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 149 TYR OH : rot -113:sc= 0.737 USER MOD Set 1.2: A 202 HIS : no HD1:sc= 0.732 K(o=1.5,f=-0.69) USER MOD Set 2.1: A 166 HIS : no HE2:sc= -0.631 K(o=-2.2,f=-6.6!) USER MOD Set 2.2: A 217 GLN : amide:sc= -1.61! C(o=-2.2!,f=-2.2!) USER MOD Set 3.1: A 150 GLN : amide:sc= 0.632 K(o=0.59,f=-0.04) USER MOD Set 3.2: A 196 HIS : no HE2:sc= -0.0388 K(o=0.59,f=-1.4) USER MOD Single : A 147 GLN : amide:sc= -0.583 X(o=-0.58,f=-0.88) USER MOD Single : A 155 CYS SG : rot -150:sc= -0.0994 USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 THR OG1 : rot -20:sc= 1.17 USER MOD Single : A 162 TYR OH : rot -73:sc= 0.0102 USER MOD Single : A 169 GLN : amide:sc= -0.0171 K(o=-0.017,f=-1.3!) USER MOD Single : A 171 THR OG1 : rot -88:sc= -0.362! USER MOD Single : A 172 SER OG : rot -84:sc= 1.25 USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD Single : A 174 ASN : amide:sc= -0.617 X(o=-0.62,f=-0.69) USER MOD Single : A 177 THR OG1 : rot 180:sc= 0 USER MOD Single : A 183 THR OG1 : rot 29:sc= 0.89 USER MOD Single : A 190 ASN : amide:sc= 0.338 K(o=0.34,f=-4!) USER MOD Single : A 192 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 THR OG1 : rot 180:sc= 0 USER MOD Single : A 199 MET CE :methyl -160:sc= -2.16 (180deg=-3.03) USER MOD Single : A 203 THR OG1 : rot 180:sc= 0 USER MOD Single : A 206 LYS NZ :NH3+ 170:sc= 1.22 (180deg=1.18) USER MOD Single : A 215 SER OG : rot -87:sc= 1.05 USER MOD Single : A 221 TYR OH : rot 35:sc= 1.11 USER MOD Single : A 224 HIS : no HD1:sc= -0.023 X(o=-0.023,f=-0.0094) USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 146 3.781 15.461 -1.519 1.00 62.22 N ATOM 66 CA LEU A 146 2.778 14.484 -1.665 1.00 24.42 C ATOM 67 C LEU A 146 2.492 13.994 -0.262 1.00 43.23 C ATOM 68 O LEU A 146 3.380 14.031 0.585 1.00 33.12 O ATOM 69 CB LEU A 146 3.290 13.310 -2.527 1.00 52.14 C ATOM 70 CG LEU A 146 3.659 13.577 -4.012 1.00 13.32 C ATOM 71 CD1 LEU A 146 4.894 14.464 -4.167 1.00 12.53 C ATOM 72 CD2 LEU A 146 3.878 12.266 -4.736 1.00 52.44 C ATOM 0 HA LEU A 146 1.892 14.888 -2.154 1.00 24.42 H new ATOM 0 HB2 LEU A 146 4.173 12.901 -2.036 1.00 52.14 H new ATOM 0 HB3 LEU A 146 2.527 12.532 -2.511 1.00 52.14 H new ATOM 0 HG LEU A 146 2.820 14.114 -4.454 1.00 13.32 H new ATOM 0 HD11 LEU A 146 5.103 14.615 -5.226 1.00 12.53 H new ATOM 0 HD12 LEU A 146 4.712 15.428 -3.692 1.00 12.53 H new ATOM 0 HD13 LEU A 146 5.750 13.982 -3.694 1.00 12.53 H new ATOM 0 HD21 LEU A 146 4.136 12.464 -5.776 1.00 52.44 H new ATOM 0 HD22 LEU A 146 4.690 11.718 -4.258 1.00 52.44 H new ATOM 0 HD23 LEU A 146 2.966 11.671 -4.695 1.00 52.44 H new ATOM 84 N GLN A 147 1.288 13.583 -0.010 1.00 1.42 N ATOM 85 CA GLN A 147 0.888 13.141 1.316 1.00 72.35 C ATOM 86 C GLN A 147 1.388 11.744 1.561 1.00 63.12 C ATOM 87 O GLN A 147 0.955 10.802 0.890 1.00 30.24 O ATOM 88 CB GLN A 147 -0.638 13.235 1.486 1.00 0.21 C ATOM 89 CG GLN A 147 -1.195 14.660 1.676 1.00 1.21 C ATOM 90 CD GLN A 147 -0.746 15.660 0.614 1.00 73.13 C ATOM 91 OE1 GLN A 147 -1.371 15.808 -0.430 1.00 41.25 O ATOM 92 NE2 GLN A 147 0.308 16.377 0.894 1.00 71.12 N ATOM 0 H GLN A 147 0.546 13.539 -0.708 1.00 1.42 H new ATOM 0 HA GLN A 147 1.336 13.799 2.061 1.00 72.35 H new ATOM 0 HB2 GLN A 147 -1.112 12.791 0.611 1.00 0.21 H new ATOM 0 HB3 GLN A 147 -0.929 12.632 2.346 1.00 0.21 H new ATOM 0 HG2 GLN A 147 -2.284 14.614 1.677 1.00 1.21 H new ATOM 0 HG3 GLN A 147 -0.891 15.028 2.656 1.00 1.21 H new ATOM 0 HE21 GLN A 147 0.807 16.230 1.772 1.00 71.12 H new ATOM 0 HE22 GLN A 147 0.633 17.085 0.235 1.00 71.12 H new ATOM 101 N PRO A 148 2.347 11.596 2.482 1.00 52.05 N ATOM 102 CA PRO A 148 2.933 10.324 2.781 1.00 0.32 C ATOM 103 C PRO A 148 2.001 9.461 3.593 1.00 11.33 C ATOM 104 O PRO A 148 1.386 9.915 4.581 1.00 35.44 O ATOM 105 CB PRO A 148 4.199 10.675 3.568 1.00 41.35 C ATOM 106 CG PRO A 148 3.899 11.978 4.213 1.00 73.30 C ATOM 107 CD PRO A 148 2.946 12.686 3.295 1.00 41.31 C ATOM 0 HA PRO A 148 3.147 9.744 1.883 1.00 0.32 H new ATOM 0 HB2 PRO A 148 4.428 9.910 4.310 1.00 41.35 H new ATOM 0 HB3 PRO A 148 5.065 10.750 2.910 1.00 41.35 H new ATOM 0 HG2 PRO A 148 3.456 11.833 5.198 1.00 73.30 H new ATOM 0 HG3 PRO A 148 4.809 12.561 4.356 1.00 73.30 H new ATOM 0 HD2 PRO A 148 2.185 13.231 3.854 1.00 41.31 H new ATOM 0 HD3 PRO A 148 3.462 13.413 2.668 1.00 41.31 H new ATOM 115 N TYR A 149 1.866 8.262 3.155 1.00 52.13 N ATOM 116 CA TYR A 149 1.055 7.257 3.799 1.00 22.23 C ATOM 117 C TYR A 149 1.734 5.910 3.732 1.00 40.32 C ATOM 118 O TYR A 149 2.698 5.726 3.010 1.00 75.10 O ATOM 119 CB TYR A 149 -0.332 7.149 3.137 1.00 61.30 C ATOM 120 CG TYR A 149 -1.217 8.339 3.368 1.00 63.25 C ATOM 121 CD1 TYR A 149 -1.751 8.561 4.613 1.00 62.23 C ATOM 122 CD2 TYR A 149 -1.517 9.238 2.355 1.00 71.31 C ATOM 123 CE1 TYR A 149 -2.559 9.635 4.864 1.00 31.21 C ATOM 124 CE2 TYR A 149 -2.331 10.323 2.600 1.00 14.51 C ATOM 125 CZ TYR A 149 -2.848 10.511 3.867 1.00 52.22 C ATOM 126 OH TYR A 149 -3.670 11.579 4.132 1.00 3.12 O ATOM 0 H TYR A 149 2.328 7.928 2.309 1.00 52.13 H new ATOM 0 HA TYR A 149 0.929 7.557 4.839 1.00 22.23 H new ATOM 0 HB2 TYR A 149 -0.200 7.011 2.064 1.00 61.30 H new ATOM 0 HB3 TYR A 149 -0.834 6.258 3.514 1.00 61.30 H new ATOM 0 HD1 TYR A 149 -1.528 7.871 5.413 1.00 62.23 H new ATOM 0 HD2 TYR A 149 -1.109 9.087 1.366 1.00 71.31 H new ATOM 0 HE1 TYR A 149 -2.966 9.786 5.853 1.00 31.21 H new ATOM 0 HE2 TYR A 149 -2.563 11.020 1.808 1.00 14.51 H new ATOM 0 HH TYR A 149 -4.508 11.478 3.634 1.00 3.12 H new ATOM 136 N GLN A 150 1.251 5.007 4.516 1.00 4.30 N ATOM 137 CA GLN A 150 1.656 3.625 4.491 1.00 61.35 C ATOM 138 C GLN A 150 0.424 2.801 4.593 1.00 61.13 C ATOM 139 O GLN A 150 -0.424 3.056 5.443 1.00 72.13 O ATOM 140 CB GLN A 150 2.550 3.282 5.659 1.00 51.51 C ATOM 141 CG GLN A 150 3.909 3.924 5.633 1.00 3.13 C ATOM 142 CD GLN A 150 4.592 3.786 6.956 1.00 61.14 C ATOM 143 OE1 GLN A 150 5.297 2.815 7.227 1.00 63.22 O ATOM 144 NE2 GLN A 150 4.398 4.756 7.789 1.00 62.12 N ATOM 0 H GLN A 150 0.539 5.208 5.219 1.00 4.30 H new ATOM 0 HA GLN A 150 2.210 3.435 3.572 1.00 61.35 H new ATOM 0 HB2 GLN A 150 2.045 3.573 6.580 1.00 51.51 H new ATOM 0 HB3 GLN A 150 2.677 2.200 5.694 1.00 51.51 H new ATOM 0 HG2 GLN A 150 4.518 3.463 4.855 1.00 3.13 H new ATOM 0 HG3 GLN A 150 3.812 4.979 5.378 1.00 3.13 H new ATOM 0 HE21 GLN A 150 3.806 5.544 7.526 1.00 62.12 H new ATOM 0 HE22 GLN A 150 4.837 4.733 8.709 1.00 62.12 H new ATOM 153 N VAL A 151 0.303 1.857 3.743 1.00 72.13 N ATOM 154 CA VAL A 151 -0.835 0.980 3.744 1.00 2.51 C ATOM 155 C VAL A 151 -0.329 -0.442 3.846 1.00 64.31 C ATOM 156 O VAL A 151 0.481 -0.871 3.020 1.00 72.22 O ATOM 157 CB VAL A 151 -1.697 1.133 2.444 1.00 25.41 C ATOM 158 CG1 VAL A 151 -2.902 0.195 2.467 1.00 51.04 C ATOM 159 CG2 VAL A 151 -2.156 2.577 2.248 1.00 35.11 C ATOM 0 H VAL A 151 0.988 1.656 3.014 1.00 72.13 H new ATOM 0 HA VAL A 151 -1.474 1.237 4.589 1.00 2.51 H new ATOM 0 HB VAL A 151 -1.062 0.858 1.601 1.00 25.41 H new ATOM 0 HG11 VAL A 151 -3.481 0.324 1.552 1.00 51.04 H new ATOM 0 HG12 VAL A 151 -2.558 -0.837 2.537 1.00 51.04 H new ATOM 0 HG13 VAL A 151 -3.528 0.428 3.328 1.00 51.04 H new ATOM 0 HG21 VAL A 151 -2.751 2.649 1.338 1.00 35.11 H new ATOM 0 HG22 VAL A 151 -2.759 2.886 3.102 1.00 35.11 H new ATOM 0 HG23 VAL A 151 -1.285 3.227 2.164 1.00 35.11 H new ATOM 169 N ARG A 152 -0.745 -1.154 4.858 1.00 22.23 N ATOM 170 CA ARG A 152 -0.335 -2.518 5.000 1.00 2.35 C ATOM 171 C ARG A 152 -1.542 -3.429 4.919 1.00 21.43 C ATOM 172 O ARG A 152 -2.575 -3.179 5.548 1.00 35.33 O ATOM 173 CB ARG A 152 0.478 -2.763 6.290 1.00 62.50 C ATOM 174 CG ARG A 152 -0.303 -2.641 7.580 1.00 75.50 C ATOM 175 CD ARG A 152 0.581 -2.866 8.786 1.00 54.43 C ATOM 176 NE ARG A 152 -0.206 -2.920 10.014 1.00 54.40 N ATOM 177 CZ ARG A 152 0.153 -2.412 11.195 1.00 41.03 C ATOM 178 NH1 ARG A 152 1.297 -1.731 11.327 1.00 1.10 N ATOM 179 NH2 ARG A 152 -0.641 -2.583 12.244 1.00 72.13 N ATOM 0 H ARG A 152 -1.365 -0.811 5.592 1.00 22.23 H new ATOM 0 HA ARG A 152 0.338 -2.751 4.175 1.00 2.35 H new ATOM 0 HB2 ARG A 152 0.913 -3.761 6.241 1.00 62.50 H new ATOM 0 HB3 ARG A 152 1.306 -2.055 6.318 1.00 62.50 H new ATOM 0 HG2 ARG A 152 -0.757 -1.652 7.640 1.00 75.50 H new ATOM 0 HG3 ARG A 152 -1.117 -3.366 7.584 1.00 75.50 H new ATOM 0 HD2 ARG A 152 1.136 -3.796 8.665 1.00 54.43 H new ATOM 0 HD3 ARG A 152 1.316 -2.064 8.857 1.00 54.43 H new ATOM 0 HE ARG A 152 -1.111 -3.388 9.965 1.00 54.40 H new ATOM 0 HH11 ARG A 152 1.906 -1.595 10.520 1.00 1.10 H new ATOM 0 HH12 ARG A 152 1.560 -1.348 12.235 1.00 1.10 H new ATOM 0 HH21 ARG A 152 -1.516 -3.098 12.143 1.00 72.13 H new ATOM 0 HH22 ARG A 152 -0.377 -2.199 13.151 1.00 72.13 H new ATOM 193 N VAL A 153 -1.428 -4.437 4.126 1.00 42.31 N ATOM 194 CA VAL A 153 -2.484 -5.400 3.949 1.00 41.34 C ATOM 195 C VAL A 153 -1.965 -6.798 4.274 1.00 5.52 C ATOM 196 O VAL A 153 -0.891 -7.197 3.819 1.00 22.31 O ATOM 197 CB VAL A 153 -3.116 -5.331 2.505 1.00 5.53 C ATOM 198 CG1 VAL A 153 -2.048 -5.381 1.423 1.00 11.44 C ATOM 199 CG2 VAL A 153 -4.111 -6.462 2.289 1.00 60.22 C ATOM 0 H VAL A 153 -0.594 -4.627 3.571 1.00 42.31 H new ATOM 0 HA VAL A 153 -3.289 -5.156 4.642 1.00 41.34 H new ATOM 0 HB VAL A 153 -3.638 -4.377 2.433 1.00 5.53 H new ATOM 0 HG11 VAL A 153 -2.521 -5.331 0.442 1.00 11.44 H new ATOM 0 HG12 VAL A 153 -1.370 -4.536 1.542 1.00 11.44 H new ATOM 0 HG13 VAL A 153 -1.487 -6.312 1.508 1.00 11.44 H new ATOM 0 HG21 VAL A 153 -4.531 -6.390 1.286 1.00 60.22 H new ATOM 0 HG22 VAL A 153 -3.603 -7.420 2.402 1.00 60.22 H new ATOM 0 HG23 VAL A 153 -4.912 -6.387 3.024 1.00 60.22 H new ATOM 209 N ILE A 154 -2.692 -7.501 5.100 1.00 23.04 N ATOM 210 CA ILE A 154 -2.343 -8.840 5.495 1.00 41.03 C ATOM 211 C ILE A 154 -3.218 -9.789 4.712 1.00 41.41 C ATOM 212 O ILE A 154 -4.444 -9.781 4.875 1.00 71.33 O ATOM 213 CB ILE A 154 -2.594 -9.053 7.008 1.00 3.22 C ATOM 214 CG1 ILE A 154 -1.834 -8.002 7.825 1.00 20.11 C ATOM 215 CG2 ILE A 154 -2.180 -10.464 7.424 1.00 43.21 C ATOM 216 CD1 ILE A 154 -2.098 -8.066 9.310 1.00 71.12 C ATOM 0 H ILE A 154 -3.554 -7.156 5.523 1.00 23.04 H new ATOM 0 HA ILE A 154 -1.286 -9.017 5.297 1.00 41.03 H new ATOM 0 HB ILE A 154 -3.660 -8.938 7.205 1.00 3.22 H new ATOM 0 HG12 ILE A 154 -0.765 -8.126 7.651 1.00 20.11 H new ATOM 0 HG13 ILE A 154 -2.103 -7.010 7.461 1.00 20.11 H new ATOM 0 HG21 ILE A 154 -2.363 -10.597 8.490 1.00 43.21 H new ATOM 0 HG22 ILE A 154 -2.762 -11.194 6.862 1.00 43.21 H new ATOM 0 HG23 ILE A 154 -1.120 -10.608 7.217 1.00 43.21 H new ATOM 0 HD11 ILE A 154 -1.523 -7.290 9.816 1.00 71.12 H new ATOM 0 HD12 ILE A 154 -3.160 -7.911 9.498 1.00 71.12 H new ATOM 0 HD13 ILE A 154 -1.801 -9.043 9.690 1.00 71.12 H new ATOM 228 N CYS A 155 -2.629 -10.586 3.878 1.00 4.24 N ATOM 229 CA CYS A 155 -3.392 -11.449 3.028 1.00 55.01 C ATOM 230 C CYS A 155 -2.710 -12.789 2.856 1.00 43.34 C ATOM 231 O CYS A 155 -1.618 -13.011 3.395 1.00 24.22 O ATOM 232 CB CYS A 155 -3.615 -10.770 1.667 1.00 4.44 C ATOM 233 SG CYS A 155 -2.098 -10.267 0.817 1.00 41.32 S ATOM 0 H CYS A 155 -1.618 -10.658 3.766 1.00 4.24 H new ATOM 0 HA CYS A 155 -4.359 -11.633 3.496 1.00 55.01 H new ATOM 0 HB2 CYS A 155 -4.168 -11.453 1.022 1.00 4.44 H new ATOM 0 HB3 CYS A 155 -4.242 -9.891 1.813 1.00 4.44 H new ATOM 0 HG CYS A 155 -2.338 -9.221 0.083 1.00 41.32 H new ATOM 239 N ARG A 156 -3.400 -13.686 2.179 1.00 35.24 N ATOM 240 CA ARG A 156 -2.859 -14.997 1.786 1.00 42.52 C ATOM 241 C ARG A 156 -1.600 -14.807 0.926 1.00 45.22 C ATOM 242 O ARG A 156 -1.537 -13.877 0.131 1.00 32.35 O ATOM 243 CB ARG A 156 -3.896 -15.764 0.945 1.00 64.45 C ATOM 244 CG ARG A 156 -5.160 -16.161 1.674 1.00 74.23 C ATOM 245 CD ARG A 156 -4.885 -17.177 2.757 1.00 64.34 C ATOM 246 NE ARG A 156 -6.106 -17.520 3.476 1.00 61.54 N ATOM 247 CZ ARG A 156 -6.190 -18.407 4.457 1.00 61.42 C ATOM 248 NH1 ARG A 156 -5.150 -19.172 4.759 1.00 55.45 N ATOM 249 NH2 ARG A 156 -7.340 -18.567 5.104 1.00 31.13 N ATOM 0 H ARG A 156 -4.363 -13.535 1.878 1.00 35.24 H new ATOM 0 HA ARG A 156 -2.620 -15.554 2.692 1.00 42.52 H new ATOM 0 HB2 ARG A 156 -4.170 -15.149 0.088 1.00 64.45 H new ATOM 0 HB3 ARG A 156 -3.425 -16.665 0.553 1.00 64.45 H new ATOM 0 HG2 ARG A 156 -5.620 -15.276 2.114 1.00 74.23 H new ATOM 0 HG3 ARG A 156 -5.876 -16.572 0.963 1.00 74.23 H new ATOM 0 HD2 ARG A 156 -4.454 -18.076 2.316 1.00 64.34 H new ATOM 0 HD3 ARG A 156 -4.148 -16.779 3.455 1.00 64.34 H new ATOM 0 HE ARG A 156 -6.963 -17.039 3.202 1.00 61.54 H new ATOM 0 HH11 ARG A 156 -4.280 -19.079 4.235 1.00 55.45 H new ATOM 0 HH12 ARG A 156 -5.220 -19.853 5.515 1.00 55.45 H new ATOM 0 HH21 ARG A 156 -8.153 -18.008 4.845 1.00 31.13 H new ATOM 0 HH22 ARG A 156 -7.409 -19.249 5.860 1.00 31.13 H new ATOM 263 N PRO A 157 -0.583 -15.660 1.073 1.00 31.24 N ATOM 264 CA PRO A 157 0.642 -15.584 0.252 1.00 12.11 C ATOM 265 C PRO A 157 0.380 -15.637 -1.262 1.00 72.45 C ATOM 266 O PRO A 157 1.040 -14.948 -2.031 1.00 23.54 O ATOM 267 CB PRO A 157 1.483 -16.770 0.722 1.00 33.41 C ATOM 268 CG PRO A 157 0.990 -17.051 2.100 1.00 54.14 C ATOM 269 CD PRO A 157 -0.481 -16.723 2.092 1.00 30.42 C ATOM 0 HA PRO A 157 1.142 -14.625 0.387 1.00 12.11 H new ATOM 0 HB2 PRO A 157 1.352 -17.633 0.069 1.00 33.41 H new ATOM 0 HB3 PRO A 157 2.546 -16.528 0.722 1.00 33.41 H new ATOM 0 HG2 PRO A 157 1.155 -18.095 2.368 1.00 54.14 H new ATOM 0 HG3 PRO A 157 1.520 -16.445 2.835 1.00 54.14 H new ATOM 0 HD2 PRO A 157 -1.086 -17.591 1.830 1.00 30.42 H new ATOM 0 HD3 PRO A 157 -0.822 -16.379 3.068 1.00 30.42 H new ATOM 277 N LYS A 158 -0.604 -16.417 -1.681 1.00 15.13 N ATOM 278 CA LYS A 158 -0.966 -16.470 -3.089 1.00 5.20 C ATOM 279 C LYS A 158 -1.680 -15.190 -3.518 1.00 62.14 C ATOM 280 O LYS A 158 -1.780 -14.889 -4.709 1.00 31.25 O ATOM 281 CB LYS A 158 -1.847 -17.681 -3.402 1.00 10.31 C ATOM 282 CG LYS A 158 -1.153 -19.038 -3.280 1.00 43.04 C ATOM 283 CD LYS A 158 -2.102 -20.183 -3.641 1.00 5.33 C ATOM 284 CE LYS A 158 -3.275 -20.281 -2.669 1.00 41.14 C ATOM 285 NZ LYS A 158 -4.252 -21.301 -3.075 1.00 64.35 N ATOM 0 H LYS A 158 -1.162 -17.017 -1.073 1.00 15.13 H new ATOM 0 HA LYS A 158 -0.038 -16.567 -3.652 1.00 5.20 H new ATOM 0 HB2 LYS A 158 -2.706 -17.668 -2.731 1.00 10.31 H new ATOM 0 HB3 LYS A 158 -2.233 -17.578 -4.416 1.00 10.31 H new ATOM 0 HG2 LYS A 158 -0.283 -19.064 -3.936 1.00 43.04 H new ATOM 0 HG3 LYS A 158 -0.789 -19.172 -2.261 1.00 43.04 H new ATOM 0 HD2 LYS A 158 -2.481 -20.035 -4.652 1.00 5.33 H new ATOM 0 HD3 LYS A 158 -1.552 -21.124 -3.641 1.00 5.33 H new ATOM 0 HE2 LYS A 158 -2.900 -20.516 -1.673 1.00 41.14 H new ATOM 0 HE3 LYS A 158 -3.771 -19.312 -2.602 1.00 41.14 H new ATOM 0 HZ1 LYS A 158 -5.030 -21.331 -2.385 1.00 64.35 H new ATOM 0 HZ2 LYS A 158 -4.631 -21.064 -4.014 1.00 64.35 H new ATOM 0 HZ3 LYS A 158 -3.788 -22.231 -3.114 1.00 64.35 H new ATOM 299 N ALA A 159 -2.145 -14.425 -2.550 1.00 44.11 N ATOM 300 CA ALA A 159 -2.871 -13.214 -2.840 1.00 73.22 C ATOM 301 C ALA A 159 -1.898 -12.092 -3.036 1.00 35.23 C ATOM 302 O ALA A 159 -2.083 -11.268 -3.915 1.00 55.40 O ATOM 303 CB ALA A 159 -3.888 -12.886 -1.754 1.00 4.13 C ATOM 0 H ALA A 159 -2.031 -14.625 -1.556 1.00 44.11 H new ATOM 0 HA ALA A 159 -3.440 -13.360 -3.758 1.00 73.22 H new ATOM 0 HB1 ALA A 159 -4.412 -11.966 -2.013 1.00 4.13 H new ATOM 0 HB2 ALA A 159 -4.606 -13.702 -1.670 1.00 4.13 H new ATOM 0 HB3 ALA A 159 -3.374 -12.755 -0.802 1.00 4.13 H new ATOM 309 N GLU A 160 -0.812 -12.143 -2.261 1.00 21.41 N ATOM 310 CA GLU A 160 0.295 -11.170 -2.273 1.00 11.52 C ATOM 311 C GLU A 160 0.704 -10.831 -3.677 1.00 63.43 C ATOM 312 O GLU A 160 0.796 -9.657 -4.046 1.00 30.34 O ATOM 313 CB GLU A 160 1.492 -11.783 -1.467 1.00 51.12 C ATOM 314 CG GLU A 160 2.885 -11.092 -1.545 1.00 71.33 C ATOM 315 CD GLU A 160 3.596 -11.244 -2.896 1.00 10.52 C ATOM 316 OE1 GLU A 160 3.679 -12.381 -3.429 1.00 62.53 O ATOM 317 OE2 GLU A 160 4.081 -10.244 -3.444 1.00 64.03 O ATOM 0 H GLU A 160 -0.669 -12.889 -1.581 1.00 21.41 H new ATOM 0 HA GLU A 160 -0.026 -10.239 -1.807 1.00 11.52 H new ATOM 0 HB2 GLU A 160 1.199 -11.817 -0.418 1.00 51.12 H new ATOM 0 HB3 GLU A 160 1.617 -12.814 -1.796 1.00 51.12 H new ATOM 0 HG2 GLU A 160 2.762 -10.030 -1.331 1.00 71.33 H new ATOM 0 HG3 GLU A 160 3.525 -11.503 -0.764 1.00 71.33 H new ATOM 324 N THR A 161 0.882 -11.857 -4.455 1.00 64.14 N ATOM 325 CA THR A 161 1.391 -11.741 -5.777 1.00 55.43 C ATOM 326 C THR A 161 0.489 -10.881 -6.674 1.00 12.22 C ATOM 327 O THR A 161 0.982 -10.030 -7.438 1.00 24.14 O ATOM 328 CB THR A 161 1.637 -13.139 -6.344 1.00 63.43 C ATOM 329 OG1 THR A 161 2.457 -13.860 -5.399 1.00 63.31 O ATOM 330 CG2 THR A 161 2.343 -13.084 -7.686 1.00 21.34 C ATOM 0 H THR A 161 0.671 -12.815 -4.177 1.00 64.14 H new ATOM 0 HA THR A 161 2.343 -11.212 -5.747 1.00 55.43 H new ATOM 0 HB THR A 161 0.679 -13.635 -6.499 1.00 63.43 H new ATOM 0 HG1 THR A 161 2.914 -13.224 -4.810 1.00 63.31 H new ATOM 0 HG21 THR A 161 2.500 -14.097 -8.056 1.00 21.34 H new ATOM 0 HG22 THR A 161 1.731 -12.529 -8.397 1.00 21.34 H new ATOM 0 HG23 THR A 161 3.306 -12.587 -7.570 1.00 21.34 H new ATOM 338 N TYR A 162 -0.810 -11.032 -6.558 1.00 4.12 N ATOM 339 CA TYR A 162 -1.658 -10.199 -7.341 1.00 10.13 C ATOM 340 C TYR A 162 -1.950 -8.891 -6.632 1.00 33.13 C ATOM 341 O TYR A 162 -2.097 -7.869 -7.277 1.00 53.34 O ATOM 342 CB TYR A 162 -2.928 -10.896 -7.875 1.00 62.01 C ATOM 343 CG TYR A 162 -3.944 -11.408 -6.873 1.00 65.21 C ATOM 344 CD1 TYR A 162 -4.771 -10.539 -6.182 1.00 14.24 C ATOM 345 CD2 TYR A 162 -4.123 -12.770 -6.678 1.00 5.10 C ATOM 346 CE1 TYR A 162 -5.741 -11.003 -5.333 1.00 13.23 C ATOM 347 CE2 TYR A 162 -5.087 -13.244 -5.818 1.00 41.33 C ATOM 348 CZ TYR A 162 -5.894 -12.353 -5.150 1.00 50.24 C ATOM 349 OH TYR A 162 -6.887 -12.811 -4.329 1.00 14.20 O ATOM 0 H TYR A 162 -1.279 -11.702 -5.949 1.00 4.12 H new ATOM 0 HA TYR A 162 -1.094 -9.965 -8.244 1.00 10.13 H new ATOM 0 HB2 TYR A 162 -3.438 -10.196 -8.537 1.00 62.01 H new ATOM 0 HB3 TYR A 162 -2.611 -11.740 -8.487 1.00 62.01 H new ATOM 0 HD1 TYR A 162 -4.649 -9.474 -6.315 1.00 14.24 H new ATOM 0 HD2 TYR A 162 -3.495 -13.470 -7.210 1.00 5.10 H new ATOM 0 HE1 TYR A 162 -6.382 -10.309 -4.810 1.00 13.23 H new ATOM 0 HE2 TYR A 162 -5.209 -14.307 -5.669 1.00 41.33 H new ATOM 0 HH TYR A 162 -6.647 -12.634 -3.395 1.00 14.20 H new ATOM 359 N VAL A 163 -1.959 -8.929 -5.300 1.00 10.44 N ATOM 360 CA VAL A 163 -2.244 -7.761 -4.475 1.00 31.35 C ATOM 361 C VAL A 163 -1.197 -6.683 -4.675 1.00 70.52 C ATOM 362 O VAL A 163 -1.536 -5.545 -4.958 1.00 61.24 O ATOM 363 CB VAL A 163 -2.389 -8.135 -2.954 1.00 13.53 C ATOM 364 CG1 VAL A 163 -2.326 -6.907 -2.051 1.00 74.21 C ATOM 365 CG2 VAL A 163 -3.710 -8.857 -2.720 1.00 10.43 C ATOM 0 H VAL A 163 -1.768 -9.775 -4.763 1.00 10.44 H new ATOM 0 HA VAL A 163 -3.205 -7.364 -4.801 1.00 31.35 H new ATOM 0 HB VAL A 163 -1.551 -8.785 -2.701 1.00 13.53 H new ATOM 0 HG11 VAL A 163 -2.431 -7.215 -1.011 1.00 74.21 H new ATOM 0 HG12 VAL A 163 -1.368 -6.405 -2.186 1.00 74.21 H new ATOM 0 HG13 VAL A 163 -3.134 -6.223 -2.310 1.00 74.21 H new ATOM 0 HG21 VAL A 163 -3.803 -9.113 -1.664 1.00 10.43 H new ATOM 0 HG22 VAL A 163 -4.536 -8.208 -3.010 1.00 10.43 H new ATOM 0 HG23 VAL A 163 -3.738 -9.768 -3.318 1.00 10.43 H new ATOM 375 N ARG A 164 0.064 -7.063 -4.605 1.00 10.13 N ATOM 376 CA ARG A 164 1.156 -6.114 -4.747 1.00 3.50 C ATOM 377 C ARG A 164 1.148 -5.465 -6.126 1.00 72.25 C ATOM 378 O ARG A 164 1.337 -4.255 -6.255 1.00 12.14 O ATOM 379 CB ARG A 164 2.494 -6.795 -4.427 1.00 54.01 C ATOM 380 CG ARG A 164 3.720 -5.916 -4.594 1.00 11.21 C ATOM 381 CD ARG A 164 4.942 -6.522 -3.913 1.00 15.25 C ATOM 382 NE ARG A 164 5.168 -7.926 -4.270 1.00 34.45 N ATOM 383 CZ ARG A 164 6.206 -8.398 -4.956 1.00 33.41 C ATOM 384 NH1 ARG A 164 7.099 -7.578 -5.507 1.00 34.33 N ATOM 385 NH2 ARG A 164 6.336 -9.697 -5.091 1.00 72.22 N ATOM 0 H ARG A 164 0.361 -8.027 -4.450 1.00 10.13 H new ATOM 0 HA ARG A 164 1.017 -5.307 -4.027 1.00 3.50 H new ATOM 0 HB2 ARG A 164 2.463 -7.157 -3.399 1.00 54.01 H new ATOM 0 HB3 ARG A 164 2.602 -7.669 -5.070 1.00 54.01 H new ATOM 0 HG2 ARG A 164 3.926 -5.776 -5.655 1.00 11.21 H new ATOM 0 HG3 ARG A 164 3.521 -4.930 -4.175 1.00 11.21 H new ATOM 0 HD2 ARG A 164 5.824 -5.940 -4.180 1.00 15.25 H new ATOM 0 HD3 ARG A 164 4.823 -6.444 -2.832 1.00 15.25 H new ATOM 0 HE ARG A 164 4.467 -8.601 -3.965 1.00 34.45 H new ATOM 0 HH11 ARG A 164 6.994 -6.568 -5.407 1.00 34.33 H new ATOM 0 HH12 ARG A 164 7.888 -7.960 -6.029 1.00 34.33 H new ATOM 0 HH21 ARG A 164 5.648 -10.324 -4.674 1.00 72.22 H new ATOM 0 HH22 ARG A 164 7.125 -10.079 -5.613 1.00 72.22 H new ATOM 399 N ALA A 165 0.856 -6.257 -7.133 1.00 61.41 N ATOM 400 CA ALA A 165 0.792 -5.776 -8.491 1.00 54.13 C ATOM 401 C ALA A 165 -0.437 -4.892 -8.688 1.00 21.32 C ATOM 402 O ALA A 165 -0.383 -3.870 -9.376 1.00 25.53 O ATOM 403 CB ALA A 165 0.784 -6.947 -9.452 1.00 31.15 C ATOM 0 H ALA A 165 0.657 -7.252 -7.032 1.00 61.41 H new ATOM 0 HA ALA A 165 1.674 -5.169 -8.696 1.00 54.13 H new ATOM 0 HB1 ALA A 165 0.736 -6.577 -10.476 1.00 31.15 H new ATOM 0 HB2 ALA A 165 1.694 -7.532 -9.320 1.00 31.15 H new ATOM 0 HB3 ALA A 165 -0.084 -7.576 -9.252 1.00 31.15 H new ATOM 409 N HIS A 166 -1.525 -5.271 -8.045 1.00 14.05 N ATOM 410 CA HIS A 166 -2.765 -4.531 -8.110 1.00 70.03 C ATOM 411 C HIS A 166 -2.593 -3.180 -7.414 1.00 10.03 C ATOM 412 O HIS A 166 -3.094 -2.170 -7.889 1.00 34.02 O ATOM 413 CB HIS A 166 -3.912 -5.351 -7.481 1.00 42.00 C ATOM 414 CG HIS A 166 -5.281 -4.765 -7.656 1.00 1.35 C ATOM 415 ND1 HIS A 166 -6.144 -5.121 -8.669 1.00 4.24 N ATOM 416 CD2 HIS A 166 -5.937 -3.850 -6.917 1.00 51.13 C ATOM 417 CE1 HIS A 166 -7.267 -4.428 -8.522 1.00 50.01 C ATOM 418 NE2 HIS A 166 -7.195 -3.638 -7.467 1.00 53.21 N ATOM 0 H HIS A 166 -1.571 -6.106 -7.461 1.00 14.05 H new ATOM 0 HA HIS A 166 -3.026 -4.348 -9.152 1.00 70.03 H new ATOM 0 HB2 HIS A 166 -3.903 -6.351 -7.914 1.00 42.00 H new ATOM 0 HB3 HIS A 166 -3.715 -5.464 -6.415 1.00 42.00 H new ATOM 0 HD1 HIS A 166 -5.953 -5.800 -9.406 1.00 4.24 H new ATOM 0 HD2 HIS A 166 -5.547 -3.359 -6.037 1.00 51.13 H new ATOM 0 HE1 HIS A 166 -8.123 -4.501 -9.177 1.00 50.01 H new ATOM 426 N ILE A 167 -1.857 -3.172 -6.301 1.00 10.25 N ATOM 427 CA ILE A 167 -1.544 -1.937 -5.589 1.00 64.42 C ATOM 428 C ILE A 167 -0.783 -0.994 -6.505 1.00 60.34 C ATOM 429 O ILE A 167 -1.111 0.182 -6.594 1.00 54.24 O ATOM 430 CB ILE A 167 -0.727 -2.179 -4.271 1.00 4.54 C ATOM 431 CG1 ILE A 167 -1.562 -2.972 -3.255 1.00 21.22 C ATOM 432 CG2 ILE A 167 -0.259 -0.851 -3.655 1.00 44.33 C ATOM 433 CD1 ILE A 167 -0.828 -3.309 -1.967 1.00 20.31 C ATOM 0 H ILE A 167 -1.466 -4.012 -5.874 1.00 10.25 H new ATOM 0 HA ILE A 167 -2.493 -1.490 -5.294 1.00 64.42 H new ATOM 0 HB ILE A 167 0.156 -2.763 -4.530 1.00 4.54 H new ATOM 0 HG12 ILE A 167 -2.456 -2.398 -3.010 1.00 21.22 H new ATOM 0 HG13 ILE A 167 -1.896 -3.899 -3.722 1.00 21.22 H new ATOM 0 HG21 ILE A 167 0.304 -1.051 -2.743 1.00 44.33 H new ATOM 0 HG22 ILE A 167 0.377 -0.324 -4.366 1.00 44.33 H new ATOM 0 HG23 ILE A 167 -1.126 -0.234 -3.418 1.00 44.33 H new ATOM 0 HD11 ILE A 167 -1.490 -3.869 -1.307 1.00 20.31 H new ATOM 0 HD12 ILE A 167 0.051 -3.912 -2.196 1.00 20.31 H new ATOM 0 HD13 ILE A 167 -0.517 -2.388 -1.474 1.00 20.31 H new ATOM 445 N VAL A 168 0.200 -1.521 -7.217 1.00 54.13 N ATOM 446 CA VAL A 168 0.983 -0.712 -8.154 1.00 72.40 C ATOM 447 C VAL A 168 0.091 -0.143 -9.269 1.00 20.41 C ATOM 448 O VAL A 168 0.223 1.024 -9.660 1.00 45.24 O ATOM 449 CB VAL A 168 2.183 -1.495 -8.760 1.00 31.40 C ATOM 450 CG1 VAL A 168 2.969 -0.627 -9.731 1.00 72.54 C ATOM 451 CG2 VAL A 168 3.103 -2.004 -7.664 1.00 45.44 C ATOM 0 H VAL A 168 0.479 -2.501 -7.169 1.00 54.13 H new ATOM 0 HA VAL A 168 1.398 0.116 -7.580 1.00 72.40 H new ATOM 0 HB VAL A 168 1.778 -2.347 -9.306 1.00 31.40 H new ATOM 0 HG11 VAL A 168 3.802 -1.200 -10.139 1.00 72.54 H new ATOM 0 HG12 VAL A 168 2.316 -0.307 -10.543 1.00 72.54 H new ATOM 0 HG13 VAL A 168 3.353 0.248 -9.207 1.00 72.54 H new ATOM 0 HG21 VAL A 168 3.935 -2.548 -8.111 1.00 45.44 H new ATOM 0 HG22 VAL A 168 3.488 -1.160 -7.091 1.00 45.44 H new ATOM 0 HG23 VAL A 168 2.548 -2.669 -7.003 1.00 45.44 H new ATOM 461 N GLN A 169 -0.827 -0.944 -9.757 1.00 75.31 N ATOM 462 CA GLN A 169 -1.735 -0.477 -10.784 1.00 11.21 C ATOM 463 C GLN A 169 -2.710 0.546 -10.249 1.00 33.32 C ATOM 464 O GLN A 169 -3.002 1.542 -10.920 1.00 12.42 O ATOM 465 CB GLN A 169 -2.466 -1.608 -11.474 1.00 34.42 C ATOM 466 CG GLN A 169 -1.577 -2.564 -12.240 1.00 73.14 C ATOM 467 CD GLN A 169 -2.380 -3.522 -13.092 1.00 12.15 C ATOM 468 OE1 GLN A 169 -3.472 -3.188 -13.556 1.00 11.33 O ATOM 469 NE2 GLN A 169 -1.857 -4.688 -13.321 1.00 14.13 N ATOM 0 H GLN A 169 -0.966 -1.911 -9.465 1.00 75.31 H new ATOM 0 HA GLN A 169 -1.114 0.010 -11.536 1.00 11.21 H new ATOM 0 HB2 GLN A 169 -3.023 -2.172 -10.726 1.00 34.42 H new ATOM 0 HB3 GLN A 169 -3.197 -1.183 -12.162 1.00 34.42 H new ATOM 0 HG2 GLN A 169 -0.896 -1.997 -12.875 1.00 73.14 H new ATOM 0 HG3 GLN A 169 -0.963 -3.129 -11.539 1.00 73.14 H new ATOM 0 HE21 GLN A 169 -0.951 -4.928 -12.919 1.00 14.13 H new ATOM 0 HE22 GLN A 169 -2.352 -5.364 -13.903 1.00 14.13 H new ATOM 478 N ARG A 170 -3.189 0.328 -9.052 1.00 24.23 N ATOM 479 CA ARG A 170 -4.097 1.258 -8.450 1.00 25.21 C ATOM 480 C ARG A 170 -3.417 2.556 -8.160 1.00 1.23 C ATOM 481 O ARG A 170 -3.904 3.580 -8.537 1.00 2.34 O ATOM 482 CB ARG A 170 -4.762 0.717 -7.196 1.00 12.23 C ATOM 483 CG ARG A 170 -5.788 -0.373 -7.422 1.00 5.14 C ATOM 484 CD ARG A 170 -6.913 0.110 -8.314 1.00 21.55 C ATOM 485 NE ARG A 170 -8.032 -0.833 -8.347 1.00 42.20 N ATOM 486 CZ ARG A 170 -8.905 -0.959 -9.347 1.00 40.12 C ATOM 487 NH1 ARG A 170 -8.650 -0.422 -10.544 1.00 21.33 N ATOM 488 NH2 ARG A 170 -10.010 -1.668 -9.169 1.00 25.01 N ATOM 0 H ARG A 170 -2.964 -0.485 -8.479 1.00 24.23 H new ATOM 0 HA ARG A 170 -4.890 1.424 -9.179 1.00 25.21 H new ATOM 0 HB2 ARG A 170 -3.988 0.332 -6.533 1.00 12.23 H new ATOM 0 HB3 ARG A 170 -5.245 1.544 -6.676 1.00 12.23 H new ATOM 0 HG2 ARG A 170 -5.308 -1.240 -7.875 1.00 5.14 H new ATOM 0 HG3 ARG A 170 -6.194 -0.698 -6.464 1.00 5.14 H new ATOM 0 HD2 ARG A 170 -7.266 1.079 -7.960 1.00 21.55 H new ATOM 0 HD3 ARG A 170 -6.535 0.259 -9.325 1.00 21.55 H new ATOM 0 HE ARG A 170 -8.154 -1.444 -7.539 1.00 42.20 H new ATOM 0 HH11 ARG A 170 -7.781 0.090 -10.699 1.00 21.33 H new ATOM 0 HH12 ARG A 170 -9.324 -0.524 -11.303 1.00 21.33 H new ATOM 0 HH21 ARG A 170 -10.190 -2.115 -8.270 1.00 25.01 H new ATOM 0 HH22 ARG A 170 -10.681 -1.767 -9.931 1.00 25.01 H new ATOM 502 N THR A 171 -2.250 2.501 -7.577 1.00 42.21 N ATOM 503 CA THR A 171 -1.544 3.702 -7.199 1.00 72.11 C ATOM 504 C THR A 171 -1.196 4.567 -8.413 1.00 45.41 C ATOM 505 O THR A 171 -1.419 5.785 -8.396 1.00 71.44 O ATOM 506 CB THR A 171 -0.296 3.378 -6.368 1.00 62.42 C ATOM 507 OG1 THR A 171 0.443 2.346 -7.017 1.00 23.35 O ATOM 508 CG2 THR A 171 -0.683 2.924 -4.969 1.00 32.21 C ATOM 0 H THR A 171 -1.763 1.634 -7.351 1.00 42.21 H new ATOM 0 HA THR A 171 -2.218 4.286 -6.572 1.00 72.11 H new ATOM 0 HB THR A 171 0.314 4.278 -6.282 1.00 62.42 H new ATOM 0 HG1 THR A 171 0.115 1.472 -6.719 1.00 23.35 H new ATOM 0 HG21 THR A 171 0.217 2.700 -4.397 1.00 32.21 H new ATOM 0 HG22 THR A 171 -1.241 3.717 -4.471 1.00 32.21 H new ATOM 0 HG23 THR A 171 -1.303 2.030 -5.035 1.00 32.21 H new ATOM 516 N SER A 172 -0.759 3.928 -9.495 1.00 14.11 N ATOM 517 CA SER A 172 -0.389 4.651 -10.692 1.00 61.32 C ATOM 518 C SER A 172 -1.606 5.321 -11.344 1.00 31.22 C ATOM 519 O SER A 172 -1.485 6.353 -12.002 1.00 21.23 O ATOM 520 CB SER A 172 0.372 3.733 -11.667 1.00 72.42 C ATOM 521 OG SER A 172 -0.312 2.494 -11.859 1.00 64.33 O ATOM 0 H SER A 172 -0.655 2.915 -9.560 1.00 14.11 H new ATOM 0 HA SER A 172 0.289 5.457 -10.410 1.00 61.32 H new ATOM 0 HB2 SER A 172 0.490 4.237 -12.626 1.00 72.42 H new ATOM 0 HB3 SER A 172 1.373 3.541 -11.282 1.00 72.42 H new ATOM 0 HG SER A 172 -0.078 1.876 -11.136 1.00 64.33 H new ATOM 527 N SER A 173 -2.772 4.747 -11.131 1.00 0.34 N ATOM 528 CA SER A 173 -3.989 5.295 -11.651 1.00 62.35 C ATOM 529 C SER A 173 -4.659 6.278 -10.644 1.00 41.01 C ATOM 530 O SER A 173 -5.267 7.263 -11.046 1.00 62.12 O ATOM 531 CB SER A 173 -4.951 4.150 -12.026 1.00 2.31 C ATOM 532 OG SER A 173 -6.124 4.632 -12.683 1.00 64.25 O ATOM 0 H SER A 173 -2.893 3.889 -10.592 1.00 0.34 H new ATOM 0 HA SER A 173 -3.751 5.872 -12.545 1.00 62.35 H new ATOM 0 HB2 SER A 173 -4.436 3.442 -12.676 1.00 2.31 H new ATOM 0 HB3 SER A 173 -5.237 3.607 -11.125 1.00 2.31 H new ATOM 0 HG SER A 173 -6.708 3.877 -12.906 1.00 64.25 H new ATOM 538 N ASN A 174 -4.511 6.016 -9.356 1.00 40.32 N ATOM 539 CA ASN A 174 -5.190 6.773 -8.296 1.00 72.43 C ATOM 540 C ASN A 174 -4.397 7.984 -7.811 1.00 45.51 C ATOM 541 O ASN A 174 -4.705 8.517 -6.747 1.00 74.01 O ATOM 542 CB ASN A 174 -5.523 5.877 -7.069 1.00 4.43 C ATOM 543 CG ASN A 174 -6.508 4.728 -7.332 1.00 22.20 C ATOM 544 OD1 ASN A 174 -6.429 3.683 -6.693 1.00 23.14 O ATOM 545 ND2 ASN A 174 -7.432 4.900 -8.248 1.00 15.13 N ATOM 0 H ASN A 174 -3.913 5.268 -9.005 1.00 40.32 H new ATOM 0 HA ASN A 174 -6.110 7.131 -8.758 1.00 72.43 H new ATOM 0 HB2 ASN A 174 -4.593 5.454 -6.688 1.00 4.43 H new ATOM 0 HB3 ASN A 174 -5.932 6.509 -6.281 1.00 4.43 H new ATOM 0 HD21 ASN A 174 -8.103 4.157 -8.441 1.00 15.13 H new ATOM 0 HD22 ASN A 174 -7.479 5.777 -8.767 1.00 15.13 H new ATOM 552 N ASP A 175 -3.388 8.417 -8.588 1.00 31.20 N ATOM 553 CA ASP A 175 -2.564 9.633 -8.264 1.00 52.34 C ATOM 554 C ASP A 175 -1.630 9.380 -7.076 1.00 74.44 C ATOM 555 O ASP A 175 -1.230 10.317 -6.357 1.00 44.32 O ATOM 556 CB ASP A 175 -3.458 10.875 -7.961 1.00 50.03 C ATOM 557 CG ASP A 175 -4.209 11.442 -9.149 1.00 2.34 C ATOM 558 OD1 ASP A 175 -5.125 10.769 -9.711 1.00 15.14 O ATOM 559 OD2 ASP A 175 -3.919 12.588 -9.544 1.00 2.22 O ATOM 0 H ASP A 175 -3.110 7.952 -9.452 1.00 31.20 H new ATOM 0 HA ASP A 175 -1.964 9.841 -9.150 1.00 52.34 H new ATOM 0 HB2 ASP A 175 -4.181 10.602 -7.193 1.00 50.03 H new ATOM 0 HB3 ASP A 175 -2.829 11.660 -7.542 1.00 50.03 H new ATOM 564 N ILE A 176 -1.237 8.141 -6.892 1.00 65.43 N ATOM 565 CA ILE A 176 -0.412 7.778 -5.767 1.00 3.54 C ATOM 566 C ILE A 176 0.962 7.276 -6.240 1.00 13.24 C ATOM 567 O ILE A 176 1.063 6.412 -7.099 1.00 62.23 O ATOM 568 CB ILE A 176 -1.094 6.686 -4.897 1.00 52.54 C ATOM 569 CG1 ILE A 176 -2.514 7.121 -4.502 1.00 21.32 C ATOM 570 CG2 ILE A 176 -0.266 6.428 -3.644 1.00 14.44 C ATOM 571 CD1 ILE A 176 -3.305 6.077 -3.745 1.00 65.05 C ATOM 0 H ILE A 176 -1.477 7.366 -7.510 1.00 65.43 H new ATOM 0 HA ILE A 176 -0.277 8.673 -5.159 1.00 3.54 H new ATOM 0 HB ILE A 176 -1.159 5.768 -5.481 1.00 52.54 H new ATOM 0 HG12 ILE A 176 -2.447 8.021 -3.891 1.00 21.32 H new ATOM 0 HG13 ILE A 176 -3.062 7.389 -5.405 1.00 21.32 H new ATOM 0 HG21 ILE A 176 -0.750 5.661 -3.039 1.00 14.44 H new ATOM 0 HG22 ILE A 176 0.730 6.089 -3.929 1.00 14.44 H new ATOM 0 HG23 ILE A 176 -0.184 7.348 -3.066 1.00 14.44 H new ATOM 0 HD11 ILE A 176 -4.293 6.471 -3.508 1.00 65.05 H new ATOM 0 HD12 ILE A 176 -3.408 5.183 -4.359 1.00 65.05 H new ATOM 0 HD13 ILE A 176 -2.784 5.825 -2.821 1.00 65.05 H new ATOM 583 N THR A 177 1.987 7.832 -5.681 1.00 2.33 N ATOM 584 CA THR A 177 3.347 7.468 -5.967 1.00 4.41 C ATOM 585 C THR A 177 3.828 6.559 -4.822 1.00 21.21 C ATOM 586 O THR A 177 3.362 6.700 -3.693 1.00 21.00 O ATOM 587 CB THR A 177 4.182 8.758 -6.035 1.00 63.43 C ATOM 588 OG1 THR A 177 3.517 9.663 -6.931 1.00 71.33 O ATOM 589 CG2 THR A 177 5.593 8.498 -6.547 1.00 23.20 C ATOM 0 H THR A 177 1.904 8.577 -4.989 1.00 2.33 H new ATOM 0 HA THR A 177 3.443 6.939 -6.915 1.00 4.41 H new ATOM 0 HB THR A 177 4.269 9.174 -5.031 1.00 63.43 H new ATOM 0 HG1 THR A 177 4.028 10.497 -6.992 1.00 71.33 H new ATOM 0 HG21 THR A 177 6.147 9.436 -6.579 1.00 23.20 H new ATOM 0 HG22 THR A 177 6.099 7.800 -5.880 1.00 23.20 H new ATOM 0 HG23 THR A 177 5.544 8.072 -7.549 1.00 23.20 H new ATOM 597 N LEU A 178 4.692 5.627 -5.099 1.00 24.53 N ATOM 598 CA LEU A 178 5.126 4.690 -4.087 1.00 62.00 C ATOM 599 C LEU A 178 6.504 5.063 -3.559 1.00 74.41 C ATOM 600 O LEU A 178 7.345 5.544 -4.299 1.00 34.52 O ATOM 601 CB LEU A 178 5.145 3.234 -4.614 1.00 33.34 C ATOM 602 CG LEU A 178 3.825 2.645 -5.168 1.00 22.45 C ATOM 603 CD1 LEU A 178 3.498 3.178 -6.559 1.00 44.44 C ATOM 604 CD2 LEU A 178 3.872 1.131 -5.178 1.00 64.35 C ATOM 0 H LEU A 178 5.115 5.490 -6.017 1.00 24.53 H new ATOM 0 HA LEU A 178 4.402 4.745 -3.274 1.00 62.00 H new ATOM 0 HB2 LEU A 178 5.895 3.174 -5.403 1.00 33.34 H new ATOM 0 HB3 LEU A 178 5.484 2.590 -3.803 1.00 33.34 H new ATOM 0 HG LEU A 178 3.027 2.966 -4.499 1.00 22.45 H new ATOM 0 HD11 LEU A 178 2.564 2.737 -6.907 1.00 44.44 H new ATOM 0 HD12 LEU A 178 3.395 4.262 -6.518 1.00 44.44 H new ATOM 0 HD13 LEU A 178 4.302 2.916 -7.247 1.00 44.44 H new ATOM 0 HD21 LEU A 178 2.933 0.740 -5.571 1.00 64.35 H new ATOM 0 HD22 LEU A 178 4.696 0.797 -5.808 1.00 64.35 H new ATOM 0 HD23 LEU A 178 4.020 0.765 -4.162 1.00 64.35 H new ATOM 616 N ARG A 179 6.704 4.870 -2.276 1.00 30.43 N ATOM 617 CA ARG A 179 7.984 5.123 -1.625 1.00 50.13 C ATOM 618 C ARG A 179 8.690 3.817 -1.290 1.00 14.50 C ATOM 619 O ARG A 179 9.830 3.819 -0.820 1.00 42.23 O ATOM 620 CB ARG A 179 7.812 5.983 -0.364 1.00 51.52 C ATOM 621 CG ARG A 179 8.345 7.400 -0.511 1.00 2.40 C ATOM 622 CD ARG A 179 9.868 7.419 -0.602 1.00 52.11 C ATOM 623 NE ARG A 179 10.397 8.750 -0.937 1.00 41.22 N ATOM 624 CZ ARG A 179 11.530 9.285 -0.444 1.00 1.22 C ATOM 625 NH1 ARG A 179 12.160 8.714 0.588 1.00 12.45 N ATOM 626 NH2 ARG A 179 12.001 10.411 -0.954 1.00 54.55 N ATOM 0 H ARG A 179 5.981 4.530 -1.642 1.00 30.43 H new ATOM 0 HA ARG A 179 8.605 5.680 -2.327 1.00 50.13 H new ATOM 0 HB2 ARG A 179 6.754 6.028 -0.107 1.00 51.52 H new ATOM 0 HB3 ARG A 179 8.322 5.497 0.468 1.00 51.52 H new ATOM 0 HG2 ARG A 179 7.921 7.858 -1.404 1.00 2.40 H new ATOM 0 HG3 ARG A 179 8.023 8.001 0.339 1.00 2.40 H new ATOM 0 HD2 ARG A 179 10.289 7.093 0.349 1.00 52.11 H new ATOM 0 HD3 ARG A 179 10.192 6.702 -1.357 1.00 52.11 H new ATOM 0 HE ARG A 179 9.862 9.314 -1.597 1.00 41.22 H new ATOM 0 HH11 ARG A 179 11.783 7.865 1.009 1.00 12.45 H new ATOM 0 HH12 ARG A 179 13.018 9.127 0.954 1.00 12.45 H new ATOM 0 HH21 ARG A 179 11.506 10.871 -1.718 1.00 54.55 H new ATOM 0 HH22 ARG A 179 12.859 10.819 -0.583 1.00 54.55 H new ATOM 640 N GLY A 180 8.013 2.723 -1.493 1.00 31.42 N ATOM 641 CA GLY A 180 8.614 1.434 -1.294 1.00 12.14 C ATOM 642 C GLY A 180 7.593 0.426 -0.927 1.00 63.21 C ATOM 643 O GLY A 180 6.481 0.786 -0.535 1.00 32.30 O ATOM 0 H GLY A 180 7.040 2.698 -1.798 1.00 31.42 H new ATOM 0 HA2 GLY A 180 9.127 1.123 -2.204 1.00 12.14 H new ATOM 0 HA3 GLY A 180 9.367 1.497 -0.509 1.00 12.14 H new ATOM 647 N ILE A 181 7.942 -0.815 -1.060 1.00 14.43 N ATOM 648 CA ILE A 181 7.048 -1.908 -0.740 1.00 70.55 C ATOM 649 C ILE A 181 7.815 -2.940 0.050 1.00 70.52 C ATOM 650 O ILE A 181 8.823 -3.466 -0.419 1.00 41.11 O ATOM 651 CB ILE A 181 6.445 -2.596 -2.008 1.00 13.54 C ATOM 652 CG1 ILE A 181 5.699 -1.582 -2.891 1.00 51.34 C ATOM 653 CG2 ILE A 181 5.493 -3.725 -1.591 1.00 23.41 C ATOM 654 CD1 ILE A 181 5.174 -2.163 -4.192 1.00 40.13 C ATOM 0 H ILE A 181 8.859 -1.111 -1.395 1.00 14.43 H new ATOM 0 HA ILE A 181 6.217 -1.494 -0.169 1.00 70.55 H new ATOM 0 HB ILE A 181 7.268 -3.012 -2.589 1.00 13.54 H new ATOM 0 HG12 ILE A 181 4.863 -1.170 -2.326 1.00 51.34 H new ATOM 0 HG13 ILE A 181 6.369 -0.753 -3.120 1.00 51.34 H new ATOM 0 HG21 ILE A 181 5.078 -4.198 -2.481 1.00 23.41 H new ATOM 0 HG22 ILE A 181 6.040 -4.466 -1.008 1.00 23.41 H new ATOM 0 HG23 ILE A 181 4.684 -3.314 -0.988 1.00 23.41 H new ATOM 0 HD11 ILE A 181 4.661 -1.385 -4.757 1.00 40.13 H new ATOM 0 HD12 ILE A 181 6.006 -2.549 -4.780 1.00 40.13 H new ATOM 0 HD13 ILE A 181 4.477 -2.972 -3.974 1.00 40.13 H new ATOM 666 N ARG A 182 7.364 -3.207 1.231 1.00 74.53 N ATOM 667 CA ARG A 182 7.988 -4.182 2.085 1.00 62.54 C ATOM 668 C ARG A 182 6.961 -5.245 2.379 1.00 33.55 C ATOM 669 O ARG A 182 5.776 -4.945 2.414 1.00 32.20 O ATOM 670 CB ARG A 182 8.426 -3.522 3.387 1.00 31.34 C ATOM 671 CG ARG A 182 9.253 -2.264 3.192 1.00 71.02 C ATOM 672 CD ARG A 182 9.708 -1.702 4.512 1.00 64.13 C ATOM 673 NE ARG A 182 10.648 -2.601 5.178 1.00 11.21 N ATOM 674 CZ ARG A 182 11.066 -2.474 6.430 1.00 4.41 C ATOM 675 NH1 ARG A 182 10.564 -1.528 7.207 1.00 1.31 N ATOM 676 NH2 ARG A 182 11.981 -3.300 6.904 1.00 25.51 N ATOM 0 H ARG A 182 6.546 -2.755 1.640 1.00 74.53 H new ATOM 0 HA ARG A 182 8.866 -4.612 1.602 1.00 62.54 H new ATOM 0 HB2 ARG A 182 7.541 -3.276 3.974 1.00 31.34 H new ATOM 0 HB3 ARG A 182 9.005 -4.239 3.969 1.00 31.34 H new ATOM 0 HG2 ARG A 182 10.120 -2.488 2.571 1.00 71.02 H new ATOM 0 HG3 ARG A 182 8.664 -1.517 2.659 1.00 71.02 H new ATOM 0 HD2 ARG A 182 10.180 -0.732 4.353 1.00 64.13 H new ATOM 0 HD3 ARG A 182 8.844 -1.535 5.155 1.00 64.13 H new ATOM 0 HE ARG A 182 11.011 -3.387 4.638 1.00 11.21 H new ATOM 0 HH11 ARG A 182 9.853 -0.893 6.843 1.00 1.31 H new ATOM 0 HH12 ARG A 182 10.888 -1.433 8.170 1.00 1.31 H new ATOM 0 HH21 ARG A 182 12.364 -4.033 6.307 1.00 25.51 H new ATOM 0 HH22 ARG A 182 12.304 -3.205 7.867 1.00 25.51 H new ATOM 690 N THR A 183 7.367 -6.455 2.562 1.00 71.33 N ATOM 691 CA THR A 183 6.430 -7.492 2.848 1.00 61.35 C ATOM 692 C THR A 183 7.075 -8.536 3.755 1.00 33.30 C ATOM 693 O THR A 183 8.278 -8.812 3.655 1.00 41.23 O ATOM 694 CB THR A 183 5.858 -8.121 1.531 1.00 62.31 C ATOM 695 OG1 THR A 183 4.785 -9.008 1.829 1.00 75.04 O ATOM 696 CG2 THR A 183 6.928 -8.865 0.736 1.00 31.20 C ATOM 0 H THR A 183 8.342 -6.753 2.519 1.00 71.33 H new ATOM 0 HA THR A 183 5.579 -7.065 3.379 1.00 61.35 H new ATOM 0 HB THR A 183 5.495 -7.297 0.917 1.00 62.31 H new ATOM 0 HG1 THR A 183 4.333 -8.711 2.646 1.00 75.04 H new ATOM 0 HG21 THR A 183 6.485 -9.284 -0.168 1.00 31.20 H new ATOM 0 HG22 THR A 183 7.725 -8.173 0.463 1.00 31.20 H new ATOM 0 HG23 THR A 183 7.340 -9.670 1.345 1.00 31.20 H new ATOM 704 N GLY A 184 6.316 -9.029 4.689 1.00 15.22 N ATOM 705 CA GLY A 184 6.812 -10.011 5.595 1.00 42.34 C ATOM 706 C GLY A 184 5.736 -10.980 6.005 1.00 41.15 C ATOM 707 O GLY A 184 4.577 -10.584 6.109 1.00 14.44 O ATOM 0 H GLY A 184 5.343 -8.761 4.840 1.00 15.22 H new ATOM 0 HA2 GLY A 184 7.634 -10.555 5.129 1.00 42.34 H new ATOM 0 HA3 GLY A 184 7.216 -9.519 6.480 1.00 42.34 H new ATOM 711 N PRO A 185 6.070 -12.264 6.177 1.00 72.40 N ATOM 712 CA PRO A 185 5.146 -13.279 6.716 1.00 23.32 C ATOM 713 C PRO A 185 4.481 -12.756 8.002 1.00 52.25 C ATOM 714 O PRO A 185 5.166 -12.321 8.929 1.00 24.32 O ATOM 715 CB PRO A 185 6.075 -14.449 7.034 1.00 30.13 C ATOM 716 CG PRO A 185 7.199 -14.313 6.069 1.00 32.12 C ATOM 717 CD PRO A 185 7.374 -12.838 5.829 1.00 63.04 C ATOM 0 HA PRO A 185 4.338 -13.543 6.034 1.00 23.32 H new ATOM 0 HB2 PRO A 185 6.430 -14.404 8.064 1.00 30.13 H new ATOM 0 HB3 PRO A 185 5.564 -15.404 6.914 1.00 30.13 H new ATOM 0 HG2 PRO A 185 8.112 -14.752 6.471 1.00 32.12 H new ATOM 0 HG3 PRO A 185 6.977 -14.835 5.138 1.00 32.12 H new ATOM 0 HD2 PRO A 185 8.170 -12.425 6.448 1.00 63.04 H new ATOM 0 HD3 PRO A 185 7.637 -12.631 4.792 1.00 63.04 H new ATOM 725 N ALA A 186 3.168 -12.795 8.052 1.00 32.10 N ATOM 726 CA ALA A 186 2.442 -12.138 9.131 1.00 63.13 C ATOM 727 C ALA A 186 1.987 -13.081 10.227 1.00 63.35 C ATOM 728 O ALA A 186 1.363 -12.642 11.202 1.00 51.34 O ATOM 729 CB ALA A 186 1.264 -11.360 8.574 1.00 20.52 C ATOM 0 H ALA A 186 2.579 -13.269 7.367 1.00 32.10 H new ATOM 0 HA ALA A 186 3.148 -11.453 9.601 1.00 63.13 H new ATOM 0 HB1 ALA A 186 0.730 -10.874 9.391 1.00 20.52 H new ATOM 0 HB2 ALA A 186 1.624 -10.605 7.876 1.00 20.52 H new ATOM 0 HB3 ALA A 186 0.590 -12.042 8.055 1.00 20.52 H new ATOM 735 N GLY A 187 2.301 -14.340 10.102 1.00 73.14 N ATOM 736 CA GLY A 187 1.875 -15.286 11.073 1.00 71.34 C ATOM 737 C GLY A 187 2.093 -16.691 10.630 1.00 71.30 C ATOM 738 O GLY A 187 3.127 -17.298 10.936 1.00 12.04 O ATOM 0 H GLY A 187 2.851 -14.727 9.335 1.00 73.14 H new ATOM 0 HA2 GLY A 187 2.414 -15.114 12.005 1.00 71.34 H new ATOM 0 HA3 GLY A 187 0.816 -15.134 11.284 1.00 71.34 H new ATOM 742 N ASP A 188 1.176 -17.199 9.868 1.00 24.11 N ATOM 743 CA ASP A 188 1.250 -18.585 9.429 1.00 53.30 C ATOM 744 C ASP A 188 1.050 -18.693 7.953 1.00 14.31 C ATOM 745 O ASP A 188 1.991 -18.960 7.209 1.00 63.33 O ATOM 746 CB ASP A 188 0.250 -19.493 10.171 1.00 64.32 C ATOM 747 CG ASP A 188 0.617 -19.742 11.615 1.00 62.31 C ATOM 748 OD1 ASP A 188 0.191 -18.972 12.493 1.00 52.43 O ATOM 749 OD2 ASP A 188 1.337 -20.736 11.905 1.00 24.12 O ATOM 0 H ASP A 188 0.362 -16.687 9.529 1.00 24.11 H new ATOM 0 HA ASP A 188 2.253 -18.934 9.676 1.00 53.30 H new ATOM 0 HB2 ASP A 188 -0.740 -19.039 10.129 1.00 64.32 H new ATOM 0 HB3 ASP A 188 0.185 -20.449 9.651 1.00 64.32 H new ATOM 754 N ASP A 189 -0.154 -18.439 7.518 1.00 24.45 N ATOM 755 CA ASP A 189 -0.504 -18.528 6.116 1.00 31.12 C ATOM 756 C ASP A 189 -1.020 -17.179 5.690 1.00 44.11 C ATOM 757 O ASP A 189 -2.088 -17.014 5.097 1.00 0.13 O ATOM 758 CB ASP A 189 -1.515 -19.656 5.828 1.00 14.22 C ATOM 759 CG ASP A 189 -1.688 -19.925 4.332 1.00 40.35 C ATOM 760 OD1 ASP A 189 -0.771 -20.509 3.714 1.00 41.14 O ATOM 761 OD2 ASP A 189 -2.749 -19.608 3.766 1.00 71.05 O ATOM 0 H ASP A 189 -0.927 -18.163 8.124 1.00 24.45 H new ATOM 0 HA ASP A 189 0.379 -18.792 5.534 1.00 31.12 H new ATOM 0 HB2 ASP A 189 -1.184 -20.570 6.322 1.00 14.22 H new ATOM 0 HB3 ASP A 189 -2.480 -19.392 6.260 1.00 14.22 H new ATOM 766 N ASN A 190 -0.276 -16.211 6.092 1.00 55.33 N ATOM 767 CA ASN A 190 -0.494 -14.841 5.767 1.00 64.34 C ATOM 768 C ASN A 190 0.784 -14.124 5.657 1.00 33.34 C ATOM 769 O ASN A 190 1.816 -14.533 6.207 1.00 54.11 O ATOM 770 CB ASN A 190 -1.407 -14.072 6.735 1.00 3.43 C ATOM 771 CG ASN A 190 -1.247 -14.433 8.210 1.00 10.04 C ATOM 772 OD1 ASN A 190 -0.211 -14.929 8.635 1.00 12.43 O ATOM 773 ND2 ASN A 190 -2.236 -14.133 9.003 1.00 62.11 N ATOM 0 H ASN A 190 0.541 -16.357 6.685 1.00 55.33 H new ATOM 0 HA ASN A 190 -1.017 -14.874 4.811 1.00 64.34 H new ATOM 0 HB2 ASN A 190 -1.218 -13.005 6.617 1.00 3.43 H new ATOM 0 HB3 ASN A 190 -2.444 -14.246 6.446 1.00 3.43 H new ATOM 0 HD21 ASN A 190 -2.159 -14.310 10.004 1.00 62.11 H new ATOM 0 HD22 ASN A 190 -3.088 -13.721 8.622 1.00 62.11 H new ATOM 780 N ILE A 191 0.710 -13.057 4.987 1.00 13.40 N ATOM 781 CA ILE A 191 1.830 -12.213 4.738 1.00 2.45 C ATOM 782 C ILE A 191 1.336 -10.772 4.698 1.00 61.33 C ATOM 783 O ILE A 191 0.235 -10.501 4.195 1.00 64.14 O ATOM 784 CB ILE A 191 2.552 -12.638 3.411 1.00 4.02 C ATOM 785 CG1 ILE A 191 3.817 -11.816 3.160 1.00 11.43 C ATOM 786 CG2 ILE A 191 1.608 -12.568 2.211 1.00 53.23 C ATOM 787 CD1 ILE A 191 4.654 -12.312 1.993 1.00 4.32 C ATOM 0 H ILE A 191 -0.158 -12.718 4.573 1.00 13.40 H new ATOM 0 HA ILE A 191 2.571 -12.307 5.532 1.00 2.45 H new ATOM 0 HB ILE A 191 2.857 -13.677 3.537 1.00 4.02 H new ATOM 0 HG12 ILE A 191 3.534 -10.779 2.976 1.00 11.43 H new ATOM 0 HG13 ILE A 191 4.429 -11.825 4.062 1.00 11.43 H new ATOM 0 HG21 ILE A 191 2.142 -12.869 1.310 1.00 53.23 H new ATOM 0 HG22 ILE A 191 0.763 -13.238 2.373 1.00 53.23 H new ATOM 0 HG23 ILE A 191 1.244 -11.547 2.093 1.00 53.23 H new ATOM 0 HD11 ILE A 191 5.533 -11.677 1.880 1.00 4.32 H new ATOM 0 HD12 ILE A 191 4.969 -13.338 2.182 1.00 4.32 H new ATOM 0 HD13 ILE A 191 4.061 -12.277 1.079 1.00 4.32 H new ATOM 799 N THR A 192 2.082 -9.883 5.292 1.00 74.34 N ATOM 800 CA THR A 192 1.706 -8.509 5.334 1.00 13.51 C ATOM 801 C THR A 192 2.518 -7.751 4.312 1.00 4.11 C ATOM 802 O THR A 192 3.733 -7.956 4.179 1.00 53.41 O ATOM 803 CB THR A 192 1.861 -7.889 6.770 1.00 74.02 C ATOM 804 OG1 THR A 192 1.309 -6.564 6.823 1.00 32.34 O ATOM 805 CG2 THR A 192 3.316 -7.845 7.242 1.00 24.11 C ATOM 0 H THR A 192 2.964 -10.096 5.758 1.00 74.34 H new ATOM 0 HA THR A 192 0.647 -8.430 5.090 1.00 13.51 H new ATOM 0 HB THR A 192 1.308 -8.547 7.441 1.00 74.02 H new ATOM 0 HG1 THR A 192 1.416 -6.201 7.727 1.00 32.34 H new ATOM 0 HG21 THR A 192 3.362 -7.407 8.239 1.00 24.11 H new ATOM 0 HG22 THR A 192 3.720 -8.857 7.271 1.00 24.11 H new ATOM 0 HG23 THR A 192 3.904 -7.239 6.553 1.00 24.11 H new ATOM 813 N LEU A 193 1.855 -6.967 3.542 1.00 33.31 N ATOM 814 CA LEU A 193 2.499 -6.151 2.563 1.00 64.30 C ATOM 815 C LEU A 193 2.335 -4.718 2.993 1.00 1.41 C ATOM 816 O LEU A 193 1.219 -4.253 3.150 1.00 14.42 O ATOM 817 CB LEU A 193 1.874 -6.312 1.158 1.00 43.34 C ATOM 818 CG LEU A 193 1.973 -7.672 0.431 1.00 25.52 C ATOM 819 CD1 LEU A 193 1.170 -8.761 1.127 1.00 5.51 C ATOM 820 CD2 LEU A 193 1.507 -7.508 -0.997 1.00 42.10 C ATOM 0 H LEU A 193 0.840 -6.868 3.569 1.00 33.31 H new ATOM 0 HA LEU A 193 3.545 -6.451 2.495 1.00 64.30 H new ATOM 0 HB2 LEU A 193 0.816 -6.063 1.241 1.00 43.34 H new ATOM 0 HB3 LEU A 193 2.329 -5.562 0.511 1.00 43.34 H new ATOM 0 HG LEU A 193 3.016 -7.988 0.451 1.00 25.52 H new ATOM 0 HD11 LEU A 193 1.273 -9.696 0.577 1.00 5.51 H new ATOM 0 HD12 LEU A 193 1.542 -8.895 2.143 1.00 5.51 H new ATOM 0 HD13 LEU A 193 0.119 -8.473 1.161 1.00 5.51 H new ATOM 0 HD21 LEU A 193 1.575 -8.465 -1.514 1.00 42.10 H new ATOM 0 HD22 LEU A 193 0.473 -7.164 -1.005 1.00 42.10 H new ATOM 0 HD23 LEU A 193 2.137 -6.776 -1.503 1.00 42.10 H new ATOM 832 N THR A 194 3.409 -4.045 3.205 1.00 52.53 N ATOM 833 CA THR A 194 3.377 -2.678 3.610 1.00 62.33 C ATOM 834 C THR A 194 3.899 -1.808 2.475 1.00 0.43 C ATOM 835 O THR A 194 5.084 -1.871 2.117 1.00 13.41 O ATOM 836 CB THR A 194 4.240 -2.473 4.865 1.00 0.23 C ATOM 837 OG1 THR A 194 3.832 -3.427 5.865 1.00 54.42 O ATOM 838 CG2 THR A 194 4.070 -1.057 5.415 1.00 74.34 C ATOM 0 H THR A 194 4.348 -4.429 3.102 1.00 52.53 H new ATOM 0 HA THR A 194 2.351 -2.397 3.846 1.00 62.33 H new ATOM 0 HB THR A 194 5.289 -2.617 4.605 1.00 0.23 H new ATOM 0 HG1 THR A 194 4.376 -3.309 6.671 1.00 54.42 H new ATOM 0 HG21 THR A 194 4.690 -0.935 6.303 1.00 74.34 H new ATOM 0 HG22 THR A 194 4.374 -0.334 4.658 1.00 74.34 H new ATOM 0 HG23 THR A 194 3.025 -0.891 5.677 1.00 74.34 H new ATOM 846 N ALA A 195 3.025 -1.060 1.882 1.00 13.30 N ATOM 847 CA ALA A 195 3.387 -0.179 0.821 1.00 10.31 C ATOM 848 C ALA A 195 3.461 1.232 1.349 1.00 22.34 C ATOM 849 O ALA A 195 2.515 1.718 1.983 1.00 20.33 O ATOM 850 CB ALA A 195 2.385 -0.275 -0.322 1.00 42.30 C ATOM 0 H ALA A 195 2.034 -1.044 2.122 1.00 13.30 H new ATOM 0 HA ALA A 195 4.364 -0.467 0.432 1.00 10.31 H new ATOM 0 HB1 ALA A 195 2.679 0.405 -1.122 1.00 42.30 H new ATOM 0 HB2 ALA A 195 2.364 -1.296 -0.703 1.00 42.30 H new ATOM 0 HB3 ALA A 195 1.393 -0.003 0.040 1.00 42.30 H new ATOM 856 N HIS A 196 4.574 1.866 1.129 1.00 65.44 N ATOM 857 CA HIS A 196 4.769 3.226 1.535 1.00 72.43 C ATOM 858 C HIS A 196 4.335 4.060 0.363 1.00 4.15 C ATOM 859 O HIS A 196 4.805 3.841 -0.750 1.00 72.11 O ATOM 860 CB HIS A 196 6.252 3.492 1.872 1.00 30.33 C ATOM 861 CG HIS A 196 6.818 2.619 2.969 1.00 42.24 C ATOM 862 ND1 HIS A 196 7.072 3.048 4.256 1.00 62.32 N ATOM 863 CD2 HIS A 196 7.201 1.316 2.937 1.00 25.31 C ATOM 864 CE1 HIS A 196 7.585 2.022 4.941 1.00 63.13 C ATOM 865 NE2 HIS A 196 7.685 0.946 4.186 1.00 63.31 N ATOM 0 H HIS A 196 5.378 1.451 0.659 1.00 65.44 H new ATOM 0 HA HIS A 196 4.199 3.462 2.434 1.00 72.43 H new ATOM 0 HB2 HIS A 196 6.847 3.349 0.970 1.00 30.33 H new ATOM 0 HB3 HIS A 196 6.362 4.536 2.164 1.00 30.33 H new ATOM 0 HD1 HIS A 196 6.898 3.985 4.621 1.00 62.32 H new ATOM 0 HD2 HIS A 196 7.139 0.668 2.075 1.00 25.31 H new ATOM 0 HE1 HIS A 196 7.880 2.068 5.979 1.00 63.13 H new ATOM 873 N LEU A 197 3.442 4.964 0.576 1.00 53.30 N ATOM 874 CA LEU A 197 2.842 5.699 -0.500 1.00 62.53 C ATOM 875 C LEU A 197 2.943 7.200 -0.281 1.00 54.23 C ATOM 876 O LEU A 197 3.087 7.672 0.835 1.00 22.21 O ATOM 877 CB LEU A 197 1.365 5.296 -0.628 1.00 2.52 C ATOM 878 CG LEU A 197 1.078 3.803 -0.873 1.00 32.10 C ATOM 879 CD1 LEU A 197 -0.414 3.541 -0.911 1.00 1.14 C ATOM 880 CD2 LEU A 197 1.729 3.328 -2.162 1.00 33.43 C ATOM 0 H LEU A 197 3.101 5.220 1.503 1.00 53.30 H new ATOM 0 HA LEU A 197 3.381 5.459 -1.416 1.00 62.53 H new ATOM 0 HB2 LEU A 197 0.849 5.597 0.284 1.00 2.52 H new ATOM 0 HB3 LEU A 197 0.926 5.866 -1.446 1.00 2.52 H new ATOM 0 HG LEU A 197 1.508 3.241 -0.044 1.00 32.10 H new ATOM 0 HD11 LEU A 197 -0.593 2.480 -1.085 1.00 1.14 H new ATOM 0 HD12 LEU A 197 -0.859 3.833 0.040 1.00 1.14 H new ATOM 0 HD13 LEU A 197 -0.865 4.122 -1.716 1.00 1.14 H new ATOM 0 HD21 LEU A 197 1.511 2.271 -2.312 1.00 33.43 H new ATOM 0 HD22 LEU A 197 1.336 3.902 -3.001 1.00 33.43 H new ATOM 0 HD23 LEU A 197 2.808 3.471 -2.099 1.00 33.43 H new ATOM 892 N LEU A 198 2.901 7.913 -1.356 1.00 14.44 N ATOM 893 CA LEU A 198 2.890 9.353 -1.390 1.00 21.30 C ATOM 894 C LEU A 198 1.768 9.733 -2.329 1.00 13.22 C ATOM 895 O LEU A 198 1.802 9.356 -3.495 1.00 74.31 O ATOM 896 CB LEU A 198 4.197 9.874 -2.002 1.00 34.15 C ATOM 897 CG LEU A 198 5.508 9.530 -1.315 1.00 23.45 C ATOM 898 CD1 LEU A 198 6.666 10.084 -2.123 1.00 24.14 C ATOM 899 CD2 LEU A 198 5.542 10.088 0.092 1.00 2.01 C ATOM 0 H LEU A 198 2.872 7.495 -2.286 1.00 14.44 H new ATOM 0 HA LEU A 198 2.772 9.764 -0.387 1.00 21.30 H new ATOM 0 HB2 LEU A 198 4.253 9.506 -3.026 1.00 34.15 H new ATOM 0 HB3 LEU A 198 4.127 10.960 -2.057 1.00 34.15 H new ATOM 0 HG LEU A 198 5.595 8.445 -1.252 1.00 23.45 H new ATOM 0 HD11 LEU A 198 7.606 9.837 -1.629 1.00 24.14 H new ATOM 0 HD12 LEU A 198 6.655 9.647 -3.122 1.00 24.14 H new ATOM 0 HD13 LEU A 198 6.571 11.167 -2.200 1.00 24.14 H new ATOM 0 HD21 LEU A 198 6.490 9.829 0.563 1.00 2.01 H new ATOM 0 HD22 LEU A 198 5.439 11.173 0.056 1.00 2.01 H new ATOM 0 HD23 LEU A 198 4.721 9.665 0.671 1.00 2.01 H new ATOM 911 N MET A 199 0.787 10.447 -1.879 1.00 74.23 N ATOM 912 CA MET A 199 -0.307 10.759 -2.778 1.00 14.24 C ATOM 913 C MET A 199 -0.277 12.202 -3.193 1.00 64.24 C ATOM 914 O MET A 199 -0.150 13.099 -2.356 1.00 4.31 O ATOM 915 CB MET A 199 -1.667 10.408 -2.173 1.00 14.14 C ATOM 916 CG MET A 199 -2.807 10.570 -3.169 1.00 55.42 C ATOM 917 SD MET A 199 -4.420 10.150 -2.497 1.00 21.22 S ATOM 918 CE MET A 199 -5.372 10.153 -4.008 1.00 25.04 C ATOM 0 H MET A 199 0.708 10.819 -0.933 1.00 74.23 H new ATOM 0 HA MET A 199 -0.169 10.140 -3.665 1.00 14.24 H new ATOM 0 HB2 MET A 199 -1.646 9.379 -1.813 1.00 14.14 H new ATOM 0 HB3 MET A 199 -1.851 11.045 -1.308 1.00 14.14 H new ATOM 0 HG2 MET A 199 -2.827 11.602 -3.520 1.00 55.42 H new ATOM 0 HG3 MET A 199 -2.611 9.942 -4.038 1.00 55.42 H new ATOM 0 HE1 MET A 199 -6.430 10.266 -3.771 1.00 25.04 H new ATOM 0 HE2 MET A 199 -5.051 10.982 -4.639 1.00 25.04 H new ATOM 0 HE3 MET A 199 -5.217 9.213 -4.537 1.00 25.04 H new ATOM 928 N VAL A 200 -0.372 12.419 -4.486 1.00 54.15 N ATOM 929 CA VAL A 200 -0.393 13.744 -5.046 1.00 51.11 C ATOM 930 C VAL A 200 -1.778 14.306 -4.818 1.00 1.53 C ATOM 931 O VAL A 200 -2.776 13.664 -5.182 1.00 23.22 O ATOM 932 CB VAL A 200 -0.114 13.719 -6.578 1.00 11.31 C ATOM 933 CG1 VAL A 200 0.008 15.125 -7.142 1.00 10.44 C ATOM 934 CG2 VAL A 200 1.125 12.906 -6.904 1.00 45.54 C ATOM 0 H VAL A 200 -0.437 11.674 -5.179 1.00 54.15 H new ATOM 0 HA VAL A 200 0.380 14.349 -4.571 1.00 51.11 H new ATOM 0 HB VAL A 200 -0.969 13.236 -7.052 1.00 11.31 H new ATOM 0 HG11 VAL A 200 0.203 15.072 -8.213 1.00 10.44 H new ATOM 0 HG12 VAL A 200 -0.921 15.668 -6.969 1.00 10.44 H new ATOM 0 HG13 VAL A 200 0.830 15.645 -6.649 1.00 10.44 H new ATOM 0 HG21 VAL A 200 1.290 12.910 -7.981 1.00 45.54 H new ATOM 0 HG22 VAL A 200 1.989 13.343 -6.403 1.00 45.54 H new ATOM 0 HG23 VAL A 200 0.988 11.880 -6.562 1.00 45.54 H new ATOM 944 N GLY A 201 -1.865 15.451 -4.192 1.00 4.25 N ATOM 945 CA GLY A 201 -3.170 16.036 -3.941 1.00 30.51 C ATOM 946 C GLY A 201 -3.864 15.494 -2.694 1.00 14.34 C ATOM 947 O GLY A 201 -4.251 16.277 -1.821 1.00 73.12 O ATOM 0 H GLY A 201 -1.071 15.992 -3.850 1.00 4.25 H new ATOM 0 HA2 GLY A 201 -3.060 17.116 -3.843 1.00 30.51 H new ATOM 0 HA3 GLY A 201 -3.809 15.858 -4.806 1.00 30.51 H new ATOM 951 N HIS A 202 -4.051 14.159 -2.643 1.00 52.35 N ATOM 952 CA HIS A 202 -4.727 13.459 -1.570 1.00 73.22 C ATOM 953 C HIS A 202 -6.205 13.620 -1.714 1.00 32.34 C ATOM 954 O HIS A 202 -6.803 14.624 -1.313 1.00 63.15 O ATOM 955 CB HIS A 202 -4.223 13.785 -0.137 1.00 72.01 C ATOM 956 CG HIS A 202 -5.011 13.103 0.974 1.00 75.31 C ATOM 957 ND1 HIS A 202 -5.736 13.784 1.923 1.00 43.31 N ATOM 958 CD2 HIS A 202 -5.183 11.782 1.266 1.00 14.11 C ATOM 959 CE1 HIS A 202 -6.310 12.900 2.731 1.00 44.45 C ATOM 960 NE2 HIS A 202 -6.005 11.665 2.376 1.00 71.10 N ATOM 0 H HIS A 202 -3.720 13.534 -3.378 1.00 52.35 H new ATOM 0 HA HIS A 202 -4.466 12.407 -1.682 1.00 73.22 H new ATOM 0 HB2 HIS A 202 -3.176 13.492 -0.057 1.00 72.01 H new ATOM 0 HB3 HIS A 202 -4.264 14.864 0.014 1.00 72.01 H new ATOM 0 HD2 HIS A 202 -4.748 10.958 0.719 1.00 14.11 H new ATOM 0 HE1 HIS A 202 -6.943 13.157 3.568 1.00 44.45 H new ATOM 0 HE2 HIS A 202 -6.311 10.802 2.826 1.00 71.10 H new ATOM 968 N THR A 203 -6.759 12.660 -2.340 1.00 62.54 N ATOM 969 CA THR A 203 -8.126 12.563 -2.585 1.00 2.42 C ATOM 970 C THR A 203 -8.628 11.330 -1.845 1.00 74.35 C ATOM 971 O THR A 203 -8.456 10.194 -2.322 1.00 35.13 O ATOM 972 CB THR A 203 -8.385 12.446 -4.093 1.00 43.43 C ATOM 973 OG1 THR A 203 -7.772 13.562 -4.764 1.00 13.32 O ATOM 974 CG2 THR A 203 -9.866 12.427 -4.396 1.00 31.41 C ATOM 0 H THR A 203 -6.229 11.874 -2.716 1.00 62.54 H new ATOM 0 HA THR A 203 -8.652 13.451 -2.236 1.00 2.42 H new ATOM 0 HB THR A 203 -7.955 11.509 -4.446 1.00 43.43 H new ATOM 0 HG1 THR A 203 -7.932 13.492 -5.728 1.00 13.32 H new ATOM 0 HG21 THR A 203 -10.016 12.343 -5.472 1.00 31.41 H new ATOM 0 HG22 THR A 203 -10.328 11.575 -3.898 1.00 31.41 H new ATOM 0 HG23 THR A 203 -10.323 13.349 -4.037 1.00 31.41 H new ATOM 982 N PRO A 204 -9.142 11.548 -0.622 1.00 15.00 N ATOM 983 CA PRO A 204 -9.661 10.506 0.272 1.00 71.44 C ATOM 984 C PRO A 204 -10.482 9.443 -0.428 1.00 33.35 C ATOM 985 O PRO A 204 -10.324 8.279 -0.157 1.00 4.40 O ATOM 986 CB PRO A 204 -10.520 11.287 1.247 1.00 71.14 C ATOM 987 CG PRO A 204 -9.836 12.603 1.359 1.00 22.40 C ATOM 988 CD PRO A 204 -9.210 12.872 0.017 1.00 1.23 C ATOM 0 HA PRO A 204 -8.849 9.943 0.732 1.00 71.44 H new ATOM 0 HB2 PRO A 204 -11.540 11.398 0.879 1.00 71.14 H new ATOM 0 HB3 PRO A 204 -10.582 10.786 2.213 1.00 71.14 H new ATOM 0 HG2 PRO A 204 -10.545 13.388 1.621 1.00 22.40 H new ATOM 0 HG3 PRO A 204 -9.079 12.582 2.143 1.00 22.40 H new ATOM 0 HD2 PRO A 204 -9.810 13.567 -0.570 1.00 1.23 H new ATOM 0 HD3 PRO A 204 -8.220 13.315 0.121 1.00 1.23 H new ATOM 996 N ALA A 205 -11.305 9.858 -1.357 1.00 51.31 N ATOM 997 CA ALA A 205 -12.168 8.954 -2.106 1.00 50.41 C ATOM 998 C ALA A 205 -11.377 7.883 -2.846 1.00 15.40 C ATOM 999 O ALA A 205 -11.733 6.704 -2.803 1.00 73.11 O ATOM 1000 CB ALA A 205 -13.055 9.721 -3.061 1.00 15.32 C ATOM 0 H ALA A 205 -11.403 10.838 -1.624 1.00 51.31 H new ATOM 0 HA ALA A 205 -12.800 8.443 -1.380 1.00 50.41 H new ATOM 0 HB1 ALA A 205 -13.689 9.024 -3.608 1.00 15.32 H new ATOM 0 HB2 ALA A 205 -13.680 10.416 -2.499 1.00 15.32 H new ATOM 0 HB3 ALA A 205 -12.436 10.277 -3.765 1.00 15.32 H new ATOM 1006 N LYS A 206 -10.288 8.282 -3.473 1.00 12.14 N ATOM 1007 CA LYS A 206 -9.455 7.354 -4.216 1.00 25.23 C ATOM 1008 C LYS A 206 -8.703 6.460 -3.256 1.00 21.12 C ATOM 1009 O LYS A 206 -8.625 5.250 -3.443 1.00 2.01 O ATOM 1010 CB LYS A 206 -8.454 8.095 -5.105 1.00 13.11 C ATOM 1011 CG LYS A 206 -9.067 8.956 -6.194 1.00 32.14 C ATOM 1012 CD LYS A 206 -7.987 9.723 -6.940 1.00 23.50 C ATOM 1013 CE LYS A 206 -8.565 10.567 -8.057 1.00 63.30 C ATOM 1014 NZ LYS A 206 -7.535 11.404 -8.703 1.00 32.35 N ATOM 0 H LYS A 206 -9.957 9.247 -3.483 1.00 12.14 H new ATOM 0 HA LYS A 206 -10.105 6.755 -4.853 1.00 25.23 H new ATOM 0 HB2 LYS A 206 -7.830 8.727 -4.473 1.00 13.11 H new ATOM 0 HB3 LYS A 206 -7.796 7.362 -5.572 1.00 13.11 H new ATOM 0 HG2 LYS A 206 -9.623 8.329 -6.891 1.00 32.14 H new ATOM 0 HG3 LYS A 206 -9.780 9.654 -5.755 1.00 32.14 H new ATOM 0 HD2 LYS A 206 -7.448 10.364 -6.242 1.00 23.50 H new ATOM 0 HD3 LYS A 206 -7.262 9.021 -7.353 1.00 23.50 H new ATOM 0 HE2 LYS A 206 -9.025 9.918 -8.802 1.00 63.30 H new ATOM 0 HE3 LYS A 206 -9.354 11.205 -7.659 1.00 63.30 H new ATOM 0 HZ1 LYS A 206 -7.928 11.836 -9.564 1.00 32.35 H new ATOM 0 HZ2 LYS A 206 -7.234 12.152 -8.047 1.00 32.35 H new ATOM 0 HZ3 LYS A 206 -6.716 10.814 -8.955 1.00 32.35 H new ATOM 1028 N LEU A 207 -8.218 7.062 -2.189 1.00 15.43 N ATOM 1029 CA LEU A 207 -7.422 6.362 -1.201 1.00 61.01 C ATOM 1030 C LEU A 207 -8.282 5.344 -0.461 1.00 44.34 C ATOM 1031 O LEU A 207 -7.871 4.211 -0.227 1.00 62.23 O ATOM 1032 CB LEU A 207 -6.792 7.365 -0.221 1.00 50.45 C ATOM 1033 CG LEU A 207 -5.878 6.787 0.867 1.00 21.12 C ATOM 1034 CD1 LEU A 207 -4.671 6.086 0.260 1.00 23.23 C ATOM 1035 CD2 LEU A 207 -5.430 7.884 1.816 1.00 22.35 C ATOM 0 H LEU A 207 -8.364 8.050 -1.982 1.00 15.43 H new ATOM 0 HA LEU A 207 -6.617 5.827 -1.705 1.00 61.01 H new ATOM 0 HB2 LEU A 207 -6.217 8.089 -0.798 1.00 50.45 H new ATOM 0 HB3 LEU A 207 -7.597 7.914 0.268 1.00 50.45 H new ATOM 0 HG LEU A 207 -6.449 6.046 1.427 1.00 21.12 H new ATOM 0 HD11 LEU A 207 -4.043 5.687 1.057 1.00 23.23 H new ATOM 0 HD12 LEU A 207 -5.008 5.270 -0.379 1.00 23.23 H new ATOM 0 HD13 LEU A 207 -4.097 6.798 -0.333 1.00 23.23 H new ATOM 0 HD21 LEU A 207 -4.782 7.460 2.583 1.00 22.35 H new ATOM 0 HD22 LEU A 207 -4.883 8.645 1.260 1.00 22.35 H new ATOM 0 HD23 LEU A 207 -6.303 8.336 2.288 1.00 22.35 H new ATOM 1047 N GLU A 208 -9.498 5.738 -0.156 1.00 32.00 N ATOM 1048 CA GLU A 208 -10.413 4.901 0.561 1.00 12.13 C ATOM 1049 C GLU A 208 -10.900 3.777 -0.346 1.00 33.35 C ATOM 1050 O GLU A 208 -11.145 2.660 0.113 1.00 25.13 O ATOM 1051 CB GLU A 208 -11.559 5.746 1.115 1.00 65.22 C ATOM 1052 CG GLU A 208 -12.501 5.022 2.045 1.00 13.02 C ATOM 1053 CD GLU A 208 -13.412 5.979 2.758 1.00 72.14 C ATOM 1054 OE1 GLU A 208 -14.510 6.293 2.239 1.00 14.21 O ATOM 1055 OE2 GLU A 208 -13.053 6.432 3.852 1.00 13.10 O ATOM 0 H GLU A 208 -9.875 6.653 -0.403 1.00 32.00 H new ATOM 0 HA GLU A 208 -9.913 4.437 1.411 1.00 12.13 H new ATOM 0 HB2 GLU A 208 -11.136 6.600 1.645 1.00 65.22 H new ATOM 0 HB3 GLU A 208 -12.134 6.143 0.278 1.00 65.22 H new ATOM 0 HG2 GLU A 208 -13.096 4.306 1.478 1.00 13.02 H new ATOM 0 HG3 GLU A 208 -11.927 4.452 2.775 1.00 13.02 H new ATOM 1062 N ARG A 209 -10.988 4.068 -1.644 1.00 41.23 N ATOM 1063 CA ARG A 209 -11.344 3.066 -2.638 1.00 54.24 C ATOM 1064 C ARG A 209 -10.247 2.020 -2.701 1.00 14.40 C ATOM 1065 O ARG A 209 -10.524 0.825 -2.686 1.00 54.44 O ATOM 1066 CB ARG A 209 -11.562 3.704 -4.018 1.00 60.41 C ATOM 1067 CG ARG A 209 -11.929 2.724 -5.130 1.00 42.20 C ATOM 1068 CD ARG A 209 -12.087 3.446 -6.460 1.00 2.32 C ATOM 1069 NE ARG A 209 -12.452 2.536 -7.559 1.00 11.14 N ATOM 1070 CZ ARG A 209 -12.561 2.897 -8.854 1.00 61.50 C ATOM 1071 NH1 ARG A 209 -12.288 4.159 -9.235 1.00 61.42 N ATOM 1072 NH2 ARG A 209 -12.933 2.001 -9.764 1.00 10.34 N ATOM 0 H ARG A 209 -10.816 4.997 -2.029 1.00 41.23 H new ATOM 0 HA ARG A 209 -12.283 2.595 -2.346 1.00 54.24 H new ATOM 0 HB2 ARG A 209 -12.352 4.450 -3.936 1.00 60.41 H new ATOM 0 HB3 ARG A 209 -10.653 4.233 -4.305 1.00 60.41 H new ATOM 0 HG2 ARG A 209 -11.157 1.960 -5.216 1.00 42.20 H new ATOM 0 HG3 ARG A 209 -12.857 2.212 -4.877 1.00 42.20 H new ATOM 0 HD2 ARG A 209 -12.852 4.217 -6.362 1.00 2.32 H new ATOM 0 HD3 ARG A 209 -11.154 3.952 -6.707 1.00 2.32 H new ATOM 0 HE ARG A 209 -12.636 1.561 -7.323 1.00 11.14 H new ATOM 0 HH11 ARG A 209 -11.997 4.849 -8.543 1.00 61.42 H new ATOM 0 HH12 ARG A 209 -12.372 4.425 -10.216 1.00 61.42 H new ATOM 0 HH21 ARG A 209 -13.136 1.042 -9.482 1.00 10.34 H new ATOM 0 HH22 ARG A 209 -13.016 2.273 -10.744 1.00 10.34 H new ATOM 1086 N LEU A 210 -9.010 2.493 -2.723 1.00 1.53 N ATOM 1087 CA LEU A 210 -7.822 1.642 -2.716 1.00 43.43 C ATOM 1088 C LEU A 210 -7.834 0.715 -1.512 1.00 20.34 C ATOM 1089 O LEU A 210 -7.672 -0.503 -1.645 1.00 53.44 O ATOM 1090 CB LEU A 210 -6.553 2.514 -2.689 1.00 2.34 C ATOM 1091 CG LEU A 210 -5.211 1.785 -2.532 1.00 33.10 C ATOM 1092 CD1 LEU A 210 -4.884 0.961 -3.753 1.00 5.11 C ATOM 1093 CD2 LEU A 210 -4.093 2.767 -2.228 1.00 74.34 C ATOM 0 H LEU A 210 -8.797 3.490 -2.747 1.00 1.53 H new ATOM 0 HA LEU A 210 -7.826 1.036 -3.622 1.00 43.43 H new ATOM 0 HB2 LEU A 210 -6.519 3.092 -3.613 1.00 2.34 H new ATOM 0 HB3 LEU A 210 -6.649 3.227 -1.870 1.00 2.34 H new ATOM 0 HG LEU A 210 -5.304 1.102 -1.688 1.00 33.10 H new ATOM 0 HD11 LEU A 210 -3.928 0.459 -3.608 1.00 5.11 H new ATOM 0 HD12 LEU A 210 -5.665 0.217 -3.909 1.00 5.11 H new ATOM 0 HD13 LEU A 210 -4.823 1.612 -4.625 1.00 5.11 H new ATOM 0 HD21 LEU A 210 -3.153 2.226 -2.121 1.00 74.34 H new ATOM 0 HD22 LEU A 210 -4.008 3.485 -3.043 1.00 74.34 H new ATOM 0 HD23 LEU A 210 -4.315 3.295 -1.301 1.00 74.34 H new ATOM 1105 N VAL A 211 -8.074 1.285 -0.351 1.00 11.13 N ATOM 1106 CA VAL A 211 -8.074 0.521 0.876 1.00 3.24 C ATOM 1107 C VAL A 211 -9.202 -0.497 0.864 1.00 62.11 C ATOM 1108 O VAL A 211 -9.012 -1.648 1.257 1.00 14.40 O ATOM 1109 CB VAL A 211 -8.150 1.433 2.140 1.00 53.23 C ATOM 1110 CG1 VAL A 211 -8.202 0.608 3.417 1.00 41.21 C ATOM 1111 CG2 VAL A 211 -6.957 2.375 2.186 1.00 72.04 C ATOM 0 H VAL A 211 -8.272 2.278 -0.232 1.00 11.13 H new ATOM 0 HA VAL A 211 -7.124 -0.011 0.932 1.00 3.24 H new ATOM 0 HB VAL A 211 -9.068 2.016 2.071 1.00 53.23 H new ATOM 0 HG11 VAL A 211 -8.254 1.274 4.278 1.00 41.21 H new ATOM 0 HG12 VAL A 211 -9.083 -0.034 3.400 1.00 41.21 H new ATOM 0 HG13 VAL A 211 -7.306 -0.008 3.489 1.00 41.21 H new ATOM 0 HG21 VAL A 211 -7.024 3.005 3.073 1.00 72.04 H new ATOM 0 HG22 VAL A 211 -6.036 1.794 2.223 1.00 72.04 H new ATOM 0 HG23 VAL A 211 -6.955 3.003 1.295 1.00 72.04 H new ATOM 1121 N ALA A 212 -10.344 -0.099 0.342 1.00 41.52 N ATOM 1122 CA ALA A 212 -11.492 -0.980 0.271 1.00 61.30 C ATOM 1123 C ALA A 212 -11.238 -2.114 -0.701 1.00 1.31 C ATOM 1124 O ALA A 212 -11.564 -3.245 -0.426 1.00 4.03 O ATOM 1125 CB ALA A 212 -12.763 -0.218 -0.083 1.00 53.14 C ATOM 0 H ALA A 212 -10.502 0.833 -0.041 1.00 41.52 H new ATOM 0 HA ALA A 212 -11.643 -1.411 1.261 1.00 61.30 H new ATOM 0 HB1 ALA A 212 -13.603 -0.912 -0.127 1.00 53.14 H new ATOM 0 HB2 ALA A 212 -12.957 0.539 0.677 1.00 53.14 H new ATOM 0 HB3 ALA A 212 -12.640 0.265 -1.053 1.00 53.14 H new ATOM 1131 N GLU A 213 -10.608 -1.802 -1.801 1.00 53.15 N ATOM 1132 CA GLU A 213 -10.292 -2.773 -2.828 1.00 31.22 C ATOM 1133 C GLU A 213 -9.372 -3.841 -2.281 1.00 62.33 C ATOM 1134 O GLU A 213 -9.656 -5.035 -2.409 1.00 34.01 O ATOM 1135 CB GLU A 213 -9.641 -2.050 -4.008 1.00 53.13 C ATOM 1136 CG GLU A 213 -9.331 -2.905 -5.206 1.00 65.22 C ATOM 1137 CD GLU A 213 -10.557 -3.323 -5.949 1.00 0.43 C ATOM 1138 OE1 GLU A 213 -10.986 -2.582 -6.845 1.00 4.10 O ATOM 1139 OE2 GLU A 213 -11.117 -4.394 -5.660 1.00 0.14 O ATOM 0 H GLU A 213 -10.293 -0.856 -2.017 1.00 53.15 H new ATOM 0 HA GLU A 213 -11.206 -3.263 -3.163 1.00 31.22 H new ATOM 0 HB2 GLU A 213 -10.300 -1.241 -4.323 1.00 53.13 H new ATOM 0 HB3 GLU A 213 -8.715 -1.591 -3.663 1.00 53.13 H new ATOM 0 HG2 GLU A 213 -8.673 -2.355 -5.879 1.00 65.22 H new ATOM 0 HG3 GLU A 213 -8.787 -3.792 -4.883 1.00 65.22 H new ATOM 1146 N LEU A 214 -8.322 -3.427 -1.616 1.00 53.03 N ATOM 1147 CA LEU A 214 -7.364 -4.385 -1.144 1.00 3.34 C ATOM 1148 C LEU A 214 -7.806 -5.098 0.103 1.00 61.11 C ATOM 1149 O LEU A 214 -7.223 -6.085 0.478 1.00 2.02 O ATOM 1150 CB LEU A 214 -5.923 -3.854 -1.052 1.00 45.23 C ATOM 1151 CG LEU A 214 -5.165 -3.669 -2.392 1.00 21.12 C ATOM 1152 CD1 LEU A 214 -5.226 -4.935 -3.239 1.00 15.31 C ATOM 1153 CD2 LEU A 214 -5.678 -2.483 -3.182 1.00 3.14 C ATOM 0 H LEU A 214 -8.114 -2.453 -1.395 1.00 53.03 H new ATOM 0 HA LEU A 214 -7.329 -5.140 -1.930 1.00 3.34 H new ATOM 0 HB2 LEU A 214 -5.946 -2.893 -0.538 1.00 45.23 H new ATOM 0 HB3 LEU A 214 -5.348 -4.536 -0.426 1.00 45.23 H new ATOM 0 HG LEU A 214 -4.124 -3.469 -2.136 1.00 21.12 H new ATOM 0 HD11 LEU A 214 -4.686 -4.775 -4.172 1.00 15.31 H new ATOM 0 HD12 LEU A 214 -4.770 -5.761 -2.693 1.00 15.31 H new ATOM 0 HD13 LEU A 214 -6.266 -5.176 -3.459 1.00 15.31 H new ATOM 0 HD21 LEU A 214 -5.116 -2.395 -4.112 1.00 3.14 H new ATOM 0 HD22 LEU A 214 -6.735 -2.626 -3.409 1.00 3.14 H new ATOM 0 HD23 LEU A 214 -5.553 -1.573 -2.595 1.00 3.14 H new ATOM 1165 N SER A 215 -8.813 -4.589 0.762 1.00 53.23 N ATOM 1166 CA SER A 215 -9.375 -5.310 1.858 1.00 22.11 C ATOM 1167 C SER A 215 -10.467 -6.301 1.380 1.00 73.10 C ATOM 1168 O SER A 215 -10.569 -7.432 1.880 1.00 14.45 O ATOM 1169 CB SER A 215 -9.887 -4.367 2.958 1.00 51.11 C ATOM 1170 OG SER A 215 -10.666 -3.304 2.432 1.00 41.32 O ATOM 0 H SER A 215 -9.251 -3.691 0.559 1.00 53.23 H new ATOM 0 HA SER A 215 -8.578 -5.904 2.304 1.00 22.11 H new ATOM 0 HB2 SER A 215 -10.484 -4.934 3.672 1.00 51.11 H new ATOM 0 HB3 SER A 215 -9.039 -3.957 3.507 1.00 51.11 H new ATOM 0 HG SER A 215 -10.079 -2.559 2.185 1.00 41.32 H new ATOM 1176 N LEU A 216 -11.245 -5.880 0.377 1.00 31.44 N ATOM 1177 CA LEU A 216 -12.395 -6.631 -0.099 1.00 11.24 C ATOM 1178 C LEU A 216 -12.006 -7.766 -1.070 1.00 43.23 C ATOM 1179 O LEU A 216 -12.852 -8.587 -1.446 1.00 55.25 O ATOM 1180 CB LEU A 216 -13.414 -5.664 -0.742 1.00 54.11 C ATOM 1181 CG LEU A 216 -14.780 -6.227 -1.146 1.00 33.11 C ATOM 1182 CD1 LEU A 216 -15.536 -6.729 0.074 1.00 64.12 C ATOM 1183 CD2 LEU A 216 -15.594 -5.168 -1.874 1.00 23.52 C ATOM 0 H LEU A 216 -11.088 -5.005 -0.124 1.00 31.44 H new ATOM 0 HA LEU A 216 -12.854 -7.119 0.761 1.00 11.24 H new ATOM 0 HB2 LEU A 216 -13.583 -4.844 -0.044 1.00 54.11 H new ATOM 0 HB3 LEU A 216 -12.953 -5.235 -1.632 1.00 54.11 H new ATOM 0 HG LEU A 216 -14.619 -7.068 -1.820 1.00 33.11 H new ATOM 0 HD11 LEU A 216 -16.504 -7.125 -0.235 1.00 64.12 H new ATOM 0 HD12 LEU A 216 -14.960 -7.517 0.560 1.00 64.12 H new ATOM 0 HD13 LEU A 216 -15.687 -5.906 0.773 1.00 64.12 H new ATOM 0 HD21 LEU A 216 -16.562 -5.583 -2.155 1.00 23.52 H new ATOM 0 HD22 LEU A 216 -15.743 -4.310 -1.219 1.00 23.52 H new ATOM 0 HD23 LEU A 216 -15.061 -4.852 -2.771 1.00 23.52 H new ATOM 1195 N GLN A 217 -10.758 -7.807 -1.500 1.00 41.41 N ATOM 1196 CA GLN A 217 -10.313 -8.901 -2.355 1.00 10.04 C ATOM 1197 C GLN A 217 -10.215 -10.225 -1.585 1.00 22.21 C ATOM 1198 O GLN A 217 -9.887 -10.240 -0.385 1.00 22.01 O ATOM 1199 CB GLN A 217 -9.028 -8.580 -3.147 1.00 13.31 C ATOM 1200 CG GLN A 217 -9.271 -7.567 -4.252 1.00 12.43 C ATOM 1201 CD GLN A 217 -8.092 -7.323 -5.163 1.00 12.44 C ATOM 1202 OE1 GLN A 217 -7.265 -8.197 -5.405 1.00 62.25 O ATOM 1203 NE2 GLN A 217 -8.029 -6.147 -5.702 1.00 75.52 N ATOM 0 H GLN A 217 -10.044 -7.112 -1.279 1.00 41.41 H new ATOM 0 HA GLN A 217 -11.089 -9.027 -3.110 1.00 10.04 H new ATOM 0 HB2 GLN A 217 -8.270 -8.196 -2.465 1.00 13.31 H new ATOM 0 HB3 GLN A 217 -8.631 -9.498 -3.580 1.00 13.31 H new ATOM 0 HG2 GLN A 217 -10.114 -7.905 -4.855 1.00 12.43 H new ATOM 0 HG3 GLN A 217 -9.563 -6.620 -3.799 1.00 12.43 H new ATOM 0 HE21 GLN A 217 -8.734 -5.445 -5.478 1.00 75.52 H new ATOM 0 HE22 GLN A 217 -7.274 -5.923 -6.351 1.00 75.52 H new ATOM 1212 N PRO A 218 -10.561 -11.340 -2.249 1.00 74.21 N ATOM 1213 CA PRO A 218 -10.587 -12.667 -1.632 1.00 54.51 C ATOM 1214 C PRO A 218 -9.230 -13.146 -1.135 1.00 2.31 C ATOM 1215 O PRO A 218 -8.301 -13.389 -1.909 1.00 65.44 O ATOM 1216 CB PRO A 218 -11.102 -13.585 -2.750 1.00 24.32 C ATOM 1217 CG PRO A 218 -10.807 -12.846 -4.003 1.00 14.53 C ATOM 1218 CD PRO A 218 -10.980 -11.401 -3.662 1.00 13.30 C ATOM 0 HA PRO A 218 -11.210 -12.661 -0.738 1.00 54.51 H new ATOM 0 HB2 PRO A 218 -10.600 -14.552 -2.732 1.00 24.32 H new ATOM 0 HB3 PRO A 218 -12.170 -13.778 -2.645 1.00 24.32 H new ATOM 0 HG2 PRO A 218 -9.794 -13.049 -4.350 1.00 14.53 H new ATOM 0 HG3 PRO A 218 -11.484 -13.144 -4.804 1.00 14.53 H new ATOM 0 HD2 PRO A 218 -10.364 -10.761 -4.293 1.00 13.30 H new ATOM 0 HD3 PRO A 218 -12.013 -11.077 -3.791 1.00 13.30 H new ATOM 1226 N GLY A 219 -9.114 -13.244 0.150 1.00 45.13 N ATOM 1227 CA GLY A 219 -7.917 -13.798 0.740 1.00 1.15 C ATOM 1228 C GLY A 219 -7.238 -12.849 1.679 1.00 61.22 C ATOM 1229 O GLY A 219 -6.185 -13.161 2.253 1.00 1.44 O ATOM 0 H GLY A 219 -9.827 -12.951 0.818 1.00 45.13 H new ATOM 0 HA2 GLY A 219 -8.172 -14.712 1.276 1.00 1.15 H new ATOM 0 HA3 GLY A 219 -7.222 -14.076 -0.053 1.00 1.15 H new ATOM 1233 N VAL A 220 -7.801 -11.692 1.826 1.00 14.15 N ATOM 1234 CA VAL A 220 -7.264 -10.713 2.709 1.00 2.43 C ATOM 1235 C VAL A 220 -7.803 -10.925 4.114 1.00 62.12 C ATOM 1236 O VAL A 220 -9.002 -11.120 4.307 1.00 21.41 O ATOM 1237 CB VAL A 220 -7.584 -9.291 2.210 1.00 4.54 C ATOM 1238 CG1 VAL A 220 -7.011 -8.240 3.146 1.00 1.32 C ATOM 1239 CG2 VAL A 220 -7.043 -9.110 0.799 1.00 51.22 C ATOM 0 H VAL A 220 -8.647 -11.401 1.336 1.00 14.15 H new ATOM 0 HA VAL A 220 -6.180 -10.824 2.732 1.00 2.43 H new ATOM 0 HB VAL A 220 -8.666 -9.162 2.195 1.00 4.54 H new ATOM 0 HG11 VAL A 220 -7.252 -7.246 2.769 1.00 1.32 H new ATOM 0 HG12 VAL A 220 -7.441 -8.365 4.140 1.00 1.32 H new ATOM 0 HG13 VAL A 220 -5.928 -8.354 3.202 1.00 1.32 H new ATOM 0 HG21 VAL A 220 -7.271 -8.103 0.448 1.00 51.22 H new ATOM 0 HG22 VAL A 220 -5.963 -9.258 0.802 1.00 51.22 H new ATOM 0 HG23 VAL A 220 -7.507 -9.839 0.135 1.00 51.22 H new ATOM 1249 N TYR A 221 -6.913 -10.926 5.075 1.00 63.40 N ATOM 1250 CA TYR A 221 -7.281 -11.068 6.462 1.00 52.02 C ATOM 1251 C TYR A 221 -7.734 -9.729 6.984 1.00 22.02 C ATOM 1252 O TYR A 221 -8.813 -9.605 7.578 1.00 22.11 O ATOM 1253 CB TYR A 221 -6.092 -11.554 7.306 1.00 70.55 C ATOM 1254 CG TYR A 221 -5.666 -12.998 7.107 1.00 33.15 C ATOM 1255 CD1 TYR A 221 -5.120 -13.442 5.910 1.00 55.32 C ATOM 1256 CD2 TYR A 221 -5.770 -13.907 8.151 1.00 72.04 C ATOM 1257 CE1 TYR A 221 -4.698 -14.750 5.762 1.00 25.30 C ATOM 1258 CE2 TYR A 221 -5.358 -15.211 8.011 1.00 0.02 C ATOM 1259 CZ TYR A 221 -4.821 -15.629 6.818 1.00 35.24 C ATOM 1260 OH TYR A 221 -4.382 -16.922 6.688 1.00 54.12 O ATOM 0 H TYR A 221 -5.910 -10.828 4.917 1.00 63.40 H new ATOM 0 HA TYR A 221 -8.081 -11.805 6.535 1.00 52.02 H new ATOM 0 HB2 TYR A 221 -5.237 -10.913 7.092 1.00 70.55 H new ATOM 0 HB3 TYR A 221 -6.340 -11.413 8.358 1.00 70.55 H new ATOM 0 HD1 TYR A 221 -5.024 -12.755 5.082 1.00 55.32 H new ATOM 0 HD2 TYR A 221 -6.184 -13.582 9.094 1.00 72.04 H new ATOM 0 HE1 TYR A 221 -4.275 -15.082 4.825 1.00 25.30 H new ATOM 0 HE2 TYR A 221 -5.456 -15.903 8.834 1.00 0.02 H new ATOM 0 HH TYR A 221 -3.578 -16.940 6.127 1.00 54.12 H new ATOM 1270 N ALA A 222 -6.913 -8.716 6.742 1.00 30.35 N ATOM 1271 CA ALA A 222 -7.179 -7.368 7.228 1.00 53.05 C ATOM 1272 C ALA A 222 -6.235 -6.373 6.586 1.00 0.53 C ATOM 1273 O ALA A 222 -5.196 -6.758 6.036 1.00 12.02 O ATOM 1274 CB ALA A 222 -7.026 -7.306 8.749 1.00 21.24 C ATOM 0 H ALA A 222 -6.049 -8.804 6.207 1.00 30.35 H new ATOM 0 HA ALA A 222 -8.204 -7.111 6.960 1.00 53.05 H new ATOM 0 HB1 ALA A 222 -7.228 -6.292 9.094 1.00 21.24 H new ATOM 0 HB2 ALA A 222 -7.731 -7.995 9.214 1.00 21.24 H new ATOM 0 HB3 ALA A 222 -6.009 -7.587 9.024 1.00 21.24 H new ATOM 1280 N VAL A 223 -6.592 -5.110 6.660 1.00 73.43 N ATOM 1281 CA VAL A 223 -5.773 -4.030 6.150 1.00 5.33 C ATOM 1282 C VAL A 223 -5.651 -2.960 7.256 1.00 21.03 C ATOM 1283 O VAL A 223 -6.498 -2.908 8.165 1.00 72.22 O ATOM 1284 CB VAL A 223 -6.406 -3.407 4.853 1.00 64.32 C ATOM 1285 CG1 VAL A 223 -7.702 -2.668 5.156 1.00 11.20 C ATOM 1286 CG2 VAL A 223 -5.427 -2.508 4.105 1.00 14.24 C ATOM 0 H VAL A 223 -7.468 -4.799 7.080 1.00 73.43 H new ATOM 0 HA VAL A 223 -4.788 -4.411 5.880 1.00 5.33 H new ATOM 0 HB VAL A 223 -6.644 -4.243 4.195 1.00 64.32 H new ATOM 0 HG11 VAL A 223 -8.108 -2.252 4.234 1.00 11.20 H new ATOM 0 HG12 VAL A 223 -8.423 -3.361 5.590 1.00 11.20 H new ATOM 0 HG13 VAL A 223 -7.504 -1.861 5.862 1.00 11.20 H new ATOM 0 HG21 VAL A 223 -5.911 -2.102 3.217 1.00 14.24 H new ATOM 0 HG22 VAL A 223 -5.115 -1.690 4.754 1.00 14.24 H new ATOM 0 HG23 VAL A 223 -4.554 -3.089 3.808 1.00 14.24 H new ATOM 1296 N HIS A 224 -4.600 -2.181 7.217 1.00 75.52 N ATOM 1297 CA HIS A 224 -4.391 -1.093 8.162 1.00 23.32 C ATOM 1298 C HIS A 224 -3.519 -0.050 7.477 1.00 43.22 C ATOM 1299 O HIS A 224 -2.516 -0.401 6.857 1.00 41.01 O ATOM 1300 CB HIS A 224 -3.685 -1.632 9.439 1.00 62.10 C ATOM 1301 CG HIS A 224 -3.530 -0.649 10.586 1.00 24.24 C ATOM 1302 ND1 HIS A 224 -4.166 -0.790 11.802 1.00 61.04 N ATOM 1303 CD2 HIS A 224 -2.761 0.468 10.701 1.00 4.44 C ATOM 1304 CE1 HIS A 224 -3.784 0.210 12.597 1.00 74.23 C ATOM 1305 NE2 HIS A 224 -2.925 1.010 11.976 1.00 70.45 N ATOM 0 H HIS A 224 -3.855 -2.278 6.527 1.00 75.52 H new ATOM 0 HA HIS A 224 -5.342 -0.653 8.461 1.00 23.32 H new ATOM 0 HB2 HIS A 224 -4.244 -2.495 9.801 1.00 62.10 H new ATOM 0 HB3 HIS A 224 -2.694 -1.989 9.158 1.00 62.10 H new ATOM 0 HD2 HIS A 224 -2.124 0.871 9.927 1.00 4.44 H new ATOM 0 HE1 HIS A 224 -4.128 0.351 13.611 1.00 74.23 H new ATOM 0 HE2 HIS A 224 -2.478 1.846 12.353 1.00 70.45 H new ATOM 1313 N TRP A 225 -3.887 1.203 7.552 1.00 61.30 N ATOM 1314 CA TRP A 225 -3.074 2.227 6.954 1.00 22.34 C ATOM 1315 C TRP A 225 -2.802 3.332 7.925 1.00 30.20 C ATOM 1316 O TRP A 225 -3.540 3.505 8.904 1.00 22.32 O ATOM 1317 CB TRP A 225 -3.640 2.751 5.628 1.00 31.12 C ATOM 1318 CG TRP A 225 -4.955 3.486 5.669 1.00 1.11 C ATOM 1319 CD1 TRP A 225 -6.215 2.958 5.711 1.00 10.10 C ATOM 1320 CD2 TRP A 225 -5.117 4.901 5.605 1.00 13.41 C ATOM 1321 NE1 TRP A 225 -7.147 3.973 5.675 1.00 25.34 N ATOM 1322 CE2 TRP A 225 -6.494 5.176 5.608 1.00 43.54 C ATOM 1323 CE3 TRP A 225 -4.223 5.961 5.544 1.00 51.01 C ATOM 1324 CZ2 TRP A 225 -6.993 6.481 5.551 1.00 52.22 C ATOM 1325 CZ3 TRP A 225 -4.712 7.239 5.489 1.00 33.04 C ATOM 1326 CH2 TRP A 225 -6.080 7.500 5.488 1.00 15.33 C ATOM 0 H TRP A 225 -4.733 1.535 8.015 1.00 61.30 H new ATOM 0 HA TRP A 225 -2.122 1.761 6.700 1.00 22.34 H new ATOM 0 HB2 TRP A 225 -2.898 3.416 5.186 1.00 31.12 H new ATOM 0 HB3 TRP A 225 -3.751 1.903 4.952 1.00 31.12 H new ATOM 0 HD1 TRP A 225 -6.446 1.904 5.764 1.00 10.10 H new ATOM 0 HE1 TRP A 225 -8.159 3.849 5.695 1.00 25.34 H new ATOM 0 HE3 TRP A 225 -3.158 5.781 5.540 1.00 51.01 H new ATOM 0 HZ2 TRP A 225 -8.055 6.677 5.556 1.00 52.22 H new ATOM 0 HZ3 TRP A 225 -4.019 8.066 5.445 1.00 33.04 H new ATOM 0 HH2 TRP A 225 -6.426 8.522 5.437 1.00 15.33 H new ATOM 1337 N TYR A 226 -1.749 4.059 7.679 1.00 50.42 N ATOM 1338 CA TYR A 226 -1.323 5.110 8.589 1.00 74.05 C ATOM 1339 C TYR A 226 -0.586 6.216 7.816 1.00 40.01 C ATOM 1340 O TYR A 226 0.084 5.939 6.821 1.00 71.42 O ATOM 1341 CB TYR A 226 -0.410 4.492 9.676 1.00 15.03 C ATOM 1342 CG TYR A 226 -0.191 5.361 10.895 1.00 11.24 C ATOM 1343 CD1 TYR A 226 -1.138 5.398 11.906 1.00 11.34 C ATOM 1344 CD2 TYR A 226 0.943 6.143 11.034 1.00 21.21 C ATOM 1345 CE1 TYR A 226 -0.963 6.188 13.017 1.00 23.10 C ATOM 1346 CE2 TYR A 226 1.124 6.943 12.145 1.00 34.32 C ATOM 1347 CZ TYR A 226 0.164 6.961 13.133 1.00 22.43 C ATOM 1348 OH TYR A 226 0.327 7.771 14.241 1.00 1.21 O ATOM 0 H TYR A 226 -1.160 3.950 6.853 1.00 50.42 H new ATOM 0 HA TYR A 226 -2.193 5.561 9.067 1.00 74.05 H new ATOM 0 HB2 TYR A 226 -0.842 3.544 9.997 1.00 15.03 H new ATOM 0 HB3 TYR A 226 0.559 4.266 9.230 1.00 15.03 H new ATOM 0 HD1 TYR A 226 -2.030 4.795 11.819 1.00 11.34 H new ATOM 0 HD2 TYR A 226 1.698 6.127 10.262 1.00 21.21 H new ATOM 0 HE1 TYR A 226 -1.711 6.200 13.796 1.00 23.10 H new ATOM 0 HE2 TYR A 226 2.012 7.550 12.239 1.00 34.32 H new ATOM 0 HH TYR A 226 1.178 8.253 14.172 1.00 1.21 H new ATOM 1358 N ALA A 227 -0.753 7.449 8.253 1.00 25.41 N ATOM 1359 CA ALA A 227 -0.109 8.614 7.647 1.00 45.41 C ATOM 1360 C ALA A 227 1.386 8.706 7.981 1.00 33.33 C ATOM 1361 O ALA A 227 1.833 8.296 9.060 1.00 12.41 O ATOM 1362 CB ALA A 227 -0.830 9.882 8.073 1.00 12.12 C ATOM 0 H ALA A 227 -1.347 7.680 9.050 1.00 25.41 H new ATOM 0 HA ALA A 227 -0.179 8.498 6.565 1.00 45.41 H new ATOM 0 HB1 ALA A 227 -0.346 10.746 7.618 1.00 12.12 H new ATOM 0 HB2 ALA A 227 -1.869 9.836 7.748 1.00 12.12 H new ATOM 0 HB3 ALA A 227 -0.793 9.975 9.158 1.00 12.12 H new ATOM 1368 N GLY A 228 2.148 9.266 7.066 1.00 72.23 N ATOM 1369 CA GLY A 228 3.568 9.389 7.259 1.00 15.51 C ATOM 1370 C GLY A 228 4.294 8.303 6.511 1.00 74.12 C ATOM 1371 O GLY A 228 3.807 7.178 6.444 1.00 33.15 O ATOM 0 H GLY A 228 1.803 9.642 6.183 1.00 72.23 H new ATOM 0 HA2 GLY A 228 3.905 10.366 6.913 1.00 15.51 H new ATOM 0 HA3 GLY A 228 3.804 9.328 8.321 1.00 15.51 H new