USER MOD reduce.3.24.130724 H: found=0, std=0, add=659, rem=0, adj=20 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 79 THR OG1 : rot 81:sc= 1.09 USER MOD Set 1.3: A 111 GLN : amide:sc= -12! C(o=-19!,f=-23!) USER MOD Set 1.4: A 113 MET CE :methyl -163:sc= -8.24! (180deg=-8.7!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= -1.32 K(o=-1.3,f=-2.2!) USER MOD Single : A 43 TYR OH : rot 180:sc= -0.161 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 167:sc= -0.93 (180deg=-1.33) USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.281 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 52:sc= 0.103 USER MOD Single : A 63 ASN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 MET CE :methyl -131:sc= -2.66 (180deg=-6.81!) USER MOD Single : A 74 ASN : amide:sc=-0.00153 K(o=-0.0015,f=-1.7!) USER MOD Single : A 75 CYS SG : rot 100:sc= -1.44 USER MOD Single : A 80 TYR OH : rot -14:sc= -7.45! USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 MET CE :methyl -146:sc= -11.3! (180deg=-15.2!) 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= -0.14 K(o=-0.14,f=-3.4!) USER MOD Single : A 96 THR OG1 : rot -71:sc= 1.23 USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 100 SER OG : rot 43:sc= 0.0313 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= -1.34 K(o=-1.3,f=-2.4!) USER MOD Single : A 110 LYS NZ :NH3+ -166:sc=-0.00864 (180deg=-0.215) 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 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 35 25.805 21.106 30.165 1.00 0.00 N ATOM 2 CA ALA A 35 25.304 22.321 29.464 1.00 0.00 C ATOM 3 C ALA A 35 24.859 21.947 28.049 1.00 0.00 C ATOM 4 O ALA A 35 25.666 21.804 27.153 1.00 0.00 O ATOM 5 CB ALA A 35 26.420 23.364 29.389 1.00 0.00 C ATOM 0 HA ALA A 35 24.458 22.734 30.013 1.00 0.00 H new ATOM 0 HB1 ALA A 35 26.053 24.253 28.876 1.00 0.00 H new ATOM 0 HB2 ALA A 35 26.736 23.631 30.397 1.00 0.00 H new ATOM 0 HB3 ALA A 35 27.267 22.952 28.840 1.00 0.00 H new ATOM 11 N PRO A 36 23.543 21.786 27.851 1.00 0.00 N ATOM 12 CA PRO A 36 22.975 21.427 26.544 1.00 0.00 C ATOM 13 C PRO A 36 23.101 22.572 25.534 1.00 0.00 C ATOM 14 O PRO A 36 22.897 23.725 25.859 1.00 0.00 O ATOM 15 CB PRO A 36 21.502 21.164 26.856 1.00 0.00 C ATOM 16 CG PRO A 36 21.231 21.962 28.087 1.00 0.00 C ATOM 17 CD PRO A 36 22.504 21.942 28.884 1.00 0.00 C ATOM 0 HA PRO A 36 23.488 20.577 26.094 1.00 0.00 H new ATOM 0 HB2 PRO A 36 20.860 21.476 26.032 1.00 0.00 H new ATOM 0 HB3 PRO A 36 21.315 20.103 27.022 1.00 0.00 H new ATOM 0 HG2 PRO A 36 20.945 22.983 27.835 1.00 0.00 H new ATOM 0 HG3 PRO A 36 20.407 21.532 28.657 1.00 0.00 H new ATOM 0 HD2 PRO A 36 22.637 22.862 29.454 1.00 0.00 H new ATOM 0 HD3 PRO A 36 22.519 21.119 29.599 1.00 0.00 H new ATOM 25 N ARG A 37 23.434 22.261 24.311 1.00 0.00 N ATOM 26 CA ARG A 37 23.573 23.331 23.282 1.00 0.00 C ATOM 27 C ARG A 37 22.698 22.992 22.073 1.00 0.00 C ATOM 28 O ARG A 37 22.391 21.844 21.820 1.00 0.00 O ATOM 29 CB ARG A 37 25.034 23.431 22.842 1.00 0.00 C ATOM 30 CG ARG A 37 25.896 23.855 24.034 1.00 0.00 C ATOM 31 CD ARG A 37 27.345 24.029 23.581 1.00 0.00 C ATOM 32 NE ARG A 37 28.219 24.217 24.773 1.00 0.00 N ATOM 33 CZ ARG A 37 29.198 25.077 24.735 1.00 0.00 C ATOM 34 NH1 ARG A 37 30.318 24.766 24.141 1.00 0.00 N ATOM 35 NH2 ARG A 37 29.059 26.251 25.289 1.00 0.00 N ATOM 0 H ARG A 37 23.616 21.313 23.980 1.00 0.00 H new ATOM 0 HA ARG A 37 23.256 24.284 23.705 1.00 0.00 H new ATOM 0 HB2 ARG A 37 25.375 22.471 22.455 1.00 0.00 H new ATOM 0 HB3 ARG A 37 25.133 24.154 22.032 1.00 0.00 H new ATOM 0 HG2 ARG A 37 25.521 24.788 24.454 1.00 0.00 H new ATOM 0 HG3 ARG A 37 25.838 23.105 24.823 1.00 0.00 H new ATOM 0 HD2 ARG A 37 27.667 23.155 23.014 1.00 0.00 H new ATOM 0 HD3 ARG A 37 27.429 24.889 22.916 1.00 0.00 H new ATOM 0 HE ARG A 37 28.051 23.673 25.619 1.00 0.00 H new ATOM 0 HH11 ARG A 37 30.427 23.850 23.706 1.00 0.00 H new ATOM 0 HH12 ARG A 37 31.084 25.439 24.112 1.00 0.00 H new ATOM 0 HH21 ARG A 37 28.184 26.496 25.752 1.00 0.00 H new ATOM 0 HH22 ARG A 37 29.826 26.923 25.259 1.00 0.00 H new ATOM 49 N LYS A 38 22.295 23.982 21.326 1.00 0.00 N ATOM 50 CA LYS A 38 21.440 23.716 20.135 1.00 0.00 C ATOM 51 C LYS A 38 22.327 23.410 18.927 1.00 0.00 C ATOM 52 O LYS A 38 23.495 23.102 19.064 1.00 0.00 O ATOM 53 CB LYS A 38 20.583 24.948 19.840 1.00 0.00 C ATOM 54 CG LYS A 38 19.705 25.260 21.054 1.00 0.00 C ATOM 55 CD LYS A 38 18.711 26.367 20.695 1.00 0.00 C ATOM 56 CE LYS A 38 17.870 26.716 21.924 1.00 0.00 C ATOM 57 NZ LYS A 38 18.371 27.985 22.524 1.00 0.00 N ATOM 0 H LYS A 38 22.520 24.963 21.488 1.00 0.00 H new ATOM 0 HA LYS A 38 20.793 22.862 20.335 1.00 0.00 H new ATOM 0 HB2 LYS A 38 21.221 25.801 19.610 1.00 0.00 H new ATOM 0 HB3 LYS A 38 19.960 24.770 18.963 1.00 0.00 H new ATOM 0 HG2 LYS A 38 19.170 24.364 21.369 1.00 0.00 H new ATOM 0 HG3 LYS A 38 20.325 25.572 21.894 1.00 0.00 H new ATOM 0 HD2 LYS A 38 19.245 27.250 20.344 1.00 0.00 H new ATOM 0 HD3 LYS A 38 18.065 26.040 19.880 1.00 0.00 H new ATOM 0 HE2 LYS A 38 16.822 26.823 21.643 1.00 0.00 H new ATOM 0 HE3 LYS A 38 17.923 25.909 22.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 17.800 28.223 23.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 19.365 27.867 22.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 18.298 28.752 21.825 1.00 0.00 H new ATOM 71 N GLY A 39 21.783 23.488 17.744 1.00 0.00 N ATOM 72 CA GLY A 39 22.595 23.199 16.528 1.00 0.00 C ATOM 73 C GLY A 39 21.730 22.454 15.507 1.00 0.00 C ATOM 74 O GLY A 39 20.641 22.014 15.811 1.00 0.00 O ATOM 0 H GLY A 39 20.811 23.740 17.566 1.00 0.00 H new ATOM 0 HA2 GLY A 39 22.968 24.128 16.097 1.00 0.00 H new ATOM 0 HA3 GLY A 39 23.465 22.598 16.792 1.00 0.00 H new ATOM 78 N ASN A 40 22.202 22.311 14.299 1.00 0.00 N ATOM 79 CA ASN A 40 21.398 21.593 13.269 1.00 0.00 C ATOM 80 C ASN A 40 22.331 21.022 12.200 1.00 0.00 C ATOM 81 O ASN A 40 22.775 21.724 11.312 1.00 0.00 O ATOM 82 CB ASN A 40 20.414 22.568 12.623 1.00 0.00 C ATOM 83 CG ASN A 40 19.357 21.784 11.842 1.00 0.00 C ATOM 84 OD1 ASN A 40 19.224 20.588 12.007 1.00 0.00 O ATOM 85 ND2 ASN A 40 18.593 22.414 10.990 1.00 0.00 N ATOM 0 H ASN A 40 23.107 22.659 13.981 1.00 0.00 H new ATOM 0 HA ASN A 40 20.846 20.779 13.739 1.00 0.00 H new ATOM 0 HB2 ASN A 40 19.936 23.180 13.388 1.00 0.00 H new ATOM 0 HB3 ASN A 40 20.944 23.248 11.956 1.00 0.00 H new ATOM 0 HD21 ASN A 40 17.885 21.902 10.464 1.00 0.00 H new ATOM 0 HD22 ASN A 40 18.704 23.418 10.851 1.00 0.00 H new ATOM 92 N THR A 41 22.636 19.756 12.278 1.00 0.00 N ATOM 93 CA THR A 41 23.545 19.143 11.268 1.00 0.00 C ATOM 94 C THR A 41 22.926 19.260 9.875 1.00 0.00 C ATOM 95 O THR A 41 21.736 19.091 9.696 1.00 0.00 O ATOM 96 CB THR A 41 23.760 17.666 11.607 1.00 0.00 C ATOM 97 OG1 THR A 41 24.228 17.551 12.943 1.00 0.00 O ATOM 98 CG2 THR A 41 24.792 17.068 10.648 1.00 0.00 C ATOM 0 H THR A 41 22.295 19.119 12.998 1.00 0.00 H new ATOM 0 HA THR A 41 24.502 19.665 11.281 1.00 0.00 H new ATOM 0 HB THR A 41 22.818 17.128 11.506 1.00 0.00 H new ATOM 0 HG1 THR A 41 24.364 16.605 13.162 1.00 0.00 H new ATOM 0 HG21 THR A 41 24.946 16.016 10.889 1.00 0.00 H new ATOM 0 HG22 THR A 41 24.431 17.157 9.623 1.00 0.00 H new ATOM 0 HG23 THR A 41 25.735 17.605 10.748 1.00 0.00 H new ATOM 106 N LEU A 42 23.727 19.542 8.883 1.00 0.00 N ATOM 107 CA LEU A 42 23.188 19.664 7.499 1.00 0.00 C ATOM 108 C LEU A 42 23.957 18.727 6.568 1.00 0.00 C ATOM 109 O LEU A 42 25.150 18.538 6.706 1.00 0.00 O ATOM 110 CB LEU A 42 23.348 21.105 7.009 1.00 0.00 C ATOM 111 CG LEU A 42 22.764 22.070 8.042 1.00 0.00 C ATOM 112 CD1 LEU A 42 22.662 23.467 7.429 1.00 0.00 C ATOM 113 CD2 LEU A 42 21.373 21.595 8.462 1.00 0.00 C ATOM 0 H LEU A 42 24.732 19.693 8.972 1.00 0.00 H new ATOM 0 HA LEU A 42 22.132 19.395 7.500 1.00 0.00 H new ATOM 0 HB2 LEU A 42 24.402 21.328 6.844 1.00 0.00 H new ATOM 0 HB3 LEU A 42 22.842 21.232 6.052 1.00 0.00 H new ATOM 0 HG LEU A 42 23.413 22.101 8.917 1.00 0.00 H new ATOM 0 HD11 LEU A 42 22.246 24.157 8.163 1.00 0.00 H new ATOM 0 HD12 LEU A 42 23.654 23.807 7.132 1.00 0.00 H new ATOM 0 HD13 LEU A 42 22.013 23.434 6.554 1.00 0.00 H new ATOM 0 HD21 LEU A 42 20.960 22.285 9.198 1.00 0.00 H new ATOM 0 HD22 LEU A 42 20.721 21.562 7.589 1.00 0.00 H new ATOM 0 HD23 LEU A 42 21.445 20.599 8.899 1.00 0.00 H new ATOM 125 N TYR A 43 23.283 18.138 5.618 1.00 0.00 N ATOM 126 CA TYR A 43 23.970 17.212 4.675 1.00 0.00 C ATOM 127 C TYR A 43 24.346 17.968 3.399 1.00 0.00 C ATOM 128 O TYR A 43 23.500 18.501 2.709 1.00 0.00 O ATOM 129 CB TYR A 43 23.029 16.057 4.322 1.00 0.00 C ATOM 130 CG TYR A 43 23.736 15.091 3.402 1.00 0.00 C ATOM 131 CD1 TYR A 43 24.509 14.053 3.936 1.00 0.00 C ATOM 132 CD2 TYR A 43 23.619 15.233 2.015 1.00 0.00 C ATOM 133 CE1 TYR A 43 25.163 13.156 3.083 1.00 0.00 C ATOM 134 CE2 TYR A 43 24.273 14.336 1.160 1.00 0.00 C ATOM 135 CZ TYR A 43 25.046 13.297 1.696 1.00 0.00 C ATOM 136 OH TYR A 43 25.690 12.414 0.854 1.00 0.00 O ATOM 0 H TYR A 43 22.283 18.259 5.454 1.00 0.00 H new ATOM 0 HA TYR A 43 24.872 16.819 5.144 1.00 0.00 H new ATOM 0 HB2 TYR A 43 22.710 15.544 5.229 1.00 0.00 H new ATOM 0 HB3 TYR A 43 22.130 16.441 3.841 1.00 0.00 H new ATOM 0 HD1 TYR A 43 24.601 13.944 5.007 1.00 0.00 H new ATOM 0 HD2 TYR A 43 23.024 16.035 1.603 1.00 0.00 H new ATOM 0 HE1 TYR A 43 25.758 12.355 3.496 1.00 0.00 H new ATOM 0 HE2 TYR A 43 24.182 14.445 0.089 1.00 0.00 H new ATOM 0 HH TYR A 43 25.503 12.654 -0.077 1.00 0.00 H new ATOM 146 N VAL A 44 25.610 18.019 3.078 1.00 0.00 N ATOM 147 CA VAL A 44 26.039 18.740 1.846 1.00 0.00 C ATOM 148 C VAL A 44 26.714 17.755 0.889 1.00 0.00 C ATOM 149 O VAL A 44 27.477 16.902 1.298 1.00 0.00 O ATOM 150 CB VAL A 44 27.027 19.845 2.221 1.00 0.00 C ATOM 151 CG1 VAL A 44 27.452 20.598 0.958 1.00 0.00 C ATOM 152 CG2 VAL A 44 26.357 20.818 3.193 1.00 0.00 C ATOM 0 H VAL A 44 26.364 17.592 3.616 1.00 0.00 H new ATOM 0 HA VAL A 44 25.169 19.181 1.360 1.00 0.00 H new ATOM 0 HB VAL A 44 27.904 19.404 2.694 1.00 0.00 H new ATOM 0 HG11 VAL A 44 28.156 21.386 1.224 1.00 0.00 H new ATOM 0 HG12 VAL A 44 27.928 19.905 0.264 1.00 0.00 H new ATOM 0 HG13 VAL A 44 26.575 21.040 0.485 1.00 0.00 H new ATOM 0 HG21 VAL A 44 27.060 21.606 3.461 1.00 0.00 H new ATOM 0 HG22 VAL A 44 25.480 21.260 2.719 1.00 0.00 H new ATOM 0 HG23 VAL A 44 26.052 20.282 4.092 1.00 0.00 H new ATOM 162 N TYR A 45 26.440 17.865 -0.381 1.00 0.00 N ATOM 163 CA TYR A 45 27.066 16.933 -1.362 1.00 0.00 C ATOM 164 C TYR A 45 27.692 17.736 -2.504 1.00 0.00 C ATOM 165 O TYR A 45 27.150 18.728 -2.950 1.00 0.00 O ATOM 166 CB TYR A 45 25.998 15.994 -1.925 1.00 0.00 C ATOM 167 CG TYR A 45 26.642 15.023 -2.887 1.00 0.00 C ATOM 168 CD1 TYR A 45 27.146 13.804 -2.418 1.00 0.00 C ATOM 169 CD2 TYR A 45 26.735 15.343 -4.246 1.00 0.00 C ATOM 170 CE1 TYR A 45 27.743 12.905 -3.309 1.00 0.00 C ATOM 171 CE2 TYR A 45 27.332 14.444 -5.138 1.00 0.00 C ATOM 172 CZ TYR A 45 27.837 13.224 -4.669 1.00 0.00 C ATOM 173 OH TYR A 45 28.425 12.338 -5.547 1.00 0.00 O ATOM 0 H TYR A 45 25.810 18.559 -0.783 1.00 0.00 H new ATOM 0 HA TYR A 45 27.839 16.348 -0.864 1.00 0.00 H new ATOM 0 HB2 TYR A 45 25.511 15.452 -1.115 1.00 0.00 H new ATOM 0 HB3 TYR A 45 25.224 16.569 -2.434 1.00 0.00 H new ATOM 0 HD1 TYR A 45 27.074 13.557 -1.369 1.00 0.00 H new ATOM 0 HD2 TYR A 45 26.346 16.284 -4.607 1.00 0.00 H new ATOM 0 HE1 TYR A 45 28.131 11.964 -2.947 1.00 0.00 H new ATOM 0 HE2 TYR A 45 27.403 14.691 -6.187 1.00 0.00 H new ATOM 0 HH TYR A 45 28.407 12.714 -6.452 1.00 0.00 H new ATOM 183 N GLY A 46 28.831 17.313 -2.982 1.00 0.00 N ATOM 184 CA GLY A 46 29.491 18.051 -4.096 1.00 0.00 C ATOM 185 C GLY A 46 30.856 17.423 -4.384 1.00 0.00 C ATOM 186 O GLY A 46 31.218 16.413 -3.814 1.00 0.00 O ATOM 0 H GLY A 46 29.332 16.489 -2.649 1.00 0.00 H new ATOM 0 HA2 GLY A 46 28.867 18.017 -4.989 1.00 0.00 H new ATOM 0 HA3 GLY A 46 29.610 19.101 -3.830 1.00 0.00 H new ATOM 190 N GLU A 47 31.618 18.012 -5.266 1.00 0.00 N ATOM 191 CA GLU A 47 32.959 17.447 -5.588 1.00 0.00 C ATOM 192 C GLU A 47 34.044 18.409 -5.102 1.00 0.00 C ATOM 193 O GLU A 47 33.799 19.581 -4.893 1.00 0.00 O ATOM 194 CB GLU A 47 33.083 17.256 -7.100 1.00 0.00 C ATOM 195 CG GLU A 47 31.978 16.317 -7.589 1.00 0.00 C ATOM 196 CD GLU A 47 32.121 16.101 -9.097 1.00 0.00 C ATOM 197 OE1 GLU A 47 32.915 16.801 -9.702 1.00 0.00 O ATOM 198 OE2 GLU A 47 31.435 15.238 -9.619 1.00 0.00 O ATOM 0 H GLU A 47 31.370 18.859 -5.777 1.00 0.00 H new ATOM 0 HA GLU A 47 33.078 16.484 -5.092 1.00 0.00 H new ATOM 0 HB2 GLU A 47 33.007 18.218 -7.606 1.00 0.00 H new ATOM 0 HB3 GLU A 47 34.061 16.843 -7.346 1.00 0.00 H new ATOM 0 HG2 GLU A 47 32.040 15.362 -7.067 1.00 0.00 H new ATOM 0 HG3 GLU A 47 31.000 16.741 -7.363 1.00 0.00 H new ATOM 205 N ASP A 48 35.242 17.925 -4.917 1.00 0.00 N ATOM 206 CA ASP A 48 36.340 18.815 -4.443 1.00 0.00 C ATOM 207 C ASP A 48 35.820 19.696 -3.305 1.00 0.00 C ATOM 208 O ASP A 48 36.133 20.867 -3.221 1.00 0.00 O ATOM 209 CB ASP A 48 36.817 19.698 -5.597 1.00 0.00 C ATOM 210 CG ASP A 48 37.263 18.816 -6.765 1.00 0.00 C ATOM 211 OD1 ASP A 48 37.523 17.647 -6.533 1.00 0.00 O ATOM 212 OD2 ASP A 48 37.336 19.325 -7.871 1.00 0.00 O ATOM 0 H ASP A 48 35.508 16.953 -5.073 1.00 0.00 H new ATOM 0 HA ASP A 48 37.173 18.209 -4.085 1.00 0.00 H new ATOM 0 HB2 ASP A 48 36.014 20.363 -5.916 1.00 0.00 H new ATOM 0 HB3 ASP A 48 37.643 20.329 -5.268 1.00 0.00 H new ATOM 217 N MET A 49 35.027 19.142 -2.429 1.00 0.00 N ATOM 218 CA MET A 49 34.487 19.947 -1.299 1.00 0.00 C ATOM 219 C MET A 49 35.584 20.163 -0.255 1.00 0.00 C ATOM 220 O MET A 49 36.372 19.279 0.024 1.00 0.00 O ATOM 221 CB MET A 49 33.312 19.206 -0.657 1.00 0.00 C ATOM 222 CG MET A 49 32.360 18.711 -1.747 1.00 0.00 C ATOM 223 SD MET A 49 31.191 17.526 -1.035 1.00 0.00 S ATOM 224 CE MET A 49 30.254 18.708 -0.036 1.00 0.00 C ATOM 0 H MET A 49 34.730 18.166 -2.448 1.00 0.00 H new ATOM 0 HA MET A 49 34.146 20.912 -1.674 1.00 0.00 H new ATOM 0 HB2 MET A 49 33.678 18.364 -0.069 1.00 0.00 H new ATOM 0 HB3 MET A 49 32.783 19.868 0.029 1.00 0.00 H new ATOM 0 HG2 MET A 49 31.821 19.552 -2.184 1.00 0.00 H new ATOM 0 HG3 MET A 49 32.925 18.242 -2.552 1.00 0.00 H new ATOM 0 HE1 MET A 49 29.335 18.239 0.315 1.00 0.00 H new ATOM 0 HE2 MET A 49 30.854 19.017 0.820 1.00 0.00 H new ATOM 0 HE3 MET A 49 30.008 19.581 -0.641 1.00 0.00 H new ATOM 234 N THR A 50 35.644 21.330 0.326 1.00 0.00 N ATOM 235 CA THR A 50 36.691 21.601 1.351 1.00 0.00 C ATOM 236 C THR A 50 36.039 22.218 2.591 1.00 0.00 C ATOM 237 O THR A 50 34.934 22.718 2.538 1.00 0.00 O ATOM 238 CB THR A 50 37.724 22.574 0.780 1.00 0.00 C ATOM 239 OG1 THR A 50 37.106 23.399 -0.198 1.00 0.00 O ATOM 240 CG2 THR A 50 38.868 21.787 0.139 1.00 0.00 C ATOM 0 H THR A 50 35.013 22.108 0.135 1.00 0.00 H new ATOM 0 HA THR A 50 37.184 20.668 1.624 1.00 0.00 H new ATOM 0 HB THR A 50 38.120 23.197 1.582 1.00 0.00 H new ATOM 0 HG1 THR A 50 37.766 24.024 -0.563 1.00 0.00 H new ATOM 0 HG21 THR A 50 39.604 22.481 -0.268 1.00 0.00 H new ATOM 0 HG22 THR A 50 39.341 21.156 0.891 1.00 0.00 H new ATOM 0 HG23 THR A 50 38.475 21.163 -0.664 1.00 0.00 H new ATOM 248 N PRO A 51 36.747 22.182 3.731 1.00 0.00 N ATOM 249 CA PRO A 51 36.244 22.737 4.994 1.00 0.00 C ATOM 250 C PRO A 51 36.199 24.268 4.961 1.00 0.00 C ATOM 251 O PRO A 51 35.180 24.873 5.226 1.00 0.00 O ATOM 252 CB PRO A 51 37.270 22.266 6.025 1.00 0.00 C ATOM 253 CG PRO A 51 38.521 22.051 5.243 1.00 0.00 C ATOM 254 CD PRO A 51 38.091 21.596 3.875 1.00 0.00 C ATOM 0 HA PRO A 51 35.226 22.413 5.208 1.00 0.00 H new ATOM 0 HB2 PRO A 51 37.415 23.011 6.808 1.00 0.00 H new ATOM 0 HB3 PRO A 51 36.946 21.348 6.515 1.00 0.00 H new ATOM 0 HG2 PRO A 51 39.104 22.970 5.182 1.00 0.00 H new ATOM 0 HG3 PRO A 51 39.154 21.303 5.720 1.00 0.00 H new ATOM 0 HD2 PRO A 51 38.770 21.952 3.100 1.00 0.00 H new ATOM 0 HD3 PRO A 51 38.066 20.509 3.802 1.00 0.00 H new ATOM 262 N THR A 52 37.295 24.897 4.636 1.00 0.00 N ATOM 263 CA THR A 52 37.313 26.385 4.584 1.00 0.00 C ATOM 264 C THR A 52 36.260 26.870 3.586 1.00 0.00 C ATOM 265 O THR A 52 35.553 27.827 3.829 1.00 0.00 O ATOM 266 CB THR A 52 38.696 26.865 4.140 1.00 0.00 C ATOM 267 OG1 THR A 52 39.687 26.286 4.977 1.00 0.00 O ATOM 268 CG2 THR A 52 38.767 28.389 4.239 1.00 0.00 C ATOM 0 H THR A 52 38.179 24.444 4.404 1.00 0.00 H new ATOM 0 HA THR A 52 37.091 26.786 5.573 1.00 0.00 H new ATOM 0 HB THR A 52 38.871 26.564 3.107 1.00 0.00 H new ATOM 0 HG1 THR A 52 40.574 26.591 4.693 1.00 0.00 H new ATOM 0 HG21 THR A 52 39.753 28.729 3.922 1.00 0.00 H new ATOM 0 HG22 THR A 52 38.007 28.831 3.595 1.00 0.00 H new ATOM 0 HG23 THR A 52 38.592 28.695 5.270 1.00 0.00 H new ATOM 276 N LEU A 53 36.150 26.214 2.463 1.00 0.00 N ATOM 277 CA LEU A 53 35.142 26.636 1.451 1.00 0.00 C ATOM 278 C LEU A 53 33.739 26.501 2.045 1.00 0.00 C ATOM 279 O LEU A 53 32.917 27.387 1.930 1.00 0.00 O ATOM 280 CB LEU A 53 35.259 25.749 0.211 1.00 0.00 C ATOM 281 CG LEU A 53 34.419 26.341 -0.921 1.00 0.00 C ATOM 282 CD1 LEU A 53 35.016 25.930 -2.269 1.00 0.00 C ATOM 283 CD2 LEU A 53 32.985 25.820 -0.818 1.00 0.00 C ATOM 0 H LEU A 53 36.714 25.405 2.203 1.00 0.00 H new ATOM 0 HA LEU A 53 35.321 27.674 1.171 1.00 0.00 H new ATOM 0 HB2 LEU A 53 36.302 25.673 -0.097 1.00 0.00 H new ATOM 0 HB3 LEU A 53 34.919 24.739 0.440 1.00 0.00 H new ATOM 0 HG LEU A 53 34.417 27.428 -0.841 1.00 0.00 H new ATOM 0 HD11 LEU A 53 34.417 26.352 -3.076 1.00 0.00 H new ATOM 0 HD12 LEU A 53 36.038 26.302 -2.343 1.00 0.00 H new ATOM 0 HD13 LEU A 53 35.019 24.843 -2.349 1.00 0.00 H new ATOM 0 HD21 LEU A 53 32.386 26.242 -1.625 1.00 0.00 H new ATOM 0 HD22 LEU A 53 32.986 24.733 -0.897 1.00 0.00 H new ATOM 0 HD23 LEU A 53 32.559 26.113 0.142 1.00 0.00 H new ATOM 295 N LEU A 54 33.460 25.397 2.685 1.00 0.00 N ATOM 296 CA LEU A 54 32.112 25.208 3.290 1.00 0.00 C ATOM 297 C LEU A 54 31.911 26.238 4.403 1.00 0.00 C ATOM 298 O LEU A 54 30.883 26.879 4.493 1.00 0.00 O ATOM 299 CB LEU A 54 32.006 23.799 3.875 1.00 0.00 C ATOM 300 CG LEU A 54 32.116 22.769 2.749 1.00 0.00 C ATOM 301 CD1 LEU A 54 32.439 21.397 3.344 1.00 0.00 C ATOM 302 CD2 LEU A 54 30.788 22.696 1.993 1.00 0.00 C ATOM 0 H LEU A 54 34.107 24.619 2.814 1.00 0.00 H new ATOM 0 HA LEU A 54 31.347 25.340 2.525 1.00 0.00 H new ATOM 0 HB2 LEU A 54 32.796 23.638 4.608 1.00 0.00 H new ATOM 0 HB3 LEU A 54 31.057 23.681 4.398 1.00 0.00 H new ATOM 0 HG LEU A 54 32.909 23.064 2.062 1.00 0.00 H new ATOM 0 HD11 LEU A 54 32.518 20.662 2.543 1.00 0.00 H new ATOM 0 HD12 LEU A 54 33.385 21.448 3.884 1.00 0.00 H new ATOM 0 HD13 LEU A 54 31.645 21.102 4.030 1.00 0.00 H new ATOM 0 HD21 LEU A 54 30.866 21.962 1.191 1.00 0.00 H new ATOM 0 HD22 LEU A 54 29.994 22.400 2.679 1.00 0.00 H new ATOM 0 HD23 LEU A 54 30.556 23.673 1.570 1.00 0.00 H new ATOM 314 N ARG A 55 32.888 26.403 5.252 1.00 0.00 N ATOM 315 CA ARG A 55 32.758 27.390 6.359 1.00 0.00 C ATOM 316 C ARG A 55 32.247 28.718 5.798 1.00 0.00 C ATOM 317 O ARG A 55 31.415 29.376 6.392 1.00 0.00 O ATOM 318 CB ARG A 55 34.124 27.604 7.014 1.00 0.00 C ATOM 319 CG ARG A 55 33.971 28.524 8.226 1.00 0.00 C ATOM 320 CD ARG A 55 35.336 28.727 8.887 1.00 0.00 C ATOM 321 NE ARG A 55 35.170 29.521 10.138 1.00 0.00 N ATOM 322 CZ ARG A 55 36.208 30.076 10.701 1.00 0.00 C ATOM 323 NH1 ARG A 55 36.649 31.225 10.268 1.00 0.00 N ATOM 324 NH2 ARG A 55 36.806 29.481 11.698 1.00 0.00 N ATOM 0 H ARG A 55 33.772 25.895 5.226 1.00 0.00 H new ATOM 0 HA ARG A 55 32.054 27.014 7.102 1.00 0.00 H new ATOM 0 HB2 ARG A 55 34.545 26.647 7.322 1.00 0.00 H new ATOM 0 HB3 ARG A 55 34.818 28.042 6.297 1.00 0.00 H new ATOM 0 HG2 ARG A 55 33.558 29.484 7.917 1.00 0.00 H new ATOM 0 HG3 ARG A 55 33.270 28.090 8.939 1.00 0.00 H new ATOM 0 HD2 ARG A 55 35.789 27.762 9.114 1.00 0.00 H new ATOM 0 HD3 ARG A 55 36.010 29.243 8.203 1.00 0.00 H new ATOM 0 HE ARG A 55 34.245 29.630 10.554 1.00 0.00 H new ATOM 0 HH11 ARG A 55 36.182 31.690 9.489 1.00 0.00 H new ATOM 0 HH12 ARG A 55 37.460 31.659 10.708 1.00 0.00 H new ATOM 0 HH21 ARG A 55 36.462 28.583 12.036 1.00 0.00 H new ATOM 0 HH22 ARG A 55 37.617 29.915 12.138 1.00 0.00 H new ATOM 338 N GLY A 56 32.737 29.117 4.656 1.00 0.00 N ATOM 339 CA GLY A 56 32.277 30.401 4.057 1.00 0.00 C ATOM 340 C GLY A 56 30.864 30.226 3.499 1.00 0.00 C ATOM 341 O GLY A 56 30.072 31.147 3.486 1.00 0.00 O ATOM 0 H GLY A 56 33.435 28.610 4.113 1.00 0.00 H new ATOM 0 HA2 GLY A 56 32.287 31.190 4.809 1.00 0.00 H new ATOM 0 HA3 GLY A 56 32.958 30.709 3.263 1.00 0.00 H new ATOM 345 N ALA A 57 30.540 29.048 3.038 1.00 0.00 N ATOM 346 CA ALA A 57 29.177 28.817 2.482 1.00 0.00 C ATOM 347 C ALA A 57 28.163 28.759 3.627 1.00 0.00 C ATOM 348 O ALA A 57 26.991 29.017 3.443 1.00 0.00 O ATOM 349 CB ALA A 57 29.157 27.494 1.714 1.00 0.00 C ATOM 0 H ALA A 57 31.159 28.238 3.023 1.00 0.00 H new ATOM 0 HA ALA A 57 28.916 29.632 1.807 1.00 0.00 H new ATOM 0 HB1 ALA A 57 28.160 27.325 1.307 1.00 0.00 H new ATOM 0 HB2 ALA A 57 29.879 27.536 0.899 1.00 0.00 H new ATOM 0 HB3 ALA A 57 29.417 26.678 2.388 1.00 0.00 H new ATOM 355 N PHE A 58 28.607 28.422 4.806 1.00 0.00 N ATOM 356 CA PHE A 58 27.669 28.348 5.962 1.00 0.00 C ATOM 357 C PHE A 58 28.106 29.347 7.037 1.00 0.00 C ATOM 358 O PHE A 58 27.594 29.350 8.139 1.00 0.00 O ATOM 359 CB PHE A 58 27.691 26.934 6.545 1.00 0.00 C ATOM 360 CG PHE A 58 27.220 25.947 5.503 1.00 0.00 C ATOM 361 CD1 PHE A 58 28.135 25.384 4.606 1.00 0.00 C ATOM 362 CD2 PHE A 58 25.867 25.594 5.437 1.00 0.00 C ATOM 363 CE1 PHE A 58 27.698 24.468 3.642 1.00 0.00 C ATOM 364 CE2 PHE A 58 25.429 24.678 4.474 1.00 0.00 C ATOM 365 CZ PHE A 58 26.344 24.115 3.576 1.00 0.00 C ATOM 0 H PHE A 58 29.578 28.195 5.019 1.00 0.00 H new ATOM 0 HA PHE A 58 26.660 28.589 5.628 1.00 0.00 H new ATOM 0 HB2 PHE A 58 28.700 26.680 6.871 1.00 0.00 H new ATOM 0 HB3 PHE A 58 27.050 26.883 7.425 1.00 0.00 H new ATOM 0 HD1 PHE A 58 29.179 25.656 4.658 1.00 0.00 H new ATOM 0 HD2 PHE A 58 25.161 26.029 6.129 1.00 0.00 H new ATOM 0 HE1 PHE A 58 28.404 24.034 2.950 1.00 0.00 H new ATOM 0 HE2 PHE A 58 24.385 24.405 4.423 1.00 0.00 H new ATOM 0 HZ PHE A 58 26.006 23.409 2.832 1.00 0.00 H new ATOM 375 N SER A 59 29.054 30.189 6.728 1.00 0.00 N ATOM 376 CA SER A 59 29.531 31.181 7.734 1.00 0.00 C ATOM 377 C SER A 59 28.503 32.306 7.895 1.00 0.00 C ATOM 378 O SER A 59 28.018 32.562 8.979 1.00 0.00 O ATOM 379 CB SER A 59 30.862 31.774 7.269 1.00 0.00 C ATOM 380 OG SER A 59 31.929 31.146 7.966 1.00 0.00 O ATOM 0 H SER A 59 29.519 30.233 5.821 1.00 0.00 H new ATOM 0 HA SER A 59 29.663 30.680 8.693 1.00 0.00 H new ATOM 0 HB2 SER A 59 30.981 31.631 6.195 1.00 0.00 H new ATOM 0 HB3 SER A 59 30.877 32.849 7.451 1.00 0.00 H new ATOM 0 HG SER A 59 31.847 30.173 7.882 1.00 0.00 H new ATOM 386 N PRO A 60 28.173 32.997 6.792 1.00 0.00 N ATOM 387 CA PRO A 60 27.210 34.107 6.812 1.00 0.00 C ATOM 388 C PRO A 60 25.780 33.630 7.088 1.00 0.00 C ATOM 389 O PRO A 60 25.011 34.300 7.749 1.00 0.00 O ATOM 390 CB PRO A 60 27.306 34.688 5.400 1.00 0.00 C ATOM 391 CG PRO A 60 27.794 33.555 4.562 1.00 0.00 C ATOM 392 CD PRO A 60 28.708 32.751 5.442 1.00 0.00 C ATOM 0 HA PRO A 60 27.435 34.824 7.602 1.00 0.00 H new ATOM 0 HB2 PRO A 60 26.338 35.050 5.053 1.00 0.00 H new ATOM 0 HB3 PRO A 60 27.994 35.533 5.364 1.00 0.00 H new ATOM 0 HG2 PRO A 60 26.962 32.947 4.205 1.00 0.00 H new ATOM 0 HG3 PRO A 60 28.322 33.921 3.682 1.00 0.00 H new ATOM 0 HD2 PRO A 60 28.685 31.692 5.186 1.00 0.00 H new ATOM 0 HD3 PRO A 60 29.744 33.078 5.353 1.00 0.00 H new ATOM 400 N PHE A 61 25.416 32.483 6.587 1.00 0.00 N ATOM 401 CA PHE A 61 24.036 31.973 6.821 1.00 0.00 C ATOM 402 C PHE A 61 23.783 31.840 8.325 1.00 0.00 C ATOM 403 O PHE A 61 22.683 32.044 8.799 1.00 0.00 O ATOM 404 CB PHE A 61 23.879 30.605 6.154 1.00 0.00 C ATOM 405 CG PHE A 61 23.742 30.788 4.662 1.00 0.00 C ATOM 406 CD1 PHE A 61 22.480 31.005 4.096 1.00 0.00 C ATOM 407 CD2 PHE A 61 24.877 30.739 3.844 1.00 0.00 C ATOM 408 CE1 PHE A 61 22.353 31.173 2.711 1.00 0.00 C ATOM 409 CE2 PHE A 61 24.750 30.907 2.460 1.00 0.00 C ATOM 410 CZ PHE A 61 23.489 31.124 1.894 1.00 0.00 C ATOM 0 H PHE A 61 26.014 31.877 6.026 1.00 0.00 H new ATOM 0 HA PHE A 61 23.316 32.672 6.395 1.00 0.00 H new ATOM 0 HB2 PHE A 61 24.742 29.978 6.377 1.00 0.00 H new ATOM 0 HB3 PHE A 61 23.002 30.093 6.551 1.00 0.00 H new ATOM 0 HD1 PHE A 61 21.604 31.043 4.727 1.00 0.00 H new ATOM 0 HD2 PHE A 61 25.851 30.572 4.281 1.00 0.00 H new ATOM 0 HE1 PHE A 61 21.380 31.340 2.274 1.00 0.00 H new ATOM 0 HE2 PHE A 61 25.626 30.869 1.829 1.00 0.00 H new ATOM 0 HZ PHE A 61 23.392 31.254 0.826 1.00 0.00 H new ATOM 420 N GLY A 62 24.792 31.501 9.081 1.00 0.00 N ATOM 421 CA GLY A 62 24.601 31.358 10.552 1.00 0.00 C ATOM 422 C GLY A 62 25.904 30.878 11.195 1.00 0.00 C ATOM 423 O GLY A 62 26.925 30.767 10.547 1.00 0.00 O ATOM 0 H GLY A 62 25.737 31.317 8.745 1.00 0.00 H new ATOM 0 HA2 GLY A 62 24.300 32.312 10.984 1.00 0.00 H new ATOM 0 HA3 GLY A 62 23.799 30.649 10.757 1.00 0.00 H new ATOM 427 N ASN A 63 25.876 30.592 12.469 1.00 0.00 N ATOM 428 CA ASN A 63 27.111 30.119 13.156 1.00 0.00 C ATOM 429 C ASN A 63 27.123 28.589 13.187 1.00 0.00 C ATOM 430 O ASN A 63 26.095 27.952 13.291 1.00 0.00 O ATOM 431 CB ASN A 63 27.135 30.658 14.588 1.00 0.00 C ATOM 432 CG ASN A 63 27.132 32.187 14.557 1.00 0.00 C ATOM 433 OD1 ASN A 63 27.723 32.791 13.684 1.00 0.00 O ATOM 434 ND2 ASN A 63 26.489 32.845 15.483 1.00 0.00 N ATOM 0 H ASN A 63 25.050 30.666 13.063 1.00 0.00 H new ATOM 0 HA ASN A 63 27.988 30.478 12.617 1.00 0.00 H new ATOM 0 HB2 ASN A 63 26.269 30.293 15.140 1.00 0.00 H new ATOM 0 HB3 ASN A 63 28.021 30.296 15.110 1.00 0.00 H new ATOM 0 HD21 ASN A 63 26.483 33.865 15.473 1.00 0.00 H new ATOM 0 HD22 ASN A 63 25.992 32.339 16.216 1.00 0.00 H new ATOM 441 N ILE A 64 28.282 27.996 13.099 1.00 0.00 N ATOM 442 CA ILE A 64 28.360 26.508 13.124 1.00 0.00 C ATOM 443 C ILE A 64 29.012 26.055 14.431 1.00 0.00 C ATOM 444 O ILE A 64 30.090 26.493 14.784 1.00 0.00 O ATOM 445 CB ILE A 64 29.199 26.022 11.939 1.00 0.00 C ATOM 446 CG1 ILE A 64 28.593 26.549 10.637 1.00 0.00 C ATOM 447 CG2 ILE A 64 29.209 24.492 11.916 1.00 0.00 C ATOM 448 CD1 ILE A 64 29.629 26.450 9.516 1.00 0.00 C ATOM 0 H ILE A 64 29.177 28.477 13.011 1.00 0.00 H new ATOM 0 HA ILE A 64 27.356 26.089 13.054 1.00 0.00 H new ATOM 0 HB ILE A 64 30.220 26.390 12.039 1.00 0.00 H new ATOM 0 HG12 ILE A 64 27.705 25.973 10.378 1.00 0.00 H new ATOM 0 HG13 ILE A 64 28.276 27.584 10.764 1.00 0.00 H new ATOM 0 HG21 ILE A 64 29.806 24.145 11.073 1.00 0.00 H new ATOM 0 HG22 ILE A 64 29.640 24.117 12.844 1.00 0.00 H new ATOM 0 HG23 ILE A 64 28.188 24.123 11.814 1.00 0.00 H new ATOM 0 HD11 ILE A 64 29.198 26.825 8.588 1.00 0.00 H new ATOM 0 HD12 ILE A 64 30.504 27.045 9.776 1.00 0.00 H new ATOM 0 HD13 ILE A 64 29.924 25.409 9.384 1.00 0.00 H new ATOM 460 N ILE A 65 28.366 25.182 15.154 1.00 0.00 N ATOM 461 CA ILE A 65 28.947 24.702 16.440 1.00 0.00 C ATOM 462 C ILE A 65 29.787 23.450 16.186 1.00 0.00 C ATOM 463 O ILE A 65 30.664 23.113 16.957 1.00 0.00 O ATOM 464 CB ILE A 65 27.818 24.369 17.417 1.00 0.00 C ATOM 465 CG1 ILE A 65 27.098 23.102 16.952 1.00 0.00 C ATOM 466 CG2 ILE A 65 26.824 25.532 17.463 1.00 0.00 C ATOM 467 CD1 ILE A 65 26.037 22.712 17.983 1.00 0.00 C ATOM 0 H ILE A 65 27.461 24.780 14.910 1.00 0.00 H new ATOM 0 HA ILE A 65 29.578 25.482 16.866 1.00 0.00 H new ATOM 0 HB ILE A 65 28.234 24.206 18.411 1.00 0.00 H new ATOM 0 HG12 ILE A 65 26.632 23.271 15.981 1.00 0.00 H new ATOM 0 HG13 ILE A 65 27.814 22.290 16.825 1.00 0.00 H new ATOM 0 HG21 ILE A 65 26.019 25.295 18.159 1.00 0.00 H new ATOM 0 HG22 ILE A 65 27.336 26.435 17.794 1.00 0.00 H new ATOM 0 HG23 ILE A 65 26.408 25.694 16.469 1.00 0.00 H new ATOM 0 HD11 ILE A 65 25.523 21.809 17.653 1.00 0.00 H new ATOM 0 HD12 ILE A 65 26.515 22.526 18.945 1.00 0.00 H new ATOM 0 HD13 ILE A 65 25.316 23.522 18.087 1.00 0.00 H new ATOM 479 N ASP A 66 29.528 22.756 15.112 1.00 0.00 N ATOM 480 CA ASP A 66 30.315 21.527 14.814 1.00 0.00 C ATOM 481 C ASP A 66 30.282 21.249 13.310 1.00 0.00 C ATOM 482 O ASP A 66 29.369 20.629 12.802 1.00 0.00 O ATOM 483 CB ASP A 66 29.707 20.340 15.565 1.00 0.00 C ATOM 484 CG ASP A 66 30.690 19.167 15.546 1.00 0.00 C ATOM 485 OD1 ASP A 66 31.789 19.347 15.046 1.00 0.00 O ATOM 486 OD2 ASP A 66 30.328 18.108 16.031 1.00 0.00 O ATOM 0 H ASP A 66 28.806 22.987 14.429 1.00 0.00 H new ATOM 0 HA ASP A 66 31.347 21.671 15.133 1.00 0.00 H new ATOM 0 HB2 ASP A 66 29.482 20.623 16.593 1.00 0.00 H new ATOM 0 HB3 ASP A 66 28.765 20.047 15.102 1.00 0.00 H new ATOM 491 N LEU A 67 31.275 21.699 12.593 1.00 0.00 N ATOM 492 CA LEU A 67 31.303 21.456 11.123 1.00 0.00 C ATOM 493 C LEU A 67 32.100 20.182 10.839 1.00 0.00 C ATOM 494 O LEU A 67 33.225 20.034 11.273 1.00 0.00 O ATOM 495 CB LEU A 67 31.969 22.643 10.422 1.00 0.00 C ATOM 496 CG LEU A 67 31.685 22.574 8.919 1.00 0.00 C ATOM 497 CD1 LEU A 67 30.946 23.840 8.482 1.00 0.00 C ATOM 498 CD2 LEU A 67 33.005 22.465 8.155 1.00 0.00 C ATOM 0 H LEU A 67 32.068 22.224 12.961 1.00 0.00 H new ATOM 0 HA LEU A 67 30.285 21.342 10.751 1.00 0.00 H new ATOM 0 HB2 LEU A 67 31.591 23.580 10.832 1.00 0.00 H new ATOM 0 HB3 LEU A 67 33.044 22.628 10.601 1.00 0.00 H new ATOM 0 HG LEU A 67 31.069 21.701 8.705 1.00 0.00 H new ATOM 0 HD11 LEU A 67 30.743 23.792 7.412 1.00 0.00 H new ATOM 0 HD12 LEU A 67 30.005 23.918 9.026 1.00 0.00 H new ATOM 0 HD13 LEU A 67 31.562 24.713 8.696 1.00 0.00 H new ATOM 0 HD21 LEU A 67 32.803 22.416 7.085 1.00 0.00 H new ATOM 0 HD22 LEU A 67 33.622 23.338 8.368 1.00 0.00 H new ATOM 0 HD23 LEU A 67 33.532 21.563 8.467 1.00 0.00 H new ATOM 510 N SER A 68 31.526 19.258 10.118 1.00 0.00 N ATOM 511 CA SER A 68 32.255 17.994 9.814 1.00 0.00 C ATOM 512 C SER A 68 32.274 17.760 8.303 1.00 0.00 C ATOM 513 O SER A 68 31.408 18.216 7.583 1.00 0.00 O ATOM 514 CB SER A 68 31.551 16.823 10.502 1.00 0.00 C ATOM 515 OG SER A 68 31.574 17.016 11.909 1.00 0.00 O ATOM 0 H SER A 68 30.586 19.323 9.727 1.00 0.00 H new ATOM 0 HA SER A 68 33.279 18.071 10.180 1.00 0.00 H new ATOM 0 HB2 SER A 68 30.522 16.747 10.152 1.00 0.00 H new ATOM 0 HB3 SER A 68 32.045 15.886 10.245 1.00 0.00 H new ATOM 0 HG SER A 68 31.121 16.267 12.349 1.00 0.00 H new ATOM 521 N MET A 69 33.255 17.049 7.820 1.00 0.00 N ATOM 522 CA MET A 69 33.334 16.779 6.358 1.00 0.00 C ATOM 523 C MET A 69 33.452 15.271 6.128 1.00 0.00 C ATOM 524 O MET A 69 33.983 14.549 6.948 1.00 0.00 O ATOM 525 CB MET A 69 34.562 17.480 5.775 1.00 0.00 C ATOM 526 CG MET A 69 34.334 18.994 5.775 1.00 0.00 C ATOM 527 SD MET A 69 35.659 19.804 4.846 1.00 0.00 S ATOM 528 CE MET A 69 35.162 19.235 3.202 1.00 0.00 C ATOM 0 H MET A 69 34.007 16.643 8.377 1.00 0.00 H new ATOM 0 HA MET A 69 32.436 17.155 5.869 1.00 0.00 H new ATOM 0 HB2 MET A 69 35.447 17.235 6.362 1.00 0.00 H new ATOM 0 HB3 MET A 69 34.746 17.129 4.760 1.00 0.00 H new ATOM 0 HG2 MET A 69 33.367 19.227 5.328 1.00 0.00 H new ATOM 0 HG3 MET A 69 34.311 19.369 6.798 1.00 0.00 H new ATOM 0 HE1 MET A 69 36.027 18.821 2.683 1.00 0.00 H new ATOM 0 HE2 MET A 69 34.395 18.467 3.299 1.00 0.00 H new ATOM 0 HE3 MET A 69 34.764 20.074 2.631 1.00 0.00 H new ATOM 538 N ASP A 70 32.961 14.788 5.019 1.00 0.00 N ATOM 539 CA ASP A 70 33.047 13.326 4.743 1.00 0.00 C ATOM 540 C ASP A 70 33.639 13.102 3.351 1.00 0.00 C ATOM 541 O ASP A 70 32.951 13.192 2.352 1.00 0.00 O ATOM 542 CB ASP A 70 31.648 12.710 4.805 1.00 0.00 C ATOM 543 CG ASP A 70 31.697 11.412 5.612 1.00 0.00 C ATOM 544 OD1 ASP A 70 32.788 11.009 5.984 1.00 0.00 O ATOM 545 OD2 ASP A 70 30.644 10.842 5.845 1.00 0.00 O ATOM 0 H ASP A 70 32.505 15.342 4.294 1.00 0.00 H new ATOM 0 HA ASP A 70 33.685 12.855 5.490 1.00 0.00 H new ATOM 0 HB2 ASP A 70 30.951 13.410 5.265 1.00 0.00 H new ATOM 0 HB3 ASP A 70 31.282 12.511 3.798 1.00 0.00 H new ATOM 550 N PRO A 71 34.944 12.799 3.287 1.00 0.00 N ATOM 551 CA PRO A 71 35.634 12.557 2.019 1.00 0.00 C ATOM 552 C PRO A 71 35.299 11.191 1.387 1.00 0.00 C ATOM 553 O PRO A 71 35.359 11.050 0.181 1.00 0.00 O ATOM 554 CB PRO A 71 37.114 12.625 2.394 1.00 0.00 C ATOM 555 CG PRO A 71 37.172 12.289 3.847 1.00 0.00 C ATOM 556 CD PRO A 71 35.844 12.676 4.449 1.00 0.00 C ATOM 0 HA PRO A 71 35.333 13.284 1.264 1.00 0.00 H new ATOM 0 HB2 PRO A 71 37.701 11.921 1.804 1.00 0.00 H new ATOM 0 HB3 PRO A 71 37.522 13.618 2.204 1.00 0.00 H new ATOM 0 HG2 PRO A 71 37.363 11.225 3.988 1.00 0.00 H new ATOM 0 HG3 PRO A 71 37.986 12.826 4.334 1.00 0.00 H new ATOM 0 HD2 PRO A 71 35.489 11.921 5.150 1.00 0.00 H new ATOM 0 HD3 PRO A 71 35.914 13.614 5.000 1.00 0.00 H new ATOM 564 N PRO A 72 34.943 10.160 2.187 1.00 0.00 N ATOM 565 CA PRO A 72 34.616 8.840 1.636 1.00 0.00 C ATOM 566 C PRO A 72 33.231 8.823 0.983 1.00 0.00 C ATOM 567 O PRO A 72 32.964 8.043 0.091 1.00 0.00 O ATOM 568 CB PRO A 72 34.626 7.924 2.855 1.00 0.00 C ATOM 569 CG PRO A 72 34.322 8.815 4.011 1.00 0.00 C ATOM 570 CD PRO A 72 34.829 10.187 3.659 1.00 0.00 C ATOM 0 HA PRO A 72 35.318 8.541 0.858 1.00 0.00 H new ATOM 0 HB2 PRO A 72 33.882 7.133 2.760 1.00 0.00 H new ATOM 0 HB3 PRO A 72 35.594 7.438 2.975 1.00 0.00 H new ATOM 0 HG2 PRO A 72 33.250 8.839 4.207 1.00 0.00 H new ATOM 0 HG3 PRO A 72 34.803 8.448 4.917 1.00 0.00 H new ATOM 0 HD2 PRO A 72 34.141 10.964 3.992 1.00 0.00 H new ATOM 0 HD3 PRO A 72 35.791 10.390 4.130 1.00 0.00 H new ATOM 578 N ARG A 73 32.349 9.678 1.422 1.00 0.00 N ATOM 579 CA ARG A 73 30.982 9.710 0.827 1.00 0.00 C ATOM 580 C ARG A 73 30.813 10.983 -0.006 1.00 0.00 C ATOM 581 O ARG A 73 29.781 11.212 -0.602 1.00 0.00 O ATOM 582 CB ARG A 73 29.939 9.692 1.946 1.00 0.00 C ATOM 583 CG ARG A 73 30.143 8.448 2.812 1.00 0.00 C ATOM 584 CD ARG A 73 29.084 8.415 3.915 1.00 0.00 C ATOM 585 NE ARG A 73 29.408 7.327 4.880 1.00 0.00 N ATOM 586 CZ ARG A 73 28.849 6.156 4.756 1.00 0.00 C ATOM 587 NH1 ARG A 73 27.692 5.923 5.314 1.00 0.00 N ATOM 588 NH2 ARG A 73 29.444 5.218 4.070 1.00 0.00 N ATOM 0 H ARG A 73 32.515 10.356 2.166 1.00 0.00 H new ATOM 0 HA ARG A 73 30.846 8.838 0.187 1.00 0.00 H new ATOM 0 HB2 ARG A 73 30.028 10.591 2.555 1.00 0.00 H new ATOM 0 HB3 ARG A 73 28.935 9.693 1.522 1.00 0.00 H new ATOM 0 HG2 ARG A 73 30.073 7.550 2.199 1.00 0.00 H new ATOM 0 HG3 ARG A 73 31.141 8.457 3.251 1.00 0.00 H new ATOM 0 HD2 ARG A 73 29.050 9.375 4.430 1.00 0.00 H new ATOM 0 HD3 ARG A 73 28.097 8.250 3.482 1.00 0.00 H new ATOM 0 HE ARG A 73 30.068 7.499 5.639 1.00 0.00 H new ATOM 0 HH11 ARG A 73 27.226 6.657 5.847 1.00 0.00 H new ATOM 0 HH12 ARG A 73 27.254 5.007 5.217 1.00 0.00 H new ATOM 0 HH21 ARG A 73 30.346 5.401 3.631 1.00 0.00 H new ATOM 0 HH22 ARG A 73 29.007 4.302 3.973 1.00 0.00 H new ATOM 602 N ASN A 74 31.820 11.813 -0.053 1.00 0.00 N ATOM 603 CA ASN A 74 31.713 13.068 -0.849 1.00 0.00 C ATOM 604 C ASN A 74 30.585 13.936 -0.288 1.00 0.00 C ATOM 605 O ASN A 74 29.792 14.491 -1.023 1.00 0.00 O ATOM 606 CB ASN A 74 31.412 12.721 -2.308 1.00 0.00 C ATOM 607 CG ASN A 74 32.574 11.912 -2.889 1.00 0.00 C ATOM 608 OD1 ASN A 74 33.654 11.895 -2.334 1.00 0.00 O ATOM 609 ND2 ASN A 74 32.396 11.239 -3.992 1.00 0.00 N ATOM 0 H ASN A 74 32.711 11.676 0.425 1.00 0.00 H new ATOM 0 HA ASN A 74 32.654 13.615 -0.791 1.00 0.00 H new ATOM 0 HB2 ASN A 74 30.487 12.148 -2.374 1.00 0.00 H new ATOM 0 HB3 ASN A 74 31.264 13.633 -2.887 1.00 0.00 H new ATOM 0 HD21 ASN A 74 33.164 10.698 -4.389 1.00 0.00 H new ATOM 0 HD22 ASN A 74 31.489 11.254 -4.458 1.00 0.00 H new ATOM 616 N CYS A 75 30.508 14.060 1.009 1.00 0.00 N ATOM 617 CA CYS A 75 29.431 14.893 1.615 1.00 0.00 C ATOM 618 C CYS A 75 29.956 15.551 2.894 1.00 0.00 C ATOM 619 O CYS A 75 30.816 15.020 3.568 1.00 0.00 O ATOM 620 CB CYS A 75 28.230 14.009 1.951 1.00 0.00 C ATOM 621 SG CYS A 75 28.732 12.730 3.129 1.00 0.00 S ATOM 0 H CYS A 75 31.144 13.621 1.675 1.00 0.00 H new ATOM 0 HA CYS A 75 29.126 15.664 0.908 1.00 0.00 H new ATOM 0 HB2 CYS A 75 27.427 14.613 2.374 1.00 0.00 H new ATOM 0 HB3 CYS A 75 27.838 13.549 1.044 1.00 0.00 H new ATOM 0 HG CYS A 75 28.378 13.082 4.329 1.00 0.00 H new ATOM 627 N ALA A 76 29.447 16.704 3.234 1.00 0.00 N ATOM 628 CA ALA A 76 29.920 17.392 4.468 1.00 0.00 C ATOM 629 C ALA A 76 28.765 17.505 5.465 1.00 0.00 C ATOM 630 O ALA A 76 27.609 17.517 5.093 1.00 0.00 O ATOM 631 CB ALA A 76 30.423 18.792 4.110 1.00 0.00 C ATOM 0 H ALA A 76 28.725 17.199 2.711 1.00 0.00 H new ATOM 0 HA ALA A 76 30.731 16.817 4.916 1.00 0.00 H new ATOM 0 HB1 ALA A 76 30.769 19.296 5.012 1.00 0.00 H new ATOM 0 HB2 ALA A 76 31.246 18.712 3.400 1.00 0.00 H new ATOM 0 HB3 ALA A 76 29.612 19.366 3.662 1.00 0.00 H new ATOM 637 N PHE A 77 29.071 17.589 6.732 1.00 0.00 N ATOM 638 CA PHE A 77 27.991 17.700 7.754 1.00 0.00 C ATOM 639 C PHE A 77 28.218 18.953 8.602 1.00 0.00 C ATOM 640 O PHE A 77 29.101 18.999 9.436 1.00 0.00 O ATOM 641 CB PHE A 77 28.015 16.466 8.657 1.00 0.00 C ATOM 642 CG PHE A 77 27.684 15.238 7.845 1.00 0.00 C ATOM 643 CD1 PHE A 77 26.350 14.861 7.658 1.00 0.00 C ATOM 644 CD2 PHE A 77 28.713 14.474 7.280 1.00 0.00 C ATOM 645 CE1 PHE A 77 26.042 13.720 6.906 1.00 0.00 C ATOM 646 CE2 PHE A 77 28.407 13.334 6.528 1.00 0.00 C ATOM 647 CZ PHE A 77 27.072 12.957 6.341 1.00 0.00 C ATOM 0 H PHE A 77 30.021 17.586 7.103 1.00 0.00 H new ATOM 0 HA PHE A 77 27.025 17.768 7.254 1.00 0.00 H new ATOM 0 HB2 PHE A 77 28.998 16.357 9.115 1.00 0.00 H new ATOM 0 HB3 PHE A 77 27.296 16.583 9.468 1.00 0.00 H new ATOM 0 HD1 PHE A 77 25.557 15.450 8.094 1.00 0.00 H new ATOM 0 HD2 PHE A 77 29.743 14.765 7.425 1.00 0.00 H new ATOM 0 HE1 PHE A 77 25.012 13.429 6.762 1.00 0.00 H new ATOM 0 HE2 PHE A 77 29.201 12.745 6.092 1.00 0.00 H new ATOM 0 HZ PHE A 77 26.836 12.077 5.761 1.00 0.00 H new ATOM 657 N VAL A 78 27.428 19.973 8.398 1.00 0.00 N ATOM 658 CA VAL A 78 27.600 21.219 9.195 1.00 0.00 C ATOM 659 C VAL A 78 26.427 21.375 10.165 1.00 0.00 C ATOM 660 O VAL A 78 25.285 21.164 9.810 1.00 0.00 O ATOM 661 CB VAL A 78 27.650 22.418 8.252 1.00 0.00 C ATOM 662 CG1 VAL A 78 26.404 22.411 7.378 1.00 0.00 C ATOM 663 CG2 VAL A 78 27.700 23.713 9.067 1.00 0.00 C ATOM 0 H VAL A 78 26.672 19.996 7.714 1.00 0.00 H new ATOM 0 HA VAL A 78 28.529 21.163 9.763 1.00 0.00 H new ATOM 0 HB VAL A 78 28.540 22.357 7.626 1.00 0.00 H new ATOM 0 HG11 VAL A 78 26.430 23.264 6.700 1.00 0.00 H new ATOM 0 HG12 VAL A 78 26.371 21.488 6.799 1.00 0.00 H new ATOM 0 HG13 VAL A 78 25.517 22.475 8.008 1.00 0.00 H new ATOM 0 HG21 VAL A 78 27.736 24.567 8.391 1.00 0.00 H new ATOM 0 HG22 VAL A 78 26.811 23.783 9.694 1.00 0.00 H new ATOM 0 HG23 VAL A 78 28.589 23.712 9.698 1.00 0.00 H new ATOM 673 N THR A 79 26.701 21.737 11.389 1.00 0.00 N ATOM 674 CA THR A 79 25.601 21.900 12.382 1.00 0.00 C ATOM 675 C THR A 79 25.295 23.389 12.574 1.00 0.00 C ATOM 676 O THR A 79 26.172 24.181 12.851 1.00 0.00 O ATOM 677 CB THR A 79 26.029 21.292 13.720 1.00 0.00 C ATOM 678 OG1 THR A 79 26.709 20.067 13.485 1.00 0.00 O ATOM 679 CG2 THR A 79 24.796 21.034 14.587 1.00 0.00 C ATOM 0 H THR A 79 27.638 21.927 11.744 1.00 0.00 H new ATOM 0 HA THR A 79 24.708 21.392 12.018 1.00 0.00 H new ATOM 0 HB THR A 79 26.693 21.985 14.237 1.00 0.00 H new ATOM 0 HG1 THR A 79 27.641 20.251 13.243 1.00 0.00 H new ATOM 0 HG21 THR A 79 25.104 20.601 15.539 1.00 0.00 H new ATOM 0 HG22 THR A 79 24.275 21.974 14.768 1.00 0.00 H new ATOM 0 HG23 THR A 79 24.128 20.342 14.073 1.00 0.00 H new ATOM 687 N TYR A 80 24.054 23.773 12.429 1.00 0.00 N ATOM 688 CA TYR A 80 23.690 25.210 12.604 1.00 0.00 C ATOM 689 C TYR A 80 23.045 25.409 13.977 1.00 0.00 C ATOM 690 O TYR A 80 22.089 24.745 14.324 1.00 0.00 O ATOM 691 CB TYR A 80 22.699 25.622 11.516 1.00 0.00 C ATOM 692 CG TYR A 80 23.435 26.331 10.405 1.00 0.00 C ATOM 693 CD1 TYR A 80 24.420 27.279 10.709 1.00 0.00 C ATOM 694 CD2 TYR A 80 23.133 26.040 9.071 1.00 0.00 C ATOM 695 CE1 TYR A 80 25.102 27.934 9.678 1.00 0.00 C ATOM 696 CE2 TYR A 80 23.814 26.695 8.039 1.00 0.00 C ATOM 697 CZ TYR A 80 24.798 27.643 8.342 1.00 0.00 C ATOM 698 OH TYR A 80 25.471 28.288 7.326 1.00 0.00 O ATOM 0 H TYR A 80 23.277 23.154 12.197 1.00 0.00 H new ATOM 0 HA TYR A 80 24.589 25.822 12.530 1.00 0.00 H new ATOM 0 HB2 TYR A 80 22.187 24.743 11.124 1.00 0.00 H new ATOM 0 HB3 TYR A 80 21.934 26.276 11.935 1.00 0.00 H new ATOM 0 HD1 TYR A 80 24.653 27.504 11.739 1.00 0.00 H new ATOM 0 HD2 TYR A 80 22.373 25.309 8.837 1.00 0.00 H new ATOM 0 HE1 TYR A 80 25.863 28.664 9.912 1.00 0.00 H new ATOM 0 HE2 TYR A 80 23.580 26.469 7.009 1.00 0.00 H new ATOM 0 HH TYR A 80 25.952 29.060 7.691 1.00 0.00 H new ATOM 708 N GLU A 81 23.560 26.322 14.756 1.00 0.00 N ATOM 709 CA GLU A 81 22.983 26.573 16.109 1.00 0.00 C ATOM 710 C GLU A 81 21.455 26.557 16.031 1.00 0.00 C ATOM 711 O GLU A 81 20.791 25.928 16.830 1.00 0.00 O ATOM 712 CB GLU A 81 23.449 27.941 16.614 1.00 0.00 C ATOM 713 CG GLU A 81 22.964 28.148 18.050 1.00 0.00 C ATOM 714 CD GLU A 81 23.437 29.511 18.557 1.00 0.00 C ATOM 715 OE1 GLU A 81 24.068 30.219 17.790 1.00 0.00 O ATOM 716 OE2 GLU A 81 23.161 29.823 19.704 1.00 0.00 O ATOM 0 H GLU A 81 24.359 26.907 14.513 1.00 0.00 H new ATOM 0 HA GLU A 81 23.318 25.794 16.793 1.00 0.00 H new ATOM 0 HB2 GLU A 81 24.536 28.004 16.574 1.00 0.00 H new ATOM 0 HB3 GLU A 81 23.060 28.730 15.970 1.00 0.00 H new ATOM 0 HG2 GLU A 81 21.876 28.091 18.089 1.00 0.00 H new ATOM 0 HG3 GLU A 81 23.348 27.356 18.693 1.00 0.00 H new ATOM 723 N LYS A 82 20.893 27.244 15.077 1.00 0.00 N ATOM 724 CA LYS A 82 19.408 27.268 14.952 1.00 0.00 C ATOM 725 C LYS A 82 18.990 26.568 13.659 1.00 0.00 C ATOM 726 O LYS A 82 19.750 26.481 12.715 1.00 0.00 O ATOM 727 CB LYS A 82 18.921 28.719 14.927 1.00 0.00 C ATOM 728 CG LYS A 82 19.305 29.411 16.235 1.00 0.00 C ATOM 729 CD LYS A 82 18.777 30.847 16.228 1.00 0.00 C ATOM 730 CE LYS A 82 19.261 31.577 17.482 1.00 0.00 C ATOM 731 NZ LYS A 82 18.224 31.476 18.548 1.00 0.00 N ATOM 0 H LYS A 82 21.397 27.790 14.378 1.00 0.00 H new ATOM 0 HA LYS A 82 18.966 26.750 15.803 1.00 0.00 H new ATOM 0 HB2 LYS A 82 19.362 29.247 14.081 1.00 0.00 H new ATOM 0 HB3 LYS A 82 17.840 28.748 14.792 1.00 0.00 H new ATOM 0 HG2 LYS A 82 18.892 28.865 17.083 1.00 0.00 H new ATOM 0 HG3 LYS A 82 20.388 29.411 16.354 1.00 0.00 H new ATOM 0 HD2 LYS A 82 19.123 31.368 15.335 1.00 0.00 H new ATOM 0 HD3 LYS A 82 17.688 30.845 16.194 1.00 0.00 H new ATOM 0 HE2 LYS A 82 20.198 31.143 17.829 1.00 0.00 H new ATOM 0 HE3 LYS A 82 19.461 32.624 17.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 18.553 31.972 19.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 17.340 31.910 18.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 18.055 30.475 18.774 1.00 0.00 H new ATOM 745 N MET A 83 17.785 26.071 13.606 1.00 0.00 N ATOM 746 CA MET A 83 17.318 25.378 12.373 1.00 0.00 C ATOM 747 C MET A 83 16.954 26.420 11.313 1.00 0.00 C ATOM 748 O MET A 83 16.894 26.128 10.135 1.00 0.00 O ATOM 749 CB MET A 83 16.088 24.529 12.699 1.00 0.00 C ATOM 750 CG MET A 83 16.467 23.454 13.721 1.00 0.00 C ATOM 751 SD MET A 83 15.048 22.369 14.014 1.00 0.00 S ATOM 752 CE MET A 83 15.678 21.568 15.508 1.00 0.00 C ATOM 0 H MET A 83 17.104 26.115 14.364 1.00 0.00 H new ATOM 0 HA MET A 83 18.111 24.734 11.994 1.00 0.00 H new ATOM 0 HB2 MET A 83 15.293 25.159 13.096 1.00 0.00 H new ATOM 0 HB3 MET A 83 15.703 24.064 11.792 1.00 0.00 H new ATOM 0 HG2 MET A 83 17.313 22.872 13.355 1.00 0.00 H new ATOM 0 HG3 MET A 83 16.780 23.920 14.655 1.00 0.00 H new ATOM 0 HE1 MET A 83 15.339 20.532 15.536 1.00 0.00 H new ATOM 0 HE2 MET A 83 16.768 21.593 15.503 1.00 0.00 H new ATOM 0 HE3 MET A 83 15.307 22.095 16.387 1.00 0.00 H new ATOM 762 N GLU A 84 16.712 27.636 11.721 1.00 0.00 N ATOM 763 CA GLU A 84 16.354 28.696 10.736 1.00 0.00 C ATOM 764 C GLU A 84 17.581 29.031 9.885 1.00 0.00 C ATOM 765 O GLU A 84 17.497 29.152 8.679 1.00 0.00 O ATOM 766 CB GLU A 84 15.890 29.950 11.479 1.00 0.00 C ATOM 767 CG GLU A 84 14.595 29.646 12.236 1.00 0.00 C ATOM 768 CD GLU A 84 14.116 30.907 12.958 1.00 0.00 C ATOM 769 OE1 GLU A 84 14.866 31.868 12.989 1.00 0.00 O ATOM 770 OE2 GLU A 84 13.008 30.889 13.468 1.00 0.00 O ATOM 0 H GLU A 84 16.747 27.941 12.694 1.00 0.00 H new ATOM 0 HA GLU A 84 15.550 28.339 10.093 1.00 0.00 H new ATOM 0 HB2 GLU A 84 16.662 30.280 12.175 1.00 0.00 H new ATOM 0 HB3 GLU A 84 15.728 30.765 10.773 1.00 0.00 H new ATOM 0 HG2 GLU A 84 13.829 29.298 11.542 1.00 0.00 H new ATOM 0 HG3 GLU A 84 14.762 28.844 12.955 1.00 0.00 H new ATOM 777 N SER A 85 18.720 29.176 10.504 1.00 0.00 N ATOM 778 CA SER A 85 19.954 29.497 9.732 1.00 0.00 C ATOM 779 C SER A 85 20.241 28.363 8.747 1.00 0.00 C ATOM 780 O SER A 85 20.843 28.564 7.711 1.00 0.00 O ATOM 781 CB SER A 85 21.133 29.644 10.695 1.00 0.00 C ATOM 782 OG SER A 85 20.791 30.560 11.726 1.00 0.00 O ATOM 0 H SER A 85 18.850 29.086 11.512 1.00 0.00 H new ATOM 0 HA SER A 85 19.812 30.430 9.186 1.00 0.00 H new ATOM 0 HB2 SER A 85 21.388 28.675 11.125 1.00 0.00 H new ATOM 0 HB3 SER A 85 22.013 29.997 10.158 1.00 0.00 H new ATOM 0 HG SER A 85 21.546 30.653 12.344 1.00 0.00 H new ATOM 788 N ALA A 86 19.814 27.173 9.064 1.00 0.00 N ATOM 789 CA ALA A 86 20.060 26.023 8.149 1.00 0.00 C ATOM 790 C ALA A 86 19.064 26.074 6.989 1.00 0.00 C ATOM 791 O ALA A 86 19.377 25.712 5.873 1.00 0.00 O ATOM 792 CB ALA A 86 19.881 24.713 8.920 1.00 0.00 C ATOM 0 H ALA A 86 19.305 26.946 9.918 1.00 0.00 H new ATOM 0 HA ALA A 86 21.076 26.078 7.758 1.00 0.00 H new ATOM 0 HB1 ALA A 86 20.061 23.870 8.252 1.00 0.00 H new ATOM 0 HB2 ALA A 86 20.590 24.678 9.747 1.00 0.00 H new ATOM 0 HB3 ALA A 86 18.865 24.656 9.310 1.00 0.00 H new ATOM 798 N ASP A 87 17.865 26.523 7.245 1.00 0.00 N ATOM 799 CA ASP A 87 16.851 26.599 6.156 1.00 0.00 C ATOM 800 C ASP A 87 17.284 27.650 5.131 1.00 0.00 C ATOM 801 O ASP A 87 17.041 27.514 3.948 1.00 0.00 O ATOM 802 CB ASP A 87 15.496 26.992 6.748 1.00 0.00 C ATOM 803 CG ASP A 87 14.426 26.933 5.658 1.00 0.00 C ATOM 804 OD1 ASP A 87 14.743 26.484 4.568 1.00 0.00 O ATOM 805 OD2 ASP A 87 13.308 27.336 5.929 1.00 0.00 O ATOM 0 H ASP A 87 17.545 26.840 8.160 1.00 0.00 H new ATOM 0 HA ASP A 87 16.766 25.628 5.668 1.00 0.00 H new ATOM 0 HB2 ASP A 87 15.235 26.319 7.565 1.00 0.00 H new ATOM 0 HB3 ASP A 87 15.548 27.997 7.167 1.00 0.00 H new ATOM 810 N GLN A 88 17.928 28.695 5.575 1.00 0.00 N ATOM 811 CA GLN A 88 18.377 29.752 4.625 1.00 0.00 C ATOM 812 C GLN A 88 19.622 29.268 3.878 1.00 0.00 C ATOM 813 O GLN A 88 19.792 29.528 2.703 1.00 0.00 O ATOM 814 CB GLN A 88 18.712 31.027 5.402 1.00 0.00 C ATOM 815 CG GLN A 88 19.049 32.149 4.418 1.00 0.00 C ATOM 816 CD GLN A 88 19.402 33.420 5.192 1.00 0.00 C ATOM 817 OE1 GLN A 88 19.276 33.464 6.400 1.00 0.00 O ATOM 818 NE2 GLN A 88 19.842 34.464 4.545 1.00 0.00 N ATOM 0 H GLN A 88 18.162 28.862 6.554 1.00 0.00 H new ATOM 0 HA GLN A 88 17.581 29.961 3.910 1.00 0.00 H new ATOM 0 HB2 GLN A 88 17.867 31.318 6.027 1.00 0.00 H new ATOM 0 HB3 GLN A 88 19.555 30.848 6.069 1.00 0.00 H new ATOM 0 HG2 GLN A 88 19.885 31.852 3.785 1.00 0.00 H new ATOM 0 HG3 GLN A 88 18.201 32.336 3.759 1.00 0.00 H new ATOM 0 HE21 GLN A 88 19.948 34.428 3.531 1.00 0.00 H new ATOM 0 HE22 GLN A 88 20.080 35.316 5.053 1.00 0.00 H new ATOM 827 N ALA A 89 20.492 28.564 4.549 1.00 0.00 N ATOM 828 CA ALA A 89 21.723 28.064 3.875 1.00 0.00 C ATOM 829 C ALA A 89 21.369 26.862 2.998 1.00 0.00 C ATOM 830 O ALA A 89 21.933 26.667 1.940 1.00 0.00 O ATOM 831 CB ALA A 89 22.746 27.640 4.932 1.00 0.00 C ATOM 0 H ALA A 89 20.404 28.314 5.534 1.00 0.00 H new ATOM 0 HA ALA A 89 22.146 28.855 3.256 1.00 0.00 H new ATOM 0 HB1 ALA A 89 23.647 27.274 4.440 1.00 0.00 H new ATOM 0 HB2 ALA A 89 22.997 28.495 5.559 1.00 0.00 H new ATOM 0 HB3 ALA A 89 22.323 26.848 5.551 1.00 0.00 H new ATOM 837 N VAL A 90 20.438 26.056 3.429 1.00 0.00 N ATOM 838 CA VAL A 90 20.049 24.867 2.621 1.00 0.00 C ATOM 839 C VAL A 90 19.284 25.324 1.377 1.00 0.00 C ATOM 840 O VAL A 90 19.461 24.795 0.298 1.00 0.00 O ATOM 841 CB VAL A 90 19.156 23.950 3.460 1.00 0.00 C ATOM 842 CG1 VAL A 90 18.612 22.823 2.580 1.00 0.00 C ATOM 843 CG2 VAL A 90 19.972 23.353 4.608 1.00 0.00 C ATOM 0 H VAL A 90 19.930 26.170 4.306 1.00 0.00 H new ATOM 0 HA VAL A 90 20.945 24.325 2.318 1.00 0.00 H new ATOM 0 HB VAL A 90 18.325 24.526 3.867 1.00 0.00 H new ATOM 0 HG11 VAL A 90 17.976 22.170 3.177 1.00 0.00 H new ATOM 0 HG12 VAL A 90 18.030 23.248 1.763 1.00 0.00 H new ATOM 0 HG13 VAL A 90 19.442 22.247 2.172 1.00 0.00 H new ATOM 0 HG21 VAL A 90 19.336 22.700 5.205 1.00 0.00 H new ATOM 0 HG22 VAL A 90 20.804 22.777 4.202 1.00 0.00 H new ATOM 0 HG23 VAL A 90 20.359 24.156 5.236 1.00 0.00 H new ATOM 853 N ALA A 91 18.435 26.305 1.518 1.00 0.00 N ATOM 854 CA ALA A 91 17.660 26.794 0.343 1.00 0.00 C ATOM 855 C ALA A 91 18.559 27.667 -0.534 1.00 0.00 C ATOM 856 O ALA A 91 18.439 27.682 -1.743 1.00 0.00 O ATOM 857 CB ALA A 91 16.464 27.617 0.826 1.00 0.00 C ATOM 0 H ALA A 91 18.245 26.789 2.396 1.00 0.00 H new ATOM 0 HA ALA A 91 17.304 25.942 -0.236 1.00 0.00 H new ATOM 0 HB1 ALA A 91 15.897 27.975 -0.034 1.00 0.00 H new ATOM 0 HB2 ALA A 91 15.822 26.995 1.450 1.00 0.00 H new ATOM 0 HB3 ALA A 91 16.819 28.469 1.406 1.00 0.00 H new ATOM 863 N GLU A 92 19.459 28.399 0.066 1.00 0.00 N ATOM 864 CA GLU A 92 20.363 29.273 -0.734 1.00 0.00 C ATOM 865 C GLU A 92 21.499 28.435 -1.324 1.00 0.00 C ATOM 866 O GLU A 92 21.825 28.547 -2.488 1.00 0.00 O ATOM 867 CB GLU A 92 20.946 30.362 0.168 1.00 0.00 C ATOM 868 CG GLU A 92 21.233 31.613 -0.663 1.00 0.00 C ATOM 869 CD GLU A 92 22.486 31.385 -1.511 1.00 0.00 C ATOM 870 OE1 GLU A 92 23.184 30.419 -1.253 1.00 0.00 O ATOM 871 OE2 GLU A 92 22.725 32.182 -2.402 1.00 0.00 O ATOM 0 H GLU A 92 19.607 28.429 1.075 1.00 0.00 H new ATOM 0 HA GLU A 92 19.798 29.734 -1.544 1.00 0.00 H new ATOM 0 HB2 GLU A 92 20.247 30.598 0.970 1.00 0.00 H new ATOM 0 HB3 GLU A 92 21.863 30.007 0.639 1.00 0.00 H new ATOM 0 HG2 GLU A 92 20.382 31.839 -1.306 1.00 0.00 H new ATOM 0 HG3 GLU A 92 21.375 32.473 -0.008 1.00 0.00 H new ATOM 878 N LEU A 93 22.106 27.596 -0.529 1.00 0.00 N ATOM 879 CA LEU A 93 23.222 26.754 -1.048 1.00 0.00 C ATOM 880 C LEU A 93 22.664 25.698 -2.005 1.00 0.00 C ATOM 881 O LEU A 93 23.269 25.372 -3.007 1.00 0.00 O ATOM 882 CB LEU A 93 23.928 26.062 0.119 1.00 0.00 C ATOM 883 CG LEU A 93 24.624 27.112 0.988 1.00 0.00 C ATOM 884 CD1 LEU A 93 25.034 26.480 2.320 1.00 0.00 C ATOM 885 CD2 LEU A 93 25.870 27.627 0.264 1.00 0.00 C ATOM 0 H LEU A 93 21.878 27.457 0.455 1.00 0.00 H new ATOM 0 HA LEU A 93 23.934 27.386 -1.579 1.00 0.00 H new ATOM 0 HB2 LEU A 93 23.207 25.502 0.714 1.00 0.00 H new ATOM 0 HB3 LEU A 93 24.657 25.344 -0.257 1.00 0.00 H new ATOM 0 HG LEU A 93 23.942 27.941 1.173 1.00 0.00 H new ATOM 0 HD11 LEU A 93 25.530 27.227 2.940 1.00 0.00 H new ATOM 0 HD12 LEU A 93 24.147 26.111 2.836 1.00 0.00 H new ATOM 0 HD13 LEU A 93 25.717 25.651 2.134 1.00 0.00 H new ATOM 0 HD21 LEU A 93 26.367 28.375 0.882 1.00 0.00 H new ATOM 0 HD22 LEU A 93 26.553 26.797 0.079 1.00 0.00 H new ATOM 0 HD23 LEU A 93 25.579 28.076 -0.686 1.00 0.00 H new ATOM 897 N ASN A 94 21.513 25.160 -1.704 1.00 0.00 N ATOM 898 CA ASN A 94 20.921 24.125 -2.598 1.00 0.00 C ATOM 899 C ASN A 94 20.468 24.779 -3.905 1.00 0.00 C ATOM 900 O ASN A 94 19.878 25.841 -3.908 1.00 0.00 O ATOM 901 CB ASN A 94 19.718 23.481 -1.907 1.00 0.00 C ATOM 902 CG ASN A 94 19.253 22.270 -2.718 1.00 0.00 C ATOM 903 OD1 ASN A 94 19.954 21.806 -3.596 1.00 0.00 O ATOM 904 ND2 ASN A 94 18.089 21.737 -2.461 1.00 0.00 N ATOM 0 H ASN A 94 20.959 25.392 -0.880 1.00 0.00 H new ATOM 0 HA ASN A 94 21.668 23.361 -2.813 1.00 0.00 H new ATOM 0 HB2 ASN A 94 19.987 23.174 -0.896 1.00 0.00 H new ATOM 0 HB3 ASN A 94 18.907 24.204 -1.815 1.00 0.00 H new ATOM 0 HD21 ASN A 94 17.768 20.931 -2.997 1.00 0.00 H new ATOM 0 HD22 ASN A 94 17.501 22.127 -1.724 1.00 0.00 H new ATOM 911 N GLY A 95 20.739 24.152 -5.017 1.00 0.00 N ATOM 912 CA GLY A 95 20.323 24.739 -6.322 1.00 0.00 C ATOM 913 C GLY A 95 21.361 25.768 -6.774 1.00 0.00 C ATOM 914 O GLY A 95 21.058 26.689 -7.504 1.00 0.00 O ATOM 0 H GLY A 95 21.230 23.260 -5.078 1.00 0.00 H new ATOM 0 HA2 GLY A 95 20.224 23.953 -7.071 1.00 0.00 H new ATOM 0 HA3 GLY A 95 19.346 25.211 -6.225 1.00 0.00 H new ATOM 918 N THR A 96 22.584 25.618 -6.344 1.00 0.00 N ATOM 919 CA THR A 96 23.639 26.589 -6.750 1.00 0.00 C ATOM 920 C THR A 96 24.818 25.836 -7.368 1.00 0.00 C ATOM 921 O THR A 96 25.130 24.727 -6.981 1.00 0.00 O ATOM 922 CB THR A 96 24.117 27.367 -5.521 1.00 0.00 C ATOM 923 OG1 THR A 96 24.874 26.505 -4.684 1.00 0.00 O ATOM 924 CG2 THR A 96 22.909 27.899 -4.750 1.00 0.00 C ATOM 0 H THR A 96 22.898 24.866 -5.730 1.00 0.00 H new ATOM 0 HA THR A 96 23.229 27.284 -7.483 1.00 0.00 H new ATOM 0 HB THR A 96 24.738 28.204 -5.839 1.00 0.00 H new ATOM 0 HG1 THR A 96 24.277 25.855 -4.258 1.00 0.00 H new ATOM 0 HG21 THR A 96 23.251 28.453 -3.875 1.00 0.00 H new ATOM 0 HG22 THR A 96 22.329 28.560 -5.394 1.00 0.00 H new ATOM 0 HG23 THR A 96 22.285 27.064 -4.430 1.00 0.00 H new ATOM 932 N GLN A 97 25.475 26.429 -8.327 1.00 0.00 N ATOM 933 CA GLN A 97 26.633 25.747 -8.971 1.00 0.00 C ATOM 934 C GLN A 97 27.903 26.569 -8.736 1.00 0.00 C ATOM 935 O GLN A 97 27.897 27.780 -8.836 1.00 0.00 O ATOM 936 CB GLN A 97 26.378 25.622 -10.474 1.00 0.00 C ATOM 937 CG GLN A 97 27.440 24.714 -11.099 1.00 0.00 C ATOM 938 CD GLN A 97 27.297 24.735 -12.621 1.00 0.00 C ATOM 939 OE1 GLN A 97 26.318 25.229 -13.144 1.00 0.00 O ATOM 940 NE2 GLN A 97 28.240 24.218 -13.361 1.00 0.00 N ATOM 0 H GLN A 97 25.260 27.357 -8.692 1.00 0.00 H new ATOM 0 HA GLN A 97 26.757 24.754 -8.539 1.00 0.00 H new ATOM 0 HB2 GLN A 97 25.384 25.212 -10.652 1.00 0.00 H new ATOM 0 HB3 GLN A 97 26.405 26.606 -10.941 1.00 0.00 H new ATOM 0 HG2 GLN A 97 28.436 25.051 -10.812 1.00 0.00 H new ATOM 0 HG3 GLN A 97 27.328 23.696 -10.727 1.00 0.00 H new ATOM 0 HE21 GLN A 97 29.062 23.803 -12.923 1.00 0.00 H new ATOM 0 HE22 GLN A 97 28.154 24.229 -14.377 1.00 0.00 H new ATOM 949 N VAL A 98 28.992 25.920 -8.426 1.00 0.00 N ATOM 950 CA VAL A 98 30.260 26.666 -8.185 1.00 0.00 C ATOM 951 C VAL A 98 30.901 27.023 -9.528 1.00 0.00 C ATOM 952 O VAL A 98 30.230 27.151 -10.532 1.00 0.00 O ATOM 953 CB VAL A 98 31.224 25.795 -7.372 1.00 0.00 C ATOM 954 CG1 VAL A 98 32.118 26.692 -6.513 1.00 0.00 C ATOM 955 CG2 VAL A 98 30.430 24.852 -6.465 1.00 0.00 C ATOM 0 H VAL A 98 29.059 24.907 -8.329 1.00 0.00 H new ATOM 0 HA VAL A 98 30.044 27.579 -7.629 1.00 0.00 H new ATOM 0 HB VAL A 98 31.839 25.207 -8.053 1.00 0.00 H new ATOM 0 HG11 VAL A 98 32.804 26.074 -5.934 1.00 0.00 H new ATOM 0 HG12 VAL A 98 32.688 27.362 -7.157 1.00 0.00 H new ATOM 0 HG13 VAL A 98 31.499 27.280 -5.835 1.00 0.00 H new ATOM 0 HG21 VAL A 98 31.120 24.235 -5.889 1.00 0.00 H new ATOM 0 HG22 VAL A 98 29.811 25.437 -5.784 1.00 0.00 H new ATOM 0 HG23 VAL A 98 29.793 24.212 -7.075 1.00 0.00 H new ATOM 965 N GLU A 99 32.197 27.184 -9.556 1.00 0.00 N ATOM 966 CA GLU A 99 32.876 27.533 -10.835 1.00 0.00 C ATOM 967 C GLU A 99 32.585 26.453 -11.879 1.00 0.00 C ATOM 968 O GLU A 99 32.388 26.738 -13.044 1.00 0.00 O ATOM 969 CB GLU A 99 34.385 27.623 -10.602 1.00 0.00 C ATOM 970 CG GLU A 99 34.684 28.770 -9.635 1.00 0.00 C ATOM 971 CD GLU A 99 36.198 28.912 -9.464 1.00 0.00 C ATOM 972 OE1 GLU A 99 36.911 28.047 -9.945 1.00 0.00 O ATOM 973 OE2 GLU A 99 36.617 29.881 -8.854 1.00 0.00 O ATOM 0 H GLU A 99 32.813 27.089 -8.749 1.00 0.00 H new ATOM 0 HA GLU A 99 32.505 28.493 -11.193 1.00 0.00 H new ATOM 0 HB2 GLU A 99 34.758 26.683 -10.195 1.00 0.00 H new ATOM 0 HB3 GLU A 99 34.901 27.787 -11.548 1.00 0.00 H new ATOM 0 HG2 GLU A 99 34.262 29.700 -10.015 1.00 0.00 H new ATOM 0 HG3 GLU A 99 34.215 28.578 -8.670 1.00 0.00 H new ATOM 980 N SER A 100 32.553 25.214 -11.472 1.00 0.00 N ATOM 981 CA SER A 100 32.275 24.117 -12.441 1.00 0.00 C ATOM 982 C SER A 100 31.733 22.899 -11.691 1.00 0.00 C ATOM 983 O SER A 100 31.866 21.775 -12.134 1.00 0.00 O ATOM 984 CB SER A 100 33.567 23.736 -13.166 1.00 0.00 C ATOM 985 OG SER A 100 33.522 24.220 -14.501 1.00 0.00 O ATOM 0 H SER A 100 32.707 24.914 -10.510 1.00 0.00 H new ATOM 0 HA SER A 100 31.537 24.454 -13.168 1.00 0.00 H new ATOM 0 HB2 SER A 100 34.427 24.156 -12.644 1.00 0.00 H new ATOM 0 HB3 SER A 100 33.692 22.653 -13.165 1.00 0.00 H new ATOM 0 HG SER A 100 33.166 25.133 -14.506 1.00 0.00 H new ATOM 991 N VAL A 101 31.126 23.111 -10.556 1.00 0.00 N ATOM 992 CA VAL A 101 30.579 21.964 -9.778 1.00 0.00 C ATOM 993 C VAL A 101 29.194 22.326 -9.238 1.00 0.00 C ATOM 994 O VAL A 101 28.788 23.471 -9.260 1.00 0.00 O ATOM 995 CB VAL A 101 31.515 21.649 -8.610 1.00 0.00 C ATOM 996 CG1 VAL A 101 30.990 20.432 -7.846 1.00 0.00 C ATOM 997 CG2 VAL A 101 32.917 21.349 -9.145 1.00 0.00 C ATOM 0 H VAL A 101 30.985 24.029 -10.134 1.00 0.00 H new ATOM 0 HA VAL A 101 30.499 21.091 -10.426 1.00 0.00 H new ATOM 0 HB VAL A 101 31.558 22.507 -7.939 1.00 0.00 H new ATOM 0 HG11 VAL A 101 31.658 20.209 -7.014 1.00 0.00 H new ATOM 0 HG12 VAL A 101 29.992 20.646 -7.463 1.00 0.00 H new ATOM 0 HG13 VAL A 101 30.945 19.573 -8.516 1.00 0.00 H new ATOM 0 HG21 VAL A 101 33.584 21.125 -8.312 1.00 0.00 H new ATOM 0 HG22 VAL A 101 32.874 20.492 -9.817 1.00 0.00 H new ATOM 0 HG23 VAL A 101 33.293 22.217 -9.687 1.00 0.00 H new ATOM 1007 N GLN A 102 28.466 21.359 -8.751 1.00 0.00 N ATOM 1008 CA GLN A 102 27.109 21.645 -8.207 1.00 0.00 C ATOM 1009 C GLN A 102 27.044 21.179 -6.753 1.00 0.00 C ATOM 1010 O GLN A 102 27.676 20.214 -6.373 1.00 0.00 O ATOM 1011 CB GLN A 102 26.059 20.898 -9.032 1.00 0.00 C ATOM 1012 CG GLN A 102 26.101 21.391 -10.479 1.00 0.00 C ATOM 1013 CD GLN A 102 25.087 20.606 -11.314 1.00 0.00 C ATOM 1014 OE1 GLN A 102 24.610 19.570 -10.895 1.00 0.00 O ATOM 1015 NE2 GLN A 102 24.734 21.059 -12.486 1.00 0.00 N ATOM 0 H GLN A 102 28.753 20.381 -8.706 1.00 0.00 H new ATOM 0 HA GLN A 102 26.911 22.716 -8.258 1.00 0.00 H new ATOM 0 HB2 GLN A 102 26.249 19.825 -8.997 1.00 0.00 H new ATOM 0 HB3 GLN A 102 25.067 21.060 -8.610 1.00 0.00 H new ATOM 0 HG2 GLN A 102 25.874 22.456 -10.518 1.00 0.00 H new ATOM 0 HG3 GLN A 102 27.103 21.263 -10.889 1.00 0.00 H new ATOM 0 HE21 GLN A 102 25.134 21.929 -12.838 1.00 0.00 H new ATOM 0 HE22 GLN A 102 24.058 20.543 -13.050 1.00 0.00 H new ATOM 1024 N LEU A 103 26.288 21.856 -5.932 1.00 0.00 N ATOM 1025 CA LEU A 103 26.195 21.444 -4.504 1.00 0.00 C ATOM 1026 C LEU A 103 24.740 21.143 -4.142 1.00 0.00 C ATOM 1027 O LEU A 103 23.837 21.879 -4.487 1.00 0.00 O ATOM 1028 CB LEU A 103 26.718 22.570 -3.613 1.00 0.00 C ATOM 1029 CG LEU A 103 27.815 22.024 -2.697 1.00 0.00 C ATOM 1030 CD1 LEU A 103 29.154 22.661 -3.069 1.00 0.00 C ATOM 1031 CD2 LEU A 103 27.478 22.354 -1.241 1.00 0.00 C ATOM 0 H LEU A 103 25.733 22.673 -6.188 1.00 0.00 H new ATOM 0 HA LEU A 103 26.795 20.547 -4.351 1.00 0.00 H new ATOM 0 HB2 LEU A 103 27.111 23.381 -4.226 1.00 0.00 H new ATOM 0 HB3 LEU A 103 25.905 22.985 -3.018 1.00 0.00 H new ATOM 0 HG LEU A 103 27.882 20.943 -2.816 1.00 0.00 H new ATOM 0 HD11 LEU A 103 29.936 22.272 -2.416 1.00 0.00 H new ATOM 0 HD12 LEU A 103 29.395 22.423 -4.105 1.00 0.00 H new ATOM 0 HD13 LEU A 103 29.088 23.743 -2.951 1.00 0.00 H new ATOM 0 HD21 LEU A 103 28.260 21.965 -0.589 1.00 0.00 H new ATOM 0 HD22 LEU A 103 27.409 23.435 -1.119 1.00 0.00 H new ATOM 0 HD23 LEU A 103 26.524 21.898 -0.976 1.00 0.00 H new ATOM 1043 N LYS A 104 24.508 20.066 -3.441 1.00 0.00 N ATOM 1044 CA LYS A 104 23.115 19.715 -3.047 1.00 0.00 C ATOM 1045 C LYS A 104 23.014 19.710 -1.520 1.00 0.00 C ATOM 1046 O LYS A 104 23.827 19.119 -0.838 1.00 0.00 O ATOM 1047 CB LYS A 104 22.765 18.327 -3.587 1.00 0.00 C ATOM 1048 CG LYS A 104 22.900 18.323 -5.111 1.00 0.00 C ATOM 1049 CD LYS A 104 22.484 16.956 -5.657 1.00 0.00 C ATOM 1050 CE LYS A 104 22.739 16.910 -7.165 1.00 0.00 C ATOM 1051 NZ LYS A 104 23.484 15.665 -7.506 1.00 0.00 N ATOM 0 H LYS A 104 25.225 19.413 -3.124 1.00 0.00 H new ATOM 0 HA LYS A 104 22.421 20.447 -3.459 1.00 0.00 H new ATOM 0 HB2 LYS A 104 23.426 17.578 -3.151 1.00 0.00 H new ATOM 0 HB3 LYS A 104 21.748 18.060 -3.301 1.00 0.00 H new ATOM 0 HG2 LYS A 104 22.276 19.105 -5.544 1.00 0.00 H new ATOM 0 HG3 LYS A 104 23.929 18.542 -5.396 1.00 0.00 H new ATOM 0 HD2 LYS A 104 23.046 16.167 -5.158 1.00 0.00 H new ATOM 0 HD3 LYS A 104 21.429 16.775 -5.450 1.00 0.00 H new ATOM 0 HE2 LYS A 104 21.793 16.940 -7.706 1.00 0.00 H new ATOM 0 HE3 LYS A 104 23.311 17.785 -7.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 23.657 15.634 -8.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 24.393 15.655 -7.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 22.922 14.836 -7.225 1.00 0.00 H new ATOM 1065 N VAL A 105 22.026 20.367 -0.976 1.00 0.00 N ATOM 1066 CA VAL A 105 21.883 20.399 0.508 1.00 0.00 C ATOM 1067 C VAL A 105 20.669 19.569 0.929 1.00 0.00 C ATOM 1068 O VAL A 105 19.594 19.697 0.377 1.00 0.00 O ATOM 1069 CB VAL A 105 21.697 21.845 0.970 1.00 0.00 C ATOM 1070 CG1 VAL A 105 21.754 21.902 2.498 1.00 0.00 C ATOM 1071 CG2 VAL A 105 22.810 22.715 0.385 1.00 0.00 C ATOM 0 H VAL A 105 21.313 20.882 -1.493 1.00 0.00 H new ATOM 0 HA VAL A 105 22.780 19.981 0.965 1.00 0.00 H new ATOM 0 HB VAL A 105 20.730 22.215 0.628 1.00 0.00 H new ATOM 0 HG11 VAL A 105 21.622 22.932 2.829 1.00 0.00 H new ATOM 0 HG12 VAL A 105 20.960 21.282 2.915 1.00 0.00 H new ATOM 0 HG13 VAL A 105 22.721 21.532 2.840 1.00 0.00 H new ATOM 0 HG21 VAL A 105 22.677 23.746 0.714 1.00 0.00 H new ATOM 0 HG22 VAL A 105 23.777 22.347 0.727 1.00 0.00 H new ATOM 0 HG23 VAL A 105 22.770 22.674 -0.703 1.00 0.00 H new ATOM 1081 N ASN A 106 20.832 18.722 1.908 1.00 0.00 N ATOM 1082 CA ASN A 106 19.689 17.885 2.372 1.00 0.00 C ATOM 1083 C ASN A 106 19.618 17.932 3.899 1.00 0.00 C ATOM 1084 O ASN A 106 20.399 18.601 4.546 1.00 0.00 O ATOM 1085 CB ASN A 106 19.894 16.439 1.915 1.00 0.00 C ATOM 1086 CG ASN A 106 19.856 16.375 0.387 1.00 0.00 C ATOM 1087 OD1 ASN A 106 19.393 17.294 -0.260 1.00 0.00 O ATOM 1088 ND2 ASN A 106 20.324 15.319 -0.221 1.00 0.00 N ATOM 0 H ASN A 106 21.709 18.573 2.408 1.00 0.00 H new ATOM 0 HA ASN A 106 18.760 18.268 1.950 1.00 0.00 H new ATOM 0 HB2 ASN A 106 20.849 16.063 2.281 1.00 0.00 H new ATOM 0 HB3 ASN A 106 19.117 15.800 2.336 1.00 0.00 H new ATOM 0 HD21 ASN A 106 20.301 15.265 -1.239 1.00 0.00 H new ATOM 0 HD22 ASN A 106 20.712 14.548 0.322 1.00 0.00 H new ATOM 1095 N ILE A 107 18.689 17.227 4.482 1.00 0.00 N ATOM 1096 CA ILE A 107 18.574 17.233 5.968 1.00 0.00 C ATOM 1097 C ILE A 107 19.051 15.889 6.521 1.00 0.00 C ATOM 1098 O ILE A 107 18.714 14.840 6.010 1.00 0.00 O ATOM 1099 CB ILE A 107 17.114 17.459 6.367 1.00 0.00 C ATOM 1100 CG1 ILE A 107 16.610 18.760 5.745 1.00 0.00 C ATOM 1101 CG2 ILE A 107 17.010 17.547 7.891 1.00 0.00 C ATOM 1102 CD1 ILE A 107 15.149 18.983 6.141 1.00 0.00 C ATOM 0 H ILE A 107 18.005 16.648 3.995 1.00 0.00 H new ATOM 0 HA ILE A 107 19.190 18.034 6.376 1.00 0.00 H new ATOM 0 HB ILE A 107 16.507 16.628 6.009 1.00 0.00 H new ATOM 0 HG12 ILE A 107 17.221 19.597 6.082 1.00 0.00 H new ATOM 0 HG13 ILE A 107 16.701 18.716 4.660 1.00 0.00 H new ATOM 0 HG21 ILE A 107 15.970 17.708 8.176 1.00 0.00 H new ATOM 0 HG22 ILE A 107 17.368 16.618 8.334 1.00 0.00 H new ATOM 0 HG23 ILE A 107 17.617 18.378 8.250 1.00 0.00 H new ATOM 0 HD11 ILE A 107 14.789 19.911 5.697 1.00 0.00 H new ATOM 0 HD12 ILE A 107 14.544 18.151 5.782 1.00 0.00 H new ATOM 0 HD13 ILE A 107 15.072 19.046 7.226 1.00 0.00 H new ATOM 1114 N ALA A 108 19.836 15.913 7.564 1.00 0.00 N ATOM 1115 CA ALA A 108 20.336 14.637 8.151 1.00 0.00 C ATOM 1116 C ALA A 108 19.643 14.385 9.491 1.00 0.00 C ATOM 1117 O ALA A 108 19.047 15.272 10.068 1.00 0.00 O ATOM 1118 CB ALA A 108 21.847 14.735 8.368 1.00 0.00 C ATOM 0 H ALA A 108 20.153 16.761 8.035 1.00 0.00 H new ATOM 0 HA ALA A 108 20.119 13.814 7.470 1.00 0.00 H new ATOM 0 HB1 ALA A 108 22.214 13.803 8.797 1.00 0.00 H new ATOM 0 HB2 ALA A 108 22.341 14.914 7.413 1.00 0.00 H new ATOM 0 HB3 ALA A 108 22.064 15.558 9.049 1.00 0.00 H new ATOM 1124 N ARG A 109 19.717 13.182 9.992 1.00 0.00 N ATOM 1125 CA ARG A 109 19.062 12.878 11.295 1.00 0.00 C ATOM 1126 C ARG A 109 19.414 13.971 12.307 1.00 0.00 C ATOM 1127 O ARG A 109 20.517 14.478 12.327 1.00 0.00 O ATOM 1128 CB ARG A 109 19.557 11.526 11.813 1.00 0.00 C ATOM 1129 CG ARG A 109 18.849 11.194 13.128 1.00 0.00 C ATOM 1130 CD ARG A 109 19.443 9.916 13.719 1.00 0.00 C ATOM 1131 NE ARG A 109 18.640 9.495 14.901 1.00 0.00 N ATOM 1132 CZ ARG A 109 18.701 8.263 15.327 1.00 0.00 C ATOM 1133 NH1 ARG A 109 19.844 7.634 15.339 1.00 0.00 N ATOM 1134 NH2 ARG A 109 17.620 7.660 15.739 1.00 0.00 N ATOM 0 H ARG A 109 20.202 12.398 9.556 1.00 0.00 H new ATOM 0 HA ARG A 109 17.981 12.840 11.159 1.00 0.00 H new ATOM 0 HB2 ARG A 109 19.361 10.748 11.075 1.00 0.00 H new ATOM 0 HB3 ARG A 109 20.636 11.556 11.966 1.00 0.00 H new ATOM 0 HG2 ARG A 109 18.961 12.019 13.832 1.00 0.00 H new ATOM 0 HG3 ARG A 109 17.781 11.065 12.955 1.00 0.00 H new ATOM 0 HD2 ARG A 109 19.449 9.125 12.969 1.00 0.00 H new ATOM 0 HD3 ARG A 109 20.479 10.085 14.012 1.00 0.00 H new ATOM 0 HE ARG A 109 18.042 10.170 15.378 1.00 0.00 H new ATOM 0 HH11 ARG A 109 20.689 8.105 15.016 1.00 0.00 H new ATOM 0 HH12 ARG A 109 19.893 6.671 15.672 1.00 0.00 H new ATOM 0 HH21 ARG A 109 16.726 8.151 15.728 1.00 0.00 H new ATOM 0 HH22 ARG A 109 17.669 6.697 16.072 1.00 0.00 H new ATOM 1148 N LYS A 110 18.485 14.337 13.146 1.00 0.00 N ATOM 1149 CA LYS A 110 18.770 15.398 14.153 1.00 0.00 C ATOM 1150 C LYS A 110 19.942 14.961 15.033 1.00 0.00 C ATOM 1151 O LYS A 110 20.067 13.808 15.394 1.00 0.00 O ATOM 1152 CB LYS A 110 17.531 15.621 15.022 1.00 0.00 C ATOM 1153 CG LYS A 110 16.381 16.124 14.147 1.00 0.00 C ATOM 1154 CD LYS A 110 15.177 16.462 15.027 1.00 0.00 C ATOM 1155 CE LYS A 110 13.993 16.858 14.142 1.00 0.00 C ATOM 1156 NZ LYS A 110 14.285 18.160 13.478 1.00 0.00 N ATOM 0 H LYS A 110 17.542 13.948 13.178 1.00 0.00 H new ATOM 0 HA LYS A 110 19.026 16.327 13.643 1.00 0.00 H new ATOM 0 HB2 LYS A 110 17.247 14.692 15.516 1.00 0.00 H new ATOM 0 HB3 LYS A 110 17.749 16.345 15.807 1.00 0.00 H new ATOM 0 HG2 LYS A 110 16.695 17.006 13.588 1.00 0.00 H new ATOM 0 HG3 LYS A 110 16.108 15.363 13.416 1.00 0.00 H new ATOM 0 HD2 LYS A 110 14.912 15.604 15.644 1.00 0.00 H new ATOM 0 HD3 LYS A 110 15.427 17.278 15.705 1.00 0.00 H new ATOM 0 HE2 LYS A 110 13.811 16.088 13.393 1.00 0.00 H new ATOM 0 HE3 LYS A 110 13.087 16.939 14.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 13.409 18.547 13.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 14.667 18.828 14.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 14.983 18.015 12.721 1.00 0.00 H new ATOM 1170 N GLN A 111 20.806 15.876 15.379 1.00 0.00 N ATOM 1171 CA GLN A 111 21.973 15.515 16.233 1.00 0.00 C ATOM 1172 C GLN A 111 21.489 15.181 17.647 1.00 0.00 C ATOM 1173 O GLN A 111 20.546 15.764 18.144 1.00 0.00 O ATOM 1174 CB GLN A 111 22.946 16.692 16.285 1.00 0.00 C ATOM 1175 CG GLN A 111 22.225 17.929 16.823 1.00 0.00 C ATOM 1176 CD GLN A 111 22.891 19.188 16.270 1.00 0.00 C ATOM 1177 OE1 GLN A 111 22.854 19.435 15.081 1.00 0.00 O ATOM 1178 NE2 GLN A 111 23.501 20.000 17.088 1.00 0.00 N ATOM 0 H GLN A 111 20.754 16.858 15.107 1.00 0.00 H new ATOM 0 HA GLN A 111 22.479 14.646 15.812 1.00 0.00 H new ATOM 0 HB2 GLN A 111 23.795 16.447 16.923 1.00 0.00 H new ATOM 0 HB3 GLN A 111 23.343 16.894 15.290 1.00 0.00 H new ATOM 0 HG2 GLN A 111 21.174 17.904 16.535 1.00 0.00 H new ATOM 0 HG3 GLN A 111 22.257 17.936 17.913 1.00 0.00 H new ATOM 0 HE21 GLN A 111 23.531 19.791 18.086 1.00 0.00 H new ATOM 0 HE22 GLN A 111 23.948 20.844 16.730 1.00 0.00 H new ATOM 1187 N PRO A 112 22.149 14.212 18.299 1.00 0.00 N ATOM 1188 CA PRO A 112 21.790 13.778 19.656 1.00 0.00 C ATOM 1189 C PRO A 112 22.168 14.808 20.727 1.00 0.00 C ATOM 1190 O PRO A 112 21.474 14.972 21.709 1.00 0.00 O ATOM 1191 CB PRO A 112 22.616 12.508 19.856 1.00 0.00 C ATOM 1192 CG PRO A 112 23.781 12.664 18.937 1.00 0.00 C ATOM 1193 CD PRO A 112 23.296 13.462 17.759 1.00 0.00 C ATOM 0 HA PRO A 112 20.714 13.636 19.754 1.00 0.00 H new ATOM 0 HB2 PRO A 112 22.940 12.405 20.892 1.00 0.00 H new ATOM 0 HB3 PRO A 112 22.037 11.617 19.613 1.00 0.00 H new ATOM 0 HG2 PRO A 112 24.604 13.174 19.438 1.00 0.00 H new ATOM 0 HG3 PRO A 112 24.156 11.691 18.618 1.00 0.00 H new ATOM 0 HD2 PRO A 112 24.070 14.130 17.381 1.00 0.00 H new ATOM 0 HD3 PRO A 112 23.000 12.817 16.932 1.00 0.00 H new ATOM 1201 N MET A 113 23.266 15.492 20.552 1.00 0.00 N ATOM 1202 CA MET A 113 23.685 16.499 21.571 1.00 0.00 C ATOM 1203 C MET A 113 22.469 17.309 22.023 1.00 0.00 C ATOM 1204 O MET A 113 22.426 17.817 23.126 1.00 0.00 O ATOM 1205 CB MET A 113 24.725 17.445 20.967 1.00 0.00 C ATOM 1206 CG MET A 113 25.934 16.639 20.486 1.00 0.00 C ATOM 1207 SD MET A 113 26.772 17.542 19.160 1.00 0.00 S ATOM 1208 CE MET A 113 25.342 17.718 18.066 1.00 0.00 C ATOM 0 H MET A 113 23.890 15.398 19.751 1.00 0.00 H new ATOM 0 HA MET A 113 24.118 15.981 22.427 1.00 0.00 H new ATOM 0 HB2 MET A 113 24.289 17.997 20.135 1.00 0.00 H new ATOM 0 HB3 MET A 113 25.037 18.180 21.709 1.00 0.00 H new ATOM 0 HG2 MET A 113 26.622 16.466 21.314 1.00 0.00 H new ATOM 0 HG3 MET A 113 25.613 15.661 20.128 1.00 0.00 H new ATOM 0 HE1 MET A 113 25.681 17.975 17.063 1.00 0.00 H new ATOM 0 HE2 MET A 113 24.791 16.778 18.033 1.00 0.00 H new ATOM 0 HE3 MET A 113 24.691 18.507 18.442 1.00 0.00 H new ATOM 1218 N LEU A 114 21.482 17.434 21.181 1.00 0.00 N ATOM 1219 CA LEU A 114 20.272 18.213 21.563 1.00 0.00 C ATOM 1220 C LEU A 114 19.218 18.089 20.464 1.00 0.00 C ATOM 1221 O LEU A 114 18.423 18.982 20.253 1.00 0.00 O ATOM 1222 CB LEU A 114 20.651 19.683 21.730 1.00 0.00 C ATOM 1223 CG LEU A 114 19.417 20.483 22.155 1.00 0.00 C ATOM 1224 CD1 LEU A 114 19.759 21.335 23.378 1.00 0.00 C ATOM 1225 CD2 LEU A 114 18.980 21.394 21.005 1.00 0.00 C ATOM 0 H LEU A 114 21.461 17.030 20.245 1.00 0.00 H new ATOM 0 HA LEU A 114 19.871 17.826 22.500 1.00 0.00 H new ATOM 0 HB2 LEU A 114 21.438 19.784 22.477 1.00 0.00 H new ATOM 0 HB3 LEU A 114 21.048 20.076 20.794 1.00 0.00 H new ATOM 0 HG LEU A 114 18.607 19.798 22.404 1.00 0.00 H new ATOM 0 HD11 LEU A 114 18.881 21.905 23.681 1.00 0.00 H new ATOM 0 HD12 LEU A 114 20.072 20.687 24.197 1.00 0.00 H new ATOM 0 HD13 LEU A 114 20.569 22.021 23.129 1.00 0.00 H new ATOM 0 HD21 LEU A 114 18.101 21.964 21.306 1.00 0.00 H new ATOM 0 HD22 LEU A 114 19.790 22.080 20.756 1.00 0.00 H new ATOM 0 HD23 LEU A 114 18.737 20.787 20.132 1.00 0.00 H new ATOM 1237 N ASP A 115 19.211 16.997 19.755 1.00 0.00 N ATOM 1238 CA ASP A 115 18.211 16.834 18.665 1.00 0.00 C ATOM 1239 C ASP A 115 18.254 18.073 17.772 1.00 0.00 C ATOM 1240 O ASP A 115 17.251 18.504 17.237 1.00 0.00 O ATOM 1241 CB ASP A 115 16.814 16.684 19.269 1.00 0.00 C ATOM 1242 CG ASP A 115 16.767 15.426 20.138 1.00 0.00 C ATOM 1243 OD1 ASP A 115 17.661 14.606 20.007 1.00 0.00 O ATOM 1244 OD2 ASP A 115 15.839 15.304 20.920 1.00 0.00 O ATOM 0 H ASP A 115 19.851 16.213 19.882 1.00 0.00 H new ATOM 0 HA ASP A 115 18.442 15.945 18.078 1.00 0.00 H new ATOM 0 HB2 ASP A 115 16.569 17.562 19.867 1.00 0.00 H new ATOM 0 HB3 ASP A 115 16.068 16.620 18.477 1.00 0.00 H new ATOM 1249 N ALA A 116 19.413 18.654 17.614 1.00 0.00 N ATOM 1250 CA ALA A 116 19.532 19.869 16.762 1.00 0.00 C ATOM 1251 C ALA A 116 18.980 21.078 17.516 1.00 0.00 C ATOM 1252 O ALA A 116 19.722 21.868 18.066 1.00 0.00 O ATOM 1253 CB ALA A 116 18.737 19.671 15.473 1.00 0.00 C ATOM 0 H ALA A 116 20.284 18.337 18.040 1.00 0.00 H new ATOM 0 HA ALA A 116 20.581 20.038 16.520 1.00 0.00 H new ATOM 0 HB1 ALA A 116 18.825 20.561 14.851 1.00 0.00 H new ATOM 0 HB2 ALA A 116 19.129 18.810 14.932 1.00 0.00 H new ATOM 0 HB3 ALA A 116 17.688 19.500 15.715 1.00 0.00 H new ATOM 1259 N ALA A 117 17.687 21.234 17.542 1.00 0.00 N ATOM 1260 CA ALA A 117 17.100 22.400 18.257 1.00 0.00 C ATOM 1261 C ALA A 117 15.602 22.180 18.462 1.00 0.00 C ATOM 1262 O ALA A 117 14.842 23.118 18.592 1.00 0.00 O ATOM 1263 CB ALA A 117 17.312 23.660 17.422 1.00 0.00 C ATOM 0 H ALA A 117 17.013 20.608 17.101 1.00 0.00 H new ATOM 0 HA ALA A 117 17.585 22.511 19.227 1.00 0.00 H new ATOM 0 HB1 ALA A 117 16.884 24.517 17.942 1.00 0.00 H new ATOM 0 HB2 ALA A 117 18.379 23.822 17.273 1.00 0.00 H new ATOM 0 HB3 ALA A 117 16.824 23.542 16.454 1.00 0.00 H new ATOM 1269 N THR A 118 15.168 20.952 18.487 1.00 0.00 N ATOM 1270 CA THR A 118 13.717 20.690 18.677 1.00 0.00 C ATOM 1271 C THR A 118 13.286 21.172 20.066 1.00 0.00 C ATOM 1272 O THR A 118 12.113 21.255 20.368 1.00 0.00 O ATOM 1273 CB THR A 118 13.447 19.188 18.551 1.00 0.00 C ATOM 1274 OG1 THR A 118 14.104 18.501 19.607 1.00 0.00 O ATOM 1275 CG2 THR A 118 13.970 18.684 17.206 1.00 0.00 C ATOM 0 H THR A 118 15.753 20.122 18.385 1.00 0.00 H new ATOM 0 HA THR A 118 13.150 21.226 17.916 1.00 0.00 H new ATOM 0 HB THR A 118 12.374 19.005 18.610 1.00 0.00 H new ATOM 0 HG1 THR A 118 13.931 17.540 19.529 1.00 0.00 H new ATOM 0 HG21 THR A 118 13.777 17.615 17.118 1.00 0.00 H new ATOM 0 HG22 THR A 118 13.464 19.212 16.398 1.00 0.00 H new ATOM 0 HG23 THR A 118 15.043 18.865 17.142 1.00 0.00 H new ATOM 1283 N GLY A 119 14.227 21.489 20.913 1.00 0.00 N ATOM 1284 CA GLY A 119 13.870 21.964 22.280 1.00 0.00 C ATOM 1285 C GLY A 119 12.959 23.188 22.175 1.00 0.00 C ATOM 1286 O GLY A 119 12.117 23.421 23.019 1.00 0.00 O ATOM 0 H GLY A 119 15.227 21.440 20.718 1.00 0.00 H new ATOM 0 HA2 GLY A 119 13.367 21.170 22.832 1.00 0.00 H new ATOM 0 HA3 GLY A 119 14.773 22.217 22.836 1.00 0.00 H new ATOM 1290 N LYS A 120 13.120 23.975 21.145 1.00 0.00 N ATOM 1291 CA LYS A 120 12.263 25.184 20.989 1.00 0.00 C ATOM 1292 C LYS A 120 10.790 24.785 21.092 1.00 0.00 C ATOM 1293 O LYS A 120 9.969 25.528 21.594 1.00 0.00 O ATOM 1294 CB LYS A 120 12.525 25.820 19.622 1.00 0.00 C ATOM 1295 CG LYS A 120 11.677 27.086 19.478 1.00 0.00 C ATOM 1296 CD LYS A 120 12.308 28.219 20.291 1.00 0.00 C ATOM 1297 CE LYS A 120 11.517 29.509 20.070 1.00 0.00 C ATOM 1298 NZ LYS A 120 10.537 29.688 21.178 1.00 0.00 N ATOM 0 H LYS A 120 13.808 23.832 20.406 1.00 0.00 H new ATOM 0 HA LYS A 120 12.499 25.900 21.776 1.00 0.00 H new ATOM 0 HB2 LYS A 120 13.582 26.064 19.519 1.00 0.00 H new ATOM 0 HB3 LYS A 120 12.282 25.114 18.828 1.00 0.00 H new ATOM 0 HG2 LYS A 120 11.607 27.372 18.429 1.00 0.00 H new ATOM 0 HG3 LYS A 120 10.661 26.897 19.825 1.00 0.00 H new ATOM 0 HD2 LYS A 120 12.314 27.961 21.350 1.00 0.00 H new ATOM 0 HD3 LYS A 120 13.346 28.361 19.991 1.00 0.00 H new ATOM 0 HE2 LYS A 120 12.195 30.361 20.029 1.00 0.00 H new ATOM 0 HE3 LYS A 120 10.997 29.469 19.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 9.999 30.565 21.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 9.883 28.880 21.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 11.044 29.744 22.084 1.00 0.00 H new ATOM 1312 N SER A 121 10.445 23.618 20.619 1.00 0.00 N ATOM 1313 CA SER A 121 9.025 23.175 20.690 1.00 0.00 C ATOM 1314 C SER A 121 8.916 21.950 21.600 1.00 0.00 C ATOM 1315 O SER A 121 9.949 21.400 21.947 1.00 0.00 O ATOM 1316 CB SER A 121 8.532 22.813 19.287 1.00 0.00 C ATOM 1317 OG SER A 121 8.421 23.993 18.506 1.00 0.00 O ATOM 1318 OXT SER A 121 7.802 21.582 21.936 1.00 0.00 O ATOM 0 H SER A 121 11.086 22.953 20.187 1.00 0.00 H new ATOM 0 HA SER A 121 8.414 23.982 21.093 1.00 0.00 H new ATOM 0 HB2 SER A 121 9.224 22.116 18.815 1.00 0.00 H new ATOM 0 HB3 SER A 121 7.566 22.312 19.347 1.00 0.00 H new ATOM 0 HG SER A 121 8.107 23.762 17.607 1.00 0.00 H new TER 1324 SER A 121