USER MOD reduce.3.24.130724 H: found=0, std=0, add=665, rem=0, adj=19 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 150 GLN : amide:sc= -0.999 X(o=-1,f=-0.58) USER MOD Set 1.2: A 194 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 149 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 202 HIS : no HD1:sc= 0 K(o=0,f=0.71) USER MOD Single : A 147 GLN : amide:sc=-9.35e-05 X(o=-9.3e-05,f=-9.3e-05) USER MOD Single : A 155 CYS SG : rot -16:sc= 0.455 USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 THR OG1 : rot -22:sc= 0.76 USER MOD Single : A 162 TYR OH : rot 40:sc= 1.21 USER MOD Single : A 166 HIS : no HE2:sc= -2.22! C(o=-2.2!,f=-6.7!) USER MOD Single : A 169 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 171 THR OG1 : rot -83:sc= 1.14 USER MOD Single : A 172 SER OG : rot 100:sc= 1.31 USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD Single : A 174 ASN : amide:sc= -0.0271 K(o=-0.027,f=-1.1) USER MOD Single : A 177 THR OG1 : rot 180:sc= 0 USER MOD Single : A 183 THR OG1 : rot -130:sc= 0 USER MOD Single : A 190 ASN : amide:sc= -5.07! C(o=-5.1!,f=-11!) USER MOD Single : A 192 THR OG1 : rot 180:sc= 0 USER MOD Single : A 196 HIS : no HE2:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 199 MET CE :methyl -166:sc= -1.1 (180deg=-1.53) USER MOD Single : A 203 THR OG1 : rot 180:sc= 0 USER MOD Single : A 206 LYS NZ :NH3+ -162:sc= 1.04 (180deg=0.211) USER MOD Single : A 215 SER OG : rot -91:sc= 1 USER MOD Single : A 217 GLN : amide:sc= 0.0153 K(o=0.015,f=-0.63) USER MOD Single : A 221 TYR OH : rot 23:sc= 0.757 USER MOD Single : A 224 HIS : no HD1:sc= -0.0199 X(o=-0.02,f=-0.02) USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 146 4.033 15.305 -1.789 1.00 31.33 N ATOM 66 CA LEU A 146 3.062 14.300 -1.610 1.00 23.22 C ATOM 67 C LEU A 146 3.246 13.817 -0.186 1.00 71.35 C ATOM 68 O LEU A 146 4.343 13.955 0.371 1.00 33.51 O ATOM 69 CB LEU A 146 3.266 13.117 -2.607 1.00 64.14 C ATOM 70 CG LEU A 146 3.172 13.409 -4.135 1.00 34.43 C ATOM 71 CD1 LEU A 146 4.429 14.074 -4.678 1.00 3.55 C ATOM 72 CD2 LEU A 146 2.876 12.143 -4.913 1.00 64.13 C ATOM 0 HA LEU A 146 2.060 14.687 -1.795 1.00 23.22 H new ATOM 0 HB2 LEU A 146 4.247 12.684 -2.412 1.00 64.14 H new ATOM 0 HB3 LEU A 146 2.527 12.352 -2.369 1.00 64.14 H new ATOM 0 HG LEU A 146 2.347 14.109 -4.267 1.00 34.43 H new ATOM 0 HD11 LEU A 146 4.312 14.256 -5.746 1.00 3.55 H new ATOM 0 HD12 LEU A 146 4.590 15.022 -4.164 1.00 3.55 H new ATOM 0 HD13 LEU A 146 5.286 13.421 -4.513 1.00 3.55 H new ATOM 0 HD21 LEU A 146 2.816 12.375 -5.976 1.00 64.13 H new ATOM 0 HD22 LEU A 146 3.672 11.418 -4.744 1.00 64.13 H new ATOM 0 HD23 LEU A 146 1.927 11.724 -4.579 1.00 64.13 H new ATOM 84 N GLN A 147 2.220 13.303 0.410 1.00 50.12 N ATOM 85 CA GLN A 147 2.304 12.817 1.761 1.00 55.22 C ATOM 86 C GLN A 147 2.481 11.339 1.741 1.00 40.32 C ATOM 87 O GLN A 147 1.824 10.645 0.949 1.00 30.41 O ATOM 88 CB GLN A 147 1.067 13.206 2.593 1.00 43.32 C ATOM 89 CG GLN A 147 1.116 14.586 3.266 1.00 43.42 C ATOM 90 CD GLN A 147 1.319 15.759 2.324 1.00 73.41 C ATOM 91 OE1 GLN A 147 0.361 16.327 1.802 1.00 43.54 O ATOM 92 NE2 GLN A 147 2.548 16.174 2.155 1.00 32.43 N ATOM 0 H GLN A 147 1.300 13.205 -0.019 1.00 50.12 H new ATOM 0 HA GLN A 147 3.165 13.284 2.240 1.00 55.22 H new ATOM 0 HB2 GLN A 147 0.192 13.171 1.944 1.00 43.32 H new ATOM 0 HB3 GLN A 147 0.922 12.451 3.366 1.00 43.32 H new ATOM 0 HG2 GLN A 147 0.186 14.738 3.814 1.00 43.42 H new ATOM 0 HG3 GLN A 147 1.922 14.586 3.999 1.00 43.42 H new ATOM 0 HE21 GLN A 147 3.319 15.679 2.603 1.00 32.43 H new ATOM 0 HE22 GLN A 147 2.735 16.992 1.576 1.00 32.43 H new ATOM 101 N PRO A 148 3.426 10.828 2.523 1.00 44.42 N ATOM 102 CA PRO A 148 3.611 9.415 2.654 1.00 33.04 C ATOM 103 C PRO A 148 2.450 8.789 3.409 1.00 43.34 C ATOM 104 O PRO A 148 2.145 9.170 4.542 1.00 61.21 O ATOM 105 CB PRO A 148 4.924 9.263 3.433 1.00 33.34 C ATOM 106 CG PRO A 148 5.111 10.560 4.136 1.00 21.25 C ATOM 107 CD PRO A 148 4.418 11.600 3.303 1.00 73.14 C ATOM 0 HA PRO A 148 3.651 8.911 1.688 1.00 33.04 H new ATOM 0 HB2 PRO A 148 4.869 8.436 4.141 1.00 33.34 H new ATOM 0 HB3 PRO A 148 5.758 9.054 2.763 1.00 33.34 H new ATOM 0 HG2 PRO A 148 4.688 10.522 5.140 1.00 21.25 H new ATOM 0 HG3 PRO A 148 6.170 10.793 4.245 1.00 21.25 H new ATOM 0 HD2 PRO A 148 3.937 12.355 3.925 1.00 73.14 H new ATOM 0 HD3 PRO A 148 5.119 12.123 2.652 1.00 73.14 H new ATOM 115 N TYR A 149 1.764 7.925 2.750 1.00 3.04 N ATOM 116 CA TYR A 149 0.705 7.156 3.352 1.00 50.25 C ATOM 117 C TYR A 149 1.072 5.727 3.221 1.00 14.12 C ATOM 118 O TYR A 149 1.561 5.332 2.199 1.00 20.01 O ATOM 119 CB TYR A 149 -0.635 7.391 2.640 1.00 65.45 C ATOM 120 CG TYR A 149 -1.157 8.778 2.808 1.00 41.24 C ATOM 121 CD1 TYR A 149 -1.776 9.142 3.975 1.00 64.22 C ATOM 122 CD2 TYR A 149 -1.017 9.727 1.813 1.00 0.21 C ATOM 123 CE1 TYR A 149 -2.240 10.409 4.169 1.00 55.31 C ATOM 124 CE2 TYR A 149 -1.485 11.009 1.987 1.00 61.22 C ATOM 125 CZ TYR A 149 -2.096 11.348 3.168 1.00 34.23 C ATOM 126 OH TYR A 149 -2.533 12.637 3.364 1.00 72.33 O ATOM 0 H TYR A 149 1.915 7.721 1.762 1.00 3.04 H new ATOM 0 HA TYR A 149 0.587 7.454 4.394 1.00 50.25 H new ATOM 0 HB2 TYR A 149 -0.515 7.182 1.577 1.00 65.45 H new ATOM 0 HB3 TYR A 149 -1.371 6.684 3.023 1.00 65.45 H new ATOM 0 HD1 TYR A 149 -1.899 8.409 4.758 1.00 64.22 H new ATOM 0 HD2 TYR A 149 -0.533 9.458 0.886 1.00 0.21 H new ATOM 0 HE1 TYR A 149 -2.717 10.676 5.100 1.00 55.31 H new ATOM 0 HE2 TYR A 149 -1.373 11.742 1.202 1.00 61.22 H new ATOM 0 HH TYR A 149 -2.355 13.169 2.560 1.00 72.33 H new ATOM 136 N GLN A 150 0.872 4.971 4.217 1.00 70.52 N ATOM 137 CA GLN A 150 1.172 3.581 4.128 1.00 41.34 C ATOM 138 C GLN A 150 -0.052 2.766 4.338 1.00 64.32 C ATOM 139 O GLN A 150 -0.756 2.913 5.340 1.00 73.31 O ATOM 140 CB GLN A 150 2.319 3.170 5.044 1.00 35.43 C ATOM 141 CG GLN A 150 2.202 3.683 6.452 1.00 0.22 C ATOM 142 CD GLN A 150 3.336 3.231 7.321 1.00 43.21 C ATOM 143 OE1 GLN A 150 3.873 2.142 7.156 1.00 3.25 O ATOM 144 NE2 GLN A 150 3.765 4.089 8.186 1.00 24.44 N ATOM 0 H GLN A 150 0.500 5.278 5.116 1.00 70.52 H new ATOM 0 HA GLN A 150 1.527 3.383 3.116 1.00 41.34 H new ATOM 0 HB2 GLN A 150 2.375 2.082 5.070 1.00 35.43 H new ATOM 0 HB3 GLN A 150 3.256 3.528 4.616 1.00 35.43 H new ATOM 0 HG2 GLN A 150 2.171 4.772 6.437 1.00 0.22 H new ATOM 0 HG3 GLN A 150 1.260 3.343 6.883 1.00 0.22 H new ATOM 0 HE21 GLN A 150 3.290 4.985 8.294 1.00 24.44 H new ATOM 0 HE22 GLN A 150 4.578 3.870 8.761 1.00 24.44 H new ATOM 153 N VAL A 151 -0.336 1.953 3.377 1.00 3.50 N ATOM 154 CA VAL A 151 -1.472 1.098 3.414 1.00 22.14 C ATOM 155 C VAL A 151 -0.960 -0.304 3.640 1.00 14.53 C ATOM 156 O VAL A 151 -0.241 -0.859 2.807 1.00 43.12 O ATOM 157 CB VAL A 151 -2.284 1.164 2.088 1.00 0.43 C ATOM 158 CG1 VAL A 151 -3.530 0.308 2.173 1.00 11.32 C ATOM 159 CG2 VAL A 151 -2.653 2.602 1.745 1.00 11.03 C ATOM 0 H VAL A 151 0.225 1.863 2.530 1.00 3.50 H new ATOM 0 HA VAL A 151 -2.146 1.410 4.211 1.00 22.14 H new ATOM 0 HB VAL A 151 -1.651 0.772 1.292 1.00 0.43 H new ATOM 0 HG11 VAL A 151 -4.080 0.371 1.234 1.00 11.32 H new ATOM 0 HG12 VAL A 151 -3.248 -0.728 2.359 1.00 11.32 H new ATOM 0 HG13 VAL A 151 -4.161 0.664 2.987 1.00 11.32 H new ATOM 0 HG21 VAL A 151 -3.220 2.620 0.814 1.00 11.03 H new ATOM 0 HG22 VAL A 151 -3.259 3.023 2.547 1.00 11.03 H new ATOM 0 HG23 VAL A 151 -1.744 3.193 1.628 1.00 11.03 H new ATOM 169 N ARG A 152 -1.286 -0.849 4.759 1.00 0.01 N ATOM 170 CA ARG A 152 -0.785 -2.119 5.150 1.00 72.32 C ATOM 171 C ARG A 152 -1.894 -3.155 5.105 1.00 33.11 C ATOM 172 O ARG A 152 -2.875 -3.064 5.841 1.00 22.54 O ATOM 173 CB ARG A 152 -0.154 -2.004 6.536 1.00 21.41 C ATOM 174 CG ARG A 152 0.564 -3.245 7.003 1.00 55.33 C ATOM 175 CD ARG A 152 1.271 -3.016 8.325 1.00 43.33 C ATOM 176 NE ARG A 152 0.334 -2.678 9.397 1.00 13.10 N ATOM 177 CZ ARG A 152 0.669 -2.354 10.651 1.00 51.23 C ATOM 178 NH1 ARG A 152 1.949 -2.329 11.029 1.00 44.04 N ATOM 179 NH2 ARG A 152 -0.276 -2.083 11.528 1.00 74.21 N ATOM 0 H ARG A 152 -1.916 -0.420 5.437 1.00 0.01 H new ATOM 0 HA ARG A 152 -0.013 -2.450 4.456 1.00 72.32 H new ATOM 0 HB2 ARG A 152 0.550 -1.172 6.532 1.00 21.41 H new ATOM 0 HB3 ARG A 152 -0.934 -1.758 7.257 1.00 21.41 H new ATOM 0 HG2 ARG A 152 -0.150 -4.062 7.108 1.00 55.33 H new ATOM 0 HG3 ARG A 152 1.290 -3.551 6.250 1.00 55.33 H new ATOM 0 HD2 ARG A 152 1.827 -3.913 8.599 1.00 43.33 H new ATOM 0 HD3 ARG A 152 1.998 -2.212 8.213 1.00 43.33 H new ATOM 0 HE ARG A 152 -0.660 -2.691 9.168 1.00 13.10 H new ATOM 0 HH11 ARG A 152 2.683 -2.558 10.359 1.00 44.04 H new ATOM 0 HH12 ARG A 152 2.193 -2.081 11.988 1.00 44.04 H new ATOM 0 HH21 ARG A 152 -1.256 -2.121 11.249 1.00 74.21 H new ATOM 0 HH22 ARG A 152 -0.027 -1.835 12.486 1.00 74.21 H new ATOM 193 N VAL A 153 -1.737 -4.114 4.235 1.00 33.13 N ATOM 194 CA VAL A 153 -2.723 -5.154 4.028 1.00 45.05 C ATOM 195 C VAL A 153 -2.142 -6.527 4.359 1.00 75.03 C ATOM 196 O VAL A 153 -1.065 -6.897 3.881 1.00 61.42 O ATOM 197 CB VAL A 153 -3.352 -5.119 2.570 1.00 73.10 C ATOM 198 CG1 VAL A 153 -2.288 -4.935 1.503 1.00 54.34 C ATOM 199 CG2 VAL A 153 -4.114 -6.397 2.279 1.00 50.02 C ATOM 0 H VAL A 153 -0.913 -4.202 3.640 1.00 33.13 H new ATOM 0 HA VAL A 153 -3.544 -4.958 4.717 1.00 45.05 H new ATOM 0 HB VAL A 153 -4.032 -4.268 2.543 1.00 73.10 H new ATOM 0 HG11 VAL A 153 -2.758 -4.916 0.520 1.00 54.34 H new ATOM 0 HG12 VAL A 153 -1.762 -3.995 1.672 1.00 54.34 H new ATOM 0 HG13 VAL A 153 -1.579 -5.761 1.550 1.00 54.34 H new ATOM 0 HG21 VAL A 153 -4.535 -6.349 1.275 1.00 50.02 H new ATOM 0 HG22 VAL A 153 -3.437 -7.248 2.348 1.00 50.02 H new ATOM 0 HG23 VAL A 153 -4.919 -6.514 3.005 1.00 50.02 H new ATOM 209 N ILE A 154 -2.833 -7.238 5.208 1.00 72.31 N ATOM 210 CA ILE A 154 -2.467 -8.572 5.598 1.00 32.23 C ATOM 211 C ILE A 154 -3.291 -9.557 4.778 1.00 51.22 C ATOM 212 O ILE A 154 -4.526 -9.512 4.788 1.00 3.44 O ATOM 213 CB ILE A 154 -2.655 -8.797 7.141 1.00 73.24 C ATOM 214 CG1 ILE A 154 -2.470 -10.277 7.535 1.00 32.12 C ATOM 215 CG2 ILE A 154 -3.975 -8.227 7.661 1.00 65.53 C ATOM 216 CD1 ILE A 154 -2.688 -10.556 9.011 1.00 24.32 C ATOM 0 H ILE A 154 -3.684 -6.899 5.657 1.00 72.31 H new ATOM 0 HA ILE A 154 -1.408 -8.732 5.398 1.00 32.23 H new ATOM 0 HB ILE A 154 -1.862 -8.233 7.633 1.00 73.24 H new ATOM 0 HG12 ILE A 154 -3.163 -10.886 6.955 1.00 32.12 H new ATOM 0 HG13 ILE A 154 -1.463 -10.592 7.261 1.00 32.12 H new ATOM 0 HG21 ILE A 154 -4.053 -8.410 8.733 1.00 65.53 H new ATOM 0 HG22 ILE A 154 -4.007 -7.154 7.473 1.00 65.53 H new ATOM 0 HG23 ILE A 154 -4.807 -8.710 7.149 1.00 65.53 H new ATOM 0 HD11 ILE A 154 -2.540 -11.618 9.206 1.00 24.32 H new ATOM 0 HD12 ILE A 154 -1.977 -9.976 9.600 1.00 24.32 H new ATOM 0 HD13 ILE A 154 -3.704 -10.275 9.288 1.00 24.32 H new ATOM 228 N CYS A 155 -2.628 -10.412 4.062 1.00 70.13 N ATOM 229 CA CYS A 155 -3.288 -11.318 3.170 1.00 64.41 C ATOM 230 C CYS A 155 -2.657 -12.683 3.258 1.00 2.31 C ATOM 231 O CYS A 155 -1.678 -12.860 3.980 1.00 42.45 O ATOM 232 CB CYS A 155 -3.187 -10.768 1.746 1.00 41.43 C ATOM 233 SG CYS A 155 -1.491 -10.444 1.192 1.00 73.42 S ATOM 0 H CYS A 155 -1.612 -10.502 4.079 1.00 70.13 H new ATOM 0 HA CYS A 155 -4.338 -11.413 3.447 1.00 64.41 H new ATOM 0 HB2 CYS A 155 -3.652 -11.477 1.061 1.00 41.43 H new ATOM 0 HB3 CYS A 155 -3.760 -9.843 1.684 1.00 41.43 H new ATOM 0 HG CYS A 155 -0.696 -10.417 2.220 1.00 73.42 H new ATOM 239 N ARG A 156 -3.240 -13.644 2.576 1.00 14.12 N ATOM 240 CA ARG A 156 -2.674 -14.998 2.473 1.00 23.42 C ATOM 241 C ARG A 156 -1.291 -14.898 1.766 1.00 32.11 C ATOM 242 O ARG A 156 -1.056 -13.947 1.021 1.00 21.31 O ATOM 243 CB ARG A 156 -3.633 -15.896 1.662 1.00 4.54 C ATOM 244 CG ARG A 156 -4.092 -17.159 2.391 1.00 71.11 C ATOM 245 CD ARG A 156 -4.921 -16.840 3.620 1.00 22.53 C ATOM 246 NE ARG A 156 -5.265 -18.038 4.386 1.00 13.40 N ATOM 247 CZ ARG A 156 -6.502 -18.396 4.749 1.00 74.24 C ATOM 248 NH1 ARG A 156 -7.532 -17.590 4.514 1.00 12.10 N ATOM 249 NH2 ARG A 156 -6.699 -19.537 5.395 1.00 32.35 N ATOM 0 H ARG A 156 -4.119 -13.523 2.073 1.00 14.12 H new ATOM 0 HA ARG A 156 -2.546 -15.437 3.463 1.00 23.42 H new ATOM 0 HB2 ARG A 156 -4.511 -15.312 1.387 1.00 4.54 H new ATOM 0 HB3 ARG A 156 -3.140 -16.187 0.734 1.00 4.54 H new ATOM 0 HG2 ARG A 156 -4.677 -17.777 1.710 1.00 71.11 H new ATOM 0 HG3 ARG A 156 -3.221 -17.745 2.684 1.00 71.11 H new ATOM 0 HD2 ARG A 156 -4.369 -16.150 4.258 1.00 22.53 H new ATOM 0 HD3 ARG A 156 -5.836 -16.331 3.316 1.00 22.53 H new ATOM 0 HE ARG A 156 -4.499 -18.651 4.666 1.00 13.40 H new ATOM 0 HH11 ARG A 156 -7.382 -16.692 4.054 1.00 12.10 H new ATOM 0 HH12 ARG A 156 -8.472 -17.869 4.793 1.00 12.10 H new ATOM 0 HH21 ARG A 156 -5.908 -20.142 5.615 1.00 32.35 H new ATOM 0 HH22 ARG A 156 -7.642 -19.810 5.672 1.00 32.35 H new ATOM 263 N PRO A 157 -0.363 -15.869 1.937 1.00 3.34 N ATOM 264 CA PRO A 157 0.978 -15.741 1.371 1.00 14.23 C ATOM 265 C PRO A 157 0.971 -15.787 -0.154 1.00 31.01 C ATOM 266 O PRO A 157 1.792 -15.158 -0.815 1.00 2.41 O ATOM 267 CB PRO A 157 1.759 -16.911 1.969 1.00 50.55 C ATOM 268 CG PRO A 157 0.729 -17.913 2.356 1.00 0.32 C ATOM 269 CD PRO A 157 -0.532 -17.144 2.661 1.00 3.32 C ATOM 0 HA PRO A 157 1.427 -14.777 1.612 1.00 14.23 H new ATOM 0 HB2 PRO A 157 2.460 -17.327 1.245 1.00 50.55 H new ATOM 0 HB3 PRO A 157 2.343 -16.594 2.833 1.00 50.55 H new ATOM 0 HG2 PRO A 157 0.561 -18.627 1.549 1.00 0.32 H new ATOM 0 HG3 PRO A 157 1.053 -18.485 3.225 1.00 0.32 H new ATOM 0 HD2 PRO A 157 -1.418 -17.681 2.321 1.00 3.32 H new ATOM 0 HD3 PRO A 157 -0.650 -16.981 3.732 1.00 3.32 H new ATOM 277 N LYS A 158 0.004 -16.485 -0.699 1.00 15.24 N ATOM 278 CA LYS A 158 -0.154 -16.613 -2.130 1.00 22.15 C ATOM 279 C LYS A 158 -0.876 -15.392 -2.697 1.00 35.04 C ATOM 280 O LYS A 158 -0.964 -15.215 -3.911 1.00 54.42 O ATOM 281 CB LYS A 158 -0.943 -17.885 -2.467 1.00 41.40 C ATOM 282 CG LYS A 158 -0.299 -19.184 -1.995 1.00 64.11 C ATOM 283 CD LYS A 158 1.046 -19.427 -2.652 1.00 74.34 C ATOM 284 CE LYS A 158 1.631 -20.765 -2.221 1.00 31.31 C ATOM 285 NZ LYS A 158 2.925 -21.048 -2.876 1.00 3.53 N ATOM 0 H LYS A 158 -0.702 -16.985 -0.158 1.00 15.24 H new ATOM 0 HA LYS A 158 0.836 -16.679 -2.581 1.00 22.15 H new ATOM 0 HB2 LYS A 158 -1.936 -17.807 -2.024 1.00 41.40 H new ATOM 0 HB3 LYS A 158 -1.079 -17.935 -3.547 1.00 41.40 H new ATOM 0 HG2 LYS A 158 -0.173 -19.153 -0.913 1.00 64.11 H new ATOM 0 HG3 LYS A 158 -0.965 -20.019 -2.214 1.00 64.11 H new ATOM 0 HD2 LYS A 158 0.934 -19.408 -3.736 1.00 74.34 H new ATOM 0 HD3 LYS A 158 1.734 -18.624 -2.388 1.00 74.34 H new ATOM 0 HE2 LYS A 158 1.765 -20.769 -1.139 1.00 31.31 H new ATOM 0 HE3 LYS A 158 0.925 -21.561 -2.457 1.00 31.31 H new ATOM 0 HZ1 LYS A 158 3.284 -21.969 -2.552 1.00 3.53 H new ATOM 0 HZ2 LYS A 158 2.794 -21.071 -3.907 1.00 3.53 H new ATOM 0 HZ3 LYS A 158 3.609 -20.304 -2.630 1.00 3.53 H new ATOM 299 N ALA A 159 -1.360 -14.541 -1.815 1.00 44.43 N ATOM 300 CA ALA A 159 -2.118 -13.392 -2.210 1.00 73.20 C ATOM 301 C ALA A 159 -1.215 -12.233 -2.522 1.00 12.02 C ATOM 302 O ALA A 159 -1.493 -11.468 -3.435 1.00 2.21 O ATOM 303 CB ALA A 159 -3.134 -13.017 -1.148 1.00 32.43 C ATOM 0 H ALA A 159 -1.234 -14.635 -0.807 1.00 44.43 H new ATOM 0 HA ALA A 159 -2.663 -13.648 -3.119 1.00 73.20 H new ATOM 0 HB1 ALA A 159 -3.695 -12.141 -1.474 1.00 32.43 H new ATOM 0 HB2 ALA A 159 -3.820 -13.849 -0.990 1.00 32.43 H new ATOM 0 HB3 ALA A 159 -2.618 -12.790 -0.215 1.00 32.43 H new ATOM 309 N GLU A 160 -0.101 -12.165 -1.798 1.00 3.25 N ATOM 310 CA GLU A 160 0.912 -11.098 -1.906 1.00 62.35 C ATOM 311 C GLU A 160 1.254 -10.801 -3.344 1.00 21.52 C ATOM 312 O GLU A 160 1.279 -9.648 -3.760 1.00 30.10 O ATOM 313 CB GLU A 160 2.173 -11.525 -1.091 1.00 25.14 C ATOM 314 CG GLU A 160 3.442 -10.628 -1.167 1.00 11.32 C ATOM 315 CD GLU A 160 4.234 -10.746 -2.469 1.00 75.43 C ATOM 316 OE1 GLU A 160 4.295 -11.867 -3.050 1.00 63.30 O ATOM 317 OE2 GLU A 160 4.810 -9.738 -2.927 1.00 40.20 O ATOM 0 H GLU A 160 0.137 -12.867 -1.097 1.00 3.25 H new ATOM 0 HA GLU A 160 0.510 -10.174 -1.492 1.00 62.35 H new ATOM 0 HB2 GLU A 160 1.882 -11.600 -0.043 1.00 25.14 H new ATOM 0 HB3 GLU A 160 2.455 -12.527 -1.416 1.00 25.14 H new ATOM 0 HG2 GLU A 160 3.143 -9.588 -1.033 1.00 11.32 H new ATOM 0 HG3 GLU A 160 4.099 -10.881 -0.335 1.00 11.32 H new ATOM 324 N THR A 161 1.440 -11.835 -4.096 1.00 62.34 N ATOM 325 CA THR A 161 1.879 -11.710 -5.447 1.00 43.50 C ATOM 326 C THR A 161 0.837 -11.005 -6.347 1.00 34.54 C ATOM 327 O THR A 161 1.205 -10.175 -7.191 1.00 13.13 O ATOM 328 CB THR A 161 2.284 -13.079 -5.970 1.00 33.23 C ATOM 329 OG1 THR A 161 3.191 -13.652 -4.999 1.00 24.24 O ATOM 330 CG2 THR A 161 2.992 -12.965 -7.316 1.00 13.33 C ATOM 0 H THR A 161 1.291 -12.796 -3.789 1.00 62.34 H new ATOM 0 HA THR A 161 2.753 -11.059 -5.473 1.00 43.50 H new ATOM 0 HB THR A 161 1.400 -13.700 -6.112 1.00 33.23 H new ATOM 0 HG1 THR A 161 3.589 -12.936 -4.461 1.00 24.24 H new ATOM 0 HG21 THR A 161 3.270 -13.959 -7.666 1.00 13.33 H new ATOM 0 HG22 THR A 161 2.324 -12.499 -8.040 1.00 13.33 H new ATOM 0 HG23 THR A 161 3.889 -12.355 -7.205 1.00 13.33 H new ATOM 338 N TYR A 162 -0.443 -11.283 -6.152 1.00 65.53 N ATOM 339 CA TYR A 162 -1.440 -10.599 -6.931 1.00 0.11 C ATOM 340 C TYR A 162 -1.857 -9.278 -6.289 1.00 74.31 C ATOM 341 O TYR A 162 -2.239 -8.343 -6.980 1.00 73.24 O ATOM 342 CB TYR A 162 -2.643 -11.487 -7.347 1.00 74.25 C ATOM 343 CG TYR A 162 -3.391 -12.203 -6.237 1.00 61.44 C ATOM 344 CD1 TYR A 162 -4.258 -11.523 -5.394 1.00 24.01 C ATOM 345 CD2 TYR A 162 -3.249 -13.575 -6.059 1.00 61.44 C ATOM 346 CE1 TYR A 162 -4.954 -12.182 -4.404 1.00 35.33 C ATOM 347 CE2 TYR A 162 -3.943 -14.242 -5.071 1.00 31.21 C ATOM 348 CZ TYR A 162 -4.794 -13.541 -4.246 1.00 50.45 C ATOM 349 OH TYR A 162 -5.481 -14.199 -3.246 1.00 75.34 O ATOM 0 H TYR A 162 -0.801 -11.960 -5.478 1.00 65.53 H new ATOM 0 HA TYR A 162 -0.957 -10.351 -7.876 1.00 0.11 H new ATOM 0 HB2 TYR A 162 -3.355 -10.861 -7.886 1.00 74.25 H new ATOM 0 HB3 TYR A 162 -2.282 -12.237 -8.050 1.00 74.25 H new ATOM 0 HD1 TYR A 162 -4.390 -10.458 -5.516 1.00 24.01 H new ATOM 0 HD2 TYR A 162 -2.584 -14.128 -6.706 1.00 61.44 H new ATOM 0 HE1 TYR A 162 -5.622 -11.635 -3.755 1.00 35.33 H new ATOM 0 HE2 TYR A 162 -3.820 -15.308 -4.945 1.00 31.21 H new ATOM 0 HH TYR A 162 -6.390 -13.839 -3.183 1.00 75.34 H new ATOM 359 N VAL A 163 -1.730 -9.187 -4.966 1.00 31.23 N ATOM 360 CA VAL A 163 -2.059 -7.962 -4.251 1.00 54.12 C ATOM 361 C VAL A 163 -1.044 -6.877 -4.599 1.00 52.22 C ATOM 362 O VAL A 163 -1.406 -5.740 -4.808 1.00 45.13 O ATOM 363 CB VAL A 163 -2.138 -8.179 -2.697 1.00 20.01 C ATOM 364 CG1 VAL A 163 -2.341 -6.860 -1.959 1.00 13.01 C ATOM 365 CG2 VAL A 163 -3.281 -9.123 -2.353 1.00 71.21 C ATOM 0 H VAL A 163 -1.402 -9.948 -4.371 1.00 31.23 H new ATOM 0 HA VAL A 163 -3.052 -7.645 -4.570 1.00 54.12 H new ATOM 0 HB VAL A 163 -1.190 -8.614 -2.380 1.00 20.01 H new ATOM 0 HG11 VAL A 163 -2.391 -7.047 -0.886 1.00 13.01 H new ATOM 0 HG12 VAL A 163 -1.507 -6.192 -2.172 1.00 13.01 H new ATOM 0 HG13 VAL A 163 -3.270 -6.397 -2.290 1.00 13.01 H new ATOM 0 HG21 VAL A 163 -3.324 -9.264 -1.273 1.00 71.21 H new ATOM 0 HG22 VAL A 163 -4.222 -8.697 -2.701 1.00 71.21 H new ATOM 0 HG23 VAL A 163 -3.117 -10.085 -2.838 1.00 71.21 H new ATOM 375 N ARG A 164 0.213 -7.266 -4.713 1.00 21.12 N ATOM 376 CA ARG A 164 1.302 -6.355 -5.074 1.00 35.10 C ATOM 377 C ARG A 164 1.030 -5.724 -6.441 1.00 53.01 C ATOM 378 O ARG A 164 1.184 -4.507 -6.625 1.00 62.22 O ATOM 379 CB ARG A 164 2.614 -7.132 -5.098 1.00 52.23 C ATOM 380 CG ARG A 164 3.866 -6.302 -5.275 1.00 73.03 C ATOM 381 CD ARG A 164 5.086 -7.203 -5.327 1.00 50.34 C ATOM 382 NE ARG A 164 5.099 -8.047 -6.539 1.00 61.13 N ATOM 383 CZ ARG A 164 5.457 -9.345 -6.578 1.00 40.22 C ATOM 384 NH1 ARG A 164 5.544 -10.050 -5.459 1.00 31.12 N ATOM 385 NH2 ARG A 164 5.622 -9.955 -7.746 1.00 25.01 N ATOM 0 H ARG A 164 0.516 -8.227 -4.558 1.00 21.12 H new ATOM 0 HA ARG A 164 1.370 -5.555 -4.337 1.00 35.10 H new ATOM 0 HB2 ARG A 164 2.700 -7.692 -4.167 1.00 52.23 H new ATOM 0 HB3 ARG A 164 2.567 -7.862 -5.906 1.00 52.23 H new ATOM 0 HG2 ARG A 164 3.797 -5.717 -6.192 1.00 73.03 H new ATOM 0 HG3 ARG A 164 3.962 -5.594 -4.452 1.00 73.03 H new ATOM 0 HD2 ARG A 164 5.989 -6.593 -5.300 1.00 50.34 H new ATOM 0 HD3 ARG A 164 5.105 -7.839 -4.442 1.00 50.34 H new ATOM 0 HE ARG A 164 4.814 -7.612 -7.417 1.00 61.13 H new ATOM 0 HH11 ARG A 164 5.339 -9.610 -4.562 1.00 31.12 H new ATOM 0 HH12 ARG A 164 5.816 -11.033 -5.495 1.00 31.12 H new ATOM 0 HH21 ARG A 164 5.478 -9.441 -8.615 1.00 25.01 H new ATOM 0 HH22 ARG A 164 5.893 -10.938 -7.774 1.00 25.01 H new ATOM 399 N ALA A 165 0.574 -6.551 -7.374 1.00 21.14 N ATOM 400 CA ALA A 165 0.238 -6.097 -8.707 1.00 51.12 C ATOM 401 C ALA A 165 -0.964 -5.171 -8.644 1.00 20.52 C ATOM 402 O ALA A 165 -0.996 -4.121 -9.278 1.00 72.05 O ATOM 403 CB ALA A 165 -0.050 -7.282 -9.618 1.00 21.01 C ATOM 0 H ALA A 165 0.429 -7.549 -7.224 1.00 21.14 H new ATOM 0 HA ALA A 165 1.086 -5.550 -9.119 1.00 51.12 H new ATOM 0 HB1 ALA A 165 -0.301 -6.921 -10.616 1.00 21.01 H new ATOM 0 HB2 ALA A 165 0.832 -7.921 -9.674 1.00 21.01 H new ATOM 0 HB3 ALA A 165 -0.887 -7.854 -9.218 1.00 21.01 H new ATOM 409 N HIS A 166 -1.918 -5.542 -7.828 1.00 3.04 N ATOM 410 CA HIS A 166 -3.133 -4.781 -7.666 1.00 75.00 C ATOM 411 C HIS A 166 -2.826 -3.418 -7.029 1.00 0.14 C ATOM 412 O HIS A 166 -3.396 -2.399 -7.419 1.00 14.42 O ATOM 413 CB HIS A 166 -4.150 -5.592 -6.840 1.00 30.35 C ATOM 414 CG HIS A 166 -5.530 -5.013 -6.767 1.00 73.34 C ATOM 415 ND1 HIS A 166 -6.564 -5.397 -7.586 1.00 1.35 N ATOM 416 CD2 HIS A 166 -6.050 -4.096 -5.926 1.00 1.21 C ATOM 417 CE1 HIS A 166 -7.650 -4.726 -7.227 1.00 31.52 C ATOM 418 NE2 HIS A 166 -7.394 -3.921 -6.221 1.00 70.31 N ATOM 0 H HIS A 166 -1.874 -6.384 -7.254 1.00 3.04 H new ATOM 0 HA HIS A 166 -3.578 -4.588 -8.642 1.00 75.00 H new ATOM 0 HB2 HIS A 166 -4.217 -6.595 -7.262 1.00 30.35 H new ATOM 0 HB3 HIS A 166 -3.765 -5.698 -5.826 1.00 30.35 H new ATOM 0 HD1 HIS A 166 -6.506 -6.081 -8.341 1.00 1.35 H new ATOM 0 HD2 HIS A 166 -5.507 -3.581 -5.148 1.00 1.21 H new ATOM 0 HE1 HIS A 166 -8.616 -4.828 -7.699 1.00 31.52 H new ATOM 426 N ILE A 167 -1.899 -3.402 -6.083 1.00 23.11 N ATOM 427 CA ILE A 167 -1.485 -2.168 -5.442 1.00 22.33 C ATOM 428 C ILE A 167 -0.866 -1.231 -6.460 1.00 54.30 C ATOM 429 O ILE A 167 -1.252 -0.064 -6.535 1.00 21.23 O ATOM 430 CB ILE A 167 -0.496 -2.387 -4.244 1.00 24.11 C ATOM 431 CG1 ILE A 167 -1.165 -3.190 -3.119 1.00 73.34 C ATOM 432 CG2 ILE A 167 0.017 -1.046 -3.703 1.00 54.51 C ATOM 433 CD1 ILE A 167 -0.246 -3.522 -1.956 1.00 13.11 C ATOM 0 H ILE A 167 -1.419 -4.235 -5.743 1.00 23.11 H new ATOM 0 HA ILE A 167 -2.387 -1.723 -5.023 1.00 22.33 H new ATOM 0 HB ILE A 167 0.354 -2.957 -4.618 1.00 24.11 H new ATOM 0 HG12 ILE A 167 -2.018 -2.625 -2.743 1.00 73.34 H new ATOM 0 HG13 ILE A 167 -1.556 -4.119 -3.534 1.00 73.34 H new ATOM 0 HG21 ILE A 167 0.701 -1.226 -2.873 1.00 54.51 H new ATOM 0 HG22 ILE A 167 0.541 -0.510 -4.495 1.00 54.51 H new ATOM 0 HG23 ILE A 167 -0.825 -0.448 -3.356 1.00 54.51 H new ATOM 0 HD11 ILE A 167 -0.798 -4.090 -1.207 1.00 13.11 H new ATOM 0 HD12 ILE A 167 0.595 -4.116 -2.315 1.00 13.11 H new ATOM 0 HD13 ILE A 167 0.126 -2.599 -1.511 1.00 13.11 H new ATOM 445 N VAL A 168 0.040 -1.738 -7.283 1.00 43.21 N ATOM 446 CA VAL A 168 0.710 -0.871 -8.241 1.00 63.42 C ATOM 447 C VAL A 168 -0.266 -0.352 -9.299 1.00 42.15 C ATOM 448 O VAL A 168 -0.211 0.812 -9.686 1.00 14.04 O ATOM 449 CB VAL A 168 2.021 -1.479 -8.871 1.00 60.31 C ATOM 450 CG1 VAL A 168 1.760 -2.755 -9.643 1.00 43.53 C ATOM 451 CG2 VAL A 168 2.739 -0.461 -9.756 1.00 53.31 C ATOM 0 H VAL A 168 0.323 -2.718 -7.309 1.00 43.21 H new ATOM 0 HA VAL A 168 1.065 -0.016 -7.665 1.00 63.42 H new ATOM 0 HB VAL A 168 2.670 -1.733 -8.033 1.00 60.31 H new ATOM 0 HG11 VAL A 168 2.697 -3.129 -10.055 1.00 43.53 H new ATOM 0 HG12 VAL A 168 1.332 -3.503 -8.975 1.00 43.53 H new ATOM 0 HG13 VAL A 168 1.062 -2.552 -10.455 1.00 43.53 H new ATOM 0 HG21 VAL A 168 3.638 -0.913 -10.174 1.00 53.31 H new ATOM 0 HG22 VAL A 168 2.078 -0.152 -10.566 1.00 53.31 H new ATOM 0 HG23 VAL A 168 3.014 0.409 -9.160 1.00 53.31 H new ATOM 461 N GLN A 169 -1.204 -1.183 -9.690 1.00 74.12 N ATOM 462 CA GLN A 169 -2.198 -0.786 -10.661 1.00 72.03 C ATOM 463 C GLN A 169 -3.157 0.239 -10.076 1.00 64.51 C ATOM 464 O GLN A 169 -3.388 1.300 -10.672 1.00 1.13 O ATOM 465 CB GLN A 169 -2.964 -1.989 -11.207 1.00 34.01 C ATOM 466 CG GLN A 169 -2.113 -2.970 -11.994 1.00 73.53 C ATOM 467 CD GLN A 169 -2.912 -4.152 -12.508 1.00 31.21 C ATOM 468 OE1 GLN A 169 -3.026 -5.189 -11.849 1.00 4.03 O ATOM 469 NE2 GLN A 169 -3.482 -4.004 -13.674 1.00 73.12 N ATOM 0 H GLN A 169 -1.300 -2.140 -9.350 1.00 74.12 H new ATOM 0 HA GLN A 169 -1.669 -0.323 -11.494 1.00 72.03 H new ATOM 0 HB2 GLN A 169 -3.429 -2.517 -10.374 1.00 34.01 H new ATOM 0 HB3 GLN A 169 -3.770 -1.631 -11.847 1.00 34.01 H new ATOM 0 HG2 GLN A 169 -1.654 -2.453 -12.836 1.00 73.53 H new ATOM 0 HG3 GLN A 169 -1.302 -3.331 -11.361 1.00 73.53 H new ATOM 0 HE21 GLN A 169 -3.366 -3.133 -14.191 1.00 73.12 H new ATOM 0 HE22 GLN A 169 -4.043 -4.760 -14.067 1.00 73.12 H new ATOM 478 N ARG A 170 -3.650 -0.027 -8.883 1.00 65.13 N ATOM 479 CA ARG A 170 -4.623 0.854 -8.286 1.00 55.41 C ATOM 480 C ARG A 170 -4.020 2.168 -7.867 1.00 43.14 C ATOM 481 O ARG A 170 -4.677 3.186 -7.922 1.00 25.45 O ATOM 482 CB ARG A 170 -5.391 0.191 -7.150 1.00 73.11 C ATOM 483 CG ARG A 170 -6.385 -0.863 -7.606 1.00 14.11 C ATOM 484 CD ARG A 170 -7.517 -0.236 -8.404 1.00 71.33 C ATOM 485 NE ARG A 170 -8.478 -1.231 -8.868 1.00 53.31 N ATOM 486 CZ ARG A 170 -9.744 -0.975 -9.218 1.00 1.12 C ATOM 487 NH1 ARG A 170 -10.225 0.265 -9.147 1.00 31.43 N ATOM 488 NH2 ARG A 170 -10.522 -1.958 -9.636 1.00 0.21 N ATOM 0 H ARG A 170 -3.395 -0.836 -8.317 1.00 65.13 H new ATOM 0 HA ARG A 170 -5.352 1.075 -9.065 1.00 55.41 H new ATOM 0 HB2 ARG A 170 -4.679 -0.269 -6.464 1.00 73.11 H new ATOM 0 HB3 ARG A 170 -5.924 0.959 -6.589 1.00 73.11 H new ATOM 0 HG2 ARG A 170 -5.875 -1.609 -8.216 1.00 14.11 H new ATOM 0 HG3 ARG A 170 -6.792 -1.384 -6.739 1.00 14.11 H new ATOM 0 HD2 ARG A 170 -8.029 0.502 -7.787 1.00 71.33 H new ATOM 0 HD3 ARG A 170 -7.104 0.296 -9.261 1.00 71.33 H new ATOM 0 HE ARG A 170 -8.160 -2.198 -8.931 1.00 53.31 H new ATOM 0 HH11 ARG A 170 -9.627 1.026 -8.824 1.00 31.43 H new ATOM 0 HH12 ARG A 170 -11.191 0.453 -9.415 1.00 31.43 H new ATOM 0 HH21 ARG A 170 -10.157 -2.909 -9.691 1.00 0.21 H new ATOM 0 HH22 ARG A 170 -11.487 -1.766 -9.903 1.00 0.21 H new ATOM 502 N THR A 171 -2.767 2.163 -7.488 1.00 73.12 N ATOM 503 CA THR A 171 -2.122 3.393 -7.139 1.00 1.00 C ATOM 504 C THR A 171 -1.881 4.245 -8.381 1.00 62.11 C ATOM 505 O THR A 171 -2.209 5.433 -8.388 1.00 11.23 O ATOM 506 CB THR A 171 -0.813 3.178 -6.353 1.00 50.51 C ATOM 507 OG1 THR A 171 0.018 2.229 -7.032 1.00 51.10 O ATOM 508 CG2 THR A 171 -1.105 2.694 -4.945 1.00 70.32 C ATOM 0 H THR A 171 -2.183 1.330 -7.415 1.00 73.12 H new ATOM 0 HA THR A 171 -2.799 3.928 -6.472 1.00 1.00 H new ATOM 0 HB THR A 171 -0.290 4.132 -6.290 1.00 50.51 H new ATOM 0 HG1 THR A 171 -0.268 1.320 -6.802 1.00 51.10 H new ATOM 0 HG21 THR A 171 -0.167 2.549 -4.408 1.00 70.32 H new ATOM 0 HG22 THR A 171 -1.710 3.435 -4.424 1.00 70.32 H new ATOM 0 HG23 THR A 171 -1.647 1.750 -4.990 1.00 70.32 H new ATOM 516 N SER A 172 -1.407 3.615 -9.463 1.00 2.32 N ATOM 517 CA SER A 172 -1.102 4.335 -10.682 1.00 73.13 C ATOM 518 C SER A 172 -2.372 4.941 -11.292 1.00 72.23 C ATOM 519 O SER A 172 -2.353 6.051 -11.831 1.00 73.44 O ATOM 520 CB SER A 172 -0.432 3.404 -11.681 1.00 62.51 C ATOM 521 OG SER A 172 0.735 2.810 -11.121 1.00 34.45 O ATOM 0 H SER A 172 -1.231 2.611 -9.509 1.00 2.32 H new ATOM 0 HA SER A 172 -0.420 5.150 -10.439 1.00 73.13 H new ATOM 0 HB2 SER A 172 -1.132 2.625 -11.983 1.00 62.51 H new ATOM 0 HB3 SER A 172 -0.166 3.960 -12.580 1.00 62.51 H new ATOM 0 HG SER A 172 0.528 1.899 -10.823 1.00 34.45 H new ATOM 527 N SER A 173 -3.471 4.225 -11.168 1.00 51.50 N ATOM 528 CA SER A 173 -4.721 4.669 -11.703 1.00 52.24 C ATOM 529 C SER A 173 -5.370 5.725 -10.772 1.00 35.30 C ATOM 530 O SER A 173 -6.117 6.588 -11.225 1.00 43.12 O ATOM 531 CB SER A 173 -5.647 3.459 -11.914 1.00 4.11 C ATOM 532 OG SER A 173 -6.793 3.790 -12.696 1.00 61.50 O ATOM 0 H SER A 173 -3.512 3.323 -10.693 1.00 51.50 H new ATOM 0 HA SER A 173 -4.552 5.148 -12.667 1.00 52.24 H new ATOM 0 HB2 SER A 173 -5.092 2.660 -12.405 1.00 4.11 H new ATOM 0 HB3 SER A 173 -5.968 3.076 -10.945 1.00 4.11 H new ATOM 0 HG SER A 173 -7.354 2.994 -12.808 1.00 61.50 H new ATOM 538 N ASN A 174 -5.033 5.686 -9.489 1.00 34.32 N ATOM 539 CA ASN A 174 -5.624 6.596 -8.509 1.00 45.12 C ATOM 540 C ASN A 174 -4.732 7.791 -8.181 1.00 64.33 C ATOM 541 O ASN A 174 -4.984 8.503 -7.205 1.00 13.41 O ATOM 542 CB ASN A 174 -6.050 5.863 -7.218 1.00 51.32 C ATOM 543 CG ASN A 174 -7.295 4.991 -7.386 1.00 12.15 C ATOM 544 OD1 ASN A 174 -8.146 5.255 -8.232 1.00 43.43 O ATOM 545 ND2 ASN A 174 -7.424 3.976 -6.567 1.00 54.15 N ATOM 0 H ASN A 174 -4.352 5.034 -9.100 1.00 34.32 H new ATOM 0 HA ASN A 174 -6.520 6.991 -8.987 1.00 45.12 H new ATOM 0 HB2 ASN A 174 -5.224 5.239 -6.876 1.00 51.32 H new ATOM 0 HB3 ASN A 174 -6.237 6.600 -6.437 1.00 51.32 H new ATOM 0 HD21 ASN A 174 -8.249 3.379 -6.621 1.00 54.15 H new ATOM 0 HD22 ASN A 174 -6.699 3.783 -5.876 1.00 54.15 H new ATOM 552 N ASP A 175 -3.711 8.020 -9.020 1.00 52.15 N ATOM 553 CA ASP A 175 -2.748 9.173 -8.892 1.00 24.40 C ATOM 554 C ASP A 175 -1.886 9.057 -7.641 1.00 73.33 C ATOM 555 O ASP A 175 -1.339 10.041 -7.149 1.00 12.13 O ATOM 556 CB ASP A 175 -3.466 10.549 -8.890 1.00 32.43 C ATOM 557 CG ASP A 175 -4.254 10.834 -10.142 1.00 42.51 C ATOM 558 OD1 ASP A 175 -5.449 10.462 -10.200 1.00 74.45 O ATOM 559 OD2 ASP A 175 -3.721 11.443 -11.086 1.00 12.25 O ATOM 0 H ASP A 175 -3.511 7.418 -9.819 1.00 52.15 H new ATOM 0 HA ASP A 175 -2.108 9.118 -9.773 1.00 24.40 H new ATOM 0 HB2 ASP A 175 -4.138 10.595 -8.033 1.00 32.43 H new ATOM 0 HB3 ASP A 175 -2.722 11.334 -8.755 1.00 32.43 H new ATOM 564 N ILE A 176 -1.724 7.858 -7.165 1.00 31.41 N ATOM 565 CA ILE A 176 -0.953 7.604 -5.979 1.00 13.44 C ATOM 566 C ILE A 176 0.405 7.044 -6.418 1.00 70.12 C ATOM 567 O ILE A 176 0.468 6.105 -7.214 1.00 41.44 O ATOM 568 CB ILE A 176 -1.659 6.549 -5.084 1.00 33.31 C ATOM 569 CG1 ILE A 176 -3.145 6.908 -4.879 1.00 10.24 C ATOM 570 CG2 ILE A 176 -0.950 6.454 -3.743 1.00 13.44 C ATOM 571 CD1 ILE A 176 -3.928 5.894 -4.070 1.00 53.44 C ATOM 0 H ILE A 176 -2.125 7.022 -7.590 1.00 31.41 H new ATOM 0 HA ILE A 176 -0.841 8.527 -5.410 1.00 13.44 H new ATOM 0 HB ILE A 176 -1.611 5.582 -5.584 1.00 33.31 H new ATOM 0 HG12 ILE A 176 -3.207 7.877 -4.383 1.00 10.24 H new ATOM 0 HG13 ILE A 176 -3.617 7.019 -5.855 1.00 10.24 H new ATOM 0 HG21 ILE A 176 -1.449 5.713 -3.119 1.00 13.44 H new ATOM 0 HG22 ILE A 176 0.087 6.157 -3.900 1.00 13.44 H new ATOM 0 HG23 ILE A 176 -0.979 7.424 -3.247 1.00 13.44 H new ATOM 0 HD11 ILE A 176 -4.962 6.225 -3.975 1.00 53.44 H new ATOM 0 HD12 ILE A 176 -3.901 4.928 -4.574 1.00 53.44 H new ATOM 0 HD13 ILE A 176 -3.485 5.799 -3.079 1.00 53.44 H new ATOM 583 N THR A 177 1.464 7.608 -5.928 1.00 42.55 N ATOM 584 CA THR A 177 2.787 7.174 -6.290 1.00 73.31 C ATOM 585 C THR A 177 3.291 6.194 -5.224 1.00 51.14 C ATOM 586 O THR A 177 2.939 6.320 -4.056 1.00 72.40 O ATOM 587 CB THR A 177 3.721 8.410 -6.381 1.00 22.12 C ATOM 588 OG1 THR A 177 3.143 9.359 -7.297 1.00 64.52 O ATOM 589 CG2 THR A 177 5.115 8.032 -6.870 1.00 13.35 C ATOM 0 H THR A 177 1.441 8.383 -5.265 1.00 42.55 H new ATOM 0 HA THR A 177 2.775 6.674 -7.258 1.00 73.31 H new ATOM 0 HB THR A 177 3.820 8.838 -5.383 1.00 22.12 H new ATOM 0 HG1 THR A 177 3.723 10.146 -7.362 1.00 64.52 H new ATOM 0 HG21 THR A 177 5.738 8.925 -6.920 1.00 13.35 H new ATOM 0 HG22 THR A 177 5.561 7.316 -6.179 1.00 13.35 H new ATOM 0 HG23 THR A 177 5.044 7.584 -7.861 1.00 13.35 H new ATOM 597 N LEU A 178 4.050 5.206 -5.618 1.00 54.43 N ATOM 598 CA LEU A 178 4.606 4.269 -4.661 1.00 63.31 C ATOM 599 C LEU A 178 5.902 4.833 -4.116 1.00 31.52 C ATOM 600 O LEU A 178 6.654 5.489 -4.838 1.00 74.40 O ATOM 601 CB LEU A 178 4.926 2.911 -5.316 1.00 35.33 C ATOM 602 CG LEU A 178 3.788 2.125 -5.972 1.00 10.01 C ATOM 603 CD1 LEU A 178 4.336 0.869 -6.625 1.00 11.42 C ATOM 604 CD2 LEU A 178 2.734 1.752 -4.963 1.00 21.30 C ATOM 0 H LEU A 178 4.300 5.024 -6.590 1.00 54.43 H new ATOM 0 HA LEU A 178 3.868 4.120 -3.873 1.00 63.31 H new ATOM 0 HB2 LEU A 178 5.690 3.082 -6.075 1.00 35.33 H new ATOM 0 HB3 LEU A 178 5.372 2.273 -4.553 1.00 35.33 H new ATOM 0 HG LEU A 178 3.330 2.761 -6.729 1.00 10.01 H new ATOM 0 HD11 LEU A 178 3.520 0.315 -7.090 1.00 11.42 H new ATOM 0 HD12 LEU A 178 5.067 1.144 -7.385 1.00 11.42 H new ATOM 0 HD13 LEU A 178 4.814 0.245 -5.870 1.00 11.42 H new ATOM 0 HD21 LEU A 178 1.938 1.195 -5.457 1.00 21.30 H new ATOM 0 HD22 LEU A 178 3.179 1.134 -4.183 1.00 21.30 H new ATOM 0 HD23 LEU A 178 2.320 2.657 -4.517 1.00 21.30 H new ATOM 616 N ARG A 179 6.136 4.613 -2.863 1.00 40.31 N ATOM 617 CA ARG A 179 7.389 4.955 -2.247 1.00 71.03 C ATOM 618 C ARG A 179 8.143 3.639 -2.164 1.00 33.52 C ATOM 619 O ARG A 179 9.233 3.488 -2.715 1.00 62.44 O ATOM 620 CB ARG A 179 7.117 5.593 -0.852 1.00 64.45 C ATOM 621 CG ARG A 179 8.241 6.424 -0.171 1.00 24.24 C ATOM 622 CD ARG A 179 9.416 5.609 0.379 1.00 33.13 C ATOM 623 NE ARG A 179 10.373 5.183 -0.638 1.00 74.40 N ATOM 624 CZ ARG A 179 11.311 4.245 -0.454 1.00 61.03 C ATOM 625 NH1 ARG A 179 11.341 3.549 0.677 1.00 71.21 N ATOM 626 NH2 ARG A 179 12.192 3.984 -1.418 1.00 11.21 N ATOM 0 H ARG A 179 5.461 4.187 -2.228 1.00 40.31 H new ATOM 0 HA ARG A 179 7.972 5.692 -2.800 1.00 71.03 H new ATOM 0 HB2 ARG A 179 6.244 6.238 -0.950 1.00 64.45 H new ATOM 0 HB3 ARG A 179 6.844 4.788 -0.170 1.00 64.45 H new ATOM 0 HG2 ARG A 179 8.626 7.144 -0.893 1.00 24.24 H new ATOM 0 HG3 ARG A 179 7.803 6.996 0.647 1.00 24.24 H new ATOM 0 HD2 ARG A 179 9.939 6.204 1.128 1.00 33.13 H new ATOM 0 HD3 ARG A 179 9.026 4.727 0.888 1.00 33.13 H new ATOM 0 HE ARG A 179 10.324 5.631 -1.553 1.00 74.40 H new ATOM 0 HH11 ARG A 179 10.650 3.729 1.405 1.00 71.21 H new ATOM 0 HH12 ARG A 179 12.055 2.835 0.817 1.00 71.21 H new ATOM 0 HH21 ARG A 179 12.153 4.499 -2.298 1.00 11.21 H new ATOM 0 HH22 ARG A 179 12.906 3.269 -1.277 1.00 11.21 H new ATOM 640 N GLY A 180 7.503 2.677 -1.560 1.00 65.44 N ATOM 641 CA GLY A 180 8.047 1.348 -1.457 1.00 23.02 C ATOM 642 C GLY A 180 7.090 0.441 -0.763 1.00 42.53 C ATOM 643 O GLY A 180 6.218 0.902 -0.050 1.00 24.11 O ATOM 0 H GLY A 180 6.588 2.791 -1.124 1.00 65.44 H new ATOM 0 HA2 GLY A 180 8.266 0.961 -2.452 1.00 23.02 H new ATOM 0 HA3 GLY A 180 8.990 1.377 -0.911 1.00 23.02 H new ATOM 647 N ILE A 181 7.242 -0.823 -0.957 1.00 23.22 N ATOM 648 CA ILE A 181 6.345 -1.799 -0.372 1.00 31.25 C ATOM 649 C ILE A 181 7.151 -2.811 0.426 1.00 23.33 C ATOM 650 O ILE A 181 7.976 -3.532 -0.132 1.00 4.23 O ATOM 651 CB ILE A 181 5.505 -2.547 -1.461 1.00 73.52 C ATOM 652 CG1 ILE A 181 4.708 -1.546 -2.324 1.00 33.21 C ATOM 653 CG2 ILE A 181 4.556 -3.560 -0.807 1.00 1.34 C ATOM 654 CD1 ILE A 181 3.920 -2.181 -3.458 1.00 64.04 C ATOM 0 H ILE A 181 7.988 -1.225 -1.524 1.00 23.22 H new ATOM 0 HA ILE A 181 5.651 -1.267 0.279 1.00 31.25 H new ATOM 0 HB ILE A 181 6.196 -3.085 -2.110 1.00 73.52 H new ATOM 0 HG12 ILE A 181 4.019 -0.999 -1.681 1.00 33.21 H new ATOM 0 HG13 ILE A 181 5.400 -0.816 -2.743 1.00 33.21 H new ATOM 0 HG21 ILE A 181 3.980 -4.070 -1.579 1.00 1.34 H new ATOM 0 HG22 ILE A 181 5.136 -4.291 -0.244 1.00 1.34 H new ATOM 0 HG23 ILE A 181 3.876 -3.039 -0.133 1.00 1.34 H new ATOM 0 HD11 ILE A 181 3.391 -1.406 -4.012 1.00 64.04 H new ATOM 0 HD12 ILE A 181 4.603 -2.703 -4.128 1.00 64.04 H new ATOM 0 HD13 ILE A 181 3.200 -2.890 -3.049 1.00 64.04 H new ATOM 666 N ARG A 182 6.929 -2.859 1.708 1.00 74.21 N ATOM 667 CA ARG A 182 7.626 -3.796 2.552 1.00 35.14 C ATOM 668 C ARG A 182 6.702 -4.954 2.841 1.00 13.35 C ATOM 669 O ARG A 182 5.632 -4.771 3.428 1.00 21.51 O ATOM 670 CB ARG A 182 8.088 -3.130 3.850 1.00 13.11 C ATOM 671 CG ARG A 182 9.049 -1.980 3.635 1.00 73.45 C ATOM 672 CD ARG A 182 9.449 -1.328 4.946 1.00 40.42 C ATOM 673 NE ARG A 182 10.427 -0.258 4.728 1.00 73.21 N ATOM 674 CZ ARG A 182 10.565 0.844 5.478 1.00 20.33 C ATOM 675 NH1 ARG A 182 9.826 1.015 6.579 1.00 33.32 N ATOM 676 NH2 ARG A 182 11.456 1.760 5.130 1.00 1.40 N ATOM 0 H ARG A 182 6.267 -2.257 2.198 1.00 74.21 H new ATOM 0 HA ARG A 182 8.520 -4.154 2.041 1.00 35.14 H new ATOM 0 HB2 ARG A 182 7.215 -2.766 4.392 1.00 13.11 H new ATOM 0 HB3 ARG A 182 8.566 -3.878 4.482 1.00 13.11 H new ATOM 0 HG2 ARG A 182 9.940 -2.342 3.122 1.00 73.45 H new ATOM 0 HG3 ARG A 182 8.587 -1.237 2.985 1.00 73.45 H new ATOM 0 HD2 ARG A 182 8.565 -0.922 5.438 1.00 40.42 H new ATOM 0 HD3 ARG A 182 9.870 -2.078 5.615 1.00 40.42 H new ATOM 0 HE ARG A 182 11.059 -0.362 3.934 1.00 73.21 H new ATOM 0 HH11 ARG A 182 9.150 0.303 6.855 1.00 33.32 H new ATOM 0 HH12 ARG A 182 9.939 1.857 7.143 1.00 33.32 H new ATOM 0 HH21 ARG A 182 12.030 1.623 4.298 1.00 1.40 H new ATOM 0 HH22 ARG A 182 11.569 2.602 5.694 1.00 1.40 H new ATOM 690 N THR A 183 7.083 -6.113 2.405 1.00 3.30 N ATOM 691 CA THR A 183 6.270 -7.280 2.559 1.00 11.00 C ATOM 692 C THR A 183 6.929 -8.252 3.532 1.00 14.22 C ATOM 693 O THR A 183 8.139 -8.514 3.441 1.00 72.22 O ATOM 694 CB THR A 183 5.983 -7.947 1.169 1.00 61.14 C ATOM 695 OG1 THR A 183 5.250 -9.165 1.319 1.00 1.31 O ATOM 696 CG2 THR A 183 7.262 -8.213 0.386 1.00 31.01 C ATOM 0 H THR A 183 7.970 -6.278 1.930 1.00 3.30 H new ATOM 0 HA THR A 183 5.307 -6.989 2.978 1.00 11.00 H new ATOM 0 HB THR A 183 5.380 -7.236 0.605 1.00 61.14 H new ATOM 0 HG1 THR A 183 5.691 -9.877 0.810 1.00 1.31 H new ATOM 0 HG21 THR A 183 7.014 -8.675 -0.569 1.00 31.01 H new ATOM 0 HG22 THR A 183 7.783 -7.272 0.209 1.00 31.01 H new ATOM 0 HG23 THR A 183 7.906 -8.882 0.957 1.00 31.01 H new ATOM 704 N GLY A 184 6.166 -8.750 4.477 1.00 20.20 N ATOM 705 CA GLY A 184 6.710 -9.665 5.434 1.00 52.23 C ATOM 706 C GLY A 184 5.713 -10.718 5.864 1.00 55.54 C ATOM 707 O GLY A 184 4.529 -10.403 6.073 1.00 22.13 O ATOM 0 H GLY A 184 5.176 -8.535 4.598 1.00 20.20 H new ATOM 0 HA2 GLY A 184 7.587 -10.153 5.007 1.00 52.23 H new ATOM 0 HA3 GLY A 184 7.048 -9.111 6.310 1.00 52.23 H new ATOM 711 N PRO A 185 6.143 -11.978 5.985 1.00 15.32 N ATOM 712 CA PRO A 185 5.293 -13.076 6.468 1.00 64.43 C ATOM 713 C PRO A 185 4.953 -12.889 7.945 1.00 64.52 C ATOM 714 O PRO A 185 5.716 -12.251 8.686 1.00 74.42 O ATOM 715 CB PRO A 185 6.176 -14.314 6.260 1.00 4.10 C ATOM 716 CG PRO A 185 7.567 -13.796 6.284 1.00 43.12 C ATOM 717 CD PRO A 185 7.502 -12.451 5.645 1.00 54.53 C ATOM 0 HA PRO A 185 4.336 -13.140 5.951 1.00 64.43 H new ATOM 0 HB2 PRO A 185 6.015 -15.051 7.046 1.00 4.10 H new ATOM 0 HB3 PRO A 185 5.953 -14.804 5.313 1.00 4.10 H new ATOM 0 HG2 PRO A 185 7.943 -13.728 7.305 1.00 43.12 H new ATOM 0 HG3 PRO A 185 8.241 -14.457 5.740 1.00 43.12 H new ATOM 0 HD2 PRO A 185 8.270 -11.783 6.035 1.00 54.53 H new ATOM 0 HD3 PRO A 185 7.649 -12.510 4.567 1.00 54.53 H new ATOM 725 N ALA A 186 3.807 -13.387 8.367 1.00 44.12 N ATOM 726 CA ALA A 186 3.391 -13.233 9.753 1.00 30.22 C ATOM 727 C ALA A 186 3.391 -14.563 10.508 1.00 52.22 C ATOM 728 O ALA A 186 3.013 -14.626 11.680 1.00 43.01 O ATOM 729 CB ALA A 186 2.040 -12.555 9.833 1.00 72.22 C ATOM 0 H ALA A 186 3.150 -13.898 7.778 1.00 44.12 H new ATOM 0 HA ALA A 186 4.125 -12.594 10.244 1.00 30.22 H new ATOM 0 HB1 ALA A 186 1.747 -12.449 10.878 1.00 72.22 H new ATOM 0 HB2 ALA A 186 2.100 -11.569 9.371 1.00 72.22 H new ATOM 0 HB3 ALA A 186 1.299 -13.157 9.308 1.00 72.22 H new ATOM 735 N GLY A 187 3.802 -15.610 9.844 1.00 53.13 N ATOM 736 CA GLY A 187 3.929 -16.880 10.478 1.00 41.42 C ATOM 737 C GLY A 187 3.022 -17.939 9.904 1.00 52.41 C ATOM 738 O GLY A 187 3.443 -18.726 9.059 1.00 5.32 O ATOM 0 H GLY A 187 4.055 -15.600 8.856 1.00 53.13 H new ATOM 0 HA2 GLY A 187 4.963 -17.216 10.395 1.00 41.42 H new ATOM 0 HA3 GLY A 187 3.715 -16.768 11.541 1.00 41.42 H new ATOM 742 N ASP A 188 1.775 -17.908 10.346 1.00 24.35 N ATOM 743 CA ASP A 188 0.714 -18.887 10.024 1.00 24.32 C ATOM 744 C ASP A 188 0.622 -19.173 8.539 1.00 43.14 C ATOM 745 O ASP A 188 1.155 -20.178 8.054 1.00 20.32 O ATOM 746 CB ASP A 188 -0.632 -18.351 10.536 1.00 52.35 C ATOM 747 CG ASP A 188 -0.652 -18.158 12.030 1.00 70.20 C ATOM 748 OD1 ASP A 188 0.062 -17.255 12.532 1.00 42.13 O ATOM 749 OD2 ASP A 188 -1.362 -18.897 12.743 1.00 33.30 O ATOM 0 H ASP A 188 1.446 -17.171 10.969 1.00 24.35 H new ATOM 0 HA ASP A 188 0.965 -19.827 10.515 1.00 24.32 H new ATOM 0 HB2 ASP A 188 -0.849 -17.401 10.048 1.00 52.35 H new ATOM 0 HB3 ASP A 188 -1.425 -19.043 10.253 1.00 52.35 H new ATOM 754 N ASP A 189 -0.027 -18.290 7.845 1.00 3.42 N ATOM 755 CA ASP A 189 -0.145 -18.287 6.401 1.00 63.42 C ATOM 756 C ASP A 189 -0.735 -16.989 5.999 1.00 20.23 C ATOM 757 O ASP A 189 -1.896 -16.847 5.601 1.00 22.03 O ATOM 758 CB ASP A 189 -0.820 -19.531 5.725 1.00 41.15 C ATOM 759 CG ASP A 189 -2.273 -19.801 6.060 1.00 24.21 C ATOM 760 OD1 ASP A 189 -2.547 -20.432 7.104 1.00 31.11 O ATOM 761 OD2 ASP A 189 -3.165 -19.493 5.225 1.00 1.13 O ATOM 0 H ASP A 189 -0.516 -17.509 8.282 1.00 3.42 H new ATOM 0 HA ASP A 189 0.864 -18.396 6.004 1.00 63.42 H new ATOM 0 HB2 ASP A 189 -0.739 -19.413 4.644 1.00 41.15 H new ATOM 0 HB3 ASP A 189 -0.242 -20.415 5.993 1.00 41.15 H new ATOM 766 N ASN A 190 0.052 -16.018 6.255 1.00 61.42 N ATOM 767 CA ASN A 190 -0.233 -14.653 5.999 1.00 52.45 C ATOM 768 C ASN A 190 0.988 -13.866 5.794 1.00 63.22 C ATOM 769 O ASN A 190 2.028 -14.114 6.386 1.00 43.25 O ATOM 770 CB ASN A 190 -1.110 -13.957 7.056 1.00 62.11 C ATOM 771 CG ASN A 190 -0.921 -14.397 8.523 1.00 2.53 C ATOM 772 OD1 ASN A 190 -0.672 -15.554 8.838 1.00 30.15 O ATOM 773 ND2 ASN A 190 -1.018 -13.467 9.427 1.00 50.14 N ATOM 0 H ASN A 190 0.971 -16.158 6.675 1.00 61.42 H new ATOM 0 HA ASN A 190 -0.819 -14.685 5.080 1.00 52.45 H new ATOM 0 HB2 ASN A 190 -0.924 -12.885 6.997 1.00 62.11 H new ATOM 0 HB3 ASN A 190 -2.154 -14.115 6.787 1.00 62.11 H new ATOM 0 HD21 ASN A 190 -0.886 -13.697 10.412 1.00 50.14 H new ATOM 0 HD22 ASN A 190 -1.226 -12.507 9.151 1.00 50.14 H new ATOM 780 N ILE A 191 0.835 -12.899 4.998 1.00 21.10 N ATOM 781 CA ILE A 191 1.883 -12.008 4.625 1.00 1.22 C ATOM 782 C ILE A 191 1.286 -10.611 4.607 1.00 4.02 C ATOM 783 O ILE A 191 0.197 -10.399 4.041 1.00 1.30 O ATOM 784 CB ILE A 191 2.482 -12.396 3.221 1.00 22.43 C ATOM 785 CG1 ILE A 191 3.592 -13.452 3.385 1.00 61.13 C ATOM 786 CG2 ILE A 191 3.041 -11.176 2.498 1.00 31.12 C ATOM 787 CD1 ILE A 191 4.172 -13.971 2.083 1.00 1.01 C ATOM 0 H ILE A 191 -0.059 -12.680 4.558 1.00 21.10 H new ATOM 0 HA ILE A 191 2.709 -12.061 5.334 1.00 1.22 H new ATOM 0 HB ILE A 191 1.672 -12.810 2.621 1.00 22.43 H new ATOM 0 HG12 ILE A 191 4.398 -13.022 3.980 1.00 61.13 H new ATOM 0 HG13 ILE A 191 3.193 -14.294 3.950 1.00 61.13 H new ATOM 0 HG21 ILE A 191 3.446 -11.479 1.533 1.00 31.12 H new ATOM 0 HG22 ILE A 191 2.245 -10.448 2.345 1.00 31.12 H new ATOM 0 HG23 ILE A 191 3.832 -10.728 3.099 1.00 31.12 H new ATOM 0 HD11 ILE A 191 4.945 -14.709 2.298 1.00 1.01 H new ATOM 0 HD12 ILE A 191 3.382 -14.434 1.492 1.00 1.01 H new ATOM 0 HD13 ILE A 191 4.606 -13.143 1.523 1.00 1.01 H new ATOM 799 N THR A 192 1.940 -9.696 5.244 1.00 25.32 N ATOM 800 CA THR A 192 1.448 -8.360 5.321 1.00 15.55 C ATOM 801 C THR A 192 2.324 -7.455 4.459 1.00 24.24 C ATOM 802 O THR A 192 3.558 -7.493 4.557 1.00 65.43 O ATOM 803 CB THR A 192 1.452 -7.861 6.780 1.00 30.23 C ATOM 804 OG1 THR A 192 0.929 -8.890 7.656 1.00 13.30 O ATOM 805 CG2 THR A 192 0.581 -6.635 6.923 1.00 52.21 C ATOM 0 H THR A 192 2.826 -9.852 5.724 1.00 25.32 H new ATOM 0 HA THR A 192 0.421 -8.337 4.956 1.00 15.55 H new ATOM 0 HB THR A 192 2.480 -7.618 7.050 1.00 30.23 H new ATOM 0 HG1 THR A 192 0.936 -8.567 8.581 1.00 13.30 H new ATOM 0 HG21 THR A 192 0.596 -6.297 7.959 1.00 52.21 H new ATOM 0 HG22 THR A 192 0.959 -5.843 6.277 1.00 52.21 H new ATOM 0 HG23 THR A 192 -0.442 -6.880 6.636 1.00 52.21 H new ATOM 813 N LEU A 193 1.698 -6.705 3.594 1.00 0.31 N ATOM 814 CA LEU A 193 2.390 -5.767 2.745 1.00 4.12 C ATOM 815 C LEU A 193 2.093 -4.377 3.229 1.00 75.32 C ATOM 816 O LEU A 193 0.929 -3.986 3.293 1.00 0.01 O ATOM 817 CB LEU A 193 1.953 -5.855 1.255 1.00 62.04 C ATOM 818 CG LEU A 193 2.214 -7.157 0.472 1.00 3.31 C ATOM 819 CD1 LEU A 193 1.299 -8.277 0.922 1.00 50.13 C ATOM 820 CD2 LEU A 193 2.061 -6.910 -1.022 1.00 52.25 C ATOM 0 H LEU A 193 0.688 -6.726 3.455 1.00 0.31 H new ATOM 0 HA LEU A 193 3.451 -6.009 2.797 1.00 4.12 H new ATOM 0 HB2 LEU A 193 0.882 -5.657 1.215 1.00 62.04 H new ATOM 0 HB3 LEU A 193 2.448 -5.045 0.719 1.00 62.04 H new ATOM 0 HG LEU A 193 3.237 -7.470 0.679 1.00 3.31 H new ATOM 0 HD11 LEU A 193 1.515 -9.177 0.346 1.00 50.13 H new ATOM 0 HD12 LEU A 193 1.462 -8.476 1.981 1.00 50.13 H new ATOM 0 HD13 LEU A 193 0.261 -7.985 0.763 1.00 50.13 H new ATOM 0 HD21 LEU A 193 2.248 -7.837 -1.565 1.00 52.25 H new ATOM 0 HD22 LEU A 193 1.049 -6.564 -1.232 1.00 52.25 H new ATOM 0 HD23 LEU A 193 2.777 -6.152 -1.341 1.00 52.25 H new ATOM 832 N THR A 194 3.101 -3.656 3.613 1.00 12.52 N ATOM 833 CA THR A 194 2.913 -2.293 3.960 1.00 63.43 C ATOM 834 C THR A 194 3.393 -1.451 2.782 1.00 4.41 C ATOM 835 O THR A 194 4.592 -1.416 2.444 1.00 23.04 O ATOM 836 CB THR A 194 3.567 -1.899 5.344 1.00 51.13 C ATOM 837 OG1 THR A 194 3.179 -0.583 5.746 1.00 22.33 O ATOM 838 CG2 THR A 194 5.083 -2.012 5.354 1.00 50.52 C ATOM 0 H THR A 194 4.060 -3.994 3.692 1.00 12.52 H new ATOM 0 HA THR A 194 1.855 -2.097 4.134 1.00 63.43 H new ATOM 0 HB THR A 194 3.187 -2.627 6.061 1.00 51.13 H new ATOM 0 HG1 THR A 194 3.597 -0.367 6.606 1.00 22.33 H new ATOM 0 HG21 THR A 194 5.463 -1.726 6.335 1.00 50.52 H new ATOM 0 HG22 THR A 194 5.373 -3.040 5.138 1.00 50.52 H new ATOM 0 HG23 THR A 194 5.502 -1.350 4.596 1.00 50.52 H new ATOM 846 N ALA A 195 2.454 -0.884 2.094 1.00 54.34 N ATOM 847 CA ALA A 195 2.738 -0.128 0.925 1.00 3.40 C ATOM 848 C ALA A 195 2.846 1.322 1.272 1.00 32.10 C ATOM 849 O ALA A 195 1.850 1.969 1.589 1.00 64.21 O ATOM 850 CB ALA A 195 1.666 -0.353 -0.130 1.00 34.45 C ATOM 0 H ALA A 195 1.464 -0.935 2.332 1.00 54.34 H new ATOM 0 HA ALA A 195 3.691 -0.460 0.512 1.00 3.40 H new ATOM 0 HB1 ALA A 195 1.900 0.234 -1.018 1.00 34.45 H new ATOM 0 HB2 ALA A 195 1.630 -1.410 -0.393 1.00 34.45 H new ATOM 0 HB3 ALA A 195 0.698 -0.044 0.264 1.00 34.45 H new ATOM 856 N HIS A 196 4.049 1.817 1.241 1.00 65.20 N ATOM 857 CA HIS A 196 4.314 3.191 1.512 1.00 60.44 C ATOM 858 C HIS A 196 4.099 3.913 0.218 1.00 23.30 C ATOM 859 O HIS A 196 4.723 3.591 -0.798 1.00 60.24 O ATOM 860 CB HIS A 196 5.761 3.401 2.006 1.00 34.22 C ATOM 861 CG HIS A 196 6.121 2.667 3.275 1.00 54.41 C ATOM 862 ND1 HIS A 196 6.299 3.281 4.496 1.00 73.32 N ATOM 863 CD2 HIS A 196 6.391 1.352 3.480 1.00 1.51 C ATOM 864 CE1 HIS A 196 6.665 2.348 5.382 1.00 5.40 C ATOM 865 NE2 HIS A 196 6.737 1.156 4.814 1.00 74.40 N ATOM 0 H HIS A 196 4.880 1.267 1.024 1.00 65.20 H new ATOM 0 HA HIS A 196 3.660 3.563 2.301 1.00 60.44 H new ATOM 0 HB2 HIS A 196 6.446 3.088 1.218 1.00 34.22 H new ATOM 0 HB3 HIS A 196 5.923 4.467 2.164 1.00 34.22 H new ATOM 0 HD1 HIS A 196 6.173 4.274 4.690 1.00 73.32 H new ATOM 0 HD2 HIS A 196 6.345 0.580 2.726 1.00 1.51 H new ATOM 0 HE1 HIS A 196 6.874 2.543 6.424 1.00 5.40 H new ATOM 873 N LEU A 197 3.202 4.806 0.232 1.00 42.14 N ATOM 874 CA LEU A 197 2.780 5.516 -0.924 1.00 1.30 C ATOM 875 C LEU A 197 3.016 6.991 -0.710 1.00 63.51 C ATOM 876 O LEU A 197 3.170 7.447 0.413 1.00 23.44 O ATOM 877 CB LEU A 197 1.271 5.305 -1.081 1.00 41.43 C ATOM 878 CG LEU A 197 0.771 3.859 -0.999 1.00 24.01 C ATOM 879 CD1 LEU A 197 -0.734 3.810 -1.064 1.00 63.21 C ATOM 880 CD2 LEU A 197 1.364 3.027 -2.102 1.00 2.43 C ATOM 0 H LEU A 197 2.711 5.085 1.081 1.00 42.14 H new ATOM 0 HA LEU A 197 3.326 5.167 -1.800 1.00 1.30 H new ATOM 0 HB2 LEU A 197 0.763 5.886 -0.311 1.00 41.43 H new ATOM 0 HB3 LEU A 197 0.967 5.717 -2.043 1.00 41.43 H new ATOM 0 HG LEU A 197 1.091 3.447 -0.042 1.00 24.01 H new ATOM 0 HD11 LEU A 197 -1.067 2.774 -1.004 1.00 63.21 H new ATOM 0 HD12 LEU A 197 -1.153 4.375 -0.231 1.00 63.21 H new ATOM 0 HD13 LEU A 197 -1.072 4.246 -2.004 1.00 63.21 H new ATOM 0 HD21 LEU A 197 0.995 2.004 -2.025 1.00 2.43 H new ATOM 0 HD22 LEU A 197 1.077 3.444 -3.067 1.00 2.43 H new ATOM 0 HD23 LEU A 197 2.451 3.029 -2.015 1.00 2.43 H new ATOM 892 N LEU A 198 3.053 7.699 -1.771 1.00 40.31 N ATOM 893 CA LEU A 198 3.117 9.132 -1.775 1.00 15.14 C ATOM 894 C LEU A 198 1.893 9.585 -2.537 1.00 73.23 C ATOM 895 O LEU A 198 1.733 9.248 -3.715 1.00 32.41 O ATOM 896 CB LEU A 198 4.395 9.611 -2.485 1.00 23.55 C ATOM 897 CG LEU A 198 5.733 9.240 -1.830 1.00 64.52 C ATOM 898 CD1 LEU A 198 6.888 9.696 -2.703 1.00 32.43 C ATOM 899 CD2 LEU A 198 5.848 9.863 -0.446 1.00 64.23 C ATOM 0 H LEU A 198 3.040 7.293 -2.707 1.00 40.31 H new ATOM 0 HA LEU A 198 3.142 9.539 -0.764 1.00 15.14 H new ATOM 0 HB2 LEU A 198 4.391 9.210 -3.499 1.00 23.55 H new ATOM 0 HB3 LEU A 198 4.349 10.697 -2.571 1.00 23.55 H new ATOM 0 HG LEU A 198 5.773 8.156 -1.725 1.00 64.52 H new ATOM 0 HD11 LEU A 198 7.831 9.427 -2.228 1.00 32.43 H new ATOM 0 HD12 LEU A 198 6.821 9.211 -3.677 1.00 32.43 H new ATOM 0 HD13 LEU A 198 6.842 10.777 -2.832 1.00 32.43 H new ATOM 0 HD21 LEU A 198 6.804 9.587 -0.001 1.00 64.23 H new ATOM 0 HD22 LEU A 198 5.787 10.948 -0.529 1.00 64.23 H new ATOM 0 HD23 LEU A 198 5.036 9.501 0.185 1.00 64.23 H new ATOM 911 N MET A 199 1.007 10.272 -1.886 1.00 0.11 N ATOM 912 CA MET A 199 -0.231 10.664 -2.525 1.00 51.14 C ATOM 913 C MET A 199 -0.281 12.187 -2.602 1.00 54.23 C ATOM 914 O MET A 199 0.198 12.868 -1.686 1.00 44.24 O ATOM 915 CB MET A 199 -1.405 10.078 -1.728 1.00 33.22 C ATOM 916 CG MET A 199 -2.675 9.806 -2.520 1.00 21.11 C ATOM 917 SD MET A 199 -3.584 11.258 -3.050 1.00 14.54 S ATOM 918 CE MET A 199 -4.869 10.459 -4.002 1.00 33.24 C ATOM 0 H MET A 199 1.107 10.576 -0.918 1.00 0.11 H new ATOM 0 HA MET A 199 -0.296 10.278 -3.542 1.00 51.14 H new ATOM 0 HB2 MET A 199 -1.078 9.144 -1.270 1.00 33.22 H new ATOM 0 HB3 MET A 199 -1.646 10.764 -0.916 1.00 33.22 H new ATOM 0 HG2 MET A 199 -2.414 9.221 -3.402 1.00 21.11 H new ATOM 0 HG3 MET A 199 -3.336 9.188 -1.912 1.00 21.11 H new ATOM 0 HE1 MET A 199 -5.385 11.201 -4.612 1.00 33.24 H new ATOM 0 HE2 MET A 199 -4.425 9.702 -4.649 1.00 33.24 H new ATOM 0 HE3 MET A 199 -5.582 9.986 -3.326 1.00 33.24 H new ATOM 928 N VAL A 200 -0.835 12.705 -3.691 1.00 54.02 N ATOM 929 CA VAL A 200 -0.849 14.142 -3.980 1.00 74.30 C ATOM 930 C VAL A 200 -1.776 14.869 -3.012 1.00 54.52 C ATOM 931 O VAL A 200 -3.011 14.701 -3.069 1.00 14.43 O ATOM 932 CB VAL A 200 -1.330 14.416 -5.430 1.00 40.21 C ATOM 933 CG1 VAL A 200 -1.178 15.886 -5.792 1.00 31.24 C ATOM 934 CG2 VAL A 200 -0.600 13.532 -6.434 1.00 64.12 C ATOM 0 H VAL A 200 -1.292 12.140 -4.407 1.00 54.02 H new ATOM 0 HA VAL A 200 0.171 14.509 -3.865 1.00 74.30 H new ATOM 0 HB VAL A 200 -2.390 14.166 -5.475 1.00 40.21 H new ATOM 0 HG11 VAL A 200 -1.523 16.047 -6.813 1.00 31.24 H new ATOM 0 HG12 VAL A 200 -1.772 16.492 -5.109 1.00 31.24 H new ATOM 0 HG13 VAL A 200 -0.129 16.173 -5.714 1.00 31.24 H new ATOM 0 HG21 VAL A 200 -0.960 13.749 -7.440 1.00 64.12 H new ATOM 0 HG22 VAL A 200 0.471 13.730 -6.382 1.00 64.12 H new ATOM 0 HG23 VAL A 200 -0.787 12.484 -6.200 1.00 64.12 H new ATOM 944 N GLY A 201 -1.183 15.721 -2.182 1.00 14.54 N ATOM 945 CA GLY A 201 -1.901 16.387 -1.120 1.00 10.33 C ATOM 946 C GLY A 201 -2.625 15.393 -0.236 1.00 33.31 C ATOM 947 O GLY A 201 -2.005 14.539 0.409 1.00 3.44 O ATOM 0 H GLY A 201 -0.194 15.964 -2.233 1.00 14.54 H new ATOM 0 HA2 GLY A 201 -1.205 16.972 -0.519 1.00 10.33 H new ATOM 0 HA3 GLY A 201 -2.619 17.087 -1.547 1.00 10.33 H new ATOM 951 N HIS A 202 -3.921 15.475 -0.242 1.00 51.45 N ATOM 952 CA HIS A 202 -4.738 14.574 0.493 1.00 32.14 C ATOM 953 C HIS A 202 -6.091 14.473 -0.159 1.00 71.44 C ATOM 954 O HIS A 202 -6.964 15.319 0.026 1.00 20.14 O ATOM 955 CB HIS A 202 -4.859 14.952 1.985 1.00 1.14 C ATOM 956 CG HIS A 202 -5.669 13.977 2.807 1.00 64.23 C ATOM 957 ND1 HIS A 202 -6.610 14.351 3.736 1.00 72.54 N ATOM 958 CD2 HIS A 202 -5.639 12.619 2.838 1.00 22.54 C ATOM 959 CE1 HIS A 202 -7.109 13.244 4.292 1.00 2.44 C ATOM 960 NE2 HIS A 202 -6.552 12.162 3.778 1.00 42.41 N ATOM 0 H HIS A 202 -4.441 16.179 -0.765 1.00 51.45 H new ATOM 0 HA HIS A 202 -4.254 13.598 0.474 1.00 32.14 H new ATOM 0 HB2 HIS A 202 -3.859 15.026 2.412 1.00 1.14 H new ATOM 0 HB3 HIS A 202 -5.313 15.940 2.062 1.00 1.14 H new ATOM 0 HD2 HIS A 202 -5.005 11.994 2.227 1.00 22.54 H new ATOM 0 HE1 HIS A 202 -7.868 13.235 5.060 1.00 2.44 H new ATOM 0 HE2 HIS A 202 -6.752 11.192 4.022 1.00 42.41 H new ATOM 968 N THR A 203 -6.224 13.491 -0.978 1.00 74.42 N ATOM 969 CA THR A 203 -7.452 13.171 -1.592 1.00 32.54 C ATOM 970 C THR A 203 -7.839 11.750 -1.144 1.00 73.21 C ATOM 971 O THR A 203 -7.489 10.748 -1.793 1.00 53.12 O ATOM 972 CB THR A 203 -7.352 13.301 -3.121 1.00 14.33 C ATOM 973 OG1 THR A 203 -6.866 14.624 -3.433 1.00 30.23 O ATOM 974 CG2 THR A 203 -8.710 13.100 -3.785 1.00 73.00 C ATOM 0 H THR A 203 -5.456 12.874 -1.243 1.00 74.42 H new ATOM 0 HA THR A 203 -8.232 13.868 -1.287 1.00 32.54 H new ATOM 0 HB THR A 203 -6.674 12.534 -3.496 1.00 14.33 H new ATOM 0 HG1 THR A 203 -6.794 14.725 -4.405 1.00 30.23 H new ATOM 0 HG21 THR A 203 -8.605 13.198 -4.865 1.00 73.00 H new ATOM 0 HG22 THR A 203 -9.088 12.106 -3.546 1.00 73.00 H new ATOM 0 HG23 THR A 203 -9.409 13.852 -3.419 1.00 73.00 H new ATOM 982 N PRO A 204 -8.493 11.659 0.037 1.00 31.30 N ATOM 983 CA PRO A 204 -8.801 10.394 0.696 1.00 33.32 C ATOM 984 C PRO A 204 -9.658 9.467 -0.118 1.00 42.34 C ATOM 985 O PRO A 204 -9.513 8.278 -0.014 1.00 61.11 O ATOM 986 CB PRO A 204 -9.502 10.786 2.003 1.00 25.05 C ATOM 987 CG PRO A 204 -9.918 12.201 1.820 1.00 45.50 C ATOM 988 CD PRO A 204 -8.964 12.804 0.831 1.00 63.40 C ATOM 0 HA PRO A 204 -7.884 9.826 0.855 1.00 33.32 H new ATOM 0 HB2 PRO A 204 -10.363 10.145 2.194 1.00 25.05 H new ATOM 0 HB3 PRO A 204 -8.831 10.681 2.855 1.00 25.05 H new ATOM 0 HG2 PRO A 204 -10.943 12.259 1.454 1.00 45.50 H new ATOM 0 HG3 PRO A 204 -9.886 12.740 2.767 1.00 45.50 H new ATOM 0 HD2 PRO A 204 -9.457 13.547 0.204 1.00 63.40 H new ATOM 0 HD3 PRO A 204 -8.137 13.308 1.332 1.00 63.40 H new ATOM 996 N ALA A 205 -10.489 10.017 -0.977 1.00 35.12 N ATOM 997 CA ALA A 205 -11.403 9.213 -1.783 1.00 2.04 C ATOM 998 C ALA A 205 -10.654 8.183 -2.609 1.00 1.02 C ATOM 999 O ALA A 205 -10.950 7.003 -2.545 1.00 54.30 O ATOM 1000 CB ALA A 205 -12.252 10.086 -2.682 1.00 41.33 C ATOM 0 H ALA A 205 -10.556 11.022 -1.141 1.00 35.12 H new ATOM 0 HA ALA A 205 -12.061 8.684 -1.093 1.00 2.04 H new ATOM 0 HB1 ALA A 205 -12.923 9.459 -3.270 1.00 41.33 H new ATOM 0 HB2 ALA A 205 -12.839 10.773 -2.073 1.00 41.33 H new ATOM 0 HB3 ALA A 205 -11.607 10.655 -3.352 1.00 41.33 H new ATOM 1006 N LYS A 206 -9.628 8.619 -3.305 1.00 1.43 N ATOM 1007 CA LYS A 206 -8.883 7.727 -4.171 1.00 63.45 C ATOM 1008 C LYS A 206 -7.987 6.778 -3.372 1.00 2.10 C ATOM 1009 O LYS A 206 -7.638 5.693 -3.834 1.00 75.44 O ATOM 1010 CB LYS A 206 -8.096 8.502 -5.236 1.00 70.13 C ATOM 1011 CG LYS A 206 -8.981 9.301 -6.188 1.00 40.12 C ATOM 1012 CD LYS A 206 -8.191 9.950 -7.331 1.00 43.30 C ATOM 1013 CE LYS A 206 -7.185 10.968 -6.837 1.00 15.40 C ATOM 1014 NZ LYS A 206 -6.530 11.683 -7.951 1.00 44.13 N ATOM 0 H LYS A 206 -9.290 9.581 -3.290 1.00 1.43 H new ATOM 0 HA LYS A 206 -9.608 7.107 -4.699 1.00 63.45 H new ATOM 0 HB2 LYS A 206 -7.403 9.182 -4.741 1.00 70.13 H new ATOM 0 HB3 LYS A 206 -7.495 7.800 -5.814 1.00 70.13 H new ATOM 0 HG2 LYS A 206 -9.743 8.643 -6.607 1.00 40.12 H new ATOM 0 HG3 LYS A 206 -9.503 10.076 -5.627 1.00 40.12 H new ATOM 0 HD2 LYS A 206 -7.672 9.175 -7.895 1.00 43.30 H new ATOM 0 HD3 LYS A 206 -8.885 10.434 -8.019 1.00 43.30 H new ATOM 0 HE2 LYS A 206 -7.685 11.687 -6.189 1.00 15.40 H new ATOM 0 HE3 LYS A 206 -6.429 10.467 -6.233 1.00 15.40 H new ATOM 0 HZ1 LYS A 206 -5.658 12.134 -7.609 1.00 44.13 H new ATOM 0 HZ2 LYS A 206 -6.297 11.008 -8.707 1.00 44.13 H new ATOM 0 HZ3 LYS A 206 -7.173 12.411 -8.322 1.00 44.13 H new ATOM 1028 N LEU A 207 -7.670 7.168 -2.164 1.00 22.22 N ATOM 1029 CA LEU A 207 -6.847 6.369 -1.294 1.00 41.11 C ATOM 1030 C LEU A 207 -7.698 5.315 -0.598 1.00 20.21 C ATOM 1031 O LEU A 207 -7.324 4.151 -0.518 1.00 44.54 O ATOM 1032 CB LEU A 207 -6.135 7.265 -0.271 1.00 23.01 C ATOM 1033 CG LEU A 207 -5.173 6.574 0.707 1.00 52.21 C ATOM 1034 CD1 LEU A 207 -4.003 5.938 -0.032 1.00 52.44 C ATOM 1035 CD2 LEU A 207 -4.676 7.566 1.742 1.00 0.22 C ATOM 0 H LEU A 207 -7.976 8.051 -1.755 1.00 22.22 H new ATOM 0 HA LEU A 207 -6.087 5.860 -1.886 1.00 41.11 H new ATOM 0 HB2 LEU A 207 -5.576 8.025 -0.817 1.00 23.01 H new ATOM 0 HB3 LEU A 207 -6.895 7.785 0.312 1.00 23.01 H new ATOM 0 HG LEU A 207 -5.717 5.779 1.217 1.00 52.21 H new ATOM 0 HD11 LEU A 207 -3.338 5.456 0.685 1.00 52.44 H new ATOM 0 HD12 LEU A 207 -4.378 5.195 -0.736 1.00 52.44 H new ATOM 0 HD13 LEU A 207 -3.454 6.707 -0.575 1.00 52.44 H new ATOM 0 HD21 LEU A 207 -3.995 7.064 2.429 1.00 0.22 H new ATOM 0 HD22 LEU A 207 -4.152 8.381 1.243 1.00 0.22 H new ATOM 0 HD23 LEU A 207 -5.523 7.966 2.299 1.00 0.22 H new ATOM 1047 N GLU A 208 -8.864 5.714 -0.150 1.00 63.12 N ATOM 1048 CA GLU A 208 -9.737 4.825 0.560 1.00 30.24 C ATOM 1049 C GLU A 208 -10.425 3.855 -0.388 1.00 5.41 C ATOM 1050 O GLU A 208 -10.805 2.761 0.013 1.00 63.41 O ATOM 1051 CB GLU A 208 -10.728 5.585 1.438 1.00 45.35 C ATOM 1052 CG GLU A 208 -10.060 6.411 2.541 1.00 42.12 C ATOM 1053 CD GLU A 208 -11.052 7.115 3.437 1.00 54.34 C ATOM 1054 OE1 GLU A 208 -11.555 8.191 3.070 1.00 54.43 O ATOM 1055 OE2 GLU A 208 -11.361 6.591 4.543 1.00 21.12 O ATOM 0 H GLU A 208 -9.228 6.659 -0.269 1.00 63.12 H new ATOM 0 HA GLU A 208 -9.124 4.228 1.236 1.00 30.24 H new ATOM 0 HB2 GLU A 208 -11.324 6.247 0.810 1.00 45.35 H new ATOM 0 HB3 GLU A 208 -11.416 4.874 1.894 1.00 45.35 H new ATOM 0 HG2 GLU A 208 -9.432 5.757 3.147 1.00 42.12 H new ATOM 0 HG3 GLU A 208 -9.402 7.151 2.085 1.00 42.12 H new ATOM 1062 N ARG A 209 -10.574 4.250 -1.652 1.00 42.12 N ATOM 1063 CA ARG A 209 -11.081 3.338 -2.669 1.00 30.52 C ATOM 1064 C ARG A 209 -10.025 2.292 -2.999 1.00 11.14 C ATOM 1065 O ARG A 209 -10.350 1.156 -3.322 1.00 13.30 O ATOM 1066 CB ARG A 209 -11.567 4.066 -3.925 1.00 70.31 C ATOM 1067 CG ARG A 209 -12.820 4.899 -3.693 1.00 32.41 C ATOM 1068 CD ARG A 209 -13.257 5.624 -4.951 1.00 54.43 C ATOM 1069 NE ARG A 209 -13.609 4.696 -6.032 1.00 53.53 N ATOM 1070 CZ ARG A 209 -13.982 5.061 -7.256 1.00 52.14 C ATOM 1071 NH1 ARG A 209 -14.052 6.348 -7.582 1.00 23.43 N ATOM 1072 NH2 ARG A 209 -14.288 4.137 -8.148 1.00 32.03 N ATOM 0 H ARG A 209 -10.353 5.186 -1.991 1.00 42.12 H new ATOM 0 HA ARG A 209 -11.957 2.836 -2.258 1.00 30.52 H new ATOM 0 HB2 ARG A 209 -10.771 4.714 -4.291 1.00 70.31 H new ATOM 0 HB3 ARG A 209 -11.766 3.333 -4.707 1.00 70.31 H new ATOM 0 HG2 ARG A 209 -13.627 4.253 -3.347 1.00 32.41 H new ATOM 0 HG3 ARG A 209 -12.632 5.625 -2.902 1.00 32.41 H new ATOM 0 HD2 ARG A 209 -14.115 6.257 -4.724 1.00 54.43 H new ATOM 0 HD3 ARG A 209 -12.455 6.282 -5.286 1.00 54.43 H new ATOM 0 HE ARG A 209 -13.564 3.697 -5.830 1.00 53.53 H new ATOM 0 HH11 ARG A 209 -13.819 7.062 -6.892 1.00 23.43 H new ATOM 0 HH12 ARG A 209 -14.339 6.621 -8.522 1.00 23.43 H new ATOM 0 HH21 ARG A 209 -14.238 3.150 -7.897 1.00 32.03 H new ATOM 0 HH22 ARG A 209 -14.575 4.411 -9.088 1.00 32.03 H new ATOM 1086 N LEU A 210 -8.754 2.686 -2.903 1.00 75.04 N ATOM 1087 CA LEU A 210 -7.644 1.743 -3.019 1.00 33.42 C ATOM 1088 C LEU A 210 -7.766 0.725 -1.894 1.00 63.00 C ATOM 1089 O LEU A 210 -7.756 -0.481 -2.124 1.00 2.41 O ATOM 1090 CB LEU A 210 -6.297 2.482 -2.906 1.00 65.23 C ATOM 1091 CG LEU A 210 -5.044 1.613 -2.685 1.00 2.43 C ATOM 1092 CD1 LEU A 210 -4.751 0.721 -3.869 1.00 71.12 C ATOM 1093 CD2 LEU A 210 -3.851 2.478 -2.353 1.00 1.42 C ATOM 0 H LEU A 210 -8.469 3.653 -2.745 1.00 75.04 H new ATOM 0 HA LEU A 210 -7.682 1.247 -3.989 1.00 33.42 H new ATOM 0 HB2 LEU A 210 -6.151 3.063 -3.817 1.00 65.23 H new ATOM 0 HB3 LEU A 210 -6.367 3.192 -2.082 1.00 65.23 H new ATOM 0 HG LEU A 210 -5.248 0.958 -1.838 1.00 2.43 H new ATOM 0 HD11 LEU A 210 -3.859 0.128 -3.666 1.00 71.12 H new ATOM 0 HD12 LEU A 210 -5.597 0.056 -4.042 1.00 71.12 H new ATOM 0 HD13 LEU A 210 -4.585 1.335 -4.754 1.00 71.12 H new ATOM 0 HD21 LEU A 210 -2.975 1.847 -2.200 1.00 1.42 H new ATOM 0 HD22 LEU A 210 -3.662 3.168 -3.175 1.00 1.42 H new ATOM 0 HD23 LEU A 210 -4.054 3.044 -1.444 1.00 1.42 H new ATOM 1105 N VAL A 211 -7.932 1.242 -0.686 1.00 31.13 N ATOM 1106 CA VAL A 211 -8.112 0.423 0.511 1.00 45.14 C ATOM 1107 C VAL A 211 -9.339 -0.504 0.361 1.00 25.35 C ATOM 1108 O VAL A 211 -9.299 -1.667 0.749 1.00 31.03 O ATOM 1109 CB VAL A 211 -8.250 1.309 1.789 1.00 13.15 C ATOM 1110 CG1 VAL A 211 -8.459 0.466 3.038 1.00 70.33 C ATOM 1111 CG2 VAL A 211 -7.021 2.185 1.959 1.00 51.14 C ATOM 0 H VAL A 211 -7.946 2.246 -0.504 1.00 31.13 H new ATOM 0 HA VAL A 211 -7.222 -0.196 0.625 1.00 45.14 H new ATOM 0 HB VAL A 211 -9.129 1.939 1.657 1.00 13.15 H new ATOM 0 HG11 VAL A 211 -8.551 1.119 3.906 1.00 70.33 H new ATOM 0 HG12 VAL A 211 -9.369 -0.125 2.930 1.00 70.33 H new ATOM 0 HG13 VAL A 211 -7.608 -0.201 3.174 1.00 70.33 H new ATOM 0 HG21 VAL A 211 -7.132 2.797 2.854 1.00 51.14 H new ATOM 0 HG22 VAL A 211 -6.136 1.556 2.057 1.00 51.14 H new ATOM 0 HG23 VAL A 211 -6.912 2.832 1.088 1.00 51.14 H new ATOM 1121 N ALA A 212 -10.402 0.012 -0.238 1.00 2.23 N ATOM 1122 CA ALA A 212 -11.621 -0.757 -0.482 1.00 74.40 C ATOM 1123 C ALA A 212 -11.381 -1.898 -1.476 1.00 1.24 C ATOM 1124 O ALA A 212 -11.953 -2.976 -1.348 1.00 13.43 O ATOM 1125 CB ALA A 212 -12.747 0.147 -0.959 1.00 15.41 C ATOM 0 H ALA A 212 -10.447 0.975 -0.570 1.00 2.23 H new ATOM 0 HA ALA A 212 -11.919 -1.205 0.466 1.00 74.40 H new ATOM 0 HB1 ALA A 212 -13.643 -0.449 -1.134 1.00 15.41 H new ATOM 0 HB2 ALA A 212 -12.955 0.901 -0.200 1.00 15.41 H new ATOM 0 HB3 ALA A 212 -12.451 0.638 -1.886 1.00 15.41 H new ATOM 1131 N GLU A 213 -10.543 -1.663 -2.456 1.00 55.41 N ATOM 1132 CA GLU A 213 -10.199 -2.697 -3.412 1.00 22.14 C ATOM 1133 C GLU A 213 -9.313 -3.733 -2.784 1.00 12.43 C ATOM 1134 O GLU A 213 -9.496 -4.922 -3.015 1.00 45.12 O ATOM 1135 CB GLU A 213 -9.555 -2.127 -4.672 1.00 61.24 C ATOM 1136 CG GLU A 213 -10.481 -1.310 -5.547 1.00 74.20 C ATOM 1137 CD GLU A 213 -11.666 -2.107 -6.012 1.00 64.44 C ATOM 1138 OE1 GLU A 213 -11.488 -3.105 -6.740 1.00 24.13 O ATOM 1139 OE2 GLU A 213 -12.798 -1.752 -5.668 1.00 20.05 O ATOM 0 H GLU A 213 -10.084 -0.766 -2.616 1.00 55.41 H new ATOM 0 HA GLU A 213 -11.131 -3.174 -3.715 1.00 22.14 H new ATOM 0 HB2 GLU A 213 -8.710 -1.503 -4.380 1.00 61.24 H new ATOM 0 HB3 GLU A 213 -9.154 -2.951 -5.262 1.00 61.24 H new ATOM 0 HG2 GLU A 213 -10.826 -0.437 -4.993 1.00 74.20 H new ATOM 0 HG3 GLU A 213 -9.930 -0.941 -6.412 1.00 74.20 H new ATOM 1146 N LEU A 214 -8.388 -3.284 -1.970 1.00 34.21 N ATOM 1147 CA LEU A 214 -7.471 -4.175 -1.295 1.00 15.43 C ATOM 1148 C LEU A 214 -8.190 -5.032 -0.275 1.00 64.33 C ATOM 1149 O LEU A 214 -7.965 -6.218 -0.201 1.00 64.11 O ATOM 1150 CB LEU A 214 -6.326 -3.399 -0.631 1.00 1.30 C ATOM 1151 CG LEU A 214 -5.399 -2.629 -1.577 1.00 22.43 C ATOM 1152 CD1 LEU A 214 -4.344 -1.879 -0.788 1.00 23.32 C ATOM 1153 CD2 LEU A 214 -4.740 -3.574 -2.569 1.00 71.23 C ATOM 0 H LEU A 214 -8.249 -2.296 -1.757 1.00 34.21 H new ATOM 0 HA LEU A 214 -7.042 -4.832 -2.051 1.00 15.43 H new ATOM 0 HB2 LEU A 214 -6.756 -2.692 0.079 1.00 1.30 H new ATOM 0 HB3 LEU A 214 -5.723 -4.102 -0.056 1.00 1.30 H new ATOM 0 HG LEU A 214 -5.999 -1.909 -2.133 1.00 22.43 H new ATOM 0 HD11 LEU A 214 -3.693 -1.337 -1.474 1.00 23.32 H new ATOM 0 HD12 LEU A 214 -4.828 -1.173 -0.113 1.00 23.32 H new ATOM 0 HD13 LEU A 214 -3.751 -2.587 -0.209 1.00 23.32 H new ATOM 0 HD21 LEU A 214 -4.086 -3.007 -3.232 1.00 71.23 H new ATOM 0 HD22 LEU A 214 -4.154 -4.317 -2.029 1.00 71.23 H new ATOM 0 HD23 LEU A 214 -5.507 -4.076 -3.159 1.00 71.23 H new ATOM 1165 N SER A 215 -9.087 -4.440 0.472 1.00 73.51 N ATOM 1166 CA SER A 215 -9.793 -5.165 1.505 1.00 12.21 C ATOM 1167 C SER A 215 -10.777 -6.191 0.912 1.00 65.15 C ATOM 1168 O SER A 215 -11.016 -7.262 1.491 1.00 22.22 O ATOM 1169 CB SER A 215 -10.536 -4.196 2.424 1.00 40.03 C ATOM 1170 OG SER A 215 -11.267 -3.250 1.670 1.00 13.00 O ATOM 0 H SER A 215 -9.348 -3.458 0.386 1.00 73.51 H new ATOM 0 HA SER A 215 -9.050 -5.712 2.086 1.00 12.21 H new ATOM 0 HB2 SER A 215 -11.213 -4.751 3.074 1.00 40.03 H new ATOM 0 HB3 SER A 215 -9.824 -3.682 3.069 1.00 40.03 H new ATOM 0 HG SER A 215 -10.708 -2.463 1.502 1.00 13.00 H new ATOM 1176 N LEU A 216 -11.370 -5.853 -0.228 1.00 32.54 N ATOM 1177 CA LEU A 216 -12.310 -6.713 -0.888 1.00 70.12 C ATOM 1178 C LEU A 216 -11.648 -7.646 -1.898 1.00 3.43 C ATOM 1179 O LEU A 216 -12.324 -8.442 -2.541 1.00 73.33 O ATOM 1180 CB LEU A 216 -13.459 -5.917 -1.522 1.00 14.12 C ATOM 1181 CG LEU A 216 -14.625 -5.483 -0.591 1.00 35.34 C ATOM 1182 CD1 LEU A 216 -14.181 -4.513 0.493 1.00 1.15 C ATOM 1183 CD2 LEU A 216 -15.764 -4.885 -1.398 1.00 13.23 C ATOM 0 H LEU A 216 -11.203 -4.970 -0.711 1.00 32.54 H new ATOM 0 HA LEU A 216 -12.738 -7.350 -0.114 1.00 70.12 H new ATOM 0 HB2 LEU A 216 -13.038 -5.020 -1.975 1.00 14.12 H new ATOM 0 HB3 LEU A 216 -13.878 -6.516 -2.331 1.00 14.12 H new ATOM 0 HG LEU A 216 -14.976 -6.385 -0.090 1.00 35.34 H new ATOM 0 HD11 LEU A 216 -15.036 -4.244 1.113 1.00 1.15 H new ATOM 0 HD12 LEU A 216 -13.418 -4.984 1.112 1.00 1.15 H new ATOM 0 HD13 LEU A 216 -13.771 -3.615 0.032 1.00 1.15 H new ATOM 0 HD21 LEU A 216 -16.569 -4.588 -0.726 1.00 13.23 H new ATOM 0 HD22 LEU A 216 -15.405 -4.011 -1.942 1.00 13.23 H new ATOM 0 HD23 LEU A 216 -16.136 -5.626 -2.106 1.00 13.23 H new ATOM 1195 N GLN A 217 -10.343 -7.541 -2.036 1.00 23.51 N ATOM 1196 CA GLN A 217 -9.574 -8.433 -2.862 1.00 71.14 C ATOM 1197 C GLN A 217 -9.564 -9.824 -2.227 1.00 62.32 C ATOM 1198 O GLN A 217 -9.171 -9.980 -1.062 1.00 42.25 O ATOM 1199 CB GLN A 217 -8.131 -7.910 -3.034 1.00 0.43 C ATOM 1200 CG GLN A 217 -7.214 -8.843 -3.825 1.00 15.21 C ATOM 1201 CD GLN A 217 -7.693 -9.096 -5.241 1.00 3.31 C ATOM 1202 OE1 GLN A 217 -8.312 -8.242 -5.874 1.00 61.22 O ATOM 1203 NE2 GLN A 217 -7.446 -10.274 -5.736 1.00 71.35 N ATOM 0 H GLN A 217 -9.785 -6.825 -1.571 1.00 23.51 H new ATOM 0 HA GLN A 217 -10.031 -8.488 -3.850 1.00 71.14 H new ATOM 0 HB2 GLN A 217 -8.165 -6.942 -3.535 1.00 0.43 H new ATOM 0 HB3 GLN A 217 -7.697 -7.743 -2.048 1.00 0.43 H new ATOM 0 HG2 GLN A 217 -6.213 -8.414 -3.859 1.00 15.21 H new ATOM 0 HG3 GLN A 217 -7.135 -9.795 -3.300 1.00 15.21 H new ATOM 0 HE21 GLN A 217 -6.930 -10.960 -5.186 1.00 71.35 H new ATOM 0 HE22 GLN A 217 -7.768 -10.511 -6.674 1.00 71.35 H new ATOM 1212 N PRO A 218 -10.085 -10.822 -2.945 1.00 13.32 N ATOM 1213 CA PRO A 218 -10.082 -12.217 -2.502 1.00 61.12 C ATOM 1214 C PRO A 218 -8.686 -12.692 -2.086 1.00 43.13 C ATOM 1215 O PRO A 218 -7.767 -12.769 -2.907 1.00 32.24 O ATOM 1216 CB PRO A 218 -10.546 -12.989 -3.737 1.00 73.33 C ATOM 1217 CG PRO A 218 -11.348 -12.012 -4.521 1.00 71.33 C ATOM 1218 CD PRO A 218 -10.767 -10.655 -4.237 1.00 44.41 C ATOM 0 HA PRO A 218 -10.714 -12.361 -1.626 1.00 61.12 H new ATOM 0 HB2 PRO A 218 -9.698 -13.357 -4.314 1.00 73.33 H new ATOM 0 HB3 PRO A 218 -11.143 -13.857 -3.459 1.00 73.33 H new ATOM 0 HG2 PRO A 218 -11.301 -12.238 -5.586 1.00 71.33 H new ATOM 0 HG3 PRO A 218 -12.398 -12.052 -4.232 1.00 71.33 H new ATOM 0 HD2 PRO A 218 -10.072 -10.347 -5.018 1.00 44.41 H new ATOM 0 HD3 PRO A 218 -11.544 -9.892 -4.183 1.00 44.41 H new ATOM 1226 N GLY A 219 -8.531 -12.938 -0.811 1.00 41.13 N ATOM 1227 CA GLY A 219 -7.274 -13.444 -0.280 1.00 23.41 C ATOM 1228 C GLY A 219 -6.755 -12.615 0.881 1.00 61.44 C ATOM 1229 O GLY A 219 -5.781 -12.993 1.545 1.00 30.23 O ATOM 0 H GLY A 219 -9.259 -12.798 -0.111 1.00 41.13 H new ATOM 0 HA2 GLY A 219 -7.411 -14.475 0.047 1.00 23.41 H new ATOM 0 HA3 GLY A 219 -6.528 -13.458 -1.074 1.00 23.41 H new ATOM 1233 N VAL A 220 -7.395 -11.493 1.113 1.00 65.41 N ATOM 1234 CA VAL A 220 -7.020 -10.557 2.150 1.00 41.10 C ATOM 1235 C VAL A 220 -7.757 -10.815 3.478 1.00 4.31 C ATOM 1236 O VAL A 220 -8.954 -11.138 3.489 1.00 24.04 O ATOM 1237 CB VAL A 220 -7.288 -9.112 1.644 1.00 30.22 C ATOM 1238 CG1 VAL A 220 -7.103 -8.074 2.736 1.00 24.32 C ATOM 1239 CG2 VAL A 220 -6.373 -8.806 0.465 1.00 14.41 C ATOM 0 H VAL A 220 -8.209 -11.198 0.575 1.00 65.41 H new ATOM 0 HA VAL A 220 -5.959 -10.691 2.360 1.00 41.10 H new ATOM 0 HB VAL A 220 -8.330 -9.060 1.328 1.00 30.22 H new ATOM 0 HG11 VAL A 220 -7.302 -7.081 2.332 1.00 24.32 H new ATOM 0 HG12 VAL A 220 -7.795 -8.278 3.553 1.00 24.32 H new ATOM 0 HG13 VAL A 220 -6.079 -8.116 3.108 1.00 24.32 H new ATOM 0 HG21 VAL A 220 -6.562 -7.792 0.111 1.00 14.41 H new ATOM 0 HG22 VAL A 220 -5.333 -8.892 0.780 1.00 14.41 H new ATOM 0 HG23 VAL A 220 -6.568 -9.514 -0.341 1.00 14.41 H new ATOM 1249 N TYR A 221 -7.016 -10.688 4.582 1.00 41.34 N ATOM 1250 CA TYR A 221 -7.564 -10.783 5.927 1.00 20.34 C ATOM 1251 C TYR A 221 -8.111 -9.423 6.320 1.00 22.25 C ATOM 1252 O TYR A 221 -9.279 -9.283 6.700 1.00 63.21 O ATOM 1253 CB TYR A 221 -6.475 -11.153 6.964 1.00 3.13 C ATOM 1254 CG TYR A 221 -5.934 -12.563 6.927 1.00 52.24 C ATOM 1255 CD1 TYR A 221 -5.033 -12.969 5.962 1.00 3.01 C ATOM 1256 CD2 TYR A 221 -6.306 -13.477 7.897 1.00 25.55 C ATOM 1257 CE1 TYR A 221 -4.525 -14.251 5.957 1.00 62.24 C ATOM 1258 CE2 TYR A 221 -5.807 -14.757 7.902 1.00 3.23 C ATOM 1259 CZ TYR A 221 -4.918 -15.145 6.932 1.00 0.15 C ATOM 1260 OH TYR A 221 -4.423 -16.434 6.937 1.00 52.15 O ATOM 0 H TYR A 221 -6.011 -10.515 4.561 1.00 41.34 H new ATOM 0 HA TYR A 221 -8.333 -11.555 5.922 1.00 20.34 H new ATOM 0 HB2 TYR A 221 -5.638 -10.467 6.834 1.00 3.13 H new ATOM 0 HB3 TYR A 221 -6.882 -10.974 7.959 1.00 3.13 H new ATOM 0 HD1 TYR A 221 -4.721 -12.271 5.199 1.00 3.01 H new ATOM 0 HD2 TYR A 221 -7.003 -13.178 8.666 1.00 25.55 H new ATOM 0 HE1 TYR A 221 -3.823 -14.554 5.194 1.00 62.24 H new ATOM 0 HE2 TYR A 221 -6.114 -15.455 8.667 1.00 3.23 H new ATOM 0 HH TYR A 221 -3.576 -16.461 6.445 1.00 52.15 H new ATOM 1270 N ALA A 222 -7.258 -8.414 6.194 1.00 55.20 N ATOM 1271 CA ALA A 222 -7.585 -7.052 6.610 1.00 62.53 C ATOM 1272 C ALA A 222 -6.588 -6.067 6.029 1.00 32.02 C ATOM 1273 O ALA A 222 -5.553 -6.471 5.489 1.00 62.14 O ATOM 1274 CB ALA A 222 -7.592 -6.942 8.138 1.00 3.42 C ATOM 0 H ALA A 222 -6.322 -8.514 5.802 1.00 55.20 H new ATOM 0 HA ALA A 222 -8.580 -6.812 6.236 1.00 62.53 H new ATOM 0 HB1 ALA A 222 -7.838 -5.920 8.428 1.00 3.42 H new ATOM 0 HB2 ALA A 222 -8.336 -7.625 8.549 1.00 3.42 H new ATOM 0 HB3 ALA A 222 -6.607 -7.203 8.526 1.00 3.42 H new ATOM 1280 N VAL A 223 -6.896 -4.799 6.132 1.00 72.25 N ATOM 1281 CA VAL A 223 -6.030 -3.743 5.649 1.00 52.43 C ATOM 1282 C VAL A 223 -6.252 -2.475 6.482 1.00 15.11 C ATOM 1283 O VAL A 223 -7.360 -2.229 6.968 1.00 45.31 O ATOM 1284 CB VAL A 223 -6.282 -3.458 4.130 1.00 72.32 C ATOM 1285 CG1 VAL A 223 -7.711 -3.058 3.892 1.00 74.24 C ATOM 1286 CG2 VAL A 223 -5.347 -2.394 3.581 1.00 32.05 C ATOM 0 H VAL A 223 -7.761 -4.463 6.556 1.00 72.25 H new ATOM 0 HA VAL A 223 -4.994 -4.064 5.756 1.00 52.43 H new ATOM 0 HB VAL A 223 -6.076 -4.386 3.597 1.00 72.32 H new ATOM 0 HG11 VAL A 223 -7.863 -2.865 2.830 1.00 74.24 H new ATOM 0 HG12 VAL A 223 -8.372 -3.863 4.213 1.00 74.24 H new ATOM 0 HG13 VAL A 223 -7.936 -2.156 4.461 1.00 74.24 H new ATOM 0 HG21 VAL A 223 -5.561 -2.232 2.525 1.00 32.05 H new ATOM 0 HG22 VAL A 223 -5.494 -1.463 4.128 1.00 32.05 H new ATOM 0 HG23 VAL A 223 -4.314 -2.723 3.696 1.00 32.05 H new ATOM 1296 N HIS A 224 -5.211 -1.716 6.677 1.00 73.03 N ATOM 1297 CA HIS A 224 -5.277 -0.469 7.411 1.00 73.43 C ATOM 1298 C HIS A 224 -4.332 0.529 6.746 1.00 65.23 C ATOM 1299 O HIS A 224 -3.378 0.123 6.108 1.00 30.11 O ATOM 1300 CB HIS A 224 -4.861 -0.710 8.881 1.00 43.21 C ATOM 1301 CG HIS A 224 -4.901 0.513 9.750 1.00 13.25 C ATOM 1302 ND1 HIS A 224 -3.787 1.244 10.092 1.00 52.44 N ATOM 1303 CD2 HIS A 224 -5.947 1.129 10.339 1.00 54.11 C ATOM 1304 CE1 HIS A 224 -4.173 2.260 10.861 1.00 4.31 C ATOM 1305 NE2 HIS A 224 -5.488 2.240 11.043 1.00 53.14 N ATOM 0 H HIS A 224 -4.279 -1.942 6.330 1.00 73.03 H new ATOM 0 HA HIS A 224 -6.293 -0.074 7.402 1.00 73.43 H new ATOM 0 HB2 HIS A 224 -5.517 -1.467 9.311 1.00 43.21 H new ATOM 0 HB3 HIS A 224 -3.850 -1.118 8.897 1.00 43.21 H new ATOM 0 HD2 HIS A 224 -6.977 0.811 10.275 1.00 54.11 H new ATOM 0 HE1 HIS A 224 -3.507 3.000 11.280 1.00 4.31 H new ATOM 0 HE2 HIS A 224 -6.046 2.900 11.585 1.00 53.14 H new ATOM 1313 N TRP A 225 -4.611 1.811 6.857 1.00 11.34 N ATOM 1314 CA TRP A 225 -3.714 2.805 6.325 1.00 20.31 C ATOM 1315 C TRP A 225 -3.368 3.812 7.366 1.00 12.10 C ATOM 1316 O TRP A 225 -4.182 4.136 8.241 1.00 62.33 O ATOM 1317 CB TRP A 225 -4.230 3.491 5.052 1.00 41.32 C ATOM 1318 CG TRP A 225 -5.524 4.240 5.194 1.00 21.44 C ATOM 1319 CD1 TRP A 225 -6.777 3.708 5.189 1.00 3.52 C ATOM 1320 CD2 TRP A 225 -5.694 5.670 5.338 1.00 75.03 C ATOM 1321 NE1 TRP A 225 -7.710 4.695 5.325 1.00 5.05 N ATOM 1322 CE2 TRP A 225 -7.077 5.908 5.420 1.00 31.10 C ATOM 1323 CE3 TRP A 225 -4.812 6.775 5.412 1.00 62.45 C ATOM 1324 CZ2 TRP A 225 -7.608 7.187 5.569 1.00 4.41 C ATOM 1325 CZ3 TRP A 225 -5.347 8.037 5.559 1.00 32.43 C ATOM 1326 CH2 TRP A 225 -6.730 8.234 5.637 1.00 32.03 C ATOM 0 H TRP A 225 -5.447 2.183 7.308 1.00 11.34 H new ATOM 0 HA TRP A 225 -2.813 2.268 6.028 1.00 20.31 H new ATOM 0 HB2 TRP A 225 -3.467 4.185 4.701 1.00 41.32 H new ATOM 0 HB3 TRP A 225 -4.353 2.734 4.278 1.00 41.32 H new ATOM 0 HD1 TRP A 225 -7.001 2.656 5.091 1.00 3.52 H new ATOM 0 HE1 TRP A 225 -8.720 4.553 5.352 1.00 5.05 H new ATOM 0 HE3 TRP A 225 -3.743 6.632 5.355 1.00 62.45 H new ATOM 0 HZ2 TRP A 225 -8.674 7.346 5.629 1.00 4.41 H new ATOM 0 HZ3 TRP A 225 -4.686 8.889 5.615 1.00 32.43 H new ATOM 0 HH2 TRP A 225 -7.114 9.237 5.754 1.00 32.03 H new ATOM 1337 N TYR A 226 -2.193 4.291 7.271 1.00 34.32 N ATOM 1338 CA TYR A 226 -1.656 5.243 8.206 1.00 61.15 C ATOM 1339 C TYR A 226 -0.947 6.361 7.452 1.00 24.44 C ATOM 1340 O TYR A 226 -0.278 6.110 6.448 1.00 44.01 O ATOM 1341 CB TYR A 226 -0.693 4.514 9.178 1.00 20.21 C ATOM 1342 CG TYR A 226 0.059 5.407 10.148 1.00 55.42 C ATOM 1343 CD1 TYR A 226 -0.577 5.992 11.229 1.00 74.35 C ATOM 1344 CD2 TYR A 226 1.409 5.656 9.972 1.00 3.24 C ATOM 1345 CE1 TYR A 226 0.113 6.808 12.107 1.00 32.52 C ATOM 1346 CE2 TYR A 226 2.109 6.464 10.842 1.00 21.22 C ATOM 1347 CZ TYR A 226 1.458 7.042 11.904 1.00 74.24 C ATOM 1348 OH TYR A 226 2.152 7.857 12.769 1.00 35.01 O ATOM 0 H TYR A 226 -1.544 4.037 6.526 1.00 34.32 H new ATOM 0 HA TYR A 226 -2.460 5.692 8.790 1.00 61.15 H new ATOM 0 HB2 TYR A 226 -1.267 3.786 9.752 1.00 20.21 H new ATOM 0 HB3 TYR A 226 0.034 3.954 8.589 1.00 20.21 H new ATOM 0 HD1 TYR A 226 -1.629 5.808 11.390 1.00 74.35 H new ATOM 0 HD2 TYR A 226 1.925 5.208 9.136 1.00 3.24 H new ATOM 0 HE1 TYR A 226 -0.397 7.259 12.945 1.00 32.52 H new ATOM 0 HE2 TYR A 226 3.163 6.641 10.689 1.00 21.22 H new ATOM 0 HH TYR A 226 3.088 7.915 12.484 1.00 35.01 H new ATOM 1358 N ALA A 227 -1.133 7.580 7.901 1.00 33.24 N ATOM 1359 CA ALA A 227 -0.469 8.718 7.313 1.00 3.33 C ATOM 1360 C ALA A 227 0.870 8.883 7.985 1.00 63.02 C ATOM 1361 O ALA A 227 0.948 8.925 9.215 1.00 33.10 O ATOM 1362 CB ALA A 227 -1.306 9.971 7.490 1.00 32.53 C ATOM 0 H ALA A 227 -1.747 7.810 8.682 1.00 33.24 H new ATOM 0 HA ALA A 227 -0.333 8.556 6.244 1.00 3.33 H new ATOM 0 HB1 ALA A 227 -0.790 10.820 7.041 1.00 32.53 H new ATOM 0 HB2 ALA A 227 -2.272 9.835 7.004 1.00 32.53 H new ATOM 0 HB3 ALA A 227 -1.458 10.160 8.553 1.00 32.53 H new ATOM 1368 N GLY A 228 1.895 9.000 7.207 1.00 14.15 N ATOM 1369 CA GLY A 228 3.224 9.014 7.746 1.00 14.35 C ATOM 1370 C GLY A 228 3.979 7.785 7.287 1.00 1.44 C ATOM 1371 O GLY A 228 3.366 6.791 6.889 1.00 72.41 O ATOM 0 H GLY A 228 1.842 9.088 6.192 1.00 14.15 H new ATOM 0 HA2 GLY A 228 3.747 9.914 7.424 1.00 14.35 H new ATOM 0 HA3 GLY A 228 3.184 9.041 8.835 1.00 14.35 H new