USER MOD reduce.3.24.130724 H: found=0, std=0, add=735, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 738 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 215 THR OG1 : rot 180:sc= 0.378 USER MOD Set 1.2: A 218 GLN : amide:sc= -0.285 K(o=0.093,f=0.75) USER MOD Set 2.1: A 159 GLN : amide:sc= -1.23 K(o=-5.4,f=-9.5!) USER MOD Set 2.2: A 161 TYR OH : rot 180:sc= 0.0906 USER MOD Set 2.3: A 186 HIS : no HE2:sc= -4.3! C(o=-5.4!,f=-8.7!) USER MOD Set 3.1: A 170 ASN : amide:sc= -2.55! C(o=-5.7!,f=-9.7!) USER MOD Set 3.2: A 172 ASN : amide:sc= -3.16! K(o=-5.7!,f=-3.7) USER MOD Set 4.1: A 128 MET CE :methyl -152:sc= -2.02! (180deg=-3.78!) USER MOD Set 4.2: A 133 MET CE :methyl -111:sc= -6.05 (180deg=-12.6!) USER MOD Set 4.3: A 134 SER OG : rot -123:sc= 0.0322 USER MOD Set 4.4: A 162 TYR OH : rot 176:sc= 0.679 USER MOD Set 4.5: A 212 MET CE :methyl 137:sc= -8.94! (180deg=-8.44!) USER MOD Set 4.6: A 216 GLN : amide:sc= -8.78! C(o=-26!,f=-34!) USER MOD Set 4.7: A 219 GLN : amide:sc= -0.99 K(o=-26,f=-31!) USER MOD Single : A 127 TYR OH : rot -113:sc= 0.889 USER MOD Single : A 131 SER OG : rot 180:sc= 0.0232 USER MOD Single : A 139 HIS : no HE2:sc= -1.29 K(o=-1.3,f=-3.1) USER MOD Single : A 142 ASN : amide:sc= -2! C(o=-2!,f=-3.7!) USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot -140:sc= 1.26 USER MOD Single : A 149 TYR OH : rot 76:sc= -2.55! USER MOD Single : A 152 ASN : amide:sc= -13! C(o=-13!,f=-13!) USER MOD Single : A 153 MET CE :methyl -127:sc= -11! (180deg=-11.6!) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 156 TYR OH : rot -102:sc= 0.112 USER MOD Single : A 158 ASN : amide:sc= -3.7! C(o=-3.7!,f=-8.7!) USER MOD Single : A 171 GLN : amide:sc= -4.15! K(o=-4.1!,f=-1.9) USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 176 HIS : no HD1:sc=-0.00791 X(o=-0.0079,f=-0.0079) USER MOD Single : A 180 ASN : amide:sc= -0.637 K(o=-0.64,f=-2.4!) USER MOD Single : A 182 THR OG1 : rot -90:sc= -5.14! USER MOD Single : A 184 LYS NZ :NH3+ 157:sc=-0.00718 (180deg=-0.239) USER MOD Single : A 185 GLN : amide:sc= -0.496 K(o=-0.5,f=1.2) USER MOD Single : A 187 THR OG1 : rot 104:sc= 0.611 USER MOD Single : A 189 THR OG1 : rot 180:sc= 0 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 196 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 198 THR OG1 : rot 180:sc= 0 USER MOD Single : A 200 THR OG1 : rot 180:sc= 0 USER MOD Single : A 203 LYS NZ :NH3+ 139:sc= -1.49 (180deg=-3.86!) USER MOD Single : A 205 MET CE :methyl -148:sc= -8.51! (180deg=-14.9!) USER MOD Single : A 211 GLN : amide:sc=-0.00794 K(o=-0.0079,f=-1) USER MOD Single : A 217 TYR OH : rot 180:sc= 0 USER MOD Single : A 221 SER OG : rot -14:sc= 0.288 USER MOD Single : A 222 GLN : amide:sc= -2.7! K(o=-2.7!,f=-1.8) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 GLN : amide:sc= 0 X(o=0,f=0.045) USER MOD ----------------------------------------------------------------- ATOM 34 N TYR A 127 10.474 -9.525 1.708 1.00 0.57 N ATOM 35 CA TYR A 127 9.808 -8.266 1.442 1.00 0.44 C ATOM 36 C TYR A 127 9.396 -7.635 2.747 1.00 0.40 C ATOM 37 O TYR A 127 8.350 -7.963 3.317 1.00 0.60 O ATOM 38 CB TYR A 127 8.577 -8.433 0.545 1.00 0.46 C ATOM 39 CG TYR A 127 8.874 -8.535 -0.932 1.00 0.65 C ATOM 40 CD1 TYR A 127 9.579 -7.539 -1.592 1.00 1.10 C ATOM 41 CD2 TYR A 127 8.456 -9.639 -1.661 1.00 1.09 C ATOM 42 CE1 TYR A 127 9.864 -7.646 -2.938 1.00 1.26 C ATOM 43 CE2 TYR A 127 8.732 -9.750 -3.006 1.00 1.30 C ATOM 44 CZ TYR A 127 9.402 -8.693 -3.649 1.00 1.17 C ATOM 45 OH TYR A 127 9.727 -8.869 -4.974 1.00 1.41 O ATOM 0 HA TYR A 127 10.514 -7.627 0.911 1.00 0.44 H new ATOM 0 HB2 TYR A 127 8.039 -9.329 0.855 1.00 0.46 H new ATOM 0 HB3 TYR A 127 7.909 -7.587 0.709 1.00 0.46 H new ATOM 0 HD1 TYR A 127 9.909 -6.668 -1.045 1.00 1.10 H new ATOM 0 HD2 TYR A 127 7.905 -10.425 -1.166 1.00 1.09 H new ATOM 0 HE1 TYR A 127 10.460 -6.887 -3.423 1.00 1.26 H new ATOM 0 HE2 TYR A 127 8.440 -10.632 -3.557 1.00 1.30 H new ATOM 0 HH TYR A 127 8.925 -8.757 -5.525 1.00 1.41 H new ATOM 55 N MET A 128 10.285 -6.791 3.214 1.00 0.42 N ATOM 56 CA MET A 128 10.100 -5.935 4.366 1.00 0.37 C ATOM 57 C MET A 128 8.687 -5.384 4.460 1.00 0.31 C ATOM 58 O MET A 128 8.172 -4.763 3.528 1.00 0.30 O ATOM 59 CB MET A 128 11.133 -4.828 4.241 1.00 0.45 C ATOM 60 CG MET A 128 11.626 -4.293 5.550 1.00 0.90 C ATOM 61 SD MET A 128 10.556 -3.010 6.200 1.00 1.18 S ATOM 62 CE MET A 128 10.244 -2.095 4.689 1.00 0.45 C ATOM 0 H MET A 128 11.202 -6.676 2.782 1.00 0.42 H new ATOM 0 HA MET A 128 10.238 -6.499 5.288 1.00 0.37 H new ATOM 0 HB2 MET A 128 11.984 -5.204 3.672 1.00 0.45 H new ATOM 0 HB3 MET A 128 10.702 -4.008 3.666 1.00 0.45 H new ATOM 0 HG2 MET A 128 11.694 -5.107 6.271 1.00 0.90 H new ATOM 0 HG3 MET A 128 12.633 -3.895 5.422 1.00 0.90 H new ATOM 0 HE1 MET A 128 10.043 -1.051 4.931 1.00 0.45 H new ATOM 0 HE2 MET A 128 11.118 -2.156 4.040 1.00 0.45 H new ATOM 0 HE3 MET A 128 9.381 -2.521 4.177 1.00 0.45 H new ATOM 72 N LEU A 129 8.040 -5.660 5.582 1.00 0.32 N ATOM 73 CA LEU A 129 6.732 -5.105 5.836 1.00 0.28 C ATOM 74 C LEU A 129 6.843 -3.601 5.816 1.00 0.26 C ATOM 75 O LEU A 129 7.590 -3.029 6.606 1.00 0.30 O ATOM 76 CB LEU A 129 6.179 -5.570 7.192 1.00 0.33 C ATOM 77 CG LEU A 129 4.758 -5.109 7.527 1.00 0.35 C ATOM 78 CD1 LEU A 129 4.020 -6.205 8.275 1.00 0.87 C ATOM 79 CD2 LEU A 129 4.790 -3.844 8.370 1.00 0.80 C ATOM 0 H LEU A 129 8.401 -6.261 6.323 1.00 0.32 H new ATOM 0 HA LEU A 129 6.043 -5.450 5.065 1.00 0.28 H new ATOM 0 HB2 LEU A 129 6.203 -6.659 7.218 1.00 0.33 H new ATOM 0 HB3 LEU A 129 6.849 -5.218 7.976 1.00 0.33 H new ATOM 0 HG LEU A 129 4.236 -4.894 6.594 1.00 0.35 H new ATOM 0 HD11 LEU A 129 3.010 -5.869 8.510 1.00 0.87 H new ATOM 0 HD12 LEU A 129 3.970 -7.099 7.654 1.00 0.87 H new ATOM 0 HD13 LEU A 129 4.550 -6.435 9.199 1.00 0.87 H new ATOM 0 HD21 LEU A 129 3.771 -3.532 8.597 1.00 0.80 H new ATOM 0 HD22 LEU A 129 5.326 -4.039 9.299 1.00 0.80 H new ATOM 0 HD23 LEU A 129 5.297 -3.052 7.819 1.00 0.80 H new ATOM 91 N GLY A 130 6.134 -2.981 4.889 1.00 0.23 N ATOM 92 CA GLY A 130 6.041 -1.548 4.834 1.00 0.25 C ATOM 93 C GLY A 130 5.403 -1.015 6.076 1.00 0.21 C ATOM 94 O GLY A 130 4.210 -0.728 6.072 1.00 0.20 O ATOM 0 H GLY A 130 5.611 -3.463 4.158 1.00 0.23 H new ATOM 0 HA2 GLY A 130 7.036 -1.118 4.716 1.00 0.25 H new ATOM 0 HA3 GLY A 130 5.459 -1.249 3.962 1.00 0.25 H new ATOM 98 N SER A 131 6.222 -1.019 7.129 1.00 0.26 N ATOM 99 CA SER A 131 5.911 -0.551 8.487 1.00 0.31 C ATOM 100 C SER A 131 4.712 0.383 8.560 1.00 0.23 C ATOM 101 O SER A 131 4.862 1.599 8.701 1.00 0.29 O ATOM 102 CB SER A 131 7.144 0.133 9.079 1.00 0.53 C ATOM 103 OG SER A 131 8.300 -0.681 8.929 1.00 1.41 O ATOM 0 H SER A 131 7.177 -1.369 7.056 1.00 0.26 H new ATOM 0 HA SER A 131 5.638 -1.432 9.067 1.00 0.31 H new ATOM 0 HB2 SER A 131 7.304 1.092 8.586 1.00 0.53 H new ATOM 0 HB3 SER A 131 6.976 0.342 10.136 1.00 0.53 H new ATOM 0 HG SER A 131 9.076 -0.222 9.313 1.00 1.41 H new ATOM 109 N ALA A 132 3.528 -0.211 8.456 1.00 0.23 N ATOM 110 CA ALA A 132 2.260 0.513 8.515 1.00 0.24 C ATOM 111 C ALA A 132 2.221 1.721 7.574 1.00 0.21 C ATOM 112 O ALA A 132 1.424 2.641 7.770 1.00 0.31 O ATOM 113 CB ALA A 132 1.967 0.919 9.944 1.00 0.33 C ATOM 0 H ALA A 132 3.419 -1.217 8.327 1.00 0.23 H new ATOM 0 HA ALA A 132 1.479 -0.163 8.167 1.00 0.24 H new ATOM 0 HB1 ALA A 132 1.021 1.458 9.982 1.00 0.33 H new ATOM 0 HB2 ALA A 132 1.903 0.029 10.569 1.00 0.33 H new ATOM 0 HB3 ALA A 132 2.767 1.563 10.311 1.00 0.33 H new ATOM 119 N MET A 133 3.047 1.668 6.529 1.00 0.16 N ATOM 120 CA MET A 133 3.077 2.692 5.485 1.00 0.21 C ATOM 121 C MET A 133 3.136 4.100 6.068 1.00 0.29 C ATOM 122 O MET A 133 3.568 4.316 7.199 1.00 0.55 O ATOM 123 CB MET A 133 1.833 2.559 4.593 1.00 0.20 C ATOM 124 CG MET A 133 1.847 1.330 3.698 1.00 0.26 C ATOM 125 SD MET A 133 0.266 1.010 2.885 1.00 0.41 S ATOM 126 CE MET A 133 -0.155 2.607 2.192 1.00 0.22 C ATOM 0 H MET A 133 3.716 0.912 6.382 1.00 0.16 H new ATOM 0 HA MET A 133 3.981 2.536 4.896 1.00 0.21 H new ATOM 0 HB2 MET A 133 0.946 2.526 5.226 1.00 0.20 H new ATOM 0 HB3 MET A 133 1.747 3.449 3.970 1.00 0.20 H new ATOM 0 HG2 MET A 133 2.619 1.453 2.938 1.00 0.26 H new ATOM 0 HG3 MET A 133 2.122 0.460 4.294 1.00 0.26 H new ATOM 0 HE1 MET A 133 -1.014 3.019 2.722 1.00 0.22 H new ATOM 0 HE2 MET A 133 0.694 3.283 2.295 1.00 0.22 H new ATOM 0 HE3 MET A 133 -0.402 2.492 1.137 1.00 0.22 H new ATOM 136 N SER A 134 2.732 5.057 5.261 1.00 0.47 N ATOM 137 CA SER A 134 2.508 6.411 5.719 1.00 0.56 C ATOM 138 C SER A 134 1.016 6.708 5.655 1.00 0.61 C ATOM 139 O SER A 134 0.598 7.862 5.716 1.00 0.74 O ATOM 140 CB SER A 134 3.300 7.385 4.850 1.00 0.65 C ATOM 141 OG SER A 134 3.304 6.958 3.493 1.00 1.52 O ATOM 0 H SER A 134 2.549 4.918 4.267 1.00 0.47 H new ATOM 0 HA SER A 134 2.848 6.525 6.748 1.00 0.56 H new ATOM 0 HB2 SER A 134 2.864 8.381 4.922 1.00 0.65 H new ATOM 0 HB3 SER A 134 4.324 7.458 5.217 1.00 0.65 H new ATOM 0 HG SER A 134 4.229 6.857 3.184 1.00 1.52 H new ATOM 147 N ARG A 135 0.230 5.618 5.554 1.00 0.61 N ATOM 148 CA ARG A 135 -1.227 5.666 5.341 1.00 0.76 C ATOM 149 C ARG A 135 -1.649 6.841 4.447 1.00 0.75 C ATOM 150 O ARG A 135 -2.549 7.581 4.794 1.00 1.14 O ATOM 151 CB ARG A 135 -1.993 5.662 6.686 1.00 1.01 C ATOM 152 CG ARG A 135 -1.529 6.678 7.730 1.00 0.98 C ATOM 153 CD ARG A 135 -1.897 8.087 7.317 1.00 1.57 C ATOM 154 NE ARG A 135 -1.688 9.080 8.365 1.00 2.57 N ATOM 155 CZ ARG A 135 -1.366 10.349 8.119 1.00 3.27 C ATOM 156 NH1 ARG A 135 -1.127 10.747 6.877 1.00 3.37 N ATOM 157 NH2 ARG A 135 -1.281 11.223 9.113 1.00 4.17 N ATOM 0 H ARG A 135 0.596 4.668 5.619 1.00 0.61 H new ATOM 0 HA ARG A 135 -1.500 4.757 4.804 1.00 0.76 H new ATOM 0 HB2 ARG A 135 -3.048 5.840 6.480 1.00 1.01 H new ATOM 0 HB3 ARG A 135 -1.917 4.665 7.121 1.00 1.01 H new ATOM 0 HG2 ARG A 135 -1.983 6.447 8.694 1.00 0.98 H new ATOM 0 HG3 ARG A 135 -0.449 6.604 7.860 1.00 0.98 H new ATOM 0 HD2 ARG A 135 -1.308 8.365 6.443 1.00 1.57 H new ATOM 0 HD3 ARG A 135 -2.944 8.106 7.015 1.00 1.57 H new ATOM 0 HE ARG A 135 -1.794 8.788 9.336 1.00 2.57 H new ATOM 0 HH11 ARG A 135 -1.190 10.081 6.107 1.00 3.37 H new ATOM 0 HH12 ARG A 135 -0.881 11.719 6.692 1.00 3.37 H new ATOM 0 HH21 ARG A 135 -1.463 10.925 10.071 1.00 4.17 H new ATOM 0 HH22 ARG A 135 -1.034 12.193 8.919 1.00 4.17 H new ATOM 171 N PRO A 136 -1.053 6.965 3.242 1.00 0.54 N ATOM 172 CA PRO A 136 -1.183 8.135 2.354 1.00 0.50 C ATOM 173 C PRO A 136 -2.539 8.826 2.426 1.00 0.51 C ATOM 174 O PRO A 136 -2.609 10.047 2.560 1.00 0.57 O ATOM 175 CB PRO A 136 -0.982 7.534 0.957 1.00 0.55 C ATOM 176 CG PRO A 136 -0.768 6.073 1.181 1.00 0.62 C ATOM 177 CD PRO A 136 -0.255 5.949 2.578 1.00 0.59 C ATOM 0 HA PRO A 136 -0.471 8.912 2.631 1.00 0.50 H new ATOM 0 HB2 PRO A 136 -1.852 7.711 0.324 1.00 0.55 H new ATOM 0 HB3 PRO A 136 -0.126 7.984 0.455 1.00 0.55 H new ATOM 0 HG2 PRO A 136 -1.697 5.517 1.054 1.00 0.62 H new ATOM 0 HG3 PRO A 136 -0.054 5.668 0.464 1.00 0.62 H new ATOM 0 HD2 PRO A 136 -0.420 4.955 2.994 1.00 0.59 H new ATOM 0 HD3 PRO A 136 0.814 6.150 2.647 1.00 0.59 H new ATOM 185 N LEU A 137 -3.605 8.026 2.355 1.00 0.50 N ATOM 186 CA LEU A 137 -4.964 8.544 2.374 1.00 0.54 C ATOM 187 C LEU A 137 -5.154 9.526 1.245 1.00 0.58 C ATOM 188 O LEU A 137 -5.135 10.742 1.425 1.00 0.99 O ATOM 189 CB LEU A 137 -5.290 9.167 3.727 1.00 0.59 C ATOM 190 CG LEU A 137 -5.368 8.158 4.866 1.00 0.64 C ATOM 191 CD1 LEU A 137 -5.410 8.865 6.201 1.00 0.97 C ATOM 192 CD2 LEU A 137 -6.572 7.248 4.694 1.00 0.90 C ATOM 0 H LEU A 137 -3.546 7.010 2.283 1.00 0.50 H new ATOM 0 HA LEU A 137 -5.661 7.719 2.227 1.00 0.54 H new ATOM 0 HB2 LEU A 137 -4.531 9.912 3.966 1.00 0.59 H new ATOM 0 HB3 LEU A 137 -6.242 9.693 3.654 1.00 0.59 H new ATOM 0 HG LEU A 137 -4.471 7.539 4.840 1.00 0.64 H new ATOM 0 HD11 LEU A 137 -5.466 8.128 7.002 1.00 0.97 H new ATOM 0 HD12 LEU A 137 -4.509 9.466 6.323 1.00 0.97 H new ATOM 0 HD13 LEU A 137 -6.286 9.512 6.243 1.00 0.97 H new ATOM 0 HD21 LEU A 137 -6.610 6.535 5.517 1.00 0.90 H new ATOM 0 HD22 LEU A 137 -7.483 7.847 4.690 1.00 0.90 H new ATOM 0 HD23 LEU A 137 -6.489 6.709 3.750 1.00 0.90 H new ATOM 204 N ILE A 138 -5.292 8.952 0.071 1.00 0.55 N ATOM 205 CA ILE A 138 -5.384 9.679 -1.188 1.00 0.64 C ATOM 206 C ILE A 138 -6.512 10.716 -1.206 1.00 0.61 C ATOM 207 O ILE A 138 -6.528 11.582 -2.077 1.00 1.10 O ATOM 208 CB ILE A 138 -5.600 8.679 -2.342 1.00 0.91 C ATOM 209 CG1 ILE A 138 -4.667 7.482 -2.173 1.00 1.07 C ATOM 210 CG2 ILE A 138 -5.349 9.343 -3.682 1.00 1.17 C ATOM 211 CD1 ILE A 138 -3.207 7.860 -2.216 1.00 0.63 C ATOM 0 H ILE A 138 -5.345 7.940 -0.044 1.00 0.55 H new ATOM 0 HA ILE A 138 -4.446 10.222 -1.308 1.00 0.64 H new ATOM 0 HB ILE A 138 -6.635 8.338 -2.314 1.00 0.91 H new ATOM 0 HG12 ILE A 138 -4.882 6.993 -1.223 1.00 1.07 H new ATOM 0 HG13 ILE A 138 -4.872 6.755 -2.959 1.00 1.07 H new ATOM 0 HG21 ILE A 138 -5.507 8.620 -4.482 1.00 1.17 H new ATOM 0 HG22 ILE A 138 -6.037 10.179 -3.808 1.00 1.17 H new ATOM 0 HG23 ILE A 138 -4.323 9.708 -3.721 1.00 1.17 H new ATOM 0 HD11 ILE A 138 -2.596 6.966 -2.090 1.00 0.63 H new ATOM 0 HD12 ILE A 138 -2.979 8.323 -3.176 1.00 0.63 H new ATOM 0 HD13 ILE A 138 -2.990 8.564 -1.413 1.00 0.63 H new ATOM 223 N HIS A 139 -7.438 10.621 -0.239 1.00 0.40 N ATOM 224 CA HIS A 139 -8.661 11.451 -0.144 1.00 0.41 C ATOM 225 C HIS A 139 -9.556 11.364 -1.379 1.00 0.46 C ATOM 226 O HIS A 139 -10.760 11.565 -1.271 1.00 0.82 O ATOM 227 CB HIS A 139 -8.416 12.926 0.289 1.00 0.53 C ATOM 228 CG HIS A 139 -7.093 13.528 -0.075 1.00 0.65 C ATOM 229 ND1 HIS A 139 -5.943 13.284 0.640 1.00 0.86 N ATOM 230 CD2 HIS A 139 -6.733 14.357 -1.086 1.00 1.13 C ATOM 231 CE1 HIS A 139 -4.936 13.926 0.089 1.00 1.07 C ATOM 232 NE2 HIS A 139 -5.385 14.587 -0.959 1.00 1.28 N ATOM 0 H HIS A 139 -7.359 9.947 0.523 1.00 0.40 H new ATOM 0 HA HIS A 139 -9.211 10.994 0.679 1.00 0.41 H new ATOM 0 HB2 HIS A 139 -9.201 13.543 -0.148 1.00 0.53 H new ATOM 0 HB3 HIS A 139 -8.529 12.985 1.371 1.00 0.53 H new ATOM 0 HD1 HIS A 139 -5.881 12.695 1.471 1.00 0.86 H new ATOM 0 HD2 HIS A 139 -7.384 14.760 -1.848 1.00 1.13 H new ATOM 0 HE1 HIS A 139 -3.914 13.914 0.437 1.00 1.07 H new ATOM 241 N PHE A 140 -8.973 11.089 -2.540 1.00 0.45 N ATOM 242 CA PHE A 140 -9.716 10.721 -3.744 1.00 0.41 C ATOM 243 C PHE A 140 -10.463 11.905 -4.355 1.00 0.46 C ATOM 244 O PHE A 140 -10.868 11.865 -5.518 1.00 0.64 O ATOM 245 CB PHE A 140 -10.693 9.584 -3.412 1.00 0.38 C ATOM 246 CG PHE A 140 -11.476 9.089 -4.592 1.00 0.70 C ATOM 247 CD1 PHE A 140 -10.877 8.256 -5.520 1.00 0.74 C ATOM 248 CD2 PHE A 140 -12.798 9.452 -4.774 1.00 1.23 C ATOM 249 CE1 PHE A 140 -11.584 7.790 -6.611 1.00 1.19 C ATOM 250 CE2 PHE A 140 -13.511 8.990 -5.864 1.00 1.74 C ATOM 251 CZ PHE A 140 -12.903 8.158 -6.783 1.00 1.70 C ATOM 0 H PHE A 140 -7.962 11.115 -2.675 1.00 0.45 H new ATOM 0 HA PHE A 140 -8.996 10.387 -4.491 1.00 0.41 H new ATOM 0 HB2 PHE A 140 -10.134 8.752 -2.985 1.00 0.38 H new ATOM 0 HB3 PHE A 140 -11.388 9.928 -2.646 1.00 0.38 H new ATOM 0 HD1 PHE A 140 -9.845 7.967 -5.390 1.00 0.74 H new ATOM 0 HD2 PHE A 140 -13.278 10.103 -4.058 1.00 1.23 H new ATOM 0 HE1 PHE A 140 -11.106 7.139 -7.328 1.00 1.19 H new ATOM 0 HE2 PHE A 140 -14.543 9.280 -5.997 1.00 1.74 H new ATOM 0 HZ PHE A 140 -13.459 7.796 -7.635 1.00 1.70 H new ATOM 261 N GLY A 141 -10.605 12.962 -3.586 1.00 0.47 N ATOM 262 CA GLY A 141 -11.502 14.025 -3.958 1.00 0.53 C ATOM 263 C GLY A 141 -12.845 13.827 -3.297 1.00 0.48 C ATOM 264 O GLY A 141 -13.770 14.611 -3.497 1.00 0.54 O ATOM 0 H GLY A 141 -10.112 13.105 -2.704 1.00 0.47 H new ATOM 0 HA2 GLY A 141 -11.081 14.986 -3.663 1.00 0.53 H new ATOM 0 HA3 GLY A 141 -11.621 14.048 -5.041 1.00 0.53 H new ATOM 268 N ASN A 142 -12.946 12.761 -2.504 1.00 0.41 N ATOM 269 CA ASN A 142 -14.153 12.468 -1.763 1.00 0.45 C ATOM 270 C ASN A 142 -13.770 12.010 -0.379 1.00 0.47 C ATOM 271 O ASN A 142 -13.245 10.925 -0.227 1.00 0.46 O ATOM 272 CB ASN A 142 -14.953 11.352 -2.436 1.00 0.48 C ATOM 273 CG ASN A 142 -16.403 11.341 -1.999 1.00 1.22 C ATOM 274 OD1 ASN A 142 -16.929 12.345 -1.520 1.00 1.71 O ATOM 275 ND2 ASN A 142 -17.065 10.212 -2.175 1.00 1.88 N ATOM 0 H ASN A 142 -12.194 12.086 -2.364 1.00 0.41 H new ATOM 0 HA ASN A 142 -14.766 13.369 -1.726 1.00 0.45 H new ATOM 0 HB2 ASN A 142 -14.903 11.474 -3.518 1.00 0.48 H new ATOM 0 HB3 ASN A 142 -14.498 10.390 -2.202 1.00 0.48 H new ATOM 0 HD21 ASN A 142 -18.048 10.151 -1.911 1.00 1.88 H new ATOM 0 HD22 ASN A 142 -16.593 9.401 -2.575 1.00 1.88 H new ATOM 282 N ASP A 143 -13.995 12.841 0.617 1.00 0.54 N ATOM 283 CA ASP A 143 -13.738 12.469 2.002 1.00 0.57 C ATOM 284 C ASP A 143 -14.528 11.236 2.397 1.00 0.52 C ATOM 285 O ASP A 143 -14.199 10.580 3.376 1.00 0.52 O ATOM 286 CB ASP A 143 -14.073 13.610 2.950 1.00 0.72 C ATOM 287 CG ASP A 143 -15.564 13.846 3.092 1.00 1.04 C ATOM 288 OD1 ASP A 143 -16.167 14.428 2.166 1.00 1.14 O ATOM 289 OD2 ASP A 143 -16.137 13.455 4.126 1.00 1.39 O ATOM 0 H ASP A 143 -14.358 13.787 0.497 1.00 0.54 H new ATOM 0 HA ASP A 143 -12.674 12.246 2.080 1.00 0.57 H new ATOM 0 HB2 ASP A 143 -13.650 13.395 3.931 1.00 0.72 H new ATOM 0 HB3 ASP A 143 -13.599 14.524 2.591 1.00 0.72 H new ATOM 294 N TYR A 144 -15.570 10.934 1.642 1.00 0.53 N ATOM 295 CA TYR A 144 -16.297 9.691 1.817 1.00 0.55 C ATOM 296 C TYR A 144 -15.373 8.529 1.460 1.00 0.45 C ATOM 297 O TYR A 144 -15.346 7.505 2.136 1.00 0.47 O ATOM 298 CB TYR A 144 -17.548 9.697 0.938 1.00 0.63 C ATOM 299 CG TYR A 144 -18.509 8.557 1.205 1.00 0.82 C ATOM 300 CD1 TYR A 144 -19.501 8.668 2.173 1.00 1.15 C ATOM 301 CD2 TYR A 144 -18.417 7.368 0.495 1.00 0.90 C ATOM 302 CE1 TYR A 144 -20.375 7.627 2.423 1.00 1.41 C ATOM 303 CE2 TYR A 144 -19.287 6.322 0.741 1.00 1.19 C ATOM 304 CZ TYR A 144 -20.286 6.470 1.687 1.00 1.40 C ATOM 305 OH TYR A 144 -21.146 5.419 1.942 1.00 1.70 O ATOM 0 H TYR A 144 -15.931 11.534 0.901 1.00 0.53 H new ATOM 0 HA TYR A 144 -16.618 9.580 2.853 1.00 0.55 H new ATOM 0 HB2 TYR A 144 -18.074 10.640 1.083 1.00 0.63 H new ATOM 0 HB3 TYR A 144 -17.242 9.660 -0.108 1.00 0.63 H new ATOM 0 HD1 TYR A 144 -19.590 9.583 2.739 1.00 1.15 H new ATOM 0 HD2 TYR A 144 -17.654 7.258 -0.261 1.00 0.90 H new ATOM 0 HE1 TYR A 144 -21.125 7.723 3.194 1.00 1.41 H new ATOM 0 HE2 TYR A 144 -19.187 5.394 0.198 1.00 1.19 H new ATOM 0 HH TYR A 144 -20.948 4.679 1.331 1.00 1.70 H new ATOM 315 N GLU A 145 -14.589 8.721 0.404 1.00 0.39 N ATOM 316 CA GLU A 145 -13.551 7.771 0.034 1.00 0.34 C ATOM 317 C GLU A 145 -12.300 7.969 0.862 1.00 0.33 C ATOM 318 O GLU A 145 -11.572 7.017 1.128 1.00 0.34 O ATOM 319 CB GLU A 145 -13.160 7.898 -1.404 1.00 0.34 C ATOM 320 CG GLU A 145 -13.931 6.992 -2.344 1.00 0.43 C ATOM 321 CD GLU A 145 -15.402 7.330 -2.438 1.00 1.12 C ATOM 322 OE1 GLU A 145 -15.770 8.183 -3.269 1.00 1.23 O ATOM 323 OE2 GLU A 145 -16.196 6.755 -1.666 1.00 2.20 O ATOM 0 H GLU A 145 -14.655 9.531 -0.212 1.00 0.39 H new ATOM 0 HA GLU A 145 -13.977 6.784 0.216 1.00 0.34 H new ATOM 0 HB2 GLU A 145 -13.303 8.932 -1.717 1.00 0.34 H new ATOM 0 HB3 GLU A 145 -12.096 7.680 -1.500 1.00 0.34 H new ATOM 0 HG2 GLU A 145 -13.488 7.052 -3.338 1.00 0.43 H new ATOM 0 HG3 GLU A 145 -13.824 5.960 -2.010 1.00 0.43 H new ATOM 330 N ASP A 146 -12.025 9.217 1.228 1.00 0.37 N ATOM 331 CA ASP A 146 -10.881 9.514 2.068 1.00 0.45 C ATOM 332 C ASP A 146 -11.020 8.748 3.349 1.00 0.45 C ATOM 333 O ASP A 146 -10.095 8.098 3.838 1.00 0.49 O ATOM 334 CB ASP A 146 -10.761 11.002 2.381 1.00 0.56 C ATOM 335 CG ASP A 146 -9.602 11.297 3.318 1.00 1.11 C ATOM 336 OD1 ASP A 146 -8.436 11.169 2.889 1.00 1.44 O ATOM 337 OD2 ASP A 146 -9.854 11.649 4.489 1.00 1.40 O ATOM 0 H ASP A 146 -12.577 10.030 0.956 1.00 0.37 H new ATOM 0 HA ASP A 146 -9.980 9.222 1.529 1.00 0.45 H new ATOM 0 HB2 ASP A 146 -10.627 11.558 1.453 1.00 0.56 H new ATOM 0 HB3 ASP A 146 -11.689 11.353 2.831 1.00 0.56 H new ATOM 342 N ARG A 147 -12.229 8.810 3.840 1.00 0.47 N ATOM 343 CA ARG A 147 -12.648 8.044 4.984 1.00 0.52 C ATOM 344 C ARG A 147 -12.594 6.571 4.643 1.00 0.50 C ATOM 345 O ARG A 147 -12.237 5.737 5.464 1.00 0.54 O ATOM 346 CB ARG A 147 -14.073 8.450 5.371 1.00 0.57 C ATOM 347 CG ARG A 147 -14.852 7.364 6.116 1.00 0.66 C ATOM 348 CD ARG A 147 -15.479 6.360 5.163 1.00 0.69 C ATOM 349 NE ARG A 147 -16.925 6.537 5.058 1.00 1.11 N ATOM 350 CZ ARG A 147 -17.760 5.611 4.599 1.00 1.15 C ATOM 351 NH1 ARG A 147 -17.304 4.448 4.159 1.00 1.34 N ATOM 352 NH2 ARG A 147 -19.063 5.832 4.607 1.00 1.94 N ATOM 0 H ARG A 147 -12.962 9.403 3.451 1.00 0.47 H new ATOM 0 HA ARG A 147 -11.985 8.238 5.827 1.00 0.52 H new ATOM 0 HB2 ARG A 147 -14.028 9.343 5.995 1.00 0.57 H new ATOM 0 HB3 ARG A 147 -14.620 8.720 4.468 1.00 0.57 H new ATOM 0 HG2 ARG A 147 -14.184 6.844 6.802 1.00 0.66 H new ATOM 0 HG3 ARG A 147 -15.632 7.827 6.720 1.00 0.66 H new ATOM 0 HD2 ARG A 147 -15.028 6.466 4.176 1.00 0.69 H new ATOM 0 HD3 ARG A 147 -15.261 5.349 5.506 1.00 0.69 H new ATOM 0 HE ARG A 147 -17.319 7.429 5.356 1.00 1.11 H new ATOM 0 HH11 ARG A 147 -16.302 4.256 4.170 1.00 1.34 H new ATOM 0 HH12 ARG A 147 -17.954 3.745 3.809 1.00 1.34 H new ATOM 0 HH21 ARG A 147 -19.428 6.714 4.966 1.00 1.94 H new ATOM 0 HH22 ARG A 147 -19.703 5.120 4.254 1.00 1.94 H new ATOM 366 N TYR A 148 -12.971 6.263 3.419 1.00 0.45 N ATOM 367 CA TYR A 148 -13.093 4.893 3.001 1.00 0.46 C ATOM 368 C TYR A 148 -11.765 4.204 3.094 1.00 0.44 C ATOM 369 O TYR A 148 -11.680 3.103 3.583 1.00 0.57 O ATOM 370 CB TYR A 148 -13.682 4.819 1.594 1.00 0.47 C ATOM 371 CG TYR A 148 -14.190 3.459 1.184 1.00 0.49 C ATOM 372 CD1 TYR A 148 -15.047 2.738 2.005 1.00 0.71 C ATOM 373 CD2 TYR A 148 -13.824 2.906 -0.030 1.00 0.38 C ATOM 374 CE1 TYR A 148 -15.526 1.501 1.621 1.00 0.77 C ATOM 375 CE2 TYR A 148 -14.301 1.675 -0.425 1.00 0.43 C ATOM 376 CZ TYR A 148 -15.150 0.975 0.403 1.00 0.60 C ATOM 377 OH TYR A 148 -15.628 -0.252 0.006 1.00 0.68 O ATOM 0 H TYR A 148 -13.197 6.949 2.699 1.00 0.45 H new ATOM 0 HA TYR A 148 -13.779 4.371 3.668 1.00 0.46 H new ATOM 0 HB2 TYR A 148 -14.502 5.533 1.522 1.00 0.47 H new ATOM 0 HB3 TYR A 148 -12.921 5.136 0.881 1.00 0.47 H new ATOM 0 HD1 TYR A 148 -15.343 3.151 2.958 1.00 0.71 H new ATOM 0 HD2 TYR A 148 -13.153 3.448 -0.679 1.00 0.38 H new ATOM 0 HE1 TYR A 148 -16.190 0.950 2.270 1.00 0.77 H new ATOM 0 HE2 TYR A 148 -14.010 1.261 -1.379 1.00 0.43 H new ATOM 0 HH TYR A 148 -14.911 -0.757 -0.431 1.00 0.68 H new ATOM 387 N TYR A 149 -10.729 4.888 2.688 1.00 0.41 N ATOM 388 CA TYR A 149 -9.386 4.372 2.820 1.00 0.43 C ATOM 389 C TYR A 149 -8.981 4.402 4.271 1.00 0.41 C ATOM 390 O TYR A 149 -8.286 3.523 4.730 1.00 0.40 O ATOM 391 CB TYR A 149 -8.384 5.230 2.095 1.00 0.54 C ATOM 392 CG TYR A 149 -8.800 5.636 0.705 1.00 0.67 C ATOM 393 CD1 TYR A 149 -9.426 4.732 -0.136 1.00 1.40 C ATOM 394 CD2 TYR A 149 -8.574 6.925 0.238 1.00 0.97 C ATOM 395 CE1 TYR A 149 -9.819 5.096 -1.401 1.00 2.09 C ATOM 396 CE2 TYR A 149 -8.968 7.295 -1.032 1.00 1.54 C ATOM 397 CZ TYR A 149 -9.588 6.372 -1.845 1.00 2.08 C ATOM 398 OH TYR A 149 -9.978 6.723 -3.108 1.00 2.82 O ATOM 0 H TYR A 149 -10.787 5.812 2.259 1.00 0.41 H new ATOM 0 HA TYR A 149 -9.391 3.364 2.405 1.00 0.43 H new ATOM 0 HB2 TYR A 149 -8.201 6.129 2.683 1.00 0.54 H new ATOM 0 HB3 TYR A 149 -7.439 4.691 2.035 1.00 0.54 H new ATOM 0 HD1 TYR A 149 -9.608 3.725 0.208 1.00 1.40 H new ATOM 0 HD2 TYR A 149 -8.084 7.646 0.876 1.00 0.97 H new ATOM 0 HE1 TYR A 149 -10.308 4.379 -2.044 1.00 2.09 H new ATOM 0 HE2 TYR A 149 -8.792 8.300 -1.385 1.00 1.54 H new ATOM 0 HH TYR A 149 -10.949 6.855 -3.126 1.00 2.82 H new ATOM 408 N ARG A 150 -9.398 5.433 5.005 1.00 0.45 N ATOM 409 CA ARG A 150 -9.001 5.537 6.401 1.00 0.48 C ATOM 410 C ARG A 150 -9.611 4.389 7.171 1.00 0.50 C ATOM 411 O ARG A 150 -9.163 4.017 8.256 1.00 0.60 O ATOM 412 CB ARG A 150 -9.346 6.916 7.016 1.00 0.56 C ATOM 413 CG ARG A 150 -10.756 7.069 7.583 1.00 0.59 C ATOM 414 CD ARG A 150 -10.880 6.521 9.001 1.00 1.15 C ATOM 415 NE ARG A 150 -12.234 6.685 9.529 1.00 1.83 N ATOM 416 CZ ARG A 150 -12.990 5.687 9.990 1.00 2.65 C ATOM 417 NH1 ARG A 150 -12.512 4.446 10.031 1.00 2.97 N ATOM 418 NH2 ARG A 150 -14.214 5.941 10.433 1.00 3.59 N ATOM 0 H ARG A 150 -9.994 6.187 4.665 1.00 0.45 H new ATOM 0 HA ARG A 150 -7.915 5.466 6.465 1.00 0.48 H new ATOM 0 HB2 ARG A 150 -8.632 7.124 7.813 1.00 0.56 H new ATOM 0 HB3 ARG A 150 -9.200 7.678 6.251 1.00 0.56 H new ATOM 0 HG2 ARG A 150 -11.033 8.123 7.579 1.00 0.59 H new ATOM 0 HG3 ARG A 150 -11.463 6.552 6.934 1.00 0.59 H new ATOM 0 HD2 ARG A 150 -10.613 5.464 9.007 1.00 1.15 H new ATOM 0 HD3 ARG A 150 -10.171 7.033 9.652 1.00 1.15 H new ATOM 0 HE ARG A 150 -12.627 7.626 9.546 1.00 1.83 H new ATOM 0 HH11 ARG A 150 -11.563 4.254 9.709 1.00 2.97 H new ATOM 0 HH12 ARG A 150 -13.094 3.687 10.384 1.00 2.97 H new ATOM 0 HH21 ARG A 150 -14.573 6.896 10.420 1.00 3.59 H new ATOM 0 HH22 ARG A 150 -14.796 5.182 10.786 1.00 3.59 H new ATOM 432 N GLU A 151 -10.621 3.824 6.562 1.00 0.44 N ATOM 433 CA GLU A 151 -11.306 2.686 7.074 1.00 0.48 C ATOM 434 C GLU A 151 -10.736 1.459 6.395 1.00 0.44 C ATOM 435 O GLU A 151 -10.746 0.354 6.931 1.00 0.50 O ATOM 436 CB GLU A 151 -12.793 2.883 6.804 1.00 0.54 C ATOM 437 CG GLU A 151 -13.366 2.017 5.701 1.00 0.49 C ATOM 438 CD GLU A 151 -14.855 1.824 5.823 1.00 0.60 C ATOM 439 OE1 GLU A 151 -15.287 0.890 6.530 1.00 0.83 O ATOM 440 OE2 GLU A 151 -15.609 2.608 5.214 1.00 0.73 O ATOM 0 H GLU A 151 -10.993 4.159 5.673 1.00 0.44 H new ATOM 0 HA GLU A 151 -11.177 2.557 8.149 1.00 0.48 H new ATOM 0 HB2 GLU A 151 -13.343 2.684 7.724 1.00 0.54 H new ATOM 0 HB3 GLU A 151 -12.965 3.929 6.550 1.00 0.54 H new ATOM 0 HG2 GLU A 151 -13.141 2.470 4.736 1.00 0.49 H new ATOM 0 HG3 GLU A 151 -12.876 1.044 5.718 1.00 0.49 H new ATOM 447 N ASN A 152 -10.186 1.705 5.212 1.00 0.40 N ATOM 448 CA ASN A 152 -9.554 0.679 4.424 1.00 0.43 C ATOM 449 C ASN A 152 -8.206 0.336 4.944 1.00 0.37 C ATOM 450 O ASN A 152 -7.648 -0.681 4.597 1.00 0.36 O ATOM 451 CB ASN A 152 -9.365 1.071 2.975 1.00 0.62 C ATOM 452 CG ASN A 152 -10.623 1.026 2.171 1.00 0.67 C ATOM 453 OD1 ASN A 152 -11.564 0.295 2.476 1.00 1.69 O ATOM 454 ND2 ASN A 152 -10.623 1.800 1.117 1.00 0.48 N ATOM 0 H ASN A 152 -10.171 2.629 4.779 1.00 0.40 H new ATOM 0 HA ASN A 152 -10.234 -0.170 4.493 1.00 0.43 H new ATOM 0 HB2 ASN A 152 -8.953 2.079 2.932 1.00 0.62 H new ATOM 0 HB3 ASN A 152 -8.630 0.406 2.521 1.00 0.62 H new ATOM 0 HD21 ASN A 152 -11.433 1.818 0.498 1.00 0.48 H new ATOM 0 HD22 ASN A 152 -9.813 2.386 0.914 1.00 0.48 H new ATOM 461 N MET A 153 -7.676 1.188 5.758 1.00 0.35 N ATOM 462 CA MET A 153 -6.287 1.090 6.125 1.00 0.34 C ATOM 463 C MET A 153 -5.965 -0.159 6.910 1.00 0.33 C ATOM 464 O MET A 153 -4.815 -0.404 7.265 1.00 0.36 O ATOM 465 CB MET A 153 -5.804 2.321 6.868 1.00 0.36 C ATOM 466 CG MET A 153 -5.688 3.573 6.018 1.00 0.69 C ATOM 467 SD MET A 153 -4.674 3.348 4.542 1.00 0.61 S ATOM 468 CE MET A 153 -5.832 2.520 3.451 1.00 0.34 C ATOM 0 H MET A 153 -8.179 1.965 6.187 1.00 0.35 H new ATOM 0 HA MET A 153 -5.746 1.024 5.181 1.00 0.34 H new ATOM 0 HB2 MET A 153 -6.487 2.521 7.693 1.00 0.36 H new ATOM 0 HB3 MET A 153 -4.830 2.105 7.306 1.00 0.36 H new ATOM 0 HG2 MET A 153 -6.686 3.893 5.718 1.00 0.69 H new ATOM 0 HG3 MET A 153 -5.264 4.375 6.622 1.00 0.69 H new ATOM 0 HE1 MET A 153 -5.382 1.602 3.072 1.00 0.34 H new ATOM 0 HE2 MET A 153 -6.741 2.279 4.001 1.00 0.34 H new ATOM 0 HE3 MET A 153 -6.077 3.176 2.615 1.00 0.34 H new ATOM 478 N TYR A 154 -6.967 -0.948 7.169 1.00 0.33 N ATOM 479 CA TYR A 154 -6.758 -2.188 7.849 1.00 0.36 C ATOM 480 C TYR A 154 -7.076 -3.354 6.938 1.00 0.34 C ATOM 481 O TYR A 154 -7.195 -4.490 7.391 1.00 0.39 O ATOM 482 CB TYR A 154 -7.621 -2.233 9.103 1.00 0.47 C ATOM 483 CG TYR A 154 -7.409 -1.054 10.028 1.00 0.60 C ATOM 484 CD1 TYR A 154 -8.119 0.127 9.864 1.00 0.68 C ATOM 485 CD2 TYR A 154 -6.493 -1.130 11.071 1.00 0.76 C ATOM 486 CE1 TYR A 154 -7.921 1.202 10.712 1.00 0.83 C ATOM 487 CE2 TYR A 154 -6.294 -0.065 11.923 1.00 0.92 C ATOM 488 CZ TYR A 154 -7.028 1.119 11.718 1.00 0.95 C ATOM 489 OH TYR A 154 -6.799 2.168 12.579 1.00 1.10 O ATOM 0 H TYR A 154 -7.936 -0.753 6.919 1.00 0.33 H new ATOM 0 HA TYR A 154 -5.710 -2.265 8.138 1.00 0.36 H new ATOM 0 HB2 TYR A 154 -8.670 -2.270 8.810 1.00 0.47 H new ATOM 0 HB3 TYR A 154 -7.409 -3.153 9.647 1.00 0.47 H new ATOM 0 HD1 TYR A 154 -8.837 0.208 9.062 1.00 0.68 H new ATOM 0 HD2 TYR A 154 -5.928 -2.039 11.216 1.00 0.76 H new ATOM 0 HE1 TYR A 154 -8.485 2.112 10.567 1.00 0.83 H new ATOM 0 HE2 TYR A 154 -5.586 -0.138 12.735 1.00 0.92 H new ATOM 0 HH TYR A 154 -6.120 1.909 13.236 1.00 1.10 H new ATOM 499 N ARG A 155 -7.186 -3.076 5.643 1.00 0.30 N ATOM 500 CA ARG A 155 -7.563 -4.099 4.701 1.00 0.31 C ATOM 501 C ARG A 155 -7.167 -3.719 3.253 1.00 0.25 C ATOM 502 O ARG A 155 -6.660 -4.552 2.513 1.00 0.26 O ATOM 503 CB ARG A 155 -9.052 -4.371 4.874 1.00 0.41 C ATOM 504 CG ARG A 155 -9.906 -3.646 3.901 1.00 0.60 C ATOM 505 CD ARG A 155 -10.282 -2.271 4.412 1.00 0.43 C ATOM 506 NE ARG A 155 -11.174 -2.333 5.562 1.00 0.95 N ATOM 507 CZ ARG A 155 -12.473 -2.041 5.509 1.00 1.23 C ATOM 508 NH1 ARG A 155 -13.032 -1.688 4.357 1.00 1.36 N ATOM 509 NH2 ARG A 155 -13.214 -2.091 6.608 1.00 1.92 N ATOM 0 H ARG A 155 -7.019 -2.157 5.234 1.00 0.30 H new ATOM 0 HA ARG A 155 -7.017 -5.021 4.900 1.00 0.31 H new ATOM 0 HB2 ARG A 155 -9.231 -5.442 4.775 1.00 0.41 H new ATOM 0 HB3 ARG A 155 -9.349 -4.091 5.885 1.00 0.41 H new ATOM 0 HG2 ARG A 155 -9.379 -3.551 2.952 1.00 0.60 H new ATOM 0 HG3 ARG A 155 -10.810 -4.223 3.707 1.00 0.60 H new ATOM 0 HD2 ARG A 155 -9.377 -1.728 4.686 1.00 0.43 H new ATOM 0 HD3 ARG A 155 -10.763 -1.708 3.612 1.00 0.43 H new ATOM 0 HE ARG A 155 -10.781 -2.616 6.460 1.00 0.95 H new ATOM 0 HH11 ARG A 155 -12.467 -1.640 3.509 1.00 1.36 H new ATOM 0 HH12 ARG A 155 -14.027 -1.465 4.320 1.00 1.36 H new ATOM 0 HH21 ARG A 155 -12.790 -2.354 7.498 1.00 1.92 H new ATOM 0 HH22 ARG A 155 -14.208 -1.867 6.563 1.00 1.92 H new ATOM 523 N TYR A 156 -7.380 -2.463 2.864 1.00 0.26 N ATOM 524 CA TYR A 156 -6.863 -1.910 1.607 1.00 0.24 C ATOM 525 C TYR A 156 -5.842 -0.902 2.033 1.00 0.24 C ATOM 526 O TYR A 156 -5.883 0.265 1.653 1.00 0.29 O ATOM 527 CB TYR A 156 -7.979 -1.222 0.832 1.00 0.28 C ATOM 528 CG TYR A 156 -9.210 -2.068 0.682 1.00 0.33 C ATOM 529 CD1 TYR A 156 -9.152 -3.432 0.850 1.00 0.53 C ATOM 530 CD2 TYR A 156 -10.423 -1.490 0.390 1.00 0.43 C ATOM 531 CE1 TYR A 156 -10.286 -4.213 0.733 1.00 0.62 C ATOM 532 CE2 TYR A 156 -11.565 -2.254 0.263 1.00 0.49 C ATOM 533 CZ TYR A 156 -11.464 -3.644 0.371 1.00 0.56 C ATOM 534 OH TYR A 156 -12.628 -4.377 0.320 1.00 0.65 O ATOM 0 H TYR A 156 -7.919 -1.794 3.413 1.00 0.26 H new ATOM 0 HA TYR A 156 -6.448 -2.680 0.956 1.00 0.24 H new ATOM 0 HB2 TYR A 156 -8.244 -0.294 1.339 1.00 0.28 H new ATOM 0 HB3 TYR A 156 -7.611 -0.951 -0.157 1.00 0.28 H new ATOM 0 HD1 TYR A 156 -8.205 -3.900 1.077 1.00 0.53 H new ATOM 0 HD2 TYR A 156 -10.483 -0.420 0.258 1.00 0.43 H new ATOM 0 HE1 TYR A 156 -10.235 -5.274 0.929 1.00 0.62 H new ATOM 0 HE2 TYR A 156 -12.521 -1.786 0.083 1.00 0.49 H new ATOM 0 HH TYR A 156 -12.831 -4.604 -0.611 1.00 0.65 H new ATOM 544 N PRO A 157 -4.886 -1.394 2.797 1.00 0.21 N ATOM 545 CA PRO A 157 -4.531 -0.803 4.050 1.00 0.22 C ATOM 546 C PRO A 157 -3.283 0.046 4.061 1.00 0.23 C ATOM 547 O PRO A 157 -2.705 0.361 3.025 1.00 0.25 O ATOM 548 CB PRO A 157 -4.315 -2.102 4.789 1.00 0.21 C ATOM 549 CG PRO A 157 -3.407 -2.814 3.870 1.00 0.21 C ATOM 550 CD PRO A 157 -3.986 -2.541 2.509 1.00 0.22 C ATOM 0 HA PRO A 157 -5.258 -0.087 4.432 1.00 0.22 H new ATOM 0 HB2 PRO A 157 -3.867 -1.946 5.770 1.00 0.21 H new ATOM 0 HB3 PRO A 157 -5.247 -2.644 4.947 1.00 0.21 H new ATOM 0 HG2 PRO A 157 -2.385 -2.444 3.951 1.00 0.21 H new ATOM 0 HG3 PRO A 157 -3.377 -3.882 4.085 1.00 0.21 H new ATOM 0 HD2 PRO A 157 -3.217 -2.287 1.779 1.00 0.22 H new ATOM 0 HD3 PRO A 157 -4.529 -3.400 2.114 1.00 0.22 H new ATOM 558 N ASN A 158 -2.883 0.412 5.269 1.00 0.24 N ATOM 559 CA ASN A 158 -1.647 1.109 5.474 1.00 0.27 C ATOM 560 C ASN A 158 -0.594 0.110 5.912 1.00 0.32 C ATOM 561 O ASN A 158 -0.022 0.195 6.979 1.00 0.57 O ATOM 562 CB ASN A 158 -1.803 2.284 6.465 1.00 0.29 C ATOM 563 CG ASN A 158 -2.107 1.892 7.907 1.00 1.07 C ATOM 564 OD1 ASN A 158 -3.251 1.642 8.271 1.00 1.56 O ATOM 565 ND2 ASN A 158 -1.092 1.912 8.753 1.00 1.86 N ATOM 0 H ASN A 158 -3.411 0.230 6.123 1.00 0.24 H new ATOM 0 HA ASN A 158 -1.328 1.566 4.538 1.00 0.27 H new ATOM 0 HB2 ASN A 158 -0.885 2.871 6.453 1.00 0.29 H new ATOM 0 HB3 ASN A 158 -2.602 2.934 6.108 1.00 0.29 H new ATOM 0 HD21 ASN A 158 -1.248 1.716 9.742 1.00 1.86 H new ATOM 0 HD22 ASN A 158 -0.152 2.124 8.417 1.00 1.86 H new ATOM 572 N GLN A 159 -0.398 -0.894 5.081 1.00 0.22 N ATOM 573 CA GLN A 159 0.736 -1.783 5.211 1.00 0.23 C ATOM 574 C GLN A 159 0.978 -2.526 3.919 1.00 0.21 C ATOM 575 O GLN A 159 0.042 -2.877 3.198 1.00 0.24 O ATOM 576 CB GLN A 159 0.586 -2.776 6.355 1.00 0.25 C ATOM 577 CG GLN A 159 -0.706 -3.583 6.326 1.00 0.25 C ATOM 578 CD GLN A 159 -0.474 -5.069 6.523 1.00 0.42 C ATOM 579 OE1 GLN A 159 -1.239 -5.898 6.035 1.00 0.87 O ATOM 580 NE2 GLN A 159 0.584 -5.419 7.240 1.00 0.63 N ATOM 0 H GLN A 159 -1.017 -1.115 4.301 1.00 0.22 H new ATOM 0 HA GLN A 159 1.595 -1.153 5.442 1.00 0.23 H new ATOM 0 HB2 GLN A 159 1.430 -3.465 6.334 1.00 0.25 H new ATOM 0 HB3 GLN A 159 0.640 -2.234 7.299 1.00 0.25 H new ATOM 0 HG2 GLN A 159 -1.375 -3.218 7.105 1.00 0.25 H new ATOM 0 HG3 GLN A 159 -1.209 -3.421 5.373 1.00 0.25 H new ATOM 0 HE21 GLN A 159 1.196 -4.702 7.629 1.00 0.63 H new ATOM 0 HE22 GLN A 159 0.786 -6.405 7.403 1.00 0.63 H new ATOM 589 N VAL A 160 2.241 -2.773 3.643 1.00 0.20 N ATOM 590 CA VAL A 160 2.653 -3.364 2.400 1.00 0.18 C ATOM 591 C VAL A 160 3.851 -4.245 2.611 1.00 0.20 C ATOM 592 O VAL A 160 4.374 -4.318 3.713 1.00 0.26 O ATOM 593 CB VAL A 160 2.959 -2.330 1.327 1.00 0.20 C ATOM 594 CG1 VAL A 160 1.694 -1.972 0.568 1.00 0.22 C ATOM 595 CG2 VAL A 160 3.580 -1.106 1.942 1.00 0.23 C ATOM 0 H VAL A 160 3.009 -2.566 4.281 1.00 0.20 H new ATOM 0 HA VAL A 160 1.812 -3.960 2.045 1.00 0.18 H new ATOM 0 HB VAL A 160 3.673 -2.755 0.621 1.00 0.20 H new ATOM 0 HG11 VAL A 160 1.926 -1.231 -0.197 1.00 0.22 H new ATOM 0 HG12 VAL A 160 1.288 -2.866 0.096 1.00 0.22 H new ATOM 0 HG13 VAL A 160 0.959 -1.561 1.260 1.00 0.22 H new ATOM 0 HG21 VAL A 160 3.793 -0.375 1.162 1.00 0.23 H new ATOM 0 HG22 VAL A 160 2.890 -0.673 2.666 1.00 0.23 H new ATOM 0 HG23 VAL A 160 4.507 -1.382 2.444 1.00 0.23 H new ATOM 605 N TYR A 161 4.230 -4.986 1.598 1.00 0.20 N ATOM 606 CA TYR A 161 5.382 -5.860 1.711 1.00 0.24 C ATOM 607 C TYR A 161 6.314 -5.697 0.513 1.00 0.31 C ATOM 608 O TYR A 161 6.064 -6.196 -0.577 1.00 0.62 O ATOM 609 CB TYR A 161 4.904 -7.296 1.828 1.00 0.26 C ATOM 610 CG TYR A 161 3.928 -7.522 2.964 1.00 0.60 C ATOM 611 CD1 TYR A 161 2.567 -7.316 2.799 1.00 1.05 C ATOM 612 CD2 TYR A 161 4.382 -7.947 4.205 1.00 0.71 C ATOM 613 CE1 TYR A 161 1.683 -7.527 3.842 1.00 1.60 C ATOM 614 CE2 TYR A 161 3.514 -8.163 5.250 1.00 1.25 C ATOM 615 CZ TYR A 161 2.113 -7.921 5.032 1.00 1.70 C ATOM 616 OH TYR A 161 1.281 -8.158 6.108 1.00 2.25 O ATOM 0 H TYR A 161 3.764 -5.005 0.691 1.00 0.20 H new ATOM 0 HA TYR A 161 5.948 -5.591 2.603 1.00 0.24 H new ATOM 0 HB2 TYR A 161 4.431 -7.590 0.891 1.00 0.26 H new ATOM 0 HB3 TYR A 161 5.767 -7.947 1.967 1.00 0.26 H new ATOM 0 HD1 TYR A 161 2.191 -6.986 1.842 1.00 1.05 H new ATOM 0 HD2 TYR A 161 5.439 -8.112 4.353 1.00 0.71 H new ATOM 0 HE1 TYR A 161 0.626 -7.368 3.684 1.00 1.60 H new ATOM 0 HE2 TYR A 161 3.875 -8.505 6.209 1.00 1.25 H new ATOM 0 HH TYR A 161 1.816 -8.439 6.879 1.00 2.25 H new ATOM 626 N TYR A 162 7.398 -5.010 0.751 1.00 0.27 N ATOM 627 CA TYR A 162 8.383 -4.693 -0.269 1.00 0.35 C ATOM 628 C TYR A 162 9.754 -4.753 0.373 1.00 0.41 C ATOM 629 O TYR A 162 9.857 -4.745 1.577 1.00 0.46 O ATOM 630 CB TYR A 162 8.143 -3.276 -0.797 1.00 0.41 C ATOM 631 CG TYR A 162 8.282 -2.253 0.304 1.00 0.47 C ATOM 632 CD1 TYR A 162 7.217 -1.970 1.135 1.00 0.62 C ATOM 633 CD2 TYR A 162 9.496 -1.629 0.557 1.00 0.79 C ATOM 634 CE1 TYR A 162 7.353 -1.099 2.183 1.00 0.78 C ATOM 635 CE2 TYR A 162 9.637 -0.744 1.603 1.00 0.92 C ATOM 636 CZ TYR A 162 8.559 -0.489 2.417 1.00 0.83 C ATOM 637 OH TYR A 162 8.685 0.360 3.492 1.00 1.03 O ATOM 0 H TYR A 162 7.634 -4.644 1.674 1.00 0.27 H new ATOM 0 HA TYR A 162 8.309 -5.400 -1.096 1.00 0.35 H new ATOM 0 HB2 TYR A 162 8.854 -3.056 -1.593 1.00 0.41 H new ATOM 0 HB3 TYR A 162 7.146 -3.212 -1.233 1.00 0.41 H new ATOM 0 HD1 TYR A 162 6.262 -2.442 0.956 1.00 0.62 H new ATOM 0 HD2 TYR A 162 10.344 -1.841 -0.077 1.00 0.79 H new ATOM 0 HE1 TYR A 162 6.510 -0.892 2.826 1.00 0.78 H new ATOM 0 HE2 TYR A 162 10.584 -0.256 1.782 1.00 0.92 H new ATOM 0 HH TYR A 162 9.614 0.663 3.562 1.00 1.03 H new ATOM 647 N ARG A 163 10.799 -4.764 -0.407 1.00 0.49 N ATOM 648 CA ARG A 163 12.137 -4.702 0.166 1.00 0.56 C ATOM 649 C ARG A 163 12.618 -3.267 0.028 1.00 0.60 C ATOM 650 O ARG A 163 12.005 -2.499 -0.706 1.00 0.68 O ATOM 651 CB ARG A 163 13.073 -5.692 -0.513 1.00 0.71 C ATOM 652 CG ARG A 163 13.296 -5.383 -1.963 1.00 0.89 C ATOM 653 CD ARG A 163 13.357 -6.670 -2.777 1.00 1.18 C ATOM 654 NE ARG A 163 14.655 -7.346 -2.647 1.00 1.82 N ATOM 655 CZ ARG A 163 14.807 -8.639 -2.341 1.00 2.23 C ATOM 656 NH1 ARG A 163 13.750 -9.397 -2.069 1.00 2.21 N ATOM 657 NH2 ARG A 163 16.025 -9.170 -2.290 1.00 3.01 N ATOM 0 H ARG A 163 10.765 -4.814 -1.425 1.00 0.49 H new ATOM 0 HA ARG A 163 12.122 -4.986 1.218 1.00 0.56 H new ATOM 0 HB2 ARG A 163 14.032 -5.692 0.005 1.00 0.71 H new ATOM 0 HB3 ARG A 163 12.661 -6.697 -0.420 1.00 0.71 H new ATOM 0 HG2 ARG A 163 12.491 -4.748 -2.334 1.00 0.89 H new ATOM 0 HG3 ARG A 163 14.224 -4.824 -2.084 1.00 0.89 H new ATOM 0 HD2 ARG A 163 12.564 -7.343 -2.450 1.00 1.18 H new ATOM 0 HD3 ARG A 163 13.170 -6.444 -3.827 1.00 1.18 H new ATOM 0 HE ARG A 163 15.497 -6.792 -2.801 1.00 1.82 H new ATOM 0 HH11 ARG A 163 12.813 -8.994 -2.093 1.00 2.21 H new ATOM 0 HH12 ARG A 163 13.875 -10.382 -1.837 1.00 2.21 H new ATOM 0 HH21 ARG A 163 16.842 -8.591 -2.484 1.00 3.01 H new ATOM 0 HH22 ARG A 163 16.142 -10.156 -2.057 1.00 3.01 H new ATOM 671 N PRO A 164 13.716 -2.864 0.673 1.00 0.61 N ATOM 672 CA PRO A 164 13.942 -1.476 0.980 1.00 0.66 C ATOM 673 C PRO A 164 14.795 -0.765 -0.056 1.00 0.65 C ATOM 674 O PRO A 164 15.761 -1.299 -0.598 1.00 0.73 O ATOM 675 CB PRO A 164 14.684 -1.557 2.319 1.00 0.72 C ATOM 676 CG PRO A 164 15.240 -2.952 2.405 1.00 0.71 C ATOM 677 CD PRO A 164 14.828 -3.673 1.148 1.00 0.62 C ATOM 0 HA PRO A 164 13.015 -0.903 1.003 1.00 0.66 H new ATOM 0 HB2 PRO A 164 15.482 -0.816 2.368 1.00 0.72 H new ATOM 0 HB3 PRO A 164 14.010 -1.354 3.151 1.00 0.72 H new ATOM 0 HG2 PRO A 164 16.326 -2.929 2.497 1.00 0.71 H new ATOM 0 HG3 PRO A 164 14.856 -3.466 3.287 1.00 0.71 H new ATOM 0 HD2 PRO A 164 15.639 -3.716 0.420 1.00 0.62 H new ATOM 0 HD3 PRO A 164 14.526 -4.701 1.350 1.00 0.62 H new ATOM 685 N VAL A 165 14.381 0.444 -0.339 1.00 0.60 N ATOM 686 CA VAL A 165 15.006 1.282 -1.336 1.00 0.63 C ATOM 687 C VAL A 165 15.868 2.373 -0.695 1.00 0.59 C ATOM 688 O VAL A 165 15.551 2.856 0.381 1.00 0.62 O ATOM 689 CB VAL A 165 13.928 1.901 -2.218 1.00 0.72 C ATOM 690 CG1 VAL A 165 12.830 2.475 -1.354 1.00 0.63 C ATOM 691 CG2 VAL A 165 14.506 2.968 -3.113 1.00 0.82 C ATOM 0 H VAL A 165 13.586 0.883 0.124 1.00 0.60 H new ATOM 0 HA VAL A 165 15.667 0.665 -1.944 1.00 0.63 H new ATOM 0 HB VAL A 165 13.512 1.121 -2.856 1.00 0.72 H new ATOM 0 HG11 VAL A 165 12.061 2.917 -1.988 1.00 0.63 H new ATOM 0 HG12 VAL A 165 12.390 1.682 -0.750 1.00 0.63 H new ATOM 0 HG13 VAL A 165 13.245 3.242 -0.700 1.00 0.63 H new ATOM 0 HG21 VAL A 165 13.715 3.392 -3.731 1.00 0.82 H new ATOM 0 HG22 VAL A 165 14.950 3.754 -2.502 1.00 0.82 H new ATOM 0 HG23 VAL A 165 15.271 2.530 -3.754 1.00 0.82 H new ATOM 701 N ASP A 166 16.933 2.750 -1.417 1.00 0.68 N ATOM 702 CA ASP A 166 18.079 3.540 -0.924 1.00 0.72 C ATOM 703 C ASP A 166 19.125 2.542 -0.568 1.00 0.94 C ATOM 704 O ASP A 166 20.331 2.770 -0.640 1.00 1.54 O ATOM 705 CB ASP A 166 17.761 4.455 0.265 1.00 1.14 C ATOM 706 CG ASP A 166 18.974 5.220 0.758 1.00 1.67 C ATOM 707 OD1 ASP A 166 19.258 6.303 0.202 1.00 2.09 O ATOM 708 OD2 ASP A 166 19.646 4.751 1.699 1.00 2.37 O ATOM 0 H ASP A 166 17.027 2.504 -2.402 1.00 0.68 H new ATOM 0 HA ASP A 166 18.400 4.235 -1.701 1.00 0.72 H new ATOM 0 HB2 ASP A 166 16.984 5.162 -0.024 1.00 1.14 H new ATOM 0 HB3 ASP A 166 17.358 3.856 1.082 1.00 1.14 H new ATOM 762 N ASN A 170 15.512 1.637 -6.683 1.00 0.82 N ATOM 763 CA ASN A 170 14.211 1.585 -7.354 1.00 0.65 C ATOM 764 C ASN A 170 13.181 0.892 -6.491 1.00 0.56 C ATOM 765 O ASN A 170 13.146 -0.333 -6.417 1.00 0.77 O ATOM 766 CB ASN A 170 14.310 0.870 -8.704 1.00 0.84 C ATOM 767 CG ASN A 170 13.180 1.269 -9.632 1.00 1.23 C ATOM 768 OD1 ASN A 170 12.095 1.639 -9.183 1.00 1.94 O ATOM 769 ND2 ASN A 170 13.423 1.205 -10.932 1.00 1.70 N ATOM 0 HA ASN A 170 13.897 2.615 -7.524 1.00 0.65 H new ATOM 0 HB2 ASN A 170 15.266 1.106 -9.172 1.00 0.84 H new ATOM 0 HB3 ASN A 170 14.289 -0.208 -8.547 1.00 0.84 H new ATOM 0 HD21 ASN A 170 12.698 1.467 -11.600 1.00 1.70 H new ATOM 0 HD22 ASN A 170 14.335 0.893 -11.266 1.00 1.70 H new ATOM 776 N GLN A 171 12.347 1.678 -5.824 1.00 0.41 N ATOM 777 CA GLN A 171 11.250 1.124 -5.081 1.00 0.37 C ATOM 778 C GLN A 171 10.042 1.028 -5.975 1.00 0.29 C ATOM 779 O GLN A 171 9.324 0.047 -5.906 1.00 0.34 O ATOM 780 CB GLN A 171 10.940 1.966 -3.863 1.00 0.57 C ATOM 781 CG GLN A 171 9.808 1.416 -3.031 1.00 1.32 C ATOM 782 CD GLN A 171 9.997 -0.043 -2.687 1.00 2.56 C ATOM 783 OE1 GLN A 171 11.117 -0.518 -2.540 1.00 3.22 O ATOM 784 NE2 GLN A 171 8.899 -0.764 -2.576 1.00 3.29 N ATOM 0 H GLN A 171 12.418 2.695 -5.789 1.00 0.41 H new ATOM 0 HA GLN A 171 11.526 0.128 -4.734 1.00 0.37 H new ATOM 0 HB2 GLN A 171 11.834 2.040 -3.244 1.00 0.57 H new ATOM 0 HB3 GLN A 171 10.689 2.977 -4.183 1.00 0.57 H new ATOM 0 HG2 GLN A 171 9.723 1.995 -2.111 1.00 1.32 H new ATOM 0 HG3 GLN A 171 8.870 1.539 -3.573 1.00 1.32 H new ATOM 0 HE21 GLN A 171 7.987 -0.327 -2.706 1.00 3.29 H new ATOM 0 HE22 GLN A 171 8.962 -1.759 -2.360 1.00 3.29 H new ATOM 793 N ASN A 172 9.852 2.041 -6.832 1.00 0.35 N ATOM 794 CA ASN A 172 8.792 2.034 -7.853 1.00 0.42 C ATOM 795 C ASN A 172 8.714 0.676 -8.527 1.00 0.42 C ATOM 796 O ASN A 172 7.634 0.179 -8.882 1.00 0.48 O ATOM 797 CB ASN A 172 9.074 3.126 -8.897 1.00 0.47 C ATOM 798 CG ASN A 172 8.340 2.907 -10.211 1.00 0.54 C ATOM 799 OD1 ASN A 172 8.864 2.270 -11.129 1.00 1.24 O ATOM 800 ND2 ASN A 172 7.129 3.433 -10.317 1.00 1.02 N ATOM 0 H ASN A 172 10.425 2.885 -6.838 1.00 0.35 H new ATOM 0 HA ASN A 172 7.835 2.235 -7.371 1.00 0.42 H new ATOM 0 HB2 ASN A 172 8.788 4.094 -8.486 1.00 0.47 H new ATOM 0 HB3 ASN A 172 10.146 3.166 -9.090 1.00 0.47 H new ATOM 0 HD21 ASN A 172 6.597 3.318 -11.179 1.00 1.02 H new ATOM 0 HD22 ASN A 172 6.729 3.953 -9.536 1.00 1.02 H new ATOM 807 N ASN A 173 9.874 0.063 -8.622 1.00 0.40 N ATOM 808 CA ASN A 173 10.017 -1.250 -9.222 1.00 0.50 C ATOM 809 C ASN A 173 9.265 -2.257 -8.365 1.00 0.44 C ATOM 810 O ASN A 173 8.280 -2.913 -8.770 1.00 0.46 O ATOM 811 CB ASN A 173 11.490 -1.649 -9.261 1.00 0.63 C ATOM 812 CG ASN A 173 11.810 -2.579 -10.418 1.00 0.77 C ATOM 813 OD1 ASN A 173 12.200 -2.135 -11.497 1.00 1.33 O ATOM 814 ND2 ASN A 173 11.645 -3.873 -10.205 1.00 1.44 N ATOM 0 H ASN A 173 10.750 0.462 -8.284 1.00 0.40 H new ATOM 0 HA ASN A 173 9.620 -1.231 -10.237 1.00 0.50 H new ATOM 0 HB2 ASN A 173 12.104 -0.752 -9.340 1.00 0.63 H new ATOM 0 HB3 ASN A 173 11.756 -2.136 -8.323 1.00 0.63 H new ATOM 0 HD21 ASN A 173 11.843 -4.542 -10.949 1.00 1.44 H new ATOM 0 HD22 ASN A 173 11.320 -4.203 -9.296 1.00 1.44 H new ATOM 821 N PHE A 174 9.720 -2.298 -7.130 1.00 0.42 N ATOM 822 CA PHE A 174 9.192 -3.182 -6.126 1.00 0.42 C ATOM 823 C PHE A 174 7.781 -2.828 -5.747 1.00 0.33 C ATOM 824 O PHE A 174 7.176 -3.534 -4.972 1.00 0.34 O ATOM 825 CB PHE A 174 10.052 -3.100 -4.887 1.00 0.49 C ATOM 826 CG PHE A 174 11.418 -3.667 -5.090 1.00 0.60 C ATOM 827 CD1 PHE A 174 11.582 -4.913 -5.661 1.00 1.56 C ATOM 828 CD2 PHE A 174 12.537 -2.960 -4.686 1.00 1.03 C ATOM 829 CE1 PHE A 174 12.838 -5.447 -5.832 1.00 1.90 C ATOM 830 CE2 PHE A 174 13.800 -3.493 -4.849 1.00 1.38 C ATOM 831 CZ PHE A 174 13.955 -4.697 -5.507 1.00 1.53 C ATOM 0 H PHE A 174 10.480 -1.706 -6.796 1.00 0.42 H new ATOM 0 HA PHE A 174 9.194 -4.189 -6.543 1.00 0.42 H new ATOM 0 HB2 PHE A 174 10.139 -2.058 -4.579 1.00 0.49 H new ATOM 0 HB3 PHE A 174 9.560 -3.633 -4.073 1.00 0.49 H new ATOM 0 HD1 PHE A 174 10.715 -5.474 -5.977 1.00 1.56 H new ATOM 0 HD2 PHE A 174 12.421 -1.983 -4.240 1.00 1.03 H new ATOM 0 HE1 PHE A 174 12.952 -6.449 -6.219 1.00 1.90 H new ATOM 0 HE2 PHE A 174 14.663 -2.971 -4.464 1.00 1.38 H new ATOM 0 HZ PHE A 174 14.942 -5.051 -5.766 1.00 1.53 H new ATOM 841 N VAL A 175 7.278 -1.724 -6.264 1.00 0.29 N ATOM 842 CA VAL A 175 5.934 -1.280 -5.953 1.00 0.25 C ATOM 843 C VAL A 175 4.927 -1.967 -6.816 1.00 0.25 C ATOM 844 O VAL A 175 3.898 -2.423 -6.332 1.00 0.28 O ATOM 845 CB VAL A 175 5.766 0.197 -6.179 1.00 0.26 C ATOM 846 CG1 VAL A 175 4.325 0.600 -5.878 1.00 0.26 C ATOM 847 CG2 VAL A 175 6.756 0.947 -5.342 1.00 0.33 C ATOM 0 H VAL A 175 7.785 -1.114 -6.906 1.00 0.29 H new ATOM 0 HA VAL A 175 5.776 -1.521 -4.902 1.00 0.25 H new ATOM 0 HB VAL A 175 5.963 0.447 -7.221 1.00 0.26 H new ATOM 0 HG11 VAL A 175 4.205 1.671 -6.042 1.00 0.26 H new ATOM 0 HG12 VAL A 175 3.649 0.054 -6.536 1.00 0.26 H new ATOM 0 HG13 VAL A 175 4.090 0.364 -4.840 1.00 0.26 H new ATOM 0 HG21 VAL A 175 6.634 2.018 -5.506 1.00 0.33 H new ATOM 0 HG22 VAL A 175 6.588 0.720 -4.289 1.00 0.33 H new ATOM 0 HG23 VAL A 175 7.767 0.650 -5.621 1.00 0.33 H new ATOM 857 N HIS A 176 5.196 -1.983 -8.104 1.00 0.27 N ATOM 858 CA HIS A 176 4.430 -2.818 -8.999 1.00 0.33 C ATOM 859 C HIS A 176 4.299 -4.192 -8.367 1.00 0.28 C ATOM 860 O HIS A 176 3.217 -4.761 -8.330 1.00 0.29 O ATOM 861 CB HIS A 176 5.093 -2.916 -10.372 1.00 0.41 C ATOM 862 CG HIS A 176 5.241 -1.596 -11.065 1.00 1.16 C ATOM 863 ND1 HIS A 176 6.262 -1.324 -11.945 1.00 2.23 N ATOM 864 CD2 HIS A 176 4.488 -0.468 -11.005 1.00 1.62 C ATOM 865 CE1 HIS A 176 6.136 -0.090 -12.395 1.00 2.89 C ATOM 866 NE2 HIS A 176 5.068 0.452 -11.840 1.00 2.52 N ATOM 0 H HIS A 176 5.931 -1.434 -8.549 1.00 0.27 H new ATOM 0 HA HIS A 176 3.444 -2.379 -9.153 1.00 0.33 H new ATOM 0 HB2 HIS A 176 6.078 -3.369 -10.259 1.00 0.41 H new ATOM 0 HB3 HIS A 176 4.506 -3.584 -11.002 1.00 0.41 H new ATOM 0 HD2 HIS A 176 3.598 -0.322 -10.411 1.00 1.62 H new ATOM 0 HE1 HIS A 176 6.796 0.395 -13.099 1.00 2.89 H new ATOM 0 HE2 HIS A 176 4.730 1.400 -12.005 1.00 2.52 H new ATOM 875 N ASP A 177 5.397 -4.686 -7.789 1.00 0.26 N ATOM 876 CA ASP A 177 5.354 -5.972 -7.086 1.00 0.27 C ATOM 877 C ASP A 177 4.821 -5.844 -5.641 1.00 0.24 C ATOM 878 O ASP A 177 4.322 -6.807 -5.071 1.00 0.31 O ATOM 879 CB ASP A 177 6.739 -6.622 -7.093 1.00 0.36 C ATOM 880 CG ASP A 177 6.696 -8.095 -6.726 1.00 0.49 C ATOM 881 OD1 ASP A 177 6.266 -8.911 -7.557 1.00 0.66 O ATOM 882 OD2 ASP A 177 7.071 -8.442 -5.583 1.00 0.64 O ATOM 0 H ASP A 177 6.308 -4.228 -7.792 1.00 0.26 H new ATOM 0 HA ASP A 177 4.652 -6.609 -7.623 1.00 0.27 H new ATOM 0 HB2 ASP A 177 7.183 -6.511 -8.082 1.00 0.36 H new ATOM 0 HB3 ASP A 177 7.387 -6.096 -6.392 1.00 0.36 H new ATOM 887 N CYS A 178 4.892 -4.644 -5.078 1.00 0.26 N ATOM 888 CA CYS A 178 4.454 -4.376 -3.697 1.00 0.29 C ATOM 889 C CYS A 178 2.943 -4.290 -3.641 1.00 0.27 C ATOM 890 O CYS A 178 2.300 -4.773 -2.721 1.00 0.32 O ATOM 891 CB CYS A 178 5.080 -3.066 -3.183 1.00 0.41 C ATOM 892 SG CYS A 178 4.483 -2.449 -1.575 1.00 0.64 S ATOM 0 H CYS A 178 5.255 -3.822 -5.560 1.00 0.26 H new ATOM 0 HA CYS A 178 4.786 -5.194 -3.058 1.00 0.29 H new ATOM 0 HB2 CYS A 178 6.158 -3.209 -3.114 1.00 0.41 H new ATOM 0 HB3 CYS A 178 4.908 -2.291 -3.930 1.00 0.41 H new ATOM 897 N VAL A 179 2.373 -3.679 -4.643 1.00 0.23 N ATOM 898 CA VAL A 179 0.944 -3.660 -4.779 1.00 0.20 C ATOM 899 C VAL A 179 0.499 -5.041 -5.223 1.00 0.21 C ATOM 900 O VAL A 179 -0.538 -5.537 -4.811 1.00 0.28 O ATOM 901 CB VAL A 179 0.515 -2.559 -5.785 1.00 0.19 C ATOM 902 CG1 VAL A 179 -0.049 -3.122 -7.062 1.00 0.67 C ATOM 903 CG2 VAL A 179 -0.476 -1.618 -5.171 1.00 0.57 C ATOM 0 H VAL A 179 2.879 -3.186 -5.379 1.00 0.23 H new ATOM 0 HA VAL A 179 0.466 -3.420 -3.829 1.00 0.20 H new ATOM 0 HB VAL A 179 1.425 -2.014 -6.036 1.00 0.19 H new ATOM 0 HG11 VAL A 179 -0.331 -2.305 -7.726 1.00 0.67 H new ATOM 0 HG12 VAL A 179 0.703 -3.743 -7.549 1.00 0.67 H new ATOM 0 HG13 VAL A 179 -0.928 -3.726 -6.836 1.00 0.67 H new ATOM 0 HG21 VAL A 179 -0.757 -0.858 -5.901 1.00 0.57 H new ATOM 0 HG22 VAL A 179 -1.363 -2.173 -4.865 1.00 0.57 H new ATOM 0 HG23 VAL A 179 -0.030 -1.137 -4.300 1.00 0.57 H new ATOM 913 N ASN A 180 1.332 -5.692 -6.009 1.00 0.23 N ATOM 914 CA ASN A 180 1.026 -7.028 -6.455 1.00 0.24 C ATOM 915 C ASN A 180 0.995 -7.993 -5.302 1.00 0.25 C ATOM 916 O ASN A 180 0.264 -8.973 -5.328 1.00 0.26 O ATOM 917 CB ASN A 180 2.033 -7.514 -7.488 1.00 0.25 C ATOM 918 CG ASN A 180 1.641 -7.160 -8.911 1.00 0.48 C ATOM 919 OD1 ASN A 180 0.467 -6.946 -9.208 1.00 1.17 O ATOM 920 ND2 ASN A 180 2.615 -7.132 -9.807 1.00 1.33 N ATOM 0 H ASN A 180 2.218 -5.318 -6.348 1.00 0.23 H new ATOM 0 HA ASN A 180 0.039 -6.989 -6.915 1.00 0.24 H new ATOM 0 HB2 ASN A 180 3.009 -7.081 -7.268 1.00 0.25 H new ATOM 0 HB3 ASN A 180 2.138 -8.596 -7.404 1.00 0.25 H new ATOM 0 HD21 ASN A 180 2.404 -6.927 -10.784 1.00 1.33 H new ATOM 0 HD22 ASN A 180 3.577 -7.315 -9.521 1.00 1.33 H new ATOM 927 N ILE A 181 1.787 -7.731 -4.288 1.00 0.28 N ATOM 928 CA ILE A 181 1.764 -8.590 -3.141 1.00 0.29 C ATOM 929 C ILE A 181 0.676 -8.186 -2.161 1.00 0.27 C ATOM 930 O ILE A 181 -0.070 -9.020 -1.717 1.00 0.36 O ATOM 931 CB ILE A 181 3.137 -8.710 -2.417 1.00 0.34 C ATOM 932 CG1 ILE A 181 3.768 -7.381 -1.989 1.00 0.42 C ATOM 933 CG2 ILE A 181 4.127 -9.478 -3.267 1.00 0.52 C ATOM 934 CD1 ILE A 181 3.086 -6.733 -0.821 1.00 0.77 C ATOM 0 H ILE A 181 2.439 -6.948 -4.238 1.00 0.28 H new ATOM 0 HA ILE A 181 1.535 -9.582 -3.531 1.00 0.29 H new ATOM 0 HB ILE A 181 2.911 -9.249 -1.497 1.00 0.34 H new ATOM 0 HG12 ILE A 181 4.815 -7.551 -1.737 1.00 0.42 H new ATOM 0 HG13 ILE A 181 3.751 -6.693 -2.834 1.00 0.42 H new ATOM 0 HG21 ILE A 181 5.079 -9.550 -2.741 1.00 0.52 H new ATOM 0 HG22 ILE A 181 3.742 -10.480 -3.458 1.00 0.52 H new ATOM 0 HG23 ILE A 181 4.273 -8.958 -4.214 1.00 0.52 H new ATOM 0 HD11 ILE A 181 3.590 -5.798 -0.578 1.00 0.77 H new ATOM 0 HD12 ILE A 181 2.046 -6.529 -1.074 1.00 0.77 H new ATOM 0 HD13 ILE A 181 3.126 -7.401 0.040 1.00 0.77 H new ATOM 946 N THR A 182 0.549 -6.898 -1.902 1.00 0.27 N ATOM 947 CA THR A 182 -0.149 -6.395 -0.725 1.00 0.24 C ATOM 948 C THR A 182 -1.633 -6.373 -0.865 1.00 0.26 C ATOM 949 O THR A 182 -2.371 -6.603 0.095 1.00 0.30 O ATOM 950 CB THR A 182 0.380 -4.996 -0.401 1.00 0.22 C ATOM 951 OG1 THR A 182 0.950 -4.998 0.909 1.00 0.46 O ATOM 952 CG2 THR A 182 -0.695 -3.931 -0.502 1.00 0.30 C ATOM 0 H THR A 182 0.927 -6.165 -2.502 1.00 0.27 H new ATOM 0 HA THR A 182 0.054 -7.087 0.092 1.00 0.24 H new ATOM 0 HB THR A 182 1.140 -4.749 -1.142 1.00 0.22 H new ATOM 0 HG1 THR A 182 0.260 -4.769 1.566 1.00 0.46 H new ATOM 0 HG21 THR A 182 -0.267 -2.958 -0.262 1.00 0.30 H new ATOM 0 HG22 THR A 182 -1.094 -3.912 -1.516 1.00 0.30 H new ATOM 0 HG23 THR A 182 -1.498 -4.157 0.200 1.00 0.30 H new ATOM 960 N VAL A 183 -2.071 -6.106 -2.041 1.00 0.26 N ATOM 961 CA VAL A 183 -3.460 -6.013 -2.286 1.00 0.28 C ATOM 962 C VAL A 183 -3.959 -7.427 -2.376 1.00 0.29 C ATOM 963 O VAL A 183 -5.036 -7.759 -1.909 1.00 0.32 O ATOM 964 CB VAL A 183 -3.661 -5.218 -3.566 1.00 0.28 C ATOM 965 CG1 VAL A 183 -2.646 -4.111 -3.586 1.00 0.26 C ATOM 966 CG2 VAL A 183 -3.511 -6.101 -4.779 1.00 0.29 C ATOM 0 H VAL A 183 -1.479 -5.947 -2.856 1.00 0.26 H new ATOM 0 HA VAL A 183 -4.016 -5.494 -1.505 1.00 0.28 H new ATOM 0 HB VAL A 183 -4.669 -4.805 -3.593 1.00 0.28 H new ATOM 0 HG11 VAL A 183 -2.767 -3.523 -4.496 1.00 0.26 H new ATOM 0 HG12 VAL A 183 -2.790 -3.469 -2.717 1.00 0.26 H new ATOM 0 HG13 VAL A 183 -1.643 -4.537 -3.560 1.00 0.26 H new ATOM 0 HG21 VAL A 183 -3.660 -5.508 -5.681 1.00 0.29 H new ATOM 0 HG22 VAL A 183 -2.512 -6.536 -4.791 1.00 0.29 H new ATOM 0 HG23 VAL A 183 -4.253 -6.898 -4.743 1.00 0.29 H new ATOM 976 N LYS A 184 -3.058 -8.259 -2.884 1.00 0.30 N ATOM 977 CA LYS A 184 -3.237 -9.684 -2.989 1.00 0.32 C ATOM 978 C LYS A 184 -3.255 -10.309 -1.618 1.00 0.32 C ATOM 979 O LYS A 184 -4.169 -11.050 -1.257 1.00 0.38 O ATOM 980 CB LYS A 184 -2.091 -10.255 -3.795 1.00 0.34 C ATOM 981 CG LYS A 184 -2.445 -10.482 -5.241 1.00 0.37 C ATOM 982 CD LYS A 184 -3.112 -9.266 -5.835 1.00 1.01 C ATOM 983 CE LYS A 184 -2.327 -8.707 -7.010 1.00 1.37 C ATOM 984 NZ LYS A 184 -2.205 -9.688 -8.121 1.00 2.14 N ATOM 0 H LYS A 184 -2.158 -7.941 -3.243 1.00 0.30 H new ATOM 0 HA LYS A 184 -4.186 -9.899 -3.480 1.00 0.32 H new ATOM 0 HB2 LYS A 184 -1.240 -9.577 -3.737 1.00 0.34 H new ATOM 0 HB3 LYS A 184 -1.777 -11.199 -3.351 1.00 0.34 H new ATOM 0 HG2 LYS A 184 -1.544 -10.719 -5.806 1.00 0.37 H new ATOM 0 HG3 LYS A 184 -3.109 -11.342 -5.325 1.00 0.37 H new ATOM 0 HD2 LYS A 184 -4.118 -9.527 -6.162 1.00 1.01 H new ATOM 0 HD3 LYS A 184 -3.215 -8.498 -5.069 1.00 1.01 H new ATOM 0 HE2 LYS A 184 -2.817 -7.805 -7.376 1.00 1.37 H new ATOM 0 HE3 LYS A 184 -1.332 -8.415 -6.674 1.00 1.37 H new ATOM 0 HZ1 LYS A 184 -2.028 -9.183 -9.013 1.00 2.14 H new ATOM 0 HZ2 LYS A 184 -1.415 -10.335 -7.927 1.00 2.14 H new ATOM 0 HZ3 LYS A 184 -3.087 -10.233 -8.201 1.00 2.14 H new ATOM 998 N GLN A 185 -2.229 -9.994 -0.872 1.00 0.31 N ATOM 999 CA GLN A 185 -2.150 -10.279 0.535 1.00 0.39 C ATOM 1000 C GLN A 185 -3.506 -10.116 1.180 1.00 0.38 C ATOM 1001 O GLN A 185 -3.914 -10.916 2.006 1.00 0.44 O ATOM 1002 CB GLN A 185 -1.147 -9.305 1.140 1.00 0.56 C ATOM 1003 CG GLN A 185 0.275 -9.756 0.957 1.00 1.32 C ATOM 1004 CD GLN A 185 0.726 -10.735 2.025 1.00 1.75 C ATOM 1005 OE1 GLN A 185 1.245 -10.349 3.069 1.00 2.11 O ATOM 1006 NE2 GLN A 185 0.538 -12.019 1.763 1.00 2.02 N ATOM 0 H GLN A 185 -1.403 -9.519 -1.237 1.00 0.31 H new ATOM 0 HA GLN A 185 -1.830 -11.307 0.703 1.00 0.39 H new ATOM 0 HB2 GLN A 185 -1.276 -8.324 0.682 1.00 0.56 H new ATOM 0 HB3 GLN A 185 -1.354 -9.189 2.204 1.00 0.56 H new ATOM 0 HG2 GLN A 185 0.380 -10.221 -0.023 1.00 1.32 H new ATOM 0 HG3 GLN A 185 0.931 -8.886 0.969 1.00 1.32 H new ATOM 0 HE21 GLN A 185 0.103 -12.302 0.885 1.00 2.02 H new ATOM 0 HE22 GLN A 185 0.828 -12.725 2.439 1.00 2.02 H new ATOM 1015 N HIS A 186 -4.203 -9.085 0.747 1.00 0.36 N ATOM 1016 CA HIS A 186 -5.486 -8.726 1.292 1.00 0.44 C ATOM 1017 C HIS A 186 -6.689 -9.197 0.474 1.00 0.51 C ATOM 1018 O HIS A 186 -7.803 -9.009 0.906 1.00 0.67 O ATOM 1019 CB HIS A 186 -5.535 -7.229 1.452 1.00 0.49 C ATOM 1020 CG HIS A 186 -4.742 -6.758 2.627 1.00 0.55 C ATOM 1021 ND1 HIS A 186 -3.494 -6.199 2.506 1.00 0.73 N ATOM 1022 CD2 HIS A 186 -5.014 -6.788 3.955 1.00 1.09 C ATOM 1023 CE1 HIS A 186 -3.030 -5.903 3.702 1.00 0.65 C ATOM 1024 NE2 HIS A 186 -3.929 -6.254 4.602 1.00 0.91 N ATOM 0 H HIS A 186 -3.886 -8.469 -0.002 1.00 0.36 H new ATOM 0 HA HIS A 186 -5.571 -9.243 2.248 1.00 0.44 H new ATOM 0 HB2 HIS A 186 -5.154 -6.756 0.547 1.00 0.49 H new ATOM 0 HB3 HIS A 186 -6.572 -6.912 1.565 1.00 0.49 H new ATOM 0 HD1 HIS A 186 -3.003 -6.038 1.627 1.00 0.73 H new ATOM 0 HD2 HIS A 186 -5.916 -7.162 4.417 1.00 1.09 H new ATOM 0 HE1 HIS A 186 -2.073 -5.449 3.912 1.00 0.65 H new ATOM 1033 N THR A 187 -6.495 -9.798 -0.686 1.00 0.48 N ATOM 1034 CA THR A 187 -7.644 -10.109 -1.555 1.00 0.59 C ATOM 1035 C THR A 187 -7.630 -11.555 -2.038 1.00 0.62 C ATOM 1036 O THR A 187 -8.612 -12.065 -2.573 1.00 0.80 O ATOM 1037 CB THR A 187 -7.699 -9.163 -2.777 1.00 0.72 C ATOM 1038 OG1 THR A 187 -8.910 -9.366 -3.520 1.00 0.89 O ATOM 1039 CG2 THR A 187 -6.509 -9.385 -3.685 1.00 0.75 C ATOM 0 H THR A 187 -5.585 -10.079 -1.052 1.00 0.48 H new ATOM 0 HA THR A 187 -8.534 -9.961 -0.944 1.00 0.59 H new ATOM 0 HB THR A 187 -7.674 -8.139 -2.404 1.00 0.72 H new ATOM 0 HG1 THR A 187 -9.535 -8.635 -3.333 1.00 0.89 H new ATOM 0 HG21 THR A 187 -6.570 -8.708 -4.537 1.00 0.75 H new ATOM 0 HG22 THR A 187 -5.589 -9.191 -3.133 1.00 0.75 H new ATOM 0 HG23 THR A 187 -6.509 -10.416 -4.040 1.00 0.75 H new ATOM 1047 N VAL A 188 -6.518 -12.218 -1.828 1.00 0.55 N ATOM 1048 CA VAL A 188 -6.322 -13.569 -2.334 1.00 0.63 C ATOM 1049 C VAL A 188 -5.582 -14.396 -1.299 1.00 0.66 C ATOM 1050 O VAL A 188 -5.618 -15.627 -1.301 1.00 0.78 O ATOM 1051 CB VAL A 188 -5.577 -13.531 -3.690 1.00 0.69 C ATOM 1052 CG1 VAL A 188 -4.679 -12.341 -3.719 1.00 0.66 C ATOM 1053 CG2 VAL A 188 -4.765 -14.782 -3.973 1.00 0.84 C ATOM 0 H VAL A 188 -5.725 -11.846 -1.306 1.00 0.55 H new ATOM 0 HA VAL A 188 -7.288 -14.041 -2.512 1.00 0.63 H new ATOM 0 HB VAL A 188 -6.338 -13.472 -4.468 1.00 0.69 H new ATOM 0 HG11 VAL A 188 -4.150 -12.307 -4.672 1.00 0.66 H new ATOM 0 HG12 VAL A 188 -5.272 -11.434 -3.601 1.00 0.66 H new ATOM 0 HG13 VAL A 188 -3.957 -12.410 -2.906 1.00 0.66 H new ATOM 0 HG21 VAL A 188 -4.271 -14.684 -4.940 1.00 0.84 H new ATOM 0 HG22 VAL A 188 -4.015 -14.913 -3.193 1.00 0.84 H new ATOM 0 HG23 VAL A 188 -5.426 -15.649 -3.989 1.00 0.84 H new ATOM 1063 N THR A 189 -4.967 -13.695 -0.366 1.00 0.65 N ATOM 1064 CA THR A 189 -4.272 -14.336 0.718 1.00 0.79 C ATOM 1065 C THR A 189 -5.055 -14.119 2.004 1.00 0.83 C ATOM 1066 O THR A 189 -4.647 -14.563 3.077 1.00 1.04 O ATOM 1067 CB THR A 189 -2.834 -13.786 0.843 1.00 0.88 C ATOM 1068 OG1 THR A 189 -2.192 -13.858 -0.436 1.00 0.90 O ATOM 1069 CG2 THR A 189 -2.015 -14.573 1.858 1.00 1.12 C ATOM 0 H THR A 189 -4.938 -12.676 -0.343 1.00 0.65 H new ATOM 0 HA THR A 189 -4.196 -15.406 0.522 1.00 0.79 H new ATOM 0 HB THR A 189 -2.895 -12.753 1.187 1.00 0.88 H new ATOM 0 HG1 THR A 189 -1.279 -13.509 -0.364 1.00 0.90 H new ATOM 0 HG21 THR A 189 -1.010 -14.155 1.917 1.00 1.12 H new ATOM 0 HG22 THR A 189 -2.491 -14.511 2.836 1.00 1.12 H new ATOM 0 HG23 THR A 189 -1.957 -15.616 1.548 1.00 1.12 H new ATOM 1077 N THR A 190 -6.220 -13.475 1.889 1.00 0.73 N ATOM 1078 CA THR A 190 -6.984 -13.158 3.076 1.00 0.76 C ATOM 1079 C THR A 190 -8.342 -12.502 2.799 1.00 0.80 C ATOM 1080 O THR A 190 -9.245 -12.615 3.627 1.00 1.06 O ATOM 1081 CB THR A 190 -6.119 -12.307 4.046 1.00 0.90 C ATOM 1082 OG1 THR A 190 -6.549 -12.507 5.394 1.00 1.00 O ATOM 1083 CG2 THR A 190 -6.162 -10.819 3.736 1.00 0.93 C ATOM 0 H THR A 190 -6.637 -13.174 1.008 1.00 0.73 H new ATOM 0 HA THR A 190 -7.234 -14.108 3.549 1.00 0.76 H new ATOM 0 HB THR A 190 -5.091 -12.644 3.913 1.00 0.90 H new ATOM 0 HG1 THR A 190 -5.996 -11.967 5.997 1.00 1.00 H new ATOM 0 HG21 THR A 190 -5.538 -10.281 4.449 1.00 0.93 H new ATOM 0 HG22 THR A 190 -5.790 -10.647 2.726 1.00 0.93 H new ATOM 0 HG23 THR A 190 -7.189 -10.461 3.810 1.00 0.93 H new ATOM 1141 N GLY A 194 -12.594 -11.479 4.499 1.00 0.89 N ATOM 1142 CA GLY A 194 -13.795 -11.853 3.784 1.00 0.84 C ATOM 1143 C GLY A 194 -14.405 -10.632 3.134 1.00 0.70 C ATOM 1144 O GLY A 194 -15.599 -10.364 3.257 1.00 0.98 O ATOM 0 HA2 GLY A 194 -13.560 -12.601 3.026 1.00 0.84 H new ATOM 0 HA3 GLY A 194 -14.511 -12.307 4.469 1.00 0.84 H new ATOM 1148 N GLU A 195 -13.544 -9.869 2.488 1.00 0.54 N ATOM 1149 CA GLU A 195 -13.909 -8.629 1.830 1.00 0.62 C ATOM 1150 C GLU A 195 -13.967 -8.844 0.349 1.00 0.62 C ATOM 1151 O GLU A 195 -13.479 -9.854 -0.164 1.00 0.88 O ATOM 1152 CB GLU A 195 -12.885 -7.524 2.117 1.00 0.91 C ATOM 1153 CG GLU A 195 -13.427 -6.387 2.950 1.00 1.17 C ATOM 1154 CD GLU A 195 -14.826 -5.948 2.559 1.00 1.69 C ATOM 1155 OE1 GLU A 195 -15.012 -5.411 1.452 1.00 2.30 O ATOM 1156 OE2 GLU A 195 -15.753 -6.150 3.375 1.00 1.98 O ATOM 0 H GLU A 195 -12.554 -10.098 2.404 1.00 0.54 H new ATOM 0 HA GLU A 195 -14.882 -8.322 2.214 1.00 0.62 H new ATOM 0 HB2 GLU A 195 -12.028 -7.961 2.630 1.00 0.91 H new ATOM 0 HB3 GLU A 195 -12.520 -7.126 1.170 1.00 0.91 H new ATOM 0 HG2 GLU A 195 -13.431 -6.688 3.998 1.00 1.17 H new ATOM 0 HG3 GLU A 195 -12.753 -5.535 2.865 1.00 1.17 H new ATOM 1163 N ASN A 196 -14.548 -7.896 -0.339 1.00 0.61 N ATOM 1164 CA ASN A 196 -14.590 -7.970 -1.761 1.00 0.66 C ATOM 1165 C ASN A 196 -14.038 -6.707 -2.355 1.00 0.54 C ATOM 1166 O ASN A 196 -14.332 -5.596 -1.910 1.00 0.57 O ATOM 1167 CB ASN A 196 -15.992 -8.244 -2.306 1.00 0.92 C ATOM 1168 CG ASN A 196 -17.038 -7.271 -1.791 1.00 1.42 C ATOM 1169 OD1 ASN A 196 -17.295 -6.232 -2.404 1.00 2.09 O ATOM 1170 ND2 ASN A 196 -17.652 -7.603 -0.666 1.00 2.16 N ATOM 0 H ASN A 196 -14.993 -7.073 0.066 1.00 0.61 H new ATOM 0 HA ASN A 196 -13.972 -8.819 -2.053 1.00 0.66 H new ATOM 0 HB2 ASN A 196 -15.967 -8.197 -3.395 1.00 0.92 H new ATOM 0 HB3 ASN A 196 -16.287 -9.259 -2.038 1.00 0.92 H new ATOM 0 HD21 ASN A 196 -18.367 -6.990 -0.275 1.00 2.16 H new ATOM 0 HD22 ASN A 196 -17.410 -8.472 -0.190 1.00 2.16 H new ATOM 1177 N PHE A 197 -13.209 -6.889 -3.345 1.00 0.51 N ATOM 1178 CA PHE A 197 -12.523 -5.806 -3.959 1.00 0.42 C ATOM 1179 C PHE A 197 -13.152 -5.486 -5.298 1.00 0.43 C ATOM 1180 O PHE A 197 -13.252 -6.348 -6.169 1.00 0.47 O ATOM 1181 CB PHE A 197 -11.070 -6.205 -4.150 1.00 0.55 C ATOM 1182 CG PHE A 197 -10.294 -6.413 -2.878 1.00 1.16 C ATOM 1183 CD1 PHE A 197 -10.845 -7.129 -1.835 1.00 1.81 C ATOM 1184 CD2 PHE A 197 -9.028 -5.870 -2.713 1.00 2.03 C ATOM 1185 CE1 PHE A 197 -10.148 -7.306 -0.658 1.00 2.73 C ATOM 1186 CE2 PHE A 197 -8.330 -6.045 -1.541 1.00 2.99 C ATOM 1187 CZ PHE A 197 -8.838 -6.827 -0.556 1.00 3.21 C ATOM 0 H PHE A 197 -12.995 -7.802 -3.745 1.00 0.51 H new ATOM 0 HA PHE A 197 -12.587 -4.919 -3.328 1.00 0.42 H new ATOM 0 HB2 PHE A 197 -11.035 -7.125 -4.733 1.00 0.55 H new ATOM 0 HB3 PHE A 197 -10.572 -5.435 -4.740 1.00 0.55 H new ATOM 0 HD1 PHE A 197 -11.832 -7.555 -1.941 1.00 1.81 H new ATOM 0 HD2 PHE A 197 -8.584 -5.301 -3.517 1.00 2.03 H new ATOM 0 HE1 PHE A 197 -10.610 -7.810 0.178 1.00 2.73 H new ATOM 0 HE2 PHE A 197 -7.375 -5.559 -1.405 1.00 2.99 H new ATOM 0 HZ PHE A 197 -8.234 -7.079 0.303 1.00 3.21 H new ATOM 1197 N THR A 198 -13.581 -4.258 -5.457 1.00 0.47 N ATOM 1198 CA THR A 198 -14.016 -3.788 -6.746 1.00 0.50 C ATOM 1199 C THR A 198 -12.888 -2.963 -7.326 1.00 0.48 C ATOM 1200 O THR A 198 -11.955 -2.639 -6.606 1.00 0.45 O ATOM 1201 CB THR A 198 -15.325 -2.968 -6.645 1.00 0.54 C ATOM 1202 OG1 THR A 198 -15.874 -2.741 -7.946 1.00 0.61 O ATOM 1203 CG2 THR A 198 -15.092 -1.630 -5.957 1.00 0.49 C ATOM 0 H THR A 198 -13.638 -3.567 -4.709 1.00 0.47 H new ATOM 0 HA THR A 198 -14.244 -4.632 -7.397 1.00 0.50 H new ATOM 0 HB THR A 198 -16.028 -3.548 -6.047 1.00 0.54 H new ATOM 0 HG1 THR A 198 -16.702 -2.223 -7.866 1.00 0.61 H new ATOM 0 HG21 THR A 198 -16.032 -1.080 -5.903 1.00 0.49 H new ATOM 0 HG22 THR A 198 -14.713 -1.800 -4.949 1.00 0.49 H new ATOM 0 HG23 THR A 198 -14.365 -1.050 -6.525 1.00 0.49 H new ATOM 1211 N GLU A 199 -12.919 -2.654 -8.613 1.00 0.51 N ATOM 1212 CA GLU A 199 -11.839 -1.878 -9.213 1.00 0.50 C ATOM 1213 C GLU A 199 -11.715 -0.518 -8.546 1.00 0.44 C ATOM 1214 O GLU A 199 -10.760 0.182 -8.775 1.00 0.43 O ATOM 1215 CB GLU A 199 -12.028 -1.659 -10.706 1.00 0.53 C ATOM 1216 CG GLU A 199 -10.716 -1.391 -11.420 1.00 0.54 C ATOM 1217 CD GLU A 199 -10.917 -0.937 -12.850 1.00 0.58 C ATOM 1218 OE1 GLU A 199 -11.103 0.279 -13.073 1.00 0.62 O ATOM 1219 OE2 GLU A 199 -10.905 -1.797 -13.758 1.00 0.76 O ATOM 0 H GLU A 199 -13.665 -2.922 -9.255 1.00 0.51 H new ATOM 0 HA GLU A 199 -10.933 -2.465 -9.061 1.00 0.50 H new ATOM 0 HB2 GLU A 199 -12.504 -2.537 -11.142 1.00 0.53 H new ATOM 0 HB3 GLU A 199 -12.704 -0.819 -10.865 1.00 0.53 H new ATOM 0 HG2 GLU A 199 -10.159 -0.629 -10.875 1.00 0.54 H new ATOM 0 HG3 GLU A 199 -10.110 -2.297 -11.411 1.00 0.54 H new ATOM 1226 N THR A 200 -12.702 -0.145 -7.758 1.00 0.44 N ATOM 1227 CA THR A 200 -12.626 1.031 -6.923 1.00 0.38 C ATOM 1228 C THR A 200 -11.897 0.700 -5.639 1.00 0.33 C ATOM 1229 O THR A 200 -11.032 1.433 -5.219 1.00 0.28 O ATOM 1230 CB THR A 200 -14.010 1.581 -6.564 1.00 0.42 C ATOM 1231 OG1 THR A 200 -14.748 1.885 -7.755 1.00 0.51 O ATOM 1232 CG2 THR A 200 -13.866 2.821 -5.701 1.00 0.45 C ATOM 0 H THR A 200 -13.583 -0.653 -7.680 1.00 0.44 H new ATOM 0 HA THR A 200 -12.091 1.791 -7.492 1.00 0.38 H new ATOM 0 HB THR A 200 -14.557 0.823 -6.003 1.00 0.42 H new ATOM 0 HG1 THR A 200 -15.631 2.234 -7.513 1.00 0.51 H new ATOM 0 HG21 THR A 200 -14.854 3.206 -5.450 1.00 0.45 H new ATOM 0 HG22 THR A 200 -13.332 2.567 -4.785 1.00 0.45 H new ATOM 0 HG23 THR A 200 -13.308 3.582 -6.247 1.00 0.45 H new ATOM 1240 N ASP A 201 -12.211 -0.453 -5.065 1.00 0.37 N ATOM 1241 CA ASP A 201 -11.588 -0.892 -3.814 1.00 0.34 C ATOM 1242 C ASP A 201 -10.158 -1.218 -4.118 1.00 0.31 C ATOM 1243 O ASP A 201 -9.263 -1.218 -3.273 1.00 0.28 O ATOM 1244 CB ASP A 201 -12.261 -2.135 -3.223 1.00 0.37 C ATOM 1245 CG ASP A 201 -13.630 -1.866 -2.639 1.00 0.41 C ATOM 1246 OD1 ASP A 201 -13.731 -1.073 -1.688 1.00 0.56 O ATOM 1247 OD2 ASP A 201 -14.609 -2.473 -3.114 1.00 0.50 O ATOM 0 H ASP A 201 -12.896 -1.107 -5.444 1.00 0.37 H new ATOM 0 HA ASP A 201 -11.687 -0.093 -3.079 1.00 0.34 H new ATOM 0 HB2 ASP A 201 -12.350 -2.893 -4.001 1.00 0.37 H new ATOM 0 HB3 ASP A 201 -11.619 -2.550 -2.446 1.00 0.37 H new ATOM 1252 N ILE A 202 -9.973 -1.484 -5.370 1.00 0.35 N ATOM 1253 CA ILE A 202 -8.715 -1.852 -5.887 1.00 0.36 C ATOM 1254 C ILE A 202 -8.021 -0.674 -6.426 1.00 0.33 C ATOM 1255 O ILE A 202 -6.801 -0.579 -6.357 1.00 0.34 O ATOM 1256 CB ILE A 202 -8.913 -2.874 -6.982 1.00 0.44 C ATOM 1257 CG1 ILE A 202 -7.976 -4.021 -6.785 1.00 0.50 C ATOM 1258 CG2 ILE A 202 -8.664 -2.279 -8.358 1.00 0.48 C ATOM 1259 CD1 ILE A 202 -7.508 -4.128 -5.376 1.00 0.59 C ATOM 0 H ILE A 202 -10.715 -1.448 -6.069 1.00 0.35 H new ATOM 0 HA ILE A 202 -8.107 -2.278 -5.089 1.00 0.36 H new ATOM 0 HB ILE A 202 -9.948 -3.211 -6.927 1.00 0.44 H new ATOM 0 HG12 ILE A 202 -8.473 -4.948 -7.073 1.00 0.50 H new ATOM 0 HG13 ILE A 202 -7.116 -3.903 -7.444 1.00 0.50 H new ATOM 0 HG21 ILE A 202 -8.816 -3.045 -9.119 1.00 0.48 H new ATOM 0 HG22 ILE A 202 -9.357 -1.455 -8.529 1.00 0.48 H new ATOM 0 HG23 ILE A 202 -7.640 -1.910 -8.415 1.00 0.48 H new ATOM 0 HD11 ILE A 202 -6.829 -4.976 -5.281 1.00 0.59 H new ATOM 0 HD12 ILE A 202 -6.987 -3.213 -5.095 1.00 0.59 H new ATOM 0 HD13 ILE A 202 -8.365 -4.274 -4.718 1.00 0.59 H new ATOM 1271 N LYS A 203 -8.799 0.249 -6.947 1.00 0.33 N ATOM 1272 CA LYS A 203 -8.215 1.438 -7.426 1.00 0.33 C ATOM 1273 C LYS A 203 -7.659 2.146 -6.233 1.00 0.28 C ATOM 1274 O LYS A 203 -6.803 3.007 -6.314 1.00 0.32 O ATOM 1275 CB LYS A 203 -9.194 2.310 -8.179 1.00 0.33 C ATOM 1276 CG LYS A 203 -10.099 3.145 -7.304 1.00 0.29 C ATOM 1277 CD LYS A 203 -11.136 3.918 -8.115 1.00 0.34 C ATOM 1278 CE LYS A 203 -10.539 5.114 -8.853 1.00 1.13 C ATOM 1279 NZ LYS A 203 -9.677 4.715 -9.997 1.00 1.93 N ATOM 0 H LYS A 203 -9.813 0.184 -7.040 1.00 0.33 H new ATOM 0 HA LYS A 203 -7.434 1.205 -8.150 1.00 0.33 H new ATOM 0 HB2 LYS A 203 -8.635 2.974 -8.838 1.00 0.33 H new ATOM 0 HB3 LYS A 203 -9.811 1.675 -8.815 1.00 0.33 H new ATOM 0 HG2 LYS A 203 -10.608 2.498 -6.590 1.00 0.29 H new ATOM 0 HG3 LYS A 203 -9.497 3.846 -6.726 1.00 0.29 H new ATOM 0 HD2 LYS A 203 -11.600 3.246 -8.837 1.00 0.34 H new ATOM 0 HD3 LYS A 203 -11.926 4.265 -7.449 1.00 0.34 H new ATOM 0 HE2 LYS A 203 -11.346 5.750 -9.217 1.00 1.13 H new ATOM 0 HE3 LYS A 203 -9.953 5.711 -8.154 1.00 1.13 H new ATOM 0 HZ1 LYS A 203 -9.854 5.349 -10.802 1.00 1.93 H new ATOM 0 HZ2 LYS A 203 -8.677 4.780 -9.718 1.00 1.93 H new ATOM 0 HZ3 LYS A 203 -9.896 3.736 -10.272 1.00 1.93 H new ATOM 1293 N ILE A 204 -8.176 1.681 -5.118 1.00 0.24 N ATOM 1294 CA ILE A 204 -7.769 2.060 -3.827 1.00 0.22 C ATOM 1295 C ILE A 204 -6.393 1.534 -3.610 1.00 0.22 C ATOM 1296 O ILE A 204 -5.464 2.293 -3.556 1.00 0.25 O ATOM 1297 CB ILE A 204 -8.711 1.466 -2.786 1.00 0.24 C ATOM 1298 CG1 ILE A 204 -10.044 2.185 -2.821 1.00 0.27 C ATOM 1299 CG2 ILE A 204 -8.086 1.473 -1.420 1.00 0.32 C ATOM 1300 CD1 ILE A 204 -10.956 1.850 -1.691 1.00 0.30 C ATOM 0 H ILE A 204 -8.930 0.994 -5.111 1.00 0.24 H new ATOM 0 HA ILE A 204 -7.787 3.146 -3.731 1.00 0.22 H new ATOM 0 HB ILE A 204 -8.896 0.420 -3.031 1.00 0.24 H new ATOM 0 HG12 ILE A 204 -9.863 3.260 -2.819 1.00 0.27 H new ATOM 0 HG13 ILE A 204 -10.546 1.948 -3.759 1.00 0.27 H new ATOM 0 HG21 ILE A 204 -8.782 1.043 -0.699 1.00 0.32 H new ATOM 0 HG22 ILE A 204 -7.170 0.883 -1.436 1.00 0.32 H new ATOM 0 HG23 ILE A 204 -7.852 2.498 -1.132 1.00 0.32 H new ATOM 0 HD11 ILE A 204 -11.886 2.409 -1.796 1.00 0.30 H new ATOM 0 HD12 ILE A 204 -11.172 0.782 -1.702 1.00 0.30 H new ATOM 0 HD13 ILE A 204 -10.478 2.114 -0.747 1.00 0.30 H new ATOM 1312 N MET A 205 -6.235 0.225 -3.581 1.00 0.21 N ATOM 1313 CA MET A 205 -4.941 -0.331 -3.302 1.00 0.21 C ATOM 1314 C MET A 205 -3.958 -0.002 -4.381 1.00 0.22 C ATOM 1315 O MET A 205 -2.784 -0.254 -4.250 1.00 0.26 O ATOM 1316 CB MET A 205 -4.988 -1.829 -3.086 1.00 0.22 C ATOM 1317 CG MET A 205 -4.747 -2.212 -1.643 1.00 0.27 C ATOM 1318 SD MET A 205 -5.715 -3.645 -1.173 1.00 0.32 S ATOM 1319 CE MET A 205 -7.279 -3.160 -1.887 1.00 0.42 C ATOM 0 H MET A 205 -6.976 -0.456 -3.745 1.00 0.21 H new ATOM 0 HA MET A 205 -4.609 0.129 -2.371 1.00 0.21 H new ATOM 0 HB2 MET A 205 -5.960 -2.208 -3.402 1.00 0.22 H new ATOM 0 HB3 MET A 205 -4.238 -2.308 -3.716 1.00 0.22 H new ATOM 0 HG2 MET A 205 -3.688 -2.422 -1.493 1.00 0.27 H new ATOM 0 HG3 MET A 205 -5.000 -1.372 -0.996 1.00 0.27 H new ATOM 0 HE1 MET A 205 -8.094 -3.557 -1.282 1.00 0.42 H new ATOM 0 HE2 MET A 205 -7.344 -2.072 -1.915 1.00 0.42 H new ATOM 0 HE3 MET A 205 -7.354 -3.555 -2.900 1.00 0.42 H new ATOM 1329 N GLU A 206 -4.428 0.600 -5.426 1.00 0.23 N ATOM 1330 CA GLU A 206 -3.549 1.001 -6.462 1.00 0.28 C ATOM 1331 C GLU A 206 -3.192 2.446 -6.250 1.00 0.30 C ATOM 1332 O GLU A 206 -2.143 2.916 -6.638 1.00 0.38 O ATOM 1333 CB GLU A 206 -4.148 0.742 -7.822 1.00 0.32 C ATOM 1334 CG GLU A 206 -4.263 -0.739 -8.066 1.00 0.34 C ATOM 1335 CD GLU A 206 -4.539 -1.070 -9.520 1.00 0.49 C ATOM 1336 OE1 GLU A 206 -5.464 -0.470 -10.108 1.00 0.54 O ATOM 1337 OE2 GLU A 206 -3.807 -1.905 -10.101 1.00 0.90 O ATOM 0 H GLU A 206 -5.412 0.821 -5.579 1.00 0.23 H new ATOM 0 HA GLU A 206 -2.635 0.408 -6.428 1.00 0.28 H new ATOM 0 HB2 GLU A 206 -5.132 1.206 -7.888 1.00 0.32 H new ATOM 0 HB3 GLU A 206 -3.528 1.198 -8.594 1.00 0.32 H new ATOM 0 HG2 GLU A 206 -3.340 -1.228 -7.755 1.00 0.34 H new ATOM 0 HG3 GLU A 206 -5.063 -1.145 -7.447 1.00 0.34 H new ATOM 1344 N ARG A 207 -4.051 3.132 -5.543 1.00 0.26 N ATOM 1345 CA ARG A 207 -3.834 4.522 -5.287 1.00 0.30 C ATOM 1346 C ARG A 207 -3.147 4.701 -3.956 1.00 0.31 C ATOM 1347 O ARG A 207 -2.256 5.529 -3.822 1.00 0.40 O ATOM 1348 CB ARG A 207 -5.153 5.283 -5.349 1.00 0.33 C ATOM 1349 CG ARG A 207 -6.126 4.919 -4.250 1.00 0.38 C ATOM 1350 CD ARG A 207 -7.512 5.417 -4.563 1.00 0.84 C ATOM 1351 NE ARG A 207 -7.554 6.868 -4.730 1.00 1.28 N ATOM 1352 CZ ARG A 207 -7.736 7.482 -5.905 1.00 1.93 C ATOM 1353 NH1 ARG A 207 -7.856 6.776 -7.024 1.00 2.42 N ATOM 1354 NH2 ARG A 207 -7.774 8.809 -5.963 1.00 2.55 N ATOM 0 H ARG A 207 -4.904 2.748 -5.137 1.00 0.26 H new ATOM 0 HA ARG A 207 -3.181 4.933 -6.057 1.00 0.30 H new ATOM 0 HB2 ARG A 207 -4.946 6.352 -5.298 1.00 0.33 H new ATOM 0 HB3 ARG A 207 -5.624 5.095 -6.314 1.00 0.33 H new ATOM 0 HG2 ARG A 207 -6.146 3.837 -4.122 1.00 0.38 H new ATOM 0 HG3 ARG A 207 -5.788 5.346 -3.306 1.00 0.38 H new ATOM 0 HD2 ARG A 207 -7.871 4.938 -5.474 1.00 0.84 H new ATOM 0 HD3 ARG A 207 -8.190 5.126 -3.761 1.00 0.84 H new ATOM 0 HE ARG A 207 -7.437 7.449 -3.900 1.00 1.28 H new ATOM 0 HH11 ARG A 207 -7.810 5.758 -6.992 1.00 2.42 H new ATOM 0 HH12 ARG A 207 -7.995 7.252 -7.915 1.00 2.42 H new ATOM 0 HH21 ARG A 207 -7.664 9.360 -5.112 1.00 2.55 H new ATOM 0 HH22 ARG A 207 -7.913 9.277 -6.859 1.00 2.55 H new ATOM 1368 N VAL A 208 -3.538 3.907 -2.973 1.00 0.29 N ATOM 1369 CA VAL A 208 -2.844 3.936 -1.715 1.00 0.31 C ATOM 1370 C VAL A 208 -1.509 3.320 -1.900 1.00 0.34 C ATOM 1371 O VAL A 208 -0.508 3.978 -1.792 1.00 0.50 O ATOM 1372 CB VAL A 208 -3.527 3.180 -0.554 1.00 0.44 C ATOM 1373 CG1 VAL A 208 -3.686 4.068 0.660 1.00 0.30 C ATOM 1374 CG2 VAL A 208 -4.842 2.606 -0.973 1.00 0.80 C ATOM 0 H VAL A 208 -4.317 3.250 -3.027 1.00 0.29 H new ATOM 0 HA VAL A 208 -2.816 4.988 -1.432 1.00 0.31 H new ATOM 0 HB VAL A 208 -2.876 2.350 -0.279 1.00 0.44 H new ATOM 0 HG11 VAL A 208 -4.170 3.507 1.460 1.00 0.30 H new ATOM 0 HG12 VAL A 208 -2.705 4.405 0.995 1.00 0.30 H new ATOM 0 HG13 VAL A 208 -4.298 4.932 0.401 1.00 0.30 H new ATOM 0 HG21 VAL A 208 -5.295 2.081 -0.132 1.00 0.80 H new ATOM 0 HG22 VAL A 208 -5.503 3.410 -1.297 1.00 0.80 H new ATOM 0 HG23 VAL A 208 -4.689 1.908 -1.796 1.00 0.80 H new ATOM 1384 N VAL A 209 -1.552 2.072 -2.283 1.00 0.28 N ATOM 1385 CA VAL A 209 -0.429 1.185 -2.229 1.00 0.31 C ATOM 1386 C VAL A 209 0.548 1.399 -3.379 1.00 0.29 C ATOM 1387 O VAL A 209 1.755 1.390 -3.162 1.00 0.30 O ATOM 1388 CB VAL A 209 -0.926 -0.258 -2.232 1.00 0.38 C ATOM 1389 CG1 VAL A 209 0.207 -1.230 -2.252 1.00 0.89 C ATOM 1390 CG2 VAL A 209 -1.832 -0.536 -1.056 1.00 0.88 C ATOM 0 H VAL A 209 -2.397 1.635 -2.652 1.00 0.28 H new ATOM 0 HA VAL A 209 0.114 1.400 -1.309 1.00 0.31 H new ATOM 0 HB VAL A 209 -1.504 -0.390 -3.147 1.00 0.38 H new ATOM 0 HG11 VAL A 209 -0.186 -2.247 -2.254 1.00 0.89 H new ATOM 0 HG12 VAL A 209 0.807 -1.071 -3.148 1.00 0.89 H new ATOM 0 HG13 VAL A 209 0.829 -1.083 -1.369 1.00 0.89 H new ATOM 0 HG21 VAL A 209 -2.166 -1.573 -1.091 1.00 0.88 H new ATOM 0 HG22 VAL A 209 -1.287 -0.362 -0.128 1.00 0.88 H new ATOM 0 HG23 VAL A 209 -2.697 0.126 -1.099 1.00 0.88 H new ATOM 1400 N GLU A 210 0.062 1.610 -4.597 1.00 0.28 N ATOM 1401 CA GLU A 210 0.980 1.781 -5.707 1.00 0.29 C ATOM 1402 C GLU A 210 1.704 3.106 -5.531 1.00 0.24 C ATOM 1403 O GLU A 210 2.915 3.208 -5.708 1.00 0.25 O ATOM 1404 CB GLU A 210 0.233 1.697 -7.033 1.00 0.34 C ATOM 1405 CG GLU A 210 1.111 1.495 -8.268 1.00 0.63 C ATOM 1406 CD GLU A 210 1.915 2.716 -8.660 1.00 0.87 C ATOM 1407 OE1 GLU A 210 1.311 3.796 -8.815 1.00 1.16 O ATOM 1408 OE2 GLU A 210 3.155 2.612 -8.790 1.00 1.62 O ATOM 0 H GLU A 210 -0.929 1.665 -4.833 1.00 0.28 H new ATOM 0 HA GLU A 210 1.720 0.981 -5.720 1.00 0.29 H new ATOM 0 HB2 GLU A 210 -0.481 0.875 -6.977 1.00 0.34 H new ATOM 0 HB3 GLU A 210 -0.344 2.612 -7.164 1.00 0.34 H new ATOM 0 HG2 GLU A 210 1.795 0.667 -8.083 1.00 0.63 H new ATOM 0 HG3 GLU A 210 0.478 1.205 -9.107 1.00 0.63 H new ATOM 1415 N GLN A 211 0.961 4.106 -5.110 1.00 0.23 N ATOM 1416 CA GLN A 211 1.548 5.379 -4.762 1.00 0.23 C ATOM 1417 C GLN A 211 2.296 5.269 -3.440 1.00 0.22 C ATOM 1418 O GLN A 211 3.226 6.025 -3.181 1.00 0.25 O ATOM 1419 CB GLN A 211 0.463 6.435 -4.644 1.00 0.29 C ATOM 1420 CG GLN A 211 0.968 7.808 -4.229 1.00 0.34 C ATOM 1421 CD GLN A 211 -0.104 8.883 -4.318 1.00 0.79 C ATOM 1422 OE1 GLN A 211 -1.024 8.795 -5.132 1.00 1.49 O ATOM 1423 NE2 GLN A 211 0.017 9.908 -3.488 1.00 1.68 N ATOM 0 H GLN A 211 -0.052 4.061 -5.001 1.00 0.23 H new ATOM 0 HA GLN A 211 2.249 5.666 -5.546 1.00 0.23 H new ATOM 0 HB2 GLN A 211 -0.048 6.523 -5.603 1.00 0.29 H new ATOM 0 HB3 GLN A 211 -0.278 6.099 -3.918 1.00 0.29 H new ATOM 0 HG2 GLN A 211 1.342 7.758 -3.206 1.00 0.34 H new ATOM 0 HG3 GLN A 211 1.809 8.087 -4.863 1.00 0.34 H new ATOM 0 HE21 GLN A 211 0.795 9.942 -2.829 1.00 1.68 H new ATOM 0 HE22 GLN A 211 -0.668 10.664 -3.508 1.00 1.68 H new ATOM 1432 N MET A 212 1.889 4.325 -2.597 1.00 0.27 N ATOM 1433 CA MET A 212 2.497 4.192 -1.289 1.00 0.32 C ATOM 1434 C MET A 212 3.869 3.607 -1.428 1.00 0.25 C ATOM 1435 O MET A 212 4.840 4.157 -0.927 1.00 0.22 O ATOM 1436 CB MET A 212 1.650 3.358 -0.299 1.00 0.48 C ATOM 1437 CG MET A 212 2.011 1.875 -0.136 1.00 1.72 C ATOM 1438 SD MET A 212 3.615 1.594 0.649 1.00 1.89 S ATOM 1439 CE MET A 212 3.739 3.031 1.684 1.00 0.30 C ATOM 0 H MET A 212 1.150 3.651 -2.798 1.00 0.27 H new ATOM 0 HA MET A 212 2.558 5.194 -0.864 1.00 0.32 H new ATOM 0 HB2 MET A 212 1.715 3.830 0.681 1.00 0.48 H new ATOM 0 HB3 MET A 212 0.608 3.419 -0.613 1.00 0.48 H new ATOM 0 HG2 MET A 212 1.237 1.386 0.456 1.00 1.72 H new ATOM 0 HG3 MET A 212 2.010 1.401 -1.117 1.00 1.72 H new ATOM 0 HE1 MET A 212 4.118 2.742 2.664 1.00 0.30 H new ATOM 0 HE2 MET A 212 4.421 3.749 1.229 1.00 0.30 H new ATOM 0 HE3 MET A 212 2.754 3.485 1.795 1.00 0.30 H new ATOM 1449 N CYS A 213 3.962 2.482 -2.101 1.00 0.27 N ATOM 1450 CA CYS A 213 5.218 1.815 -2.193 1.00 0.24 C ATOM 1451 C CYS A 213 6.126 2.714 -3.032 1.00 0.23 C ATOM 1452 O CYS A 213 7.336 2.730 -2.862 1.00 0.25 O ATOM 1453 CB CYS A 213 5.038 0.387 -2.755 1.00 0.27 C ATOM 1454 SG CYS A 213 3.715 -0.594 -1.952 1.00 0.68 S ATOM 0 H CYS A 213 3.188 2.024 -2.583 1.00 0.27 H new ATOM 0 HA CYS A 213 5.682 1.663 -1.218 1.00 0.24 H new ATOM 0 HB2 CYS A 213 4.823 0.456 -3.821 1.00 0.27 H new ATOM 0 HB3 CYS A 213 5.981 -0.150 -2.654 1.00 0.27 H new ATOM 1459 N ILE A 214 5.509 3.515 -3.913 1.00 0.23 N ATOM 1460 CA ILE A 214 6.224 4.568 -4.639 1.00 0.24 C ATOM 1461 C ILE A 214 6.699 5.625 -3.670 1.00 0.25 C ATOM 1462 O ILE A 214 7.798 6.148 -3.790 1.00 0.30 O ATOM 1463 CB ILE A 214 5.330 5.245 -5.709 1.00 0.24 C ATOM 1464 CG1 ILE A 214 5.767 4.855 -7.114 1.00 0.30 C ATOM 1465 CG2 ILE A 214 5.371 6.757 -5.579 1.00 0.26 C ATOM 1466 CD1 ILE A 214 5.827 3.375 -7.321 1.00 0.34 C ATOM 0 H ILE A 214 4.516 3.451 -4.138 1.00 0.23 H new ATOM 0 HA ILE A 214 7.069 4.097 -5.142 1.00 0.24 H new ATOM 0 HB ILE A 214 4.310 4.898 -5.541 1.00 0.24 H new ATOM 0 HG12 ILE A 214 5.076 5.289 -7.836 1.00 0.30 H new ATOM 0 HG13 ILE A 214 6.749 5.284 -7.315 1.00 0.30 H new ATOM 0 HG21 ILE A 214 4.735 7.205 -6.342 1.00 0.26 H new ATOM 0 HG22 ILE A 214 5.012 7.047 -4.591 1.00 0.26 H new ATOM 0 HG23 ILE A 214 6.395 7.106 -5.710 1.00 0.26 H new ATOM 0 HD11 ILE A 214 6.145 3.163 -8.342 1.00 0.34 H new ATOM 0 HD12 ILE A 214 6.539 2.938 -6.621 1.00 0.34 H new ATOM 0 HD13 ILE A 214 4.841 2.944 -7.151 1.00 0.34 H new ATOM 1478 N THR A 215 5.847 5.950 -2.719 1.00 0.25 N ATOM 1479 CA THR A 215 6.195 6.911 -1.720 1.00 0.27 C ATOM 1480 C THR A 215 7.406 6.399 -0.956 1.00 0.26 C ATOM 1481 O THR A 215 8.231 7.174 -0.553 1.00 0.33 O ATOM 1482 CB THR A 215 5.003 7.219 -0.779 1.00 0.29 C ATOM 1483 OG1 THR A 215 4.843 8.637 -0.644 1.00 0.37 O ATOM 1484 CG2 THR A 215 5.200 6.597 0.591 1.00 0.31 C ATOM 0 H THR A 215 4.911 5.557 -2.626 1.00 0.25 H new ATOM 0 HA THR A 215 6.448 7.857 -2.199 1.00 0.27 H new ATOM 0 HB THR A 215 4.107 6.786 -1.223 1.00 0.29 H new ATOM 0 HG1 THR A 215 4.087 8.826 -0.049 1.00 0.37 H new ATOM 0 HG21 THR A 215 4.345 6.834 1.224 1.00 0.31 H new ATOM 0 HG22 THR A 215 5.289 5.515 0.490 1.00 0.31 H new ATOM 0 HG23 THR A 215 6.108 6.995 1.044 1.00 0.31 H new ATOM 1492 N GLN A 216 7.505 5.084 -0.771 1.00 0.23 N ATOM 1493 CA GLN A 216 8.721 4.469 -0.248 1.00 0.25 C ATOM 1494 C GLN A 216 9.938 4.738 -1.136 1.00 0.31 C ATOM 1495 O GLN A 216 11.040 4.863 -0.626 1.00 0.39 O ATOM 1496 CB GLN A 216 8.592 2.964 -0.092 1.00 0.25 C ATOM 1497 CG GLN A 216 7.390 2.506 0.715 1.00 0.28 C ATOM 1498 CD GLN A 216 7.485 2.882 2.180 1.00 0.88 C ATOM 1499 OE1 GLN A 216 6.478 3.070 2.851 1.00 1.69 O ATOM 1500 NE2 GLN A 216 8.699 3.002 2.690 1.00 1.58 N ATOM 0 H GLN A 216 6.755 4.424 -0.976 1.00 0.23 H new ATOM 0 HA GLN A 216 8.865 4.930 0.729 1.00 0.25 H new ATOM 0 HB2 GLN A 216 8.539 2.514 -1.083 1.00 0.25 H new ATOM 0 HB3 GLN A 216 9.496 2.584 0.383 1.00 0.25 H new ATOM 0 HG2 GLN A 216 6.486 2.943 0.291 1.00 0.28 H new ATOM 0 HG3 GLN A 216 7.292 1.424 0.628 1.00 0.28 H new ATOM 0 HE21 GLN A 216 9.517 2.838 2.103 1.00 1.58 H new ATOM 0 HE22 GLN A 216 8.817 3.258 3.670 1.00 1.58 H new ATOM 1509 N TYR A 217 9.760 4.799 -2.457 1.00 0.38 N ATOM 1510 CA TYR A 217 10.880 5.126 -3.358 1.00 0.49 C ATOM 1511 C TYR A 217 11.591 6.364 -2.811 1.00 0.49 C ATOM 1512 O TYR A 217 12.821 6.459 -2.815 1.00 0.57 O ATOM 1513 CB TYR A 217 10.376 5.394 -4.787 1.00 0.73 C ATOM 1514 CG TYR A 217 11.469 5.692 -5.796 1.00 0.85 C ATOM 1515 CD1 TYR A 217 12.096 4.667 -6.489 1.00 0.97 C ATOM 1516 CD2 TYR A 217 11.868 6.998 -6.061 1.00 1.07 C ATOM 1517 CE1 TYR A 217 13.091 4.931 -7.413 1.00 1.18 C ATOM 1518 CE2 TYR A 217 12.862 7.270 -6.982 1.00 1.29 C ATOM 1519 CZ TYR A 217 13.470 6.233 -7.656 1.00 1.31 C ATOM 1520 OH TYR A 217 14.461 6.498 -8.576 1.00 1.56 O ATOM 0 H TYR A 217 8.870 4.631 -2.926 1.00 0.38 H new ATOM 0 HA TYR A 217 11.569 4.282 -3.403 1.00 0.49 H new ATOM 0 HB2 TYR A 217 9.812 4.526 -5.128 1.00 0.73 H new ATOM 0 HB3 TYR A 217 9.683 6.235 -4.762 1.00 0.73 H new ATOM 0 HD1 TYR A 217 11.802 3.644 -6.304 1.00 0.97 H new ATOM 0 HD2 TYR A 217 11.392 7.814 -5.538 1.00 1.07 H new ATOM 0 HE1 TYR A 217 13.569 4.120 -7.942 1.00 1.18 H new ATOM 0 HE2 TYR A 217 13.161 8.290 -7.173 1.00 1.29 H new ATOM 0 HH TYR A 217 14.608 7.466 -8.629 1.00 1.56 H new ATOM 1530 N GLN A 218 10.774 7.293 -2.327 1.00 0.46 N ATOM 1531 CA GLN A 218 11.253 8.511 -1.678 1.00 0.51 C ATOM 1532 C GLN A 218 11.291 8.409 -0.137 1.00 0.50 C ATOM 1533 O GLN A 218 12.063 9.109 0.518 1.00 0.61 O ATOM 1534 CB GLN A 218 10.365 9.690 -2.092 1.00 0.53 C ATOM 1535 CG GLN A 218 8.892 9.343 -2.244 1.00 0.48 C ATOM 1536 CD GLN A 218 8.006 10.566 -2.348 1.00 0.72 C ATOM 1537 OE1 GLN A 218 8.417 11.610 -2.854 1.00 1.31 O ATOM 1538 NE2 GLN A 218 6.784 10.451 -1.855 1.00 1.52 N ATOM 0 H GLN A 218 9.757 7.224 -2.373 1.00 0.46 H new ATOM 0 HA GLN A 218 12.281 8.663 -2.008 1.00 0.51 H new ATOM 0 HB2 GLN A 218 10.465 10.482 -1.350 1.00 0.53 H new ATOM 0 HB3 GLN A 218 10.731 10.091 -3.037 1.00 0.53 H new ATOM 0 HG2 GLN A 218 8.759 8.728 -3.134 1.00 0.48 H new ATOM 0 HG3 GLN A 218 8.575 8.743 -1.391 1.00 0.48 H new ATOM 0 HE21 GLN A 218 6.481 9.568 -1.444 1.00 1.52 H new ATOM 0 HE22 GLN A 218 6.145 11.245 -1.886 1.00 1.52 H new ATOM 1547 N GLN A 219 10.430 7.581 0.447 1.00 0.40 N ATOM 1548 CA GLN A 219 10.239 7.579 1.894 1.00 0.41 C ATOM 1549 C GLN A 219 10.964 6.442 2.584 1.00 0.39 C ATOM 1550 O GLN A 219 11.192 6.468 3.792 1.00 0.46 O ATOM 1551 CB GLN A 219 8.767 7.620 2.295 1.00 0.45 C ATOM 1552 CG GLN A 219 8.137 6.273 2.567 1.00 0.44 C ATOM 1553 CD GLN A 219 6.890 6.418 3.422 1.00 0.81 C ATOM 1554 OE1 GLN A 219 6.203 7.437 3.363 1.00 1.64 O ATOM 1555 NE2 GLN A 219 6.600 5.419 4.236 1.00 1.26 N ATOM 0 H GLN A 219 9.856 6.905 -0.057 1.00 0.40 H new ATOM 0 HA GLN A 219 10.694 8.505 2.244 1.00 0.41 H new ATOM 0 HB2 GLN A 219 8.667 8.237 3.188 1.00 0.45 H new ATOM 0 HB3 GLN A 219 8.204 8.113 1.502 1.00 0.45 H new ATOM 0 HG2 GLN A 219 7.881 5.790 1.624 1.00 0.44 H new ATOM 0 HG3 GLN A 219 8.855 5.627 3.072 1.00 0.44 H new ATOM 0 HE21 GLN A 219 7.193 4.590 4.257 1.00 1.26 H new ATOM 0 HE22 GLN A 219 5.783 5.477 4.843 1.00 1.26 H new ATOM 1564 N GLU A 220 11.306 5.436 1.828 1.00 0.35 N ATOM 1565 CA GLU A 220 12.090 4.350 2.342 1.00 0.39 C ATOM 1566 C GLU A 220 13.541 4.679 2.134 1.00 0.48 C ATOM 1567 O GLU A 220 14.401 4.064 2.710 1.00 0.55 O ATOM 1568 CB GLU A 220 11.706 3.046 1.670 1.00 0.50 C ATOM 1569 CG GLU A 220 12.398 1.811 2.217 1.00 1.11 C ATOM 1570 CD GLU A 220 12.034 1.528 3.651 1.00 2.32 C ATOM 1571 OE1 GLU A 220 10.878 1.786 4.039 1.00 2.80 O ATOM 1572 OE2 GLU A 220 12.901 1.045 4.395 1.00 3.07 O ATOM 0 H GLU A 220 11.051 5.347 0.845 1.00 0.35 H new ATOM 0 HA GLU A 220 11.902 4.218 3.408 1.00 0.39 H new ATOM 0 HB2 GLU A 220 10.628 2.911 1.763 1.00 0.50 H new ATOM 0 HB3 GLU A 220 11.926 3.125 0.605 1.00 0.50 H new ATOM 0 HG2 GLU A 220 12.135 0.950 1.603 1.00 1.11 H new ATOM 0 HG3 GLU A 220 13.478 1.940 2.139 1.00 1.11 H new ATOM 1579 N SER A 221 13.829 5.705 1.348 1.00 0.52 N ATOM 1580 CA SER A 221 15.183 6.207 1.346 1.00 0.63 C ATOM 1581 C SER A 221 15.437 6.911 2.668 1.00 0.68 C ATOM 1582 O SER A 221 16.551 7.324 2.979 1.00 0.81 O ATOM 1583 CB SER A 221 15.481 7.129 0.172 1.00 0.70 C ATOM 1584 OG SER A 221 14.561 8.198 0.096 1.00 0.86 O ATOM 0 H SER A 221 13.173 6.185 0.731 1.00 0.52 H new ATOM 0 HA SER A 221 15.858 5.359 1.228 1.00 0.63 H new ATOM 0 HB2 SER A 221 16.492 7.526 0.269 1.00 0.70 H new ATOM 0 HB3 SER A 221 15.451 6.557 -0.756 1.00 0.70 H new ATOM 0 HG SER A 221 13.789 8.006 0.668 1.00 0.86 H new ATOM 1590 N GLN A 222 14.359 7.052 3.428 1.00 0.62 N ATOM 1591 CA GLN A 222 14.414 7.502 4.798 1.00 0.66 C ATOM 1592 C GLN A 222 14.572 6.295 5.700 1.00 0.60 C ATOM 1593 O GLN A 222 15.577 6.149 6.381 1.00 0.63 O ATOM 1594 CB GLN A 222 13.129 8.241 5.159 1.00 0.71 C ATOM 1595 CG GLN A 222 12.669 9.212 4.089 1.00 0.88 C ATOM 1596 CD GLN A 222 11.405 9.946 4.481 1.00 0.95 C ATOM 1597 OE1 GLN A 222 11.132 10.153 5.663 1.00 1.36 O ATOM 1598 NE2 GLN A 222 10.633 10.360 3.492 1.00 1.60 N ATOM 0 H GLN A 222 13.414 6.853 3.099 1.00 0.62 H new ATOM 0 HA GLN A 222 15.258 8.180 4.926 1.00 0.66 H new ATOM 0 HB2 GLN A 222 12.339 7.512 5.341 1.00 0.71 H new ATOM 0 HB3 GLN A 222 13.282 8.785 6.091 1.00 0.71 H new ATOM 0 HG2 GLN A 222 13.461 9.936 3.894 1.00 0.88 H new ATOM 0 HG3 GLN A 222 12.497 8.669 3.159 1.00 0.88 H new ATOM 0 HE21 GLN A 222 10.896 10.168 2.525 1.00 1.60 H new ATOM 0 HE22 GLN A 222 9.775 10.872 3.695 1.00 1.60 H new ATOM 1607 N ALA A 223 13.586 5.405 5.668 1.00 0.56 N ATOM 1608 CA ALA A 223 13.605 4.230 6.526 1.00 0.54 C ATOM 1609 C ALA A 223 14.751 3.299 6.180 1.00 0.53 C ATOM 1610 O ALA A 223 15.492 2.903 7.061 1.00 0.60 O ATOM 1611 CB ALA A 223 12.298 3.473 6.459 1.00 0.59 C ATOM 0 H ALA A 223 12.769 5.475 5.061 1.00 0.56 H new ATOM 0 HA ALA A 223 13.749 4.593 7.544 1.00 0.54 H new ATOM 0 HB1 ALA A 223 12.348 2.602 7.112 1.00 0.59 H new ATOM 0 HB2 ALA A 223 11.484 4.122 6.782 1.00 0.59 H new ATOM 0 HB3 ALA A 223 12.118 3.148 5.434 1.00 0.59 H new ATOM 1617 N ALA A 224 14.910 2.957 4.906 1.00 0.54 N ATOM 1618 CA ALA A 224 15.976 2.060 4.489 1.00 0.64 C ATOM 1619 C ALA A 224 17.332 2.712 4.723 1.00 0.74 C ATOM 1620 O ALA A 224 18.374 2.067 4.637 1.00 0.89 O ATOM 1621 CB ALA A 224 15.835 1.649 3.032 1.00 0.77 C ATOM 0 H ALA A 224 14.314 3.288 4.147 1.00 0.54 H new ATOM 0 HA ALA A 224 15.900 1.156 5.093 1.00 0.64 H new ATOM 0 HB1 ALA A 224 16.652 0.979 2.762 1.00 0.77 H new ATOM 0 HB2 ALA A 224 14.883 1.137 2.889 1.00 0.77 H new ATOM 0 HB3 ALA A 224 15.869 2.536 2.399 1.00 0.77 H new ATOM 1627 N TYR A 225 17.305 4.009 4.992 1.00 0.72 N ATOM 1628 CA TYR A 225 18.492 4.724 5.408 1.00 0.85 C ATOM 1629 C TYR A 225 18.726 4.488 6.903 1.00 0.89 C ATOM 1630 O TYR A 225 19.858 4.300 7.353 1.00 1.06 O ATOM 1631 CB TYR A 225 18.342 6.217 5.130 1.00 0.85 C ATOM 1632 CG TYR A 225 19.586 7.017 5.439 1.00 0.97 C ATOM 1633 CD1 TYR A 225 20.822 6.626 4.940 1.00 1.21 C ATOM 1634 CD2 TYR A 225 19.527 8.160 6.226 1.00 0.95 C ATOM 1635 CE1 TYR A 225 21.965 7.352 5.217 1.00 1.36 C ATOM 1636 CE2 TYR A 225 20.665 8.892 6.506 1.00 1.11 C ATOM 1637 CZ TYR A 225 21.882 8.483 5.998 1.00 1.29 C ATOM 1638 OH TYR A 225 23.018 9.212 6.269 1.00 1.47 O ATOM 0 H TYR A 225 16.467 4.586 4.928 1.00 0.72 H new ATOM 0 HA TYR A 225 19.348 4.355 4.842 1.00 0.85 H new ATOM 0 HB2 TYR A 225 18.080 6.358 4.081 1.00 0.85 H new ATOM 0 HB3 TYR A 225 17.513 6.607 5.721 1.00 0.85 H new ATOM 0 HD1 TYR A 225 20.891 5.740 4.326 1.00 1.21 H new ATOM 0 HD2 TYR A 225 18.577 8.482 6.625 1.00 0.95 H new ATOM 0 HE1 TYR A 225 22.919 7.034 4.823 1.00 1.36 H new ATOM 0 HE2 TYR A 225 20.603 9.779 7.119 1.00 1.11 H new ATOM 0 HH TYR A 225 22.787 9.980 6.832 1.00 1.47 H new ATOM 1648 N GLN A 226 17.625 4.486 7.660 1.00 0.77 N ATOM 1649 CA GLN A 226 17.656 4.309 9.111 1.00 0.84 C ATOM 1650 C GLN A 226 17.772 2.833 9.482 1.00 0.88 C ATOM 1651 O GLN A 226 18.767 2.400 10.060 1.00 0.96 O ATOM 1652 CB GLN A 226 16.376 4.864 9.737 1.00 0.81 C ATOM 1653 CG GLN A 226 15.975 6.228 9.231 1.00 1.19 C ATOM 1654 CD GLN A 226 16.876 7.346 9.711 1.00 1.90 C ATOM 1655 OE1 GLN A 226 17.876 7.666 9.071 1.00 2.75 O ATOM 1656 NE2 GLN A 226 16.518 7.963 10.827 1.00 2.24 N ATOM 0 H GLN A 226 16.686 4.608 7.281 1.00 0.77 H new ATOM 0 HA GLN A 226 18.526 4.846 9.489 1.00 0.84 H new ATOM 0 HB2 GLN A 226 15.561 4.166 9.547 1.00 0.81 H new ATOM 0 HB3 GLN A 226 16.507 4.915 10.818 1.00 0.81 H new ATOM 0 HG2 GLN A 226 15.976 6.216 8.141 1.00 1.19 H new ATOM 0 HG3 GLN A 226 14.953 6.437 9.547 1.00 1.19 H new ATOM 0 HE21 GLN A 226 15.681 7.666 11.328 1.00 2.24 H new ATOM 0 HE22 GLN A 226 17.080 8.735 11.186 1.00 2.24 H new