USER MOD reduce.3.24.130724 H: found=0, std=0, add=803, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 804 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 216 GLN : amide:sc= 1.01 K(o=0.37,f=-0.83) USER MOD Set 1.2: A 219 GLN : amide:sc= -0.631 K(o=0.37,f=1) USER MOD Set 2.1: A 156 TYR OH : rot -54:sc= -2.01 USER MOD Set 2.2: A 187 THR OG1 : rot -41:sc= -0.527 USER MOD Set 2.3: A 191 THR OG1 : rot -163:sc= -2.22! USER MOD Set 3.1: A 176 HIS : no HE2:sc= 0.701 K(o=0.46,f=-5.5!) USER MOD Set 3.2: A 180 ASN : amide:sc= -0.237 K(o=0.46,f=-0.68!) USER MOD Set 4.1: A 161 TYR OH : rot 180:sc= -0.228 USER MOD Set 4.2: A 186 HIS : no HE2:sc= -2.75! C(o=-3!,f=-9.5!) USER MOD Set 5.1: A 133 MET CE :methyl 139:sc= -5.75! (180deg=-9.45!) USER MOD Set 5.2: A 212 MET CE :methyl -120:sc= -7.96! (180deg=-7.8!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 MET CE :methyl 164:sc= -3.4! (180deg=-4.1!) USER MOD Single : A 131 SER OG : rot 170:sc= -0.0391 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 139 HIS : no HD1:sc= -3.56! K(o=-3.6!,f=-0.44) USER MOD Single : A 142 ASN : amide:sc= -1.57 K(o=-1.6,f=-3.6!) USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot -164:sc= -1.09 USER MOD Single : A 149 TYR OH : rot 180:sc= 0.214 USER MOD Single : A 152 ASN : amide:sc= -7.25! C(o=-7.3!,f=-7.1!) USER MOD Single : A 153 MET CE :methyl 161:sc= -10.9! (180deg=-12.3!) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 ASN : amide:sc= 0.404 K(o=0.4,f=-3.6!) USER MOD Single : A 159 GLN : amide:sc= -4.53! K(o=-4.5!,f=-1.1) USER MOD Single : A 162 TYR OH : rot 180:sc= -0.447 USER MOD Single : A 167 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 168 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 SER OG : rot 180:sc= 0 USER MOD Single : A 170 ASN : amide:sc= -0.329 X(o=-0.33,f=-0.00044) USER MOD Single : A 171 GLN : amide:sc= -3.54! K(o=-3.5!,f=-0.064) USER MOD Single : A 172 ASN : amide:sc= -0.269 K(o=-0.27,f=-3.6!) USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD Single : A 182 THR OG1 : rot -57:sc= -1.63! USER MOD Single : A 184 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 185 GLN : amide:sc= 0.535 K(o=0.54,f=-0.99) USER MOD Single : A 189 THR OG1 : rot 180:sc= 0 USER MOD Single : A 190 THR OG1 : rot 108:sc= 1.26 USER MOD Single : A 192 THR OG1 : rot -135:sc= -1.4! USER MOD Single : A 193 LYS NZ :NH3+ -153:sc= 0.412 (180deg=-0.635) USER MOD Single : A 196 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 198 THR OG1 : rot 180:sc= 0 USER MOD Single : A 200 THR OG1 : rot 180:sc= 0.0301 USER MOD Single : A 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl 152:sc= -6.12! (180deg=-8.53!) USER MOD Single : A 211 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 215 THR OG1 : rot 58:sc= 1.15 USER MOD Single : A 217 TYR OH : rot -133:sc= -1.64 USER MOD Single : A 218 GLN : amide:sc= -1.51! K(o=-1.5!,f=-0.27) USER MOD Single : A 221 SER OG : rot 44:sc= 1.17 USER MOD Single : A 222 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 GLN : amide:sc= -1.15 K(o=-1.1,f=-0.2) USER MOD ----------------------------------------------------------------- ATOM 34 N TYR A 127 -10.232 9.976 -4.923 1.00 0.61 N ATOM 35 CA TYR A 127 -8.875 9.578 -4.574 1.00 0.44 C ATOM 36 C TYR A 127 -7.977 9.606 -5.794 1.00 0.45 C ATOM 37 O TYR A 127 -8.401 9.376 -6.924 1.00 0.71 O ATOM 38 CB TYR A 127 -8.840 8.202 -3.885 1.00 0.37 C ATOM 39 CG TYR A 127 -9.442 8.249 -2.501 1.00 0.46 C ATOM 40 CD1 TYR A 127 -8.831 8.950 -1.469 1.00 0.86 C ATOM 41 CD2 TYR A 127 -10.610 7.561 -2.223 1.00 1.26 C ATOM 42 CE1 TYR A 127 -9.379 8.962 -0.199 1.00 0.92 C ATOM 43 CE2 TYR A 127 -11.164 7.573 -0.965 1.00 1.38 C ATOM 44 CZ TYR A 127 -10.546 8.399 0.039 1.00 0.78 C ATOM 45 OH TYR A 127 -11.100 8.266 1.300 1.00 0.96 O ATOM 0 HA TYR A 127 -8.494 10.303 -3.855 1.00 0.44 H new ATOM 0 HB2 TYR A 127 -9.383 7.478 -4.493 1.00 0.37 H new ATOM 0 HB3 TYR A 127 -7.809 7.854 -3.821 1.00 0.37 H new ATOM 0 HD1 TYR A 127 -7.917 9.492 -1.661 1.00 0.86 H new ATOM 0 HD2 TYR A 127 -11.096 7.004 -3.010 1.00 1.26 H new ATOM 0 HE1 TYR A 127 -8.843 9.439 0.608 1.00 0.92 H new ATOM 0 HE2 TYR A 127 -12.037 6.980 -0.737 1.00 1.38 H new ATOM 0 HH TYR A 127 -11.969 7.819 1.230 1.00 0.96 H new ATOM 55 N MET A 128 -6.734 9.905 -5.546 1.00 0.38 N ATOM 56 CA MET A 128 -5.756 10.057 -6.579 1.00 0.41 C ATOM 57 C MET A 128 -4.839 8.862 -6.459 1.00 0.42 C ATOM 58 O MET A 128 -4.078 8.754 -5.508 1.00 0.43 O ATOM 59 CB MET A 128 -5.060 11.433 -6.389 1.00 0.46 C ATOM 60 CG MET A 128 -3.800 11.441 -5.539 1.00 0.45 C ATOM 61 SD MET A 128 -2.309 11.289 -6.530 1.00 0.52 S ATOM 62 CE MET A 128 -1.300 10.370 -5.386 1.00 0.46 C ATOM 0 H MET A 128 -6.368 10.052 -4.605 1.00 0.38 H new ATOM 0 HA MET A 128 -6.162 10.070 -7.590 1.00 0.41 H new ATOM 0 HB2 MET A 128 -4.810 11.829 -7.374 1.00 0.46 H new ATOM 0 HB3 MET A 128 -5.778 12.120 -5.942 1.00 0.46 H new ATOM 0 HG2 MET A 128 -3.758 12.366 -4.963 1.00 0.45 H new ATOM 0 HG3 MET A 128 -3.843 10.621 -4.822 1.00 0.45 H new ATOM 0 HE1 MET A 128 -0.451 9.937 -5.916 1.00 0.46 H new ATOM 0 HE2 MET A 128 -0.938 11.037 -4.603 1.00 0.46 H new ATOM 0 HE3 MET A 128 -1.893 9.573 -4.938 1.00 0.46 H new ATOM 72 N LEU A 129 -4.992 7.895 -7.354 1.00 0.57 N ATOM 73 CA LEU A 129 -4.325 6.627 -7.146 1.00 0.66 C ATOM 74 C LEU A 129 -2.877 6.884 -6.825 1.00 0.56 C ATOM 75 O LEU A 129 -2.139 7.431 -7.644 1.00 0.56 O ATOM 76 CB LEU A 129 -4.444 5.676 -8.320 1.00 0.92 C ATOM 77 CG LEU A 129 -4.142 4.239 -7.930 1.00 0.37 C ATOM 78 CD1 LEU A 129 -5.349 3.347 -8.145 1.00 1.12 C ATOM 79 CD2 LEU A 129 -2.939 3.732 -8.699 1.00 1.15 C ATOM 0 H LEU A 129 -5.554 7.963 -8.203 1.00 0.57 H new ATOM 0 HA LEU A 129 -4.824 6.132 -6.313 1.00 0.66 H new ATOM 0 HB2 LEU A 129 -5.452 5.734 -8.732 1.00 0.92 H new ATOM 0 HB3 LEU A 129 -3.759 5.988 -9.108 1.00 0.92 H new ATOM 0 HG LEU A 129 -3.906 4.212 -6.866 1.00 0.37 H new ATOM 0 HD11 LEU A 129 -5.102 2.325 -7.857 1.00 1.12 H new ATOM 0 HD12 LEU A 129 -6.179 3.705 -7.536 1.00 1.12 H new ATOM 0 HD13 LEU A 129 -5.635 3.369 -9.197 1.00 1.12 H new ATOM 0 HD21 LEU A 129 -2.731 2.701 -8.412 1.00 1.15 H new ATOM 0 HD22 LEU A 129 -3.146 3.776 -9.768 1.00 1.15 H new ATOM 0 HD23 LEU A 129 -2.073 4.354 -8.471 1.00 1.15 H new ATOM 91 N GLY A 130 -2.531 6.554 -5.588 1.00 0.57 N ATOM 92 CA GLY A 130 -1.251 6.881 -5.026 1.00 0.55 C ATOM 93 C GLY A 130 -0.141 6.130 -5.692 1.00 0.53 C ATOM 94 O GLY A 130 0.458 5.226 -5.101 1.00 0.58 O ATOM 0 H GLY A 130 -3.145 6.047 -4.950 1.00 0.57 H new ATOM 0 HA2 GLY A 130 -1.074 7.952 -5.124 1.00 0.55 H new ATOM 0 HA3 GLY A 130 -1.254 6.655 -3.960 1.00 0.55 H new ATOM 98 N SER A 131 0.073 6.489 -6.952 1.00 0.56 N ATOM 99 CA SER A 131 1.106 5.903 -7.786 1.00 0.62 C ATOM 100 C SER A 131 0.823 4.426 -8.027 1.00 0.63 C ATOM 101 O SER A 131 -0.046 3.831 -7.395 1.00 1.04 O ATOM 102 CB SER A 131 2.487 6.082 -7.141 1.00 0.71 C ATOM 103 OG SER A 131 3.531 5.709 -8.025 1.00 1.30 O ATOM 0 H SER A 131 -0.476 7.206 -7.427 1.00 0.56 H new ATOM 0 HA SER A 131 1.103 6.419 -8.746 1.00 0.62 H new ATOM 0 HB2 SER A 131 2.617 7.122 -6.843 1.00 0.71 H new ATOM 0 HB3 SER A 131 2.546 5.480 -6.234 1.00 0.71 H new ATOM 0 HG SER A 131 4.393 5.984 -7.648 1.00 1.30 H new ATOM 109 N ALA A 132 1.533 3.848 -8.967 1.00 0.64 N ATOM 110 CA ALA A 132 1.496 2.419 -9.156 1.00 0.58 C ATOM 111 C ALA A 132 2.915 1.889 -9.163 1.00 0.53 C ATOM 112 O ALA A 132 3.492 1.624 -10.221 1.00 0.65 O ATOM 113 CB ALA A 132 0.768 2.030 -10.429 1.00 0.71 C ATOM 0 H ALA A 132 2.144 4.347 -9.613 1.00 0.64 H new ATOM 0 HA ALA A 132 0.938 1.974 -8.332 1.00 0.58 H new ATOM 0 HB1 ALA A 132 0.765 0.945 -10.529 1.00 0.71 H new ATOM 0 HB2 ALA A 132 -0.259 2.393 -10.386 1.00 0.71 H new ATOM 0 HB3 ALA A 132 1.274 2.472 -11.287 1.00 0.71 H new ATOM 119 N MET A 133 3.496 1.812 -7.977 1.00 0.46 N ATOM 120 CA MET A 133 4.832 1.265 -7.811 1.00 0.49 C ATOM 121 C MET A 133 4.851 -0.189 -8.248 1.00 0.61 C ATOM 122 O MET A 133 3.805 -0.797 -8.421 1.00 1.65 O ATOM 123 CB MET A 133 5.295 1.391 -6.346 1.00 0.48 C ATOM 124 CG MET A 133 4.260 0.971 -5.324 1.00 0.41 C ATOM 125 SD MET A 133 4.748 -0.453 -4.328 1.00 0.73 S ATOM 126 CE MET A 133 3.550 -0.355 -2.993 1.00 0.40 C ATOM 0 H MET A 133 3.059 2.124 -7.110 1.00 0.46 H new ATOM 0 HA MET A 133 5.522 1.833 -8.435 1.00 0.49 H new ATOM 0 HB2 MET A 133 6.191 0.786 -6.208 1.00 0.48 H new ATOM 0 HB3 MET A 133 5.577 2.426 -6.155 1.00 0.48 H new ATOM 0 HG2 MET A 133 4.056 1.812 -4.661 1.00 0.41 H new ATOM 0 HG3 MET A 133 3.328 0.739 -5.840 1.00 0.41 H new ATOM 0 HE1 MET A 133 3.196 -1.356 -2.747 1.00 0.40 H new ATOM 0 HE2 MET A 133 4.019 0.090 -2.115 1.00 0.40 H new ATOM 0 HE3 MET A 133 2.707 0.261 -3.305 1.00 0.40 H new ATOM 136 N SER A 134 6.026 -0.738 -8.467 1.00 0.72 N ATOM 137 CA SER A 134 6.134 -2.166 -8.702 1.00 0.60 C ATOM 138 C SER A 134 6.209 -2.859 -7.361 1.00 0.52 C ATOM 139 O SER A 134 5.591 -3.897 -7.122 1.00 0.74 O ATOM 140 CB SER A 134 7.368 -2.484 -9.549 1.00 0.71 C ATOM 141 OG SER A 134 7.456 -1.619 -10.670 1.00 1.49 O ATOM 0 H SER A 134 6.909 -0.229 -8.488 1.00 0.72 H new ATOM 0 HA SER A 134 5.263 -2.520 -9.254 1.00 0.60 H new ATOM 0 HB2 SER A 134 8.266 -2.386 -8.939 1.00 0.71 H new ATOM 0 HB3 SER A 134 7.323 -3.519 -9.887 1.00 0.71 H new ATOM 0 HG SER A 134 8.254 -1.842 -11.194 1.00 1.49 H new ATOM 147 N ARG A 135 6.953 -2.198 -6.505 1.00 0.47 N ATOM 148 CA ARG A 135 7.198 -2.573 -5.117 1.00 0.43 C ATOM 149 C ARG A 135 8.403 -1.788 -4.618 1.00 0.47 C ATOM 150 O ARG A 135 9.359 -1.603 -5.363 1.00 0.59 O ATOM 151 CB ARG A 135 7.471 -4.065 -4.949 1.00 0.55 C ATOM 152 CG ARG A 135 6.270 -4.815 -4.412 1.00 0.49 C ATOM 153 CD ARG A 135 5.918 -4.400 -3.008 1.00 1.38 C ATOM 154 NE ARG A 135 4.749 -5.148 -2.531 1.00 2.40 N ATOM 155 CZ ARG A 135 3.481 -4.781 -2.756 1.00 3.22 C ATOM 156 NH1 ARG A 135 3.213 -3.680 -3.440 1.00 3.47 N ATOM 157 NH2 ARG A 135 2.480 -5.522 -2.305 1.00 4.16 N ATOM 0 H ARG A 135 7.433 -1.336 -6.765 1.00 0.47 H new ATOM 0 HA ARG A 135 6.301 -2.344 -4.542 1.00 0.43 H new ATOM 0 HB2 ARG A 135 7.761 -4.489 -5.910 1.00 0.55 H new ATOM 0 HB3 ARG A 135 8.314 -4.203 -4.273 1.00 0.55 H new ATOM 0 HG2 ARG A 135 5.415 -4.642 -5.065 1.00 0.49 H new ATOM 0 HG3 ARG A 135 6.474 -5.885 -4.432 1.00 0.49 H new ATOM 0 HD2 ARG A 135 6.766 -4.577 -2.346 1.00 1.38 H new ATOM 0 HD3 ARG A 135 5.710 -3.330 -2.980 1.00 1.38 H new ATOM 0 HE ARG A 135 4.912 -6.000 -1.995 1.00 2.40 H new ATOM 0 HH11 ARG A 135 3.975 -3.105 -3.800 1.00 3.47 H new ATOM 0 HH12 ARG A 135 2.245 -3.407 -3.608 1.00 3.47 H new ATOM 0 HH21 ARG A 135 2.673 -6.377 -1.783 1.00 4.16 H new ATOM 0 HH22 ARG A 135 1.516 -5.238 -2.479 1.00 4.16 H new ATOM 171 N PRO A 136 8.384 -1.295 -3.372 1.00 0.43 N ATOM 172 CA PRO A 136 9.566 -0.689 -2.748 1.00 0.49 C ATOM 173 C PRO A 136 10.551 -1.767 -2.317 1.00 0.46 C ATOM 174 O PRO A 136 11.509 -1.507 -1.590 1.00 0.58 O ATOM 175 CB PRO A 136 8.997 0.052 -1.526 1.00 0.52 C ATOM 176 CG PRO A 136 7.517 0.022 -1.708 1.00 0.47 C ATOM 177 CD PRO A 136 7.229 -1.227 -2.481 1.00 0.40 C ATOM 0 HA PRO A 136 10.112 -0.029 -3.422 1.00 0.49 H new ATOM 0 HB2 PRO A 136 9.290 -0.437 -0.597 1.00 0.52 H new ATOM 0 HB3 PRO A 136 9.368 1.076 -1.478 1.00 0.52 H new ATOM 0 HG2 PRO A 136 7.004 0.014 -0.746 1.00 0.47 H new ATOM 0 HG3 PRO A 136 7.171 0.904 -2.246 1.00 0.47 H new ATOM 0 HD2 PRO A 136 7.158 -2.102 -1.834 1.00 0.40 H new ATOM 0 HD3 PRO A 136 6.290 -1.161 -3.031 1.00 0.40 H new ATOM 185 N LEU A 137 10.294 -2.978 -2.810 1.00 0.42 N ATOM 186 CA LEU A 137 11.047 -4.168 -2.464 1.00 0.48 C ATOM 187 C LEU A 137 11.036 -4.403 -0.963 1.00 0.45 C ATOM 188 O LEU A 137 11.912 -3.955 -0.231 1.00 0.62 O ATOM 189 CB LEU A 137 12.481 -4.128 -2.991 1.00 0.70 C ATOM 190 CG LEU A 137 12.642 -4.112 -4.520 1.00 0.77 C ATOM 191 CD1 LEU A 137 11.694 -5.106 -5.172 1.00 1.32 C ATOM 192 CD2 LEU A 137 12.434 -2.712 -5.083 1.00 1.33 C ATOM 0 H LEU A 137 9.540 -3.156 -3.474 1.00 0.42 H new ATOM 0 HA LEU A 137 10.549 -5.005 -2.953 1.00 0.48 H new ATOM 0 HB2 LEU A 137 12.970 -3.242 -2.586 1.00 0.70 H new ATOM 0 HB3 LEU A 137 13.014 -4.994 -2.599 1.00 0.70 H new ATOM 0 HG LEU A 137 13.664 -4.413 -4.752 1.00 0.77 H new ATOM 0 HD11 LEU A 137 11.825 -5.078 -6.254 1.00 1.32 H new ATOM 0 HD12 LEU A 137 11.911 -6.110 -4.806 1.00 1.32 H new ATOM 0 HD13 LEU A 137 10.665 -4.844 -4.924 1.00 1.32 H new ATOM 0 HD21 LEU A 137 12.554 -2.734 -6.166 1.00 1.33 H new ATOM 0 HD22 LEU A 137 11.430 -2.366 -4.836 1.00 1.33 H new ATOM 0 HD23 LEU A 137 13.168 -2.033 -4.650 1.00 1.33 H new ATOM 204 N ILE A 138 10.005 -5.087 -0.522 1.00 0.38 N ATOM 205 CA ILE A 138 9.823 -5.407 0.875 1.00 0.39 C ATOM 206 C ILE A 138 10.452 -6.763 1.210 1.00 0.50 C ATOM 207 O ILE A 138 10.792 -7.012 2.358 1.00 1.19 O ATOM 208 CB ILE A 138 8.324 -5.422 1.170 1.00 0.38 C ATOM 209 CG1 ILE A 138 7.702 -4.063 0.835 1.00 0.25 C ATOM 210 CG2 ILE A 138 8.031 -5.801 2.600 1.00 0.57 C ATOM 211 CD1 ILE A 138 8.228 -2.918 1.675 1.00 0.31 C ATOM 0 H ILE A 138 9.264 -5.439 -1.127 1.00 0.38 H new ATOM 0 HA ILE A 138 10.318 -4.658 1.493 1.00 0.39 H new ATOM 0 HB ILE A 138 7.874 -6.186 0.536 1.00 0.38 H new ATOM 0 HG12 ILE A 138 7.884 -3.841 -0.217 1.00 0.25 H new ATOM 0 HG13 ILE A 138 6.622 -4.128 0.965 1.00 0.25 H new ATOM 0 HG21 ILE A 138 6.953 -5.798 2.764 1.00 0.57 H new ATOM 0 HG22 ILE A 138 8.426 -6.797 2.801 1.00 0.57 H new ATOM 0 HG23 ILE A 138 8.501 -5.082 3.271 1.00 0.57 H new ATOM 0 HD11 ILE A 138 7.738 -1.992 1.376 1.00 0.31 H new ATOM 0 HD12 ILE A 138 8.022 -3.114 2.727 1.00 0.31 H new ATOM 0 HD13 ILE A 138 9.304 -2.823 1.528 1.00 0.31 H new ATOM 223 N HIS A 139 10.612 -7.602 0.166 1.00 0.65 N ATOM 224 CA HIS A 139 11.290 -8.937 0.196 1.00 0.75 C ATOM 225 C HIS A 139 11.133 -9.751 1.492 1.00 0.84 C ATOM 226 O HIS A 139 10.472 -10.783 1.482 1.00 1.80 O ATOM 227 CB HIS A 139 12.784 -8.840 -0.191 1.00 0.84 C ATOM 228 CG HIS A 139 13.436 -7.550 0.184 1.00 0.72 C ATOM 229 ND1 HIS A 139 13.992 -6.689 -0.731 1.00 1.02 N ATOM 230 CD2 HIS A 139 13.542 -6.944 1.381 1.00 1.15 C ATOM 231 CE1 HIS A 139 14.393 -5.600 -0.106 1.00 1.08 C ATOM 232 NE2 HIS A 139 14.121 -5.722 1.184 1.00 1.33 N ATOM 0 H HIS A 139 10.262 -7.369 -0.763 1.00 0.65 H new ATOM 0 HA HIS A 139 10.745 -9.500 -0.562 1.00 0.75 H new ATOM 0 HB2 HIS A 139 13.324 -9.658 0.286 1.00 0.84 H new ATOM 0 HB3 HIS A 139 12.878 -8.981 -1.268 1.00 0.84 H new ATOM 0 HD2 HIS A 139 13.225 -7.352 2.330 1.00 1.15 H new ATOM 0 HE1 HIS A 139 14.866 -4.747 -0.570 1.00 1.08 H new ATOM 0 HE2 HIS A 139 14.311 -5.026 1.905 1.00 1.33 H new ATOM 241 N PHE A 140 11.760 -9.294 2.582 1.00 0.66 N ATOM 242 CA PHE A 140 11.901 -10.049 3.836 1.00 0.54 C ATOM 243 C PHE A 140 13.025 -11.068 3.713 1.00 0.63 C ATOM 244 O PHE A 140 13.748 -11.331 4.673 1.00 0.76 O ATOM 245 CB PHE A 140 10.614 -10.780 4.258 1.00 0.53 C ATOM 246 CG PHE A 140 9.387 -9.921 4.358 1.00 0.40 C ATOM 247 CD1 PHE A 140 9.281 -8.926 5.315 1.00 0.72 C ATOM 248 CD2 PHE A 140 8.330 -10.129 3.493 1.00 0.71 C ATOM 249 CE1 PHE A 140 8.138 -8.155 5.401 1.00 0.74 C ATOM 250 CE2 PHE A 140 7.190 -9.367 3.574 1.00 0.67 C ATOM 251 CZ PHE A 140 7.090 -8.379 4.526 1.00 0.35 C ATOM 0 H PHE A 140 12.193 -8.371 2.620 1.00 0.66 H new ATOM 0 HA PHE A 140 12.127 -9.312 4.606 1.00 0.54 H new ATOM 0 HB2 PHE A 140 10.420 -11.579 3.543 1.00 0.53 H new ATOM 0 HB3 PHE A 140 10.786 -11.252 5.225 1.00 0.53 H new ATOM 0 HD1 PHE A 140 10.098 -8.751 5.999 1.00 0.72 H new ATOM 0 HD2 PHE A 140 8.401 -10.902 2.742 1.00 0.71 H new ATOM 0 HE1 PHE A 140 8.063 -7.380 6.149 1.00 0.74 H new ATOM 0 HE2 PHE A 140 6.373 -9.543 2.891 1.00 0.67 H new ATOM 0 HZ PHE A 140 6.194 -7.779 4.590 1.00 0.35 H new ATOM 261 N GLY A 141 13.168 -11.639 2.524 1.00 0.66 N ATOM 262 CA GLY A 141 14.143 -12.688 2.320 1.00 0.77 C ATOM 263 C GLY A 141 13.620 -14.014 2.824 1.00 0.74 C ATOM 264 O GLY A 141 14.376 -14.962 3.033 1.00 0.86 O ATOM 0 H GLY A 141 12.624 -11.393 1.697 1.00 0.66 H new ATOM 0 HA2 GLY A 141 14.383 -12.766 1.260 1.00 0.77 H new ATOM 0 HA3 GLY A 141 15.068 -12.436 2.838 1.00 0.77 H new ATOM 268 N ASN A 142 12.313 -14.069 3.026 1.00 0.63 N ATOM 269 CA ASN A 142 11.662 -15.272 3.543 1.00 0.63 C ATOM 270 C ASN A 142 11.343 -16.237 2.410 1.00 0.63 C ATOM 271 O ASN A 142 11.765 -16.031 1.274 1.00 0.65 O ATOM 272 CB ASN A 142 10.373 -14.920 4.291 1.00 0.61 C ATOM 273 CG ASN A 142 10.607 -14.043 5.509 1.00 0.81 C ATOM 274 OD1 ASN A 142 9.757 -13.234 5.874 1.00 1.68 O ATOM 275 ND2 ASN A 142 11.751 -14.205 6.159 1.00 1.02 N ATOM 0 H ASN A 142 11.676 -13.294 2.840 1.00 0.63 H new ATOM 0 HA ASN A 142 12.353 -15.749 4.238 1.00 0.63 H new ATOM 0 HB2 ASN A 142 9.693 -14.409 3.609 1.00 0.61 H new ATOM 0 HB3 ASN A 142 9.879 -15.840 4.604 1.00 0.61 H new ATOM 0 HD21 ASN A 142 11.948 -13.648 6.991 1.00 1.02 H new ATOM 0 HD22 ASN A 142 12.434 -14.886 5.827 1.00 1.02 H new ATOM 282 N ASP A 143 10.624 -17.303 2.723 1.00 0.66 N ATOM 283 CA ASP A 143 10.185 -18.238 1.692 1.00 0.67 C ATOM 284 C ASP A 143 8.744 -17.956 1.290 1.00 0.61 C ATOM 285 O ASP A 143 8.480 -17.491 0.188 1.00 0.57 O ATOM 286 CB ASP A 143 10.322 -19.689 2.166 1.00 0.79 C ATOM 287 CG ASP A 143 9.932 -20.702 1.098 1.00 1.34 C ATOM 288 OD1 ASP A 143 9.881 -20.337 -0.097 1.00 1.77 O ATOM 289 OD2 ASP A 143 9.682 -21.875 1.451 1.00 2.11 O ATOM 0 H ASP A 143 10.333 -17.543 3.671 1.00 0.66 H new ATOM 0 HA ASP A 143 10.828 -18.098 0.823 1.00 0.67 H new ATOM 0 HB2 ASP A 143 11.352 -19.870 2.472 1.00 0.79 H new ATOM 0 HB3 ASP A 143 9.697 -19.839 3.047 1.00 0.79 H new ATOM 294 N TYR A 144 7.819 -18.184 2.215 1.00 0.64 N ATOM 295 CA TYR A 144 6.396 -18.078 1.914 1.00 0.62 C ATOM 296 C TYR A 144 5.859 -16.696 2.273 1.00 0.55 C ATOM 297 O TYR A 144 4.823 -16.293 1.779 1.00 0.53 O ATOM 298 CB TYR A 144 5.615 -19.166 2.660 1.00 0.76 C ATOM 299 CG TYR A 144 4.127 -19.150 2.381 1.00 0.80 C ATOM 300 CD1 TYR A 144 3.630 -19.520 1.138 1.00 1.17 C ATOM 301 CD2 TYR A 144 3.222 -18.759 3.359 1.00 0.98 C ATOM 302 CE1 TYR A 144 2.273 -19.502 0.877 1.00 1.28 C ATOM 303 CE2 TYR A 144 1.864 -18.740 3.107 1.00 1.09 C ATOM 304 CZ TYR A 144 1.394 -19.110 1.865 1.00 1.08 C ATOM 305 OH TYR A 144 0.040 -19.091 1.610 1.00 1.26 O ATOM 0 H TYR A 144 8.028 -18.443 3.179 1.00 0.64 H new ATOM 0 HA TYR A 144 6.264 -18.221 0.841 1.00 0.62 H new ATOM 0 HB2 TYR A 144 6.016 -20.141 2.385 1.00 0.76 H new ATOM 0 HB3 TYR A 144 5.776 -19.046 3.731 1.00 0.76 H new ATOM 0 HD1 TYR A 144 4.316 -19.827 0.362 1.00 1.17 H new ATOM 0 HD2 TYR A 144 3.586 -18.465 4.332 1.00 0.98 H new ATOM 0 HE1 TYR A 144 1.903 -19.793 -0.095 1.00 1.28 H new ATOM 0 HE2 TYR A 144 1.173 -18.437 3.880 1.00 1.09 H new ATOM 0 HH TYR A 144 -0.440 -18.792 2.411 1.00 1.26 H new ATOM 315 N GLU A 145 6.553 -15.974 3.136 1.00 0.58 N ATOM 316 CA GLU A 145 6.165 -14.598 3.448 1.00 0.54 C ATOM 317 C GLU A 145 6.780 -13.650 2.429 1.00 0.51 C ATOM 318 O GLU A 145 6.170 -12.658 2.046 1.00 0.50 O ATOM 319 CB GLU A 145 6.618 -14.227 4.857 1.00 0.61 C ATOM 320 CG GLU A 145 6.146 -15.211 5.913 1.00 0.76 C ATOM 321 CD GLU A 145 6.586 -14.835 7.311 1.00 1.31 C ATOM 322 OE1 GLU A 145 6.355 -13.679 7.714 1.00 1.71 O ATOM 323 OE2 GLU A 145 7.169 -15.690 8.007 1.00 1.74 O ATOM 0 H GLU A 145 7.380 -16.308 3.631 1.00 0.58 H new ATOM 0 HA GLU A 145 5.079 -14.515 3.402 1.00 0.54 H new ATOM 0 HB2 GLU A 145 7.706 -14.173 4.880 1.00 0.61 H new ATOM 0 HB3 GLU A 145 6.244 -13.233 5.102 1.00 0.61 H new ATOM 0 HG2 GLU A 145 5.058 -15.272 5.885 1.00 0.76 H new ATOM 0 HG3 GLU A 145 6.527 -16.204 5.673 1.00 0.76 H new ATOM 330 N ASP A 146 7.993 -13.961 1.990 1.00 0.54 N ATOM 331 CA ASP A 146 8.563 -13.289 0.829 1.00 0.54 C ATOM 332 C ASP A 146 7.631 -13.528 -0.334 1.00 0.48 C ATOM 333 O ASP A 146 7.258 -12.623 -1.068 1.00 0.51 O ATOM 334 CB ASP A 146 9.940 -13.856 0.497 1.00 0.57 C ATOM 335 CG ASP A 146 10.517 -13.315 -0.800 1.00 0.87 C ATOM 336 OD1 ASP A 146 11.180 -12.256 -0.760 1.00 1.30 O ATOM 337 OD2 ASP A 146 10.280 -13.922 -1.865 1.00 1.38 O ATOM 0 H ASP A 146 8.596 -14.666 2.414 1.00 0.54 H new ATOM 0 HA ASP A 146 8.677 -12.225 1.035 1.00 0.54 H new ATOM 0 HB2 ASP A 146 10.625 -13.629 1.314 1.00 0.57 H new ATOM 0 HB3 ASP A 146 9.872 -14.942 0.431 1.00 0.57 H new ATOM 342 N ARG A 147 7.251 -14.784 -0.446 1.00 0.44 N ATOM 343 CA ARG A 147 6.260 -15.241 -1.387 1.00 0.45 C ATOM 344 C ARG A 147 4.960 -14.480 -1.248 1.00 0.38 C ATOM 345 O ARG A 147 4.515 -13.825 -2.178 1.00 0.35 O ATOM 346 CB ARG A 147 5.966 -16.704 -1.123 1.00 0.59 C ATOM 347 CG ARG A 147 4.922 -17.276 -2.031 1.00 0.80 C ATOM 348 CD ARG A 147 5.427 -17.269 -3.430 1.00 0.67 C ATOM 349 NE ARG A 147 6.679 -18.015 -3.568 1.00 1.38 N ATOM 350 CZ ARG A 147 7.187 -18.437 -4.725 1.00 1.78 C ATOM 351 NH1 ARG A 147 6.519 -18.271 -5.863 1.00 1.90 N ATOM 352 NH2 ARG A 147 8.365 -19.041 -4.738 1.00 2.55 N ATOM 0 H ARG A 147 7.635 -15.532 0.132 1.00 0.44 H new ATOM 0 HA ARG A 147 6.659 -15.083 -2.389 1.00 0.45 H new ATOM 0 HB2 ARG A 147 6.886 -17.277 -1.234 1.00 0.59 H new ATOM 0 HB3 ARG A 147 5.641 -16.820 -0.089 1.00 0.59 H new ATOM 0 HG2 ARG A 147 4.677 -18.293 -1.726 1.00 0.80 H new ATOM 0 HG3 ARG A 147 4.004 -16.692 -1.961 1.00 0.80 H new ATOM 0 HD2 ARG A 147 4.674 -17.701 -4.089 1.00 0.67 H new ATOM 0 HD3 ARG A 147 5.581 -16.240 -3.754 1.00 0.67 H new ATOM 0 HE ARG A 147 7.200 -18.227 -2.717 1.00 1.38 H new ATOM 0 HH11 ARG A 147 5.606 -17.816 -5.857 1.00 1.90 H new ATOM 0 HH12 ARG A 147 6.920 -18.599 -6.742 1.00 1.90 H new ATOM 0 HH21 ARG A 147 8.876 -19.180 -3.867 1.00 2.55 H new ATOM 0 HH22 ARG A 147 8.761 -19.367 -5.620 1.00 2.55 H new ATOM 366 N TYR A 148 4.335 -14.587 -0.088 1.00 0.39 N ATOM 367 CA TYR A 148 3.020 -14.033 0.082 1.00 0.38 C ATOM 368 C TYR A 148 3.052 -12.524 -0.047 1.00 0.32 C ATOM 369 O TYR A 148 2.078 -11.931 -0.468 1.00 0.44 O ATOM 370 CB TYR A 148 2.311 -14.566 1.352 1.00 0.53 C ATOM 371 CG TYR A 148 2.786 -14.142 2.723 1.00 0.90 C ATOM 372 CD1 TYR A 148 3.448 -12.927 2.877 1.00 1.93 C ATOM 373 CD2 TYR A 148 2.652 -14.946 3.831 1.00 1.13 C ATOM 374 CE1 TYR A 148 3.942 -12.532 4.102 1.00 2.86 C ATOM 375 CE2 TYR A 148 3.146 -14.560 5.051 1.00 1.93 C ATOM 376 CZ TYR A 148 3.524 -13.373 5.281 1.00 2.73 C ATOM 377 OH TYR A 148 4.267 -12.994 6.417 1.00 3.74 O ATOM 0 H TYR A 148 4.719 -15.049 0.737 1.00 0.39 H new ATOM 0 HA TYR A 148 2.387 -14.385 -0.733 1.00 0.38 H new ATOM 0 HB2 TYR A 148 1.259 -14.290 1.275 1.00 0.53 H new ATOM 0 HB3 TYR A 148 2.358 -15.654 1.316 1.00 0.53 H new ATOM 0 HD1 TYR A 148 3.577 -12.282 2.021 1.00 1.93 H new ATOM 0 HD2 TYR A 148 2.149 -15.897 3.739 1.00 1.13 H new ATOM 0 HE1 TYR A 148 4.588 -11.673 4.210 1.00 2.86 H new ATOM 0 HE2 TYR A 148 3.215 -15.292 5.842 1.00 1.93 H new ATOM 0 HH TYR A 148 4.191 -13.688 7.104 1.00 3.74 H new ATOM 387 N TYR A 149 4.185 -11.907 0.257 1.00 0.27 N ATOM 388 CA TYR A 149 4.410 -10.522 -0.102 1.00 0.25 C ATOM 389 C TYR A 149 4.580 -10.355 -1.621 1.00 0.25 C ATOM 390 O TYR A 149 4.042 -9.419 -2.211 1.00 0.29 O ATOM 391 CB TYR A 149 5.638 -9.980 0.630 1.00 0.35 C ATOM 392 CG TYR A 149 6.496 -9.087 -0.226 1.00 0.31 C ATOM 393 CD1 TYR A 149 6.098 -7.796 -0.527 1.00 0.85 C ATOM 394 CD2 TYR A 149 7.693 -9.547 -0.754 1.00 1.17 C ATOM 395 CE1 TYR A 149 6.873 -6.989 -1.328 1.00 0.80 C ATOM 396 CE2 TYR A 149 8.471 -8.744 -1.556 1.00 1.32 C ATOM 397 CZ TYR A 149 8.057 -7.464 -1.837 1.00 0.63 C ATOM 398 OH TYR A 149 8.832 -6.653 -2.633 1.00 0.81 O ATOM 0 H TYR A 149 4.961 -12.347 0.752 1.00 0.27 H new ATOM 0 HA TYR A 149 3.532 -9.951 0.200 1.00 0.25 H new ATOM 0 HB2 TYR A 149 5.312 -9.425 1.510 1.00 0.35 H new ATOM 0 HB3 TYR A 149 6.239 -10.817 0.986 1.00 0.35 H new ATOM 0 HD1 TYR A 149 5.168 -7.418 -0.129 1.00 0.85 H new ATOM 0 HD2 TYR A 149 8.020 -10.552 -0.532 1.00 1.17 H new ATOM 0 HE1 TYR A 149 6.551 -5.984 -1.556 1.00 0.80 H new ATOM 0 HE2 TYR A 149 9.400 -9.117 -1.962 1.00 1.32 H new ATOM 0 HH TYR A 149 9.637 -7.139 -2.910 1.00 0.81 H new ATOM 408 N ARG A 150 5.325 -11.252 -2.248 1.00 0.27 N ATOM 409 CA ARG A 150 5.646 -11.128 -3.670 1.00 0.30 C ATOM 410 C ARG A 150 4.401 -11.313 -4.529 1.00 0.33 C ATOM 411 O ARG A 150 4.332 -10.866 -5.670 1.00 0.40 O ATOM 412 CB ARG A 150 6.714 -12.142 -4.086 1.00 0.32 C ATOM 413 CG ARG A 150 6.146 -13.472 -4.535 1.00 0.78 C ATOM 414 CD ARG A 150 7.115 -14.198 -5.442 1.00 0.83 C ATOM 415 NE ARG A 150 7.502 -13.355 -6.573 1.00 0.94 N ATOM 416 CZ ARG A 150 8.706 -13.375 -7.139 1.00 1.23 C ATOM 417 NH1 ARG A 150 9.657 -14.158 -6.648 1.00 1.61 N ATOM 418 NH2 ARG A 150 8.962 -12.582 -8.171 1.00 1.36 N ATOM 0 H ARG A 150 5.721 -12.077 -1.798 1.00 0.27 H new ATOM 0 HA ARG A 150 6.038 -10.123 -3.828 1.00 0.30 H new ATOM 0 HB2 ARG A 150 7.309 -11.719 -4.895 1.00 0.32 H new ATOM 0 HB3 ARG A 150 7.390 -12.310 -3.247 1.00 0.32 H new ATOM 0 HG2 ARG A 150 5.925 -14.090 -3.664 1.00 0.78 H new ATOM 0 HG3 ARG A 150 5.204 -13.311 -5.059 1.00 0.78 H new ATOM 0 HD2 ARG A 150 8.002 -14.486 -4.877 1.00 0.83 H new ATOM 0 HD3 ARG A 150 6.658 -15.117 -5.808 1.00 0.83 H new ATOM 0 HE ARG A 150 6.806 -12.712 -6.951 1.00 0.94 H new ATOM 0 HH11 ARG A 150 9.466 -14.745 -5.836 1.00 1.61 H new ATOM 0 HH12 ARG A 150 10.580 -14.173 -7.082 1.00 1.61 H new ATOM 0 HH21 ARG A 150 8.237 -11.960 -8.528 1.00 1.36 H new ATOM 0 HH22 ARG A 150 9.884 -12.595 -8.607 1.00 1.36 H new ATOM 432 N GLU A 151 3.425 -11.981 -3.971 1.00 0.36 N ATOM 433 CA GLU A 151 2.189 -12.228 -4.651 1.00 0.45 C ATOM 434 C GLU A 151 1.194 -11.215 -4.148 1.00 0.49 C ATOM 435 O GLU A 151 0.249 -10.861 -4.836 1.00 0.59 O ATOM 436 CB GLU A 151 1.705 -13.656 -4.436 1.00 0.57 C ATOM 437 CG GLU A 151 1.634 -14.056 -2.990 1.00 0.82 C ATOM 438 CD GLU A 151 0.787 -15.291 -2.780 1.00 1.60 C ATOM 439 OE1 GLU A 151 -0.440 -15.211 -2.986 1.00 2.11 O ATOM 440 OE2 GLU A 151 1.343 -16.338 -2.386 1.00 2.16 O ATOM 0 H GLU A 151 3.469 -12.369 -3.029 1.00 0.36 H new ATOM 0 HA GLU A 151 2.320 -12.123 -5.728 1.00 0.45 H new ATOM 0 HB2 GLU A 151 0.718 -13.767 -4.884 1.00 0.57 H new ATOM 0 HB3 GLU A 151 2.372 -14.340 -4.961 1.00 0.57 H new ATOM 0 HG2 GLU A 151 2.641 -14.240 -2.616 1.00 0.82 H new ATOM 0 HG3 GLU A 151 1.223 -13.232 -2.407 1.00 0.82 H new ATOM 447 N ASN A 152 1.470 -10.721 -2.925 1.00 0.45 N ATOM 448 CA ASN A 152 0.743 -9.603 -2.305 1.00 0.50 C ATOM 449 C ASN A 152 0.886 -8.363 -3.144 1.00 0.55 C ATOM 450 O ASN A 152 0.401 -7.302 -2.823 1.00 0.88 O ATOM 451 CB ASN A 152 1.203 -9.391 -0.844 1.00 0.46 C ATOM 452 CG ASN A 152 1.603 -7.971 -0.453 1.00 0.51 C ATOM 453 OD1 ASN A 152 0.771 -7.150 -0.095 1.00 0.85 O ATOM 454 ND2 ASN A 152 2.892 -7.689 -0.490 1.00 0.67 N ATOM 0 H ASN A 152 2.214 -11.094 -2.335 1.00 0.45 H new ATOM 0 HA ASN A 152 -0.319 -9.844 -2.264 1.00 0.50 H new ATOM 0 HB2 ASN A 152 0.398 -9.712 -0.183 1.00 0.46 H new ATOM 0 HB3 ASN A 152 2.052 -10.048 -0.655 1.00 0.46 H new ATOM 0 HD21 ASN A 152 3.220 -6.763 -0.215 1.00 0.67 H new ATOM 0 HD22 ASN A 152 3.560 -8.397 -0.794 1.00 0.67 H new ATOM 461 N MET A 153 1.613 -8.493 -4.202 1.00 0.43 N ATOM 462 CA MET A 153 1.748 -7.420 -5.125 1.00 0.46 C ATOM 463 C MET A 153 0.808 -7.584 -6.324 1.00 0.51 C ATOM 464 O MET A 153 0.682 -6.694 -7.166 1.00 0.63 O ATOM 465 CB MET A 153 3.191 -7.381 -5.479 1.00 0.42 C ATOM 466 CG MET A 153 3.574 -7.899 -6.853 1.00 0.92 C ATOM 467 SD MET A 153 5.359 -8.010 -6.981 1.00 1.27 S ATOM 468 CE MET A 153 5.712 -8.238 -5.240 1.00 1.39 C ATOM 0 H MET A 153 2.126 -9.339 -4.449 1.00 0.43 H new ATOM 0 HA MET A 153 1.447 -6.463 -4.699 1.00 0.46 H new ATOM 0 HB2 MET A 153 3.533 -6.349 -5.398 1.00 0.42 H new ATOM 0 HB3 MET A 153 3.739 -7.958 -4.734 1.00 0.42 H new ATOM 0 HG2 MET A 153 3.126 -8.878 -7.021 1.00 0.92 H new ATOM 0 HG3 MET A 153 3.185 -7.234 -7.624 1.00 0.92 H new ATOM 0 HE1 MET A 153 6.710 -8.660 -5.123 1.00 1.39 H new ATOM 0 HE2 MET A 153 5.662 -7.276 -4.730 1.00 1.39 H new ATOM 0 HE3 MET A 153 4.978 -8.917 -4.806 1.00 1.39 H new ATOM 478 N TYR A 154 0.141 -8.732 -6.374 1.00 0.49 N ATOM 479 CA TYR A 154 -0.886 -9.002 -7.374 1.00 0.55 C ATOM 480 C TYR A 154 -2.257 -8.996 -6.705 1.00 0.47 C ATOM 481 O TYR A 154 -3.180 -8.303 -7.135 1.00 0.59 O ATOM 482 CB TYR A 154 -0.666 -10.369 -8.026 1.00 0.66 C ATOM 483 CG TYR A 154 0.728 -10.588 -8.565 1.00 1.18 C ATOM 484 CD1 TYR A 154 1.182 -9.871 -9.666 1.00 1.57 C ATOM 485 CD2 TYR A 154 1.593 -11.498 -7.974 1.00 2.12 C ATOM 486 CE1 TYR A 154 2.456 -10.060 -10.163 1.00 2.39 C ATOM 487 CE2 TYR A 154 2.870 -11.692 -8.466 1.00 3.05 C ATOM 488 CZ TYR A 154 3.292 -11.013 -9.552 1.00 3.08 C ATOM 489 OH TYR A 154 4.566 -11.155 -10.056 1.00 4.05 O ATOM 0 H TYR A 154 0.297 -9.501 -5.723 1.00 0.49 H new ATOM 0 HA TYR A 154 -0.830 -8.229 -8.140 1.00 0.55 H new ATOM 0 HB2 TYR A 154 -0.885 -11.146 -7.294 1.00 0.66 H new ATOM 0 HB3 TYR A 154 -1.380 -10.488 -8.841 1.00 0.66 H new ATOM 0 HD1 TYR A 154 0.528 -9.155 -10.140 1.00 1.57 H new ATOM 0 HD2 TYR A 154 1.263 -12.064 -7.115 1.00 2.12 H new ATOM 0 HE1 TYR A 154 2.806 -9.485 -11.008 1.00 2.39 H new ATOM 0 HE2 TYR A 154 3.533 -12.391 -7.978 1.00 3.05 H new ATOM 0 HH TYR A 154 5.044 -11.843 -9.548 1.00 4.05 H new ATOM 499 N ARG A 155 -2.358 -9.775 -5.635 1.00 0.37 N ATOM 500 CA ARG A 155 -3.570 -9.889 -4.835 1.00 0.36 C ATOM 501 C ARG A 155 -3.803 -8.599 -4.102 1.00 0.31 C ATOM 502 O ARG A 155 -4.889 -8.028 -4.113 1.00 0.41 O ATOM 503 CB ARG A 155 -3.371 -11.012 -3.840 1.00 0.43 C ATOM 504 CG ARG A 155 -1.989 -10.978 -3.221 1.00 0.63 C ATOM 505 CD ARG A 155 -1.691 -12.292 -2.515 1.00 0.58 C ATOM 506 NE ARG A 155 -0.805 -12.149 -1.372 1.00 0.78 N ATOM 507 CZ ARG A 155 -1.009 -12.764 -0.209 1.00 1.20 C ATOM 508 NH1 ARG A 155 -2.043 -13.577 -0.050 1.00 1.05 N ATOM 509 NH2 ARG A 155 -0.167 -12.579 0.786 1.00 1.89 N ATOM 0 H ARG A 155 -1.590 -10.353 -5.294 1.00 0.37 H new ATOM 0 HA ARG A 155 -4.431 -10.097 -5.470 1.00 0.36 H new ATOM 0 HB2 ARG A 155 -4.123 -10.939 -3.054 1.00 0.43 H new ATOM 0 HB3 ARG A 155 -3.523 -11.970 -4.338 1.00 0.43 H new ATOM 0 HG2 ARG A 155 -1.242 -10.796 -3.994 1.00 0.63 H new ATOM 0 HG3 ARG A 155 -1.922 -10.153 -2.511 1.00 0.63 H new ATOM 0 HD2 ARG A 155 -2.629 -12.738 -2.184 1.00 0.58 H new ATOM 0 HD3 ARG A 155 -1.243 -12.984 -3.228 1.00 0.58 H new ATOM 0 HE ARG A 155 0.014 -11.548 -1.465 1.00 0.78 H new ATOM 0 HH11 ARG A 155 -2.690 -13.736 -0.822 1.00 1.05 H new ATOM 0 HH12 ARG A 155 -2.192 -14.044 0.844 1.00 1.05 H new ATOM 0 HH21 ARG A 155 0.639 -11.966 0.665 1.00 1.89 H new ATOM 0 HH22 ARG A 155 -0.321 -13.049 1.678 1.00 1.89 H new ATOM 523 N TYR A 156 -2.750 -8.145 -3.482 1.00 0.27 N ATOM 524 CA TYR A 156 -2.729 -6.855 -2.881 1.00 0.28 C ATOM 525 C TYR A 156 -1.992 -6.039 -3.867 1.00 0.39 C ATOM 526 O TYR A 156 -1.278 -6.607 -4.683 1.00 0.78 O ATOM 527 CB TYR A 156 -2.010 -6.907 -1.556 1.00 0.35 C ATOM 528 CG TYR A 156 -2.600 -7.929 -0.633 1.00 0.95 C ATOM 529 CD1 TYR A 156 -3.943 -7.901 -0.320 1.00 1.51 C ATOM 530 CD2 TYR A 156 -1.811 -8.909 -0.057 1.00 1.36 C ATOM 531 CE1 TYR A 156 -4.492 -8.818 0.536 1.00 2.14 C ATOM 532 CE2 TYR A 156 -2.355 -9.834 0.802 1.00 1.99 C ATOM 533 CZ TYR A 156 -3.675 -9.842 1.041 1.00 2.31 C ATOM 534 OH TYR A 156 -4.242 -10.698 1.939 1.00 2.98 O ATOM 0 H TYR A 156 -1.880 -8.668 -3.383 1.00 0.27 H new ATOM 0 HA TYR A 156 -3.719 -6.455 -2.663 1.00 0.28 H new ATOM 0 HB2 TYR A 156 -0.958 -7.136 -1.724 1.00 0.35 H new ATOM 0 HB3 TYR A 156 -2.051 -5.926 -1.083 1.00 0.35 H new ATOM 0 HD1 TYR A 156 -4.573 -7.142 -0.758 1.00 1.51 H new ATOM 0 HD2 TYR A 156 -0.756 -8.948 -0.285 1.00 1.36 H new ATOM 0 HE1 TYR A 156 -5.533 -8.755 0.817 1.00 2.14 H new ATOM 0 HE2 TYR A 156 -1.717 -10.558 1.287 1.00 1.99 H new ATOM 0 HH TYR A 156 -4.633 -10.186 2.677 1.00 2.98 H new ATOM 544 N PRO A 157 -2.142 -4.755 -3.923 1.00 0.28 N ATOM 545 CA PRO A 157 -1.523 -4.086 -4.998 1.00 0.29 C ATOM 546 C PRO A 157 -0.195 -3.450 -4.632 1.00 0.34 C ATOM 547 O PRO A 157 0.343 -3.631 -3.536 1.00 0.66 O ATOM 548 CB PRO A 157 -2.552 -3.015 -5.306 1.00 0.31 C ATOM 549 CG PRO A 157 -3.005 -2.596 -3.941 1.00 0.32 C ATOM 550 CD PRO A 157 -2.948 -3.851 -3.084 1.00 0.33 C ATOM 0 HA PRO A 157 -1.274 -4.755 -5.822 1.00 0.29 H new ATOM 0 HB2 PRO A 157 -2.118 -2.184 -5.862 1.00 0.31 H new ATOM 0 HB3 PRO A 157 -3.375 -3.404 -5.905 1.00 0.31 H new ATOM 0 HG2 PRO A 157 -2.359 -1.816 -3.537 1.00 0.32 H new ATOM 0 HG3 PRO A 157 -4.016 -2.189 -3.972 1.00 0.32 H new ATOM 0 HD2 PRO A 157 -2.480 -3.665 -2.117 1.00 0.33 H new ATOM 0 HD3 PRO A 157 -3.941 -4.255 -2.885 1.00 0.33 H new ATOM 558 N ASN A 158 0.313 -2.710 -5.576 1.00 0.32 N ATOM 559 CA ASN A 158 1.455 -1.861 -5.377 1.00 0.31 C ATOM 560 C ASN A 158 1.053 -0.444 -5.703 1.00 0.33 C ATOM 561 O ASN A 158 1.699 0.262 -6.464 1.00 0.42 O ATOM 562 CB ASN A 158 2.618 -2.329 -6.236 1.00 0.40 C ATOM 563 CG ASN A 158 2.181 -2.934 -7.567 1.00 0.74 C ATOM 564 OD1 ASN A 158 1.147 -2.563 -8.131 1.00 1.47 O ATOM 565 ND2 ASN A 158 2.964 -3.870 -8.082 1.00 1.42 N ATOM 0 H ASN A 158 -0.062 -2.679 -6.524 1.00 0.32 H new ATOM 0 HA ASN A 158 1.789 -1.907 -4.340 1.00 0.31 H new ATOM 0 HB2 ASN A 158 3.281 -1.485 -6.429 1.00 0.40 H new ATOM 0 HB3 ASN A 158 3.196 -3.068 -5.681 1.00 0.40 H new ATOM 0 HD21 ASN A 158 2.720 -4.307 -8.970 1.00 1.42 H new ATOM 0 HD22 ASN A 158 3.811 -4.153 -7.590 1.00 1.42 H new ATOM 572 N GLN A 159 -0.049 -0.054 -5.106 1.00 0.30 N ATOM 573 CA GLN A 159 -0.652 1.233 -5.339 1.00 0.31 C ATOM 574 C GLN A 159 -1.668 1.488 -4.250 1.00 0.28 C ATOM 575 O GLN A 159 -2.109 0.544 -3.593 1.00 0.29 O ATOM 576 CB GLN A 159 -1.313 1.249 -6.713 1.00 0.38 C ATOM 577 CG GLN A 159 -2.228 0.058 -6.952 1.00 0.44 C ATOM 578 CD GLN A 159 -2.740 -0.027 -8.374 1.00 0.92 C ATOM 579 OE1 GLN A 159 -2.107 -0.629 -9.239 1.00 1.63 O ATOM 580 NE2 GLN A 159 -3.899 0.555 -8.622 1.00 1.50 N ATOM 0 H GLN A 159 -0.557 -0.631 -4.436 1.00 0.30 H new ATOM 0 HA GLN A 159 0.104 2.018 -5.319 1.00 0.31 H new ATOM 0 HB2 GLN A 159 -1.888 2.168 -6.821 1.00 0.38 H new ATOM 0 HB3 GLN A 159 -0.540 1.265 -7.481 1.00 0.38 H new ATOM 0 HG2 GLN A 159 -1.690 -0.859 -6.711 1.00 0.44 H new ATOM 0 HG3 GLN A 159 -3.077 0.118 -6.270 1.00 0.44 H new ATOM 0 HE21 GLN A 159 -4.393 1.045 -7.877 1.00 1.50 H new ATOM 0 HE22 GLN A 159 -4.300 0.514 -9.559 1.00 1.50 H new ATOM 589 N VAL A 160 -2.053 2.731 -4.054 1.00 0.30 N ATOM 590 CA VAL A 160 -2.960 3.063 -2.986 1.00 0.28 C ATOM 591 C VAL A 160 -3.962 4.071 -3.482 1.00 0.31 C ATOM 592 O VAL A 160 -3.801 4.609 -4.566 1.00 0.53 O ATOM 593 CB VAL A 160 -2.239 3.590 -1.725 1.00 0.28 C ATOM 594 CG1 VAL A 160 -1.834 2.434 -0.821 1.00 0.30 C ATOM 595 CG2 VAL A 160 -1.014 4.409 -2.096 1.00 0.29 C ATOM 0 H VAL A 160 -1.751 3.524 -4.621 1.00 0.30 H new ATOM 0 HA VAL A 160 -3.467 2.146 -2.686 1.00 0.28 H new ATOM 0 HB VAL A 160 -2.935 4.235 -1.189 1.00 0.28 H new ATOM 0 HG11 VAL A 160 -1.327 2.823 0.062 1.00 0.30 H new ATOM 0 HG12 VAL A 160 -2.723 1.882 -0.516 1.00 0.30 H new ATOM 0 HG13 VAL A 160 -1.161 1.768 -1.361 1.00 0.30 H new ATOM 0 HG21 VAL A 160 -0.527 4.767 -1.189 1.00 0.29 H new ATOM 0 HG22 VAL A 160 -0.318 3.788 -2.661 1.00 0.29 H new ATOM 0 HG23 VAL A 160 -1.317 5.261 -2.705 1.00 0.29 H new ATOM 605 N TYR A 161 -5.021 4.297 -2.742 1.00 0.32 N ATOM 606 CA TYR A 161 -6.014 5.240 -3.195 1.00 0.36 C ATOM 607 C TYR A 161 -6.180 6.364 -2.188 1.00 0.34 C ATOM 608 O TYR A 161 -6.760 6.178 -1.121 1.00 0.42 O ATOM 609 CB TYR A 161 -7.355 4.559 -3.457 1.00 0.49 C ATOM 610 CG TYR A 161 -7.263 3.154 -4.026 1.00 0.44 C ATOM 611 CD1 TYR A 161 -7.074 2.066 -3.186 1.00 0.38 C ATOM 612 CD2 TYR A 161 -7.341 2.917 -5.392 1.00 0.65 C ATOM 613 CE1 TYR A 161 -6.974 0.783 -3.687 1.00 0.49 C ATOM 614 CE2 TYR A 161 -7.241 1.636 -5.900 1.00 0.74 C ATOM 615 CZ TYR A 161 -7.131 0.588 -5.092 1.00 0.63 C ATOM 616 OH TYR A 161 -6.953 -0.701 -5.548 1.00 0.82 O ATOM 0 H TYR A 161 -5.215 3.853 -1.845 1.00 0.32 H new ATOM 0 HA TYR A 161 -5.664 5.661 -4.138 1.00 0.36 H new ATOM 0 HB2 TYR A 161 -7.914 4.520 -2.522 1.00 0.49 H new ATOM 0 HB3 TYR A 161 -7.930 5.177 -4.147 1.00 0.49 H new ATOM 0 HD1 TYR A 161 -7.004 2.226 -2.120 1.00 0.38 H new ATOM 0 HD2 TYR A 161 -7.482 3.747 -6.068 1.00 0.65 H new ATOM 0 HE1 TYR A 161 -6.782 -0.053 -3.031 1.00 0.49 H new ATOM 0 HE2 TYR A 161 -7.252 1.485 -6.969 1.00 0.74 H new ATOM 0 HH TYR A 161 -7.083 -0.725 -6.519 1.00 0.82 H new ATOM 626 N TYR A 162 -5.649 7.526 -2.536 1.00 0.31 N ATOM 627 CA TYR A 162 -5.705 8.691 -1.670 1.00 0.27 C ATOM 628 C TYR A 162 -5.508 9.940 -2.506 1.00 0.31 C ATOM 629 O TYR A 162 -5.092 9.836 -3.613 1.00 0.55 O ATOM 630 CB TYR A 162 -4.636 8.597 -0.588 1.00 0.39 C ATOM 631 CG TYR A 162 -3.241 9.030 -1.011 1.00 0.46 C ATOM 632 CD1 TYR A 162 -2.558 8.412 -2.051 1.00 0.77 C ATOM 633 CD2 TYR A 162 -2.610 10.069 -0.350 1.00 0.89 C ATOM 634 CE1 TYR A 162 -1.285 8.830 -2.411 1.00 1.16 C ATOM 635 CE2 TYR A 162 -1.347 10.490 -0.704 1.00 1.29 C ATOM 636 CZ TYR A 162 -0.689 9.869 -1.734 1.00 1.35 C ATOM 637 OH TYR A 162 0.571 10.291 -2.090 1.00 1.82 O ATOM 0 H TYR A 162 -5.170 7.687 -3.422 1.00 0.31 H new ATOM 0 HA TYR A 162 -6.678 8.735 -1.181 1.00 0.27 H new ATOM 0 HB2 TYR A 162 -4.946 9.208 0.260 1.00 0.39 H new ATOM 0 HB3 TYR A 162 -4.587 7.566 -0.237 1.00 0.39 H new ATOM 0 HD1 TYR A 162 -3.023 7.597 -2.585 1.00 0.77 H new ATOM 0 HD2 TYR A 162 -3.120 10.562 0.464 1.00 0.89 H new ATOM 0 HE1 TYR A 162 -0.763 8.341 -3.220 1.00 1.16 H new ATOM 0 HE2 TYR A 162 -0.878 11.305 -0.173 1.00 1.29 H new ATOM 0 HH TYR A 162 0.843 11.034 -1.512 1.00 1.82 H new ATOM 647 N ARG A 163 -5.778 11.110 -1.982 1.00 0.26 N ATOM 648 CA ARG A 163 -5.631 12.341 -2.750 1.00 0.32 C ATOM 649 C ARG A 163 -4.306 12.994 -2.359 1.00 0.36 C ATOM 650 O ARG A 163 -3.701 12.575 -1.380 1.00 0.41 O ATOM 651 CB ARG A 163 -6.810 13.294 -2.505 1.00 0.41 C ATOM 652 CG ARG A 163 -6.781 13.993 -1.160 1.00 0.75 C ATOM 653 CD ARG A 163 -7.396 15.377 -1.270 1.00 1.28 C ATOM 654 NE ARG A 163 -7.427 16.080 0.010 1.00 1.93 N ATOM 655 CZ ARG A 163 -6.981 17.323 0.188 1.00 2.58 C ATOM 656 NH1 ARG A 163 -6.414 17.985 -0.815 1.00 2.91 N ATOM 657 NH2 ARG A 163 -7.113 17.901 1.374 1.00 3.26 N ATOM 0 H ARG A 163 -6.102 11.245 -1.024 1.00 0.26 H new ATOM 0 HA ARG A 163 -5.629 12.111 -3.815 1.00 0.32 H new ATOM 0 HB2 ARG A 163 -6.822 14.048 -3.292 1.00 0.41 H new ATOM 0 HB3 ARG A 163 -7.740 12.731 -2.588 1.00 0.41 H new ATOM 0 HG2 ARG A 163 -7.327 13.403 -0.424 1.00 0.75 H new ATOM 0 HG3 ARG A 163 -5.753 14.072 -0.806 1.00 0.75 H new ATOM 0 HD2 ARG A 163 -6.829 15.966 -1.991 1.00 1.28 H new ATOM 0 HD3 ARG A 163 -8.411 15.290 -1.657 1.00 1.28 H new ATOM 0 HE ARG A 163 -7.814 15.590 0.817 1.00 1.93 H new ATOM 0 HH11 ARG A 163 -6.318 17.542 -1.729 1.00 2.91 H new ATOM 0 HH12 ARG A 163 -6.075 18.936 -0.671 1.00 2.91 H new ATOM 0 HH21 ARG A 163 -7.553 17.394 2.142 1.00 3.26 H new ATOM 0 HH22 ARG A 163 -6.774 18.852 1.518 1.00 3.26 H new ATOM 671 N PRO A 164 -3.829 14.040 -3.060 1.00 0.45 N ATOM 672 CA PRO A 164 -2.440 14.457 -2.929 1.00 0.51 C ATOM 673 C PRO A 164 -2.247 15.490 -1.831 1.00 0.51 C ATOM 674 O PRO A 164 -3.030 16.427 -1.660 1.00 0.57 O ATOM 675 CB PRO A 164 -2.157 15.074 -4.292 1.00 0.65 C ATOM 676 CG PRO A 164 -3.459 15.669 -4.717 1.00 0.80 C ATOM 677 CD PRO A 164 -4.550 14.855 -4.058 1.00 0.53 C ATOM 0 HA PRO A 164 -1.779 13.634 -2.658 1.00 0.51 H new ATOM 0 HB2 PRO A 164 -1.377 15.833 -4.229 1.00 0.65 H new ATOM 0 HB3 PRO A 164 -1.814 14.323 -5.003 1.00 0.65 H new ATOM 0 HG2 PRO A 164 -3.522 16.715 -4.416 1.00 0.80 H new ATOM 0 HG3 PRO A 164 -3.560 15.643 -5.802 1.00 0.80 H new ATOM 0 HD2 PRO A 164 -5.297 15.494 -3.588 1.00 0.53 H new ATOM 0 HD3 PRO A 164 -5.075 14.230 -4.781 1.00 0.53 H new ATOM 685 N VAL A 165 -1.176 15.282 -1.093 1.00 0.52 N ATOM 686 CA VAL A 165 -1.003 15.858 0.220 1.00 0.50 C ATOM 687 C VAL A 165 0.419 16.390 0.395 1.00 0.49 C ATOM 688 O VAL A 165 1.311 16.042 -0.377 1.00 0.47 O ATOM 689 CB VAL A 165 -1.286 14.769 1.271 1.00 0.50 C ATOM 690 CG1 VAL A 165 -0.270 13.643 1.146 1.00 1.31 C ATOM 691 CG2 VAL A 165 -1.313 15.332 2.683 1.00 1.15 C ATOM 0 H VAL A 165 -0.393 14.701 -1.394 1.00 0.52 H new ATOM 0 HA VAL A 165 -1.693 16.693 0.343 1.00 0.50 H new ATOM 0 HB VAL A 165 -2.280 14.366 1.076 1.00 0.50 H new ATOM 0 HG11 VAL A 165 -0.480 12.879 1.894 1.00 1.31 H new ATOM 0 HG12 VAL A 165 -0.334 13.204 0.151 1.00 1.31 H new ATOM 0 HG13 VAL A 165 0.733 14.039 1.304 1.00 1.31 H new ATOM 0 HG21 VAL A 165 -1.516 14.529 3.391 1.00 1.15 H new ATOM 0 HG22 VAL A 165 -0.348 15.784 2.913 1.00 1.15 H new ATOM 0 HG23 VAL A 165 -2.095 16.088 2.758 1.00 1.15 H new ATOM 701 N ASP A 166 0.606 17.222 1.413 1.00 0.62 N ATOM 702 CA ASP A 166 1.902 17.815 1.724 1.00 0.67 C ATOM 703 C ASP A 166 1.770 18.716 2.941 1.00 0.90 C ATOM 704 O ASP A 166 2.540 18.629 3.898 1.00 1.48 O ATOM 705 CB ASP A 166 2.428 18.608 0.521 1.00 0.62 C ATOM 706 CG ASP A 166 3.377 19.727 0.916 1.00 0.70 C ATOM 707 OD1 ASP A 166 4.575 19.455 1.110 1.00 0.90 O ATOM 708 OD2 ASP A 166 2.923 20.887 1.033 1.00 1.07 O ATOM 0 H ASP A 166 -0.140 17.506 2.049 1.00 0.62 H new ATOM 0 HA ASP A 166 2.616 17.021 1.946 1.00 0.67 H new ATOM 0 HB2 ASP A 166 2.940 17.928 -0.159 1.00 0.62 H new ATOM 0 HB3 ASP A 166 1.585 19.030 -0.026 1.00 0.62 H new ATOM 713 N GLN A 167 0.742 19.540 2.912 1.00 0.75 N ATOM 714 CA GLN A 167 0.481 20.502 3.971 1.00 0.96 C ATOM 715 C GLN A 167 -0.406 19.902 5.060 1.00 0.87 C ATOM 716 O GLN A 167 -1.176 20.606 5.708 1.00 1.10 O ATOM 717 CB GLN A 167 -0.166 21.747 3.362 1.00 1.34 C ATOM 718 CG GLN A 167 -1.347 21.436 2.460 1.00 1.50 C ATOM 719 CD GLN A 167 -1.696 22.591 1.549 1.00 2.16 C ATOM 720 OE1 GLN A 167 -2.513 23.444 1.887 1.00 2.71 O ATOM 721 NE2 GLN A 167 -1.070 22.625 0.386 1.00 2.72 N ATOM 0 H GLN A 167 0.061 19.564 2.153 1.00 0.75 H new ATOM 0 HA GLN A 167 1.424 20.777 4.444 1.00 0.96 H new ATOM 0 HB2 GLN A 167 -0.496 22.405 4.166 1.00 1.34 H new ATOM 0 HB3 GLN A 167 0.584 22.294 2.790 1.00 1.34 H new ATOM 0 HG2 GLN A 167 -1.119 20.557 1.857 1.00 1.50 H new ATOM 0 HG3 GLN A 167 -2.213 21.186 3.073 1.00 1.50 H new ATOM 0 HE21 GLN A 167 -0.399 21.895 0.147 1.00 2.72 H new ATOM 0 HE22 GLN A 167 -1.258 23.381 -0.272 1.00 2.72 H new ATOM 730 N TYR A 168 -0.280 18.600 5.271 1.00 0.82 N ATOM 731 CA TYR A 168 -1.054 17.920 6.302 1.00 0.92 C ATOM 732 C TYR A 168 -0.134 17.441 7.427 1.00 0.95 C ATOM 733 O TYR A 168 -0.577 17.250 8.563 1.00 1.61 O ATOM 734 CB TYR A 168 -1.830 16.747 5.693 1.00 1.02 C ATOM 735 CG TYR A 168 -2.809 16.104 6.643 1.00 1.24 C ATOM 736 CD1 TYR A 168 -4.080 16.628 6.817 1.00 2.02 C ATOM 737 CD2 TYR A 168 -2.464 14.964 7.355 1.00 1.62 C ATOM 738 CE1 TYR A 168 -4.983 16.037 7.675 1.00 2.63 C ATOM 739 CE2 TYR A 168 -3.364 14.362 8.214 1.00 2.11 C ATOM 740 CZ TYR A 168 -4.600 14.934 8.412 1.00 2.50 C ATOM 741 OH TYR A 168 -5.529 14.306 9.212 1.00 3.21 O ATOM 0 H TYR A 168 0.349 17.994 4.744 1.00 0.82 H new ATOM 0 HA TYR A 168 -1.772 18.622 6.726 1.00 0.92 H new ATOM 0 HB2 TYR A 168 -2.369 17.098 4.813 1.00 1.02 H new ATOM 0 HB3 TYR A 168 -1.121 15.993 5.352 1.00 1.02 H new ATOM 0 HD1 TYR A 168 -4.368 17.514 6.271 1.00 2.02 H new ATOM 0 HD2 TYR A 168 -1.477 14.541 7.236 1.00 1.62 H new ATOM 0 HE1 TYR A 168 -5.983 16.434 7.770 1.00 2.63 H new ATOM 0 HE2 TYR A 168 -3.099 13.449 8.726 1.00 2.11 H new ATOM 0 HH TYR A 168 -5.109 13.546 9.666 1.00 3.21 H new ATOM 751 N SER A 169 1.140 17.231 7.081 1.00 1.17 N ATOM 752 CA SER A 169 2.200 16.893 8.038 1.00 1.17 C ATOM 753 C SER A 169 2.106 15.447 8.548 1.00 1.05 C ATOM 754 O SER A 169 3.083 14.702 8.486 1.00 1.12 O ATOM 755 CB SER A 169 2.200 17.885 9.202 1.00 1.40 C ATOM 756 OG SER A 169 2.327 19.217 8.724 1.00 1.94 O ATOM 0 H SER A 169 1.469 17.292 6.117 1.00 1.17 H new ATOM 0 HA SER A 169 3.148 16.968 7.505 1.00 1.17 H new ATOM 0 HB2 SER A 169 1.277 17.784 9.773 1.00 1.40 H new ATOM 0 HB3 SER A 169 3.021 17.657 9.881 1.00 1.40 H new ATOM 0 HG SER A 169 2.323 19.838 9.482 1.00 1.94 H new ATOM 762 N ASN A 170 0.943 15.054 9.050 1.00 0.98 N ATOM 763 CA ASN A 170 0.746 13.701 9.568 1.00 0.89 C ATOM 764 C ASN A 170 0.803 12.688 8.430 1.00 0.68 C ATOM 765 O ASN A 170 0.005 12.760 7.496 1.00 0.75 O ATOM 766 CB ASN A 170 -0.609 13.582 10.277 1.00 1.08 C ATOM 767 CG ASN A 170 -0.847 14.637 11.347 1.00 1.74 C ATOM 768 OD1 ASN A 170 -1.982 15.061 11.561 1.00 2.20 O ATOM 769 ND2 ASN A 170 0.204 15.065 12.031 1.00 2.25 N ATOM 0 H ASN A 170 0.119 15.652 9.111 1.00 0.98 H new ATOM 0 HA ASN A 170 1.543 13.496 10.283 1.00 0.89 H new ATOM 0 HB2 ASN A 170 -1.403 13.649 9.533 1.00 1.08 H new ATOM 0 HB3 ASN A 170 -0.682 12.595 10.733 1.00 1.08 H new ATOM 0 HD21 ASN A 170 0.086 15.767 12.761 1.00 2.25 H new ATOM 0 HD22 ASN A 170 1.131 14.692 11.828 1.00 2.25 H new ATOM 776 N GLN A 171 1.737 11.743 8.502 1.00 0.63 N ATOM 777 CA GLN A 171 1.897 10.759 7.432 1.00 0.56 C ATOM 778 C GLN A 171 1.151 9.485 7.753 1.00 0.47 C ATOM 779 O GLN A 171 0.162 9.190 7.118 1.00 0.60 O ATOM 780 CB GLN A 171 3.361 10.410 7.175 1.00 0.86 C ATOM 781 CG GLN A 171 4.217 11.597 6.813 1.00 0.71 C ATOM 782 CD GLN A 171 5.092 12.042 7.964 1.00 1.11 C ATOM 783 OE1 GLN A 171 6.176 12.586 7.759 1.00 1.63 O ATOM 784 NE2 GLN A 171 4.642 11.796 9.187 1.00 1.41 N ATOM 0 H GLN A 171 2.388 11.637 9.280 1.00 0.63 H new ATOM 0 HA GLN A 171 1.485 11.221 6.534 1.00 0.56 H new ATOM 0 HB2 GLN A 171 3.773 9.935 8.066 1.00 0.86 H new ATOM 0 HB3 GLN A 171 3.414 9.677 6.370 1.00 0.86 H new ATOM 0 HG2 GLN A 171 4.845 11.343 5.959 1.00 0.71 H new ATOM 0 HG3 GLN A 171 3.577 12.424 6.504 1.00 0.71 H new ATOM 0 HE21 GLN A 171 3.737 11.343 9.316 1.00 1.41 H new ATOM 0 HE22 GLN A 171 5.201 12.060 9.999 1.00 1.41 H new ATOM 793 N ASN A 172 1.609 8.759 8.770 1.00 0.47 N ATOM 794 CA ASN A 172 1.019 7.464 9.133 1.00 0.49 C ATOM 795 C ASN A 172 -0.495 7.555 9.276 1.00 0.42 C ATOM 796 O ASN A 172 -1.211 6.588 9.048 1.00 0.52 O ATOM 797 CB ASN A 172 1.628 6.930 10.435 1.00 0.65 C ATOM 798 CG ASN A 172 1.374 7.836 11.633 1.00 1.19 C ATOM 799 OD1 ASN A 172 1.258 9.056 11.502 1.00 1.88 O ATOM 800 ND2 ASN A 172 1.295 7.245 12.814 1.00 1.56 N ATOM 0 H ASN A 172 2.390 9.043 9.362 1.00 0.47 H new ATOM 0 HA ASN A 172 1.246 6.772 8.322 1.00 0.49 H new ATOM 0 HB2 ASN A 172 1.217 5.942 10.642 1.00 0.65 H new ATOM 0 HB3 ASN A 172 2.703 6.807 10.302 1.00 0.65 H new ATOM 0 HD21 ASN A 172 1.133 7.802 13.653 1.00 1.56 H new ATOM 0 HD22 ASN A 172 1.396 6.233 12.885 1.00 1.56 H new ATOM 807 N SER A 173 -0.968 8.727 9.645 1.00 0.41 N ATOM 808 CA SER A 173 -2.387 8.977 9.792 1.00 0.46 C ATOM 809 C SER A 173 -3.076 9.034 8.428 1.00 0.37 C ATOM 810 O SER A 173 -3.923 8.196 8.114 1.00 0.36 O ATOM 811 CB SER A 173 -2.564 10.295 10.547 1.00 0.60 C ATOM 812 OG SER A 173 -3.903 10.482 10.970 1.00 0.74 O ATOM 0 H SER A 173 -0.379 9.534 9.852 1.00 0.41 H new ATOM 0 HA SER A 173 -2.850 8.164 10.351 1.00 0.46 H new ATOM 0 HB2 SER A 173 -1.903 10.309 11.414 1.00 0.60 H new ATOM 0 HB3 SER A 173 -2.266 11.124 9.906 1.00 0.60 H new ATOM 0 HG SER A 173 -3.979 11.333 11.450 1.00 0.74 H new ATOM 818 N PHE A 174 -2.687 10.008 7.618 1.00 0.33 N ATOM 819 CA PHE A 174 -3.284 10.218 6.302 1.00 0.32 C ATOM 820 C PHE A 174 -2.905 9.081 5.347 1.00 0.24 C ATOM 821 O PHE A 174 -3.645 8.740 4.425 1.00 0.30 O ATOM 822 CB PHE A 174 -2.814 11.574 5.760 1.00 0.40 C ATOM 823 CG PHE A 174 -3.335 11.923 4.400 1.00 0.61 C ATOM 824 CD1 PHE A 174 -4.556 12.550 4.265 1.00 1.12 C ATOM 825 CD2 PHE A 174 -2.613 11.610 3.260 1.00 0.99 C ATOM 826 CE1 PHE A 174 -5.051 12.864 3.022 1.00 1.41 C ATOM 827 CE2 PHE A 174 -3.106 11.925 2.007 1.00 1.29 C ATOM 828 CZ PHE A 174 -4.268 12.580 1.873 1.00 1.33 C ATOM 0 H PHE A 174 -1.951 10.675 7.851 1.00 0.33 H new ATOM 0 HA PHE A 174 -4.371 10.220 6.387 1.00 0.32 H new ATOM 0 HB2 PHE A 174 -3.116 12.353 6.460 1.00 0.40 H new ATOM 0 HB3 PHE A 174 -1.724 11.579 5.728 1.00 0.40 H new ATOM 0 HD1 PHE A 174 -5.130 12.797 5.146 1.00 1.12 H new ATOM 0 HD2 PHE A 174 -1.657 11.116 3.351 1.00 0.99 H new ATOM 0 HE1 PHE A 174 -6.024 13.321 2.921 1.00 1.41 H new ATOM 0 HE2 PHE A 174 -2.549 11.640 1.127 1.00 1.29 H new ATOM 0 HZ PHE A 174 -4.607 12.890 0.895 1.00 1.33 H new ATOM 838 N VAL A 175 -1.758 8.483 5.605 1.00 0.20 N ATOM 839 CA VAL A 175 -1.202 7.453 4.751 1.00 0.20 C ATOM 840 C VAL A 175 -1.763 6.061 5.049 1.00 0.22 C ATOM 841 O VAL A 175 -2.320 5.421 4.164 1.00 0.25 O ATOM 842 CB VAL A 175 0.320 7.435 4.859 1.00 0.28 C ATOM 843 CG1 VAL A 175 0.859 6.118 4.397 1.00 0.33 C ATOM 844 CG2 VAL A 175 0.924 8.563 4.045 1.00 0.41 C ATOM 0 H VAL A 175 -1.182 8.700 6.419 1.00 0.20 H new ATOM 0 HA VAL A 175 -1.496 7.704 3.732 1.00 0.20 H new ATOM 0 HB VAL A 175 0.593 7.577 5.905 1.00 0.28 H new ATOM 0 HG11 VAL A 175 1.946 6.120 4.480 1.00 0.33 H new ATOM 0 HG12 VAL A 175 0.450 5.320 5.016 1.00 0.33 H new ATOM 0 HG13 VAL A 175 0.575 5.953 3.358 1.00 0.33 H new ATOM 0 HG21 VAL A 175 2.010 8.535 4.134 1.00 0.41 H new ATOM 0 HG22 VAL A 175 0.642 8.448 2.998 1.00 0.41 H new ATOM 0 HG23 VAL A 175 0.554 9.519 4.417 1.00 0.41 H new ATOM 854 N HIS A 176 -1.563 5.541 6.257 1.00 0.26 N ATOM 855 CA HIS A 176 -2.309 4.338 6.657 1.00 0.33 C ATOM 856 C HIS A 176 -3.807 4.487 6.329 1.00 0.30 C ATOM 857 O HIS A 176 -4.505 3.493 6.152 1.00 0.32 O ATOM 858 CB HIS A 176 -2.125 4.008 8.141 1.00 0.46 C ATOM 859 CG HIS A 176 -2.548 2.610 8.495 1.00 0.73 C ATOM 860 ND1 HIS A 176 -1.669 1.551 8.538 1.00 0.97 N ATOM 861 CD2 HIS A 176 -3.763 2.094 8.803 1.00 1.40 C ATOM 862 CE1 HIS A 176 -2.323 0.447 8.849 1.00 1.32 C ATOM 863 NE2 HIS A 176 -3.595 0.749 9.018 1.00 1.69 N ATOM 0 H HIS A 176 -0.919 5.911 6.956 1.00 0.26 H new ATOM 0 HA HIS A 176 -1.899 3.508 6.082 1.00 0.33 H new ATOM 0 HB2 HIS A 176 -1.077 4.142 8.409 1.00 0.46 H new ATOM 0 HB3 HIS A 176 -2.700 4.716 8.738 1.00 0.46 H new ATOM 0 HD1 HIS A 176 -0.667 1.610 8.357 1.00 0.97 H new ATOM 0 HD2 HIS A 176 -4.692 2.641 8.867 1.00 1.40 H new ATOM 0 HE1 HIS A 176 -1.889 -0.537 8.948 1.00 1.32 H new ATOM 872 N ASP A 177 -4.293 5.729 6.239 1.00 0.30 N ATOM 873 CA ASP A 177 -5.648 5.991 5.738 1.00 0.33 C ATOM 874 C ASP A 177 -5.787 5.492 4.320 1.00 0.28 C ATOM 875 O ASP A 177 -6.702 4.742 4.034 1.00 0.29 O ATOM 876 CB ASP A 177 -5.967 7.477 5.761 1.00 0.41 C ATOM 877 CG ASP A 177 -7.429 7.751 5.471 1.00 0.60 C ATOM 878 OD1 ASP A 177 -8.286 7.320 6.270 1.00 0.81 O ATOM 879 OD2 ASP A 177 -7.728 8.417 4.458 1.00 0.84 O ATOM 0 H ASP A 177 -3.773 6.565 6.505 1.00 0.30 H new ATOM 0 HA ASP A 177 -6.344 5.466 6.392 1.00 0.33 H new ATOM 0 HB2 ASP A 177 -5.708 7.888 6.737 1.00 0.41 H new ATOM 0 HB3 ASP A 177 -5.349 7.991 5.025 1.00 0.41 H new ATOM 884 N CYS A 178 -4.853 5.896 3.453 1.00 0.26 N ATOM 885 CA CYS A 178 -4.820 5.467 2.058 1.00 0.27 C ATOM 886 C CYS A 178 -5.036 3.969 1.979 1.00 0.24 C ATOM 887 O CYS A 178 -5.698 3.458 1.085 1.00 0.29 O ATOM 888 CB CYS A 178 -3.453 5.737 1.421 1.00 0.34 C ATOM 889 SG CYS A 178 -2.573 7.242 1.929 1.00 0.79 S ATOM 0 H CYS A 178 -4.097 6.533 3.704 1.00 0.26 H new ATOM 0 HA CYS A 178 -5.599 6.022 1.536 1.00 0.27 H new ATOM 0 HB2 CYS A 178 -2.809 4.883 1.633 1.00 0.34 H new ATOM 0 HB3 CYS A 178 -3.587 5.775 0.340 1.00 0.34 H new ATOM 894 N VAL A 179 -4.448 3.276 2.932 1.00 0.23 N ATOM 895 CA VAL A 179 -4.470 1.834 2.951 1.00 0.22 C ATOM 896 C VAL A 179 -5.738 1.305 3.611 1.00 0.22 C ATOM 897 O VAL A 179 -6.230 0.239 3.250 1.00 0.22 O ATOM 898 CB VAL A 179 -3.221 1.294 3.651 1.00 0.21 C ATOM 899 CG1 VAL A 179 -2.148 2.354 3.675 1.00 0.21 C ATOM 900 CG2 VAL A 179 -3.530 0.769 5.035 1.00 0.24 C ATOM 0 H VAL A 179 -3.944 3.698 3.712 1.00 0.23 H new ATOM 0 HA VAL A 179 -4.469 1.481 1.920 1.00 0.22 H new ATOM 0 HB VAL A 179 -2.849 0.442 3.081 1.00 0.21 H new ATOM 0 HG11 VAL A 179 -1.262 1.963 4.175 1.00 0.21 H new ATOM 0 HG12 VAL A 179 -1.894 2.637 2.654 1.00 0.21 H new ATOM 0 HG13 VAL A 179 -2.512 3.228 4.214 1.00 0.21 H new ATOM 0 HG21 VAL A 179 -2.615 0.396 5.495 1.00 0.24 H new ATOM 0 HG22 VAL A 179 -3.941 1.573 5.646 1.00 0.24 H new ATOM 0 HG23 VAL A 179 -4.256 -0.040 4.963 1.00 0.24 H new ATOM 910 N ASN A 180 -6.287 2.064 4.554 1.00 0.25 N ATOM 911 CA ASN A 180 -7.603 1.758 5.102 1.00 0.27 C ATOM 912 C ASN A 180 -8.643 1.903 4.001 1.00 0.27 C ATOM 913 O ASN A 180 -9.827 1.647 4.196 1.00 0.30 O ATOM 914 CB ASN A 180 -7.948 2.668 6.288 1.00 0.31 C ATOM 915 CG ASN A 180 -7.227 2.266 7.561 1.00 0.77 C ATOM 916 OD1 ASN A 180 -6.885 1.099 7.750 1.00 1.41 O ATOM 917 ND2 ASN A 180 -7.003 3.220 8.455 1.00 1.30 N ATOM 0 H ASN A 180 -5.843 2.891 4.953 1.00 0.25 H new ATOM 0 HA ASN A 180 -7.596 0.734 5.474 1.00 0.27 H new ATOM 0 HB2 ASN A 180 -7.690 3.697 6.038 1.00 0.31 H new ATOM 0 HB3 ASN A 180 -9.024 2.642 6.460 1.00 0.31 H new ATOM 0 HD21 ASN A 180 -6.533 2.997 9.332 1.00 1.30 H new ATOM 0 HD22 ASN A 180 -7.300 4.177 8.265 1.00 1.30 H new ATOM 924 N ILE A 181 -8.177 2.403 2.869 1.00 0.25 N ATOM 925 CA ILE A 181 -8.911 2.374 1.622 1.00 0.29 C ATOM 926 C ILE A 181 -8.431 1.216 0.750 1.00 0.27 C ATOM 927 O ILE A 181 -9.225 0.436 0.252 1.00 0.36 O ATOM 928 CB ILE A 181 -8.703 3.678 0.839 1.00 0.35 C ATOM 929 CG1 ILE A 181 -8.355 4.812 1.774 1.00 0.49 C ATOM 930 CG2 ILE A 181 -9.948 4.050 0.102 1.00 0.40 C ATOM 931 CD1 ILE A 181 -9.512 5.240 2.648 1.00 1.14 C ATOM 0 H ILE A 181 -7.262 2.847 2.793 1.00 0.25 H new ATOM 0 HA ILE A 181 -9.967 2.251 1.864 1.00 0.29 H new ATOM 0 HB ILE A 181 -7.887 3.512 0.136 1.00 0.35 H new ATOM 0 HG12 ILE A 181 -7.522 4.509 2.408 1.00 0.49 H new ATOM 0 HG13 ILE A 181 -8.015 5.666 1.188 1.00 0.49 H new ATOM 0 HG21 ILE A 181 -9.782 4.977 -0.447 1.00 0.40 H new ATOM 0 HG22 ILE A 181 -10.208 3.255 -0.597 1.00 0.40 H new ATOM 0 HG23 ILE A 181 -10.763 4.190 0.812 1.00 0.40 H new ATOM 0 HD11 ILE A 181 -9.196 6.058 3.296 1.00 1.14 H new ATOM 0 HD12 ILE A 181 -10.338 5.573 2.020 1.00 1.14 H new ATOM 0 HD13 ILE A 181 -9.837 4.398 3.259 1.00 1.14 H new ATOM 943 N THR A 182 -7.112 1.096 0.631 1.00 0.20 N ATOM 944 CA THR A 182 -6.469 0.260 -0.382 1.00 0.20 C ATOM 945 C THR A 182 -6.554 -1.192 -0.067 1.00 0.24 C ATOM 946 O THR A 182 -7.042 -1.996 -0.869 1.00 0.26 O ATOM 947 CB THR A 182 -4.980 0.591 -0.542 1.00 0.20 C ATOM 948 OG1 THR A 182 -4.837 1.888 -1.076 1.00 0.22 O ATOM 949 CG2 THR A 182 -4.310 -0.400 -1.477 1.00 0.26 C ATOM 0 H THR A 182 -6.452 1.580 1.240 1.00 0.20 H new ATOM 0 HA THR A 182 -7.014 0.476 -1.301 1.00 0.20 H new ATOM 0 HB THR A 182 -4.508 0.534 0.439 1.00 0.20 H new ATOM 0 HG1 THR A 182 -5.314 1.945 -1.930 1.00 0.22 H new ATOM 0 HG21 THR A 182 -3.254 -0.149 -1.578 1.00 0.26 H new ATOM 0 HG22 THR A 182 -4.406 -1.407 -1.070 1.00 0.26 H new ATOM 0 HG23 THR A 182 -4.788 -0.357 -2.456 1.00 0.26 H new ATOM 957 N VAL A 183 -6.053 -1.525 1.097 1.00 0.28 N ATOM 958 CA VAL A 183 -5.971 -2.891 1.507 1.00 0.36 C ATOM 959 C VAL A 183 -7.366 -3.468 1.526 1.00 0.44 C ATOM 960 O VAL A 183 -7.566 -4.654 1.354 1.00 0.74 O ATOM 961 CB VAL A 183 -5.281 -3.013 2.878 1.00 0.34 C ATOM 962 CG1 VAL A 183 -4.198 -1.969 3.020 1.00 0.26 C ATOM 963 CG2 VAL A 183 -6.258 -2.945 4.038 1.00 0.40 C ATOM 0 H VAL A 183 -5.694 -0.856 1.778 1.00 0.28 H new ATOM 0 HA VAL A 183 -5.361 -3.457 0.803 1.00 0.36 H new ATOM 0 HB VAL A 183 -4.826 -4.003 2.917 1.00 0.34 H new ATOM 0 HG11 VAL A 183 -3.721 -2.070 3.995 1.00 0.26 H new ATOM 0 HG12 VAL A 183 -3.454 -2.108 2.236 1.00 0.26 H new ATOM 0 HG13 VAL A 183 -4.637 -0.975 2.932 1.00 0.26 H new ATOM 0 HG21 VAL A 183 -5.714 -3.036 4.978 1.00 0.40 H new ATOM 0 HG22 VAL A 183 -6.784 -1.991 4.015 1.00 0.40 H new ATOM 0 HG23 VAL A 183 -6.978 -3.759 3.955 1.00 0.40 H new ATOM 973 N LYS A 184 -8.325 -2.565 1.632 1.00 0.32 N ATOM 974 CA LYS A 184 -9.722 -2.918 1.693 1.00 0.34 C ATOM 975 C LYS A 184 -10.151 -3.499 0.375 1.00 0.35 C ATOM 976 O LYS A 184 -10.408 -4.692 0.252 1.00 0.37 O ATOM 977 CB LYS A 184 -10.556 -1.674 2.003 1.00 0.38 C ATOM 978 CG LYS A 184 -10.237 -1.048 3.345 1.00 0.43 C ATOM 979 CD LYS A 184 -9.304 -1.912 4.145 1.00 0.76 C ATOM 980 CE LYS A 184 -9.123 -1.451 5.578 1.00 0.60 C ATOM 981 NZ LYS A 184 -10.286 -1.796 6.440 1.00 1.00 N ATOM 0 H LYS A 184 -8.149 -1.561 1.678 1.00 0.32 H new ATOM 0 HA LYS A 184 -9.874 -3.656 2.481 1.00 0.34 H new ATOM 0 HB2 LYS A 184 -10.395 -0.934 1.219 1.00 0.38 H new ATOM 0 HB3 LYS A 184 -11.613 -1.940 1.978 1.00 0.38 H new ATOM 0 HG2 LYS A 184 -9.786 -0.067 3.193 1.00 0.43 H new ATOM 0 HG3 LYS A 184 -11.160 -0.892 3.904 1.00 0.43 H new ATOM 0 HD2 LYS A 184 -9.682 -2.934 4.147 1.00 0.76 H new ATOM 0 HD3 LYS A 184 -8.331 -1.932 3.654 1.00 0.76 H new ATOM 0 HE2 LYS A 184 -8.222 -1.905 5.991 1.00 0.60 H new ATOM 0 HE3 LYS A 184 -8.972 -0.372 5.592 1.00 0.60 H new ATOM 0 HZ1 LYS A 184 -10.112 -1.459 7.409 1.00 1.00 H new ATOM 0 HZ2 LYS A 184 -11.143 -1.342 6.064 1.00 1.00 H new ATOM 0 HZ3 LYS A 184 -10.416 -2.828 6.450 1.00 1.00 H new ATOM 995 N GLN A 185 -10.132 -2.643 -0.618 1.00 0.38 N ATOM 996 CA GLN A 185 -10.482 -2.989 -1.980 1.00 0.49 C ATOM 997 C GLN A 185 -9.866 -4.327 -2.363 1.00 0.51 C ATOM 998 O GLN A 185 -10.511 -5.192 -2.946 1.00 0.64 O ATOM 999 CB GLN A 185 -9.924 -1.902 -2.885 1.00 0.60 C ATOM 1000 CG GLN A 185 -9.991 -0.529 -2.259 1.00 0.78 C ATOM 1001 CD GLN A 185 -11.383 0.051 -2.214 1.00 1.38 C ATOM 1002 OE1 GLN A 185 -12.245 -0.278 -3.030 1.00 1.83 O ATOM 1003 NE2 GLN A 185 -11.598 0.952 -1.274 1.00 2.13 N ATOM 0 H GLN A 185 -9.868 -1.665 -0.502 1.00 0.38 H new ATOM 0 HA GLN A 185 -11.564 -3.069 -2.080 1.00 0.49 H new ATOM 0 HB2 GLN A 185 -8.888 -2.135 -3.129 1.00 0.60 H new ATOM 0 HB3 GLN A 185 -10.479 -1.896 -3.823 1.00 0.60 H new ATOM 0 HG2 GLN A 185 -9.597 -0.583 -1.244 1.00 0.78 H new ATOM 0 HG3 GLN A 185 -9.343 0.147 -2.817 1.00 0.78 H new ATOM 0 HE21 GLN A 185 -10.854 1.193 -0.619 1.00 2.13 H new ATOM 0 HE22 GLN A 185 -12.508 1.407 -1.202 1.00 2.13 H new ATOM 1012 N HIS A 186 -8.624 -4.494 -1.942 1.00 0.45 N ATOM 1013 CA HIS A 186 -7.772 -5.555 -2.426 1.00 0.54 C ATOM 1014 C HIS A 186 -7.735 -6.811 -1.542 1.00 0.69 C ATOM 1015 O HIS A 186 -7.109 -7.796 -1.916 1.00 1.31 O ATOM 1016 CB HIS A 186 -6.378 -4.994 -2.630 1.00 0.49 C ATOM 1017 CG HIS A 186 -6.105 -4.666 -4.062 1.00 0.53 C ATOM 1018 ND1 HIS A 186 -5.505 -5.544 -4.933 1.00 0.68 N ATOM 1019 CD2 HIS A 186 -6.374 -3.551 -4.781 1.00 0.54 C ATOM 1020 CE1 HIS A 186 -5.417 -4.987 -6.126 1.00 0.72 C ATOM 1021 NE2 HIS A 186 -5.935 -3.776 -6.059 1.00 0.66 N ATOM 0 H HIS A 186 -8.180 -3.891 -1.250 1.00 0.45 H new ATOM 0 HA HIS A 186 -8.200 -5.903 -3.366 1.00 0.54 H new ATOM 0 HB2 HIS A 186 -6.257 -4.096 -2.024 1.00 0.49 H new ATOM 0 HB3 HIS A 186 -5.642 -5.717 -2.278 1.00 0.49 H new ATOM 0 HD1 HIS A 186 -5.179 -6.480 -4.694 1.00 0.68 H new ATOM 0 HD2 HIS A 186 -6.847 -2.651 -4.415 1.00 0.54 H new ATOM 0 HE1 HIS A 186 -4.993 -5.445 -7.007 1.00 0.72 H new ATOM 1030 N THR A 187 -8.404 -6.803 -0.402 1.00 0.38 N ATOM 1031 CA THR A 187 -8.377 -7.966 0.484 1.00 0.45 C ATOM 1032 C THR A 187 -9.784 -8.373 0.922 1.00 0.54 C ATOM 1033 O THR A 187 -9.991 -9.461 1.458 1.00 0.83 O ATOM 1034 CB THR A 187 -7.475 -7.745 1.733 1.00 0.57 C ATOM 1035 OG1 THR A 187 -7.053 -9.008 2.262 1.00 1.63 O ATOM 1036 CG2 THR A 187 -8.191 -6.972 2.837 1.00 0.88 C ATOM 0 H THR A 187 -8.966 -6.020 -0.067 1.00 0.38 H new ATOM 0 HA THR A 187 -7.943 -8.777 -0.100 1.00 0.45 H new ATOM 0 HB THR A 187 -6.618 -7.158 1.403 1.00 0.57 H new ATOM 0 HG1 THR A 187 -7.802 -9.640 2.237 1.00 1.63 H new ATOM 0 HG21 THR A 187 -7.519 -6.844 3.686 1.00 0.88 H new ATOM 0 HG22 THR A 187 -8.491 -5.994 2.461 1.00 0.88 H new ATOM 0 HG23 THR A 187 -9.075 -7.525 3.154 1.00 0.88 H new ATOM 1044 N VAL A 188 -10.765 -7.529 0.639 1.00 0.41 N ATOM 1045 CA VAL A 188 -12.107 -7.751 1.155 1.00 0.46 C ATOM 1046 C VAL A 188 -13.001 -8.377 0.098 1.00 0.45 C ATOM 1047 O VAL A 188 -14.075 -8.905 0.385 1.00 0.57 O ATOM 1048 CB VAL A 188 -12.733 -6.446 1.686 1.00 0.51 C ATOM 1049 CG1 VAL A 188 -11.720 -5.713 2.548 1.00 0.53 C ATOM 1050 CG2 VAL A 188 -13.222 -5.558 0.549 1.00 0.49 C ATOM 0 H VAL A 188 -10.660 -6.694 0.062 1.00 0.41 H new ATOM 0 HA VAL A 188 -12.022 -8.446 1.991 1.00 0.46 H new ATOM 0 HB VAL A 188 -13.603 -6.700 2.291 1.00 0.51 H new ATOM 0 HG11 VAL A 188 -12.162 -4.790 2.924 1.00 0.53 H new ATOM 0 HG12 VAL A 188 -11.431 -6.345 3.388 1.00 0.53 H new ATOM 0 HG13 VAL A 188 -10.838 -5.477 1.952 1.00 0.53 H new ATOM 0 HG21 VAL A 188 -13.657 -4.647 0.960 1.00 0.49 H new ATOM 0 HG22 VAL A 188 -12.383 -5.300 -0.097 1.00 0.49 H new ATOM 0 HG23 VAL A 188 -13.976 -6.091 -0.030 1.00 0.49 H new ATOM 1060 N THR A 189 -12.530 -8.320 -1.126 1.00 0.38 N ATOM 1061 CA THR A 189 -13.199 -8.933 -2.254 1.00 0.41 C ATOM 1062 C THR A 189 -12.140 -9.438 -3.205 1.00 0.34 C ATOM 1063 O THR A 189 -12.169 -10.580 -3.662 1.00 0.35 O ATOM 1064 CB THR A 189 -14.113 -7.934 -2.986 1.00 0.50 C ATOM 1065 OG1 THR A 189 -15.166 -7.502 -2.110 1.00 0.64 O ATOM 1066 CG2 THR A 189 -14.692 -8.565 -4.246 1.00 0.51 C ATOM 0 H THR A 189 -11.663 -7.842 -1.371 1.00 0.38 H new ATOM 0 HA THR A 189 -13.828 -9.748 -1.894 1.00 0.41 H new ATOM 0 HB THR A 189 -13.522 -7.067 -3.280 1.00 0.50 H new ATOM 0 HG1 THR A 189 -15.743 -6.865 -2.581 1.00 0.64 H new ATOM 0 HG21 THR A 189 -15.336 -7.845 -4.751 1.00 0.51 H new ATOM 0 HG22 THR A 189 -13.881 -8.856 -4.913 1.00 0.51 H new ATOM 0 HG23 THR A 189 -15.275 -9.446 -3.977 1.00 0.51 H new ATOM 1074 N THR A 190 -11.181 -8.565 -3.452 1.00 0.32 N ATOM 1075 CA THR A 190 -10.014 -8.886 -4.233 1.00 0.34 C ATOM 1076 C THR A 190 -9.223 -10.044 -3.619 1.00 0.34 C ATOM 1077 O THR A 190 -8.498 -10.753 -4.316 1.00 0.42 O ATOM 1078 CB THR A 190 -9.143 -7.637 -4.347 1.00 0.39 C ATOM 1079 OG1 THR A 190 -9.840 -6.636 -5.094 1.00 0.54 O ATOM 1080 CG2 THR A 190 -7.815 -7.930 -5.011 1.00 0.55 C ATOM 0 H THR A 190 -11.196 -7.604 -3.110 1.00 0.32 H new ATOM 0 HA THR A 190 -10.330 -9.211 -5.224 1.00 0.34 H new ATOM 0 HB THR A 190 -8.938 -7.282 -3.337 1.00 0.39 H new ATOM 0 HG1 THR A 190 -10.128 -5.919 -4.491 1.00 0.54 H new ATOM 0 HG21 THR A 190 -7.228 -7.013 -5.071 1.00 0.55 H new ATOM 0 HG22 THR A 190 -7.271 -8.671 -4.426 1.00 0.55 H new ATOM 0 HG23 THR A 190 -7.988 -8.317 -6.015 1.00 0.55 H new ATOM 1088 N THR A 191 -9.367 -10.252 -2.315 1.00 0.34 N ATOM 1089 CA THR A 191 -8.738 -11.399 -1.698 1.00 0.47 C ATOM 1090 C THR A 191 -9.755 -12.501 -1.394 1.00 0.35 C ATOM 1091 O THR A 191 -9.450 -13.685 -1.504 1.00 0.34 O ATOM 1092 CB THR A 191 -7.952 -11.043 -0.431 1.00 0.83 C ATOM 1093 OG1 THR A 191 -6.876 -10.162 -0.765 1.00 1.66 O ATOM 1094 CG2 THR A 191 -7.376 -12.285 0.223 1.00 1.23 C ATOM 0 H THR A 191 -9.901 -9.655 -1.684 1.00 0.34 H new ATOM 0 HA THR A 191 -8.021 -11.772 -2.429 1.00 0.47 H new ATOM 0 HB THR A 191 -8.638 -10.561 0.266 1.00 0.83 H new ATOM 0 HG1 THR A 191 -6.224 -10.149 -0.033 1.00 1.66 H new ATOM 0 HG21 THR A 191 -6.824 -12.002 1.119 1.00 1.23 H new ATOM 0 HG22 THR A 191 -8.186 -12.962 0.495 1.00 1.23 H new ATOM 0 HG23 THR A 191 -6.704 -12.785 -0.474 1.00 1.23 H new ATOM 1102 N THR A 192 -10.982 -12.126 -1.057 1.00 0.46 N ATOM 1103 CA THR A 192 -11.997 -13.125 -0.737 1.00 0.60 C ATOM 1104 C THR A 192 -12.501 -13.825 -1.996 1.00 0.59 C ATOM 1105 O THR A 192 -13.458 -14.603 -1.952 1.00 0.73 O ATOM 1106 CB THR A 192 -13.190 -12.520 0.022 1.00 0.76 C ATOM 1107 OG1 THR A 192 -13.742 -11.425 -0.717 1.00 0.69 O ATOM 1108 CG2 THR A 192 -12.769 -12.046 1.404 1.00 0.90 C ATOM 0 H THR A 192 -11.296 -11.157 -0.998 1.00 0.46 H new ATOM 0 HA THR A 192 -11.513 -13.855 -0.088 1.00 0.60 H new ATOM 0 HB THR A 192 -13.947 -13.296 0.136 1.00 0.76 H new ATOM 0 HG1 THR A 192 -13.908 -10.672 -0.112 1.00 0.69 H new ATOM 0 HG21 THR A 192 -13.630 -11.622 1.921 1.00 0.90 H new ATOM 0 HG22 THR A 192 -12.381 -12.889 1.975 1.00 0.90 H new ATOM 0 HG23 THR A 192 -11.993 -11.286 1.307 1.00 0.90 H new ATOM 1116 N LYS A 193 -11.834 -13.568 -3.116 1.00 0.51 N ATOM 1117 CA LYS A 193 -12.180 -14.200 -4.376 1.00 0.58 C ATOM 1118 C LYS A 193 -11.653 -15.625 -4.445 1.00 0.69 C ATOM 1119 O LYS A 193 -11.772 -16.303 -5.466 1.00 0.82 O ATOM 1120 CB LYS A 193 -11.678 -13.362 -5.562 1.00 0.53 C ATOM 1121 CG LYS A 193 -10.212 -12.945 -5.483 1.00 0.45 C ATOM 1122 CD LYS A 193 -9.258 -14.107 -5.694 1.00 0.53 C ATOM 1123 CE LYS A 193 -7.815 -13.645 -5.630 1.00 0.57 C ATOM 1124 NZ LYS A 193 -6.860 -14.766 -5.854 1.00 1.12 N ATOM 0 H LYS A 193 -11.047 -12.922 -3.173 1.00 0.51 H new ATOM 0 HA LYS A 193 -13.267 -14.252 -4.437 1.00 0.58 H new ATOM 0 HB2 LYS A 193 -11.829 -13.931 -6.479 1.00 0.53 H new ATOM 0 HB3 LYS A 193 -12.292 -12.464 -5.639 1.00 0.53 H new ATOM 0 HG2 LYS A 193 -10.016 -12.179 -6.233 1.00 0.45 H new ATOM 0 HG3 LYS A 193 -10.019 -12.494 -4.509 1.00 0.45 H new ATOM 0 HD2 LYS A 193 -9.434 -14.869 -4.934 1.00 0.53 H new ATOM 0 HD3 LYS A 193 -9.452 -14.571 -6.661 1.00 0.53 H new ATOM 0 HE2 LYS A 193 -7.648 -12.871 -6.380 1.00 0.57 H new ATOM 0 HE3 LYS A 193 -7.622 -13.193 -4.657 1.00 0.57 H new ATOM 0 HZ1 LYS A 193 -5.960 -14.557 -5.376 1.00 1.12 H new ATOM 0 HZ2 LYS A 193 -7.260 -15.645 -5.469 1.00 1.12 H new ATOM 0 HZ3 LYS A 193 -6.692 -14.880 -6.874 1.00 1.12 H new ATOM 1138 N GLY A 194 -11.067 -16.065 -3.350 1.00 0.70 N ATOM 1139 CA GLY A 194 -10.512 -17.395 -3.289 1.00 0.81 C ATOM 1140 C GLY A 194 -9.017 -17.326 -3.138 1.00 0.75 C ATOM 1141 O GLY A 194 -8.271 -18.081 -3.757 1.00 0.86 O ATOM 0 H GLY A 194 -10.965 -15.520 -2.494 1.00 0.70 H new ATOM 0 HA2 GLY A 194 -10.945 -17.940 -2.450 1.00 0.81 H new ATOM 0 HA3 GLY A 194 -10.769 -17.946 -4.194 1.00 0.81 H new ATOM 1145 N GLU A 195 -8.595 -16.372 -2.335 1.00 0.63 N ATOM 1146 CA GLU A 195 -7.198 -16.134 -2.068 1.00 0.60 C ATOM 1147 C GLU A 195 -6.939 -16.350 -0.582 1.00 0.59 C ATOM 1148 O GLU A 195 -7.877 -16.316 0.220 1.00 0.63 O ATOM 1149 CB GLU A 195 -6.859 -14.701 -2.498 1.00 0.64 C ATOM 1150 CG GLU A 195 -5.387 -14.341 -2.408 1.00 0.72 C ATOM 1151 CD GLU A 195 -4.543 -15.198 -3.321 1.00 0.84 C ATOM 1152 OE1 GLU A 195 -4.440 -14.868 -4.516 1.00 1.40 O ATOM 1153 OE2 GLU A 195 -3.964 -16.195 -2.838 1.00 1.29 O ATOM 0 H GLU A 195 -9.222 -15.734 -1.845 1.00 0.63 H new ATOM 0 HA GLU A 195 -6.564 -16.822 -2.627 1.00 0.60 H new ATOM 0 HB2 GLU A 195 -7.192 -14.557 -3.526 1.00 0.64 H new ATOM 0 HB3 GLU A 195 -7.427 -14.007 -1.879 1.00 0.64 H new ATOM 0 HG2 GLU A 195 -5.253 -13.291 -2.669 1.00 0.72 H new ATOM 0 HG3 GLU A 195 -5.046 -14.460 -1.380 1.00 0.72 H new ATOM 1160 N ASN A 196 -5.689 -16.551 -0.208 1.00 0.64 N ATOM 1161 CA ASN A 196 -5.360 -16.811 1.186 1.00 0.69 C ATOM 1162 C ASN A 196 -4.833 -15.561 1.838 1.00 0.63 C ATOM 1163 O ASN A 196 -3.758 -15.073 1.492 1.00 0.80 O ATOM 1164 CB ASN A 196 -4.298 -17.907 1.334 1.00 0.91 C ATOM 1165 CG ASN A 196 -4.816 -19.306 1.070 1.00 1.07 C ATOM 1166 OD1 ASN A 196 -5.741 -19.511 0.288 1.00 1.13 O ATOM 1167 ND2 ASN A 196 -4.222 -20.283 1.735 1.00 1.99 N ATOM 0 H ASN A 196 -4.890 -16.540 -0.841 1.00 0.64 H new ATOM 0 HA ASN A 196 -6.280 -17.142 1.668 1.00 0.69 H new ATOM 0 HB2 ASN A 196 -3.477 -17.699 0.647 1.00 0.91 H new ATOM 0 HB3 ASN A 196 -3.887 -17.867 2.343 1.00 0.91 H new ATOM 0 HD21 ASN A 196 -4.529 -21.247 1.607 1.00 1.99 H new ATOM 0 HD22 ASN A 196 -3.457 -20.072 2.376 1.00 1.99 H new ATOM 1174 N PHE A 197 -5.603 -15.025 2.762 1.00 0.54 N ATOM 1175 CA PHE A 197 -5.118 -13.931 3.559 1.00 0.53 C ATOM 1176 C PHE A 197 -5.236 -14.251 5.030 1.00 0.56 C ATOM 1177 O PHE A 197 -6.319 -14.520 5.563 1.00 0.68 O ATOM 1178 CB PHE A 197 -5.803 -12.607 3.226 1.00 0.52 C ATOM 1179 CG PHE A 197 -7.198 -12.442 3.735 1.00 1.12 C ATOM 1180 CD1 PHE A 197 -8.185 -13.290 3.284 1.00 1.63 C ATOM 1181 CD2 PHE A 197 -7.519 -11.461 4.654 1.00 1.49 C ATOM 1182 CE1 PHE A 197 -9.483 -13.168 3.738 1.00 2.36 C ATOM 1183 CE2 PHE A 197 -8.814 -11.329 5.116 1.00 2.19 C ATOM 1184 CZ PHE A 197 -9.770 -12.088 4.703 1.00 2.61 C ATOM 0 H PHE A 197 -6.554 -15.328 2.974 1.00 0.54 H new ATOM 0 HA PHE A 197 -4.064 -13.802 3.313 1.00 0.53 H new ATOM 0 HB2 PHE A 197 -5.194 -11.796 3.625 1.00 0.52 H new ATOM 0 HB3 PHE A 197 -5.817 -12.491 2.142 1.00 0.52 H new ATOM 0 HD1 PHE A 197 -7.941 -14.060 2.567 1.00 1.63 H new ATOM 0 HD2 PHE A 197 -6.751 -10.792 5.014 1.00 1.49 H new ATOM 0 HE1 PHE A 197 -10.260 -13.838 3.400 1.00 2.36 H new ATOM 0 HE2 PHE A 197 -9.032 -10.565 5.847 1.00 2.19 H new ATOM 0 HZ PHE A 197 -10.777 -11.935 5.061 1.00 2.61 H new ATOM 1194 N THR A 198 -4.098 -14.279 5.661 1.00 0.55 N ATOM 1195 CA THR A 198 -4.025 -14.425 7.074 1.00 0.60 C ATOM 1196 C THR A 198 -3.687 -13.079 7.690 1.00 0.52 C ATOM 1197 O THR A 198 -3.415 -12.132 6.974 1.00 0.43 O ATOM 1198 CB THR A 198 -3.018 -15.525 7.485 1.00 0.74 C ATOM 1199 OG1 THR A 198 -3.201 -15.877 8.865 1.00 1.12 O ATOM 1200 CG2 THR A 198 -1.579 -15.087 7.255 1.00 0.78 C ATOM 0 H THR A 198 -3.191 -14.200 5.200 1.00 0.55 H new ATOM 0 HA THR A 198 -4.993 -14.752 7.453 1.00 0.60 H new ATOM 0 HB THR A 198 -3.211 -16.395 6.857 1.00 0.74 H new ATOM 0 HG1 THR A 198 -2.559 -16.575 9.112 1.00 1.12 H new ATOM 0 HG21 THR A 198 -0.903 -15.887 7.556 1.00 0.78 H new ATOM 0 HG22 THR A 198 -1.431 -14.865 6.198 1.00 0.78 H new ATOM 0 HG23 THR A 198 -1.371 -14.195 7.846 1.00 0.78 H new ATOM 1208 N GLU A 199 -3.810 -12.977 8.997 1.00 0.59 N ATOM 1209 CA GLU A 199 -3.436 -11.766 9.728 1.00 0.63 C ATOM 1210 C GLU A 199 -2.044 -11.279 9.323 1.00 0.55 C ATOM 1211 O GLU A 199 -1.769 -10.074 9.264 1.00 0.53 O ATOM 1212 CB GLU A 199 -3.498 -12.030 11.230 1.00 0.82 C ATOM 1213 CG GLU A 199 -3.093 -10.843 12.085 1.00 1.14 C ATOM 1214 CD GLU A 199 -3.227 -11.140 13.557 1.00 2.11 C ATOM 1215 OE1 GLU A 199 -2.374 -11.879 14.094 1.00 2.55 O ATOM 1216 OE2 GLU A 199 -4.193 -10.654 14.179 1.00 2.91 O ATOM 0 H GLU A 199 -4.171 -13.725 9.589 1.00 0.59 H new ATOM 0 HA GLU A 199 -4.145 -10.978 9.474 1.00 0.63 H new ATOM 0 HB2 GLU A 199 -4.513 -12.325 11.495 1.00 0.82 H new ATOM 0 HB3 GLU A 199 -2.849 -12.873 11.467 1.00 0.82 H new ATOM 0 HG2 GLU A 199 -2.062 -10.570 11.862 1.00 1.14 H new ATOM 0 HG3 GLU A 199 -3.713 -9.983 11.830 1.00 1.14 H new ATOM 1223 N THR A 200 -1.173 -12.212 9.021 1.00 0.56 N ATOM 1224 CA THR A 200 0.140 -11.870 8.542 1.00 0.57 C ATOM 1225 C THR A 200 0.088 -11.426 7.075 1.00 0.44 C ATOM 1226 O THR A 200 0.966 -10.699 6.605 1.00 0.44 O ATOM 1227 CB THR A 200 1.092 -13.050 8.706 1.00 0.73 C ATOM 1228 OG1 THR A 200 0.646 -13.889 9.781 1.00 0.92 O ATOM 1229 CG2 THR A 200 2.486 -12.542 9.004 1.00 0.99 C ATOM 0 H THR A 200 -1.352 -13.213 9.099 1.00 0.56 H new ATOM 0 HA THR A 200 0.512 -11.037 9.138 1.00 0.57 H new ATOM 0 HB THR A 200 1.107 -13.628 7.782 1.00 0.73 H new ATOM 0 HG1 THR A 200 1.260 -14.646 9.881 1.00 0.92 H new ATOM 0 HG21 THR A 200 3.164 -13.387 9.121 1.00 0.99 H new ATOM 0 HG22 THR A 200 2.828 -11.914 8.182 1.00 0.99 H new ATOM 0 HG23 THR A 200 2.472 -11.959 9.925 1.00 0.99 H new ATOM 1237 N ASP A 201 -0.961 -11.838 6.363 1.00 0.41 N ATOM 1238 CA ASP A 201 -1.181 -11.372 5.001 1.00 0.36 C ATOM 1239 C ASP A 201 -1.669 -9.944 5.016 1.00 0.31 C ATOM 1240 O ASP A 201 -1.478 -9.168 4.075 1.00 0.34 O ATOM 1241 CB ASP A 201 -2.133 -12.255 4.203 1.00 0.45 C ATOM 1242 CG ASP A 201 -1.492 -13.576 3.817 1.00 0.92 C ATOM 1243 OD1 ASP A 201 -0.489 -13.557 3.085 1.00 1.49 O ATOM 1244 OD2 ASP A 201 -1.992 -14.631 4.245 1.00 1.27 O ATOM 0 H ASP A 201 -1.666 -12.490 6.707 1.00 0.41 H new ATOM 0 HA ASP A 201 -0.219 -11.429 4.492 1.00 0.36 H new ATOM 0 HB2 ASP A 201 -3.031 -12.445 4.791 1.00 0.45 H new ATOM 0 HB3 ASP A 201 -2.448 -11.728 3.303 1.00 0.45 H new ATOM 1249 N ILE A 202 -2.267 -9.603 6.124 1.00 0.30 N ATOM 1250 CA ILE A 202 -2.741 -8.269 6.364 1.00 0.32 C ATOM 1251 C ILE A 202 -1.577 -7.307 6.435 1.00 0.31 C ATOM 1252 O ILE A 202 -1.480 -6.370 5.654 1.00 0.34 O ATOM 1253 CB ILE A 202 -3.500 -8.243 7.682 1.00 0.41 C ATOM 1254 CG1 ILE A 202 -4.373 -9.478 7.734 1.00 0.48 C ATOM 1255 CG2 ILE A 202 -4.315 -6.977 7.821 1.00 0.54 C ATOM 1256 CD1 ILE A 202 -5.536 -9.454 6.776 1.00 0.53 C ATOM 0 H ILE A 202 -2.440 -10.250 6.893 1.00 0.30 H new ATOM 0 HA ILE A 202 -3.398 -7.968 5.548 1.00 0.32 H new ATOM 0 HB ILE A 202 -2.802 -8.248 8.519 1.00 0.41 H new ATOM 0 HG12 ILE A 202 -3.759 -10.353 7.520 1.00 0.48 H new ATOM 0 HG13 ILE A 202 -4.755 -9.597 8.748 1.00 0.48 H new ATOM 0 HG21 ILE A 202 -4.846 -6.989 8.773 1.00 0.54 H new ATOM 0 HG22 ILE A 202 -3.653 -6.112 7.785 1.00 0.54 H new ATOM 0 HG23 ILE A 202 -5.035 -6.916 7.005 1.00 0.54 H new ATOM 0 HD11 ILE A 202 -6.110 -10.375 6.877 1.00 0.53 H new ATOM 0 HD12 ILE A 202 -6.176 -8.601 7.002 1.00 0.53 H new ATOM 0 HD13 ILE A 202 -5.165 -9.369 5.755 1.00 0.53 H new ATOM 1268 N LYS A 203 -0.658 -7.597 7.337 1.00 0.32 N ATOM 1269 CA LYS A 203 0.450 -6.703 7.610 1.00 0.35 C ATOM 1270 C LYS A 203 1.307 -6.514 6.393 1.00 0.30 C ATOM 1271 O LYS A 203 1.551 -5.398 6.024 1.00 0.31 O ATOM 1272 CB LYS A 203 1.278 -7.216 8.779 1.00 0.44 C ATOM 1273 CG LYS A 203 1.522 -8.702 8.721 1.00 0.49 C ATOM 1274 CD LYS A 203 2.970 -9.053 9.004 1.00 0.61 C ATOM 1275 CE LYS A 203 3.860 -8.747 7.808 1.00 0.77 C ATOM 1276 NZ LYS A 203 5.259 -9.204 8.036 1.00 1.14 N ATOM 0 H LYS A 203 -0.658 -8.450 7.896 1.00 0.32 H new ATOM 0 HA LYS A 203 0.038 -5.731 7.881 1.00 0.35 H new ATOM 0 HB2 LYS A 203 2.236 -6.696 8.794 1.00 0.44 H new ATOM 0 HB3 LYS A 203 0.769 -6.973 9.712 1.00 0.44 H new ATOM 0 HG2 LYS A 203 0.880 -9.203 9.445 1.00 0.49 H new ATOM 0 HG3 LYS A 203 1.244 -9.077 7.736 1.00 0.49 H new ATOM 0 HD2 LYS A 203 3.319 -8.493 9.872 1.00 0.61 H new ATOM 0 HD3 LYS A 203 3.047 -10.111 9.255 1.00 0.61 H new ATOM 0 HE2 LYS A 203 3.457 -9.234 6.920 1.00 0.77 H new ATOM 0 HE3 LYS A 203 3.854 -7.674 7.614 1.00 0.77 H new ATOM 0 HZ1 LYS A 203 5.838 -8.980 7.202 1.00 1.14 H new ATOM 0 HZ2 LYS A 203 5.651 -8.720 8.869 1.00 1.14 H new ATOM 0 HZ3 LYS A 203 5.267 -10.231 8.197 1.00 1.14 H new ATOM 1290 N ILE A 204 1.730 -7.584 5.742 1.00 0.29 N ATOM 1291 CA ILE A 204 2.557 -7.444 4.550 1.00 0.28 C ATOM 1292 C ILE A 204 1.910 -6.515 3.554 1.00 0.24 C ATOM 1293 O ILE A 204 2.564 -5.679 2.966 1.00 0.27 O ATOM 1294 CB ILE A 204 2.756 -8.771 3.857 1.00 0.28 C ATOM 1295 CG1 ILE A 204 1.417 -9.461 3.865 1.00 0.26 C ATOM 1296 CG2 ILE A 204 3.843 -9.556 4.546 1.00 0.38 C ATOM 1297 CD1 ILE A 204 1.226 -10.579 2.876 1.00 0.28 C ATOM 0 H ILE A 204 1.520 -8.545 6.011 1.00 0.29 H new ATOM 0 HA ILE A 204 3.515 -7.047 4.884 1.00 0.28 H new ATOM 0 HB ILE A 204 3.091 -8.659 2.826 1.00 0.28 H new ATOM 0 HG12 ILE A 204 1.245 -9.859 4.865 1.00 0.26 H new ATOM 0 HG13 ILE A 204 0.647 -8.711 3.684 1.00 0.26 H new ATOM 0 HG21 ILE A 204 3.979 -10.511 4.039 1.00 0.38 H new ATOM 0 HG22 ILE A 204 4.775 -8.992 4.514 1.00 0.38 H new ATOM 0 HG23 ILE A 204 3.562 -9.733 5.584 1.00 0.38 H new ATOM 0 HD11 ILE A 204 0.223 -10.992 2.983 1.00 0.28 H new ATOM 0 HD12 ILE A 204 1.354 -10.195 1.864 1.00 0.28 H new ATOM 0 HD13 ILE A 204 1.962 -11.361 3.064 1.00 0.28 H new ATOM 1309 N MET A 205 0.618 -6.663 3.374 1.00 0.21 N ATOM 1310 CA MET A 205 -0.071 -5.846 2.421 1.00 0.23 C ATOM 1311 C MET A 205 -0.206 -4.422 2.907 1.00 0.22 C ATOM 1312 O MET A 205 0.256 -3.488 2.246 1.00 0.22 O ATOM 1313 CB MET A 205 -1.434 -6.417 2.135 1.00 0.29 C ATOM 1314 CG MET A 205 -2.455 -5.366 1.747 1.00 0.29 C ATOM 1315 SD MET A 205 -4.133 -5.906 2.093 1.00 0.41 S ATOM 1316 CE MET A 205 -3.903 -6.507 3.761 1.00 0.35 C ATOM 0 H MET A 205 0.034 -7.335 3.872 1.00 0.21 H new ATOM 0 HA MET A 205 0.519 -5.838 1.505 1.00 0.23 H new ATOM 0 HB2 MET A 205 -1.352 -7.149 1.331 1.00 0.29 H new ATOM 0 HB3 MET A 205 -1.789 -6.951 3.017 1.00 0.29 H new ATOM 0 HG2 MET A 205 -2.251 -4.443 2.290 1.00 0.29 H new ATOM 0 HG3 MET A 205 -2.358 -5.139 0.685 1.00 0.29 H new ATOM 0 HE1 MET A 205 -4.839 -6.418 4.312 1.00 0.35 H new ATOM 0 HE2 MET A 205 -3.597 -7.553 3.732 1.00 0.35 H new ATOM 0 HE3 MET A 205 -3.132 -5.917 4.257 1.00 0.35 H new ATOM 1326 N GLU A 206 -0.848 -4.265 4.057 1.00 0.23 N ATOM 1327 CA GLU A 206 -1.094 -2.953 4.601 1.00 0.25 C ATOM 1328 C GLU A 206 0.217 -2.238 4.756 1.00 0.24 C ATOM 1329 O GLU A 206 0.333 -1.098 4.388 1.00 0.26 O ATOM 1330 CB GLU A 206 -1.787 -3.022 5.954 1.00 0.29 C ATOM 1331 CG GLU A 206 -3.000 -3.930 5.995 1.00 0.37 C ATOM 1332 CD GLU A 206 -3.778 -3.754 7.283 1.00 0.57 C ATOM 1333 OE1 GLU A 206 -3.261 -4.133 8.355 1.00 1.25 O ATOM 1334 OE2 GLU A 206 -4.922 -3.258 7.228 1.00 1.00 O ATOM 0 H GLU A 206 -1.204 -5.034 4.624 1.00 0.23 H new ATOM 0 HA GLU A 206 -1.751 -2.418 3.915 1.00 0.25 H new ATOM 0 HB2 GLU A 206 -1.068 -3.364 6.699 1.00 0.29 H new ATOM 0 HB3 GLU A 206 -2.092 -2.016 6.243 1.00 0.29 H new ATOM 0 HG2 GLU A 206 -3.647 -3.714 5.145 1.00 0.37 H new ATOM 0 HG3 GLU A 206 -2.683 -4.968 5.899 1.00 0.37 H new ATOM 1341 N ARG A 207 1.207 -2.954 5.259 1.00 0.24 N ATOM 1342 CA ARG A 207 2.527 -2.400 5.494 1.00 0.25 C ATOM 1343 C ARG A 207 3.094 -1.799 4.214 1.00 0.26 C ATOM 1344 O ARG A 207 3.479 -0.639 4.199 1.00 0.35 O ATOM 1345 CB ARG A 207 3.459 -3.487 6.045 1.00 0.25 C ATOM 1346 CG ARG A 207 4.226 -4.249 4.974 1.00 0.25 C ATOM 1347 CD ARG A 207 5.013 -5.396 5.540 1.00 0.32 C ATOM 1348 NE ARG A 207 6.154 -4.975 6.362 1.00 0.47 N ATOM 1349 CZ ARG A 207 6.172 -4.966 7.699 1.00 0.69 C ATOM 1350 NH1 ARG A 207 5.063 -5.187 8.395 1.00 0.87 N ATOM 1351 NH2 ARG A 207 7.304 -4.702 8.342 1.00 0.89 N ATOM 0 H ARG A 207 1.117 -3.937 5.516 1.00 0.24 H new ATOM 0 HA ARG A 207 2.447 -1.602 6.232 1.00 0.25 H new ATOM 0 HB2 ARG A 207 4.172 -3.027 6.729 1.00 0.25 H new ATOM 0 HB3 ARG A 207 2.869 -4.195 6.628 1.00 0.25 H new ATOM 0 HG2 ARG A 207 3.526 -4.625 4.228 1.00 0.25 H new ATOM 0 HG3 ARG A 207 4.903 -3.566 4.460 1.00 0.25 H new ATOM 0 HD2 ARG A 207 4.351 -6.018 6.143 1.00 0.32 H new ATOM 0 HD3 ARG A 207 5.375 -6.017 4.721 1.00 0.32 H new ATOM 0 HE ARG A 207 6.996 -4.666 5.877 1.00 0.47 H new ATOM 0 HH11 ARG A 207 4.184 -5.366 7.910 1.00 0.87 H new ATOM 0 HH12 ARG A 207 5.090 -5.177 9.415 1.00 0.87 H new ATOM 0 HH21 ARG A 207 8.156 -4.507 7.816 1.00 0.89 H new ATOM 0 HH22 ARG A 207 7.321 -4.694 9.362 1.00 0.89 H new ATOM 1365 N VAL A 208 3.105 -2.575 3.133 1.00 0.23 N ATOM 1366 CA VAL A 208 3.705 -2.136 1.904 1.00 0.23 C ATOM 1367 C VAL A 208 2.924 -0.988 1.326 1.00 0.25 C ATOM 1368 O VAL A 208 3.473 0.049 0.968 1.00 0.34 O ATOM 1369 CB VAL A 208 3.786 -3.272 0.858 1.00 0.22 C ATOM 1370 CG1 VAL A 208 4.472 -2.758 -0.369 1.00 0.28 C ATOM 1371 CG2 VAL A 208 4.526 -4.475 1.405 1.00 0.22 C ATOM 0 H VAL A 208 2.701 -3.511 3.097 1.00 0.23 H new ATOM 0 HA VAL A 208 4.721 -1.818 2.139 1.00 0.23 H new ATOM 0 HB VAL A 208 2.774 -3.593 0.612 1.00 0.22 H new ATOM 0 HG11 VAL A 208 4.533 -3.553 -1.112 1.00 0.28 H new ATOM 0 HG12 VAL A 208 3.906 -1.921 -0.779 1.00 0.28 H new ATOM 0 HG13 VAL A 208 5.477 -2.424 -0.111 1.00 0.28 H new ATOM 0 HG21 VAL A 208 4.565 -5.255 0.645 1.00 0.22 H new ATOM 0 HG22 VAL A 208 5.540 -4.185 1.679 1.00 0.22 H new ATOM 0 HG23 VAL A 208 4.006 -4.852 2.286 1.00 0.22 H new ATOM 1381 N VAL A 209 1.639 -1.186 1.269 1.00 0.22 N ATOM 1382 CA VAL A 209 0.743 -0.213 0.721 1.00 0.25 C ATOM 1383 C VAL A 209 0.732 1.057 1.593 1.00 0.27 C ATOM 1384 O VAL A 209 0.611 2.177 1.089 1.00 0.32 O ATOM 1385 CB VAL A 209 -0.645 -0.871 0.566 1.00 0.31 C ATOM 1386 CG1 VAL A 209 -1.707 -0.196 1.397 1.00 1.11 C ATOM 1387 CG2 VAL A 209 -1.041 -0.931 -0.895 1.00 1.19 C ATOM 0 H VAL A 209 1.181 -2.034 1.604 1.00 0.22 H new ATOM 0 HA VAL A 209 1.069 0.114 -0.266 1.00 0.25 H new ATOM 0 HB VAL A 209 -0.564 -1.889 0.948 1.00 0.31 H new ATOM 0 HG11 VAL A 209 -2.661 -0.701 1.248 1.00 1.11 H new ATOM 0 HG12 VAL A 209 -1.431 -0.245 2.450 1.00 1.11 H new ATOM 0 HG13 VAL A 209 -1.797 0.847 1.094 1.00 1.11 H new ATOM 0 HG21 VAL A 209 -2.022 -1.398 -0.987 1.00 1.19 H new ATOM 0 HG22 VAL A 209 -1.080 0.079 -1.303 1.00 1.19 H new ATOM 0 HG23 VAL A 209 -0.307 -1.518 -1.447 1.00 1.19 H new ATOM 1397 N GLU A 210 0.921 0.870 2.895 1.00 0.26 N ATOM 1398 CA GLU A 210 0.982 1.973 3.846 1.00 0.29 C ATOM 1399 C GLU A 210 2.300 2.725 3.763 1.00 0.29 C ATOM 1400 O GLU A 210 2.307 3.927 3.560 1.00 0.33 O ATOM 1401 CB GLU A 210 0.712 1.466 5.276 1.00 0.31 C ATOM 1402 CG GLU A 210 1.915 1.380 6.206 1.00 0.32 C ATOM 1403 CD GLU A 210 1.516 1.005 7.615 1.00 0.70 C ATOM 1404 OE1 GLU A 210 0.961 1.857 8.333 1.00 1.12 O ATOM 1405 OE2 GLU A 210 1.774 -0.150 8.017 1.00 1.19 O ATOM 0 H GLU A 210 1.036 -0.050 3.320 1.00 0.26 H new ATOM 0 HA GLU A 210 0.200 2.684 3.580 1.00 0.29 H new ATOM 0 HB2 GLU A 210 -0.028 2.121 5.736 1.00 0.31 H new ATOM 0 HB3 GLU A 210 0.263 0.475 5.207 1.00 0.31 H new ATOM 0 HG2 GLU A 210 2.619 0.643 5.820 1.00 0.32 H new ATOM 0 HG3 GLU A 210 2.433 2.339 6.219 1.00 0.32 H new ATOM 1412 N GLN A 211 3.428 2.035 3.846 1.00 0.27 N ATOM 1413 CA GLN A 211 4.687 2.739 3.953 1.00 0.31 C ATOM 1414 C GLN A 211 5.013 3.348 2.607 1.00 0.31 C ATOM 1415 O GLN A 211 5.894 4.194 2.474 1.00 0.34 O ATOM 1416 CB GLN A 211 5.829 1.825 4.431 1.00 0.34 C ATOM 1417 CG GLN A 211 6.003 0.547 3.621 1.00 0.39 C ATOM 1418 CD GLN A 211 7.434 0.064 3.598 1.00 0.97 C ATOM 1419 OE1 GLN A 211 8.208 0.424 2.715 1.00 1.55 O ATOM 1420 NE2 GLN A 211 7.802 -0.755 4.569 1.00 1.56 N ATOM 0 H GLN A 211 3.494 1.017 3.841 1.00 0.27 H new ATOM 0 HA GLN A 211 4.587 3.521 4.706 1.00 0.31 H new ATOM 0 HB2 GLN A 211 6.762 2.387 4.402 1.00 0.34 H new ATOM 0 HB3 GLN A 211 5.650 1.557 5.472 1.00 0.34 H new ATOM 0 HG2 GLN A 211 5.367 -0.233 4.039 1.00 0.39 H new ATOM 0 HG3 GLN A 211 5.665 0.720 2.599 1.00 0.39 H new ATOM 0 HE21 GLN A 211 7.130 -1.032 5.285 1.00 1.56 H new ATOM 0 HE22 GLN A 211 8.758 -1.110 4.602 1.00 1.56 H new ATOM 1429 N MET A 212 4.256 2.923 1.613 1.00 0.30 N ATOM 1430 CA MET A 212 4.418 3.418 0.278 1.00 0.31 C ATOM 1431 C MET A 212 3.486 4.588 0.003 1.00 0.30 C ATOM 1432 O MET A 212 3.834 5.459 -0.777 1.00 0.33 O ATOM 1433 CB MET A 212 4.206 2.298 -0.708 1.00 0.34 C ATOM 1434 CG MET A 212 5.143 2.363 -1.890 1.00 1.17 C ATOM 1435 SD MET A 212 4.626 3.576 -3.111 1.00 1.65 S ATOM 1436 CE MET A 212 2.927 3.051 -3.315 1.00 0.37 C ATOM 0 H MET A 212 3.517 2.228 1.717 1.00 0.30 H new ATOM 0 HA MET A 212 5.435 3.793 0.165 1.00 0.31 H new ATOM 0 HB2 MET A 212 4.339 1.344 -0.199 1.00 0.34 H new ATOM 0 HB3 MET A 212 3.177 2.327 -1.066 1.00 0.34 H new ATOM 0 HG2 MET A 212 6.146 2.608 -1.541 1.00 1.17 H new ATOM 0 HG3 MET A 212 5.200 1.381 -2.359 1.00 1.17 H new ATOM 0 HE1 MET A 212 2.756 2.767 -4.353 1.00 0.37 H new ATOM 0 HE2 MET A 212 2.730 2.196 -2.668 1.00 0.37 H new ATOM 0 HE3 MET A 212 2.259 3.870 -3.048 1.00 0.37 H new ATOM 1446 N CYS A 213 2.311 4.643 0.640 1.00 0.28 N ATOM 1447 CA CYS A 213 1.529 5.875 0.558 1.00 0.27 C ATOM 1448 C CYS A 213 2.296 6.950 1.315 1.00 0.25 C ATOM 1449 O CYS A 213 2.203 8.131 1.017 1.00 0.25 O ATOM 1450 CB CYS A 213 0.091 5.765 1.111 1.00 0.36 C ATOM 1451 SG CYS A 213 -0.916 7.255 0.732 1.00 0.42 S ATOM 0 H CYS A 213 1.899 3.890 1.190 1.00 0.28 H new ATOM 0 HA CYS A 213 1.404 6.116 -0.498 1.00 0.27 H new ATOM 0 HB2 CYS A 213 -0.393 4.885 0.688 1.00 0.36 H new ATOM 0 HB3 CYS A 213 0.129 5.620 2.191 1.00 0.36 H new ATOM 1456 N ILE A 214 3.074 6.503 2.297 1.00 0.25 N ATOM 1457 CA ILE A 214 3.978 7.366 3.040 1.00 0.27 C ATOM 1458 C ILE A 214 5.156 7.778 2.157 1.00 0.27 C ATOM 1459 O ILE A 214 5.606 8.925 2.190 1.00 0.29 O ATOM 1460 CB ILE A 214 4.480 6.647 4.313 1.00 0.30 C ATOM 1461 CG1 ILE A 214 3.725 7.127 5.552 1.00 0.33 C ATOM 1462 CG2 ILE A 214 5.963 6.845 4.504 1.00 0.31 C ATOM 1463 CD1 ILE A 214 4.106 6.398 6.826 1.00 0.36 C ATOM 0 H ILE A 214 3.093 5.529 2.598 1.00 0.25 H new ATOM 0 HA ILE A 214 3.439 8.264 3.342 1.00 0.27 H new ATOM 0 HB ILE A 214 4.288 5.582 4.180 1.00 0.30 H new ATOM 0 HG12 ILE A 214 3.908 8.193 5.687 1.00 0.33 H new ATOM 0 HG13 ILE A 214 2.655 7.007 5.382 1.00 0.33 H new ATOM 0 HG21 ILE A 214 6.286 6.328 5.407 1.00 0.31 H new ATOM 0 HG22 ILE A 214 6.498 6.442 3.644 1.00 0.31 H new ATOM 0 HG23 ILE A 214 6.179 7.909 4.599 1.00 0.31 H new ATOM 0 HD11 ILE A 214 3.527 6.796 7.660 1.00 0.36 H new ATOM 0 HD12 ILE A 214 3.896 5.334 6.713 1.00 0.36 H new ATOM 0 HD13 ILE A 214 5.169 6.539 7.022 1.00 0.36 H new ATOM 1475 N THR A 215 5.651 6.831 1.368 1.00 0.28 N ATOM 1476 CA THR A 215 6.661 7.129 0.375 1.00 0.30 C ATOM 1477 C THR A 215 6.085 8.112 -0.633 1.00 0.30 C ATOM 1478 O THR A 215 6.749 9.058 -1.055 1.00 0.34 O ATOM 1479 CB THR A 215 7.135 5.855 -0.356 1.00 0.34 C ATOM 1480 OG1 THR A 215 7.654 4.906 0.589 1.00 0.37 O ATOM 1481 CG2 THR A 215 8.206 6.190 -1.381 1.00 0.39 C ATOM 0 H THR A 215 5.366 5.852 1.401 1.00 0.28 H new ATOM 0 HA THR A 215 7.525 7.561 0.880 1.00 0.30 H new ATOM 0 HB THR A 215 6.279 5.420 -0.872 1.00 0.34 H new ATOM 0 HG1 THR A 215 6.963 4.690 1.249 1.00 0.37 H new ATOM 0 HG21 THR A 215 8.526 5.278 -1.884 1.00 0.39 H new ATOM 0 HG22 THR A 215 7.802 6.887 -2.115 1.00 0.39 H new ATOM 0 HG23 THR A 215 9.060 6.646 -0.880 1.00 0.39 H new ATOM 1489 N GLN A 216 4.834 7.887 -1.009 1.00 0.30 N ATOM 1490 CA GLN A 216 4.136 8.827 -1.858 1.00 0.32 C ATOM 1491 C GLN A 216 3.846 10.134 -1.134 1.00 0.30 C ATOM 1492 O GLN A 216 3.680 11.144 -1.770 1.00 0.45 O ATOM 1493 CB GLN A 216 2.842 8.227 -2.409 1.00 0.44 C ATOM 1494 CG GLN A 216 3.065 7.015 -3.290 1.00 1.08 C ATOM 1495 CD GLN A 216 4.014 7.289 -4.440 1.00 1.76 C ATOM 1496 OE1 GLN A 216 4.072 8.398 -4.974 1.00 2.17 O ATOM 1497 NE2 GLN A 216 4.780 6.279 -4.820 1.00 2.60 N ATOM 0 H GLN A 216 4.290 7.067 -0.740 1.00 0.30 H new ATOM 0 HA GLN A 216 4.797 9.046 -2.696 1.00 0.32 H new ATOM 0 HB2 GLN A 216 2.197 7.947 -1.576 1.00 0.44 H new ATOM 0 HB3 GLN A 216 2.312 8.989 -2.980 1.00 0.44 H new ATOM 0 HG2 GLN A 216 3.461 6.200 -2.685 1.00 1.08 H new ATOM 0 HG3 GLN A 216 2.107 6.680 -3.688 1.00 1.08 H new ATOM 0 HE21 GLN A 216 4.702 5.376 -4.353 1.00 2.60 H new ATOM 0 HE22 GLN A 216 5.448 6.404 -5.580 1.00 2.60 H new ATOM 1506 N TYR A 217 3.807 10.111 0.189 1.00 0.27 N ATOM 1507 CA TYR A 217 3.565 11.321 0.979 1.00 0.29 C ATOM 1508 C TYR A 217 4.739 12.281 0.850 1.00 0.30 C ATOM 1509 O TYR A 217 4.553 13.464 0.575 1.00 0.31 O ATOM 1510 CB TYR A 217 3.352 10.950 2.450 1.00 0.37 C ATOM 1511 CG TYR A 217 2.657 12.007 3.276 1.00 0.56 C ATOM 1512 CD1 TYR A 217 3.333 13.157 3.648 1.00 0.80 C ATOM 1513 CD2 TYR A 217 1.330 11.871 3.665 1.00 1.06 C ATOM 1514 CE1 TYR A 217 2.716 14.141 4.385 1.00 0.95 C ATOM 1515 CE2 TYR A 217 0.702 12.857 4.401 1.00 1.26 C ATOM 1516 CZ TYR A 217 1.362 13.908 4.828 1.00 1.04 C ATOM 1517 OH TYR A 217 0.791 14.981 5.482 1.00 1.26 O ATOM 0 H TYR A 217 3.940 9.267 0.746 1.00 0.27 H new ATOM 0 HA TYR A 217 2.669 11.813 0.601 1.00 0.29 H new ATOM 0 HB2 TYR A 217 2.769 10.030 2.497 1.00 0.37 H new ATOM 0 HB3 TYR A 217 4.321 10.736 2.900 1.00 0.37 H new ATOM 0 HD1 TYR A 217 4.364 13.284 3.354 1.00 0.80 H new ATOM 0 HD2 TYR A 217 0.782 10.982 3.388 1.00 1.06 H new ATOM 0 HE1 TYR A 217 3.229 15.060 4.625 1.00 0.95 H new ATOM 0 HE2 TYR A 217 -0.349 12.761 4.629 1.00 1.26 H new ATOM 0 HH TYR A 217 0.363 14.671 6.307 1.00 1.26 H new ATOM 1527 N GLN A 218 5.950 11.769 1.042 1.00 0.33 N ATOM 1528 CA GLN A 218 7.142 12.592 0.890 1.00 0.42 C ATOM 1529 C GLN A 218 7.311 12.993 -0.573 1.00 0.46 C ATOM 1530 O GLN A 218 7.755 14.099 -0.884 1.00 0.58 O ATOM 1531 CB GLN A 218 8.389 11.859 1.394 1.00 0.47 C ATOM 1532 CG GLN A 218 8.669 10.554 0.672 1.00 0.63 C ATOM 1533 CD GLN A 218 10.039 9.988 0.985 1.00 1.23 C ATOM 1534 OE1 GLN A 218 10.230 8.774 1.011 1.00 1.83 O ATOM 1535 NE2 GLN A 218 11.008 10.862 1.201 1.00 1.97 N ATOM 0 H GLN A 218 6.130 10.799 1.300 1.00 0.33 H new ATOM 0 HA GLN A 218 7.020 13.491 1.494 1.00 0.42 H new ATOM 0 HB2 GLN A 218 9.253 12.515 1.286 1.00 0.47 H new ATOM 0 HB3 GLN A 218 8.274 11.656 2.459 1.00 0.47 H new ATOM 0 HG2 GLN A 218 7.908 9.823 0.946 1.00 0.63 H new ATOM 0 HG3 GLN A 218 8.585 10.714 -0.403 1.00 0.63 H new ATOM 0 HE21 GLN A 218 10.809 11.862 1.171 1.00 1.97 H new ATOM 0 HE22 GLN A 218 11.954 10.536 1.398 1.00 1.97 H new ATOM 1544 N GLN A 219 6.934 12.085 -1.462 1.00 0.42 N ATOM 1545 CA GLN A 219 6.964 12.348 -2.890 1.00 0.53 C ATOM 1546 C GLN A 219 5.940 13.412 -3.254 1.00 0.51 C ATOM 1547 O GLN A 219 6.254 14.366 -3.947 1.00 0.58 O ATOM 1548 CB GLN A 219 6.698 11.055 -3.659 1.00 0.60 C ATOM 1549 CG GLN A 219 6.537 11.246 -5.156 1.00 0.78 C ATOM 1550 CD GLN A 219 7.005 10.042 -5.953 1.00 0.98 C ATOM 1551 OE1 GLN A 219 7.445 10.172 -7.096 1.00 1.58 O ATOM 1552 NE2 GLN A 219 6.928 8.864 -5.358 1.00 1.70 N ATOM 0 H GLN A 219 6.602 11.153 -1.215 1.00 0.42 H new ATOM 0 HA GLN A 219 7.951 12.721 -3.164 1.00 0.53 H new ATOM 0 HB2 GLN A 219 7.520 10.362 -3.478 1.00 0.60 H new ATOM 0 HB3 GLN A 219 5.795 10.589 -3.264 1.00 0.60 H new ATOM 0 HG2 GLN A 219 5.489 11.442 -5.383 1.00 0.78 H new ATOM 0 HG3 GLN A 219 7.100 12.125 -5.469 1.00 0.78 H new ATOM 0 HE21 GLN A 219 6.558 8.795 -4.410 1.00 1.70 H new ATOM 0 HE22 GLN A 219 7.239 8.024 -5.847 1.00 1.70 H new ATOM 1561 N GLU A 220 4.726 13.238 -2.753 1.00 0.45 N ATOM 1562 CA GLU A 220 3.618 14.157 -2.988 1.00 0.46 C ATOM 1563 C GLU A 220 3.949 15.534 -2.427 1.00 0.46 C ATOM 1564 O GLU A 220 3.568 16.563 -2.992 1.00 0.49 O ATOM 1565 CB GLU A 220 2.367 13.594 -2.312 1.00 0.45 C ATOM 1566 CG GLU A 220 1.084 13.767 -3.097 1.00 0.75 C ATOM 1567 CD GLU A 220 1.214 13.358 -4.546 1.00 1.21 C ATOM 1568 OE1 GLU A 220 1.333 12.146 -4.811 1.00 1.74 O ATOM 1569 OE2 GLU A 220 1.207 14.243 -5.425 1.00 1.62 O ATOM 0 H GLU A 220 4.478 12.444 -2.163 1.00 0.45 H new ATOM 0 HA GLU A 220 3.443 14.261 -4.059 1.00 0.46 H new ATOM 0 HB2 GLU A 220 2.520 12.531 -2.125 1.00 0.45 H new ATOM 0 HB3 GLU A 220 2.249 14.075 -1.341 1.00 0.45 H new ATOM 0 HG2 GLU A 220 0.296 13.177 -2.629 1.00 0.75 H new ATOM 0 HG3 GLU A 220 0.773 14.810 -3.047 1.00 0.75 H new ATOM 1576 N SER A 221 4.678 15.535 -1.317 1.00 0.46 N ATOM 1577 CA SER A 221 5.137 16.760 -0.684 1.00 0.51 C ATOM 1578 C SER A 221 5.962 17.592 -1.671 1.00 0.56 C ATOM 1579 O SER A 221 5.870 18.820 -1.710 1.00 0.63 O ATOM 1580 CB SER A 221 5.974 16.408 0.554 1.00 0.52 C ATOM 1581 OG SER A 221 6.243 17.551 1.351 1.00 0.74 O ATOM 0 H SER A 221 4.966 14.685 -0.832 1.00 0.46 H new ATOM 0 HA SER A 221 4.276 17.353 -0.377 1.00 0.51 H new ATOM 0 HB2 SER A 221 5.445 15.665 1.151 1.00 0.52 H new ATOM 0 HB3 SER A 221 6.914 15.954 0.240 1.00 0.52 H new ATOM 0 HG SER A 221 5.429 18.091 1.434 1.00 0.74 H new ATOM 1587 N GLN A 222 6.764 16.906 -2.473 1.00 0.57 N ATOM 1588 CA GLN A 222 7.605 17.558 -3.468 1.00 0.68 C ATOM 1589 C GLN A 222 6.909 17.572 -4.825 1.00 0.69 C ATOM 1590 O GLN A 222 7.254 18.351 -5.704 1.00 0.79 O ATOM 1591 CB GLN A 222 8.947 16.835 -3.548 1.00 0.77 C ATOM 1592 CG GLN A 222 9.228 16.170 -4.883 1.00 1.19 C ATOM 1593 CD GLN A 222 10.553 15.434 -4.895 1.00 1.31 C ATOM 1594 OE1 GLN A 222 10.622 14.254 -4.549 1.00 1.81 O ATOM 1595 NE2 GLN A 222 11.610 16.116 -5.297 1.00 1.52 N ATOM 0 H GLN A 222 6.850 15.890 -2.454 1.00 0.57 H new ATOM 0 HA GLN A 222 7.780 18.593 -3.174 1.00 0.68 H new ATOM 0 HB2 GLN A 222 9.743 17.550 -3.338 1.00 0.77 H new ATOM 0 HB3 GLN A 222 8.984 16.078 -2.765 1.00 0.77 H new ATOM 0 HG2 GLN A 222 8.425 15.470 -5.113 1.00 1.19 H new ATOM 0 HG3 GLN A 222 9.228 16.925 -5.669 1.00 1.19 H new ATOM 0 HE21 GLN A 222 11.511 17.092 -5.576 1.00 1.52 H new ATOM 0 HE22 GLN A 222 12.525 15.667 -5.329 1.00 1.52 H new ATOM 1604 N ALA A 223 5.945 16.687 -4.992 1.00 0.64 N ATOM 1605 CA ALA A 223 5.084 16.706 -6.167 1.00 0.71 C ATOM 1606 C ALA A 223 4.350 18.028 -6.231 1.00 0.71 C ATOM 1607 O ALA A 223 4.119 18.566 -7.310 1.00 0.82 O ATOM 1608 CB ALA A 223 4.110 15.539 -6.146 1.00 0.72 C ATOM 0 H ALA A 223 5.735 15.942 -4.328 1.00 0.64 H new ATOM 0 HA ALA A 223 5.698 16.599 -7.061 1.00 0.71 H new ATOM 0 HB1 ALA A 223 3.479 15.576 -7.034 1.00 0.72 H new ATOM 0 HB2 ALA A 223 4.666 14.601 -6.135 1.00 0.72 H new ATOM 0 HB3 ALA A 223 3.486 15.602 -5.254 1.00 0.72 H new ATOM 1614 N ALA A 224 4.013 18.559 -5.061 1.00 0.65 N ATOM 1615 CA ALA A 224 3.483 19.909 -4.954 1.00 0.72 C ATOM 1616 C ALA A 224 4.474 20.907 -5.544 1.00 0.82 C ATOM 1617 O ALA A 224 4.084 21.872 -6.192 1.00 0.93 O ATOM 1618 CB ALA A 224 3.191 20.247 -3.502 1.00 0.75 C ATOM 0 H ALA A 224 4.099 18.070 -4.170 1.00 0.65 H new ATOM 0 HA ALA A 224 2.551 19.967 -5.516 1.00 0.72 H new ATOM 0 HB1 ALA A 224 2.795 21.260 -3.437 1.00 0.75 H new ATOM 0 HB2 ALA A 224 2.458 19.545 -3.105 1.00 0.75 H new ATOM 0 HB3 ALA A 224 4.110 20.179 -2.921 1.00 0.75 H new ATOM 1624 N TYR A 225 5.758 20.643 -5.325 1.00 0.88 N ATOM 1625 CA TYR A 225 6.831 21.449 -5.893 1.00 1.02 C ATOM 1626 C TYR A 225 6.944 21.233 -7.400 1.00 1.13 C ATOM 1627 O TYR A 225 7.201 22.171 -8.150 1.00 1.30 O ATOM 1628 CB TYR A 225 8.162 21.123 -5.210 1.00 1.02 C ATOM 1629 CG TYR A 225 8.452 21.978 -4.000 1.00 1.29 C ATOM 1630 CD1 TYR A 225 7.848 21.702 -2.784 1.00 1.62 C ATOM 1631 CD2 TYR A 225 9.325 23.058 -4.071 1.00 2.15 C ATOM 1632 CE1 TYR A 225 8.103 22.473 -1.668 1.00 2.22 C ATOM 1633 CE2 TYR A 225 9.586 23.834 -2.957 1.00 2.88 C ATOM 1634 CZ TYR A 225 9.000 23.569 -1.787 1.00 2.75 C ATOM 1635 OH TYR A 225 9.231 24.304 -0.643 1.00 3.57 O ATOM 0 H TYR A 225 6.083 19.866 -4.750 1.00 0.88 H new ATOM 0 HA TYR A 225 6.592 22.498 -5.718 1.00 1.02 H new ATOM 0 HB2 TYR A 225 8.159 20.075 -4.910 1.00 1.02 H new ATOM 0 HB3 TYR A 225 8.970 21.246 -5.932 1.00 1.02 H new ATOM 0 HD1 TYR A 225 7.165 20.869 -2.708 1.00 1.62 H new ATOM 0 HD2 TYR A 225 9.806 23.294 -5.009 1.00 2.15 H new ATOM 0 HE1 TYR A 225 7.630 22.248 -0.723 1.00 2.22 H new ATOM 0 HE2 TYR A 225 10.272 24.664 -3.034 1.00 2.88 H new ATOM 0 HH TYR A 225 9.861 25.028 -0.841 1.00 3.57 H new ATOM 1645 N GLN A 226 6.743 19.999 -7.840 1.00 1.09 N ATOM 1646 CA GLN A 226 6.841 19.666 -9.255 1.00 1.27 C ATOM 1647 C GLN A 226 5.690 20.271 -10.053 1.00 1.36 C ATOM 1648 O GLN A 226 5.900 20.829 -11.132 1.00 1.55 O ATOM 1649 CB GLN A 226 6.878 18.149 -9.447 1.00 1.32 C ATOM 1650 CG GLN A 226 8.151 17.503 -8.928 1.00 1.60 C ATOM 1651 CD GLN A 226 9.395 18.015 -9.634 1.00 2.19 C ATOM 1652 OE1 GLN A 226 10.472 18.088 -9.043 1.00 2.87 O ATOM 1653 NE2 GLN A 226 9.264 18.356 -10.909 1.00 2.60 N ATOM 0 H GLN A 226 6.511 19.210 -7.237 1.00 1.09 H new ATOM 0 HA GLN A 226 7.771 20.093 -9.631 1.00 1.27 H new ATOM 0 HB2 GLN A 226 6.022 17.706 -8.939 1.00 1.32 H new ATOM 0 HB3 GLN A 226 6.771 17.922 -10.508 1.00 1.32 H new ATOM 0 HG2 GLN A 226 8.241 17.693 -7.858 1.00 1.60 H new ATOM 0 HG3 GLN A 226 8.084 16.423 -9.055 1.00 1.60 H new ATOM 0 HE21 GLN A 226 8.355 18.282 -11.366 1.00 2.60 H new ATOM 0 HE22 GLN A 226 10.072 18.692 -11.433 1.00 2.60 H new ATOM 1662 N ARG A 227 4.481 20.179 -9.517 1.00 1.25 N ATOM 1663 CA ARG A 227 3.307 20.721 -10.195 1.00 1.35 C ATOM 1664 C ARG A 227 3.175 22.218 -9.937 1.00 1.38 C ATOM 1665 O ARG A 227 2.276 22.870 -10.469 1.00 1.46 O ATOM 1666 CB ARG A 227 2.034 19.992 -9.758 1.00 1.32 C ATOM 1667 CG ARG A 227 1.764 20.074 -8.267 1.00 1.00 C ATOM 1668 CD ARG A 227 0.505 19.321 -7.882 1.00 1.08 C ATOM 1669 NE ARG A 227 0.634 17.887 -8.141 1.00 1.97 N ATOM 1670 CZ ARG A 227 0.728 16.957 -7.192 1.00 2.50 C ATOM 1671 NH1 ARG A 227 0.671 17.291 -5.908 1.00 2.39 N ATOM 1672 NH2 ARG A 227 0.873 15.685 -7.531 1.00 3.59 N ATOM 0 H ARG A 227 4.286 19.737 -8.619 1.00 1.25 H new ATOM 0 HA ARG A 227 3.440 20.565 -11.265 1.00 1.35 H new ATOM 0 HB2 ARG A 227 1.183 20.411 -10.296 1.00 1.32 H new ATOM 0 HB3 ARG A 227 2.109 18.944 -10.047 1.00 1.32 H new ATOM 0 HG2 ARG A 227 2.614 19.665 -7.720 1.00 1.00 H new ATOM 0 HG3 ARG A 227 1.668 21.119 -7.972 1.00 1.00 H new ATOM 0 HD2 ARG A 227 0.293 19.483 -6.825 1.00 1.08 H new ATOM 0 HD3 ARG A 227 -0.342 19.718 -8.442 1.00 1.08 H new ATOM 0 HE ARG A 227 0.653 17.579 -9.113 1.00 1.97 H new ATOM 0 HH11 ARG A 227 0.554 18.268 -5.640 1.00 2.39 H new ATOM 0 HH12 ARG A 227 0.744 16.570 -5.190 1.00 2.39 H new ATOM 0 HH21 ARG A 227 0.912 15.421 -8.515 1.00 3.59 H new ATOM 0 HH22 ARG A 227 0.945 14.969 -6.808 1.00 3.59 H new ATOM 1686 N ALA A 228 4.060 22.751 -9.107 1.00 1.34 N ATOM 1687 CA ALA A 228 4.097 24.180 -8.845 1.00 1.43 C ATOM 1688 C ALA A 228 4.726 24.910 -10.029 1.00 1.64 C ATOM 1689 CB ALA A 228 4.872 24.467 -7.563 1.00 1.40 C ATOM 0 H ALA A 228 4.764 22.212 -8.603 1.00 1.34 H new ATOM 0 HA ALA A 228 3.077 24.541 -8.713 1.00 1.43 H new ATOM 0 HB1 ALA A 228 4.890 25.542 -7.382 1.00 1.40 H new ATOM 0 HB2 ALA A 228 4.388 23.966 -6.725 1.00 1.40 H new ATOM 0 HB3 ALA A 228 5.893 24.099 -7.665 1.00 1.40 H new