ATOM 250 C PRO A 51 35.910 24.281 4.990 1.00 0.00 C ATOM 251 O PRO A 51 34.886 24.930 5.086 1.00 0.00 O ATOM 252 CB PRO A 51 36.709 22.197 6.131 1.00 0.00 C ATOM 253 CG PRO A 51 38.053 21.933 5.540 1.00 0.00 C ATOM 254 CD PRO A 51 37.816 21.538 4.110 1.00 0.00 C ATOM 0 HA PRO A 51 34.826 22.477 5.015 1.00 0.00 H new ATOM 0 HB2 PRO A 51 36.770 22.911 6.952 1.00 0.00 H new ATOM 0 HB3 PRO A 51 36.267 21.286 6.534 1.00 0.00 H new ATOM 0 HG2 PRO A 51 38.684 22.820 5.599 1.00 0.00 H new ATOM 0 HG3 PRO A 51 38.567 21.139 6.082 1.00 0.00 H new ATOM 0 HD2 PRO A 51 38.625 21.872 3.461 1.00 0.00 H new ATOM 0 HD3 PRO A 51 37.743 20.456 3.998 1.00 0.00 H new ATOM 262 N THR A 52 37.073 24.865 4.897 1.00 0.00 N ATOM 263 CA THR A 52 37.161 26.352 4.907 1.00 0.00 C ATOM 264 C THR A 52 36.189 26.920 3.875 1.00 0.00 C ATOM 265 O THR A 52 35.439 27.836 4.150 1.00 0.00 O ATOM 266 CB THR A 52 38.587 26.783 4.558 1.00 0.00 C ATOM 267 OG1 THR A 52 39.506 26.106 5.404 1.00 0.00 O ATOM 268 CG2 THR A 52 38.727 28.293 4.754 1.00 0.00 C ATOM 0 H THR A 52 37.965 24.377 4.815 1.00 0.00 H new ATOM 0 HA THR A 52 36.904 26.727 5.898 1.00 0.00 H new ATOM 0 HB THR A 52 38.798 26.533 3.518 1.00 0.00 H new ATOM 0 HG1 THR A 52 40.420 26.380 5.180 1.00 0.00 H new ATOM 0 HG21 THR A 52 39.743 28.600 4.505 1.00 0.00 H new ATOM 0 HG22 THR A 52 38.022 28.811 4.104 1.00 0.00 H new ATOM 0 HG23 THR A 52 38.516 28.546 5.793 1.00 0.00 H new ATOM 276 N LEU A 53 36.192 26.381 2.687 1.00 0.00 N ATOM 277 CA LEU A 53 35.263 26.888 1.639 1.00 0.00 C ATOM 278 C LEU A 53 33.823 26.768 2.141 1.00 0.00 C ATOM 279 O LEU A 53 33.090 27.737 2.194 1.00 0.00 O ATOM 280 CB LEU A 53 35.430 26.063 0.362 1.00 0.00 C ATOM 281 CG LEU A 53 34.620 26.704 -0.767 1.00 0.00 C ATOM 282 CD1 LEU A 53 35.347 27.952 -1.271 1.00 0.00 C ATOM 283 CD2 LEU A 53 34.466 25.705 -1.915 1.00 0.00 C ATOM 0 H LEU A 53 36.797 25.612 2.397 1.00 0.00 H new ATOM 0 HA LEU A 53 35.490 27.932 1.424 1.00 0.00 H new ATOM 0 HB2 LEU A 53 36.483 26.011 0.085 1.00 0.00 H new ATOM 0 HB3 LEU A 53 35.094 25.040 0.530 1.00 0.00 H new ATOM 0 HG LEU A 53 33.635 26.983 -0.394 1.00 0.00 H new ATOM 0 HD11 LEU A 53 34.770 28.409 -2.075 1.00 0.00 H new ATOM 0 HD12 LEU A 53 35.457 28.664 -0.453 1.00 0.00 H new ATOM 0 HD13 LEU A 53 36.332 27.673 -1.644 1.00 0.00 H new ATOM 0 HD21 LEU A 53 33.889 26.161 -2.719 1.00 0.00 H new ATOM 0 HD22 LEU A 53 35.451 25.425 -2.288 1.00 0.00 H new ATOM 0 HD23 LEU A 53 33.948 24.816 -1.556 1.00 0.00 H new ATOM 295 N LEU A 54 33.414 25.588 2.517 1.00 0.00 N ATOM 296 CA LEU A 54 32.025 25.411 3.023 1.00 0.00 C ATOM 297 C LEU A 54 31.778 26.400 4.162 1.00 0.00 C ATOM 298 O LEU A 54 30.742 27.029 4.239 1.00 0.00 O ATOM 299 CB LEU A 54 31.846 23.980 3.538 1.00 0.00 C ATOM 300 CG LEU A 54 32.009 22.997 2.377 1.00 0.00 C ATOM 301 CD1 LEU A 54 32.706 21.730 2.876 1.00 0.00 C ATOM 302 CD2 LEU A 54 30.631 22.635 1.819 1.00 0.00 C ATOM 0 H LEU A 54 33.981 24.740 2.496 1.00 0.00 H new ATOM 0 HA LEU A 54 31.314 25.594 2.217 1.00 0.00 H new ATOM 0 HB2 LEU A 54 32.580 23.767 4.315 1.00 0.00 H new ATOM 0 HB3 LEU A 54 30.861 23.865 3.990 1.00 0.00 H new ATOM 0 HG LEU A 54 32.610 23.457 1.592 1.00 0.00 H new ATOM 0 HD11 LEU A 54 32.822 21.029 2.049 1.00 0.00 H new ATOM 0 HD12 LEU A 54 33.687 21.987 3.274 1.00 0.00 H new ATOM 0 HD13 LEU A 54 32.105 21.269 3.660 1.00 0.00 H new ATOM 0 HD21 LEU A 54 30.746 21.935 0.992 1.00 0.00 H new ATOM 0 HD22 LEU A 54 30.030 22.175 2.603 1.00 0.00 H new ATOM 0 HD23 LEU A 54 30.134 23.538 1.464 1.00 0.00 H new ATOM 314 N ARG A 55 32.728 26.547 5.047 1.00 0.00 N ATOM 315 CA ARG A 55 32.551 27.500 6.177 1.00 0.00 C ATOM 316 C ARG A 55 32.065 28.843 5.631 1.00 0.00 C ATOM 317 O ARG A 55 31.194 29.475 6.194 1.00 0.00 O ATOM 318 CB ARG A 55 33.889 27.694 6.896 1.00 0.00 C ATOM 319 CG ARG A 55 33.667 28.495 8.179 1.00 0.00 C ATOM 320 CD ARG A 55 35.017 28.804 8.829 1.00 0.00 C ATOM 321 NE ARG A 55 34.795 29.521 10.116 1.00 0.00 N ATOM 322 CZ ARG A 55 35.810 29.814 10.885 1.00 0.00 C ATOM 323 NH1 ARG A 55 36.813 28.985 10.985 1.00 0.00 N ATOM 324 NH2 ARG A 55 35.821 30.936 11.552 1.00 0.00 N ATOM 0 H ARG A 55 33.618 26.048 5.035 1.00 0.00 H new ATOM 0 HA ARG A 55 31.818 27.104 6.879 1.00 0.00 H new ATOM 0 HB2 ARG A 55 34.331 26.726 7.131 1.00 0.00 H new ATOM 0 HB3 ARG A 55 34.591 28.216 6.246 1.00 0.00 H new ATOM 0 HG2 ARG A 55 33.139 29.422 7.955 1.00 0.00 H new ATOM 0 HG3 ARG A 55 33.040 27.930 8.869 1.00 0.00 H new ATOM 0 HD2 ARG A 55 35.568 27.880 9.005 1.00 0.00 H new ATOM 0 HD3 ARG A 55 35.624 29.414 8.160 1.00 0.00 H new ATOM 0 HE ARG A 55 33.850 29.783 10.397 1.00 0.00 H new ATOM 0 HH11 ARG A 55 36.804 28.109 10.463 1.00 0.00 H new ATOM 0 HH12 ARG A 55 37.606 29.213 11.585 1.00 0.00 H new ATOM 0 HH21 ARG A 55 35.037 31.584 11.473 1.00 0.00 H new ATOM 0 HH22 ARG A 55 36.613 31.165 12.152 1.00 0.00 H new ATOM 338 N GLY A 56 32.620 29.281 4.534 1.00 0.00 N ATOM 339 CA GLY A 56 32.188 30.581 3.950 1.00 0.00 C ATOM 340 C GLY A 56 30.752 30.452 3.438 1.00 0.00 C ATOM 341 O GLY A 56 29.971 31.380 3.512 1.00 0.00 O ATOM 0 H GLY A 56 33.353 28.795 4.018 1.00 0.00 H new ATOM 0 HA2 GLY A 56 32.249 31.369 4.701 1.00 0.00 H new ATOM 0 HA3 GLY A 56 32.853 30.866 3.135 1.00 0.00 H new ATOM 345 N ALA A 57 30.399 29.308 2.919 1.00 0.00 N ATOM 346 CA ALA A 57 29.013 29.119 2.403 1.00 0.00 C ATOM 347 C ALA A 57 28.036 29.064 3.578 1.00 0.00 C ATOM 348 O ALA A 57 26.855 29.312 3.428 1.00 0.00 O ATOM 349 CB ALA A 57 28.937 27.810 1.615 1.00 0.00 C ATOM 0 H ALA A 57 31.010 28.496 2.830 1.00 0.00 H new ATOM 0 HA ALA A 57 28.751 29.952 1.750 1.00 0.00 H new ATOM 0 HB1 ALA A 57 27.924 27.671 1.237 1.00 0.00 H new ATOM 0 HB2 ALA A 57 29.634 27.848 0.778 1.00 0.00 H new ATOM 0 HB3 ALA A 57 29.199 26.977 2.267 1.00 0.00 H new ATOM 355 N PHE A 58 28.517 28.740 4.747 1.00 0.00 N ATOM 356 CA PHE A 58 27.616 28.668 5.931 1.00 0.00 C ATOM 357 C PHE A 58 28.060 29.696 6.976 1.00 0.00 C ATOM 358 O PHE A 58 27.529 29.756 8.067 1.00 0.00 O ATOM 359 CB PHE A 58 27.689 27.264 6.539 1.00 0.00 C ATOM 360 CG PHE A 58 27.123 26.261 5.562 1.00 0.00 C ATOM 361 CD1 PHE A 58 27.961 25.644 4.627 1.00 0.00 C ATOM 362 CD2 PHE A 58 25.759 25.948 5.593 1.00 0.00 C ATOM 363 CE1 PHE A 58 27.437 24.713 3.722 1.00 0.00 C ATOM 364 CE2 PHE A 58 25.234 25.017 4.688 1.00 0.00 C ATOM 365 CZ PHE A 58 26.072 24.400 3.753 1.00 0.00 C ATOM 0 H PHE A 58 29.496 28.522 4.933 1.00 0.00 H new ATOM 0 HA PHE A 58 26.593 28.882 5.622 1.00 0.00 H new ATOM 0 HB2 PHE A 58 28.723 27.013 6.777 1.00 0.00 H new ATOM 0 HB3 PHE A 58 27.130 27.232 7.474 1.00 0.00 H new ATOM 0 HD1 PHE A 58 29.013 25.886 4.603 1.00 0.00 H new ATOM 0 HD2 PHE A 58 25.112 26.424 6.315 1.00 0.00 H new ATOM 0 HE1 PHE A 58 28.085 24.237 3.001 1.00 0.00 H new ATOM 0 HE2 PHE A 58 24.182 24.775 4.712 1.00 0.00 H new ATOM 0 HZ PHE A 58 25.667 23.682 3.055 1.00 0.00 H new ATOM 375 N SER A 59 29.037 30.500 6.654 1.00 0.00 N ATOM 376 CA SER A 59 29.521 31.518 7.629 1.00 0.00 C ATOM 377 C SER A 59 28.505 32.659 7.746 1.00 0.00 C ATOM 378 O SER A 59 28.026 32.964 8.820 1.00 0.00 O ATOM 379 CB SER A 59 30.862 32.081 7.152 1.00 0.00 C ATOM 380 OG SER A 59 31.062 33.367 7.717 1.00 0.00 O ATOM 0 H SER A 59 29.521 30.495 5.756 1.00 0.00 H new ATOM 0 HA SER A 59 29.643 31.047 8.604 1.00 0.00 H new ATOM 0 HB2 SER A 59 31.673 31.414 7.443 1.00 0.00 H new ATOM 0 HB3 SER A 59 30.876 32.144 6.064 1.00 0.00 H new ATOM 0 HG SER A 59 31.921 33.728 7.413 1.00 0.00 H new ATOM 386 N PRO A 60 28.178 33.307 6.617 1.00 0.00 N ATOM 387 CA PRO A 60 27.225 34.426 6.594 1.00 0.00 C ATOM 388 C PRO A 60 25.794 33.967 6.892 1.00 0.00 C ATOM 389 O PRO A 60 24.970 34.734 7.349 1.00 0.00 O ATOM 390 CB PRO A 60 27.321 34.949 5.161 1.00 0.00 C ATOM 391 CG PRO A 60 27.796 33.780 4.368 1.00 0.00 C ATOM 392 CD PRO A 60 28.707 33.004 5.274 1.00 0.00 C ATOM 0 HA PRO A 60 27.457 35.174 7.352 1.00 0.00 H new ATOM 0 HB2 PRO A 60 26.355 35.305 4.803 1.00 0.00 H new ATOM 0 HB3 PRO A 60 28.016 35.786 5.090 1.00 0.00 H new ATOM 0 HG2 PRO A 60 26.958 33.166 4.039 1.00 0.00 H new ATOM 0 HG3 PRO A 60 28.323 34.106 3.471 1.00 0.00 H new ATOM 0 HD2 PRO A 60 28.675 31.936 5.059 1.00 0.00 H new ATOM 0 HD3 PRO A 60 29.745 33.319 5.169 1.00 0.00 H new ATOM 400 N PHE A 61 25.491 32.724 6.636 1.00 0.00 N ATOM 401 CA PHE A 61 24.115 32.224 6.907 1.00 0.00 C ATOM 402 C PHE A 61 23.910 32.085 8.417 1.00 0.00 C ATOM 403 O PHE A 61 22.801 32.139 8.910 1.00 0.00 O ATOM 404 CB PHE A 61 23.928 30.860 6.239 1.00 0.00 C ATOM 405 CG PHE A 61 23.766 31.048 4.750 1.00 0.00 C ATOM 406 CD1 PHE A 61 24.892 31.061 3.920 1.00 0.00 C ATOM 407 CD2 PHE A 61 22.489 31.210 4.199 1.00 0.00 C ATOM 408 CE1 PHE A 61 24.743 31.234 2.539 1.00 0.00 C ATOM 409 CE2 PHE A 61 22.339 31.384 2.818 1.00 0.00 C ATOM 410 CZ PHE A 61 23.466 31.396 1.988 1.00 0.00 C ATOM 0 H PHE A 61 26.136 32.034 6.251 1.00 0.00 H new ATOM 0 HA PHE A 61 23.387 32.929 6.506 1.00 0.00 H new ATOM 0 HB2 PHE A 61 24.787 30.221 6.445 1.00 0.00 H new ATOM 0 HB3 PHE A 61 23.052 30.358 6.651 1.00 0.00 H new ATOM 0 HD1 PHE A 61 25.877 30.937 4.345 1.00 0.00 H new ATOM 0 HD2 PHE A 61 21.620 31.201 4.840 1.00 0.00 H new ATOM 0 HE1 PHE A 61 25.613 31.243 1.899 1.00 0.00 H new ATOM 0 HE2 PHE A 61 21.354 31.509 2.393 1.00 0.00 H new ATOM 0 HZ PHE A 61 23.351 31.530 0.923 1.00 0.00 H new ATOM 420 N GLY A 62 24.971 31.908 9.155 1.00 0.00 N ATOM 421 CA GLY A 62 24.836 31.767 10.632 1.00 0.00 C ATOM 422 C GLY A 62 26.145 31.235 11.217 1.00 0.00 C ATOM 423 O GLY A 62 27.111 31.025 10.510 1.00 0.00 O ATOM 0 H GLY A 62 25.925 31.855 8.799 1.00 0.00 H new ATOM 0 HA2 GLY A 62 24.591 32.731 11.079 1.00 0.00 H new ATOM 0 HA3 GLY A 62 24.017 31.088 10.870 1.00 0.00 H new ATOM 427 N ASN A 63 26.185 31.015 12.502 1.00 0.00 N ATOM 428 CA ASN A 63 27.433 30.496 13.131 1.00 0.00 C ATOM 429 C ASN A 63 27.381 28.969 13.184 1.00 0.00 C ATOM 430 O ASN A 63 26.354 28.383 13.466 1.00 0.00 O ATOM 431 CB ASN A 63 27.556 31.051 14.551 1.00 0.00 C ATOM 432 CG ASN A 63 27.724 32.571 14.492 1.00 0.00 C ATOM 433 OD1 ASN A 63 28.037 33.120 13.454 1.00 0.00 O ATOM 434 ND2 ASN A 63 27.527 33.279 15.570 1.00 0.00 N ATOM 0 H ASN A 63 25.408 31.172 13.144 1.00 0.00 H new ATOM 0 HA ASN A 63 28.295 30.810 12.541 1.00 0.00 H new ATOM 0 HB2 ASN A 63 26.670 30.795 15.131 1.00 0.00 H new ATOM 0 HB3 ASN A 63 28.409 30.599 15.057 1.00 0.00 H new ATOM 0 HD21 ASN A 63 27.636 34.293 15.541 1.00 0.00 H new ATOM 0 HD22 ASN A 63 27.264 32.819 16.442 1.00 0.00 H new ATOM 441 N ILE A 64 28.479 28.318 12.912 1.00 0.00 N ATOM 442 CA ILE A 64 28.489 26.829 12.947 1.00 0.00 C ATOM 443 C ILE A 64 29.093 26.354 14.271 1.00 0.00 C ATOM 444 O ILE A 64 30.115 26.842 14.709 1.00 0.00 O ATOM 445 CB ILE A 64 29.327 26.298 11.782 1.00 0.00 C ATOM 446 CG1 ILE A 64 28.793 26.872 10.468 1.00 0.00 C ATOM 447 CG2 ILE A 64 29.239 24.770 11.744 1.00 0.00 C ATOM 448 CD1 ILE A 64 29.831 26.668 9.362 1.00 0.00 C ATOM 0 H ILE A 64 29.369 28.753 12.667 1.00 0.00 H new ATOM 0 HA ILE A 64 27.469 26.456 12.860 1.00 0.00 H new ATOM 0 HB ILE A 64 30.366 26.598 11.915 1.00 0.00 H new ATOM 0 HG12 ILE A 64 27.858 26.382 10.198 1.00 0.00 H new ATOM 0 HG13 ILE A 64 28.574 27.933 10.585 1.00 0.00 H new ATOM 0 HG21 ILE A 64 29.836 24.392 10.914 1.00 0.00 H new ATOM 0 HG22 ILE A 64 29.618 24.360 12.680 1.00 0.00 H new ATOM 0 HG23 ILE A 64 28.200 24.469 11.611 1.00 0.00 H new ATOM 0 HD11 ILE A 64 29.450 27.077 8.426 1.00 0.00 H new ATOM 0 HD12 ILE A 64 30.755 27.179 9.632 1.00 0.00 H new ATOM 0 HD13 ILE A 64 30.027 25.603 9.239 1.00 0.00 H new ATOM 460 N ILE A 65 28.467 25.404 14.910 1.00 0.00 N ATOM 461 CA ILE A 65 29.003 24.899 16.205 1.00 0.00 C ATOM 462 C ILE A 65 29.838 23.641 15.957 1.00 0.00 C ATOM 463 O ILE A 65 30.706 23.298 16.734 1.00 0.00 O ATOM 464 CB ILE A 65 27.841 24.562 17.141 1.00 0.00 C ATOM 465 CG1 ILE A 65 27.103 23.328 16.616 1.00 0.00 C ATOM 466 CG2 ILE A 65 26.875 25.746 17.201 1.00 0.00 C ATOM 467 CD1 ILE A 65 25.941 22.991 17.552 1.00 0.00 C ATOM 0 H ILE A 65 27.608 24.956 14.591 1.00 0.00 H new ATOM 0 HA ILE A 65 29.628 25.666 16.662 1.00 0.00 H new ATOM 0 HB ILE A 65 28.227 24.357 18.139 1.00 0.00 H new ATOM 0 HG12 ILE A 65 26.730 23.515 15.609 1.00 0.00 H new ATOM 0 HG13 ILE A 65 27.788 22.482 16.550 1.00 0.00 H new ATOM 0 HG21 ILE A 65 26.047 25.506 17.868 1.00 0.00 H new ATOM 0 HG22 ILE A 65 27.400 26.625 17.575 1.00 0.00 H new ATOM 0 HG23 ILE A 65 26.489 25.952 16.203 1.00 0.00 H new ATOM 0 HD11 ILE A 65 25.416 22.112 17.178 1.00 0.00 H new ATOM 0 HD12 ILE A 65 26.326 22.786 18.551 1.00 0.00 H new ATOM 0 HD13 ILE A 65 25.252 23.835 17.595 1.00 0.00 H new ATOM 479 N ASP A 66 29.580 22.948 14.882 1.00 0.00 N ATOM 480 CA ASP A 66 30.360 21.713 14.589 1.00 0.00 C ATOM 481 C ASP A 66 30.528 21.559 13.076 1.00 0.00 C ATOM 482 O ASP A 66 29.566 21.478 12.339 1.00 0.00 O ATOM 483 CB ASP A 66 29.612 20.499 15.145 1.00 0.00 C ATOM 484 CG ASP A 66 30.528 19.273 15.103 1.00 0.00 C ATOM 485 OD1 ASP A 66 31.681 19.432 14.740 1.00 0.00 O ATOM 486 OD2 ASP A 66 30.059 18.197 15.435 1.00 0.00 O ATOM 0 H ASP A 66 28.864 23.183 14.195 1.00 0.00 H new ATOM 0 HA ASP A 66 31.342 21.784 15.056 1.00 0.00 H new ATOM 0 HB2 ASP A 66 29.292 20.693 16.169 1.00 0.00 H new ATOM 0 HB3 ASP A 66 28.711 20.314 14.560 1.00 0.00 H new ATOM 491 N LEU A 67 31.746 21.515 12.607 1.00 0.00 N ATOM 492 CA LEU A 67 31.977 21.364 11.143 1.00 0.00 C ATOM 493 C LEU A 67 32.552 19.974 10.860 1.00 0.00 C ATOM 494 O LEU A 67 33.594 19.608 11.367 1.00 0.00 O ATOM 495 CB LEU A 67 32.963 22.431 10.666 1.00 0.00 C ATOM 496 CG LEU A 67 33.232 22.246 9.171 1.00 0.00 C ATOM 497 CD1 LEU A 67 32.169 22.995 8.365 1.00 0.00 C ATOM 498 CD2 LEU A 67 34.616 22.800 8.827 1.00 0.00 C ATOM 0 H LEU A 67 32.591 21.577 13.175 1.00 0.00 H new ATOM 0 HA LEU A 67 31.032 21.483 10.613 1.00 0.00 H new ATOM 0 HB2 LEU A 67 32.558 23.425 10.853 1.00 0.00 H new ATOM 0 HB3 LEU A 67 33.895 22.356 11.226 1.00 0.00 H new ATOM 0 HG LEU A 67 33.195 21.185 8.925 1.00 0.00 H new ATOM 0 HD11 LEU A 67 32.360 22.864 7.300 1.00 0.00 H new ATOM 0 HD12 LEU A 67 31.183 22.600 8.608 1.00 0.00 H new ATOM 0 HD13 LEU A 67 32.206 24.056 8.612 1.00 0.00 H new ATOM 0 HD21 LEU A 67 34.806 22.668 7.762 1.00 0.00 H new ATOM 0 HD22 LEU A 67 34.655 23.861 9.073 1.00 0.00 H new ATOM 0 HD23 LEU A 67 35.374 22.266 9.400 1.00 0.00 H new ATOM 510 N SER A 68 31.883 19.197 10.052 1.00 0.00 N ATOM 511 CA SER A 68 32.393 17.833 9.737 1.00 0.00 C ATOM 512 C SER A 68 32.288 17.586 8.231 1.00 0.00 C ATOM 513 O SER A 68 31.362 18.032 7.583 1.00 0.00 O ATOM 514 CB SER A 68 31.560 16.791 10.486 1.00 0.00 C ATOM 515 OG SER A 68 32.090 15.498 10.242 1.00 0.00 O ATOM 0 H SER A 68 31.005 19.448 9.597 1.00 0.00 H new ATOM 0 HA SER A 68 33.435 17.753 10.046 1.00 0.00 H new ATOM 0 HB2 SER A 68 31.568 17.003 11.555 1.00 0.00 H new ATOM 0 HB3 SER A 68 30.521 16.837 10.160 1.00 0.00 H new ATOM 0 HG SER A 68 31.558 14.830 10.723 1.00 0.00 H new ATOM 521 N MET A 69 33.229 16.878 7.669 1.00 0.00 N ATOM 522 CA MET A 69 33.181 16.605 6.205 1.00 0.00 C ATOM 523 C MET A 69 33.364 15.106 5.957 1.00 0.00 C ATOM 524 O MET A 69 34.001 14.413 6.725 1.00 0.00 O ATOM 525 CB MET A 69 34.301 17.377 5.506 1.00 0.00 C ATOM 526 CG MET A 69 34.047 18.881 5.642 1.00 0.00 C ATOM 527 SD MET A 69 35.205 19.786 4.587 1.00 0.00 S ATOM 528 CE MET A 69 34.460 19.341 2.999 1.00 0.00 C ATOM 0 H MET A 69 34.028 16.477 8.160 1.00 0.00 H new ATOM 0 HA MET A 69 32.217 16.923 5.809 1.00 0.00 H new ATOM 0 HB2 MET A 69 35.264 17.119 5.946 1.00 0.00 H new ATOM 0 HB3 MET A 69 34.347 17.099 4.453 1.00 0.00 H new ATOM 0 HG2 MET A 69 33.021 19.115 5.358 1.00 0.00 H new ATOM 0 HG3 MET A 69 34.168 19.189 6.681 1.00 0.00 H new ATOM 0 HE1 MET A 69 34.659 20.127 2.271 1.00 0.00 H new ATOM 0 HE2 MET A 69 34.888 18.402 2.647 1.00 0.00 H new ATOM 0 HE3 MET A 69 33.383 19.225 3.122 1.00 0.00 H new ATOM 538 N ASP A 70 32.809 14.601 4.889 1.00 0.00 N ATOM 539 CA ASP A 70 32.951 13.147 4.591 1.00 0.00 C ATOM 540 C ASP A 70 33.483 12.969 3.167 1.00 0.00 C ATOM 541 O ASP A 70 32.743 13.046 2.206 1.00 0.00 O ATOM 542 CB ASP A 70 31.587 12.465 4.715 1.00 0.00 C ATOM 543 CG ASP A 70 31.671 11.337 5.746 1.00 0.00 C ATOM 544 OD1 ASP A 70 32.065 10.245 5.369 1.00 0.00 O ATOM 545 OD2 ASP A 70 31.341 11.584 6.893 1.00 0.00 O ATOM 0 H ASP A 70 32.264 15.132 4.210 1.00 0.00 H new ATOM 0 HA ASP A 70 33.647 12.697 5.299 1.00 0.00 H new ATOM 0 HB2 ASP A 70 30.832 13.191 5.016 1.00 0.00 H new ATOM 0 HB3 ASP A 70 31.279 12.066 3.748 1.00 0.00 H new ATOM 550 N PRO A 71 34.797 12.729 3.036 1.00 0.00 N ATOM 551 CA PRO A 71 35.435 12.540 1.733 1.00 0.00 C ATOM 552 C PRO A 71 35.139 11.170 1.089 1.00 0.00 C ATOM 553 O PRO A 71 35.150 11.053 -0.120 1.00 0.00 O ATOM 554 CB PRO A 71 36.926 12.675 2.038 1.00 0.00 C ATOM 555 CG PRO A 71 37.069 12.318 3.481 1.00 0.00 C ATOM 556 CD PRO A 71 35.755 12.628 4.152 1.00 0.00 C ATOM 0 HA PRO A 71 35.060 13.263 1.008 1.00 0.00 H new ATOM 0 HB2 PRO A 71 37.518 12.011 1.408 1.00 0.00 H new ATOM 0 HB3 PRO A 71 37.276 13.690 1.848 1.00 0.00 H new ATOM 0 HG2 PRO A 71 37.318 11.263 3.593 1.00 0.00 H new ATOM 0 HG3 PRO A 71 37.878 12.887 3.939 1.00 0.00 H new ATOM 0 HD2 PRO A 71 35.470 11.843 4.852 1.00 0.00 H new ATOM 0 HD3 PRO A 71 35.806 13.558 4.719 1.00 0.00 H new ATOM 564 N PRO A 72 34.871 10.110 1.885 1.00 0.00 N ATOM 565 CA PRO A 72 34.586 8.784 1.323 1.00 0.00 C ATOM 566 C PRO A 72 33.178 8.710 0.724 1.00 0.00 C ATOM 567 O PRO A 72 32.910 7.921 -0.159 1.00 0.00 O ATOM 568 CB PRO A 72 34.688 7.848 2.524 1.00 0.00 C ATOM 569 CG PRO A 72 34.394 8.706 3.708 1.00 0.00 C ATOM 570 CD PRO A 72 34.823 10.105 3.361 1.00 0.00 C ATOM 0 HA PRO A 72 35.271 8.533 0.513 1.00 0.00 H new ATOM 0 HB2 PRO A 72 33.976 7.026 2.446 1.00 0.00 H new ATOM 0 HB3 PRO A 72 35.681 7.404 2.595 1.00 0.00 H new ATOM 0 HG2 PRO A 72 33.331 8.678 3.949 1.00 0.00 H new ATOM 0 HG3 PRO A 72 34.930 8.346 4.586 1.00 0.00 H new ATOM 0 HD2 PRO A 72 34.117 10.844 3.740 1.00 0.00 H new ATOM 0 HD3 PRO A 72 35.795 10.343 3.793 1.00 0.00 H new ATOM 578 N ARG A 73 32.276 9.525 1.200 1.00 0.00 N ATOM 579 CA ARG A 73 30.888 9.499 0.659 1.00 0.00 C ATOM 580 C ARG A 73 30.625 10.775 -0.143 1.00 0.00 C ATOM 581 O ARG A 73 29.552 10.971 -0.679 1.00 0.00 O ATOM 582 CB ARG A 73 29.892 9.409 1.817 1.00 0.00 C ATOM 583 CG ARG A 73 30.129 8.111 2.592 1.00 0.00 C ATOM 584 CD ARG A 73 29.074 7.972 3.691 1.00 0.00 C ATOM 585 NE ARG A 73 29.422 6.817 4.566 1.00 0.00 N ATOM 586 CZ ARG A 73 28.638 6.489 5.556 1.00 0.00 C ATOM 587 NH1 ARG A 73 28.711 7.136 6.688 1.00 0.00 N ATOM 588 NH2 ARG A 73 27.782 5.515 5.416 1.00 0.00 N ATOM 0 H ARG A 73 32.441 10.207 1.940 1.00 0.00 H new ATOM 0 HA ARG A 73 30.769 8.633 0.008 1.00 0.00 H new ATOM 0 HB2 ARG A 73 30.009 10.267 2.479 1.00 0.00 H new ATOM 0 HB3 ARG A 73 28.871 9.437 1.436 1.00 0.00 H new ATOM 0 HG2 ARG A 73 30.080 7.257 1.916 1.00 0.00 H new ATOM 0 HG3 ARG A 73 31.127 8.114 3.030 1.00 0.00 H new ATOM 0 HD2 ARG A 73 29.024 8.887 4.281 1.00 0.00 H new ATOM 0 HD3 ARG A 73 28.089 7.824 3.249 1.00 0.00 H new ATOM 0 HE ARG A 73 30.273 6.283 4.391 1.00 0.00 H new ATOM 0 HH11 ARG A 73 29.381 7.897 6.798 1.00 0.00 H new ATOM 0 HH12 ARG A 73 28.098 6.880 7.462 1.00 0.00 H new ATOM 0 HH21 ARG A 73 27.725 5.009 4.532 1.00 0.00 H new ATOM 0 HH22 ARG A 73 27.169 5.259 6.190 1.00 0.00 H new ATOM 602 N ASN A 74 31.595 11.645 -0.233 1.00 0.00 N ATOM 603 CA ASN A 74 31.396 12.904 -1.003 1.00 0.00 C ATOM 604 C ASN A 74 30.258 13.714 -0.377 1.00 0.00 C ATOM 605 O ASN A 74 29.384 14.206 -1.062 1.00 0.00 O ATOM 606 CB ASN A 74 31.041 12.565 -2.451 1.00 0.00 C ATOM 607 CG ASN A 74 32.206 11.815 -3.099 1.00 0.00 C ATOM 608 OD1 ASN A 74 33.310 11.828 -2.592 1.00 0.00 O ATOM 609 ND2 ASN A 74 32.006 11.155 -4.208 1.00 0.00 N ATOM 0 H ASN A 74 32.515 11.537 0.193 1.00 0.00 H new ATOM 0 HA ASN A 74 32.314 13.491 -0.980 1.00 0.00 H new ATOM 0 HB2 ASN A 74 30.139 11.954 -2.482 1.00 0.00 H new ATOM 0 HB3 ASN A 74 30.827 13.478 -3.008 1.00 0.00 H new ATOM 0 HD21 ASN A 74 32.776 10.651 -4.648 1.00 0.00 H new ATOM 0 HD22 ASN A 74 31.080 11.143 -4.635 1.00 0.00 H new ATOM 616 N CYS A 75 30.261 13.856 0.920 1.00 0.00 N ATOM 617 CA CYS A 75 29.178 14.635 1.586 1.00 0.00 C ATOM 618 C CYS A 75 29.745 15.352 2.814 1.00 0.00 C ATOM 619 O CYS A 75 30.458 14.772 3.609 1.00 0.00 O ATOM 620 CB CYS A 75 28.060 13.685 2.018 1.00 0.00 C ATOM 621 SG CYS A 75 28.662 12.608 3.343 1.00 0.00 S ATOM 0 H CYS A 75 30.965 13.467 1.547 1.00 0.00 H new ATOM 0 HA CYS A 75 28.779 15.372 0.889 1.00 0.00 H new ATOM 0 HB2 CYS A 75 27.197 14.255 2.362 1.00 0.00 H new ATOM 0 HB3 CYS A 75 27.729 13.086 1.170 1.00 0.00 H new ATOM 0 HG CYS A 75 28.356 13.126 4.496 1.00 0.00 H new ATOM 627 N ALA A 76 29.433 16.608 2.975 1.00 0.00 N ATOM 628 CA ALA A 76 29.953 17.360 4.152 1.00 0.00 C ATOM 629 C ALA A 76 28.821 17.580 5.158 1.00 0.00 C ATOM 630 O ALA A 76 27.656 17.483 4.825 1.00 0.00 O ATOM 631 CB ALA A 76 30.499 18.713 3.692 1.00 0.00 C ATOM 0 H ALA A 76 28.841 17.146 2.343 1.00 0.00 H new ATOM 0 HA ALA A 76 30.752 16.788 4.625 1.00 0.00 H new ATOM 0 HB1 ALA A 76 30.879 19.263 4.552 1.00 0.00 H new ATOM 0 HB2 ALA A 76 31.306 18.555 2.976 1.00 0.00 H new ATOM 0 HB3 ALA A 76 29.701 19.286 3.219 1.00 0.00 H new ATOM 637 N PHE A 77 29.153 17.877 6.384 1.00 0.00 N ATOM 638 CA PHE A 77 28.093 18.102 7.408 1.00 0.00 C ATOM 639 C PHE A 77 28.320 19.453 8.088 1.00 0.00 C ATOM 640 O PHE A 77 29.418 19.778 8.495 1.00 0.00 O ATOM 641 CB PHE A 77 28.149 16.987 8.455 1.00 0.00 C ATOM 642 CG PHE A 77 27.855 15.661 7.796 1.00 0.00 C ATOM 643 CD1 PHE A 77 26.533 15.217 7.676 1.00 0.00 C ATOM 644 CD2 PHE A 77 28.905 14.875 7.306 1.00 0.00 C ATOM 645 CE1 PHE A 77 26.261 13.987 7.065 1.00 0.00 C ATOM 646 CE2 PHE A 77 28.633 13.646 6.695 1.00 0.00 C ATOM 647 CZ PHE A 77 27.311 13.201 6.574 1.00 0.00 C ATOM 0 H PHE A 77 30.111 17.974 6.721 1.00 0.00 H new ATOM 0 HA PHE A 77 27.115 18.098 6.926 1.00 0.00 H new ATOM 0 HB2 PHE A 77 29.133 16.962 8.923 1.00 0.00 H new ATOM 0 HB3 PHE A 77 27.425 17.180 9.246 1.00 0.00 H new ATOM 0 HD1 PHE A 77 25.723 15.823 8.055 1.00 0.00 H new ATOM 0 HD2 PHE A 77 29.925 15.217 7.400 1.00 0.00 H new ATOM 0 HE1 PHE A 77 25.241 13.644 6.972 1.00 0.00 H new ATOM 0 HE2 PHE A 77 29.443 13.040 6.317 1.00 0.00 H new ATOM 0 HZ PHE A 77 27.101 12.252 6.102 1.00 0.00 H new ATOM 657 N VAL A 78 27.289 20.244 8.217 1.00 0.00 N ATOM 658 CA VAL A 78 27.445 21.573 8.872 1.00 0.00 C ATOM 659 C VAL A 78 26.390 21.728 9.969 1.00 0.00 C ATOM 660 O VAL A 78 25.221 21.470 9.760 1.00 0.00 O ATOM 661 CB VAL A 78 27.265 22.678 7.830 1.00 0.00 C ATOM 662 CG1 VAL A 78 27.540 24.038 8.475 1.00 0.00 C ATOM 663 CG2 VAL A 78 28.244 22.454 6.676 1.00 0.00 C ATOM 0 H VAL A 78 26.345 20.026 7.897 1.00 0.00 H new ATOM 0 HA VAL A 78 28.439 21.647 9.312 1.00 0.00 H new ATOM 0 HB VAL A 78 26.244 22.656 7.450 1.00 0.00 H new ATOM 0 HG11 VAL A 78 27.412 24.825 7.732 1.00 0.00 H new ATOM 0 HG12 VAL A 78 26.843 24.198 9.298 1.00 0.00 H new ATOM 0 HG13 VAL A 78 28.561 24.061 8.855 1.00 0.00 H new ATOM 0 HG21 VAL A 78 28.117 23.241 5.933 1.00 0.00 H new ATOM 0 HG22 VAL A 78 29.265 22.476 7.056 1.00 0.00 H new ATOM 0 HG23 VAL A 78 28.049 21.485 6.216 1.00 0.00 H new ATOM 673 N THR A 79 26.792 22.147 11.138 1.00 0.00 N ATOM 674 CA THR A 79 25.811 22.316 12.247 1.00 0.00 C ATOM 675 C THR A 79 25.518 23.805 12.445 1.00 0.00 C ATOM 676 O THR A 79 26.403 24.635 12.387 1.00 0.00 O ATOM 677 CB THR A 79 26.394 21.736 13.537 1.00 0.00 C ATOM 678 OG1 THR A 79 26.984 20.473 13.262 1.00 0.00 O ATOM 679 CG2 THR A 79 25.281 21.566 14.571 1.00 0.00 C ATOM 0 H THR A 79 27.757 22.379 11.373 1.00 0.00 H new ATOM 0 HA THR A 79 24.888 21.793 11.998 1.00 0.00 H new ATOM 0 HB THR A 79 27.152 22.414 13.930 1.00 0.00 H new ATOM 0 HG1 THR A 79 27.834 20.604 12.793 1.00 0.00 H new ATOM 0 HG21 THR A 79 25.698 21.153 15.489 1.00 0.00 H new ATOM 0 HG22 THR A 79 24.829 22.535 14.782 1.00 0.00 H new ATOM 0 HG23 THR A 79 24.522 20.889 14.180 1.00 0.00 H new ATOM 687 N TYR A 80 24.281 24.148 12.682 1.00 0.00 N ATOM 688 CA TYR A 80 23.933 25.584 12.885 1.00 0.00 C ATOM 689 C TYR A 80 23.363 25.777 14.292 1.00 0.00 C ATOM 690 O TYR A 80 22.531 25.016 14.745 1.00 0.00 O ATOM 691 CB TYR A 80 22.889 26.008 11.851 1.00 0.00 C ATOM 692 CG TYR A 80 23.575 26.679 10.686 1.00 0.00 C ATOM 693 CD1 TYR A 80 24.587 27.618 10.916 1.00 0.00 C ATOM 694 CD2 TYR A 80 23.199 26.364 9.375 1.00 0.00 C ATOM 695 CE1 TYR A 80 25.223 28.242 9.836 1.00 0.00 C ATOM 696 CE2 TYR A 80 23.834 26.986 8.295 1.00 0.00 C ATOM 697 CZ TYR A 80 24.846 27.926 8.525 1.00 0.00 C ATOM 698 OH TYR A 80 25.473 28.541 7.460 1.00 0.00 O ATOM 0 H TYR A 80 23.498 23.498 12.744 1.00 0.00 H new ATOM 0 HA TYR A 80 24.829 26.194 12.768 1.00 0.00 H new ATOM 0 HB2 TYR A 80 22.330 25.138 11.505 1.00 0.00 H new ATOM 0 HB3 TYR A 80 22.169 26.690 12.304 1.00 0.00 H new ATOM 0 HD1 TYR A 80 24.878 27.861 11.927 1.00 0.00 H new ATOM 0 HD2 TYR A 80 22.418 25.640 9.197 1.00 0.00 H new ATOM 0 HE1 TYR A 80 26.004 28.967 10.014 1.00 0.00 H new ATOM 0 HE2 TYR A 80 23.544 26.741 7.284 1.00 0.00 H new ATOM 0 HH TYR A 80 25.847 29.398 7.752 1.00 0.00 H new ATOM 708 N GLU A 81 23.804 26.790 14.987 1.00 0.00 N ATOM 709 CA GLU A 81 23.285 27.031 16.362 1.00 0.00 C ATOM 710 C GLU A 81 21.756 27.062 16.330 1.00 0.00 C ATOM 711 O GLU A 81 21.097 26.635 17.257 1.00 0.00 O ATOM 712 CB GLU A 81 23.811 28.373 16.878 1.00 0.00 C ATOM 713 CG GLU A 81 23.505 28.503 18.371 1.00 0.00 C ATOM 714 CD GLU A 81 23.969 29.873 18.869 1.00 0.00 C ATOM 715 OE1 GLU A 81 24.518 30.616 18.073 1.00 0.00 O ATOM 716 OE2 GLU A 81 23.766 30.157 20.038 1.00 0.00 O ATOM 0 H GLU A 81 24.501 27.460 14.662 1.00 0.00 H new ATOM 0 HA GLU A 81 23.620 26.231 17.023 1.00 0.00 H new ATOM 0 HB2 GLU A 81 24.886 28.443 16.709 1.00 0.00 H new ATOM 0 HB3 GLU A 81 23.348 29.192 16.329 1.00 0.00 H new ATOM 0 HG2 GLU A 81 22.436 28.384 18.546 1.00 0.00 H new ATOM 0 HG3 GLU A 81 24.009 27.712 18.927 1.00 0.00 H new ATOM 723 N LYS A 82 21.187 27.563 15.269 1.00 0.00 N ATOM 724 CA LYS A 82 19.701 27.620 15.175 1.00 0.00 C ATOM 725 C LYS A 82 19.248 26.997 13.853 1.00 0.00 C ATOM 726 O LYS A 82 19.883 27.158 12.830 1.00 0.00 O ATOM 727 CB LYS A 82 19.242 29.079 15.234 1.00 0.00 C ATOM 728 CG LYS A 82 19.659 29.691 16.573 1.00 0.00 C ATOM 729 CD LYS A 82 18.958 31.037 16.758 1.00 0.00 C ATOM 730 CE LYS A 82 19.486 32.033 15.724 1.00 0.00 C ATOM 731 NZ LYS A 82 19.275 33.423 16.219 1.00 0.00 N ATOM 0 H LYS A 82 21.687 27.936 14.462 1.00 0.00 H new ATOM 0 HA LYS A 82 19.264 27.067 16.006 1.00 0.00 H new ATOM 0 HB2 LYS A 82 19.682 29.643 14.411 1.00 0.00 H new ATOM 0 HB3 LYS A 82 18.160 29.136 15.117 1.00 0.00 H new ATOM 0 HG2 LYS A 82 19.398 29.018 17.390 1.00 0.00 H new ATOM 0 HG3 LYS A 82 20.740 29.825 16.603 1.00 0.00 H new ATOM 0 HD2 LYS A 82 17.881 30.917 16.646 1.00 0.00 H new ATOM 0 HD3 LYS A 82 19.133 31.415 17.765 1.00 0.00 H new ATOM 0 HE2 LYS A 82 20.546 31.857 15.543 1.00 0.00 H new ATOM 0 HE3 LYS A 82 18.972 31.893 14.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 19.634 34.100 15.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 18.259 33.587 16.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 19.784 33.553 17.116 1.00 0.00 H new ATOM 745 N MET A 83 18.154 26.286 13.866 1.00 0.00 N ATOM 746 CA MET A 83 17.661 25.652 12.611 1.00 0.00 C ATOM 747 C MET A 83 17.323 26.738 11.587 1.00 0.00 C ATOM 748 O MET A 83 17.346 26.508 10.395 1.00 0.00 O ATOM 749 CB MET A 83 16.408 24.829 12.914 1.00 0.00 C ATOM 750 CG MET A 83 16.799 23.578 13.704 1.00 0.00 C ATOM 751 SD MET A 83 15.311 22.638 14.124 1.00 0.00 S ATOM 752 CE MET A 83 15.230 23.109 15.868 1.00 0.00 C ATOM 0 H MET A 83 17.580 26.117 14.692 1.00 0.00 H new ATOM 0 HA MET A 83 18.435 25.000 12.206 1.00 0.00 H new ATOM 0 HB2 MET A 83 15.697 25.426 13.486 1.00 0.00 H new ATOM 0 HB3 MET A 83 15.912 24.546 11.985 1.00 0.00 H new ATOM 0 HG2 MET A 83 17.478 22.961 13.115 1.00 0.00 H new ATOM 0 HG3 MET A 83 17.332 23.860 14.612 1.00 0.00 H new ATOM 0 HE1 MET A 83 15.419 22.234 16.490 1.00 0.00 H new ATOM 0 HE2 MET A 83 15.982 23.870 16.075 1.00 0.00 H new ATOM 0 HE3 MET A 83 14.240 23.507 16.092 1.00 0.00 H new ATOM 762 N GLU A 84 17.009 27.920 12.043 1.00 0.00 N ATOM 763 CA GLU A 84 16.669 29.018 11.093 1.00 0.00 C ATOM 764 C GLU A 84 17.882 29.327 10.212 1.00 0.00 C ATOM 765 O GLU A 84 17.754 29.571 9.029 1.00 0.00 O ATOM 766 CB GLU A 84 16.278 30.270 11.881 1.00 0.00 C ATOM 767 CG GLU A 84 14.995 29.999 12.669 1.00 0.00 C ATOM 768 CD GLU A 84 14.561 31.275 13.394 1.00 0.00 C ATOM 769 OE1 GLU A 84 15.341 32.213 13.417 1.00 0.00 O ATOM 770 OE2 GLU A 84 13.458 31.291 13.912 1.00 0.00 O ATOM 0 H GLU A 84 16.973 28.173 13.031 1.00 0.00 H new ATOM 0 HA GLU A 84 15.834 28.708 10.464 1.00 0.00 H new ATOM 0 HB2 GLU A 84 17.082 30.550 12.561 1.00 0.00 H new ATOM 0 HB3 GLU A 84 16.129 31.109 11.201 1.00 0.00 H new ATOM 0 HG2 GLU A 84 14.206 29.665 11.995 1.00 0.00 H new ATOM 0 HG3 GLU A 84 15.160 29.198 13.389 1.00 0.00 H new ATOM 777 N SER A 85 19.058 29.320 10.778 1.00 0.00 N ATOM 778 CA SER A 85 20.276 29.613 9.971 1.00 0.00 C ATOM 779 C SER A 85 20.459 28.531 8.905 1.00 0.00 C ATOM 780 O SER A 85 20.921 28.794 7.814 1.00 0.00 O ATOM 781 CB SER A 85 21.502 29.639 10.887 1.00 0.00 C ATOM 782 OG SER A 85 21.259 30.514 11.978 1.00 0.00 O ATOM 0 H SER A 85 19.228 29.124 11.764 1.00 0.00 H new ATOM 0 HA SER A 85 20.163 30.583 9.486 1.00 0.00 H new ATOM 0 HB2 SER A 85 21.717 28.635 11.253 1.00 0.00 H new ATOM 0 HB3 SER A 85 22.379 29.970 10.330 1.00 0.00 H new ATOM 0 HG SER A 85 22.043 30.530 12.566 1.00 0.00 H new ATOM 788 N ALA A 86 20.100 27.314 9.214 1.00 0.00 N ATOM 789 CA ALA A 86 20.255 26.217 8.217 1.00 0.00 C ATOM 790 C ALA A 86 19.208 26.377 7.113 1.00 0.00 C ATOM 791 O ALA A 86 19.445 26.051 5.968 1.00 0.00 O ATOM 792 CB ALA A 86 20.063 24.866 8.910 1.00 0.00 C ATOM 0 H ALA A 86 19.707 27.033 10.112 1.00 0.00 H new ATOM 0 HA ALA A 86 21.253 26.263 7.780 1.00 0.00 H new ATOM 0 HB1 ALA A 86 20.176 24.064 8.181 1.00 0.00 H new ATOM 0 HB2 ALA A 86 20.810 24.751 9.696 1.00 0.00 H new ATOM 0 HB3 ALA A 86 19.066 24.820 9.348 1.00 0.00 H new ATOM 798 N ASP A 87 18.050 26.876 7.448 1.00 0.00 N ATOM 799 CA ASP A 87 16.989 27.055 6.417 1.00 0.00 C ATOM 800 C ASP A 87 17.443 28.094 5.390 1.00 0.00 C ATOM 801 O ASP A 87 17.263 27.925 4.201 1.00 0.00 O ATOM 802 CB ASP A 87 15.701 27.532 7.089 1.00 0.00 C ATOM 803 CG ASP A 87 14.583 27.613 6.048 1.00 0.00 C ATOM 804 OD1 ASP A 87 13.951 26.597 5.807 1.00 0.00 O ATOM 805 OD2 ASP A 87 14.376 28.689 5.511 1.00 0.00 O ATOM 0 H ASP A 87 17.793 27.167 8.391 1.00 0.00 H new ATOM 0 HA ASP A 87 16.807 26.105 5.915 1.00 0.00 H new ATOM 0 HB2 ASP A 87 15.420 26.846 7.888 1.00 0.00 H new ATOM 0 HB3 ASP A 87 15.857 28.509 7.547 1.00 0.00 H new ATOM 810 N GLN A 88 18.030 29.169 5.839 1.00 0.00 N ATOM 811 CA GLN A 88 18.494 30.218 4.888 1.00 0.00 C ATOM 812 C GLN A 88 19.654 29.675 4.052 1.00 0.00 C ATOM 813 O GLN A 88 19.779 29.972 2.880 1.00 0.00 O ATOM 814 CB GLN A 88 18.961 31.446 5.672 1.00 0.00 C ATOM 815 CG GLN A 88 19.318 32.569 4.695 1.00 0.00 C ATOM 816 CD GLN A 88 19.775 33.801 5.479 1.00 0.00 C ATOM 817 OE1 GLN A 88 19.726 33.816 6.693 1.00 0.00 O ATOM 818 NE2 GLN A 88 20.222 34.842 4.831 1.00 0.00 N ATOM 0 H GLN A 88 18.208 29.366 6.824 1.00 0.00 H new ATOM 0 HA GLN A 88 17.673 30.498 4.228 1.00 0.00 H new ATOM 0 HB2 GLN A 88 18.176 31.777 6.352 1.00 0.00 H new ATOM 0 HB3 GLN A 88 19.827 31.193 6.284 1.00 0.00 H new ATOM 0 HG2 GLN A 88 20.108 32.241 4.020 1.00 0.00 H new ATOM 0 HG3 GLN A 88 18.454 32.817 4.078 1.00 0.00 H new ATOM 0 HE21 GLN A 88 20.263 34.829 3.812 1.00 0.00 H new ATOM 0 HE22 GLN A 88 20.530 35.668 5.344 1.00 0.00 H new ATOM 827 N ALA A 89 20.505 28.882 4.643 1.00 0.00 N ATOM 828 CA ALA A 89 21.656 28.323 3.880 1.00 0.00 C ATOM 829 C ALA A 89 21.170 27.184 2.982 1.00 0.00 C ATOM 830 O ALA A 89 21.474 27.134 1.807 1.00 0.00 O ATOM 831 CB ALA A 89 22.705 27.789 4.858 1.00 0.00 C ATOM 0 H ALA A 89 20.453 28.597 5.621 1.00 0.00 H new ATOM 0 HA ALA A 89 22.098 29.107 3.264 1.00 0.00 H new ATOM 0 HB1 ALA A 89 23.547 27.380 4.300 1.00 0.00 H new ATOM 0 HB2 ALA A 89 23.053 28.600 5.497 1.00 0.00 H new ATOM 0 HB3 ALA A 89 22.263 27.006 5.474 1.00 0.00 H new ATOM 837 N VAL A 90 20.417 26.268 3.525 1.00 0.00 N ATOM 838 CA VAL A 90 19.914 25.133 2.702 1.00 0.00 C ATOM 839 C VAL A 90 19.090 25.677 1.533 1.00 0.00 C ATOM 840 O VAL A 90 19.015 25.074 0.481 1.00 0.00 O ATOM 841 CB VAL A 90 19.037 24.224 3.567 1.00 0.00 C ATOM 842 CG1 VAL A 90 18.358 23.177 2.683 1.00 0.00 C ATOM 843 CG2 VAL A 90 19.906 23.521 4.612 1.00 0.00 C ATOM 0 H VAL A 90 20.128 26.256 4.503 1.00 0.00 H new ATOM 0 HA VAL A 90 20.758 24.562 2.316 1.00 0.00 H new ATOM 0 HB VAL A 90 18.278 24.824 4.069 1.00 0.00 H new ATOM 0 HG11 VAL A 90 17.734 22.530 3.299 1.00 0.00 H new ATOM 0 HG12 VAL A 90 17.739 23.676 1.938 1.00 0.00 H new ATOM 0 HG13 VAL A 90 19.117 22.577 2.181 1.00 0.00 H new ATOM 0 HG21 VAL A 90 19.282 22.874 5.228 1.00 0.00 H new ATOM 0 HG22 VAL A 90 20.666 22.922 4.110 1.00 0.00 H new ATOM 0 HG23 VAL A 90 20.390 24.266 5.243 1.00 0.00 H new ATOM 853 N ALA A 91 18.469 26.810 1.709 1.00 0.00 N ATOM 854 CA ALA A 91 17.649 27.391 0.609 1.00 0.00 C ATOM 855 C ALA A 91 18.560 28.097 -0.398 1.00 0.00 C ATOM 856 O ALA A 91 18.520 27.826 -1.581 1.00 0.00 O ATOM 857 CB ALA A 91 16.658 28.401 1.190 1.00 0.00 C ATOM 0 H ALA A 91 18.494 27.359 2.568 1.00 0.00 H new ATOM 0 HA ALA A 91 17.105 26.591 0.106 1.00 0.00 H new ATOM 0 HB1 ALA A 91 16.058 28.826 0.385 1.00 0.00 H new ATOM 0 HB2 ALA A 91 16.004 27.900 1.904 1.00 0.00 H new ATOM 0 HB3 ALA A 91 17.204 29.198 1.695 1.00 0.00 H new ATOM 863 N GLU A 92 19.376 29.006 0.062 1.00 0.00 N ATOM 864 CA GLU A 92 20.282 29.735 -0.871 1.00 0.00 C ATOM 865 C GLU A 92 21.383 28.795 -1.368 1.00 0.00 C ATOM 866 O GLU A 92 21.750 28.811 -2.526 1.00 0.00 O ATOM 867 CB GLU A 92 20.915 30.922 -0.143 1.00 0.00 C ATOM 868 CG GLU A 92 19.820 31.895 0.292 1.00 0.00 C ATOM 869 CD GLU A 92 20.459 33.180 0.824 1.00 0.00 C ATOM 870 OE1 GLU A 92 21.667 33.190 0.997 1.00 0.00 O ATOM 871 OE2 GLU A 92 19.730 34.132 1.048 1.00 0.00 O ATOM 0 H GLU A 92 19.455 29.275 1.043 1.00 0.00 H new ATOM 0 HA GLU A 92 19.705 30.094 -1.724 1.00 0.00 H new ATOM 0 HB2 GLU A 92 21.473 30.574 0.726 1.00 0.00 H new ATOM 0 HB3 GLU A 92 21.626 31.427 -0.797 1.00 0.00 H new ATOM 0 HG2 GLU A 92 19.166 32.123 -0.550 1.00 0.00 H new ATOM 0 HG3 GLU A 92 19.199 31.439 1.063 1.00 0.00 H new ATOM 878 N LEU A 93 21.916 27.976 -0.502 1.00 0.00 N ATOM 879 CA LEU A 93 22.995 27.041 -0.930 1.00 0.00 C ATOM 880 C LEU A 93 22.414 25.986 -1.874 1.00 0.00 C ATOM 881 O LEU A 93 23.012 25.637 -2.873 1.00 0.00 O ATOM 882 CB LEU A 93 23.593 26.354 0.299 1.00 0.00 C ATOM 883 CG LEU A 93 24.224 27.407 1.213 1.00 0.00 C ATOM 884 CD1 LEU A 93 25.064 26.711 2.287 1.00 0.00 C ATOM 885 CD2 LEU A 93 25.119 28.331 0.386 1.00 0.00 C ATOM 0 H LEU A 93 21.651 27.914 0.481 1.00 0.00 H new ATOM 0 HA LEU A 93 23.774 27.600 -1.448 1.00 0.00 H new ATOM 0 HB2 LEU A 93 22.818 25.807 0.837 1.00 0.00 H new ATOM 0 HB3 LEU A 93 24.344 25.625 -0.007 1.00 0.00 H new ATOM 0 HG LEU A 93 23.438 27.994 1.688 1.00 0.00 H new ATOM 0 HD11 LEU A 93 25.514 27.460 2.939 1.00 0.00 H new ATOM 0 HD12 LEU A 93 24.427 26.052 2.877 1.00 0.00 H new ATOM 0 HD13 LEU A 93 25.850 26.125 1.811 1.00 0.00 H new ATOM 0 HD21 LEU A 93 25.568 29.081 1.037 1.00 0.00 H new ATOM 0 HD22 LEU A 93 25.906 27.745 -0.090 1.00 0.00 H new ATOM 0 HD23 LEU A 93 24.522 28.826 -0.380 1.00 0.00 H new ATOM 897 N ASN A 94 21.255 25.473 -1.565 1.00 0.00 N ATOM 898 CA ASN A 94 20.640 24.441 -2.446 1.00 0.00 C ATOM 899 C ASN A 94 20.338 25.051 -3.816 1.00 0.00 C ATOM 900 O ASN A 94 19.758 26.113 -3.918 1.00 0.00 O ATOM 901 CB ASN A 94 19.340 23.940 -1.814 1.00 0.00 C ATOM 902 CG ASN A 94 18.723 22.858 -2.703 1.00 0.00 C ATOM 903 OD1 ASN A 94 19.221 22.579 -3.775 1.00 0.00 O ATOM 904 ND2 ASN A 94 17.650 22.233 -2.300 1.00 0.00 N ATOM 0 H ASN A 94 20.708 25.724 -0.741 1.00 0.00 H new ATOM 0 HA ASN A 94 21.332 23.607 -2.565 1.00 0.00 H new ATOM 0 HB2 ASN A 94 19.538 23.539 -0.820 1.00 0.00 H new ATOM 0 HB3 ASN A 94 18.641 24.767 -1.691 1.00 0.00 H new ATOM 0 HD21 ASN A 94 17.230 21.511 -2.885 1.00 0.00 H new ATOM 0 HD22 ASN A 94 17.231 22.467 -1.400 1.00 0.00 H new ATOM 911 N GLY A 95 20.729 24.389 -4.871 1.00 0.00 N ATOM 912 CA GLY A 95 20.464 24.933 -6.233 1.00 0.00 C ATOM 913 C GLY A 95 21.596 25.880 -6.634 1.00 0.00 C ATOM 914 O GLY A 95 21.380 26.872 -7.303 1.00 0.00 O ATOM 0 H GLY A 95 21.220 23.495 -4.848 1.00 0.00 H new ATOM 0 HA2 GLY A 95 20.385 24.118 -6.953 1.00 0.00 H new ATOM 0 HA3 GLY A 95 19.511 25.462 -6.246 1.00 0.00 H new ATOM 918 N THR A 96 22.802 25.584 -6.233 1.00 0.00 N ATOM 919 CA THR A 96 23.945 26.469 -6.594 1.00 0.00 C ATOM 920 C THR A 96 25.017 25.646 -7.312 1.00 0.00 C ATOM 921 O THR A 96 25.055 24.436 -7.213 1.00 0.00 O ATOM 922 CB THR A 96 24.538 27.081 -5.323 1.00 0.00 C ATOM 923 OG1 THR A 96 25.251 26.084 -4.606 1.00 0.00 O ATOM 924 CG2 THR A 96 23.412 27.635 -4.448 1.00 0.00 C ATOM 0 H THR A 96 23.045 24.768 -5.671 1.00 0.00 H new ATOM 0 HA THR A 96 23.596 27.265 -7.251 1.00 0.00 H new ATOM 0 HB THR A 96 25.217 27.890 -5.592 1.00 0.00 H new ATOM 0 HG1 THR A 96 24.668 25.692 -3.923 1.00 0.00 H new ATOM 0 HG21 THR A 96 23.835 28.071 -3.543 1.00 0.00 H new ATOM 0 HG22 THR A 96 22.867 28.401 -4.999 1.00 0.00 H new ATOM 0 HG23 THR A 96 22.731 26.828 -4.178 1.00 0.00 H new ATOM 932 N GLN A 97 25.889 26.294 -8.037 1.00 0.00 N ATOM 933 CA GLN A 97 26.956 25.547 -8.761 1.00 0.00 C ATOM 934 C GLN A 97 28.320 26.156 -8.429 1.00 0.00 C ATOM 935 O GLN A 97 28.425 27.314 -8.077 1.00 0.00 O ATOM 936 CB GLN A 97 26.710 25.641 -10.268 1.00 0.00 C ATOM 937 CG GLN A 97 27.764 24.817 -11.010 1.00 0.00 C ATOM 938 CD GLN A 97 27.552 24.955 -12.519 1.00 0.00 C ATOM 939 OE1 GLN A 97 26.585 25.546 -12.956 1.00 0.00 O ATOM 940 NE2 GLN A 97 28.421 24.430 -13.339 1.00 0.00 N ATOM 0 H GLN A 97 25.908 27.307 -8.159 1.00 0.00 H new ATOM 0 HA GLN A 97 26.940 24.501 -8.454 1.00 0.00 H new ATOM 0 HB2 GLN A 97 25.712 25.275 -10.508 1.00 0.00 H new ATOM 0 HB3 GLN A 97 26.754 26.681 -10.590 1.00 0.00 H new ATOM 0 HG2 GLN A 97 28.763 25.158 -10.740 1.00 0.00 H new ATOM 0 HG3 GLN A 97 27.694 23.769 -10.717 1.00 0.00 H new ATOM 0 HE21 GLN A 97 29.233 23.934 -12.972 1.00 0.00 H new ATOM 0 HE22 GLN A 97 28.288 24.516 -14.347 1.00 0.00 H new ATOM 949 N VAL A 98 29.367 25.384 -8.536 1.00 0.00 N ATOM 950 CA VAL A 98 30.723 25.919 -8.226 1.00 0.00 C ATOM 951 C VAL A 98 31.495 26.129 -9.530 1.00 0.00 C ATOM 952 O VAL A 98 30.916 26.312 -10.583 1.00 0.00 O ATOM 953 CB VAL A 98 31.478 24.925 -7.338 1.00 0.00 C ATOM 954 CG1 VAL A 98 32.455 25.685 -6.438 1.00 0.00 C ATOM 955 CG2 VAL A 98 30.483 24.153 -6.467 1.00 0.00 C ATOM 0 H VAL A 98 29.342 24.406 -8.825 1.00 0.00 H new ATOM 0 HA VAL A 98 30.627 26.870 -7.701 1.00 0.00 H new ATOM 0 HB VAL A 98 32.028 24.226 -7.968 1.00 0.00 H new ATOM 0 HG11 VAL A 98 32.992 24.978 -5.806 1.00 0.00 H new ATOM 0 HG12 VAL A 98 33.166 26.234 -7.055 1.00 0.00 H new ATOM 0 HG13 VAL A 98 31.903 26.385 -5.811 1.00 0.00 H new ATOM 0 HG21 VAL A 98 31.023 23.447 -5.836 1.00 0.00 H new ATOM 0 HG22 VAL A 98 29.931 24.852 -5.839 1.00 0.00 H new ATOM 0 HG23 VAL A 98 29.786 23.610 -7.105 1.00 0.00 H new ATOM 965 N GLU A 99 32.799 26.107 -9.472 1.00 0.00 N ATOM 966 CA GLU A 99 33.604 26.307 -10.710 1.00 0.00 C ATOM 967 C GLU A 99 33.203 25.262 -11.754 1.00 0.00 C ATOM 968 O GLU A 99 33.157 25.539 -12.936 1.00 0.00 O ATOM 969 CB GLU A 99 35.090 26.156 -10.380 1.00 0.00 C ATOM 970 CG GLU A 99 35.516 27.272 -9.424 1.00 0.00 C ATOM 971 CD GLU A 99 37.021 27.180 -9.170 1.00 0.00 C ATOM 972 OE1 GLU A 99 37.613 26.196 -9.583 1.00 0.00 O ATOM 973 OE2 GLU A 99 37.557 28.094 -8.565 1.00 0.00 O ATOM 0 H GLU A 99 33.341 25.959 -8.621 1.00 0.00 H new ATOM 0 HA GLU A 99 33.419 27.305 -11.107 1.00 0.00 H new ATOM 0 HB2 GLU A 99 35.276 25.183 -9.926 1.00 0.00 H new ATOM 0 HB3 GLU A 99 35.683 26.199 -11.294 1.00 0.00 H new ATOM 0 HG2 GLU A 99 35.267 28.244 -9.849 1.00 0.00 H new ATOM 0 HG3 GLU A 99 34.972 27.187 -8.483 1.00 0.00 H new ATOM 980 N SER A 100 32.916 24.063 -11.329 1.00 0.00 N ATOM 981 CA SER A 100 32.520 23.004 -12.300 1.00 0.00 C ATOM 982 C SER A 100 31.795 21.876 -11.562 1.00 0.00 C ATOM 983 O SER A 100 31.748 20.752 -12.021 1.00 0.00 O ATOM 984 CB SER A 100 33.771 22.445 -12.981 1.00 0.00 C ATOM 985 OG SER A 100 33.387 21.580 -14.039 1.00 0.00 O ATOM 0 H SER A 100 32.938 23.770 -10.352 1.00 0.00 H new ATOM 0 HA SER A 100 31.855 23.431 -13.051 1.00 0.00 H new ATOM 0 HB2 SER A 100 34.383 23.260 -13.367 1.00 0.00 H new ATOM 0 HB3 SER A 100 34.381 21.904 -12.258 1.00 0.00 H new ATOM 0 HG SER A 100 32.715 20.945 -13.715 1.00 0.00 H new ATOM 991 N VAL A 101 31.230 22.165 -10.422 1.00 0.00 N ATOM 992 CA VAL A 101 30.510 21.107 -9.659 1.00 0.00 C ATOM 993 C VAL A 101 29.215 21.683 -9.082 1.00 0.00 C ATOM 994 O VAL A 101 29.101 22.871 -8.853 1.00 0.00 O ATOM 995 CB VAL A 101 31.397 20.608 -8.517 1.00 0.00 C ATOM 996 CG1 VAL A 101 30.683 19.476 -7.775 1.00 0.00 C ATOM 997 CG2 VAL A 101 32.719 20.088 -9.086 1.00 0.00 C ATOM 0 H VAL A 101 31.236 23.087 -9.986 1.00 0.00 H new ATOM 0 HA VAL A 101 30.274 20.278 -10.326 1.00 0.00 H new ATOM 0 HB VAL A 101 31.596 21.428 -7.827 1.00 0.00 H new ATOM 0 HG11 VAL A 101 31.314 19.120 -6.961 1.00 0.00 H new ATOM 0 HG12 VAL A 101 29.741 19.844 -7.369 1.00 0.00 H new ATOM 0 HG13 VAL A 101 30.485 18.656 -8.466 1.00 0.00 H new ATOM 0 HG21 VAL A 101 33.351 19.733 -8.272 1.00 0.00 H new ATOM 0 HG22 VAL A 101 32.521 19.268 -9.776 1.00 0.00 H new ATOM 0 HG23 VAL A 101 33.229 20.893 -9.616 1.00 0.00 H new ATOM 1007 N GLN A 102 28.239 20.851 -8.845 1.00 0.00 N ATOM 1008 CA GLN A 102 26.953 21.349 -8.282 1.00 0.00 C ATOM 1009 C GLN A 102 26.925 21.086 -6.775 1.00 0.00 C ATOM 1010 O GLN A 102 27.488 20.124 -6.292 1.00 0.00 O ATOM 1011 CB GLN A 102 25.787 20.619 -8.950 1.00 0.00 C ATOM 1012 CG GLN A 102 25.790 20.920 -10.451 1.00 0.00 C ATOM 1013 CD GLN A 102 24.641 20.166 -11.125 1.00 0.00 C ATOM 1014 OE1 GLN A 102 24.072 19.261 -10.547 1.00 0.00 O ATOM 1015 NE2 GLN A 102 24.274 20.503 -12.331 1.00 0.00 N ATOM 0 H GLN A 102 28.277 19.846 -9.017 1.00 0.00 H new ATOM 0 HA GLN A 102 26.863 22.419 -8.467 1.00 0.00 H new ATOM 0 HB2 GLN A 102 25.873 19.545 -8.783 1.00 0.00 H new ATOM 0 HB3 GLN A 102 24.843 20.936 -8.506 1.00 0.00 H new ATOM 0 HG2 GLN A 102 25.683 21.992 -10.618 1.00 0.00 H new ATOM 0 HG3 GLN A 102 26.742 20.622 -10.891 1.00 0.00 H new ATOM 0 HE21 GLN A 102 24.752 21.263 -12.816 1.00 0.00 H new ATOM 0 HE22 GLN A 102 23.509 20.007 -12.789 1.00 0.00 H new ATOM 1024 N LEU A 103 26.273 21.933 -6.027 1.00 0.00 N ATOM 1025 CA LEU A 103 26.212 21.731 -4.552 1.00 0.00 C ATOM 1026 C LEU A 103 24.797 21.309 -4.149 1.00 0.00 C ATOM 1027 O LEU A 103 23.818 21.850 -4.624 1.00 0.00 O ATOM 1028 CB LEU A 103 26.575 23.037 -3.843 1.00 0.00 C ATOM 1029 CG LEU A 103 28.041 23.375 -4.118 1.00 0.00 C ATOM 1030 CD1 LEU A 103 28.389 24.710 -3.457 1.00 0.00 C ATOM 1031 CD2 LEU A 103 28.936 22.274 -3.543 1.00 0.00 C ATOM 0 H LEU A 103 25.780 22.756 -6.373 1.00 0.00 H new ATOM 0 HA LEU A 103 26.918 20.952 -4.265 1.00 0.00 H new ATOM 0 HB2 LEU A 103 25.932 23.845 -4.194 1.00 0.00 H new ATOM 0 HB3 LEU A 103 26.408 22.940 -2.770 1.00 0.00 H new ATOM 0 HG LEU A 103 28.201 23.449 -5.194 1.00 0.00 H new ATOM 0 HD11 LEU A 103 29.434 24.951 -3.653 1.00 0.00 H new ATOM 0 HD12 LEU A 103 27.753 25.495 -3.865 1.00 0.00 H new ATOM 0 HD13 LEU A 103 28.229 24.636 -2.381 1.00 0.00 H new ATOM 0 HD21 LEU A 103 29.981 22.515 -3.739 1.00 0.00 H new ATOM 0 HD22 LEU A 103 28.776 22.200 -2.467 1.00 0.00 H new ATOM 0 HD23 LEU A 103 28.689 21.322 -4.013 1.00 0.00 H new ATOM 1043 N LYS A 104 24.683 20.347 -3.275 1.00 0.00 N ATOM 1044 CA LYS A 104 23.334 19.890 -2.839 1.00 0.00 C ATOM 1045 C LYS A 104 23.223 20.018 -1.319 1.00 0.00 C ATOM 1046 O LYS A 104 24.151 19.719 -0.593 1.00 0.00 O ATOM 1047 CB LYS A 104 23.132 18.428 -3.244 1.00 0.00 C ATOM 1048 CG LYS A 104 23.187 18.306 -4.767 1.00 0.00 C ATOM 1049 CD LYS A 104 23.004 16.841 -5.169 1.00 0.00 C ATOM 1050 CE LYS A 104 21.548 16.428 -4.945 1.00 0.00 C ATOM 1051 NZ LYS A 104 21.474 15.457 -3.817 1.00 0.00 N ATOM 0 H LYS A 104 25.467 19.857 -2.844 1.00 0.00 H new ATOM 0 HA LYS A 104 22.570 20.505 -3.315 1.00 0.00 H new ATOM 0 HB2 LYS A 104 23.903 17.805 -2.791 1.00 0.00 H new ATOM 0 HB3 LYS A 104 22.172 18.067 -2.874 1.00 0.00 H new ATOM 0 HG2 LYS A 104 22.407 18.918 -5.220 1.00 0.00 H new ATOM 0 HG3 LYS A 104 24.141 18.679 -5.138 1.00 0.00 H new ATOM 0 HD2 LYS A 104 23.275 16.704 -6.216 1.00 0.00 H new ATOM 0 HD3 LYS A 104 23.668 16.206 -4.582 1.00 0.00 H new ATOM 0 HE2 LYS A 104 20.940 17.305 -4.724 1.00 0.00 H new ATOM 0 HE3 LYS A 104 21.143 15.980 -5.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 20.484 15.176 -3.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 22.041 14.616 -4.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 21.845 15.900 -2.952 1.00 0.00 H new ATOM 1065 N VAL A 105 22.098 20.461 -0.830 1.00 0.00 N ATOM 1066 CA VAL A 105 21.933 20.607 0.643 1.00 0.00 C ATOM 1067 C VAL A 105 20.742 19.767 1.111 1.00 0.00 C ATOM 1068 O VAL A 105 19.699 19.752 0.490 1.00 0.00 O ATOM 1069 CB VAL A 105 21.685 22.078 0.985 1.00 0.00 C ATOM 1070 CG1 VAL A 105 21.680 22.254 2.504 1.00 0.00 C ATOM 1071 CG2 VAL A 105 22.795 22.936 0.375 1.00 0.00 C ATOM 0 H VAL A 105 21.286 20.728 -1.387 1.00 0.00 H new ATOM 0 HA VAL A 105 22.838 20.264 1.145 1.00 0.00 H new ATOM 0 HB VAL A 105 20.722 22.389 0.581 1.00 0.00 H new ATOM 0 HG11 VAL A 105 21.503 23.301 2.748 1.00 0.00 H new ATOM 0 HG12 VAL A 105 20.890 21.642 2.939 1.00 0.00 H new ATOM 0 HG13 VAL A 105 22.643 21.944 2.909 1.00 0.00 H new ATOM 0 HG21 VAL A 105 22.620 23.984 0.618 1.00 0.00 H new ATOM 0 HG22 VAL A 105 23.758 22.626 0.780 1.00 0.00 H new ATOM 0 HG23 VAL A 105 22.799 22.810 -0.708 1.00 0.00 H new ATOM 1081 N ASN A 106 20.891 19.068 2.203 1.00 0.00 N ATOM 1082 CA ASN A 106 19.769 18.231 2.711 1.00 0.00 C ATOM 1083 C ASN A 106 19.739 18.295 4.239 1.00 0.00 C ATOM 1084 O ASN A 106 20.531 18.978 4.857 1.00 0.00 O ATOM 1085 CB ASN A 106 19.971 16.782 2.263 1.00 0.00 C ATOM 1086 CG ASN A 106 19.726 16.674 0.757 1.00 0.00 C ATOM 1087 OD1 ASN A 106 19.075 17.517 0.174 1.00 0.00 O ATOM 1088 ND2 ASN A 106 20.226 15.664 0.098 1.00 0.00 N ATOM 0 H ASN A 106 21.742 19.041 2.765 1.00 0.00 H new ATOM 0 HA ASN A 106 18.826 18.605 2.313 1.00 0.00 H new ATOM 0 HB2 ASN A 106 20.983 16.454 2.502 1.00 0.00 H new ATOM 0 HB3 ASN A 106 19.288 16.125 2.801 1.00 0.00 H new ATOM 0 HD21 ASN A 106 20.070 15.583 -0.907 1.00 0.00 H new ATOM 0 HD22 ASN A 106 20.773 14.956 0.588 1.00 0.00 H new ATOM 1095 N ILE A 107 18.830 17.588 4.855 1.00 0.00 N ATOM 1096 CA ILE A 107 18.750 17.612 6.343 1.00 0.00 C ATOM 1097 C ILE A 107 19.380 16.338 6.911 1.00 0.00 C ATOM 1098 O ILE A 107 19.173 15.253 6.406 1.00 0.00 O ATOM 1099 CB ILE A 107 17.285 17.693 6.775 1.00 0.00 C ATOM 1100 CG1 ILE A 107 16.628 18.913 6.129 1.00 0.00 C ATOM 1101 CG2 ILE A 107 17.208 17.818 8.297 1.00 0.00 C ATOM 1102 CD1 ILE A 107 15.187 19.040 6.627 1.00 0.00 C ATOM 0 H ILE A 107 18.140 16.996 4.392 1.00 0.00 H new ATOM 0 HA ILE A 107 19.288 18.482 6.720 1.00 0.00 H new ATOM 0 HB ILE A 107 16.763 16.790 6.458 1.00 0.00 H new ATOM 0 HG12 ILE A 107 17.190 19.814 6.374 1.00 0.00 H new ATOM 0 HG13 ILE A 107 16.642 18.815 5.044 1.00 0.00 H new ATOM 0 HG21 ILE A 107 16.164 17.876 8.605 1.00 0.00 H new ATOM 0 HG22 ILE A 107 17.675 16.947 8.758 1.00 0.00 H new ATOM 0 HG23 ILE A 107 17.730 18.720 8.615 1.00 0.00 H new ATOM 0 HD11 ILE A 107 14.718 19.910 6.167 1.00 0.00 H new ATOM 0 HD12 ILE A 107 14.629 18.143 6.359 1.00 0.00 H new ATOM 0 HD13 ILE A 107 15.186 19.158 7.711 1.00 0.00 H new ATOM 1114 N ALA A 108 20.149 16.462 7.959 1.00 0.00 N ATOM 1115 CA ALA A 108 20.791 15.259 8.560 1.00 0.00 C ATOM 1116 C ALA A 108 20.430 15.177 10.044 1.00 0.00 C ATOM 1117 O ALA A 108 20.362 16.176 10.732 1.00 0.00 O ATOM 1118 CB ALA A 108 22.310 15.364 8.410 1.00 0.00 C ATOM 0 H ALA A 108 20.360 17.345 8.425 1.00 0.00 H new ATOM 0 HA ALA A 108 20.436 14.364 8.049 1.00 0.00 H new ATOM 0 HB1 ALA A 108 22.781 14.484 8.849 1.00 0.00 H new ATOM 0 HB2 ALA A 108 22.568 15.424 7.353 1.00 0.00 H new ATOM 0 HB3 ALA A 108 22.665 16.259 8.921 1.00 0.00 H new ATOM 1124 N ARG A 109 20.200 13.994 10.544 1.00 0.00 N ATOM 1125 CA ARG A 109 19.846 13.849 11.985 1.00 0.00 C ATOM 1126 C ARG A 109 20.991 13.153 12.722 1.00 0.00 C ATOM 1127 O ARG A 109 20.774 12.315 13.574 1.00 0.00 O ATOM 1128 CB ARG A 109 18.572 13.011 12.117 1.00 0.00 C ATOM 1129 CG ARG A 109 17.500 13.555 11.171 1.00 0.00 C ATOM 1130 CD ARG A 109 16.264 12.655 11.232 1.00 0.00 C ATOM 1131 NE ARG A 109 15.295 13.068 10.178 1.00 0.00 N ATOM 1132 CZ ARG A 109 14.012 12.979 10.400 1.00 0.00 C ATOM 1133 NH1 ARG A 109 13.378 13.965 10.973 1.00 0.00 N ATOM 1134 NH2 ARG A 109 13.361 11.903 10.047 1.00 0.00 N ATOM 0 H ARG A 109 20.242 13.121 10.017 1.00 0.00 H new ATOM 0 HA ARG A 109 19.679 14.835 12.419 1.00 0.00 H new ATOM 0 HB2 ARG A 109 18.784 11.968 11.881 1.00 0.00 H new ATOM 0 HB3 ARG A 109 18.212 13.038 13.145 1.00 0.00 H new ATOM 0 HG2 ARG A 109 17.235 14.574 11.452 1.00 0.00 H new ATOM 0 HG3 ARG A 109 17.885 13.594 10.152 1.00 0.00 H new ATOM 0 HD2 ARG A 109 16.552 11.614 11.088 1.00 0.00 H new ATOM 0 HD3 ARG A 109 15.799 12.724 12.215 1.00 0.00 H new ATOM 0 HE ARG A 109 15.634 13.420 9.283 1.00 0.00 H new ATOM 0 HH11 ARG A 109 13.885 14.806 11.248 1.00 0.00 H new ATOM 0 HH12 ARG A 109 12.375 13.895 11.146 1.00 0.00 H new ATOM 0 HH21 ARG A 109 13.855 11.132 9.598 1.00 0.00 H new ATOM 0 HH22 ARG A 109 12.358 11.834 10.221 1.00 0.00 H new ATOM 1148 N LYS A 110 22.209 13.489 12.400 1.00 0.00 N ATOM 1149 CA LYS A 110 23.365 12.843 13.082 1.00 0.00 C ATOM 1150 C LYS A 110 23.611 13.526 14.429 1.00 0.00 C ATOM 1151 O LYS A 110 24.356 13.040 15.256 1.00 0.00 O ATOM 1152 CB LYS A 110 24.612 12.968 12.205 1.00 0.00 C ATOM 1153 CG LYS A 110 24.430 12.116 10.945 1.00 0.00 C ATOM 1154 CD LYS A 110 25.719 12.138 10.121 1.00 0.00 C ATOM 1155 CE LYS A 110 25.490 11.396 8.802 1.00 0.00 C ATOM 1156 NZ LYS A 110 25.422 9.930 9.061 1.00 0.00 N ATOM 0 H LYS A 110 22.454 14.183 11.694 1.00 0.00 H new ATOM 0 HA LYS A 110 23.146 11.788 13.248 1.00 0.00 H new ATOM 0 HB2 LYS A 110 24.777 14.011 11.933 1.00 0.00 H new ATOM 0 HB3 LYS A 110 25.493 12.640 12.756 1.00 0.00 H new ATOM 0 HG2 LYS A 110 24.179 11.091 11.220 1.00 0.00 H new ATOM 0 HG3 LYS A 110 23.600 12.499 10.351 1.00 0.00 H new ATOM 0 HD2 LYS A 110 26.021 13.167 9.925 1.00 0.00 H new ATOM 0 HD3 LYS A 110 26.529 11.669 10.679 1.00 0.00 H new ATOM 0 HE2 LYS A 110 24.565 11.737 8.337 1.00 0.00 H new ATOM 0 HE3 LYS A 110 26.298 11.616 8.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 25.420 9.417 8.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 26.247 9.638 9.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 24.551 9.710 9.585 1.00 0.00 H new ATOM 1170 N GLN A 111 22.987 14.651 14.658 1.00 0.00 N ATOM 1171 CA GLN A 111 23.185 15.357 15.956 1.00 0.00 C ATOM 1172 C GLN A 111 21.866 15.352 16.745 1.00 0.00 C ATOM 1173 O GLN A 111 21.338 16.377 17.122 1.00 0.00 O ATOM 1174 CB GLN A 111 23.682 16.794 15.693 1.00 0.00 C ATOM 1175 CG GLN A 111 22.522 17.758 15.391 1.00 0.00 C ATOM 1176 CD GLN A 111 21.440 17.049 14.573 1.00 0.00 C ATOM 1177 OE1 GLN A 111 21.717 16.495 13.527 1.00 0.00 O ATOM 1178 NE2 GLN A 111 20.209 17.046 15.007 1.00 0.00 N ATOM 0 H GLN A 111 22.352 15.109 14.005 1.00 0.00 H new ATOM 0 HA GLN A 111 23.940 14.844 16.552 1.00 0.00 H new ATOM 0 HB2 GLN A 111 24.234 17.152 16.562 1.00 0.00 H new ATOM 0 HB3 GLN A 111 24.378 16.789 14.854 1.00 0.00 H new ATOM 0 HG2 GLN A 111 22.097 18.130 16.323 1.00 0.00 H new ATOM 0 HG3 GLN A 111 22.893 18.624 14.842 1.00 0.00 H new ATOM 0 HE21 GLN A 111 19.977 17.511 15.885 1.00 0.00 H new ATOM 0 HE22 GLN A 111 19.480 16.579 14.468 1.00 0.00 H new ATOM 1187 N PRO A 112 21.329 14.151 17.002 1.00 0.00 N ATOM 1188 CA PRO A 112 20.071 13.984 17.742 1.00 0.00 C ATOM 1189 C PRO A 112 20.203 14.418 19.205 1.00 0.00 C ATOM 1190 O PRO A 112 19.248 14.399 19.954 1.00 0.00 O ATOM 1191 CB PRO A 112 19.805 12.479 17.657 1.00 0.00 C ATOM 1192 CG PRO A 112 21.151 11.876 17.443 1.00 0.00 C ATOM 1193 CD PRO A 112 21.907 12.859 16.597 1.00 0.00 C ATOM 0 HA PRO A 112 19.269 14.596 17.329 1.00 0.00 H new ATOM 0 HB2 PRO A 112 19.343 12.105 18.571 1.00 0.00 H new ATOM 0 HB3 PRO A 112 19.128 12.241 16.837 1.00 0.00 H new ATOM 0 HG2 PRO A 112 21.659 11.705 18.392 1.00 0.00 H new ATOM 0 HG3 PRO A 112 21.072 10.910 16.945 1.00 0.00 H new ATOM 0 HD2 PRO A 112 22.979 12.818 16.789 1.00 0.00 H new ATOM 0 HD3 PRO A 112 21.766 12.669 15.533 1.00 0.00 H new ATOM 1201 N MET A 113 21.376 14.815 19.616 1.00 0.00 N ATOM 1202 CA MET A 113 21.556 15.256 21.026 1.00 0.00 C ATOM 1203 C MET A 113 20.580 16.397 21.322 1.00 0.00 C ATOM 1204 O MET A 113 20.233 16.655 22.457 1.00 0.00 O ATOM 1205 CB MET A 113 23.001 15.735 21.232 1.00 0.00 C ATOM 1206 CG MET A 113 23.175 17.148 20.664 1.00 0.00 C ATOM 1207 SD MET A 113 24.586 17.183 19.533 1.00 0.00 S ATOM 1208 CE MET A 113 23.963 18.491 18.448 1.00 0.00 C ATOM 0 H MET A 113 22.215 14.853 19.037 1.00 0.00 H new ATOM 0 HA MET A 113 21.357 14.425 21.703 1.00 0.00 H new ATOM 0 HB2 MET A 113 23.246 15.729 22.294 1.00 0.00 H new ATOM 0 HB3 MET A 113 23.693 15.050 20.741 1.00 0.00 H new ATOM 0 HG2 MET A 113 22.269 17.453 20.140 1.00 0.00 H new ATOM 0 HG3 MET A 113 23.329 17.860 21.475 1.00 0.00 H new ATOM 0 HE1 MET A 113 24.606 18.574 17.572 1.00 0.00 H new ATOM 0 HE2 MET A 113 22.948 18.249 18.132 1.00 0.00 H new ATOM 0 HE3 MET A 113 23.959 19.439 18.986 1.00 0.00 H new ATOM 1218 N LEU A 114 20.141 17.088 20.304 1.00 0.00 N ATOM 1219 CA LEU A 114 19.194 18.216 20.520 1.00 0.00 C ATOM 1220 C LEU A 114 18.346 18.429 19.269 1.00 0.00 C ATOM 1221 O LEU A 114 17.743 19.468 19.092 1.00 0.00 O ATOM 1222 CB LEU A 114 19.987 19.492 20.805 1.00 0.00 C ATOM 1223 CG LEU A 114 19.279 20.302 21.891 1.00 0.00 C ATOM 1224 CD1 LEU A 114 20.320 21.009 22.762 1.00 0.00 C ATOM 1225 CD2 LEU A 114 18.368 21.344 21.235 1.00 0.00 C ATOM 0 H LEU A 114 20.399 16.918 19.332 1.00 0.00 H new ATOM 0 HA LEU A 114 18.545 17.982 21.364 1.00 0.00 H new ATOM 0 HB2 LEU A 114 20.998 19.240 21.125 1.00 0.00 H new ATOM 0 HB3 LEU A 114 20.079 20.086 19.896 1.00 0.00 H new ATOM 0 HG LEU A 114 18.681 19.635 22.512 1.00 0.00 H new ATOM 0 HD11 LEU A 114 19.815 21.586 23.536 1.00 0.00 H new ATOM 0 HD12 LEU A 114 20.969 20.267 23.228 1.00 0.00 H new ATOM 0 HD13 LEU A 114 20.919 21.677 22.143 1.00 0.00 H new ATOM 0 HD21 LEU A 114 17.862 21.923 22.008 1.00 0.00 H new ATOM 0 HD22 LEU A 114 18.966 22.011 20.615 1.00 0.00 H new ATOM 0 HD23 LEU A 114 17.626 20.840 20.615 1.00 0.00 H new ATOM 1237 N ASP A 115 18.297 17.455 18.405 1.00 0.00 N ATOM 1238 CA ASP A 115 17.491 17.599 17.158 1.00 0.00 C ATOM 1239 C ASP A 115 17.673 19.014 16.603 1.00 0.00 C ATOM 1240 O ASP A 115 16.726 19.657 16.196 1.00 0.00 O ATOM 1241 CB ASP A 115 16.014 17.360 17.473 1.00 0.00 C ATOM 1242 CG ASP A 115 15.825 15.930 17.982 1.00 0.00 C ATOM 1243 OD1 ASP A 115 16.725 15.130 17.788 1.00 0.00 O ATOM 1244 OD2 ASP A 115 14.783 15.658 18.555 1.00 0.00 O ATOM 0 H ASP A 115 18.781 16.563 18.507 1.00 0.00 H new ATOM 0 HA ASP A 115 17.824 16.869 16.420 1.00 0.00 H new ATOM 0 HB2 ASP A 115 15.671 18.073 18.223 1.00 0.00 H new ATOM 0 HB3 ASP A 115 15.410 17.522 16.580 1.00 0.00 H new ATOM 1249 N ALA A 116 18.885 19.505 16.602 1.00 0.00 N ATOM 1250 CA ALA A 116 19.141 20.883 16.092 1.00 0.00 C ATOM 1251 C ALA A 116 18.765 21.898 17.169 1.00 0.00 C ATOM 1252 O ALA A 116 19.615 22.484 17.808 1.00 0.00 O ATOM 1253 CB ALA A 116 18.296 21.140 14.846 1.00 0.00 C ATOM 0 H ALA A 116 19.711 19.008 16.934 1.00 0.00 H new ATOM 0 HA ALA A 116 20.197 20.982 15.840 1.00 0.00 H new ATOM 0 HB1 ALA A 116 18.487 22.148 14.478 1.00 0.00 H new ATOM 0 HB2 ALA A 116 18.557 20.416 14.074 1.00 0.00 H new ATOM 0 HB3 ALA A 116 17.240 21.039 15.096 1.00 0.00 H new ATOM 1259 N ALA A 117 17.495 22.113 17.371 1.00 0.00 N ATOM 1260 CA ALA A 117 17.069 23.091 18.405 1.00 0.00 C ATOM 1261 C ALA A 117 15.567 22.959 18.652 1.00 0.00 C ATOM 1262 O ALA A 117 14.817 23.898 18.480 1.00 0.00 O ATOM 1263 CB ALA A 117 17.377 24.506 17.921 1.00 0.00 C ATOM 0 H ALA A 117 16.737 21.654 16.865 1.00 0.00 H new ATOM 0 HA ALA A 117 17.607 22.893 19.332 1.00 0.00 H new ATOM 0 HB1 ALA A 117 17.065 25.225 18.678 1.00 0.00 H new ATOM 0 HB2 ALA A 117 18.448 24.605 17.745 1.00 0.00 H new ATOM 0 HB3 ALA A 117 16.838 24.699 16.994 1.00 0.00 H new ATOM 1269 N THR A 118 15.119 21.803 19.053 1.00 0.00 N ATOM 1270 CA THR A 118 13.665 21.625 19.306 1.00 0.00 C ATOM 1271 C THR A 118 13.441 21.270 20.777 1.00 0.00 C ATOM 1272 O THR A 118 14.266 20.638 21.406 1.00 0.00 O ATOM 1273 CB THR A 118 13.125 20.500 18.420 1.00 0.00 C ATOM 1274 OG1 THR A 118 13.440 20.775 17.063 1.00 0.00 O ATOM 1275 CG2 THR A 118 11.607 20.403 18.584 1.00 0.00 C ATOM 0 H THR A 118 15.695 20.977 19.216 1.00 0.00 H new ATOM 0 HA THR A 118 13.141 22.552 19.074 1.00 0.00 H new ATOM 0 HB THR A 118 13.581 19.555 18.714 1.00 0.00 H new ATOM 0 HG1 THR A 118 13.096 20.054 16.495 1.00 0.00 H new ATOM 0 HG21 THR A 118 11.223 19.602 17.953 1.00 0.00 H new ATOM 0 HG22 THR A 118 11.366 20.191 19.626 1.00 0.00 H new ATOM 0 HG23 THR A 118 11.148 21.347 18.291 1.00 0.00 H new ATOM 1283 N GLY A 119 12.330 21.672 21.331 1.00 0.00 N ATOM 1284 CA GLY A 119 12.052 21.357 22.760 1.00 0.00 C ATOM 1285 C GLY A 119 10.548 21.164 22.958 1.00 0.00 C ATOM 1286 O GLY A 119 9.771 21.281 22.031 1.00 0.00 O ATOM 0 H GLY A 119 11.602 22.205 20.855 1.00 0.00 H new ATOM 0 HA2 GLY A 119 12.587 20.454 23.055 1.00 0.00 H new ATOM 0 HA3 GLY A 119 12.413 22.164 23.398 1.00 0.00 H new ATOM 1290 N LYS A 120 10.130 20.868 24.158 1.00 0.00 N ATOM 1291 CA LYS A 120 8.675 20.669 24.411 1.00 0.00 C ATOM 1292 C LYS A 120 8.000 22.028 24.606 1.00 0.00 C ATOM 1293 O LYS A 120 8.577 22.945 25.158 1.00 0.00 O ATOM 1294 CB LYS A 120 8.487 19.821 25.672 1.00 0.00 C ATOM 1295 CG LYS A 120 9.235 18.497 25.511 1.00 0.00 C ATOM 1296 CD LYS A 120 8.613 17.695 24.367 1.00 0.00 C ATOM 1297 CE LYS A 120 9.246 16.303 24.316 1.00 0.00 C ATOM 1298 NZ LYS A 120 8.702 15.471 25.426 1.00 0.00 N ATOM 0 H LYS A 120 10.732 20.755 24.973 1.00 0.00 H new ATOM 0 HA LYS A 120 8.225 20.159 23.559 1.00 0.00 H new ATOM 0 HB2 LYS A 120 8.860 20.358 26.544 1.00 0.00 H new ATOM 0 HB3 LYS A 120 7.427 19.634 25.843 1.00 0.00 H new ATOM 0 HG2 LYS A 120 10.289 18.685 25.306 1.00 0.00 H new ATOM 0 HG3 LYS A 120 9.187 17.925 26.438 1.00 0.00 H new ATOM 0 HD2 LYS A 120 7.536 17.611 24.511 1.00 0.00 H new ATOM 0 HD3 LYS A 120 8.769 18.212 23.420 1.00 0.00 H new ATOM 0 HE2 LYS A 120 9.036 15.831 23.356 1.00 0.00 H new ATOM 0 HE3 LYS A 120 10.330 16.381 24.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 8.910 14.469 25.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 9.143 15.758 26.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 7.673 15.605 25.488 1.00 0.00 H new ATOM 1312 N SER A 121 6.783 22.165 24.157 1.00 0.00 N ATOM 1313 CA SER A 121 6.073 23.465 24.317 1.00 0.00 C ATOM 1314 C SER A 121 5.255 23.443 25.610 1.00 0.00 C ATOM 1315 O SER A 121 4.454 22.537 25.765 1.00 0.00 O ATOM 1316 CB SER A 121 5.139 23.685 23.125 1.00 0.00 C ATOM 1317 OG SER A 121 5.839 23.416 21.919 1.00 0.00 O ATOM 1318 OXT SER A 121 5.445 24.333 26.423 1.00 0.00 O ATOM 0 H SER A 121 6.250 21.434 23.687 1.00 0.00 H new ATOM 0 HA SER A 121 6.801 24.275 24.362 1.00 0.00 H new ATOM 0 HB2 SER A 121 4.269 23.033 23.206 1.00 0.00 H new ATOM 0 HB3 SER A 121 4.770 24.711 23.123 1.00 0.00 H new ATOM 0 HG SER A 121 5.241 23.555 21.155 1.00 0.00 H new TER 1324 SER A 121