USER MOD reduce.3.24.130724 H: found=0, std=0, add=665, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 662 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 149 TYR OH : rot -173:sc= -1.38! USER MOD Set 1.2: A 202 HIS : no HD1:sc= -1.61! K(o=-3!,f=0.9) USER MOD Single : A 147 GLN : amide:sc= -2.05 K(o=-2,f=-1.5) USER MOD Single : A 150 GLN : amide:sc= 0.716 K(o=0.72,f=-0.74) USER MOD Single : A 155 CYS SG : rot 180:sc= -0.12 USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 THR OG1 : rot 180:sc= 0.027 USER MOD Single : A 162 TYR OH : rot 15:sc= 1.29 USER MOD Single : A 166 HIS : no HE2:sc= 0.966 K(o=0.97,f=-3.6!) USER MOD Single : A 169 GLN : amide:sc= -0.658 K(o=-0.66,f=0) USER MOD Single : A 171 THR OG1 : rot -90:sc= 0.574 USER MOD Single : A 172 SER OG : rot 81:sc= 1.3 USER MOD Single : A 173 SER OG : rot 83:sc= 0.0522 USER MOD Single : A 174 ASN : amide:sc= -1.52 K(o=-1.5,f=-3.3!) USER MOD Single : A 177 THR OG1 : rot 180:sc= 0 USER MOD Single : A 183 THR OG1 : rot -150:sc= 0 USER MOD Single : A 190 ASN : amide:sc= 0.894 X(o=0.89,f=0.65) USER MOD Single : A 192 THR OG1 : rot 180:sc= -0.906 USER MOD Single : A 194 THR OG1 : rot 137:sc= 0.485 USER MOD Single : A 196 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 199 MET CE :methyl 152:sc= -0.448 (180deg=-1.78) USER MOD Single : A 203 THR OG1 : rot 180:sc= 0 USER MOD Single : A 206 LYS NZ :NH3+ 135:sc= 1.17 (180deg=0.629) USER MOD Single : A 215 SER OG : rot 180:sc= 0 USER MOD Single : A 217 GLN : amide:sc= -0.524 X(o=-0.52,f=-0.56) USER MOD Single : A 221 TYR OH : rot 180:sc= 0 USER MOD Single : A 224 HIS : no HD1:sc= -0.0146 X(o=-0.015,f=0) USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 146 3.698 14.847 -2.030 1.00 1.13 N ATOM 66 CA LEU A 146 2.851 13.729 -2.078 1.00 61.34 C ATOM 67 C LEU A 146 3.041 13.096 -0.731 1.00 71.21 C ATOM 68 O LEU A 146 4.184 12.904 -0.312 1.00 51.14 O ATOM 69 CB LEU A 146 3.241 12.725 -3.191 1.00 72.33 C ATOM 70 CG LEU A 146 3.143 13.180 -4.663 1.00 13.35 C ATOM 71 CD1 LEU A 146 4.260 14.133 -5.052 1.00 21.34 C ATOM 72 CD2 LEU A 146 3.113 11.979 -5.589 1.00 62.32 C ATOM 0 HA LEU A 146 1.823 14.015 -2.301 1.00 61.34 H new ATOM 0 HB2 LEU A 146 4.269 12.412 -3.009 1.00 72.33 H new ATOM 0 HB3 LEU A 146 2.613 11.842 -3.075 1.00 72.33 H new ATOM 0 HG LEU A 146 2.208 13.731 -4.767 1.00 13.35 H new ATOM 0 HD11 LEU A 146 4.144 14.422 -6.097 1.00 21.34 H new ATOM 0 HD12 LEU A 146 4.216 15.022 -4.422 1.00 21.34 H new ATOM 0 HD13 LEU A 146 5.223 13.640 -4.917 1.00 21.34 H new ATOM 0 HD21 LEU A 146 3.044 12.318 -6.623 1.00 62.32 H new ATOM 0 HD22 LEU A 146 4.025 11.396 -5.459 1.00 62.32 H new ATOM 0 HD23 LEU A 146 2.249 11.358 -5.352 1.00 62.32 H new ATOM 84 N GLN A 147 1.977 12.824 -0.045 1.00 41.52 N ATOM 85 CA GLN A 147 2.068 12.336 1.305 1.00 72.35 C ATOM 86 C GLN A 147 2.358 10.847 1.286 1.00 10.04 C ATOM 87 O GLN A 147 1.659 10.092 0.596 1.00 13.53 O ATOM 88 CB GLN A 147 0.764 12.642 2.063 1.00 41.43 C ATOM 89 CG GLN A 147 0.779 12.268 3.548 1.00 11.10 C ATOM 90 CD GLN A 147 1.846 12.999 4.354 1.00 4.41 C ATOM 91 OE1 GLN A 147 2.368 12.466 5.335 1.00 14.34 O ATOM 92 NE2 GLN A 147 2.163 14.220 3.972 1.00 53.22 N ATOM 0 H GLN A 147 1.025 12.931 -0.396 1.00 41.52 H new ATOM 0 HA GLN A 147 2.884 12.839 1.825 1.00 72.35 H new ATOM 0 HB2 GLN A 147 0.550 13.707 1.974 1.00 41.43 H new ATOM 0 HB3 GLN A 147 -0.055 12.111 1.578 1.00 41.43 H new ATOM 0 HG2 GLN A 147 -0.199 12.484 3.978 1.00 11.10 H new ATOM 0 HG3 GLN A 147 0.938 11.194 3.641 1.00 11.10 H new ATOM 0 HE21 GLN A 147 1.712 14.632 3.155 1.00 53.22 H new ATOM 0 HE22 GLN A 147 2.859 14.753 4.493 1.00 53.22 H new ATOM 101 N PRO A 148 3.427 10.411 1.980 1.00 3.44 N ATOM 102 CA PRO A 148 3.775 9.016 2.059 1.00 74.53 C ATOM 103 C PRO A 148 2.875 8.260 3.018 1.00 4.13 C ATOM 104 O PRO A 148 3.010 8.353 4.227 1.00 44.23 O ATOM 105 CB PRO A 148 5.228 9.016 2.546 1.00 41.31 C ATOM 106 CG PRO A 148 5.386 10.295 3.296 1.00 52.34 C ATOM 107 CD PRO A 148 4.386 11.265 2.718 1.00 22.44 C ATOM 0 HA PRO A 148 3.654 8.512 1.100 1.00 74.53 H new ATOM 0 HB2 PRO A 148 5.430 8.157 3.185 1.00 41.31 H new ATOM 0 HB3 PRO A 148 5.924 8.961 1.709 1.00 41.31 H new ATOM 0 HG2 PRO A 148 5.207 10.144 4.361 1.00 52.34 H new ATOM 0 HG3 PRO A 148 6.401 10.680 3.195 1.00 52.34 H new ATOM 0 HD2 PRO A 148 3.888 11.836 3.502 1.00 22.44 H new ATOM 0 HD3 PRO A 148 4.868 11.985 2.056 1.00 22.44 H new ATOM 115 N TYR A 149 1.933 7.579 2.476 1.00 33.12 N ATOM 116 CA TYR A 149 1.046 6.765 3.244 1.00 74.41 C ATOM 117 C TYR A 149 1.592 5.378 3.319 1.00 63.24 C ATOM 118 O TYR A 149 2.277 4.928 2.411 1.00 14.02 O ATOM 119 CB TYR A 149 -0.353 6.743 2.638 1.00 23.12 C ATOM 120 CG TYR A 149 -1.041 8.068 2.700 1.00 10.34 C ATOM 121 CD1 TYR A 149 -1.596 8.508 3.884 1.00 2.42 C ATOM 122 CD2 TYR A 149 -1.133 8.884 1.587 1.00 4.42 C ATOM 123 CE1 TYR A 149 -2.227 9.720 3.965 1.00 15.55 C ATOM 124 CE2 TYR A 149 -1.765 10.102 1.658 1.00 62.14 C ATOM 125 CZ TYR A 149 -2.308 10.514 2.846 1.00 42.35 C ATOM 126 OH TYR A 149 -2.928 11.723 2.914 1.00 13.32 O ATOM 0 H TYR A 149 1.748 7.567 1.473 1.00 33.12 H new ATOM 0 HA TYR A 149 0.967 7.188 4.246 1.00 74.41 H new ATOM 0 HB2 TYR A 149 -0.287 6.423 1.598 1.00 23.12 H new ATOM 0 HB3 TYR A 149 -0.957 6.002 3.161 1.00 23.12 H new ATOM 0 HD1 TYR A 149 -1.531 7.884 4.763 1.00 2.42 H new ATOM 0 HD2 TYR A 149 -0.703 8.560 0.651 1.00 4.42 H new ATOM 0 HE1 TYR A 149 -2.657 10.049 4.899 1.00 15.55 H new ATOM 0 HE2 TYR A 149 -1.833 10.731 0.782 1.00 62.14 H new ATOM 0 HH TYR A 149 -2.996 12.107 2.015 1.00 13.32 H new ATOM 136 N GLN A 150 1.322 4.723 4.383 1.00 4.14 N ATOM 137 CA GLN A 150 1.758 3.386 4.581 1.00 14.44 C ATOM 138 C GLN A 150 0.544 2.507 4.763 1.00 0.20 C ATOM 139 O GLN A 150 -0.229 2.666 5.711 1.00 62.21 O ATOM 140 CB GLN A 150 2.748 3.301 5.772 1.00 13.33 C ATOM 141 CG GLN A 150 2.803 4.566 6.648 1.00 5.13 C ATOM 142 CD GLN A 150 3.831 4.486 7.759 1.00 75.21 C ATOM 143 OE1 GLN A 150 4.839 3.791 7.639 1.00 30.34 O ATOM 144 NE2 GLN A 150 3.632 5.247 8.820 1.00 54.33 N ATOM 0 H GLN A 150 0.781 5.104 5.159 1.00 4.14 H new ATOM 0 HA GLN A 150 2.308 3.032 3.709 1.00 14.44 H new ATOM 0 HB2 GLN A 150 2.472 2.453 6.398 1.00 13.33 H new ATOM 0 HB3 GLN A 150 3.747 3.099 5.384 1.00 13.33 H new ATOM 0 HG2 GLN A 150 3.027 5.426 6.017 1.00 5.13 H new ATOM 0 HG3 GLN A 150 1.820 4.739 7.085 1.00 5.13 H new ATOM 0 HE21 GLN A 150 2.786 5.812 8.891 1.00 54.33 H new ATOM 0 HE22 GLN A 150 4.324 5.269 9.569 1.00 54.33 H new ATOM 153 N VAL A 151 0.358 1.623 3.837 1.00 53.31 N ATOM 154 CA VAL A 151 -0.781 0.749 3.821 1.00 30.45 C ATOM 155 C VAL A 151 -0.332 -0.651 4.185 1.00 55.24 C ATOM 156 O VAL A 151 0.441 -1.270 3.463 1.00 41.24 O ATOM 157 CB VAL A 151 -1.459 0.743 2.417 1.00 30.21 C ATOM 158 CG1 VAL A 151 -2.692 -0.144 2.399 1.00 33.05 C ATOM 159 CG2 VAL A 151 -1.821 2.161 1.983 1.00 22.04 C ATOM 0 H VAL A 151 1.000 1.482 3.057 1.00 53.31 H new ATOM 0 HA VAL A 151 -1.513 1.106 4.546 1.00 30.45 H new ATOM 0 HB VAL A 151 -0.739 0.334 1.708 1.00 30.21 H new ATOM 0 HG11 VAL A 151 -3.140 -0.125 1.405 1.00 33.05 H new ATOM 0 HG12 VAL A 151 -2.409 -1.166 2.650 1.00 33.05 H new ATOM 0 HG13 VAL A 151 -3.414 0.222 3.129 1.00 33.05 H new ATOM 0 HG21 VAL A 151 -2.293 2.132 1.001 1.00 22.04 H new ATOM 0 HG22 VAL A 151 -2.512 2.597 2.704 1.00 22.04 H new ATOM 0 HG23 VAL A 151 -0.917 2.768 1.933 1.00 22.04 H new ATOM 169 N ARG A 152 -0.791 -1.113 5.307 1.00 1.21 N ATOM 170 CA ARG A 152 -0.443 -2.413 5.831 1.00 33.53 C ATOM 171 C ARG A 152 -1.565 -3.397 5.494 1.00 43.22 C ATOM 172 O ARG A 152 -2.616 -3.370 6.121 1.00 22.54 O ATOM 173 CB ARG A 152 -0.314 -2.324 7.370 1.00 22.45 C ATOM 174 CG ARG A 152 0.815 -1.440 7.891 1.00 34.21 C ATOM 175 CD ARG A 152 2.132 -2.195 7.968 1.00 44.03 C ATOM 176 NE ARG A 152 2.077 -3.264 8.980 1.00 12.25 N ATOM 177 CZ ARG A 152 2.989 -4.231 9.160 1.00 2.24 C ATOM 178 NH1 ARG A 152 4.053 -4.315 8.365 1.00 14.23 N ATOM 179 NH2 ARG A 152 2.815 -5.115 10.135 1.00 25.11 N ATOM 0 H ARG A 152 -1.433 -0.591 5.903 1.00 1.21 H new ATOM 0 HA ARG A 152 0.499 -2.746 5.396 1.00 33.53 H new ATOM 0 HB2 ARG A 152 -1.256 -1.954 7.774 1.00 22.45 H new ATOM 0 HB3 ARG A 152 -0.173 -3.331 7.763 1.00 22.45 H new ATOM 0 HG2 ARG A 152 0.930 -0.574 7.239 1.00 34.21 H new ATOM 0 HG3 ARG A 152 0.554 -1.062 8.879 1.00 34.21 H new ATOM 0 HD2 ARG A 152 2.365 -2.625 6.994 1.00 44.03 H new ATOM 0 HD3 ARG A 152 2.937 -1.502 8.211 1.00 44.03 H new ATOM 0 HE ARG A 152 1.269 -3.269 9.603 1.00 12.25 H new ATOM 0 HH11 ARG A 152 4.181 -3.640 7.611 1.00 14.23 H new ATOM 0 HH12 ARG A 152 4.741 -5.054 8.510 1.00 14.23 H new ATOM 0 HH21 ARG A 152 1.994 -5.055 10.738 1.00 25.11 H new ATOM 0 HH22 ARG A 152 3.502 -5.855 10.281 1.00 25.11 H new ATOM 193 N VAL A 153 -1.359 -4.230 4.515 1.00 52.53 N ATOM 194 CA VAL A 153 -2.357 -5.221 4.144 1.00 63.13 C ATOM 195 C VAL A 153 -1.884 -6.618 4.496 1.00 51.42 C ATOM 196 O VAL A 153 -0.816 -7.062 4.069 1.00 55.34 O ATOM 197 CB VAL A 153 -2.846 -5.123 2.644 1.00 4.31 C ATOM 198 CG1 VAL A 153 -1.686 -4.961 1.685 1.00 34.05 C ATOM 199 CG2 VAL A 153 -3.628 -6.373 2.264 1.00 62.32 C ATOM 0 H VAL A 153 -0.510 -4.251 3.951 1.00 52.53 H new ATOM 0 HA VAL A 153 -3.242 -4.992 4.737 1.00 63.13 H new ATOM 0 HB VAL A 153 -3.484 -4.242 2.569 1.00 4.31 H new ATOM 0 HG11 VAL A 153 -2.064 -4.897 0.665 1.00 34.05 H new ATOM 0 HG12 VAL A 153 -1.139 -4.050 1.927 1.00 34.05 H new ATOM 0 HG13 VAL A 153 -1.019 -5.819 1.772 1.00 34.05 H new ATOM 0 HG21 VAL A 153 -3.960 -6.294 1.229 1.00 62.32 H new ATOM 0 HG22 VAL A 153 -2.989 -7.249 2.375 1.00 62.32 H new ATOM 0 HG23 VAL A 153 -4.496 -6.472 2.916 1.00 62.32 H new ATOM 209 N ILE A 154 -2.665 -7.279 5.295 1.00 55.01 N ATOM 210 CA ILE A 154 -2.376 -8.602 5.743 1.00 22.31 C ATOM 211 C ILE A 154 -3.200 -9.537 4.878 1.00 3.33 C ATOM 212 O ILE A 154 -4.434 -9.454 4.881 1.00 2.23 O ATOM 213 CB ILE A 154 -2.777 -8.837 7.255 1.00 23.44 C ATOM 214 CG1 ILE A 154 -2.109 -7.838 8.239 1.00 2.51 C ATOM 215 CG2 ILE A 154 -2.456 -10.263 7.680 1.00 34.11 C ATOM 216 CD1 ILE A 154 -2.647 -6.412 8.206 1.00 2.10 C ATOM 0 H ILE A 154 -3.540 -6.903 5.660 1.00 55.01 H new ATOM 0 HA ILE A 154 -1.303 -8.777 5.666 1.00 22.31 H new ATOM 0 HB ILE A 154 -3.852 -8.663 7.307 1.00 23.44 H new ATOM 0 HG12 ILE A 154 -2.222 -8.225 9.252 1.00 2.51 H new ATOM 0 HG13 ILE A 154 -1.040 -7.808 8.026 1.00 2.51 H new ATOM 0 HG21 ILE A 154 -2.739 -10.404 8.723 1.00 34.11 H new ATOM 0 HG22 ILE A 154 -3.011 -10.963 7.055 1.00 34.11 H new ATOM 0 HG23 ILE A 154 -1.387 -10.445 7.566 1.00 34.11 H new ATOM 0 HD11 ILE A 154 -2.109 -5.803 8.932 1.00 2.10 H new ATOM 0 HD12 ILE A 154 -2.509 -5.994 7.209 1.00 2.10 H new ATOM 0 HD13 ILE A 154 -3.709 -6.418 8.453 1.00 2.10 H new ATOM 228 N CYS A 155 -2.561 -10.385 4.140 1.00 14.42 N ATOM 229 CA CYS A 155 -3.252 -11.262 3.251 1.00 65.35 C ATOM 230 C CYS A 155 -2.546 -12.592 3.202 1.00 53.11 C ATOM 231 O CYS A 155 -1.515 -12.762 3.832 1.00 51.21 O ATOM 232 CB CYS A 155 -3.321 -10.629 1.855 1.00 71.52 C ATOM 233 SG CYS A 155 -1.720 -10.159 1.166 1.00 32.00 S ATOM 0 H CYS A 155 -1.546 -10.490 4.136 1.00 14.42 H new ATOM 0 HA CYS A 155 -4.269 -11.424 3.609 1.00 65.35 H new ATOM 0 HB2 CYS A 155 -3.803 -11.331 1.175 1.00 71.52 H new ATOM 0 HB3 CYS A 155 -3.956 -9.744 1.902 1.00 71.52 H new ATOM 0 HG CYS A 155 -1.891 -9.638 -0.013 1.00 32.00 H new ATOM 239 N ARG A 156 -3.131 -13.531 2.525 1.00 15.44 N ATOM 240 CA ARG A 156 -2.499 -14.835 2.276 1.00 62.02 C ATOM 241 C ARG A 156 -1.213 -14.663 1.428 1.00 15.04 C ATOM 242 O ARG A 156 -1.146 -13.771 0.594 1.00 62.32 O ATOM 243 CB ARG A 156 -3.476 -15.742 1.527 1.00 23.44 C ATOM 244 CG ARG A 156 -4.647 -16.248 2.346 1.00 13.02 C ATOM 245 CD ARG A 156 -4.203 -17.259 3.393 1.00 32.34 C ATOM 246 NE ARG A 156 -5.345 -17.812 4.125 1.00 4.03 N ATOM 247 CZ ARG A 156 -5.389 -19.033 4.685 1.00 10.32 C ATOM 248 NH1 ARG A 156 -4.316 -19.825 4.677 1.00 44.41 N ATOM 249 NH2 ARG A 156 -6.498 -19.442 5.304 1.00 20.11 N ATOM 0 H ARG A 156 -4.062 -13.437 2.119 1.00 15.44 H new ATOM 0 HA ARG A 156 -2.235 -15.282 3.234 1.00 62.02 H new ATOM 0 HB2 ARG A 156 -3.864 -15.198 0.666 1.00 23.44 H new ATOM 0 HB3 ARG A 156 -2.926 -16.600 1.141 1.00 23.44 H new ATOM 0 HG2 ARG A 156 -5.139 -15.408 2.836 1.00 13.02 H new ATOM 0 HG3 ARG A 156 -5.383 -16.707 1.685 1.00 13.02 H new ATOM 0 HD2 ARG A 156 -3.654 -18.067 2.910 1.00 32.34 H new ATOM 0 HD3 ARG A 156 -3.517 -16.782 4.093 1.00 32.34 H new ATOM 0 HE ARG A 156 -6.173 -17.223 4.217 1.00 4.03 H new ATOM 0 HH11 ARG A 156 -3.450 -19.506 4.243 1.00 44.41 H new ATOM 0 HH12 ARG A 156 -4.361 -20.750 5.105 1.00 44.41 H new ATOM 0 HH21 ARG A 156 -7.311 -18.828 5.352 1.00 20.11 H new ATOM 0 HH22 ARG A 156 -6.533 -20.368 5.729 1.00 20.11 H new ATOM 263 N PRO A 157 -0.163 -15.481 1.655 1.00 74.22 N ATOM 264 CA PRO A 157 1.078 -15.439 0.851 1.00 11.12 C ATOM 265 C PRO A 157 0.848 -15.612 -0.651 1.00 24.12 C ATOM 266 O PRO A 157 1.584 -15.049 -1.463 1.00 23.14 O ATOM 267 CB PRO A 157 1.913 -16.584 1.403 1.00 44.24 C ATOM 268 CG PRO A 157 1.430 -16.745 2.798 1.00 13.22 C ATOM 269 CD PRO A 157 -0.043 -16.442 2.761 1.00 4.45 C ATOM 0 HA PRO A 157 1.558 -14.464 0.933 1.00 11.12 H new ATOM 0 HB2 PRO A 157 1.770 -17.496 0.824 1.00 44.24 H new ATOM 0 HB3 PRO A 157 2.977 -16.351 1.374 1.00 44.24 H new ATOM 0 HG2 PRO A 157 1.612 -17.757 3.160 1.00 13.22 H new ATOM 0 HG3 PRO A 157 1.952 -16.066 3.473 1.00 13.22 H new ATOM 0 HD2 PRO A 157 -0.634 -17.340 2.580 1.00 4.45 H new ATOM 0 HD3 PRO A 157 -0.390 -16.017 3.703 1.00 4.45 H new ATOM 277 N LYS A 158 -0.160 -16.379 -1.018 1.00 3.52 N ATOM 278 CA LYS A 158 -0.520 -16.554 -2.412 1.00 22.54 C ATOM 279 C LYS A 158 -1.382 -15.412 -2.902 1.00 63.43 C ATOM 280 O LYS A 158 -1.735 -15.347 -4.073 1.00 54.23 O ATOM 281 CB LYS A 158 -1.220 -17.882 -2.667 1.00 44.11 C ATOM 282 CG LYS A 158 -0.334 -19.098 -2.504 1.00 51.21 C ATOM 283 CD LYS A 158 -1.098 -20.359 -2.843 1.00 12.13 C ATOM 284 CE LYS A 158 -0.193 -21.567 -2.849 1.00 42.22 C ATOM 285 NZ LYS A 158 -0.913 -22.780 -3.277 1.00 11.44 N ATOM 0 H LYS A 158 -0.749 -16.895 -0.364 1.00 3.52 H new ATOM 0 HA LYS A 158 0.414 -16.558 -2.974 1.00 22.54 H new ATOM 0 HB2 LYS A 158 -2.066 -17.970 -1.985 1.00 44.11 H new ATOM 0 HB3 LYS A 158 -1.626 -17.876 -3.679 1.00 44.11 H new ATOM 0 HG2 LYS A 158 0.538 -19.009 -3.151 1.00 51.21 H new ATOM 0 HG3 LYS A 158 0.034 -19.153 -1.479 1.00 51.21 H new ATOM 0 HD2 LYS A 158 -1.899 -20.506 -2.119 1.00 12.13 H new ATOM 0 HD3 LYS A 158 -1.568 -20.250 -3.820 1.00 12.13 H new ATOM 0 HE2 LYS A 158 0.650 -21.388 -3.517 1.00 42.22 H new ATOM 0 HE3 LYS A 158 0.218 -21.720 -1.851 1.00 42.22 H new ATOM 0 HZ1 LYS A 158 -0.262 -23.591 -3.270 1.00 11.44 H new ATOM 0 HZ2 LYS A 158 -1.702 -22.964 -2.625 1.00 11.44 H new ATOM 0 HZ3 LYS A 158 -1.284 -22.642 -4.239 1.00 11.44 H new ATOM 299 N ALA A 159 -1.745 -14.532 -2.000 1.00 32.15 N ATOM 300 CA ALA A 159 -2.542 -13.396 -2.344 1.00 71.11 C ATOM 301 C ALA A 159 -1.646 -12.235 -2.660 1.00 61.52 C ATOM 302 O ALA A 159 -1.925 -11.470 -3.571 1.00 62.10 O ATOM 303 CB ALA A 159 -3.528 -13.042 -1.238 1.00 31.34 C ATOM 0 H ALA A 159 -1.494 -14.589 -1.013 1.00 32.15 H new ATOM 0 HA ALA A 159 -3.134 -13.643 -3.225 1.00 71.11 H new ATOM 0 HB1 ALA A 159 -4.115 -12.174 -1.538 1.00 31.34 H new ATOM 0 HB2 ALA A 159 -4.194 -13.886 -1.060 1.00 31.34 H new ATOM 0 HB3 ALA A 159 -2.982 -12.812 -0.323 1.00 31.34 H new ATOM 309 N GLU A 160 -0.535 -12.163 -1.931 1.00 34.13 N ATOM 310 CA GLU A 160 0.488 -11.121 -2.056 1.00 15.21 C ATOM 311 C GLU A 160 0.875 -10.882 -3.510 1.00 5.12 C ATOM 312 O GLU A 160 1.017 -9.736 -3.940 1.00 15.53 O ATOM 313 CB GLU A 160 1.696 -11.520 -1.165 1.00 62.55 C ATOM 314 CG GLU A 160 2.937 -10.615 -1.197 1.00 12.34 C ATOM 315 CD GLU A 160 3.935 -10.976 -2.272 1.00 51.11 C ATOM 316 OE1 GLU A 160 4.727 -11.898 -2.056 1.00 24.31 O ATOM 317 OE2 GLU A 160 3.988 -10.316 -3.309 1.00 5.13 O ATOM 0 H GLU A 160 -0.312 -12.851 -1.212 1.00 34.13 H new ATOM 0 HA GLU A 160 0.095 -10.166 -1.708 1.00 15.21 H new ATOM 0 HB2 GLU A 160 1.348 -11.576 -0.134 1.00 62.55 H new ATOM 0 HB3 GLU A 160 2.006 -12.525 -1.451 1.00 62.55 H new ATOM 0 HG2 GLU A 160 2.618 -9.583 -1.344 1.00 12.34 H new ATOM 0 HG3 GLU A 160 3.432 -10.660 -0.227 1.00 12.34 H new ATOM 324 N THR A 161 0.936 -11.950 -4.263 1.00 54.22 N ATOM 325 CA THR A 161 1.309 -11.906 -5.654 1.00 3.31 C ATOM 326 C THR A 161 0.340 -11.053 -6.493 1.00 63.12 C ATOM 327 O THR A 161 0.766 -10.168 -7.246 1.00 41.01 O ATOM 328 CB THR A 161 1.417 -13.332 -6.210 1.00 42.41 C ATOM 329 OG1 THR A 161 0.252 -14.073 -5.793 1.00 74.11 O ATOM 330 CG2 THR A 161 2.669 -14.022 -5.685 1.00 5.54 C ATOM 0 H THR A 161 0.725 -12.888 -3.923 1.00 54.22 H new ATOM 0 HA THR A 161 2.283 -11.422 -5.723 1.00 3.31 H new ATOM 0 HB THR A 161 1.478 -13.291 -7.298 1.00 42.41 H new ATOM 0 HG1 THR A 161 0.304 -14.987 -6.141 1.00 74.11 H new ATOM 0 HG21 THR A 161 2.726 -15.032 -6.092 1.00 5.54 H new ATOM 0 HG22 THR A 161 3.550 -13.458 -5.990 1.00 5.54 H new ATOM 0 HG23 THR A 161 2.628 -14.071 -4.597 1.00 5.54 H new ATOM 338 N TYR A 162 -0.947 -11.279 -6.347 1.00 3.33 N ATOM 339 CA TYR A 162 -1.901 -10.507 -7.098 1.00 41.53 C ATOM 340 C TYR A 162 -2.230 -9.203 -6.412 1.00 74.02 C ATOM 341 O TYR A 162 -2.555 -8.226 -7.065 1.00 3.52 O ATOM 342 CB TYR A 162 -3.163 -11.300 -7.504 1.00 3.35 C ATOM 343 CG TYR A 162 -3.877 -12.043 -6.394 1.00 73.04 C ATOM 344 CD1 TYR A 162 -4.663 -11.379 -5.461 1.00 41.20 C ATOM 345 CD2 TYR A 162 -3.773 -13.419 -6.296 1.00 4.01 C ATOM 346 CE1 TYR A 162 -5.315 -12.068 -4.461 1.00 61.21 C ATOM 347 CE2 TYR A 162 -4.422 -14.114 -5.303 1.00 61.04 C ATOM 348 CZ TYR A 162 -5.187 -13.438 -4.389 1.00 22.04 C ATOM 349 OH TYR A 162 -5.818 -14.129 -3.387 1.00 32.30 O ATOM 0 H TYR A 162 -1.349 -11.980 -5.725 1.00 3.33 H new ATOM 0 HA TYR A 162 -1.410 -10.261 -8.040 1.00 41.53 H new ATOM 0 HB2 TYR A 162 -3.870 -10.607 -7.961 1.00 3.35 H new ATOM 0 HB3 TYR A 162 -2.881 -12.021 -8.272 1.00 3.35 H new ATOM 0 HD1 TYR A 162 -4.765 -10.305 -5.520 1.00 41.20 H new ATOM 0 HD2 TYR A 162 -3.171 -13.957 -7.013 1.00 4.01 H new ATOM 0 HE1 TYR A 162 -5.921 -11.539 -3.740 1.00 61.21 H new ATOM 0 HE2 TYR A 162 -4.329 -15.188 -5.244 1.00 61.04 H new ATOM 0 HH TYR A 162 -6.494 -13.555 -2.969 1.00 32.30 H new ATOM 359 N VAL A 163 -2.086 -9.181 -5.103 1.00 0.21 N ATOM 360 CA VAL A 163 -2.345 -7.984 -4.323 1.00 3.14 C ATOM 361 C VAL A 163 -1.333 -6.906 -4.664 1.00 13.21 C ATOM 362 O VAL A 163 -1.711 -5.795 -5.006 1.00 71.24 O ATOM 363 CB VAL A 163 -2.372 -8.272 -2.782 1.00 52.42 C ATOM 364 CG1 VAL A 163 -2.381 -6.986 -1.971 1.00 10.11 C ATOM 365 CG2 VAL A 163 -3.601 -9.096 -2.424 1.00 60.11 C ATOM 0 H VAL A 163 -1.788 -9.985 -4.551 1.00 0.21 H new ATOM 0 HA VAL A 163 -3.340 -7.626 -4.588 1.00 3.14 H new ATOM 0 HB VAL A 163 -1.466 -8.827 -2.538 1.00 52.42 H new ATOM 0 HG11 VAL A 163 -2.400 -7.226 -0.908 1.00 10.11 H new ATOM 0 HG12 VAL A 163 -1.485 -6.407 -2.196 1.00 10.11 H new ATOM 0 HG13 VAL A 163 -3.265 -6.401 -2.226 1.00 10.11 H new ATOM 0 HG21 VAL A 163 -3.609 -9.290 -1.351 1.00 60.11 H new ATOM 0 HG22 VAL A 163 -4.501 -8.546 -2.700 1.00 60.11 H new ATOM 0 HG23 VAL A 163 -3.574 -10.043 -2.964 1.00 60.11 H new ATOM 375 N ARG A 164 -0.062 -7.264 -4.655 1.00 25.25 N ATOM 376 CA ARG A 164 1.003 -6.318 -4.941 1.00 34.32 C ATOM 377 C ARG A 164 0.892 -5.780 -6.366 1.00 61.41 C ATOM 378 O ARG A 164 1.049 -4.582 -6.597 1.00 33.00 O ATOM 379 CB ARG A 164 2.359 -6.964 -4.664 1.00 30.14 C ATOM 380 CG ARG A 164 3.578 -6.190 -5.134 1.00 51.12 C ATOM 381 CD ARG A 164 4.857 -6.884 -4.681 1.00 14.32 C ATOM 382 NE ARG A 164 4.785 -8.338 -4.881 1.00 75.53 N ATOM 383 CZ ARG A 164 5.255 -9.038 -5.911 1.00 55.21 C ATOM 384 NH1 ARG A 164 5.927 -8.449 -6.890 1.00 24.41 N ATOM 385 NH2 ARG A 164 5.069 -10.344 -5.918 1.00 33.11 N ATOM 0 H ARG A 164 0.260 -8.210 -4.451 1.00 25.25 H new ATOM 0 HA ARG A 164 0.905 -5.457 -4.279 1.00 34.32 H new ATOM 0 HB2 ARG A 164 2.449 -7.125 -3.590 1.00 30.14 H new ATOM 0 HB3 ARG A 164 2.374 -7.946 -5.136 1.00 30.14 H new ATOM 0 HG2 ARG A 164 3.567 -6.108 -6.221 1.00 51.12 H new ATOM 0 HG3 ARG A 164 3.547 -5.175 -4.737 1.00 51.12 H new ATOM 0 HD2 ARG A 164 5.705 -6.482 -5.235 1.00 14.32 H new ATOM 0 HD3 ARG A 164 5.034 -6.670 -3.627 1.00 14.32 H new ATOM 0 HE ARG A 164 4.322 -8.872 -4.146 1.00 75.53 H new ATOM 0 HH11 ARG A 164 6.092 -7.443 -6.862 1.00 24.41 H new ATOM 0 HH12 ARG A 164 6.280 -9.002 -7.671 1.00 24.41 H new ATOM 0 HH21 ARG A 164 4.575 -10.793 -5.147 1.00 33.11 H new ATOM 0 HH22 ARG A 164 5.419 -10.905 -6.695 1.00 33.11 H new ATOM 399 N ALA A 165 0.555 -6.655 -7.294 1.00 3.45 N ATOM 400 CA ALA A 165 0.399 -6.271 -8.682 1.00 12.11 C ATOM 401 C ALA A 165 -0.808 -5.359 -8.846 1.00 0.41 C ATOM 402 O ALA A 165 -0.762 -4.369 -9.579 1.00 1.44 O ATOM 403 CB ALA A 165 0.274 -7.499 -9.567 1.00 71.24 C ATOM 0 H ALA A 165 0.383 -7.643 -7.109 1.00 3.45 H new ATOM 0 HA ALA A 165 1.288 -5.722 -8.992 1.00 12.11 H new ATOM 0 HB1 ALA A 165 0.158 -7.189 -10.605 1.00 71.24 H new ATOM 0 HB2 ALA A 165 1.171 -8.111 -9.469 1.00 71.24 H new ATOM 0 HB3 ALA A 165 -0.596 -8.080 -9.262 1.00 71.24 H new ATOM 409 N HIS A 166 -1.869 -5.676 -8.130 1.00 5.31 N ATOM 410 CA HIS A 166 -3.086 -4.902 -8.179 1.00 11.33 C ATOM 411 C HIS A 166 -2.844 -3.517 -7.567 1.00 71.15 C ATOM 412 O HIS A 166 -3.367 -2.518 -8.061 1.00 44.44 O ATOM 413 CB HIS A 166 -4.225 -5.653 -7.464 1.00 31.24 C ATOM 414 CG HIS A 166 -5.592 -5.082 -7.686 1.00 23.13 C ATOM 415 ND1 HIS A 166 -6.376 -5.380 -8.779 1.00 54.00 N ATOM 416 CD2 HIS A 166 -6.316 -4.227 -6.930 1.00 40.40 C ATOM 417 CE1 HIS A 166 -7.523 -4.719 -8.667 1.00 45.32 C ATOM 418 NE2 HIS A 166 -7.543 -3.991 -7.556 1.00 22.40 N ATOM 0 H HIS A 166 -1.908 -6.477 -7.500 1.00 5.31 H new ATOM 0 HA HIS A 166 -3.389 -4.762 -9.217 1.00 11.33 H new ATOM 0 HB2 HIS A 166 -4.222 -6.691 -7.797 1.00 31.24 H new ATOM 0 HB3 HIS A 166 -4.020 -5.661 -6.394 1.00 31.24 H new ATOM 0 HD1 HIS A 166 -6.119 -6.003 -9.545 1.00 54.00 H new ATOM 0 HD2 HIS A 166 -5.997 -3.795 -5.993 1.00 40.40 H new ATOM 0 HE1 HIS A 166 -8.330 -4.767 -9.383 1.00 45.32 H new ATOM 426 N ILE A 167 -2.020 -3.464 -6.513 1.00 74.53 N ATOM 427 CA ILE A 167 -1.637 -2.194 -5.893 1.00 53.41 C ATOM 428 C ILE A 167 -0.956 -1.311 -6.920 1.00 13.11 C ATOM 429 O ILE A 167 -1.317 -0.143 -7.078 1.00 32.05 O ATOM 430 CB ILE A 167 -0.685 -2.373 -4.653 1.00 63.22 C ATOM 431 CG1 ILE A 167 -1.389 -3.131 -3.523 1.00 33.34 C ATOM 432 CG2 ILE A 167 -0.177 -1.014 -4.143 1.00 30.44 C ATOM 433 CD1 ILE A 167 -0.516 -3.403 -2.308 1.00 31.14 C ATOM 0 H ILE A 167 -1.607 -4.287 -6.074 1.00 74.53 H new ATOM 0 HA ILE A 167 -2.555 -1.732 -5.531 1.00 53.41 H new ATOM 0 HB ILE A 167 0.173 -2.960 -4.981 1.00 63.22 H new ATOM 0 HG12 ILE A 167 -2.262 -2.559 -3.207 1.00 33.34 H new ATOM 0 HG13 ILE A 167 -1.754 -4.081 -3.912 1.00 33.34 H new ATOM 0 HG21 ILE A 167 0.478 -1.169 -3.286 1.00 30.44 H new ATOM 0 HG22 ILE A 167 0.376 -0.511 -4.936 1.00 30.44 H new ATOM 0 HG23 ILE A 167 -1.025 -0.397 -3.845 1.00 30.44 H new ATOM 0 HD11 ILE A 167 -1.094 -3.943 -1.558 1.00 31.14 H new ATOM 0 HD12 ILE A 167 0.344 -4.003 -2.605 1.00 31.14 H new ATOM 0 HD13 ILE A 167 -0.171 -2.458 -1.889 1.00 31.14 H new ATOM 445 N VAL A 168 -0.007 -1.883 -7.643 1.00 24.51 N ATOM 446 CA VAL A 168 0.734 -1.146 -8.662 1.00 12.25 C ATOM 447 C VAL A 168 -0.213 -0.638 -9.748 1.00 1.13 C ATOM 448 O VAL A 168 -0.128 0.509 -10.171 1.00 21.50 O ATOM 449 CB VAL A 168 1.881 -1.994 -9.298 1.00 31.54 C ATOM 450 CG1 VAL A 168 2.658 -1.186 -10.331 1.00 64.15 C ATOM 451 CG2 VAL A 168 2.829 -2.523 -8.231 1.00 51.02 C ATOM 0 H VAL A 168 0.272 -2.859 -7.545 1.00 24.51 H new ATOM 0 HA VAL A 168 1.201 -0.297 -8.163 1.00 12.25 H new ATOM 0 HB VAL A 168 1.416 -2.842 -9.801 1.00 31.54 H new ATOM 0 HG11 VAL A 168 3.449 -1.804 -10.756 1.00 64.15 H new ATOM 0 HG12 VAL A 168 1.983 -0.865 -11.124 1.00 64.15 H new ATOM 0 HG13 VAL A 168 3.098 -0.311 -9.853 1.00 64.15 H new ATOM 0 HG21 VAL A 168 3.617 -3.110 -8.703 1.00 51.02 H new ATOM 0 HG22 VAL A 168 3.273 -1.686 -7.692 1.00 51.02 H new ATOM 0 HG23 VAL A 168 2.277 -3.152 -7.533 1.00 51.02 H new ATOM 461 N GLN A 169 -1.145 -1.468 -10.147 1.00 42.12 N ATOM 462 CA GLN A 169 -2.110 -1.086 -11.170 1.00 31.43 C ATOM 463 C GLN A 169 -3.023 0.027 -10.690 1.00 23.32 C ATOM 464 O GLN A 169 -3.287 0.989 -11.423 1.00 45.25 O ATOM 465 CB GLN A 169 -2.930 -2.281 -11.629 1.00 25.05 C ATOM 466 CG GLN A 169 -2.125 -3.375 -12.300 1.00 53.21 C ATOM 467 CD GLN A 169 -2.958 -4.597 -12.662 1.00 50.21 C ATOM 468 OE1 GLN A 169 -2.450 -5.731 -12.668 1.00 14.43 O ATOM 469 NE2 GLN A 169 -4.210 -4.393 -13.000 1.00 74.25 N ATOM 0 H GLN A 169 -1.263 -2.414 -9.784 1.00 42.12 H new ATOM 0 HA GLN A 169 -1.541 -0.712 -12.021 1.00 31.43 H new ATOM 0 HB2 GLN A 169 -3.446 -2.704 -10.767 1.00 25.05 H new ATOM 0 HB3 GLN A 169 -3.697 -1.935 -12.322 1.00 25.05 H new ATOM 0 HG2 GLN A 169 -1.665 -2.976 -13.204 1.00 53.21 H new ATOM 0 HG3 GLN A 169 -1.315 -3.679 -11.638 1.00 53.21 H new ATOM 0 HE21 GLN A 169 -4.595 -3.449 -12.984 1.00 74.25 H new ATOM 0 HE22 GLN A 169 -4.798 -5.179 -13.279 1.00 74.25 H new ATOM 478 N ARG A 170 -3.470 -0.080 -9.463 1.00 63.33 N ATOM 479 CA ARG A 170 -4.363 0.902 -8.903 1.00 5.01 C ATOM 480 C ARG A 170 -3.672 2.221 -8.705 1.00 13.11 C ATOM 481 O ARG A 170 -4.232 3.257 -8.998 1.00 63.04 O ATOM 482 CB ARG A 170 -5.001 0.425 -7.597 1.00 33.21 C ATOM 483 CG ARG A 170 -6.011 -0.702 -7.738 1.00 75.04 C ATOM 484 CD ARG A 170 -7.216 -0.269 -8.554 1.00 75.23 C ATOM 485 NE ARG A 170 -8.251 -1.305 -8.610 1.00 33.43 N ATOM 486 CZ ARG A 170 -9.531 -1.091 -8.967 1.00 72.51 C ATOM 487 NH1 ARG A 170 -9.939 0.129 -9.304 1.00 74.23 N ATOM 488 NH2 ARG A 170 -10.393 -2.100 -9.004 1.00 13.25 N ATOM 0 H ARG A 170 -3.228 -0.843 -8.830 1.00 63.33 H new ATOM 0 HA ARG A 170 -5.166 1.042 -9.626 1.00 5.01 H new ATOM 0 HB2 ARG A 170 -4.209 0.098 -6.924 1.00 33.21 H new ATOM 0 HB3 ARG A 170 -5.493 1.274 -7.122 1.00 33.21 H new ATOM 0 HG2 ARG A 170 -5.537 -1.560 -8.214 1.00 75.04 H new ATOM 0 HG3 ARG A 170 -6.337 -1.026 -6.750 1.00 75.04 H new ATOM 0 HD2 ARG A 170 -7.637 0.639 -8.122 1.00 75.23 H new ATOM 0 HD3 ARG A 170 -6.897 -0.022 -9.567 1.00 75.23 H new ATOM 0 HE ARG A 170 -7.982 -2.257 -8.360 1.00 33.43 H new ATOM 0 HH11 ARG A 170 -9.281 0.908 -9.293 1.00 74.23 H new ATOM 0 HH12 ARG A 170 -10.910 0.286 -9.574 1.00 74.23 H new ATOM 0 HH21 ARG A 170 -10.086 -3.042 -8.761 1.00 13.25 H new ATOM 0 HH22 ARG A 170 -11.362 -1.933 -9.275 1.00 13.25 H new ATOM 502 N THR A 171 -2.457 2.184 -8.261 1.00 11.13 N ATOM 503 CA THR A 171 -1.735 3.391 -8.015 1.00 22.41 C ATOM 504 C THR A 171 -1.365 4.087 -9.324 1.00 64.43 C ATOM 505 O THR A 171 -1.552 5.311 -9.466 1.00 20.04 O ATOM 506 CB THR A 171 -0.503 3.118 -7.142 1.00 72.21 C ATOM 507 OG1 THR A 171 0.205 1.993 -7.666 1.00 1.02 O ATOM 508 CG2 THR A 171 -0.923 2.817 -5.715 1.00 71.25 C ATOM 0 H THR A 171 -1.942 1.327 -8.060 1.00 11.13 H new ATOM 0 HA THR A 171 -2.382 4.072 -7.463 1.00 22.41 H new ATOM 0 HB THR A 171 0.136 4.001 -7.147 1.00 72.21 H new ATOM 0 HG1 THR A 171 -0.130 1.172 -7.249 1.00 1.02 H new ATOM 0 HG21 THR A 171 -0.038 2.625 -5.108 1.00 71.25 H new ATOM 0 HG22 THR A 171 -1.465 3.670 -5.307 1.00 71.25 H new ATOM 0 HG23 THR A 171 -1.568 1.939 -5.703 1.00 71.25 H new ATOM 516 N SER A 172 -0.960 3.295 -10.317 1.00 12.45 N ATOM 517 CA SER A 172 -0.536 3.832 -11.587 1.00 44.33 C ATOM 518 C SER A 172 -1.704 4.475 -12.356 1.00 15.21 C ATOM 519 O SER A 172 -1.495 5.362 -13.201 1.00 20.31 O ATOM 520 CB SER A 172 0.155 2.752 -12.415 1.00 71.43 C ATOM 521 OG SER A 172 1.269 2.209 -11.708 1.00 41.11 O ATOM 0 H SER A 172 -0.921 2.278 -10.255 1.00 12.45 H new ATOM 0 HA SER A 172 0.184 4.627 -11.393 1.00 44.33 H new ATOM 0 HB2 SER A 172 -0.554 1.958 -12.651 1.00 71.43 H new ATOM 0 HB3 SER A 172 0.490 3.172 -13.363 1.00 71.43 H new ATOM 0 HG SER A 172 0.954 1.538 -11.067 1.00 41.11 H new ATOM 527 N SER A 173 -2.916 4.044 -12.083 1.00 24.31 N ATOM 528 CA SER A 173 -4.045 4.651 -12.716 1.00 0.43 C ATOM 529 C SER A 173 -4.718 5.726 -11.835 1.00 32.24 C ATOM 530 O SER A 173 -5.142 6.784 -12.334 1.00 3.33 O ATOM 531 CB SER A 173 -5.042 3.580 -13.112 1.00 42.34 C ATOM 532 OG SER A 173 -4.416 2.604 -13.938 1.00 43.20 O ATOM 0 H SER A 173 -3.134 3.287 -11.436 1.00 24.31 H new ATOM 0 HA SER A 173 -3.685 5.166 -13.607 1.00 0.43 H new ATOM 0 HB2 SER A 173 -5.449 3.104 -12.220 1.00 42.34 H new ATOM 0 HB3 SER A 173 -5.880 4.032 -13.643 1.00 42.34 H new ATOM 0 HG SER A 173 -3.949 1.951 -13.376 1.00 43.20 H new ATOM 538 N ASN A 174 -4.758 5.500 -10.535 1.00 63.10 N ATOM 539 CA ASN A 174 -5.566 6.327 -9.655 1.00 62.21 C ATOM 540 C ASN A 174 -4.800 7.418 -8.911 1.00 72.53 C ATOM 541 O ASN A 174 -5.192 7.810 -7.814 1.00 62.11 O ATOM 542 CB ASN A 174 -6.418 5.479 -8.695 1.00 31.14 C ATOM 543 CG ASN A 174 -7.458 4.600 -9.404 1.00 52.02 C ATOM 544 OD1 ASN A 174 -7.253 4.116 -10.520 1.00 34.02 O ATOM 545 ND2 ASN A 174 -8.576 4.399 -8.772 1.00 61.10 N ATOM 0 H ASN A 174 -4.244 4.755 -10.066 1.00 63.10 H new ATOM 0 HA ASN A 174 -6.235 6.866 -10.326 1.00 62.21 H new ATOM 0 HB2 ASN A 174 -5.759 4.842 -8.105 1.00 31.14 H new ATOM 0 HB3 ASN A 174 -6.930 6.141 -7.997 1.00 31.14 H new ATOM 0 HD21 ASN A 174 -9.308 3.830 -9.198 1.00 61.10 H new ATOM 0 HD22 ASN A 174 -8.722 4.810 -7.850 1.00 61.10 H new ATOM 552 N ASP A 175 -3.727 7.910 -9.532 1.00 31.20 N ATOM 553 CA ASP A 175 -2.993 9.140 -9.083 1.00 70.35 C ATOM 554 C ASP A 175 -2.101 8.946 -7.868 1.00 13.44 C ATOM 555 O ASP A 175 -1.739 9.925 -7.196 1.00 64.53 O ATOM 556 CB ASP A 175 -3.945 10.338 -8.818 1.00 45.40 C ATOM 557 CG ASP A 175 -4.755 10.757 -10.010 1.00 51.13 C ATOM 558 OD1 ASP A 175 -4.178 11.016 -11.085 1.00 65.41 O ATOM 559 OD2 ASP A 175 -6.007 10.883 -9.886 1.00 25.01 O ATOM 0 H ASP A 175 -3.325 7.480 -10.365 1.00 31.20 H new ATOM 0 HA ASP A 175 -2.343 9.362 -9.930 1.00 70.35 H new ATOM 0 HB2 ASP A 175 -4.623 10.076 -8.006 1.00 45.40 H new ATOM 0 HB3 ASP A 175 -3.354 11.188 -8.477 1.00 45.40 H new ATOM 564 N ILE A 176 -1.681 7.747 -7.607 1.00 42.15 N ATOM 565 CA ILE A 176 -0.801 7.515 -6.477 1.00 35.31 C ATOM 566 C ILE A 176 0.557 6.965 -6.970 1.00 41.44 C ATOM 567 O ILE A 176 0.605 6.136 -7.862 1.00 21.32 O ATOM 568 CB ILE A 176 -1.453 6.550 -5.442 1.00 64.25 C ATOM 569 CG1 ILE A 176 -2.799 7.124 -4.954 1.00 24.32 C ATOM 570 CG2 ILE A 176 -0.525 6.311 -4.266 1.00 55.33 C ATOM 571 CD1 ILE A 176 -3.475 6.310 -3.870 1.00 13.20 C ATOM 0 H ILE A 176 -1.923 6.916 -8.146 1.00 42.15 H new ATOM 0 HA ILE A 176 -0.630 8.466 -5.972 1.00 35.31 H new ATOM 0 HB ILE A 176 -1.634 5.593 -5.932 1.00 64.25 H new ATOM 0 HG12 ILE A 176 -2.634 8.135 -4.582 1.00 24.32 H new ATOM 0 HG13 ILE A 176 -3.475 7.204 -5.805 1.00 24.32 H new ATOM 0 HG21 ILE A 176 -1.003 5.634 -3.557 1.00 55.33 H new ATOM 0 HG22 ILE A 176 0.405 5.867 -4.621 1.00 55.33 H new ATOM 0 HG23 ILE A 176 -0.310 7.259 -3.774 1.00 55.33 H new ATOM 0 HD11 ILE A 176 -4.414 6.787 -3.588 1.00 13.20 H new ATOM 0 HD12 ILE A 176 -3.676 5.305 -4.242 1.00 13.20 H new ATOM 0 HD13 ILE A 176 -2.822 6.251 -2.999 1.00 13.20 H new ATOM 583 N THR A 177 1.633 7.472 -6.427 1.00 52.22 N ATOM 584 CA THR A 177 2.973 7.041 -6.784 1.00 33.31 C ATOM 585 C THR A 177 3.466 6.081 -5.686 1.00 10.45 C ATOM 586 O THR A 177 3.037 6.194 -4.552 1.00 31.54 O ATOM 587 CB THR A 177 3.906 8.273 -6.875 1.00 53.35 C ATOM 588 OG1 THR A 177 3.268 9.282 -7.669 1.00 0.44 O ATOM 589 CG2 THR A 177 5.238 7.916 -7.524 1.00 4.11 C ATOM 0 H THR A 177 1.611 8.204 -5.717 1.00 52.22 H new ATOM 0 HA THR A 177 2.973 6.537 -7.751 1.00 33.31 H new ATOM 0 HB THR A 177 4.097 8.631 -5.863 1.00 53.35 H new ATOM 0 HG1 THR A 177 3.851 10.067 -7.731 1.00 0.44 H new ATOM 0 HG21 THR A 177 5.869 8.804 -7.572 1.00 4.11 H new ATOM 0 HG22 THR A 177 5.737 7.148 -6.933 1.00 4.11 H new ATOM 0 HG23 THR A 177 5.062 7.541 -8.532 1.00 4.11 H new ATOM 597 N LEU A 178 4.288 5.124 -6.012 1.00 52.45 N ATOM 598 CA LEU A 178 4.762 4.182 -5.014 1.00 2.05 C ATOM 599 C LEU A 178 6.109 4.642 -4.473 1.00 61.11 C ATOM 600 O LEU A 178 6.966 5.085 -5.231 1.00 3.24 O ATOM 601 CB LEU A 178 4.904 2.748 -5.581 1.00 21.31 C ATOM 602 CG LEU A 178 3.658 2.084 -6.205 1.00 71.31 C ATOM 603 CD1 LEU A 178 3.349 2.638 -7.594 1.00 44.12 C ATOM 604 CD2 LEU A 178 3.837 0.583 -6.262 1.00 72.11 C ATOM 0 H LEU A 178 4.648 4.968 -6.954 1.00 52.45 H new ATOM 0 HA LEU A 178 4.020 4.154 -4.216 1.00 2.05 H new ATOM 0 HB2 LEU A 178 5.687 2.766 -6.339 1.00 21.31 H new ATOM 0 HB3 LEU A 178 5.256 2.104 -4.775 1.00 21.31 H new ATOM 0 HG LEU A 178 2.807 2.319 -5.566 1.00 71.31 H new ATOM 0 HD11 LEU A 178 2.465 2.142 -7.995 1.00 44.12 H new ATOM 0 HD12 LEU A 178 3.164 3.710 -7.525 1.00 44.12 H new ATOM 0 HD13 LEU A 178 4.197 2.458 -8.255 1.00 44.12 H new ATOM 0 HD21 LEU A 178 2.951 0.127 -6.704 1.00 72.11 H new ATOM 0 HD22 LEU A 178 4.710 0.343 -6.869 1.00 72.11 H new ATOM 0 HD23 LEU A 178 3.979 0.195 -5.253 1.00 72.11 H new ATOM 616 N ARG A 179 6.277 4.574 -3.172 1.00 61.20 N ATOM 617 CA ARG A 179 7.536 4.937 -2.545 1.00 61.34 C ATOM 618 C ARG A 179 8.340 3.662 -2.369 1.00 13.24 C ATOM 619 O ARG A 179 9.568 3.645 -2.514 1.00 15.24 O ATOM 620 CB ARG A 179 7.290 5.596 -1.178 1.00 42.23 C ATOM 621 CG ARG A 179 8.461 6.405 -0.620 1.00 30.33 C ATOM 622 CD ARG A 179 8.152 6.883 0.795 1.00 71.23 C ATOM 623 NE ARG A 179 9.050 7.959 1.259 1.00 64.41 N ATOM 624 CZ ARG A 179 9.696 7.992 2.439 1.00 55.34 C ATOM 625 NH1 ARG A 179 9.831 6.885 3.178 1.00 2.42 N ATOM 626 NH2 ARG A 179 10.256 9.124 2.840 1.00 74.32 N ATOM 0 H ARG A 179 5.554 4.269 -2.520 1.00 61.20 H new ATOM 0 HA ARG A 179 8.074 5.653 -3.166 1.00 61.34 H new ATOM 0 HB2 ARG A 179 6.424 6.252 -1.261 1.00 42.23 H new ATOM 0 HB3 ARG A 179 7.033 4.818 -0.459 1.00 42.23 H new ATOM 0 HG2 ARG A 179 9.364 5.794 -0.615 1.00 30.33 H new ATOM 0 HG3 ARG A 179 8.659 7.261 -1.265 1.00 30.33 H new ATOM 0 HD2 ARG A 179 7.122 7.237 0.834 1.00 71.23 H new ATOM 0 HD3 ARG A 179 8.225 6.038 1.480 1.00 71.23 H new ATOM 0 HE ARG A 179 9.194 8.748 0.629 1.00 64.41 H new ATOM 0 HH11 ARG A 179 9.442 6.001 2.849 1.00 2.42 H new ATOM 0 HH12 ARG A 179 10.323 6.925 4.071 1.00 2.42 H new ATOM 0 HH21 ARG A 179 10.195 9.958 2.256 1.00 74.32 H new ATOM 0 HH22 ARG A 179 10.748 9.161 3.733 1.00 74.32 H new ATOM 640 N GLY A 180 7.626 2.604 -2.059 1.00 42.33 N ATOM 641 CA GLY A 180 8.203 1.296 -1.913 1.00 63.30 C ATOM 642 C GLY A 180 7.200 0.343 -1.334 1.00 22.02 C ATOM 643 O GLY A 180 6.161 0.772 -0.823 1.00 34.13 O ATOM 0 H GLY A 180 6.619 2.632 -1.900 1.00 42.33 H new ATOM 0 HA2 GLY A 180 8.543 0.931 -2.882 1.00 63.30 H new ATOM 0 HA3 GLY A 180 9.079 1.348 -1.267 1.00 63.30 H new ATOM 647 N ILE A 181 7.490 -0.923 -1.408 1.00 53.51 N ATOM 648 CA ILE A 181 6.615 -1.953 -0.893 1.00 21.01 C ATOM 649 C ILE A 181 7.436 -2.942 -0.087 1.00 32.31 C ATOM 650 O ILE A 181 8.366 -3.576 -0.605 1.00 73.32 O ATOM 651 CB ILE A 181 5.831 -2.720 -2.018 1.00 62.33 C ATOM 652 CG1 ILE A 181 4.931 -1.758 -2.820 1.00 41.03 C ATOM 653 CG2 ILE A 181 4.986 -3.857 -1.415 1.00 45.21 C ATOM 654 CD1 ILE A 181 4.159 -2.422 -3.949 1.00 70.30 C ATOM 0 H ILE A 181 8.347 -1.280 -1.830 1.00 53.51 H new ATOM 0 HA ILE A 181 5.869 -1.460 -0.270 1.00 21.01 H new ATOM 0 HB ILE A 181 6.564 -3.152 -2.699 1.00 62.33 H new ATOM 0 HG12 ILE A 181 4.223 -1.288 -2.138 1.00 41.03 H new ATOM 0 HG13 ILE A 181 5.549 -0.962 -3.236 1.00 41.03 H new ATOM 0 HG21 ILE A 181 4.452 -4.375 -2.211 1.00 45.21 H new ATOM 0 HG22 ILE A 181 5.639 -4.561 -0.899 1.00 45.21 H new ATOM 0 HG23 ILE A 181 4.269 -3.441 -0.707 1.00 45.21 H new ATOM 0 HD11 ILE A 181 3.551 -1.676 -4.462 1.00 70.30 H new ATOM 0 HD12 ILE A 181 4.859 -2.868 -4.655 1.00 70.30 H new ATOM 0 HD13 ILE A 181 3.512 -3.198 -3.540 1.00 70.30 H new ATOM 666 N ARG A 182 7.119 -3.048 1.153 1.00 22.52 N ATOM 667 CA ARG A 182 7.770 -3.961 2.039 1.00 2.43 C ATOM 668 C ARG A 182 6.813 -5.105 2.303 1.00 33.21 C ATOM 669 O ARG A 182 5.626 -4.883 2.437 1.00 74.51 O ATOM 670 CB ARG A 182 8.144 -3.230 3.334 1.00 5.12 C ATOM 671 CG ARG A 182 8.795 -4.095 4.389 1.00 3.11 C ATOM 672 CD ARG A 182 9.160 -3.286 5.616 1.00 54.34 C ATOM 673 NE ARG A 182 9.700 -4.140 6.668 1.00 24.02 N ATOM 674 CZ ARG A 182 10.094 -3.734 7.876 1.00 24.12 C ATOM 675 NH1 ARG A 182 10.148 -2.430 8.180 1.00 5.51 N ATOM 676 NH2 ARG A 182 10.480 -4.639 8.766 1.00 2.14 N ATOM 0 H ARG A 182 6.386 -2.494 1.595 1.00 22.52 H new ATOM 0 HA ARG A 182 8.689 -4.354 1.604 1.00 2.43 H new ATOM 0 HB2 ARG A 182 8.820 -2.411 3.089 1.00 5.12 H new ATOM 0 HB3 ARG A 182 7.243 -2.785 3.756 1.00 5.12 H new ATOM 0 HG2 ARG A 182 8.117 -4.901 4.671 1.00 3.11 H new ATOM 0 HG3 ARG A 182 9.691 -4.561 3.978 1.00 3.11 H new ATOM 0 HD2 ARG A 182 9.894 -2.525 5.349 1.00 54.34 H new ATOM 0 HD3 ARG A 182 8.278 -2.762 5.985 1.00 54.34 H new ATOM 0 HE ARG A 182 9.784 -5.135 6.462 1.00 24.02 H new ATOM 0 HH11 ARG A 182 9.886 -1.733 7.483 1.00 5.51 H new ATOM 0 HH12 ARG A 182 10.451 -2.135 9.108 1.00 5.51 H new ATOM 0 HH21 ARG A 182 10.473 -5.629 8.522 1.00 2.14 H new ATOM 0 HH22 ARG A 182 10.784 -4.344 9.694 1.00 2.14 H new ATOM 690 N THR A 183 7.294 -6.301 2.325 1.00 4.20 N ATOM 691 CA THR A 183 6.451 -7.421 2.575 1.00 34.21 C ATOM 692 C THR A 183 7.133 -8.364 3.567 1.00 63.43 C ATOM 693 O THR A 183 8.343 -8.592 3.492 1.00 70.13 O ATOM 694 CB THR A 183 6.045 -8.141 1.241 1.00 40.34 C ATOM 695 OG1 THR A 183 5.138 -9.211 1.497 1.00 61.44 O ATOM 696 CG2 THR A 183 7.257 -8.670 0.478 1.00 14.22 C ATOM 0 H THR A 183 8.276 -6.530 2.171 1.00 4.20 H new ATOM 0 HA THR A 183 5.520 -7.076 3.025 1.00 34.21 H new ATOM 0 HB THR A 183 5.556 -7.392 0.619 1.00 40.34 H new ATOM 0 HG1 THR A 183 5.257 -9.910 0.820 1.00 61.44 H new ATOM 0 HG21 THR A 183 6.925 -9.160 -0.437 1.00 14.22 H new ATOM 0 HG22 THR A 183 7.919 -7.841 0.227 1.00 14.22 H new ATOM 0 HG23 THR A 183 7.793 -9.387 1.099 1.00 14.22 H new ATOM 704 N GLY A 184 6.386 -8.829 4.540 1.00 10.14 N ATOM 705 CA GLY A 184 6.935 -9.704 5.533 1.00 41.12 C ATOM 706 C GLY A 184 5.922 -10.717 6.001 1.00 1.23 C ATOM 707 O GLY A 184 4.731 -10.391 6.109 1.00 21.51 O ATOM 0 H GLY A 184 5.397 -8.613 4.660 1.00 10.14 H new ATOM 0 HA2 GLY A 184 7.804 -10.220 5.124 1.00 41.12 H new ATOM 0 HA3 GLY A 184 7.283 -9.117 6.383 1.00 41.12 H new ATOM 711 N PRO A 185 6.345 -11.967 6.261 1.00 44.42 N ATOM 712 CA PRO A 185 5.456 -13.026 6.746 1.00 74.12 C ATOM 713 C PRO A 185 4.843 -12.653 8.102 1.00 54.32 C ATOM 714 O PRO A 185 5.544 -12.203 9.012 1.00 44.44 O ATOM 715 CB PRO A 185 6.391 -14.245 6.875 1.00 11.31 C ATOM 716 CG PRO A 185 7.748 -13.662 6.981 1.00 13.14 C ATOM 717 CD PRO A 185 7.732 -12.450 6.108 1.00 13.30 C ATOM 0 HA PRO A 185 4.610 -13.208 6.084 1.00 74.12 H new ATOM 0 HB2 PRO A 185 6.146 -14.842 7.753 1.00 11.31 H new ATOM 0 HB3 PRO A 185 6.308 -14.902 6.009 1.00 11.31 H new ATOM 0 HG2 PRO A 185 7.983 -13.399 8.013 1.00 13.14 H new ATOM 0 HG3 PRO A 185 8.507 -14.372 6.652 1.00 13.14 H new ATOM 0 HD2 PRO A 185 8.459 -11.706 6.433 1.00 13.30 H new ATOM 0 HD3 PRO A 185 7.966 -12.693 5.071 1.00 13.30 H new ATOM 725 N ALA A 186 3.546 -12.850 8.229 1.00 65.11 N ATOM 726 CA ALA A 186 2.821 -12.457 9.429 1.00 13.05 C ATOM 727 C ALA A 186 2.635 -13.632 10.373 1.00 64.42 C ATOM 728 O ALA A 186 1.859 -13.562 11.325 1.00 4.55 O ATOM 729 CB ALA A 186 1.479 -11.851 9.057 1.00 71.15 C ATOM 0 H ALA A 186 2.965 -13.283 7.511 1.00 65.11 H new ATOM 0 HA ALA A 186 3.413 -11.705 9.951 1.00 13.05 H new ATOM 0 HB1 ALA A 186 0.947 -11.561 9.963 1.00 71.15 H new ATOM 0 HB2 ALA A 186 1.637 -10.972 8.432 1.00 71.15 H new ATOM 0 HB3 ALA A 186 0.888 -12.584 8.508 1.00 71.15 H new ATOM 735 N GLY A 187 3.306 -14.703 10.091 1.00 73.42 N ATOM 736 CA GLY A 187 3.285 -15.810 10.956 1.00 52.42 C ATOM 737 C GLY A 187 2.798 -17.031 10.298 1.00 13.11 C ATOM 738 O GLY A 187 3.462 -17.557 9.404 1.00 3.24 O ATOM 0 H GLY A 187 3.878 -14.822 9.255 1.00 73.42 H new ATOM 0 HA2 GLY A 187 4.290 -15.985 11.341 1.00 52.42 H new ATOM 0 HA3 GLY A 187 2.650 -15.585 11.813 1.00 52.42 H new ATOM 742 N ASP A 188 1.619 -17.436 10.702 1.00 53.23 N ATOM 743 CA ASP A 188 0.968 -18.667 10.267 1.00 52.53 C ATOM 744 C ASP A 188 0.932 -18.837 8.761 1.00 12.11 C ATOM 745 O ASP A 188 1.793 -19.521 8.181 1.00 22.10 O ATOM 746 CB ASP A 188 -0.434 -18.826 10.921 1.00 43.12 C ATOM 747 CG ASP A 188 -1.420 -17.699 10.646 1.00 45.44 C ATOM 748 OD1 ASP A 188 -1.430 -16.701 11.390 1.00 62.00 O ATOM 749 OD2 ASP A 188 -2.186 -17.787 9.677 1.00 51.45 O ATOM 0 H ASP A 188 1.058 -16.904 11.368 1.00 53.23 H new ATOM 0 HA ASP A 188 1.592 -19.486 10.625 1.00 52.53 H new ATOM 0 HB2 ASP A 188 -0.873 -19.761 10.574 1.00 43.12 H new ATOM 0 HB3 ASP A 188 -0.304 -18.916 11.999 1.00 43.12 H new ATOM 754 N ASP A 189 -0.003 -18.231 8.134 1.00 43.45 N ATOM 755 CA ASP A 189 -0.115 -18.309 6.724 1.00 11.12 C ATOM 756 C ASP A 189 -0.706 -17.034 6.205 1.00 41.43 C ATOM 757 O ASP A 189 -1.519 -17.003 5.295 1.00 24.41 O ATOM 758 CB ASP A 189 -0.891 -19.547 6.288 1.00 34.11 C ATOM 759 CG ASP A 189 -0.681 -19.868 4.826 1.00 61.54 C ATOM 760 OD1 ASP A 189 0.492 -19.866 4.365 1.00 31.23 O ATOM 761 OD2 ASP A 189 -1.675 -20.150 4.114 1.00 0.54 O ATOM 0 H ASP A 189 -0.719 -17.662 8.585 1.00 43.45 H new ATOM 0 HA ASP A 189 0.877 -18.422 6.287 1.00 11.12 H new ATOM 0 HB2 ASP A 189 -0.582 -20.399 6.893 1.00 34.11 H new ATOM 0 HB3 ASP A 189 -1.954 -19.392 6.475 1.00 34.11 H new ATOM 766 N ASN A 190 -0.284 -15.963 6.818 1.00 72.14 N ATOM 767 CA ASN A 190 -0.602 -14.642 6.351 1.00 51.33 C ATOM 768 C ASN A 190 0.705 -13.916 6.125 1.00 21.04 C ATOM 769 O ASN A 190 1.744 -14.308 6.683 1.00 50.25 O ATOM 770 CB ASN A 190 -1.478 -13.814 7.328 1.00 74.21 C ATOM 771 CG ASN A 190 -2.070 -14.607 8.454 1.00 32.33 C ATOM 772 OD1 ASN A 190 -3.156 -15.139 8.342 1.00 15.13 O ATOM 773 ND2 ASN A 190 -1.372 -14.662 9.565 1.00 22.25 N ATOM 0 H ASN A 190 0.293 -15.982 7.659 1.00 72.14 H new ATOM 0 HA ASN A 190 -1.191 -14.749 5.440 1.00 51.33 H new ATOM 0 HB2 ASN A 190 -0.873 -13.009 7.746 1.00 74.21 H new ATOM 0 HB3 ASN A 190 -2.286 -13.347 6.765 1.00 74.21 H new ATOM 0 HD21 ASN A 190 -1.739 -15.165 10.373 1.00 22.25 H new ATOM 0 HD22 ASN A 190 -0.463 -14.202 9.620 1.00 22.25 H new ATOM 780 N ILE A 191 0.677 -12.911 5.320 1.00 75.22 N ATOM 781 CA ILE A 191 1.820 -12.094 5.029 1.00 61.24 C ATOM 782 C ILE A 191 1.336 -10.642 5.006 1.00 75.01 C ATOM 783 O ILE A 191 0.194 -10.376 4.618 1.00 43.13 O ATOM 784 CB ILE A 191 2.468 -12.521 3.660 1.00 42.03 C ATOM 785 CG1 ILE A 191 3.789 -11.793 3.401 1.00 3.34 C ATOM 786 CG2 ILE A 191 1.507 -12.294 2.496 1.00 62.25 C ATOM 787 CD1 ILE A 191 4.549 -12.315 2.195 1.00 51.05 C ATOM 0 H ILE A 191 -0.167 -12.620 4.826 1.00 75.22 H new ATOM 0 HA ILE A 191 2.596 -12.213 5.785 1.00 61.24 H new ATOM 0 HB ILE A 191 2.680 -13.588 3.734 1.00 42.03 H new ATOM 0 HG12 ILE A 191 3.587 -10.731 3.260 1.00 3.34 H new ATOM 0 HG13 ILE A 191 4.422 -11.882 4.284 1.00 3.34 H new ATOM 0 HG21 ILE A 191 1.985 -12.599 1.565 1.00 62.25 H new ATOM 0 HG22 ILE A 191 0.603 -12.884 2.650 1.00 62.25 H new ATOM 0 HG23 ILE A 191 1.246 -11.237 2.441 1.00 62.25 H new ATOM 0 HD11 ILE A 191 5.474 -11.750 2.075 1.00 51.05 H new ATOM 0 HD12 ILE A 191 4.784 -13.369 2.341 1.00 51.05 H new ATOM 0 HD13 ILE A 191 3.936 -12.201 1.301 1.00 51.05 H new ATOM 799 N THR A 192 2.128 -9.734 5.485 1.00 35.30 N ATOM 800 CA THR A 192 1.717 -8.362 5.529 1.00 71.12 C ATOM 801 C THR A 192 2.564 -7.523 4.607 1.00 22.33 C ATOM 802 O THR A 192 3.802 -7.561 4.664 1.00 4.54 O ATOM 803 CB THR A 192 1.786 -7.802 6.961 1.00 31.34 C ATOM 804 OG1 THR A 192 1.058 -8.679 7.829 1.00 71.41 O ATOM 805 CG2 THR A 192 1.166 -6.408 7.025 1.00 2.42 C ATOM 0 H THR A 192 3.062 -9.916 5.851 1.00 35.30 H new ATOM 0 HA THR A 192 0.680 -8.319 5.195 1.00 71.12 H new ATOM 0 HB THR A 192 2.829 -7.733 7.269 1.00 31.34 H new ATOM 0 HG1 THR A 192 1.094 -8.336 8.746 1.00 71.41 H new ATOM 0 HG21 THR A 192 1.225 -6.030 8.046 1.00 2.42 H new ATOM 0 HG22 THR A 192 1.708 -5.738 6.358 1.00 2.42 H new ATOM 0 HG23 THR A 192 0.122 -6.460 6.717 1.00 2.42 H new ATOM 813 N LEU A 193 1.911 -6.807 3.754 1.00 2.32 N ATOM 814 CA LEU A 193 2.569 -5.901 2.855 1.00 51.22 C ATOM 815 C LEU A 193 2.405 -4.508 3.387 1.00 53.55 C ATOM 816 O LEU A 193 1.305 -4.118 3.758 1.00 33.30 O ATOM 817 CB LEU A 193 1.985 -5.933 1.422 1.00 5.14 C ATOM 818 CG LEU A 193 2.130 -7.209 0.575 1.00 32.03 C ATOM 819 CD1 LEU A 193 1.342 -8.373 1.150 1.00 22.54 C ATOM 820 CD2 LEU A 193 1.689 -6.926 -0.853 1.00 34.11 C ATOM 0 H LEU A 193 0.896 -6.830 3.655 1.00 2.32 H new ATOM 0 HA LEU A 193 3.613 -6.207 2.794 1.00 51.22 H new ATOM 0 HB2 LEU A 193 0.921 -5.710 1.498 1.00 5.14 H new ATOM 0 HB3 LEU A 193 2.443 -5.116 0.864 1.00 5.14 H new ATOM 0 HG LEU A 193 3.181 -7.499 0.586 1.00 32.03 H new ATOM 0 HD11 LEU A 193 1.476 -9.251 0.518 1.00 22.54 H new ATOM 0 HD12 LEU A 193 1.699 -8.593 2.156 1.00 22.54 H new ATOM 0 HD13 LEU A 193 0.284 -8.112 1.190 1.00 22.54 H new ATOM 0 HD21 LEU A 193 1.792 -7.831 -1.452 1.00 34.11 H new ATOM 0 HD22 LEU A 193 0.647 -6.606 -0.855 1.00 34.11 H new ATOM 0 HD23 LEU A 193 2.311 -6.138 -1.277 1.00 34.11 H new ATOM 832 N THR A 194 3.468 -3.793 3.463 1.00 5.31 N ATOM 833 CA THR A 194 3.422 -2.427 3.814 1.00 5.34 C ATOM 834 C THR A 194 3.735 -1.667 2.542 1.00 52.31 C ATOM 835 O THR A 194 4.879 -1.675 2.057 1.00 60.01 O ATOM 836 CB THR A 194 4.481 -2.093 4.879 1.00 72.44 C ATOM 837 OG1 THR A 194 4.407 -3.059 5.938 1.00 42.02 O ATOM 838 CG2 THR A 194 4.249 -0.699 5.454 1.00 22.03 C ATOM 0 H THR A 194 4.406 -4.148 3.280 1.00 5.31 H new ATOM 0 HA THR A 194 2.449 -2.166 4.230 1.00 5.34 H new ATOM 0 HB THR A 194 5.466 -2.119 4.412 1.00 72.44 H new ATOM 0 HG1 THR A 194 5.312 -3.329 6.198 1.00 42.02 H new ATOM 0 HG21 THR A 194 5.009 -0.484 6.205 1.00 22.03 H new ATOM 0 HG22 THR A 194 4.310 0.039 4.654 1.00 22.03 H new ATOM 0 HG23 THR A 194 3.262 -0.655 5.914 1.00 22.03 H new ATOM 846 N ALA A 195 2.739 -1.091 1.973 1.00 63.20 N ATOM 847 CA ALA A 195 2.899 -0.347 0.765 1.00 73.43 C ATOM 848 C ALA A 195 3.008 1.107 1.107 1.00 64.42 C ATOM 849 O ALA A 195 2.091 1.681 1.691 1.00 72.15 O ATOM 850 CB ALA A 195 1.734 -0.598 -0.182 1.00 15.55 C ATOM 0 H ALA A 195 1.784 -1.119 2.329 1.00 63.20 H new ATOM 0 HA ALA A 195 3.807 -0.668 0.255 1.00 73.43 H new ATOM 0 HB1 ALA A 195 1.877 -0.021 -1.096 1.00 15.55 H new ATOM 0 HB2 ALA A 195 1.686 -1.659 -0.427 1.00 15.55 H new ATOM 0 HB3 ALA A 195 0.803 -0.294 0.297 1.00 15.55 H new ATOM 856 N HIS A 196 4.124 1.687 0.798 1.00 65.23 N ATOM 857 CA HIS A 196 4.339 3.070 1.060 1.00 53.24 C ATOM 858 C HIS A 196 4.016 3.794 -0.211 1.00 24.20 C ATOM 859 O HIS A 196 4.700 3.624 -1.221 1.00 3.11 O ATOM 860 CB HIS A 196 5.789 3.342 1.485 1.00 1.42 C ATOM 861 CG HIS A 196 6.236 2.598 2.718 1.00 52.44 C ATOM 862 ND1 HIS A 196 6.300 3.146 3.986 1.00 50.52 N ATOM 863 CD2 HIS A 196 6.691 1.330 2.844 1.00 31.24 C ATOM 864 CE1 HIS A 196 6.786 2.217 4.814 1.00 54.31 C ATOM 865 NE2 HIS A 196 7.042 1.092 4.167 1.00 52.23 N ATOM 0 H HIS A 196 4.911 1.212 0.356 1.00 65.23 H new ATOM 0 HA HIS A 196 3.710 3.408 1.883 1.00 53.24 H new ATOM 0 HB2 HIS A 196 6.450 3.079 0.659 1.00 1.42 H new ATOM 0 HB3 HIS A 196 5.907 4.411 1.660 1.00 1.42 H new ATOM 0 HD2 HIS A 196 6.769 0.613 2.040 1.00 31.24 H new ATOM 0 HE1 HIS A 196 6.948 2.365 5.871 1.00 54.31 H new ATOM 0 HE2 HIS A 196 7.419 0.229 4.558 1.00 52.23 H new ATOM 873 N LEU A 197 2.978 4.539 -0.184 1.00 31.30 N ATOM 874 CA LEU A 197 2.472 5.191 -1.354 1.00 53.25 C ATOM 875 C LEU A 197 2.540 6.691 -1.178 1.00 30.32 C ATOM 876 O LEU A 197 2.501 7.183 -0.081 1.00 3.43 O ATOM 877 CB LEU A 197 1.028 4.751 -1.578 1.00 43.04 C ATOM 878 CG LEU A 197 0.789 3.238 -1.730 1.00 55.45 C ATOM 879 CD1 LEU A 197 -0.687 2.942 -1.928 1.00 61.30 C ATOM 880 CD2 LEU A 197 1.613 2.667 -2.881 1.00 11.42 C ATOM 0 H LEU A 197 2.438 4.724 0.661 1.00 31.30 H new ATOM 0 HA LEU A 197 3.075 4.918 -2.220 1.00 53.25 H new ATOM 0 HB2 LEU A 197 0.428 5.109 -0.741 1.00 43.04 H new ATOM 0 HB3 LEU A 197 0.655 5.247 -2.474 1.00 43.04 H new ATOM 0 HG LEU A 197 1.114 2.753 -0.809 1.00 55.45 H new ATOM 0 HD11 LEU A 197 -0.832 1.867 -2.033 1.00 61.30 H new ATOM 0 HD12 LEU A 197 -1.249 3.301 -1.066 1.00 61.30 H new ATOM 0 HD13 LEU A 197 -1.042 3.445 -2.827 1.00 61.30 H new ATOM 0 HD21 LEU A 197 1.426 1.597 -2.967 1.00 11.42 H new ATOM 0 HD22 LEU A 197 1.330 3.160 -3.811 1.00 11.42 H new ATOM 0 HD23 LEU A 197 2.673 2.836 -2.689 1.00 11.42 H new ATOM 892 N LEU A 198 2.667 7.385 -2.249 1.00 43.34 N ATOM 893 CA LEU A 198 2.739 8.819 -2.255 1.00 0.03 C ATOM 894 C LEU A 198 1.552 9.351 -3.046 1.00 52.32 C ATOM 895 O LEU A 198 1.446 9.104 -4.250 1.00 42.33 O ATOM 896 CB LEU A 198 4.031 9.261 -2.954 1.00 61.01 C ATOM 897 CG LEU A 198 5.353 8.847 -2.321 1.00 41.05 C ATOM 898 CD1 LEU A 198 6.487 9.118 -3.288 1.00 54.14 C ATOM 899 CD2 LEU A 198 5.590 9.617 -1.038 1.00 33.22 C ATOM 0 H LEU A 198 2.726 6.969 -3.178 1.00 43.34 H new ATOM 0 HA LEU A 198 2.726 9.199 -1.233 1.00 0.03 H new ATOM 0 HB2 LEU A 198 4.011 8.874 -3.973 1.00 61.01 H new ATOM 0 HB3 LEU A 198 4.019 10.349 -3.026 1.00 61.01 H new ATOM 0 HG LEU A 198 5.312 7.782 -2.091 1.00 41.05 H new ATOM 0 HD11 LEU A 198 7.432 8.821 -2.833 1.00 54.14 H new ATOM 0 HD12 LEU A 198 6.329 8.547 -4.203 1.00 54.14 H new ATOM 0 HD13 LEU A 198 6.517 10.182 -3.525 1.00 54.14 H new ATOM 0 HD21 LEU A 198 6.539 9.309 -0.599 1.00 33.22 H new ATOM 0 HD22 LEU A 198 5.620 10.685 -1.255 1.00 33.22 H new ATOM 0 HD23 LEU A 198 4.782 9.412 -0.336 1.00 33.22 H new ATOM 911 N MET A 199 0.665 10.038 -2.398 1.00 42.52 N ATOM 912 CA MET A 199 -0.491 10.601 -3.082 1.00 24.33 C ATOM 913 C MET A 199 -0.423 12.116 -3.043 1.00 74.44 C ATOM 914 O MET A 199 -0.017 12.689 -2.033 1.00 30.33 O ATOM 915 CB MET A 199 -1.791 10.061 -2.483 1.00 31.24 C ATOM 916 CG MET A 199 -3.066 10.607 -3.116 1.00 24.24 C ATOM 917 SD MET A 199 -4.567 9.882 -2.419 1.00 64.52 S ATOM 918 CE MET A 199 -4.382 10.299 -0.689 1.00 70.21 C ATOM 0 H MET A 199 0.705 10.231 -1.397 1.00 42.52 H new ATOM 0 HA MET A 199 -0.478 10.295 -4.128 1.00 24.33 H new ATOM 0 HB2 MET A 199 -1.793 8.975 -2.576 1.00 31.24 H new ATOM 0 HB3 MET A 199 -1.805 10.290 -1.417 1.00 31.24 H new ATOM 0 HG2 MET A 199 -3.096 11.689 -2.984 1.00 24.24 H new ATOM 0 HG3 MET A 199 -3.042 10.418 -4.189 1.00 24.24 H new ATOM 0 HE1 MET A 199 -5.366 10.386 -0.228 1.00 70.21 H new ATOM 0 HE2 MET A 199 -3.813 9.518 -0.185 1.00 70.21 H new ATOM 0 HE3 MET A 199 -3.854 11.248 -0.598 1.00 70.21 H new ATOM 928 N VAL A 200 -0.823 12.751 -4.133 1.00 70.00 N ATOM 929 CA VAL A 200 -0.679 14.196 -4.307 1.00 31.11 C ATOM 930 C VAL A 200 -1.604 14.966 -3.377 1.00 41.41 C ATOM 931 O VAL A 200 -2.829 14.764 -3.383 1.00 41.22 O ATOM 932 CB VAL A 200 -0.990 14.621 -5.764 1.00 1.42 C ATOM 933 CG1 VAL A 200 -0.684 16.098 -5.985 1.00 15.10 C ATOM 934 CG2 VAL A 200 -0.247 13.756 -6.768 1.00 23.20 C ATOM 0 H VAL A 200 -1.259 12.282 -4.927 1.00 70.00 H new ATOM 0 HA VAL A 200 0.358 14.433 -4.067 1.00 31.11 H new ATOM 0 HB VAL A 200 -2.057 14.471 -5.925 1.00 1.42 H new ATOM 0 HG11 VAL A 200 -0.912 16.366 -7.016 1.00 15.10 H new ATOM 0 HG12 VAL A 200 -1.292 16.700 -5.310 1.00 15.10 H new ATOM 0 HG13 VAL A 200 0.371 16.285 -5.787 1.00 15.10 H new ATOM 0 HG21 VAL A 200 -0.489 14.083 -7.779 1.00 23.20 H new ATOM 0 HG22 VAL A 200 0.827 13.849 -6.604 1.00 23.20 H new ATOM 0 HG23 VAL A 200 -0.545 12.715 -6.642 1.00 23.20 H new ATOM 944 N GLY A 201 -1.004 15.857 -2.609 1.00 52.45 N ATOM 945 CA GLY A 201 -1.726 16.672 -1.676 1.00 71.33 C ATOM 946 C GLY A 201 -2.303 15.861 -0.548 1.00 60.40 C ATOM 947 O GLY A 201 -1.562 15.282 0.261 1.00 44.25 O ATOM 0 H GLY A 201 0.001 16.029 -2.622 1.00 52.45 H new ATOM 0 HA2 GLY A 201 -1.061 17.435 -1.271 1.00 71.33 H new ATOM 0 HA3 GLY A 201 -2.530 17.193 -2.196 1.00 71.33 H new ATOM 951 N HIS A 202 -3.607 15.814 -0.509 1.00 23.13 N ATOM 952 CA HIS A 202 -4.352 15.078 0.476 1.00 1.40 C ATOM 953 C HIS A 202 -5.784 14.924 0.008 1.00 41.31 C ATOM 954 O HIS A 202 -6.617 15.816 0.174 1.00 60.21 O ATOM 955 CB HIS A 202 -4.293 15.739 1.882 1.00 15.31 C ATOM 956 CG HIS A 202 -5.089 15.015 2.950 1.00 30.03 C ATOM 957 ND1 HIS A 202 -5.996 15.630 3.778 1.00 23.12 N ATOM 958 CD2 HIS A 202 -5.078 13.714 3.325 1.00 52.01 C ATOM 959 CE1 HIS A 202 -6.490 14.720 4.611 1.00 31.21 C ATOM 960 NE2 HIS A 202 -5.966 13.530 4.379 1.00 32.13 N ATOM 0 H HIS A 202 -4.198 16.302 -1.182 1.00 23.13 H new ATOM 0 HA HIS A 202 -3.894 14.095 0.582 1.00 1.40 H new ATOM 0 HB2 HIS A 202 -3.252 15.797 2.199 1.00 15.31 H new ATOM 0 HB3 HIS A 202 -4.660 16.762 1.804 1.00 15.31 H new ATOM 0 HD2 HIS A 202 -4.474 12.940 2.876 1.00 52.01 H new ATOM 0 HE1 HIS A 202 -7.223 14.926 5.377 1.00 31.21 H new ATOM 0 HE2 HIS A 202 -6.170 12.659 4.870 1.00 32.13 H new ATOM 968 N THR A 203 -6.036 13.839 -0.638 1.00 23.54 N ATOM 969 CA THR A 203 -7.341 13.492 -1.065 1.00 14.22 C ATOM 970 C THR A 203 -7.621 12.064 -0.580 1.00 12.32 C ATOM 971 O THR A 203 -7.436 11.094 -1.320 1.00 22.15 O ATOM 972 CB THR A 203 -7.467 13.605 -2.604 1.00 2.53 C ATOM 973 OG1 THR A 203 -7.037 14.919 -3.007 1.00 41.44 O ATOM 974 CG2 THR A 203 -8.908 13.404 -3.050 1.00 2.01 C ATOM 0 H THR A 203 -5.322 13.155 -0.888 1.00 23.54 H new ATOM 0 HA THR A 203 -8.076 14.178 -0.644 1.00 14.22 H new ATOM 0 HB THR A 203 -6.849 12.834 -3.063 1.00 2.53 H new ATOM 0 HG1 THR A 203 -7.111 15.003 -3.981 1.00 41.44 H new ATOM 0 HG21 THR A 203 -8.968 13.488 -4.135 1.00 2.01 H new ATOM 0 HG22 THR A 203 -9.249 12.415 -2.744 1.00 2.01 H new ATOM 0 HG23 THR A 203 -9.540 14.164 -2.591 1.00 2.01 H new ATOM 982 N PRO A 204 -8.028 11.917 0.702 1.00 33.22 N ATOM 983 CA PRO A 204 -8.165 10.608 1.355 1.00 51.22 C ATOM 984 C PRO A 204 -9.168 9.694 0.682 1.00 23.11 C ATOM 985 O PRO A 204 -9.066 8.481 0.789 1.00 31.24 O ATOM 986 CB PRO A 204 -8.595 10.942 2.787 1.00 31.51 C ATOM 987 CG PRO A 204 -9.145 12.322 2.719 1.00 74.32 C ATOM 988 CD PRO A 204 -8.406 13.020 1.615 1.00 61.35 C ATOM 0 HA PRO A 204 -7.229 10.051 1.304 1.00 51.22 H new ATOM 0 HB2 PRO A 204 -9.344 10.237 3.147 1.00 31.51 H new ATOM 0 HB3 PRO A 204 -7.750 10.888 3.474 1.00 31.51 H new ATOM 0 HG2 PRO A 204 -10.216 12.303 2.518 1.00 74.32 H new ATOM 0 HG3 PRO A 204 -9.008 12.842 3.667 1.00 74.32 H new ATOM 0 HD2 PRO A 204 -9.034 13.758 1.115 1.00 61.35 H new ATOM 0 HD3 PRO A 204 -7.530 13.549 1.990 1.00 61.35 H new ATOM 996 N ALA A 205 -10.093 10.283 -0.048 1.00 12.04 N ATOM 997 CA ALA A 205 -11.118 9.539 -0.754 1.00 21.13 C ATOM 998 C ALA A 205 -10.518 8.577 -1.773 1.00 5.13 C ATOM 999 O ALA A 205 -10.972 7.451 -1.903 1.00 71.23 O ATOM 1000 CB ALA A 205 -12.097 10.482 -1.410 1.00 11.04 C ATOM 0 H ALA A 205 -10.156 11.294 -0.169 1.00 12.04 H new ATOM 0 HA ALA A 205 -11.655 8.937 -0.021 1.00 21.13 H new ATOM 0 HB1 ALA A 205 -12.860 9.907 -1.935 1.00 11.04 H new ATOM 0 HB2 ALA A 205 -12.570 11.102 -0.649 1.00 11.04 H new ATOM 0 HB3 ALA A 205 -11.569 11.119 -2.120 1.00 11.04 H new ATOM 1006 N LYS A 206 -9.466 9.009 -2.461 1.00 33.13 N ATOM 1007 CA LYS A 206 -8.809 8.159 -3.448 1.00 51.44 C ATOM 1008 C LYS A 206 -8.165 6.984 -2.776 1.00 23.13 C ATOM 1009 O LYS A 206 -8.348 5.842 -3.193 1.00 31.11 O ATOM 1010 CB LYS A 206 -7.757 8.923 -4.250 1.00 2.32 C ATOM 1011 CG LYS A 206 -8.291 9.985 -5.185 1.00 44.41 C ATOM 1012 CD LYS A 206 -7.141 10.765 -5.805 1.00 72.00 C ATOM 1013 CE LYS A 206 -7.628 11.767 -6.833 1.00 13.53 C ATOM 1014 NZ LYS A 206 -8.109 11.120 -8.073 1.00 0.42 N ATOM 0 H LYS A 206 -9.053 9.935 -2.355 1.00 33.13 H new ATOM 0 HA LYS A 206 -9.578 7.815 -4.139 1.00 51.44 H new ATOM 0 HB2 LYS A 206 -7.065 9.394 -3.552 1.00 2.32 H new ATOM 0 HB3 LYS A 206 -7.181 8.206 -4.835 1.00 2.32 H new ATOM 0 HG2 LYS A 206 -8.890 9.522 -5.969 1.00 44.41 H new ATOM 0 HG3 LYS A 206 -8.948 10.663 -4.640 1.00 44.41 H new ATOM 0 HD2 LYS A 206 -6.592 11.287 -5.021 1.00 72.00 H new ATOM 0 HD3 LYS A 206 -6.444 10.072 -6.275 1.00 72.00 H new ATOM 0 HE2 LYS A 206 -8.433 12.362 -6.402 1.00 13.53 H new ATOM 0 HE3 LYS A 206 -6.818 12.455 -7.077 1.00 13.53 H new ATOM 0 HZ1 LYS A 206 -9.008 11.554 -8.365 1.00 0.42 H new ATOM 0 HZ2 LYS A 206 -7.403 11.246 -8.826 1.00 0.42 H new ATOM 0 HZ3 LYS A 206 -8.254 10.105 -7.901 1.00 0.42 H new ATOM 1028 N LEU A 207 -7.477 7.262 -1.699 1.00 71.30 N ATOM 1029 CA LEU A 207 -6.756 6.247 -0.987 1.00 44.12 C ATOM 1030 C LEU A 207 -7.725 5.257 -0.385 1.00 2.10 C ATOM 1031 O LEU A 207 -7.536 4.058 -0.499 1.00 53.15 O ATOM 1032 CB LEU A 207 -5.875 6.868 0.094 1.00 43.03 C ATOM 1033 CG LEU A 207 -5.003 5.900 0.901 1.00 14.23 C ATOM 1034 CD1 LEU A 207 -3.994 5.194 0.009 1.00 31.34 C ATOM 1035 CD2 LEU A 207 -4.301 6.638 2.013 1.00 1.54 C ATOM 0 H LEU A 207 -7.403 8.195 -1.295 1.00 71.30 H new ATOM 0 HA LEU A 207 -6.106 5.721 -1.686 1.00 44.12 H new ATOM 0 HB2 LEU A 207 -5.223 7.603 -0.377 1.00 43.03 H new ATOM 0 HB3 LEU A 207 -6.517 7.410 0.789 1.00 43.03 H new ATOM 0 HG LEU A 207 -5.652 5.140 1.336 1.00 14.23 H new ATOM 0 HD11 LEU A 207 -3.390 4.514 0.610 1.00 31.34 H new ATOM 0 HD12 LEU A 207 -4.521 4.628 -0.760 1.00 31.34 H new ATOM 0 HD13 LEU A 207 -3.347 5.933 -0.464 1.00 31.34 H new ATOM 0 HD21 LEU A 207 -3.684 5.941 2.580 1.00 1.54 H new ATOM 0 HD22 LEU A 207 -3.670 7.419 1.589 1.00 1.54 H new ATOM 0 HD23 LEU A 207 -5.041 7.088 2.675 1.00 1.54 H new ATOM 1047 N GLU A 208 -8.798 5.771 0.179 1.00 45.03 N ATOM 1048 CA GLU A 208 -9.792 4.949 0.817 1.00 31.13 C ATOM 1049 C GLU A 208 -10.475 4.033 -0.194 1.00 71.01 C ATOM 1050 O GLU A 208 -10.715 2.859 0.095 1.00 51.52 O ATOM 1051 CB GLU A 208 -10.799 5.810 1.572 1.00 11.11 C ATOM 1052 CG GLU A 208 -11.892 5.029 2.271 1.00 73.34 C ATOM 1053 CD GLU A 208 -12.762 5.908 3.106 1.00 71.20 C ATOM 1054 OE1 GLU A 208 -13.428 6.812 2.545 1.00 5.24 O ATOM 1055 OE2 GLU A 208 -12.811 5.705 4.352 1.00 20.01 O ATOM 0 H GLU A 208 -9.001 6.770 0.205 1.00 45.03 H new ATOM 0 HA GLU A 208 -9.294 4.310 1.546 1.00 31.13 H new ATOM 0 HB2 GLU A 208 -10.266 6.406 2.312 1.00 11.11 H new ATOM 0 HB3 GLU A 208 -11.259 6.508 0.872 1.00 11.11 H new ATOM 0 HG2 GLU A 208 -12.502 4.516 1.528 1.00 73.34 H new ATOM 0 HG3 GLU A 208 -11.443 4.261 2.900 1.00 73.34 H new ATOM 1062 N ARG A 209 -10.738 4.547 -1.400 1.00 11.01 N ATOM 1063 CA ARG A 209 -11.348 3.719 -2.433 1.00 1.21 C ATOM 1064 C ARG A 209 -10.426 2.588 -2.835 1.00 11.04 C ATOM 1065 O ARG A 209 -10.864 1.447 -3.017 1.00 62.15 O ATOM 1066 CB ARG A 209 -11.763 4.515 -3.665 1.00 5.03 C ATOM 1067 CG ARG A 209 -12.910 5.477 -3.443 1.00 24.23 C ATOM 1068 CD ARG A 209 -13.430 5.995 -4.771 1.00 32.02 C ATOM 1069 NE ARG A 209 -13.962 4.897 -5.599 1.00 31.24 N ATOM 1070 CZ ARG A 209 -14.299 4.989 -6.892 1.00 51.42 C ATOM 1071 NH1 ARG A 209 -14.129 6.135 -7.555 1.00 42.34 N ATOM 1072 NH2 ARG A 209 -14.791 3.928 -7.525 1.00 45.20 N ATOM 0 H ARG A 209 -10.542 5.509 -1.676 1.00 11.01 H new ATOM 0 HA ARG A 209 -12.256 3.307 -1.994 1.00 1.21 H new ATOM 0 HB2 ARG A 209 -10.901 5.077 -4.025 1.00 5.03 H new ATOM 0 HB3 ARG A 209 -12.041 3.817 -4.455 1.00 5.03 H new ATOM 0 HG2 ARG A 209 -13.713 4.977 -2.901 1.00 24.23 H new ATOM 0 HG3 ARG A 209 -12.579 6.311 -2.824 1.00 24.23 H new ATOM 0 HD2 ARG A 209 -14.212 6.734 -4.595 1.00 32.02 H new ATOM 0 HD3 ARG A 209 -12.627 6.502 -5.306 1.00 32.02 H new ATOM 0 HE ARG A 209 -14.084 3.990 -5.149 1.00 31.24 H new ATOM 0 HH11 ARG A 209 -13.740 6.948 -7.077 1.00 42.34 H new ATOM 0 HH12 ARG A 209 -14.388 6.198 -8.540 1.00 42.34 H new ATOM 0 HH21 ARG A 209 -14.911 3.047 -7.026 1.00 45.20 H new ATOM 0 HH22 ARG A 209 -15.048 3.996 -8.510 1.00 45.20 H new ATOM 1086 N LEU A 210 -9.148 2.893 -2.959 1.00 53.54 N ATOM 1087 CA LEU A 210 -8.173 1.878 -3.294 1.00 73.31 C ATOM 1088 C LEU A 210 -8.008 0.875 -2.174 1.00 70.42 C ATOM 1089 O LEU A 210 -7.922 -0.318 -2.428 1.00 51.44 O ATOM 1090 CB LEU A 210 -6.818 2.472 -3.711 1.00 25.23 C ATOM 1091 CG LEU A 210 -6.678 2.909 -5.181 1.00 73.34 C ATOM 1092 CD1 LEU A 210 -7.698 3.962 -5.565 1.00 33.34 C ATOM 1093 CD2 LEU A 210 -5.275 3.414 -5.445 1.00 74.40 C ATOM 0 H LEU A 210 -8.765 3.830 -2.833 1.00 53.54 H new ATOM 0 HA LEU A 210 -8.566 1.351 -4.163 1.00 73.31 H new ATOM 0 HB2 LEU A 210 -6.616 3.336 -3.078 1.00 25.23 H new ATOM 0 HB3 LEU A 210 -6.044 1.735 -3.500 1.00 25.23 H new ATOM 0 HG LEU A 210 -6.869 2.033 -5.801 1.00 73.34 H new ATOM 0 HD11 LEU A 210 -7.560 4.238 -6.610 1.00 33.34 H new ATOM 0 HD12 LEU A 210 -8.703 3.563 -5.425 1.00 33.34 H new ATOM 0 HD13 LEU A 210 -7.566 4.843 -4.936 1.00 33.34 H new ATOM 0 HD21 LEU A 210 -5.189 3.720 -6.488 1.00 74.40 H new ATOM 0 HD22 LEU A 210 -5.067 4.267 -4.798 1.00 74.40 H new ATOM 0 HD23 LEU A 210 -4.558 2.620 -5.239 1.00 74.40 H new ATOM 1105 N VAL A 211 -8.002 1.355 -0.941 1.00 3.41 N ATOM 1106 CA VAL A 211 -7.868 0.487 0.219 1.00 72.22 C ATOM 1107 C VAL A 211 -9.064 -0.460 0.330 1.00 24.35 C ATOM 1108 O VAL A 211 -8.890 -1.648 0.575 1.00 1.11 O ATOM 1109 CB VAL A 211 -7.658 1.292 1.552 1.00 22.33 C ATOM 1110 CG1 VAL A 211 -7.675 0.374 2.765 1.00 0.13 C ATOM 1111 CG2 VAL A 211 -6.334 2.043 1.517 1.00 42.34 C ATOM 0 H VAL A 211 -8.089 2.346 -0.716 1.00 3.41 H new ATOM 0 HA VAL A 211 -6.968 -0.109 0.069 1.00 72.22 H new ATOM 0 HB VAL A 211 -8.482 2.000 1.636 1.00 22.33 H new ATOM 0 HG11 VAL A 211 -7.527 0.964 3.670 1.00 0.13 H new ATOM 0 HG12 VAL A 211 -8.635 -0.139 2.819 1.00 0.13 H new ATOM 0 HG13 VAL A 211 -6.875 -0.361 2.676 1.00 0.13 H new ATOM 0 HG21 VAL A 211 -6.204 2.595 2.448 1.00 42.34 H new ATOM 0 HG22 VAL A 211 -5.516 1.333 1.400 1.00 42.34 H new ATOM 0 HG23 VAL A 211 -6.333 2.740 0.679 1.00 42.34 H new ATOM 1121 N ALA A 212 -10.257 0.060 0.088 1.00 14.10 N ATOM 1122 CA ALA A 212 -11.476 -0.739 0.139 1.00 0.15 C ATOM 1123 C ALA A 212 -11.454 -1.847 -0.904 1.00 60.24 C ATOM 1124 O ALA A 212 -11.798 -2.994 -0.613 1.00 11.44 O ATOM 1125 CB ALA A 212 -12.702 0.138 -0.043 1.00 3.11 C ATOM 0 H ALA A 212 -10.410 1.041 -0.148 1.00 14.10 H new ATOM 0 HA ALA A 212 -11.526 -1.205 1.123 1.00 0.15 H new ATOM 0 HB1 ALA A 212 -13.600 -0.479 -0.002 1.00 3.11 H new ATOM 0 HB2 ALA A 212 -12.737 0.884 0.751 1.00 3.11 H new ATOM 0 HB3 ALA A 212 -12.650 0.639 -1.009 1.00 3.11 H new ATOM 1131 N GLU A 213 -11.016 -1.505 -2.093 1.00 4.25 N ATOM 1132 CA GLU A 213 -10.922 -2.434 -3.206 1.00 35.10 C ATOM 1133 C GLU A 213 -9.829 -3.449 -2.943 1.00 63.10 C ATOM 1134 O GLU A 213 -9.984 -4.631 -3.235 1.00 42.43 O ATOM 1135 CB GLU A 213 -10.632 -1.649 -4.484 1.00 41.24 C ATOM 1136 CG GLU A 213 -10.604 -2.461 -5.763 1.00 21.22 C ATOM 1137 CD GLU A 213 -11.964 -2.974 -6.179 1.00 31.30 C ATOM 1138 OE1 GLU A 213 -12.803 -2.163 -6.628 1.00 15.14 O ATOM 1139 OE2 GLU A 213 -12.188 -4.190 -6.159 1.00 71.24 O ATOM 0 H GLU A 213 -10.709 -0.560 -2.323 1.00 4.25 H new ATOM 0 HA GLU A 213 -11.863 -2.971 -3.321 1.00 35.10 H new ATOM 0 HB2 GLU A 213 -11.386 -0.868 -4.588 1.00 41.24 H new ATOM 0 HB3 GLU A 213 -9.670 -1.150 -4.371 1.00 41.24 H new ATOM 0 HG2 GLU A 213 -10.195 -1.847 -6.565 1.00 21.22 H new ATOM 0 HG3 GLU A 213 -9.929 -3.307 -5.633 1.00 21.22 H new ATOM 1146 N LEU A 214 -8.747 -2.989 -2.373 1.00 52.22 N ATOM 1147 CA LEU A 214 -7.629 -3.836 -2.072 1.00 42.54 C ATOM 1148 C LEU A 214 -8.040 -4.819 -0.973 1.00 55.44 C ATOM 1149 O LEU A 214 -7.736 -5.994 -1.044 1.00 45.31 O ATOM 1150 CB LEU A 214 -6.416 -2.960 -1.671 1.00 21.33 C ATOM 1151 CG LEU A 214 -5.011 -3.593 -1.710 1.00 1.41 C ATOM 1152 CD1 LEU A 214 -4.814 -4.610 -0.612 1.00 62.01 C ATOM 1153 CD2 LEU A 214 -4.755 -4.219 -3.075 1.00 32.51 C ATOM 0 H LEU A 214 -8.618 -2.013 -2.105 1.00 52.22 H new ATOM 0 HA LEU A 214 -7.328 -4.419 -2.943 1.00 42.54 H new ATOM 0 HB2 LEU A 214 -6.406 -2.088 -2.325 1.00 21.33 H new ATOM 0 HB3 LEU A 214 -6.589 -2.597 -0.658 1.00 21.33 H new ATOM 0 HG LEU A 214 -4.287 -2.796 -1.541 1.00 1.41 H new ATOM 0 HD11 LEU A 214 -3.810 -5.029 -0.680 1.00 62.01 H new ATOM 0 HD12 LEU A 214 -4.941 -4.128 0.357 1.00 62.01 H new ATOM 0 HD13 LEU A 214 -5.548 -5.408 -0.720 1.00 62.01 H new ATOM 0 HD21 LEU A 214 -3.760 -4.663 -3.091 1.00 32.51 H new ATOM 0 HD22 LEU A 214 -5.500 -4.991 -3.267 1.00 32.51 H new ATOM 0 HD23 LEU A 214 -4.822 -3.451 -3.846 1.00 32.51 H new ATOM 1165 N SER A 215 -8.775 -4.322 0.003 1.00 51.44 N ATOM 1166 CA SER A 215 -9.290 -5.130 1.090 1.00 11.21 C ATOM 1167 C SER A 215 -10.282 -6.190 0.539 1.00 71.11 C ATOM 1168 O SER A 215 -10.344 -7.340 1.020 1.00 4.22 O ATOM 1169 CB SER A 215 -10.036 -4.211 2.085 1.00 14.22 C ATOM 1170 OG SER A 215 -10.614 -4.927 3.168 1.00 11.34 O ATOM 0 H SER A 215 -9.033 -3.337 0.064 1.00 51.44 H new ATOM 0 HA SER A 215 -8.463 -5.637 1.588 1.00 11.21 H new ATOM 0 HB2 SER A 215 -9.342 -3.467 2.476 1.00 14.22 H new ATOM 0 HB3 SER A 215 -10.819 -3.669 1.555 1.00 14.22 H new ATOM 0 HG SER A 215 -11.071 -4.301 3.767 1.00 11.34 H new ATOM 1176 N LEU A 216 -11.042 -5.779 -0.477 1.00 71.14 N ATOM 1177 CA LEU A 216 -12.092 -6.584 -1.076 1.00 72.31 C ATOM 1178 C LEU A 216 -11.527 -7.730 -1.907 1.00 34.22 C ATOM 1179 O LEU A 216 -12.226 -8.719 -2.169 1.00 4.12 O ATOM 1180 CB LEU A 216 -12.996 -5.702 -1.940 1.00 25.50 C ATOM 1181 CG LEU A 216 -14.236 -6.365 -2.542 1.00 13.55 C ATOM 1182 CD1 LEU A 216 -15.181 -6.851 -1.452 1.00 11.24 C ATOM 1183 CD2 LEU A 216 -14.940 -5.404 -3.465 1.00 23.15 C ATOM 0 H LEU A 216 -10.939 -4.861 -0.910 1.00 71.14 H new ATOM 0 HA LEU A 216 -12.675 -7.023 -0.267 1.00 72.31 H new ATOM 0 HB2 LEU A 216 -13.323 -4.856 -1.336 1.00 25.50 H new ATOM 0 HB3 LEU A 216 -12.397 -5.298 -2.756 1.00 25.50 H new ATOM 0 HG LEU A 216 -13.916 -7.234 -3.117 1.00 13.55 H new ATOM 0 HD11 LEU A 216 -16.054 -7.318 -1.909 1.00 11.24 H new ATOM 0 HD12 LEU A 216 -14.668 -7.578 -0.823 1.00 11.24 H new ATOM 0 HD13 LEU A 216 -15.499 -6.005 -0.843 1.00 11.24 H new ATOM 0 HD21 LEU A 216 -15.821 -5.886 -3.888 1.00 23.15 H new ATOM 0 HD22 LEU A 216 -15.244 -4.519 -2.906 1.00 23.15 H new ATOM 0 HD23 LEU A 216 -14.265 -5.111 -4.269 1.00 23.15 H new ATOM 1195 N GLN A 217 -10.299 -7.582 -2.352 1.00 13.04 N ATOM 1196 CA GLN A 217 -9.616 -8.641 -3.100 1.00 2.33 C ATOM 1197 C GLN A 217 -9.565 -9.914 -2.260 1.00 32.34 C ATOM 1198 O GLN A 217 -9.039 -9.896 -1.134 1.00 0.23 O ATOM 1199 CB GLN A 217 -8.202 -8.214 -3.517 1.00 73.03 C ATOM 1200 CG GLN A 217 -8.187 -6.981 -4.393 1.00 13.11 C ATOM 1201 CD GLN A 217 -8.990 -7.153 -5.667 1.00 12.45 C ATOM 1202 OE1 GLN A 217 -9.085 -8.247 -6.231 1.00 4.31 O ATOM 1203 NE2 GLN A 217 -9.617 -6.098 -6.091 1.00 0.34 N ATOM 0 H GLN A 217 -9.742 -6.739 -2.214 1.00 13.04 H new ATOM 0 HA GLN A 217 -10.181 -8.834 -4.012 1.00 2.33 H new ATOM 0 HB2 GLN A 217 -7.608 -8.024 -2.623 1.00 73.03 H new ATOM 0 HB3 GLN A 217 -7.723 -9.036 -4.049 1.00 73.03 H new ATOM 0 HG2 GLN A 217 -8.585 -6.137 -3.830 1.00 13.11 H new ATOM 0 HG3 GLN A 217 -7.156 -6.736 -4.649 1.00 13.11 H new ATOM 0 HE21 GLN A 217 -9.514 -5.211 -5.598 1.00 0.34 H new ATOM 0 HE22 GLN A 217 -10.213 -6.156 -6.917 1.00 0.34 H new ATOM 1212 N PRO A 218 -10.145 -11.024 -2.772 1.00 72.52 N ATOM 1213 CA PRO A 218 -10.248 -12.280 -2.036 1.00 15.32 C ATOM 1214 C PRO A 218 -8.894 -12.835 -1.661 1.00 51.45 C ATOM 1215 O PRO A 218 -8.138 -13.304 -2.515 1.00 4.41 O ATOM 1216 CB PRO A 218 -10.980 -13.230 -2.997 1.00 21.52 C ATOM 1217 CG PRO A 218 -10.804 -12.622 -4.345 1.00 10.33 C ATOM 1218 CD PRO A 218 -10.729 -11.142 -4.123 1.00 33.13 C ATOM 0 HA PRO A 218 -10.774 -12.146 -1.091 1.00 15.32 H new ATOM 0 HB2 PRO A 218 -10.557 -14.234 -2.958 1.00 21.52 H new ATOM 0 HB3 PRO A 218 -12.035 -13.318 -2.738 1.00 21.52 H new ATOM 0 HG2 PRO A 218 -9.897 -12.991 -4.824 1.00 10.33 H new ATOM 0 HG3 PRO A 218 -11.637 -12.877 -5.000 1.00 10.33 H new ATOM 0 HD2 PRO A 218 -10.106 -10.655 -4.873 1.00 33.13 H new ATOM 0 HD3 PRO A 218 -11.714 -10.678 -4.176 1.00 33.13 H new ATOM 1226 N GLY A 219 -8.582 -12.731 -0.402 1.00 32.41 N ATOM 1227 CA GLY A 219 -7.322 -13.216 0.107 1.00 72.33 C ATOM 1228 C GLY A 219 -6.792 -12.326 1.199 1.00 65.43 C ATOM 1229 O GLY A 219 -5.925 -12.730 1.989 1.00 33.23 O ATOM 0 H GLY A 219 -9.188 -12.310 0.302 1.00 32.41 H new ATOM 0 HA2 GLY A 219 -7.448 -14.229 0.490 1.00 72.33 H new ATOM 0 HA3 GLY A 219 -6.596 -13.270 -0.705 1.00 72.33 H new ATOM 1233 N VAL A 220 -7.286 -11.106 1.227 1.00 1.31 N ATOM 1234 CA VAL A 220 -6.922 -10.149 2.242 1.00 34.03 C ATOM 1235 C VAL A 220 -7.695 -10.405 3.537 1.00 4.40 C ATOM 1236 O VAL A 220 -8.916 -10.586 3.515 1.00 14.23 O ATOM 1237 CB VAL A 220 -7.178 -8.699 1.748 1.00 53.54 C ATOM 1238 CG1 VAL A 220 -6.882 -7.678 2.838 1.00 44.34 C ATOM 1239 CG2 VAL A 220 -6.351 -8.413 0.507 1.00 55.40 C ATOM 0 H VAL A 220 -7.954 -10.752 0.542 1.00 1.31 H new ATOM 0 HA VAL A 220 -5.858 -10.267 2.445 1.00 34.03 H new ATOM 0 HB VAL A 220 -8.235 -8.612 1.495 1.00 53.54 H new ATOM 0 HG11 VAL A 220 -7.072 -6.674 2.458 1.00 44.34 H new ATOM 0 HG12 VAL A 220 -7.524 -7.868 3.698 1.00 44.34 H new ATOM 0 HG13 VAL A 220 -5.838 -7.760 3.140 1.00 44.34 H new ATOM 0 HG21 VAL A 220 -6.540 -7.393 0.171 1.00 55.40 H new ATOM 0 HG22 VAL A 220 -5.293 -8.528 0.741 1.00 55.40 H new ATOM 0 HG23 VAL A 220 -6.626 -9.112 -0.283 1.00 55.40 H new ATOM 1249 N TYR A 221 -6.976 -10.439 4.641 1.00 62.50 N ATOM 1250 CA TYR A 221 -7.555 -10.594 5.960 1.00 11.15 C ATOM 1251 C TYR A 221 -7.986 -9.248 6.471 1.00 44.31 C ATOM 1252 O TYR A 221 -9.141 -9.051 6.867 1.00 71.21 O ATOM 1253 CB TYR A 221 -6.531 -11.168 6.948 1.00 40.45 C ATOM 1254 CG TYR A 221 -6.305 -12.653 6.883 1.00 53.41 C ATOM 1255 CD1 TYR A 221 -5.693 -13.257 5.796 1.00 33.11 C ATOM 1256 CD2 TYR A 221 -6.690 -13.452 7.946 1.00 23.12 C ATOM 1257 CE1 TYR A 221 -5.481 -14.619 5.776 1.00 62.50 C ATOM 1258 CE2 TYR A 221 -6.483 -14.804 7.931 1.00 73.11 C ATOM 1259 CZ TYR A 221 -5.881 -15.385 6.851 1.00 70.24 C ATOM 1260 OH TYR A 221 -5.675 -16.738 6.846 1.00 32.11 O ATOM 0 H TYR A 221 -5.959 -10.359 4.647 1.00 62.50 H new ATOM 0 HA TYR A 221 -8.402 -11.276 5.880 1.00 11.15 H new ATOM 0 HB2 TYR A 221 -5.577 -10.669 6.781 1.00 40.45 H new ATOM 0 HB3 TYR A 221 -6.851 -10.914 7.959 1.00 40.45 H new ATOM 0 HD1 TYR A 221 -5.379 -12.655 4.956 1.00 33.11 H new ATOM 0 HD2 TYR A 221 -7.163 -12.999 8.804 1.00 23.12 H new ATOM 0 HE1 TYR A 221 -5.005 -15.083 4.925 1.00 62.50 H new ATOM 0 HE2 TYR A 221 -6.794 -15.410 8.769 1.00 73.11 H new ATOM 0 HH TYR A 221 -6.015 -17.124 7.680 1.00 32.11 H new ATOM 1270 N ALA A 222 -7.059 -8.321 6.437 1.00 75.21 N ATOM 1271 CA ALA A 222 -7.275 -6.988 6.962 1.00 31.24 C ATOM 1272 C ALA A 222 -6.283 -6.036 6.352 1.00 10.14 C ATOM 1273 O ALA A 222 -5.228 -6.464 5.875 1.00 11.32 O ATOM 1274 CB ALA A 222 -7.123 -6.982 8.485 1.00 71.20 C ATOM 0 H ALA A 222 -6.129 -8.467 6.044 1.00 75.21 H new ATOM 0 HA ALA A 222 -8.287 -6.672 6.709 1.00 31.24 H new ATOM 0 HB1 ALA A 222 -7.288 -5.973 8.863 1.00 71.20 H new ATOM 0 HB2 ALA A 222 -7.854 -7.659 8.926 1.00 71.20 H new ATOM 0 HB3 ALA A 222 -6.118 -7.309 8.752 1.00 71.20 H new ATOM 1280 N VAL A 223 -6.609 -4.774 6.351 1.00 54.43 N ATOM 1281 CA VAL A 223 -5.722 -3.761 5.839 1.00 33.22 C ATOM 1282 C VAL A 223 -5.847 -2.476 6.664 1.00 45.33 C ATOM 1283 O VAL A 223 -6.952 -1.995 6.938 1.00 63.54 O ATOM 1284 CB VAL A 223 -5.953 -3.493 4.317 1.00 42.32 C ATOM 1285 CG1 VAL A 223 -7.385 -3.104 4.029 1.00 11.21 C ATOM 1286 CG2 VAL A 223 -5.006 -2.429 3.794 1.00 53.41 C ATOM 0 H VAL A 223 -7.496 -4.416 6.704 1.00 54.43 H new ATOM 0 HA VAL A 223 -4.702 -4.132 5.936 1.00 33.22 H new ATOM 0 HB VAL A 223 -5.745 -4.427 3.796 1.00 42.32 H new ATOM 0 HG11 VAL A 223 -7.506 -2.926 2.960 1.00 11.21 H new ATOM 0 HG12 VAL A 223 -8.050 -3.909 4.340 1.00 11.21 H new ATOM 0 HG13 VAL A 223 -7.633 -2.196 4.578 1.00 11.21 H new ATOM 0 HG21 VAL A 223 -5.192 -2.266 2.732 1.00 53.41 H new ATOM 0 HG22 VAL A 223 -5.168 -1.498 4.338 1.00 53.41 H new ATOM 0 HG23 VAL A 223 -3.976 -2.757 3.935 1.00 53.41 H new ATOM 1296 N HIS A 224 -4.734 -1.964 7.098 1.00 42.22 N ATOM 1297 CA HIS A 224 -4.691 -0.748 7.887 1.00 13.04 C ATOM 1298 C HIS A 224 -3.956 0.286 7.092 1.00 71.21 C ATOM 1299 O HIS A 224 -2.919 -0.018 6.517 1.00 60.13 O ATOM 1300 CB HIS A 224 -3.895 -0.936 9.210 1.00 71.23 C ATOM 1301 CG HIS A 224 -4.323 -2.052 10.130 1.00 21.21 C ATOM 1302 ND1 HIS A 224 -3.587 -2.454 11.227 1.00 0.20 N ATOM 1303 CD2 HIS A 224 -5.415 -2.848 10.112 1.00 22.23 C ATOM 1304 CE1 HIS A 224 -4.232 -3.452 11.821 1.00 22.45 C ATOM 1305 NE2 HIS A 224 -5.356 -3.738 11.184 1.00 53.14 N ATOM 0 H HIS A 224 -3.818 -2.374 6.918 1.00 42.22 H new ATOM 0 HA HIS A 224 -5.717 -0.465 8.124 1.00 13.04 H new ATOM 0 HB2 HIS A 224 -2.848 -1.096 8.952 1.00 71.23 H new ATOM 0 HB3 HIS A 224 -3.947 -0.002 9.769 1.00 71.23 H new ATOM 0 HD2 HIS A 224 -6.209 -2.802 9.382 1.00 22.23 H new ATOM 0 HE1 HIS A 224 -3.885 -3.963 12.707 1.00 22.45 H new ATOM 0 HE2 HIS A 224 -6.036 -4.458 11.426 1.00 53.14 H new ATOM 1313 N TRP A 225 -4.459 1.471 7.025 1.00 31.33 N ATOM 1314 CA TRP A 225 -3.701 2.506 6.406 1.00 45.50 C ATOM 1315 C TRP A 225 -3.352 3.515 7.420 1.00 35.23 C ATOM 1316 O TRP A 225 -4.112 3.765 8.361 1.00 0.15 O ATOM 1317 CB TRP A 225 -4.361 3.147 5.192 1.00 3.50 C ATOM 1318 CG TRP A 225 -5.611 3.940 5.455 1.00 12.12 C ATOM 1319 CD1 TRP A 225 -6.884 3.467 5.620 1.00 35.33 C ATOM 1320 CD2 TRP A 225 -5.694 5.371 5.559 1.00 43.42 C ATOM 1321 NE1 TRP A 225 -7.752 4.524 5.815 1.00 43.11 N ATOM 1322 CE2 TRP A 225 -7.040 5.701 5.780 1.00 0.21 C ATOM 1323 CE3 TRP A 225 -4.747 6.402 5.485 1.00 45.34 C ATOM 1324 CZ2 TRP A 225 -7.468 7.023 5.923 1.00 14.01 C ATOM 1325 CZ3 TRP A 225 -5.168 7.707 5.628 1.00 40.30 C ATOM 1326 CH2 TRP A 225 -6.514 8.011 5.844 1.00 71.34 C ATOM 0 H TRP A 225 -5.374 1.746 7.383 1.00 31.33 H new ATOM 0 HA TRP A 225 -2.803 2.038 6.004 1.00 45.50 H new ATOM 0 HB2 TRP A 225 -3.634 3.803 4.714 1.00 3.50 H new ATOM 0 HB3 TRP A 225 -4.599 2.360 4.477 1.00 3.50 H new ATOM 0 HD1 TRP A 225 -7.168 2.425 5.601 1.00 35.33 H new ATOM 0 HE1 TRP A 225 -8.758 4.445 5.961 1.00 43.11 H new ATOM 0 HE3 TRP A 225 -3.704 6.177 5.319 1.00 45.34 H new ATOM 0 HZ2 TRP A 225 -8.508 7.260 6.089 1.00 14.01 H new ATOM 0 HZ3 TRP A 225 -4.445 8.507 5.572 1.00 40.30 H new ATOM 0 HH2 TRP A 225 -6.812 9.043 5.951 1.00 71.34 H new ATOM 1337 N TYR A 226 -2.239 4.071 7.250 1.00 44.24 N ATOM 1338 CA TYR A 226 -1.708 5.003 8.181 1.00 73.31 C ATOM 1339 C TYR A 226 -0.888 5.988 7.398 1.00 71.25 C ATOM 1340 O TYR A 226 -0.333 5.638 6.354 1.00 40.24 O ATOM 1341 CB TYR A 226 -0.844 4.214 9.191 1.00 33.13 C ATOM 1342 CG TYR A 226 -0.391 4.960 10.433 1.00 63.02 C ATOM 1343 CD1 TYR A 226 -1.311 5.474 11.333 1.00 12.34 C ATOM 1344 CD2 TYR A 226 0.954 5.096 10.733 1.00 4.45 C ATOM 1345 CE1 TYR A 226 -0.905 6.105 12.490 1.00 12.44 C ATOM 1346 CE2 TYR A 226 1.367 5.732 11.884 1.00 4.01 C ATOM 1347 CZ TYR A 226 0.434 6.229 12.759 1.00 22.00 C ATOM 1348 OH TYR A 226 0.848 6.853 13.920 1.00 12.03 O ATOM 0 H TYR A 226 -1.639 3.900 6.443 1.00 44.24 H new ATOM 0 HA TYR A 226 -2.479 5.541 8.733 1.00 73.31 H new ATOM 0 HB2 TYR A 226 -1.408 3.337 9.508 1.00 33.13 H new ATOM 0 HB3 TYR A 226 0.042 3.852 8.670 1.00 33.13 H new ATOM 0 HD1 TYR A 226 -2.366 5.379 11.124 1.00 12.34 H new ATOM 0 HD2 TYR A 226 1.692 4.697 10.053 1.00 4.45 H new ATOM 0 HE1 TYR A 226 -1.637 6.499 13.180 1.00 12.44 H new ATOM 0 HE2 TYR A 226 2.421 5.839 12.096 1.00 4.01 H new ATOM 0 HH TYR A 226 1.827 6.856 13.958 1.00 12.03 H new ATOM 1358 N ALA A 227 -0.864 7.211 7.826 1.00 70.15 N ATOM 1359 CA ALA A 227 -0.056 8.203 7.169 1.00 41.43 C ATOM 1360 C ALA A 227 1.385 8.040 7.585 1.00 73.44 C ATOM 1361 O ALA A 227 1.694 7.253 8.497 1.00 61.41 O ATOM 1362 CB ALA A 227 -0.556 9.596 7.474 1.00 51.15 C ATOM 0 H ALA A 227 -1.394 7.552 8.628 1.00 70.15 H new ATOM 0 HA ALA A 227 -0.128 8.060 6.091 1.00 41.43 H new ATOM 0 HB1 ALA A 227 0.072 10.327 6.965 1.00 51.15 H new ATOM 0 HB2 ALA A 227 -1.584 9.697 7.128 1.00 51.15 H new ATOM 0 HB3 ALA A 227 -0.517 9.769 8.549 1.00 51.15 H new ATOM 1368 N GLY A 228 2.258 8.736 6.906 1.00 72.24 N ATOM 1369 CA GLY A 228 3.661 8.686 7.211 1.00 71.24 C ATOM 1370 C GLY A 228 3.927 9.172 8.587 1.00 33.22 C ATOM 1371 O GLY A 228 3.673 10.333 8.900 1.00 43.43 O ATOM 0 H GLY A 228 2.017 9.351 6.129 1.00 72.24 H new ATOM 0 HA2 GLY A 228 4.022 7.663 7.107 1.00 71.24 H new ATOM 0 HA3 GLY A 228 4.214 9.293 6.494 1.00 71.24 H new