USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1046 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 39 MET CE :methyl 172:sc= -1.5 (180deg=-1.69) USER MOD Set 1.2: A 143 THR OG1 : rot 75:sc= 1.26 USER MOD Set 2.1: A 134 ASN : amide:sc= 0.938 K(o=1.6,f=-2.2!) USER MOD Set 2.2: A 138 ASN : amide:sc= 0.696 K(o=1.6,f=0.29) USER MOD Set 3.1: A 61 HIS : no HE2:sc= 0.125 K(o=2,f=0.73) USER MOD Set 3.2: A 62 SER OG : rot -107:sc= 0.141 USER MOD Set 3.3: A 96 ASN : amide:sc= 0.764 K(o=2,f=-0.37) USER MOD Set 3.4: A 111 GLN : amide:sc= 0.941 K(o=2,f=-1.9) USER MOD Set 4.1: A 11 SER OG : rot -116:sc= 0.65 USER MOD Set 4.2: A 75 TYR OH : rot 30:sc= 0.588 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 HIS : no HE2:sc= 0.901 K(o=0.9,f=-3.8!) USER MOD Single : A 20 GLN : amide:sc= -0.77 K(o=-0.77,f=-1.4) USER MOD Single : A 35 SER OG : rot 34:sc= 0.0168 USER MOD Single : A 38 LYS NZ :NH3+ -174:sc= 0.176 (180deg=-0.0607) USER MOD Single : A 43 THR OG1 : rot -45:sc= 0.812 USER MOD Single : A 44 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 53 MET CE :methyl 176:sc= -0.534 (180deg=-0.573) USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= 0.699 K(o=0.7,f=-0.28) USER MOD Single : A 66 THR OG1 : rot 12:sc= 0.399 USER MOD Single : A 68 GLN : amide:sc= 0 K(o=0,f=-2.6!) USER MOD Single : A 72 GLN :FLIP amide:sc= -0.116 F(o=-1.7!,f=-0.12) USER MOD Single : A 77 TYR OH : rot -11:sc= 0.562 USER MOD Single : A 81 SER OG : rot 26:sc= 1.1 USER MOD Single : A 84 SER OG : rot 31:sc= 1.24 USER MOD Single : A 87 LYS NZ :NH3+ 166:sc= 1.62 (180deg=1.34) USER MOD Single : A 90 MET CE :methyl 157:sc= -0.283 (180deg=-1.28) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 HIS : no HE2:sc= 0.26 K(o=0.26,f=-4.9!) USER MOD Single : A 106 LYS NZ :NH3+ -146:sc= 1.26 (180deg=0.126) USER MOD Single : A 108 SER OG : rot 63:sc= 1.11 USER MOD Single : A 119 LYS NZ :NH3+ -171:sc= 0.963 (180deg=0.729) USER MOD Single : A 120 GLN : amide:sc= -0.429 X(o=-0.43,f=-0.025) USER MOD Single : A 133 MET CE :methyl -173:sc= -0.718 (180deg=-0.873) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0.0026 USER MOD Single : A 142 GLN : amide:sc= 0.0605 K(o=0.06,f=-1) USER MOD Single : A 145 GLN : amide:sc= 1.26 K(o=1.3,f=-0.28) USER MOD Single : A 146 ASN : amide:sc= 1.17 K(o=1.2,f=-5.5!) USER MOD Single : A 151 LYS NZ :NH3+ -160:sc= 1.83 (180deg=1.17) USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 GLN : amide:sc= 0.117 X(o=0.12,f=0) USER MOD ----------------------------------------------------------------- ATOM 148 N SER A 11 -2.917 13.171 3.070 1.00 0.00 N ATOM 149 CA SER A 11 -2.677 12.398 1.857 1.00 0.00 C ATOM 150 C SER A 11 -2.971 10.918 2.144 1.00 0.00 C ATOM 151 O SER A 11 -3.311 10.563 3.269 1.00 0.00 O ATOM 152 CB SER A 11 -1.298 12.692 1.240 1.00 0.00 C ATOM 153 OG SER A 11 -1.382 13.879 0.480 1.00 0.00 O ATOM 0 HA SER A 11 -3.365 12.707 1.070 1.00 0.00 H new ATOM 0 HB2 SER A 11 -0.549 12.799 2.024 1.00 0.00 H new ATOM 0 HB3 SER A 11 -0.982 11.861 0.609 1.00 0.00 H new ATOM 0 HG SER A 11 -1.209 13.676 -0.463 1.00 0.00 H new ATOM 159 N LEU A 12 -2.862 10.070 1.119 1.00 0.00 N ATOM 160 CA LEU A 12 -3.212 8.649 1.082 1.00 0.00 C ATOM 161 C LEU A 12 -2.772 7.871 2.330 1.00 0.00 C ATOM 162 O LEU A 12 -1.598 7.905 2.711 1.00 0.00 O ATOM 163 CB LEU A 12 -2.484 8.099 -0.164 1.00 0.00 C ATOM 164 CG LEU A 12 -2.708 6.639 -0.593 1.00 0.00 C ATOM 165 CD1 LEU A 12 -1.883 6.419 -1.855 1.00 0.00 C ATOM 166 CD2 LEU A 12 -2.198 5.600 0.394 1.00 0.00 C ATOM 0 H LEU A 12 -2.497 10.386 0.220 1.00 0.00 H new ATOM 0 HA LEU A 12 -4.295 8.532 1.048 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -2.758 8.732 -1.008 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -1.414 8.230 -0.001 1.00 0.00 H new ATOM 0 HG LEU A 12 -3.785 6.511 -0.698 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.010 5.392 -2.199 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -2.217 7.106 -2.632 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -0.830 6.601 -1.638 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -2.400 4.601 0.007 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.124 5.726 0.532 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -2.704 5.728 1.351 1.00 0.00 H new ATOM 178 N TYR A 13 -3.726 7.132 2.912 1.00 0.00 N ATOM 179 CA TYR A 13 -3.539 6.203 4.023 1.00 0.00 C ATOM 180 C TYR A 13 -3.904 4.789 3.547 1.00 0.00 C ATOM 181 O TYR A 13 -4.850 4.633 2.771 1.00 0.00 O ATOM 182 CB TYR A 13 -4.456 6.552 5.200 1.00 0.00 C ATOM 183 CG TYR A 13 -4.326 7.917 5.839 1.00 0.00 C ATOM 184 CD1 TYR A 13 -5.081 8.996 5.340 1.00 0.00 C ATOM 185 CD2 TYR A 13 -3.562 8.077 7.011 1.00 0.00 C ATOM 186 CE1 TYR A 13 -5.088 10.228 6.016 1.00 0.00 C ATOM 187 CE2 TYR A 13 -3.548 9.315 7.679 1.00 0.00 C ATOM 188 CZ TYR A 13 -4.326 10.391 7.194 1.00 0.00 C ATOM 189 OH TYR A 13 -4.362 11.559 7.887 1.00 0.00 O ATOM 0 H TYR A 13 -4.697 7.172 2.601 1.00 0.00 H new ATOM 0 HA TYR A 13 -2.501 6.264 4.349 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -5.486 6.442 4.861 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -4.295 5.806 5.978 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -5.657 8.876 4.434 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -2.986 7.249 7.397 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -5.676 11.050 5.635 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -2.942 9.444 8.564 1.00 0.00 H new ATOM 0 HH TYR A 13 -3.778 11.492 8.671 1.00 0.00 H new ATOM 199 N LEU A 14 -3.208 3.753 4.022 1.00 0.00 N ATOM 200 CA LEU A 14 -3.409 2.342 3.680 1.00 0.00 C ATOM 201 C LEU A 14 -2.940 1.525 4.893 1.00 0.00 C ATOM 202 O LEU A 14 -1.800 1.695 5.325 1.00 0.00 O ATOM 203 CB LEU A 14 -2.582 2.012 2.415 1.00 0.00 C ATOM 204 CG LEU A 14 -2.865 0.716 1.638 1.00 0.00 C ATOM 205 CD1 LEU A 14 -1.629 0.301 0.832 1.00 0.00 C ATOM 206 CD2 LEU A 14 -3.371 -0.484 2.434 1.00 0.00 C ATOM 0 H LEU A 14 -2.449 3.882 4.691 1.00 0.00 H new ATOM 0 HA LEU A 14 -4.451 2.110 3.461 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -2.705 2.842 1.720 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -1.532 1.994 2.708 1.00 0.00 H new ATOM 0 HG LEU A 14 -3.705 0.989 0.999 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -1.842 -0.618 0.286 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -1.373 1.091 0.126 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.792 0.135 1.510 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -3.528 -1.327 1.761 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -2.634 -0.756 3.190 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -4.312 -0.227 2.920 1.00 0.00 H new ATOM 218 N TRP A 15 -3.780 0.675 5.482 1.00 0.00 N ATOM 219 CA TRP A 15 -3.420 -0.169 6.616 1.00 0.00 C ATOM 220 C TRP A 15 -4.068 -1.553 6.473 1.00 0.00 C ATOM 221 O TRP A 15 -4.986 -1.727 5.673 1.00 0.00 O ATOM 222 CB TRP A 15 -3.800 0.584 7.903 1.00 0.00 C ATOM 223 CG TRP A 15 -5.250 0.879 8.156 1.00 0.00 C ATOM 224 CD1 TRP A 15 -6.060 0.201 9.005 1.00 0.00 C ATOM 225 CD2 TRP A 15 -6.047 1.991 7.639 1.00 0.00 C ATOM 226 NE1 TRP A 15 -7.288 0.838 9.063 1.00 0.00 N ATOM 227 CE2 TRP A 15 -7.325 1.969 8.268 1.00 0.00 C ATOM 228 CE3 TRP A 15 -5.808 3.040 6.724 1.00 0.00 C ATOM 229 CZ2 TRP A 15 -8.299 2.959 8.026 1.00 0.00 C ATOM 230 CZ3 TRP A 15 -6.792 4.003 6.436 1.00 0.00 C ATOM 231 CH2 TRP A 15 -8.029 3.984 7.097 1.00 0.00 C ATOM 0 H TRP A 15 -4.746 0.553 5.178 1.00 0.00 H new ATOM 0 HA TRP A 15 -2.348 -0.364 6.656 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -3.426 0.006 8.748 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -3.263 1.533 7.903 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -5.791 -0.692 9.549 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -8.073 0.511 9.626 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -4.848 3.104 6.234 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -9.244 2.932 8.548 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -6.593 4.766 5.698 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -8.767 4.747 6.896 1.00 0.00 H new ATOM 242 N ILE A 16 -3.570 -2.571 7.176 1.00 0.00 N ATOM 243 CA ILE A 16 -4.192 -3.895 7.222 1.00 0.00 C ATOM 244 C ILE A 16 -5.040 -3.877 8.500 1.00 0.00 C ATOM 245 O ILE A 16 -4.628 -3.257 9.482 1.00 0.00 O ATOM 246 CB ILE A 16 -3.166 -5.054 7.145 1.00 0.00 C ATOM 247 CG1 ILE A 16 -2.055 -4.874 6.082 1.00 0.00 C ATOM 248 CG2 ILE A 16 -3.915 -6.324 6.717 1.00 0.00 C ATOM 249 CD1 ILE A 16 -0.686 -4.539 6.664 1.00 0.00 C ATOM 0 H ILE A 16 -2.718 -2.500 7.733 1.00 0.00 H new ATOM 0 HA ILE A 16 -4.813 -4.091 6.348 1.00 0.00 H new ATOM 0 HB ILE A 16 -2.701 -5.094 8.130 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -1.975 -5.790 5.497 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -2.350 -4.081 5.394 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -3.214 -7.156 6.655 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -4.688 -6.555 7.450 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -4.375 -6.164 5.742 1.00 0.00 H new ATOM 0 HD11 ILE A 16 0.036 -4.429 5.855 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -0.747 -3.606 7.225 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -0.367 -5.342 7.329 1.00 0.00 H new ATOM 261 N ASP A 17 -6.209 -4.530 8.515 1.00 0.00 N ATOM 262 CA ASP A 17 -7.125 -4.429 9.656 1.00 0.00 C ATOM 263 C ASP A 17 -7.030 -5.582 10.658 1.00 0.00 C ATOM 264 O ASP A 17 -6.510 -6.663 10.369 1.00 0.00 O ATOM 265 CB ASP A 17 -8.584 -4.191 9.193 1.00 0.00 C ATOM 266 CG ASP A 17 -9.408 -5.415 8.731 1.00 0.00 C ATOM 267 OD1 ASP A 17 -9.132 -6.565 9.131 1.00 0.00 O ATOM 268 OD2 ASP A 17 -10.448 -5.202 8.066 1.00 0.00 O ATOM 0 H ASP A 17 -6.540 -5.128 7.758 1.00 0.00 H new ATOM 0 HA ASP A 17 -6.790 -3.552 10.210 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -9.122 -3.717 10.014 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -8.561 -3.475 8.372 1.00 0.00 H new ATOM 273 N ALA A 18 -7.576 -5.326 11.848 1.00 0.00 N ATOM 274 CA ALA A 18 -7.720 -6.270 12.947 1.00 0.00 C ATOM 275 C ALA A 18 -8.887 -7.241 12.794 1.00 0.00 C ATOM 276 O ALA A 18 -8.876 -8.280 13.457 1.00 0.00 O ATOM 277 CB ALA A 18 -7.904 -5.462 14.232 1.00 0.00 C ATOM 0 H ALA A 18 -7.948 -4.405 12.079 1.00 0.00 H new ATOM 0 HA ALA A 18 -6.822 -6.887 12.964 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -8.015 -6.142 15.077 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -7.033 -4.826 14.390 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -8.796 -4.841 14.147 1.00 0.00 H new ATOM 283 N HIS A 19 -9.873 -6.963 11.935 1.00 0.00 N ATOM 284 CA HIS A 19 -10.984 -7.881 11.718 1.00 0.00 C ATOM 285 C HIS A 19 -10.435 -9.216 11.219 1.00 0.00 C ATOM 286 O HIS A 19 -10.872 -10.279 11.665 1.00 0.00 O ATOM 287 CB HIS A 19 -11.993 -7.315 10.708 1.00 0.00 C ATOM 288 CG HIS A 19 -12.451 -5.903 10.976 1.00 0.00 C ATOM 289 ND1 HIS A 19 -12.242 -4.828 10.143 1.00 0.00 N ATOM 290 CD2 HIS A 19 -13.167 -5.459 12.055 1.00 0.00 C ATOM 291 CE1 HIS A 19 -12.817 -3.755 10.710 1.00 0.00 C ATOM 292 NE2 HIS A 19 -13.401 -4.093 11.872 1.00 0.00 N ATOM 0 H HIS A 19 -9.920 -6.108 11.381 1.00 0.00 H new ATOM 0 HA HIS A 19 -11.509 -8.022 12.663 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -11.547 -7.352 9.714 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -12.867 -7.966 10.689 1.00 0.00 H new ATOM 0 HD1 HIS A 19 -11.741 -4.843 9.255 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -13.492 -6.055 12.895 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -12.811 -2.760 10.291 1.00 0.00 H new ATOM 300 N GLN A 20 -9.447 -9.172 10.323 1.00 0.00 N ATOM 301 CA GLN A 20 -8.860 -10.374 9.776 1.00 0.00 C ATOM 302 C GLN A 20 -8.100 -11.173 10.836 1.00 0.00 C ATOM 303 O GLN A 20 -8.202 -12.400 10.868 1.00 0.00 O ATOM 304 CB GLN A 20 -7.963 -10.008 8.592 1.00 0.00 C ATOM 305 CG GLN A 20 -7.477 -11.268 7.875 1.00 0.00 C ATOM 306 CD GLN A 20 -8.651 -12.149 7.441 1.00 0.00 C ATOM 307 OE1 GLN A 20 -9.416 -11.791 6.559 1.00 0.00 O ATOM 308 NE2 GLN A 20 -8.866 -13.275 8.098 1.00 0.00 N ATOM 0 H GLN A 20 -9.042 -8.307 9.966 1.00 0.00 H new ATOM 0 HA GLN A 20 -9.661 -11.023 9.424 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -8.512 -9.375 7.895 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -7.108 -9.429 8.942 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -6.888 -10.988 7.002 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -6.820 -11.834 8.535 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -8.222 -13.567 8.833 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -9.676 -13.852 7.870 1.00 0.00 H new ATOM 317 N ALA A 21 -7.315 -10.508 11.683 1.00 0.00 N ATOM 318 CA ALA A 21 -6.651 -11.157 12.798 1.00 0.00 C ATOM 319 C ALA A 21 -7.648 -11.719 13.801 1.00 0.00 C ATOM 320 O ALA A 21 -7.393 -12.776 14.374 1.00 0.00 O ATOM 321 CB ALA A 21 -5.633 -10.232 13.421 1.00 0.00 C ATOM 0 H ALA A 21 -7.126 -9.508 11.611 1.00 0.00 H new ATOM 0 HA ALA A 21 -6.103 -12.020 12.419 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -5.146 -10.736 14.255 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -4.886 -9.958 12.676 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -6.132 -9.333 13.782 1.00 0.00 H new ATOM 327 N ARG A 22 -8.816 -11.105 13.985 1.00 0.00 N ATOM 328 CA ARG A 22 -9.823 -11.708 14.827 1.00 0.00 C ATOM 329 C ARG A 22 -10.131 -13.090 14.254 1.00 0.00 C ATOM 330 O ARG A 22 -9.891 -14.091 14.926 1.00 0.00 O ATOM 331 CB ARG A 22 -11.028 -10.772 14.994 1.00 0.00 C ATOM 332 CG ARG A 22 -12.059 -11.399 15.938 1.00 0.00 C ATOM 333 CD ARG A 22 -12.764 -10.388 16.838 1.00 0.00 C ATOM 334 NE ARG A 22 -11.849 -9.905 17.886 1.00 0.00 N ATOM 335 CZ ARG A 22 -11.430 -8.649 18.071 1.00 0.00 C ATOM 336 NH1 ARG A 22 -11.806 -7.670 17.258 1.00 0.00 N ATOM 337 NH2 ARG A 22 -10.644 -8.384 19.102 1.00 0.00 N ATOM 0 H ARG A 22 -9.076 -10.211 13.569 1.00 0.00 H new ATOM 0 HA ARG A 22 -9.474 -11.855 15.849 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -10.699 -9.811 15.390 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -11.484 -10.578 14.023 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -12.806 -11.927 15.346 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -11.562 -12.142 16.562 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -13.120 -9.548 16.242 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -13.640 -10.848 17.295 1.00 0.00 H new ATOM 0 HE ARG A 22 -11.497 -10.604 18.541 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -12.427 -7.869 16.473 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -11.474 -6.719 17.418 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -10.368 -9.132 19.739 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -10.314 -7.432 19.260 1.00 0.00 H new ATOM 432 N GLU A 28 -6.857 -8.930 18.155 1.00 0.00 N ATOM 433 CA GLU A 28 -6.980 -7.621 17.534 1.00 0.00 C ATOM 434 C GLU A 28 -5.592 -7.227 17.015 1.00 0.00 C ATOM 435 O GLU A 28 -4.645 -7.283 17.799 1.00 0.00 O ATOM 436 CB GLU A 28 -7.424 -6.616 18.613 1.00 0.00 C ATOM 437 CG GLU A 28 -8.050 -5.341 18.031 1.00 0.00 C ATOM 438 CD GLU A 28 -9.554 -5.528 17.846 1.00 0.00 C ATOM 439 OE1 GLU A 28 -10.259 -5.711 18.864 1.00 0.00 O ATOM 440 OE2 GLU A 28 -10.029 -5.672 16.701 1.00 0.00 O ATOM 0 HA GLU A 28 -7.704 -7.631 16.719 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -8.144 -7.097 19.274 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -6.563 -6.344 19.224 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -7.860 -4.498 18.696 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -7.585 -5.103 17.074 1.00 0.00 H new ATOM 447 N GLU A 29 -5.438 -6.857 15.738 1.00 0.00 N ATOM 448 CA GLU A 29 -4.164 -6.342 15.233 1.00 0.00 C ATOM 449 C GLU A 29 -4.316 -5.531 13.931 1.00 0.00 C ATOM 450 O GLU A 29 -4.653 -6.105 12.888 1.00 0.00 O ATOM 451 CB GLU A 29 -3.280 -7.524 14.766 1.00 0.00 C ATOM 452 CG GLU A 29 -2.716 -8.607 15.685 1.00 0.00 C ATOM 453 CD GLU A 29 -1.965 -9.677 14.860 1.00 0.00 C ATOM 454 OE1 GLU A 29 -1.978 -9.620 13.604 1.00 0.00 O ATOM 455 OE2 GLU A 29 -1.358 -10.580 15.477 1.00 0.00 O ATOM 0 H GLU A 29 -6.179 -6.905 15.039 1.00 0.00 H new ATOM 0 HA GLU A 29 -3.759 -5.743 16.048 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -3.857 -8.047 14.003 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.421 -7.077 14.265 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -2.040 -8.159 16.413 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -3.525 -9.074 16.247 1.00 0.00 H new ATOM 462 N ASP A 30 -4.073 -4.223 13.943 1.00 0.00 N ATOM 463 CA ASP A 30 -4.039 -3.419 12.719 1.00 0.00 C ATOM 464 C ASP A 30 -2.547 -3.325 12.357 1.00 0.00 C ATOM 465 O ASP A 30 -1.685 -3.607 13.196 1.00 0.00 O ATOM 466 CB ASP A 30 -4.647 -2.015 12.842 1.00 0.00 C ATOM 467 CG ASP A 30 -3.744 -1.044 13.604 1.00 0.00 C ATOM 468 OD1 ASP A 30 -3.805 -1.079 14.852 1.00 0.00 O ATOM 469 OD2 ASP A 30 -3.023 -0.281 12.921 1.00 0.00 O ATOM 0 H ASP A 30 -3.895 -3.691 14.795 1.00 0.00 H new ATOM 0 HA ASP A 30 -4.655 -3.897 11.957 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -4.840 -1.619 11.845 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -5.609 -2.084 13.349 1.00 0.00 H new ATOM 474 N ILE A 31 -2.218 -2.962 11.121 1.00 0.00 N ATOM 475 CA ILE A 31 -0.830 -2.704 10.732 1.00 0.00 C ATOM 476 C ILE A 31 -0.901 -1.507 9.790 1.00 0.00 C ATOM 477 O ILE A 31 -1.425 -1.618 8.681 1.00 0.00 O ATOM 478 CB ILE A 31 -0.129 -3.933 10.097 1.00 0.00 C ATOM 479 CG1 ILE A 31 0.141 -5.106 11.070 1.00 0.00 C ATOM 480 CG2 ILE A 31 1.231 -3.538 9.477 1.00 0.00 C ATOM 481 CD1 ILE A 31 -0.965 -6.163 11.059 1.00 0.00 C ATOM 0 H ILE A 31 -2.894 -2.839 10.367 1.00 0.00 H new ATOM 0 HA ILE A 31 -0.210 -2.494 11.603 1.00 0.00 H new ATOM 0 HB ILE A 31 -0.840 -4.275 9.345 1.00 0.00 H new ATOM 0 HG12 ILE A 31 1.088 -5.577 10.807 1.00 0.00 H new ATOM 0 HG13 ILE A 31 0.250 -4.714 12.081 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.701 -4.419 9.039 1.00 0.00 H new ATOM 0 HG22 ILE A 31 1.073 -2.788 8.702 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.879 -3.129 10.252 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.716 -6.958 11.762 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -1.910 -5.704 11.350 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.059 -6.581 10.057 1.00 0.00 H new ATOM 493 N LEU A 32 -0.351 -0.371 10.206 1.00 0.00 N ATOM 494 CA LEU A 32 -0.374 0.857 9.425 1.00 0.00 C ATOM 495 C LEU A 32 0.741 0.742 8.371 1.00 0.00 C ATOM 496 O LEU A 32 1.903 0.565 8.741 1.00 0.00 O ATOM 497 CB LEU A 32 -0.184 2.049 10.385 1.00 0.00 C ATOM 498 CG LEU A 32 -0.682 3.416 9.870 1.00 0.00 C ATOM 499 CD1 LEU A 32 -0.528 3.628 8.367 1.00 0.00 C ATOM 500 CD2 LEU A 32 -2.163 3.623 10.217 1.00 0.00 C ATOM 0 H LEU A 32 0.127 -0.278 11.102 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.319 1.016 8.906 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.700 1.824 11.319 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.877 2.136 10.620 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.042 4.140 10.373 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -0.904 4.615 8.098 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.525 3.555 8.095 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.095 2.866 7.832 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.492 4.593 9.844 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -2.758 2.836 9.755 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.292 3.587 11.299 1.00 0.00 H new ATOM 512 N ILE A 33 0.416 0.797 7.072 1.00 0.00 N ATOM 513 CA ILE A 33 1.404 0.711 5.994 1.00 0.00 C ATOM 514 C ILE A 33 1.791 2.122 5.530 1.00 0.00 C ATOM 515 O ILE A 33 2.970 2.485 5.498 1.00 0.00 O ATOM 516 CB ILE A 33 0.877 -0.113 4.795 1.00 0.00 C ATOM 517 CG1 ILE A 33 0.312 -1.479 5.223 1.00 0.00 C ATOM 518 CG2 ILE A 33 2.000 -0.325 3.764 1.00 0.00 C ATOM 519 CD1 ILE A 33 -0.065 -2.325 4.007 1.00 0.00 C ATOM 0 H ILE A 33 -0.543 0.903 6.741 1.00 0.00 H new ATOM 0 HA ILE A 33 2.282 0.198 6.387 1.00 0.00 H new ATOM 0 HB ILE A 33 0.062 0.458 4.351 1.00 0.00 H new ATOM 0 HG12 ILE A 33 1.051 -2.009 5.824 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.565 -1.332 5.853 1.00 0.00 H new ATOM 0 HG21 ILE A 33 1.618 -0.906 2.924 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.352 0.642 3.406 1.00 0.00 H new ATOM 0 HG23 ILE A 33 2.826 -0.862 4.231 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -0.461 -3.284 4.340 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -0.822 -1.803 3.421 1.00 0.00 H new ATOM 0 HD13 ILE A 33 0.819 -2.491 3.391 1.00 0.00 H new ATOM 531 N VAL A 34 0.786 2.880 5.088 1.00 0.00 N ATOM 532 CA VAL A 34 0.901 4.190 4.473 1.00 0.00 C ATOM 533 C VAL A 34 0.006 5.170 5.219 1.00 0.00 C ATOM 534 O VAL A 34 -1.116 4.837 5.599 1.00 0.00 O ATOM 535 CB VAL A 34 0.479 4.090 2.985 1.00 0.00 C ATOM 536 CG1 VAL A 34 0.911 5.288 2.131 1.00 0.00 C ATOM 537 CG2 VAL A 34 1.045 2.848 2.290 1.00 0.00 C ATOM 0 H VAL A 34 -0.184 2.572 5.157 1.00 0.00 H new ATOM 0 HA VAL A 34 1.931 4.544 4.524 1.00 0.00 H new ATOM 0 HB VAL A 34 -0.609 4.049 3.045 1.00 0.00 H new ATOM 0 HG11 VAL A 34 0.578 5.141 1.104 1.00 0.00 H new ATOM 0 HG12 VAL A 34 0.465 6.199 2.530 1.00 0.00 H new ATOM 0 HG13 VAL A 34 1.997 5.376 2.151 1.00 0.00 H new ATOM 0 HG21 VAL A 34 0.716 2.831 1.251 1.00 0.00 H new ATOM 0 HG22 VAL A 34 2.134 2.876 2.326 1.00 0.00 H new ATOM 0 HG23 VAL A 34 0.688 1.952 2.798 1.00 0.00 H new ATOM 547 N SER A 35 0.483 6.394 5.355 1.00 0.00 N ATOM 548 CA SER A 35 -0.183 7.564 5.895 1.00 0.00 C ATOM 549 C SER A 35 0.533 8.702 5.184 1.00 0.00 C ATOM 550 O SER A 35 1.755 8.615 5.067 1.00 0.00 O ATOM 551 CB SER A 35 -0.007 7.630 7.420 1.00 0.00 C ATOM 552 OG SER A 35 1.315 7.309 7.821 1.00 0.00 O ATOM 0 H SER A 35 1.435 6.614 5.063 1.00 0.00 H new ATOM 0 HA SER A 35 -1.261 7.580 5.737 1.00 0.00 H new ATOM 0 HB2 SER A 35 -0.258 8.631 7.770 1.00 0.00 H new ATOM 0 HB3 SER A 35 -0.706 6.942 7.895 1.00 0.00 H new ATOM 0 HG SER A 35 1.949 7.631 7.147 1.00 0.00 H new ATOM 558 N GLU A 36 -0.175 9.708 4.668 1.00 0.00 N ATOM 559 CA GLU A 36 0.382 10.797 3.857 1.00 0.00 C ATOM 560 C GLU A 36 1.383 10.305 2.780 1.00 0.00 C ATOM 561 O GLU A 36 2.356 10.978 2.456 1.00 0.00 O ATOM 562 CB GLU A 36 0.897 11.969 4.744 1.00 0.00 C ATOM 563 CG GLU A 36 2.014 11.549 5.718 1.00 0.00 C ATOM 564 CD GLU A 36 2.838 12.659 6.379 1.00 0.00 C ATOM 565 OE1 GLU A 36 3.506 13.454 5.678 1.00 0.00 O ATOM 566 OE2 GLU A 36 3.093 12.532 7.600 1.00 0.00 O ATOM 0 H GLU A 36 -1.182 9.792 4.806 1.00 0.00 H new ATOM 0 HA GLU A 36 -0.436 11.217 3.271 1.00 0.00 H new ATOM 0 HB2 GLU A 36 1.266 12.768 4.101 1.00 0.00 H new ATOM 0 HB3 GLU A 36 0.063 12.379 5.313 1.00 0.00 H new ATOM 0 HG2 GLU A 36 1.562 10.951 6.509 1.00 0.00 H new ATOM 0 HG3 GLU A 36 2.701 10.897 5.179 1.00 0.00 H new ATOM 573 N GLY A 37 1.165 9.112 2.206 1.00 0.00 N ATOM 574 CA GLY A 37 2.063 8.505 1.209 1.00 0.00 C ATOM 575 C GLY A 37 3.431 8.041 1.747 1.00 0.00 C ATOM 576 O GLY A 37 4.214 7.433 1.023 1.00 0.00 O ATOM 0 H GLY A 37 0.352 8.535 2.423 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.557 7.648 0.763 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.232 9.227 0.410 1.00 0.00 H new ATOM 580 N LYS A 38 3.710 8.276 3.025 1.00 0.00 N ATOM 581 CA LYS A 38 4.901 8.011 3.838 1.00 0.00 C ATOM 582 C LYS A 38 5.236 6.523 4.038 1.00 0.00 C ATOM 583 O LYS A 38 5.529 6.161 5.174 1.00 0.00 O ATOM 584 CB LYS A 38 4.848 8.870 5.117 1.00 0.00 C ATOM 585 CG LYS A 38 6.204 9.104 5.812 1.00 0.00 C ATOM 586 CD LYS A 38 6.125 10.252 6.836 1.00 0.00 C ATOM 587 CE LYS A 38 6.009 11.616 6.141 1.00 0.00 C ATOM 588 NZ LYS A 38 5.737 12.713 7.086 1.00 0.00 N ATOM 0 H LYS A 38 2.999 8.725 3.603 1.00 0.00 H new ATOM 0 HA LYS A 38 5.777 8.330 3.274 1.00 0.00 H new ATOM 0 HB2 LYS A 38 4.415 9.839 4.866 1.00 0.00 H new ATOM 0 HB3 LYS A 38 4.172 8.393 5.827 1.00 0.00 H new ATOM 0 HG2 LYS A 38 6.519 8.189 6.314 1.00 0.00 H new ATOM 0 HG3 LYS A 38 6.962 9.335 5.064 1.00 0.00 H new ATOM 0 HD2 LYS A 38 5.266 10.100 7.489 1.00 0.00 H new ATOM 0 HD3 LYS A 38 7.012 10.239 7.469 1.00 0.00 H new ATOM 0 HE2 LYS A 38 6.934 11.825 5.604 1.00 0.00 H new ATOM 0 HE3 LYS A 38 5.212 11.575 5.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 5.567 13.592 6.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 4.896 12.482 7.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 6.555 12.840 7.716 1.00 0.00 H new ATOM 602 N MET A 39 5.054 5.645 3.034 1.00 0.00 N ATOM 603 CA MET A 39 5.206 4.183 3.141 1.00 0.00 C ATOM 604 C MET A 39 6.383 3.834 4.059 1.00 0.00 C ATOM 605 O MET A 39 7.547 4.131 3.781 1.00 0.00 O ATOM 606 CB MET A 39 5.545 3.574 1.759 1.00 0.00 C ATOM 607 CG MET A 39 4.391 3.329 0.783 1.00 0.00 C ATOM 608 SD MET A 39 3.837 1.597 0.724 1.00 0.00 S ATOM 609 CE MET A 39 2.683 1.673 -0.673 1.00 0.00 C ATOM 0 H MET A 39 4.788 5.944 2.096 1.00 0.00 H new ATOM 0 HA MET A 39 4.267 3.789 3.530 1.00 0.00 H new ATOM 0 HB2 MET A 39 6.263 4.233 1.270 1.00 0.00 H new ATOM 0 HB3 MET A 39 6.049 2.622 1.927 1.00 0.00 H new ATOM 0 HG2 MET A 39 3.549 3.961 1.064 1.00 0.00 H new ATOM 0 HG3 MET A 39 4.700 3.636 -0.216 1.00 0.00 H new ATOM 0 HE1 MET A 39 2.361 0.665 -0.934 1.00 0.00 H new ATOM 0 HE2 MET A 39 1.815 2.271 -0.396 1.00 0.00 H new ATOM 0 HE3 MET A 39 3.179 2.129 -1.530 1.00 0.00 H new ATOM 619 N ALA A 40 6.020 3.227 5.187 1.00 0.00 N ATOM 620 CA ALA A 40 6.899 2.893 6.290 1.00 0.00 C ATOM 621 C ALA A 40 7.895 1.794 5.903 1.00 0.00 C ATOM 622 O ALA A 40 7.726 1.092 4.909 1.00 0.00 O ATOM 623 CB ALA A 40 5.982 2.445 7.445 1.00 0.00 C ATOM 0 H ALA A 40 5.055 2.943 5.358 1.00 0.00 H new ATOM 0 HA ALA A 40 7.507 3.750 6.581 1.00 0.00 H new ATOM 0 HB1 ALA A 40 6.590 2.179 8.310 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.308 3.259 7.712 1.00 0.00 H new ATOM 0 HB3 ALA A 40 5.398 1.579 7.131 1.00 0.00 H new ATOM 629 N PRO A 41 8.918 1.559 6.737 1.00 0.00 N ATOM 630 CA PRO A 41 9.859 0.454 6.567 1.00 0.00 C ATOM 631 C PRO A 41 9.215 -0.904 6.939 1.00 0.00 C ATOM 632 O PRO A 41 9.931 -1.887 7.152 1.00 0.00 O ATOM 633 CB PRO A 41 11.066 0.832 7.438 1.00 0.00 C ATOM 634 CG PRO A 41 10.477 1.749 8.511 1.00 0.00 C ATOM 635 CD PRO A 41 9.336 2.450 7.804 1.00 0.00 C ATOM 0 HA PRO A 41 10.166 0.314 5.531 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.532 -0.050 7.878 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.834 1.341 6.856 1.00 0.00 H new ATOM 0 HG2 PRO A 41 10.125 1.181 9.372 1.00 0.00 H new ATOM 0 HG3 PRO A 41 11.217 2.460 8.879 1.00 0.00 H new ATOM 0 HD2 PRO A 41 8.514 2.648 8.492 1.00 0.00 H new ATOM 0 HD3 PRO A 41 9.657 3.412 7.405 1.00 0.00 H new ATOM 643 N PHE A 42 7.876 -0.972 7.019 1.00 0.00 N ATOM 644 CA PHE A 42 7.076 -2.122 7.439 1.00 0.00 C ATOM 645 C PHE A 42 7.420 -3.384 6.647 1.00 0.00 C ATOM 646 O PHE A 42 7.304 -4.498 7.155 1.00 0.00 O ATOM 647 CB PHE A 42 5.577 -1.795 7.203 1.00 0.00 C ATOM 648 CG PHE A 42 5.159 -1.855 5.732 1.00 0.00 C ATOM 649 CD1 PHE A 42 4.750 -3.078 5.167 1.00 0.00 C ATOM 650 CD2 PHE A 42 5.312 -0.742 4.887 1.00 0.00 C ATOM 651 CE1 PHE A 42 4.592 -3.216 3.775 1.00 0.00 C ATOM 652 CE2 PHE A 42 5.183 -0.878 3.493 1.00 0.00 C ATOM 653 CZ PHE A 42 4.839 -2.119 2.931 1.00 0.00 C ATOM 0 H PHE A 42 7.292 -0.172 6.776 1.00 0.00 H new ATOM 0 HA PHE A 42 7.289 -2.311 8.491 1.00 0.00 H new ATOM 0 HB2 PHE A 42 4.967 -2.495 7.774 1.00 0.00 H new ATOM 0 HB3 PHE A 42 5.366 -0.799 7.591 1.00 0.00 H new ATOM 0 HD1 PHE A 42 4.555 -3.923 5.811 1.00 0.00 H new ATOM 0 HD2 PHE A 42 5.531 0.226 5.312 1.00 0.00 H new ATOM 0 HE1 PHE A 42 4.282 -4.162 3.356 1.00 0.00 H new ATOM 0 HE2 PHE A 42 5.349 -0.025 2.852 1.00 0.00 H new ATOM 0 HZ PHE A 42 4.765 -2.229 1.859 1.00 0.00 H new ATOM 663 N THR A 43 7.911 -3.201 5.425 1.00 0.00 N ATOM 664 CA THR A 43 8.184 -4.220 4.439 1.00 0.00 C ATOM 665 C THR A 43 9.157 -5.274 4.982 1.00 0.00 C ATOM 666 O THR A 43 9.074 -6.440 4.594 1.00 0.00 O ATOM 667 CB THR A 43 8.761 -3.510 3.202 1.00 0.00 C ATOM 668 OG1 THR A 43 8.104 -2.277 2.993 1.00 0.00 O ATOM 669 CG2 THR A 43 8.479 -4.339 1.949 1.00 0.00 C ATOM 0 H THR A 43 8.142 -2.268 5.082 1.00 0.00 H new ATOM 0 HA THR A 43 7.270 -4.755 4.180 1.00 0.00 H new ATOM 0 HB THR A 43 9.829 -3.374 3.373 1.00 0.00 H new ATOM 0 HG1 THR A 43 7.136 -2.403 3.083 1.00 0.00 H new ATOM 0 HG21 THR A 43 8.890 -3.831 1.077 1.00 0.00 H new ATOM 0 HG22 THR A 43 8.943 -5.320 2.050 1.00 0.00 H new ATOM 0 HG23 THR A 43 7.402 -4.458 1.826 1.00 0.00 H new ATOM 677 N HIS A 44 10.074 -4.889 5.882 1.00 0.00 N ATOM 678 CA HIS A 44 11.010 -5.832 6.475 1.00 0.00 C ATOM 679 C HIS A 44 10.262 -6.889 7.287 1.00 0.00 C ATOM 680 O HIS A 44 10.462 -8.086 7.060 1.00 0.00 O ATOM 681 CB HIS A 44 12.065 -5.118 7.331 1.00 0.00 C ATOM 682 CG HIS A 44 13.054 -6.097 7.919 1.00 0.00 C ATOM 683 ND1 HIS A 44 13.796 -7.016 7.208 1.00 0.00 N ATOM 684 CD2 HIS A 44 13.286 -6.316 9.251 1.00 0.00 C ATOM 685 CE1 HIS A 44 14.457 -7.777 8.095 1.00 0.00 C ATOM 686 NE2 HIS A 44 14.164 -7.406 9.351 1.00 0.00 N ATOM 0 H HIS A 44 10.181 -3.929 6.210 1.00 0.00 H new ATOM 0 HA HIS A 44 11.539 -6.333 5.665 1.00 0.00 H new ATOM 0 HB2 HIS A 44 12.595 -4.385 6.722 1.00 0.00 H new ATOM 0 HB3 HIS A 44 11.573 -4.569 8.134 1.00 0.00 H new ATOM 0 HD2 HIS A 44 12.870 -5.753 10.073 1.00 0.00 H new ATOM 0 HE1 HIS A 44 15.132 -8.578 7.833 1.00 0.00 H new ATOM 0 HE2 HIS A 44 14.511 -7.833 10.210 1.00 0.00 H new ATOM 694 N ASP A 45 9.428 -6.470 8.241 1.00 0.00 N ATOM 695 CA ASP A 45 8.696 -7.412 9.085 1.00 0.00 C ATOM 696 C ASP A 45 7.520 -8.043 8.349 1.00 0.00 C ATOM 697 O ASP A 45 7.145 -9.178 8.631 1.00 0.00 O ATOM 698 CB ASP A 45 8.417 -6.876 10.497 1.00 0.00 C ATOM 699 CG ASP A 45 9.684 -7.081 11.339 1.00 0.00 C ATOM 700 OD1 ASP A 45 10.713 -6.447 11.017 1.00 0.00 O ATOM 701 OD2 ASP A 45 9.755 -8.050 12.128 1.00 0.00 O ATOM 0 H ASP A 45 9.244 -5.488 8.447 1.00 0.00 H new ATOM 0 HA ASP A 45 9.355 -8.256 9.290 1.00 0.00 H new ATOM 0 HB2 ASP A 45 8.152 -5.820 10.458 1.00 0.00 H new ATOM 0 HB3 ASP A 45 7.573 -7.401 10.944 1.00 0.00 H new ATOM 706 N PHE A 46 6.997 -7.367 7.327 1.00 0.00 N ATOM 707 CA PHE A 46 5.969 -7.921 6.455 1.00 0.00 C ATOM 708 C PHE A 46 6.556 -9.164 5.776 1.00 0.00 C ATOM 709 O PHE A 46 5.916 -10.210 5.723 1.00 0.00 O ATOM 710 CB PHE A 46 5.569 -6.848 5.439 1.00 0.00 C ATOM 711 CG PHE A 46 4.327 -7.095 4.603 1.00 0.00 C ATOM 712 CD1 PHE A 46 4.332 -8.048 3.565 1.00 0.00 C ATOM 713 CD2 PHE A 46 3.198 -6.271 4.782 1.00 0.00 C ATOM 714 CE1 PHE A 46 3.237 -8.135 2.686 1.00 0.00 C ATOM 715 CE2 PHE A 46 2.123 -6.333 3.884 1.00 0.00 C ATOM 716 CZ PHE A 46 2.155 -7.249 2.824 1.00 0.00 C ATOM 0 H PHE A 46 7.277 -6.417 7.082 1.00 0.00 H new ATOM 0 HA PHE A 46 5.074 -8.213 7.005 1.00 0.00 H new ATOM 0 HB2 PHE A 46 5.429 -5.911 5.978 1.00 0.00 H new ATOM 0 HB3 PHE A 46 6.408 -6.702 4.758 1.00 0.00 H new ATOM 0 HD1 PHE A 46 5.176 -8.711 3.444 1.00 0.00 H new ATOM 0 HD2 PHE A 46 3.160 -5.587 5.617 1.00 0.00 H new ATOM 0 HE1 PHE A 46 3.228 -8.882 1.906 1.00 0.00 H new ATOM 0 HE2 PHE A 46 1.274 -5.677 4.009 1.00 0.00 H new ATOM 0 HZ PHE A 46 1.345 -7.274 2.110 1.00 0.00 H new ATOM 726 N ARG A 47 7.806 -9.068 5.295 1.00 0.00 N ATOM 727 CA ARG A 47 8.536 -10.195 4.728 1.00 0.00 C ATOM 728 C ARG A 47 8.891 -11.222 5.807 1.00 0.00 C ATOM 729 O ARG A 47 8.796 -12.419 5.539 1.00 0.00 O ATOM 730 CB ARG A 47 9.797 -9.675 4.004 1.00 0.00 C ATOM 731 CG ARG A 47 10.475 -10.721 3.103 1.00 0.00 C ATOM 732 CD ARG A 47 9.697 -10.891 1.795 1.00 0.00 C ATOM 733 NE ARG A 47 10.069 -12.115 1.060 1.00 0.00 N ATOM 734 CZ ARG A 47 10.629 -12.177 -0.158 1.00 0.00 C ATOM 735 NH1 ARG A 47 11.170 -11.106 -0.731 1.00 0.00 N ATOM 736 NH2 ARG A 47 10.649 -13.336 -0.814 1.00 0.00 N ATOM 0 H ARG A 47 8.335 -8.196 5.292 1.00 0.00 H new ATOM 0 HA ARG A 47 7.901 -10.705 4.003 1.00 0.00 H new ATOM 0 HB2 ARG A 47 9.526 -8.810 3.399 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.515 -9.331 4.748 1.00 0.00 H new ATOM 0 HG2 ARG A 47 11.498 -10.414 2.887 1.00 0.00 H new ATOM 0 HG3 ARG A 47 10.532 -11.676 3.625 1.00 0.00 H new ATOM 0 HD2 ARG A 47 8.629 -10.915 2.014 1.00 0.00 H new ATOM 0 HD3 ARG A 47 9.872 -10.024 1.159 1.00 0.00 H new ATOM 0 HE ARG A 47 9.882 -13.004 1.524 1.00 0.00 H new ATOM 0 HH11 ARG A 47 11.166 -10.210 -0.244 1.00 0.00 H new ATOM 0 HH12 ARG A 47 11.589 -11.180 -1.658 1.00 0.00 H new ATOM 0 HH21 ARG A 47 10.240 -14.169 -0.390 1.00 0.00 H new ATOM 0 HH22 ARG A 47 11.073 -13.391 -1.740 1.00 0.00 H new ATOM 840 N MET A 53 1.771 -11.760 9.367 1.00 0.00 N ATOM 841 CA MET A 53 1.994 -11.031 8.112 1.00 0.00 C ATOM 842 C MET A 53 2.441 -11.933 6.955 1.00 0.00 C ATOM 843 O MET A 53 1.661 -12.073 6.016 1.00 0.00 O ATOM 844 CB MET A 53 2.903 -9.806 8.327 1.00 0.00 C ATOM 845 CG MET A 53 2.129 -8.603 8.880 1.00 0.00 C ATOM 846 SD MET A 53 1.569 -7.385 7.651 1.00 0.00 S ATOM 847 CE MET A 53 0.781 -8.386 6.354 1.00 0.00 C ATOM 0 HA MET A 53 1.025 -10.647 7.794 1.00 0.00 H new ATOM 0 HB2 MET A 53 3.706 -10.068 9.016 1.00 0.00 H new ATOM 0 HB3 MET A 53 3.371 -9.532 7.381 1.00 0.00 H new ATOM 0 HG2 MET A 53 1.257 -8.973 9.419 1.00 0.00 H new ATOM 0 HG3 MET A 53 2.760 -8.093 9.607 1.00 0.00 H new ATOM 0 HE1 MET A 53 0.348 -7.729 5.600 1.00 0.00 H new ATOM 0 HE2 MET A 53 1.527 -9.031 5.889 1.00 0.00 H new ATOM 0 HE3 MET A 53 -0.005 -9.000 6.795 1.00 0.00 H new ATOM 857 N PRO A 54 3.635 -12.555 6.979 1.00 0.00 N ATOM 858 CA PRO A 54 4.070 -13.401 5.880 1.00 0.00 C ATOM 859 C PRO A 54 3.323 -14.734 5.895 1.00 0.00 C ATOM 860 O PRO A 54 2.571 -15.030 4.974 1.00 0.00 O ATOM 861 CB PRO A 54 5.584 -13.566 6.042 1.00 0.00 C ATOM 862 CG PRO A 54 5.841 -13.298 7.518 1.00 0.00 C ATOM 863 CD PRO A 54 4.723 -12.337 7.917 1.00 0.00 C ATOM 0 HA PRO A 54 3.847 -12.958 4.909 1.00 0.00 H new ATOM 0 HB2 PRO A 54 5.907 -14.568 5.759 1.00 0.00 H new ATOM 0 HB3 PRO A 54 6.129 -12.865 5.410 1.00 0.00 H new ATOM 0 HG2 PRO A 54 5.806 -14.217 8.103 1.00 0.00 H new ATOM 0 HG3 PRO A 54 6.824 -12.856 7.678 1.00 0.00 H new ATOM 0 HD2 PRO A 54 4.397 -12.525 8.940 1.00 0.00 H new ATOM 0 HD3 PRO A 54 5.068 -11.304 7.878 1.00 0.00 H new ATOM 871 N ALA A 55 3.590 -15.568 6.902 1.00 0.00 N ATOM 872 CA ALA A 55 3.062 -16.921 7.005 1.00 0.00 C ATOM 873 C ALA A 55 1.560 -16.881 7.307 1.00 0.00 C ATOM 874 O ALA A 55 1.151 -16.376 8.352 1.00 0.00 O ATOM 875 CB ALA A 55 3.819 -17.685 8.099 1.00 0.00 C ATOM 0 H ALA A 55 4.193 -15.311 7.684 1.00 0.00 H new ATOM 0 HA ALA A 55 3.202 -17.438 6.056 1.00 0.00 H new ATOM 0 HB1 ALA A 55 3.423 -18.698 8.176 1.00 0.00 H new ATOM 0 HB2 ALA A 55 4.878 -17.727 7.846 1.00 0.00 H new ATOM 0 HB3 ALA A 55 3.694 -17.173 9.053 1.00 0.00 H new ATOM 881 N ILE A 56 0.761 -17.453 6.412 1.00 0.00 N ATOM 882 CA ILE A 56 -0.695 -17.510 6.431 1.00 0.00 C ATOM 883 C ILE A 56 -1.070 -18.997 6.334 1.00 0.00 C ATOM 884 O ILE A 56 -0.551 -19.686 5.452 1.00 0.00 O ATOM 885 CB ILE A 56 -1.233 -16.691 5.235 1.00 0.00 C ATOM 886 CG1 ILE A 56 -0.916 -15.185 5.375 1.00 0.00 C ATOM 887 CG2 ILE A 56 -2.749 -16.869 5.040 1.00 0.00 C ATOM 888 CD1 ILE A 56 -0.897 -14.481 4.016 1.00 0.00 C ATOM 0 H ILE A 56 1.145 -17.924 5.593 1.00 0.00 H new ATOM 0 HA ILE A 56 -1.129 -17.085 7.336 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.719 -17.083 4.357 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -1.660 -14.715 6.018 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.051 -15.061 5.863 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -3.079 -16.274 4.188 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -2.971 -17.920 4.856 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -3.272 -16.539 5.937 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -0.671 -13.424 4.157 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -0.135 -14.934 3.382 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -1.872 -14.583 3.540 1.00 0.00 H new ATOM 900 N PRO A 57 -1.942 -19.544 7.197 1.00 0.00 N ATOM 901 CA PRO A 57 -2.381 -20.930 7.082 1.00 0.00 C ATOM 902 C PRO A 57 -3.436 -21.097 5.977 1.00 0.00 C ATOM 903 O PRO A 57 -4.197 -20.173 5.684 1.00 0.00 O ATOM 904 CB PRO A 57 -2.979 -21.258 8.451 1.00 0.00 C ATOM 905 CG PRO A 57 -3.544 -19.914 8.918 1.00 0.00 C ATOM 906 CD PRO A 57 -2.541 -18.903 8.357 1.00 0.00 C ATOM 0 HA PRO A 57 -1.559 -21.594 6.812 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -3.757 -22.018 8.379 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -2.224 -21.638 9.139 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -4.549 -19.743 8.531 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -3.607 -19.859 10.005 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -3.037 -17.973 8.078 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -1.784 -18.650 9.099 1.00 0.00 H new ATOM 914 N VAL A 58 -3.559 -22.321 5.456 1.00 0.00 N ATOM 915 CA VAL A 58 -4.524 -22.774 4.453 1.00 0.00 C ATOM 916 C VAL A 58 -5.934 -22.209 4.681 1.00 0.00 C ATOM 917 O VAL A 58 -6.562 -21.742 3.729 1.00 0.00 O ATOM 918 CB VAL A 58 -4.465 -24.325 4.378 1.00 0.00 C ATOM 919 CG1 VAL A 58 -4.959 -25.047 5.641 1.00 0.00 C ATOM 920 CG2 VAL A 58 -5.173 -24.866 3.131 1.00 0.00 C ATOM 0 H VAL A 58 -2.939 -23.077 5.747 1.00 0.00 H new ATOM 0 HA VAL A 58 -4.250 -22.375 3.476 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.401 -24.552 4.305 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -4.881 -26.125 5.498 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -4.348 -24.749 6.493 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.999 -24.780 5.830 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -5.108 -25.954 3.119 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -6.221 -24.566 3.148 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -4.695 -24.464 2.238 1.00 0.00 H new ATOM 930 N ASN A 59 -6.389 -22.219 5.940 1.00 0.00 N ATOM 931 CA ASN A 59 -7.727 -21.830 6.380 1.00 0.00 C ATOM 932 C ASN A 59 -8.082 -20.383 6.040 1.00 0.00 C ATOM 933 O ASN A 59 -9.247 -20.084 5.791 1.00 0.00 O ATOM 934 CB ASN A 59 -7.842 -22.033 7.898 1.00 0.00 C ATOM 935 CG ASN A 59 -9.256 -21.720 8.381 1.00 0.00 C ATOM 936 OD1 ASN A 59 -10.182 -22.459 8.090 1.00 0.00 O ATOM 937 ND2 ASN A 59 -9.453 -20.653 9.140 1.00 0.00 N ATOM 0 H ASN A 59 -5.799 -22.515 6.718 1.00 0.00 H new ATOM 0 HA ASN A 59 -8.431 -22.465 5.842 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -7.585 -23.061 8.152 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -7.127 -21.390 8.411 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -10.388 -20.441 9.489 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -8.670 -20.043 9.376 1.00 0.00 H new ATOM 944 N ILE A 60 -7.112 -19.463 6.061 1.00 0.00 N ATOM 945 CA ILE A 60 -7.392 -18.077 5.706 1.00 0.00 C ATOM 946 C ILE A 60 -7.655 -18.112 4.200 1.00 0.00 C ATOM 947 O ILE A 60 -6.759 -18.364 3.392 1.00 0.00 O ATOM 948 CB ILE A 60 -6.193 -17.200 6.138 1.00 0.00 C ATOM 949 CG1 ILE A 60 -6.075 -17.110 7.678 1.00 0.00 C ATOM 950 CG2 ILE A 60 -6.183 -15.794 5.524 1.00 0.00 C ATOM 951 CD1 ILE A 60 -6.968 -16.070 8.375 1.00 0.00 C ATOM 0 H ILE A 60 -6.143 -19.653 6.316 1.00 0.00 H new ATOM 0 HA ILE A 60 -8.254 -17.636 6.207 1.00 0.00 H new ATOM 0 HB ILE A 60 -5.319 -17.715 5.739 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -6.304 -18.091 8.096 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -5.037 -16.891 7.928 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.309 -15.248 5.880 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.145 -15.872 4.437 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.088 -15.262 5.818 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -6.794 -16.104 9.451 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -6.729 -15.075 8.000 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -8.015 -16.293 8.169 1.00 0.00 H new ATOM 963 N HIS A 61 -8.896 -17.831 3.813 1.00 0.00 N ATOM 964 CA HIS A 61 -9.303 -17.782 2.417 1.00 0.00 C ATOM 965 C HIS A 61 -8.927 -16.446 1.802 1.00 0.00 C ATOM 966 O HIS A 61 -8.739 -16.332 0.591 1.00 0.00 O ATOM 967 CB HIS A 61 -10.812 -17.989 2.330 1.00 0.00 C ATOM 968 CG HIS A 61 -11.326 -18.073 0.915 1.00 0.00 C ATOM 969 ND1 HIS A 61 -11.785 -17.018 0.154 1.00 0.00 N ATOM 970 CD2 HIS A 61 -11.357 -19.197 0.133 1.00 0.00 C ATOM 971 CE1 HIS A 61 -12.081 -17.501 -1.065 1.00 0.00 C ATOM 972 NE2 HIS A 61 -11.833 -18.818 -1.124 1.00 0.00 N ATOM 0 H HIS A 61 -9.652 -17.630 4.467 1.00 0.00 H new ATOM 0 HA HIS A 61 -8.791 -18.570 1.865 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -11.076 -18.904 2.859 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -11.314 -17.168 2.842 1.00 0.00 H new ATOM 0 HD1 HIS A 61 -11.882 -16.050 0.460 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -11.067 -20.193 0.433 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -12.465 -16.911 -1.884 1.00 0.00 H new ATOM 980 N SER A 62 -8.886 -15.407 2.622 1.00 0.00 N ATOM 981 CA SER A 62 -8.645 -14.045 2.194 1.00 0.00 C ATOM 982 C SER A 62 -8.168 -13.227 3.384 1.00 0.00 C ATOM 983 O SER A 62 -8.300 -13.682 4.519 1.00 0.00 O ATOM 984 CB SER A 62 -9.968 -13.441 1.682 1.00 0.00 C ATOM 985 OG SER A 62 -10.606 -14.265 0.713 1.00 0.00 O ATOM 0 H SER A 62 -9.023 -15.494 3.629 1.00 0.00 H new ATOM 0 HA SER A 62 -7.893 -14.033 1.405 1.00 0.00 H new ATOM 0 HB2 SER A 62 -10.643 -13.287 2.524 1.00 0.00 H new ATOM 0 HB3 SER A 62 -9.772 -12.461 1.248 1.00 0.00 H new ATOM 0 HG SER A 62 -10.515 -13.857 -0.174 1.00 0.00 H new ATOM 991 N MET A 63 -7.619 -12.046 3.122 1.00 0.00 N ATOM 992 CA MET A 63 -7.239 -11.069 4.125 1.00 0.00 C ATOM 993 C MET A 63 -7.926 -9.768 3.754 1.00 0.00 C ATOM 994 O MET A 63 -8.290 -9.558 2.594 1.00 0.00 O ATOM 995 CB MET A 63 -5.723 -10.874 4.251 1.00 0.00 C ATOM 996 CG MET A 63 -5.056 -12.031 5.001 1.00 0.00 C ATOM 997 SD MET A 63 -3.260 -12.168 4.807 1.00 0.00 S ATOM 998 CE MET A 63 -2.657 -10.567 5.390 1.00 0.00 C ATOM 0 H MET A 63 -7.421 -11.736 2.171 1.00 0.00 H new ATOM 0 HA MET A 63 -7.553 -11.426 5.106 1.00 0.00 H new ATOM 0 HB2 MET A 63 -5.285 -10.786 3.257 1.00 0.00 H new ATOM 0 HB3 MET A 63 -5.520 -9.939 4.773 1.00 0.00 H new ATOM 0 HG2 MET A 63 -5.281 -11.928 6.063 1.00 0.00 H new ATOM 0 HG3 MET A 63 -5.510 -12.964 4.668 1.00 0.00 H new ATOM 0 HE1 MET A 63 -1.570 -10.539 5.316 1.00 0.00 H new ATOM 0 HE2 MET A 63 -3.083 -9.773 4.777 1.00 0.00 H new ATOM 0 HE3 MET A 63 -2.954 -10.423 6.429 1.00 0.00 H new ATOM 1008 N ASN A 64 -8.038 -8.889 4.739 1.00 0.00 N ATOM 1009 CA ASN A 64 -8.601 -7.561 4.596 1.00 0.00 C ATOM 1010 C ASN A 64 -7.498 -6.542 4.758 1.00 0.00 C ATOM 1011 O ASN A 64 -6.710 -6.620 5.699 1.00 0.00 O ATOM 1012 CB ASN A 64 -9.577 -7.207 5.728 1.00 0.00 C ATOM 1013 CG ASN A 64 -10.992 -7.729 5.632 1.00 0.00 C ATOM 1014 OD1 ASN A 64 -11.364 -8.476 4.733 1.00 0.00 O ATOM 1015 ND2 ASN A 64 -11.814 -7.285 6.567 1.00 0.00 N ATOM 0 H ASN A 64 -7.728 -9.090 5.690 1.00 0.00 H new ATOM 0 HA ASN A 64 -9.098 -7.550 3.626 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -9.150 -7.569 6.663 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -9.626 -6.120 5.800 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -12.795 -7.563 6.557 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -11.467 -6.665 7.299 1.00 0.00 H new ATOM 1022 N PHE A 65 -7.489 -5.576 3.862 1.00 0.00 N ATOM 1023 CA PHE A 65 -6.656 -4.392 3.840 1.00 0.00 C ATOM 1024 C PHE A 65 -7.673 -3.249 3.869 1.00 0.00 C ATOM 1025 O PHE A 65 -8.868 -3.470 3.665 1.00 0.00 O ATOM 1026 CB PHE A 65 -5.748 -4.348 2.604 1.00 0.00 C ATOM 1027 CG PHE A 65 -4.480 -5.172 2.691 1.00 0.00 C ATOM 1028 CD1 PHE A 65 -4.527 -6.579 2.750 1.00 0.00 C ATOM 1029 CD2 PHE A 65 -3.233 -4.517 2.682 1.00 0.00 C ATOM 1030 CE1 PHE A 65 -3.335 -7.320 2.843 1.00 0.00 C ATOM 1031 CE2 PHE A 65 -2.044 -5.258 2.750 1.00 0.00 C ATOM 1032 CZ PHE A 65 -2.097 -6.654 2.860 1.00 0.00 C ATOM 0 H PHE A 65 -8.120 -5.603 3.061 1.00 0.00 H new ATOM 0 HA PHE A 65 -5.955 -4.346 4.674 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -6.322 -4.688 1.742 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -5.473 -3.310 2.415 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -5.479 -7.089 2.724 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -3.192 -3.439 2.622 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -3.371 -8.398 2.901 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -1.090 -4.754 2.718 1.00 0.00 H new ATOM 0 HZ PHE A 65 -1.183 -7.221 2.958 1.00 0.00 H new ATOM 1042 N THR A 66 -7.259 -2.026 4.145 1.00 0.00 N ATOM 1043 CA THR A 66 -8.143 -0.874 4.193 1.00 0.00 C ATOM 1044 C THR A 66 -7.349 0.347 3.773 1.00 0.00 C ATOM 1045 O THR A 66 -6.216 0.514 4.205 1.00 0.00 O ATOM 1046 CB THR A 66 -8.702 -0.739 5.614 1.00 0.00 C ATOM 1047 OG1 THR A 66 -9.685 -1.733 5.830 1.00 0.00 O ATOM 1048 CG2 THR A 66 -9.346 0.624 5.852 1.00 0.00 C ATOM 0 H THR A 66 -6.285 -1.801 4.345 1.00 0.00 H new ATOM 0 HA THR A 66 -8.988 -0.985 3.514 1.00 0.00 H new ATOM 0 HB THR A 66 -7.865 -0.853 6.302 1.00 0.00 H new ATOM 0 HG1 THR A 66 -9.651 -2.390 5.103 1.00 0.00 H new ATOM 0 HG21 THR A 66 -9.728 0.673 6.872 1.00 0.00 H new ATOM 0 HG22 THR A 66 -8.603 1.408 5.704 1.00 0.00 H new ATOM 0 HG23 THR A 66 -10.168 0.766 5.150 1.00 0.00 H new ATOM 1056 N TRP A 67 -7.922 1.222 2.955 1.00 0.00 N ATOM 1057 CA TRP A 67 -7.221 2.423 2.522 1.00 0.00 C ATOM 1058 C TRP A 67 -8.191 3.573 2.293 1.00 0.00 C ATOM 1059 O TRP A 67 -9.409 3.343 2.248 1.00 0.00 O ATOM 1060 CB TRP A 67 -6.374 2.070 1.290 1.00 0.00 C ATOM 1061 CG TRP A 67 -7.045 1.617 0.025 1.00 0.00 C ATOM 1062 CD1 TRP A 67 -8.368 1.413 -0.187 1.00 0.00 C ATOM 1063 CD2 TRP A 67 -6.381 1.225 -1.213 1.00 0.00 C ATOM 1064 NE1 TRP A 67 -8.562 0.934 -1.467 1.00 0.00 N ATOM 1065 CE2 TRP A 67 -7.365 0.727 -2.118 1.00 0.00 C ATOM 1066 CE3 TRP A 67 -5.035 1.202 -1.637 1.00 0.00 C ATOM 1067 CZ2 TRP A 67 -7.027 0.146 -3.350 1.00 0.00 C ATOM 1068 CZ3 TRP A 67 -4.683 0.631 -2.877 1.00 0.00 C ATOM 1069 CH2 TRP A 67 -5.672 0.092 -3.721 1.00 0.00 C ATOM 0 H TRP A 67 -8.865 1.123 2.580 1.00 0.00 H new ATOM 0 HA TRP A 67 -6.546 2.778 3.301 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -5.777 2.948 1.044 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -5.679 1.285 1.588 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -9.150 1.597 0.535 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -9.478 0.755 -1.880 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -4.268 1.626 -1.006 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -7.792 -0.252 -4.000 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -3.647 0.607 -3.181 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -5.389 -0.365 -4.658 1.00 0.00 H new ATOM 1080 N GLN A 68 -7.668 4.800 2.183 1.00 0.00 N ATOM 1081 CA GLN A 68 -8.463 5.968 1.838 1.00 0.00 C ATOM 1082 C GLN A 68 -7.623 7.161 1.348 1.00 0.00 C ATOM 1083 O GLN A 68 -6.493 7.335 1.818 1.00 0.00 O ATOM 1084 CB GLN A 68 -9.347 6.383 3.035 1.00 0.00 C ATOM 1085 CG GLN A 68 -8.585 6.812 4.298 1.00 0.00 C ATOM 1086 CD GLN A 68 -8.617 8.319 4.545 1.00 0.00 C ATOM 1087 OE1 GLN A 68 -8.580 9.130 3.632 1.00 0.00 O ATOM 1088 NE2 GLN A 68 -8.717 8.731 5.796 1.00 0.00 N ATOM 0 H GLN A 68 -6.680 5.003 2.332 1.00 0.00 H new ATOM 0 HA GLN A 68 -9.093 5.676 0.998 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -9.990 7.205 2.722 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -9.999 5.548 3.290 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -9.011 6.301 5.161 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -7.548 6.487 4.215 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -8.748 8.051 6.556 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -8.764 9.729 6.002 1.00 0.00 H new ATOM 1097 N ALA A 69 -8.140 7.958 0.394 1.00 0.00 N ATOM 1098 CA ALA A 69 -7.480 9.196 -0.031 1.00 0.00 C ATOM 1099 C ALA A 69 -8.038 10.346 0.822 1.00 0.00 C ATOM 1100 O ALA A 69 -9.242 10.438 1.018 1.00 0.00 O ATOM 1101 CB ALA A 69 -7.738 9.455 -1.515 1.00 0.00 C ATOM 0 H ALA A 69 -9.014 7.762 -0.094 1.00 0.00 H new ATOM 0 HA ALA A 69 -6.402 9.116 0.107 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -7.241 10.378 -1.815 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -7.347 8.625 -2.103 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -8.810 9.548 -1.687 1.00 0.00 H new ATOM 1107 N ALA A 70 -7.222 11.301 1.253 1.00 0.00 N ATOM 1108 CA ALA A 70 -7.596 12.367 2.174 1.00 0.00 C ATOM 1109 C ALA A 70 -8.603 13.408 1.643 1.00 0.00 C ATOM 1110 O ALA A 70 -8.270 14.523 1.254 1.00 0.00 O ATOM 1111 CB ALA A 70 -6.334 13.036 2.696 1.00 0.00 C ATOM 0 H ALA A 70 -6.247 11.356 0.960 1.00 0.00 H new ATOM 0 HA ALA A 70 -8.147 11.880 2.978 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -6.605 13.835 3.386 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -5.720 12.300 3.216 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -5.771 13.453 1.861 1.00 0.00 H new ATOM 1117 N GLY A 71 -9.870 13.022 1.631 1.00 0.00 N ATOM 1118 CA GLY A 71 -11.038 13.848 1.313 1.00 0.00 C ATOM 1119 C GLY A 71 -11.164 14.373 -0.119 1.00 0.00 C ATOM 1120 O GLY A 71 -12.121 13.980 -0.773 1.00 0.00 O ATOM 0 H GLY A 71 -10.133 12.063 1.857 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -11.932 13.267 1.538 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -11.037 14.705 1.987 1.00 0.00 H new ATOM 1124 N GLN A 72 -10.361 15.358 -0.531 1.00 0.00 N ATOM 1125 CA GLN A 72 -10.273 15.880 -1.907 1.00 0.00 C ATOM 1126 C GLN A 72 -8.883 15.660 -2.526 1.00 0.00 C ATOM 1127 O GLN A 72 -8.383 16.465 -3.309 1.00 0.00 O ATOM 1128 CB GLN A 72 -10.819 17.313 -2.006 1.00 0.00 C ATOM 1129 CG GLN A 72 -12.356 17.328 -2.090 1.00 0.00 C ATOM 1130 CD GLN A 72 -12.945 17.067 -3.488 1.00 0.00 C ATOM 1131 OE1 GLN A 72 -12.358 16.220 -4.324 1.00 0.00 O flip ATOM 1132 NE2 GLN A 72 -13.983 17.640 -3.811 1.00 0.00 N flip ATOM 0 H GLN A 72 -9.726 15.837 0.108 1.00 0.00 H new ATOM 0 HA GLN A 72 -10.936 15.290 -2.539 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -10.496 17.887 -1.138 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -10.401 17.803 -2.886 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -12.747 16.577 -1.404 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -12.712 18.297 -1.740 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -14.429 18.290 -3.164 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -14.398 17.466 -4.726 1.00 0.00 H new ATOM 1141 N ALA A 73 -8.201 14.634 -2.037 1.00 0.00 N ATOM 1142 CA ALA A 73 -6.834 14.261 -2.340 1.00 0.00 C ATOM 1143 C ALA A 73 -6.786 13.083 -3.312 1.00 0.00 C ATOM 1144 O ALA A 73 -6.054 12.143 -3.033 1.00 0.00 O ATOM 1145 CB ALA A 73 -6.108 13.966 -1.028 1.00 0.00 C ATOM 0 H ALA A 73 -8.626 13.994 -1.366 1.00 0.00 H new ATOM 0 HA ALA A 73 -6.325 15.084 -2.842 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -5.077 13.683 -1.239 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.119 14.855 -0.398 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -6.610 13.148 -0.510 1.00 0.00 H new ATOM 1151 N GLU A 74 -7.687 12.996 -4.293 1.00 0.00 N ATOM 1152 CA GLU A 74 -7.831 11.859 -5.200 1.00 0.00 C ATOM 1153 C GLU A 74 -6.466 11.266 -5.614 1.00 0.00 C ATOM 1154 O GLU A 74 -5.699 11.878 -6.358 1.00 0.00 O ATOM 1155 CB GLU A 74 -8.631 12.303 -6.443 1.00 0.00 C ATOM 1156 CG GLU A 74 -10.158 12.410 -6.267 1.00 0.00 C ATOM 1157 CD GLU A 74 -10.673 13.748 -5.700 1.00 0.00 C ATOM 1158 OE1 GLU A 74 -10.204 14.180 -4.619 1.00 0.00 O ATOM 1159 OE2 GLU A 74 -11.561 14.351 -6.344 1.00 0.00 O ATOM 0 H GLU A 74 -8.358 13.741 -4.483 1.00 0.00 H new ATOM 0 HA GLU A 74 -8.368 11.069 -4.675 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.254 13.274 -6.764 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.428 11.600 -7.250 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -10.630 12.241 -7.235 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.487 11.607 -5.608 1.00 0.00 H new ATOM 1166 N TYR A 75 -6.209 10.027 -5.171 1.00 0.00 N ATOM 1167 CA TYR A 75 -5.042 9.218 -5.505 1.00 0.00 C ATOM 1168 C TYR A 75 -5.572 8.032 -6.302 1.00 0.00 C ATOM 1169 O TYR A 75 -6.436 7.291 -5.825 1.00 0.00 O ATOM 1170 CB TYR A 75 -4.267 8.763 -4.248 1.00 0.00 C ATOM 1171 CG TYR A 75 -3.324 9.801 -3.655 1.00 0.00 C ATOM 1172 CD1 TYR A 75 -2.054 10.008 -4.226 1.00 0.00 C ATOM 1173 CD2 TYR A 75 -3.700 10.555 -2.528 1.00 0.00 C ATOM 1174 CE1 TYR A 75 -1.175 10.963 -3.680 1.00 0.00 C ATOM 1175 CE2 TYR A 75 -2.842 11.538 -1.997 1.00 0.00 C ATOM 1176 CZ TYR A 75 -1.568 11.742 -2.570 1.00 0.00 C ATOM 1177 OH TYR A 75 -0.708 12.669 -2.060 1.00 0.00 O ATOM 0 H TYR A 75 -6.846 9.543 -4.538 1.00 0.00 H new ATOM 0 HA TYR A 75 -4.322 9.796 -6.084 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -4.987 8.471 -3.483 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -3.690 7.873 -4.499 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -1.752 9.431 -5.088 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -4.659 10.378 -2.064 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -0.195 11.100 -4.113 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -3.158 12.134 -1.154 1.00 0.00 H new ATOM 0 HH TYR A 75 -0.133 13.011 -2.776 1.00 0.00 H new ATOM 1187 N PHE A 76 -5.110 7.888 -7.537 1.00 0.00 N ATOM 1188 CA PHE A 76 -5.464 6.797 -8.429 1.00 0.00 C ATOM 1189 C PHE A 76 -4.517 5.651 -8.059 1.00 0.00 C ATOM 1190 O PHE A 76 -3.398 5.918 -7.617 1.00 0.00 O ATOM 1191 CB PHE A 76 -5.212 7.273 -9.870 1.00 0.00 C ATOM 1192 CG PHE A 76 -5.977 6.532 -10.943 1.00 0.00 C ATOM 1193 CD1 PHE A 76 -5.627 5.239 -11.363 1.00 0.00 C ATOM 1194 CD2 PHE A 76 -7.089 7.171 -11.525 1.00 0.00 C ATOM 1195 CE1 PHE A 76 -6.393 4.588 -12.339 1.00 0.00 C ATOM 1196 CE2 PHE A 76 -7.860 6.520 -12.499 1.00 0.00 C ATOM 1197 CZ PHE A 76 -7.522 5.213 -12.893 1.00 0.00 C ATOM 0 H PHE A 76 -4.458 8.550 -7.957 1.00 0.00 H new ATOM 0 HA PHE A 76 -6.504 6.480 -8.347 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -5.464 8.332 -9.934 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.146 7.186 -10.082 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -4.767 4.746 -10.934 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -7.351 8.173 -11.218 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -6.113 3.598 -12.668 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.708 7.019 -12.944 1.00 0.00 H new ATOM 0 HZ PHE A 76 -8.128 4.692 -13.619 1.00 0.00 H new ATOM 1207 N TYR A 77 -4.893 4.391 -8.261 1.00 0.00 N ATOM 1208 CA TYR A 77 -4.002 3.255 -8.041 1.00 0.00 C ATOM 1209 C TYR A 77 -4.088 2.270 -9.203 1.00 0.00 C ATOM 1210 O TYR A 77 -5.082 2.254 -9.934 1.00 0.00 O ATOM 1211 CB TYR A 77 -4.358 2.539 -6.719 1.00 0.00 C ATOM 1212 CG TYR A 77 -5.582 1.629 -6.789 1.00 0.00 C ATOM 1213 CD1 TYR A 77 -5.471 0.353 -7.377 1.00 0.00 C ATOM 1214 CD2 TYR A 77 -6.834 2.057 -6.306 1.00 0.00 C ATOM 1215 CE1 TYR A 77 -6.605 -0.447 -7.565 1.00 0.00 C ATOM 1216 CE2 TYR A 77 -7.965 1.221 -6.418 1.00 0.00 C ATOM 1217 CZ TYR A 77 -7.851 -0.035 -7.060 1.00 0.00 C ATOM 1218 OH TYR A 77 -8.921 -0.866 -7.179 1.00 0.00 O ATOM 0 H TYR A 77 -5.825 4.128 -8.582 1.00 0.00 H new ATOM 0 HA TYR A 77 -2.981 3.632 -7.977 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -3.500 1.946 -6.402 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -4.527 3.292 -5.949 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -4.502 -0.011 -7.686 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -6.929 3.030 -5.848 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -6.522 -1.382 -8.099 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -8.915 1.539 -6.015 1.00 0.00 H new ATOM 0 HH TYR A 77 -8.696 -1.605 -7.782 1.00 0.00 H new ATOM 1228 N GLU A 78 -3.074 1.415 -9.338 1.00 0.00 N ATOM 1229 CA GLU A 78 -3.067 0.327 -10.298 1.00 0.00 C ATOM 1230 C GLU A 78 -2.142 -0.751 -9.752 1.00 0.00 C ATOM 1231 O GLU A 78 -1.093 -0.454 -9.183 1.00 0.00 O ATOM 1232 CB GLU A 78 -2.726 0.803 -11.724 1.00 0.00 C ATOM 1233 CG GLU A 78 -2.682 -0.375 -12.713 1.00 0.00 C ATOM 1234 CD GLU A 78 -2.690 0.074 -14.178 1.00 0.00 C ATOM 1235 OE1 GLU A 78 -1.586 0.274 -14.731 1.00 0.00 O ATOM 1236 OE2 GLU A 78 -3.804 0.176 -14.743 1.00 0.00 O ATOM 0 H GLU A 78 -2.226 1.465 -8.773 1.00 0.00 H new ATOM 0 HA GLU A 78 -4.065 -0.097 -10.413 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -3.468 1.530 -12.054 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.762 1.312 -11.719 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.786 -0.967 -12.525 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -3.538 -1.026 -12.533 1.00 0.00 H new ATOM 1243 N PHE A 79 -2.582 -2.004 -9.817 1.00 0.00 N ATOM 1244 CA PHE A 79 -1.823 -3.152 -9.360 1.00 0.00 C ATOM 1245 C PHE A 79 -0.822 -3.511 -10.456 1.00 0.00 C ATOM 1246 O PHE A 79 -1.183 -4.143 -11.448 1.00 0.00 O ATOM 1247 CB PHE A 79 -2.772 -4.327 -9.044 1.00 0.00 C ATOM 1248 CG PHE A 79 -3.586 -4.221 -7.760 1.00 0.00 C ATOM 1249 CD1 PHE A 79 -4.831 -3.568 -7.753 1.00 0.00 C ATOM 1250 CD2 PHE A 79 -3.129 -4.812 -6.567 1.00 0.00 C ATOM 1251 CE1 PHE A 79 -5.598 -3.486 -6.579 1.00 0.00 C ATOM 1252 CE2 PHE A 79 -3.878 -4.698 -5.378 1.00 0.00 C ATOM 1253 CZ PHE A 79 -5.113 -4.026 -5.383 1.00 0.00 C ATOM 0 H PHE A 79 -3.496 -2.249 -10.198 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.286 -2.924 -8.439 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -3.465 -4.439 -9.878 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.179 -5.240 -8.997 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -5.203 -3.123 -8.664 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -2.197 -5.357 -6.562 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -6.565 -3.005 -6.600 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -3.502 -5.128 -4.461 1.00 0.00 H new ATOM 0 HZ PHE A 79 -5.683 -3.927 -4.471 1.00 0.00 H new ATOM 1263 N LEU A 80 0.447 -3.153 -10.241 1.00 0.00 N ATOM 1264 CA LEU A 80 1.570 -3.513 -11.099 1.00 0.00 C ATOM 1265 C LEU A 80 1.671 -5.041 -11.101 1.00 0.00 C ATOM 1266 O LEU A 80 1.931 -5.668 -12.129 1.00 0.00 O ATOM 1267 CB LEU A 80 2.852 -2.856 -10.536 1.00 0.00 C ATOM 1268 CG LEU A 80 4.018 -2.683 -11.530 1.00 0.00 C ATOM 1269 CD1 LEU A 80 5.185 -1.971 -10.836 1.00 0.00 C ATOM 1270 CD2 LEU A 80 4.547 -3.994 -12.118 1.00 0.00 C ATOM 0 H LEU A 80 0.726 -2.587 -9.439 1.00 0.00 H new ATOM 0 HA LEU A 80 1.436 -3.162 -12.122 1.00 0.00 H new ATOM 0 HB2 LEU A 80 2.589 -1.875 -10.141 1.00 0.00 H new ATOM 0 HB3 LEU A 80 3.204 -3.454 -9.696 1.00 0.00 H new ATOM 0 HG LEU A 80 3.612 -2.099 -12.356 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.008 -1.850 -11.540 1.00 0.00 H new ATOM 0 HD12 LEU A 80 4.858 -0.991 -10.488 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.520 -2.565 -9.986 1.00 0.00 H new ATOM 0 HD21 LEU A 80 5.365 -3.780 -12.806 1.00 0.00 H new ATOM 0 HD22 LEU A 80 4.908 -4.634 -11.313 1.00 0.00 H new ATOM 0 HD23 LEU A 80 3.745 -4.502 -12.654 1.00 0.00 H new ATOM 1282 N SER A 81 1.484 -5.674 -9.941 1.00 0.00 N ATOM 1283 CA SER A 81 1.503 -7.112 -9.803 1.00 0.00 C ATOM 1284 C SER A 81 0.717 -7.592 -8.588 1.00 0.00 C ATOM 1285 O SER A 81 0.683 -6.956 -7.539 1.00 0.00 O ATOM 1286 CB SER A 81 2.968 -7.550 -9.726 1.00 0.00 C ATOM 1287 OG SER A 81 3.507 -7.617 -11.038 1.00 0.00 O ATOM 0 H SER A 81 1.313 -5.184 -9.063 1.00 0.00 H new ATOM 0 HA SER A 81 1.012 -7.564 -10.665 1.00 0.00 H new ATOM 0 HB2 SER A 81 3.539 -6.845 -9.121 1.00 0.00 H new ATOM 0 HB3 SER A 81 3.044 -8.522 -9.239 1.00 0.00 H new ATOM 0 HG SER A 81 3.010 -7.011 -11.627 1.00 0.00 H new ATOM 1293 N LEU A 82 0.088 -8.754 -8.748 1.00 0.00 N ATOM 1294 CA LEU A 82 -0.617 -9.512 -7.730 1.00 0.00 C ATOM 1295 C LEU A 82 -0.525 -10.963 -8.234 1.00 0.00 C ATOM 1296 O LEU A 82 -1.292 -11.321 -9.124 1.00 0.00 O ATOM 1297 CB LEU A 82 -2.079 -8.997 -7.639 1.00 0.00 C ATOM 1298 CG LEU A 82 -2.849 -9.294 -6.333 1.00 0.00 C ATOM 1299 CD1 LEU A 82 -2.308 -10.442 -5.492 1.00 0.00 C ATOM 1300 CD2 LEU A 82 -2.949 -8.027 -5.486 1.00 0.00 C ATOM 0 H LEU A 82 0.058 -9.218 -9.656 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.206 -9.420 -6.725 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -2.067 -7.917 -7.787 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -2.641 -9.426 -8.468 1.00 0.00 H new ATOM 0 HG LEU A 82 -3.834 -9.628 -6.660 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -2.924 -10.562 -4.601 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -2.331 -11.363 -6.075 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -1.281 -10.225 -5.197 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.493 -8.246 -4.567 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.948 -7.674 -5.239 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -3.478 -7.256 -6.046 1.00 0.00 H new ATOM 1312 N ARG A 83 0.465 -11.779 -7.826 1.00 0.00 N ATOM 1313 CA ARG A 83 0.587 -13.167 -8.341 1.00 0.00 C ATOM 1314 C ARG A 83 1.361 -14.058 -7.372 1.00 0.00 C ATOM 1315 O ARG A 83 2.091 -13.527 -6.534 1.00 0.00 O ATOM 1316 CB ARG A 83 1.338 -13.301 -9.695 1.00 0.00 C ATOM 1317 CG ARG A 83 0.936 -12.500 -10.949 1.00 0.00 C ATOM 1318 CD ARG A 83 1.393 -11.032 -11.035 1.00 0.00 C ATOM 1319 NE ARG A 83 2.852 -10.833 -11.174 1.00 0.00 N ATOM 1320 CZ ARG A 83 3.764 -10.758 -10.191 1.00 0.00 C ATOM 1321 NH1 ARG A 83 3.456 -11.050 -8.937 1.00 0.00 N ATOM 1322 NH2 ARG A 83 5.004 -10.361 -10.432 1.00 0.00 N ATOM 0 H ARG A 83 1.184 -11.513 -7.153 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.452 -13.470 -8.467 1.00 0.00 H new ATOM 0 HB2 ARG A 83 2.383 -13.065 -9.496 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.296 -14.355 -9.972 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.325 -13.025 -11.822 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -0.151 -12.518 -11.025 1.00 0.00 H new ATOM 0 HD2 ARG A 83 0.896 -10.563 -11.884 1.00 0.00 H new ATOM 0 HD3 ARG A 83 1.055 -10.510 -10.140 1.00 0.00 H new ATOM 0 HE ARG A 83 3.206 -10.742 -12.126 1.00 0.00 H new ATOM 0 HH11 ARG A 83 2.507 -11.340 -8.699 1.00 0.00 H new ATOM 0 HH12 ARG A 83 4.167 -10.985 -8.209 1.00 0.00 H new ATOM 0 HH21 ARG A 83 5.282 -10.105 -11.379 1.00 0.00 H new ATOM 0 HH22 ARG A 83 5.681 -10.311 -9.670 1.00 0.00 H new ATOM 1336 N SER A 84 1.238 -15.386 -7.497 1.00 0.00 N ATOM 1337 CA SER A 84 2.043 -16.313 -6.716 1.00 0.00 C ATOM 1338 C SER A 84 3.413 -16.469 -7.370 1.00 0.00 C ATOM 1339 O SER A 84 3.603 -16.154 -8.546 1.00 0.00 O ATOM 1340 CB SER A 84 1.333 -17.659 -6.552 1.00 0.00 C ATOM 1341 OG SER A 84 2.026 -18.553 -5.694 1.00 0.00 O ATOM 0 H SER A 84 0.584 -15.837 -8.137 1.00 0.00 H new ATOM 0 HA SER A 84 2.183 -15.910 -5.713 1.00 0.00 H new ATOM 0 HB2 SER A 84 0.331 -17.489 -6.157 1.00 0.00 H new ATOM 0 HB3 SER A 84 1.215 -18.123 -7.531 1.00 0.00 H new ATOM 0 HG SER A 84 2.517 -18.042 -5.017 1.00 0.00 H new ATOM 1347 N LEU A 85 4.349 -16.994 -6.582 1.00 0.00 N ATOM 1348 CA LEU A 85 5.693 -17.359 -6.981 1.00 0.00 C ATOM 1349 C LEU A 85 5.913 -18.862 -6.838 1.00 0.00 C ATOM 1350 O LEU A 85 6.900 -19.345 -7.389 1.00 0.00 O ATOM 1351 CB LEU A 85 6.732 -16.625 -6.120 1.00 0.00 C ATOM 1352 CG LEU A 85 6.673 -15.091 -6.182 1.00 0.00 C ATOM 1353 CD1 LEU A 85 7.819 -14.535 -5.334 1.00 0.00 C ATOM 1354 CD2 LEU A 85 6.781 -14.555 -7.613 1.00 0.00 C ATOM 0 H LEU A 85 4.173 -17.184 -5.595 1.00 0.00 H new ATOM 0 HA LEU A 85 5.813 -17.072 -8.026 1.00 0.00 H new ATOM 0 HB2 LEU A 85 6.604 -16.935 -5.083 1.00 0.00 H new ATOM 0 HB3 LEU A 85 7.727 -16.946 -6.428 1.00 0.00 H new ATOM 0 HG LEU A 85 5.705 -14.769 -5.799 1.00 0.00 H new ATOM 0 HD11 LEU A 85 7.798 -13.446 -5.363 1.00 0.00 H new ATOM 0 HD12 LEU A 85 7.707 -14.873 -4.304 1.00 0.00 H new ATOM 0 HD13 LEU A 85 8.770 -14.890 -5.730 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.734 -13.466 -7.598 1.00 0.00 H new ATOM 0 HD22 LEU A 85 7.728 -14.871 -8.049 1.00 0.00 H new ATOM 0 HD23 LEU A 85 5.958 -14.946 -8.211 1.00 0.00 H new ATOM 1366 N ASP A 86 5.051 -19.607 -6.121 1.00 0.00 N ATOM 1367 CA ASP A 86 5.213 -21.058 -6.079 1.00 0.00 C ATOM 1368 C ASP A 86 4.266 -21.624 -7.145 1.00 0.00 C ATOM 1369 O ASP A 86 3.342 -20.953 -7.625 1.00 0.00 O ATOM 1370 CB ASP A 86 4.900 -21.711 -4.720 1.00 0.00 C ATOM 1371 CG ASP A 86 5.612 -23.059 -4.653 1.00 0.00 C ATOM 1372 OD1 ASP A 86 6.772 -23.067 -4.208 1.00 0.00 O ATOM 1373 OD2 ASP A 86 5.046 -24.057 -5.140 1.00 0.00 O ATOM 0 H ASP A 86 4.266 -19.239 -5.584 1.00 0.00 H new ATOM 0 HA ASP A 86 6.264 -21.284 -6.258 1.00 0.00 H new ATOM 0 HB2 ASP A 86 5.231 -21.067 -3.905 1.00 0.00 H new ATOM 0 HB3 ASP A 86 3.825 -21.845 -4.603 1.00 0.00 H new ATOM 1378 N LYS A 87 4.467 -22.881 -7.515 1.00 0.00 N ATOM 1379 CA LYS A 87 3.706 -23.615 -8.507 1.00 0.00 C ATOM 1380 C LYS A 87 3.408 -25.052 -8.095 1.00 0.00 C ATOM 1381 O LYS A 87 2.425 -25.645 -8.514 1.00 0.00 O ATOM 1382 CB LYS A 87 4.470 -23.532 -9.806 1.00 0.00 C ATOM 1383 CG LYS A 87 4.189 -22.188 -10.529 1.00 0.00 C ATOM 1384 CD LYS A 87 2.721 -21.892 -10.951 1.00 0.00 C ATOM 1385 CE LYS A 87 2.256 -20.422 -10.762 1.00 0.00 C ATOM 1386 NZ LYS A 87 1.419 -20.164 -9.556 1.00 0.00 N ATOM 0 H LYS A 87 5.210 -23.446 -7.104 1.00 0.00 H new ATOM 0 HA LYS A 87 2.720 -23.165 -8.618 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.538 -23.628 -9.611 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.188 -24.363 -10.452 1.00 0.00 H new ATOM 0 HG2 LYS A 87 4.521 -21.380 -9.877 1.00 0.00 H new ATOM 0 HG3 LYS A 87 4.810 -22.151 -11.424 1.00 0.00 H new ATOM 0 HD2 LYS A 87 2.602 -22.161 -12.001 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.059 -22.541 -10.378 1.00 0.00 H new ATOM 0 HE2 LYS A 87 3.138 -19.784 -10.714 1.00 0.00 H new ATOM 0 HE3 LYS A 87 1.692 -20.121 -11.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 1.359 -19.139 -9.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 0.464 -20.547 -9.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 1.849 -20.626 -8.729 1.00 0.00 H new ATOM 1400 N GLY A 88 4.316 -25.640 -7.355 1.00 0.00 N ATOM 1401 CA GLY A 88 4.140 -26.948 -6.744 1.00 0.00 C ATOM 1402 C GLY A 88 2.991 -26.813 -5.727 1.00 0.00 C ATOM 1403 O GLY A 88 1.924 -27.381 -5.924 1.00 0.00 O ATOM 0 H GLY A 88 5.222 -25.218 -7.152 1.00 0.00 H new ATOM 0 HA2 GLY A 88 3.903 -27.698 -7.498 1.00 0.00 H new ATOM 0 HA3 GLY A 88 5.057 -27.271 -6.251 1.00 0.00 H new ATOM 1407 N ILE A 89 3.176 -25.991 -4.686 1.00 0.00 N ATOM 1408 CA ILE A 89 2.231 -25.594 -3.625 1.00 0.00 C ATOM 1409 C ILE A 89 1.227 -24.544 -4.167 1.00 0.00 C ATOM 1410 O ILE A 89 0.588 -23.812 -3.419 1.00 0.00 O ATOM 1411 CB ILE A 89 3.025 -25.103 -2.369 1.00 0.00 C ATOM 1412 CG1 ILE A 89 4.059 -26.109 -1.820 1.00 0.00 C ATOM 1413 CG2 ILE A 89 2.113 -24.776 -1.167 1.00 0.00 C ATOM 1414 CD1 ILE A 89 5.417 -26.027 -2.498 1.00 0.00 C ATOM 0 H ILE A 89 4.081 -25.540 -4.549 1.00 0.00 H new ATOM 0 HA ILE A 89 1.637 -26.451 -3.309 1.00 0.00 H new ATOM 0 HB ILE A 89 3.528 -24.218 -2.759 1.00 0.00 H new ATOM 0 HG12 ILE A 89 4.186 -25.937 -0.751 1.00 0.00 H new ATOM 0 HG13 ILE A 89 3.666 -27.119 -1.936 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.723 -24.441 -0.328 1.00 0.00 H new ATOM 0 HG22 ILE A 89 1.414 -23.987 -1.445 1.00 0.00 H new ATOM 0 HG23 ILE A 89 1.557 -25.668 -0.878 1.00 0.00 H new ATOM 0 HD11 ILE A 89 6.089 -26.764 -2.058 1.00 0.00 H new ATOM 0 HD12 ILE A 89 5.305 -26.229 -3.563 1.00 0.00 H new ATOM 0 HD13 ILE A 89 5.833 -25.029 -2.360 1.00 0.00 H new ATOM 1426 N MET A 90 1.040 -24.485 -5.482 1.00 0.00 N ATOM 1427 CA MET A 90 0.255 -23.494 -6.193 1.00 0.00 C ATOM 1428 C MET A 90 -1.071 -23.178 -5.526 1.00 0.00 C ATOM 1429 O MET A 90 -1.894 -24.008 -5.139 1.00 0.00 O ATOM 1430 CB MET A 90 0.005 -23.911 -7.646 1.00 0.00 C ATOM 1431 CG MET A 90 -0.824 -22.942 -8.499 1.00 0.00 C ATOM 1432 SD MET A 90 -0.687 -23.162 -10.305 1.00 0.00 S ATOM 1433 CE MET A 90 -0.278 -24.923 -10.495 1.00 0.00 C ATOM 0 H MET A 90 1.459 -25.169 -6.112 1.00 0.00 H new ATOM 0 HA MET A 90 0.857 -22.586 -6.170 1.00 0.00 H new ATOM 0 HB2 MET A 90 0.970 -24.054 -8.132 1.00 0.00 H new ATOM 0 HB3 MET A 90 -0.497 -24.879 -7.643 1.00 0.00 H new ATOM 0 HG2 MET A 90 -1.872 -23.045 -8.217 1.00 0.00 H new ATOM 0 HG3 MET A 90 -0.526 -21.923 -8.252 1.00 0.00 H new ATOM 0 HE1 MET A 90 -0.566 -25.258 -11.491 1.00 0.00 H new ATOM 0 HE2 MET A 90 0.794 -25.064 -10.361 1.00 0.00 H new ATOM 0 HE3 MET A 90 -0.817 -25.504 -9.747 1.00 0.00 H new ATOM 1443 N ALA A 91 -1.207 -21.877 -5.478 1.00 0.00 N ATOM 1444 CA ALA A 91 -2.242 -20.983 -5.093 1.00 0.00 C ATOM 1445 C ALA A 91 -1.970 -19.818 -6.011 1.00 0.00 C ATOM 1446 O ALA A 91 -0.817 -19.585 -6.375 1.00 0.00 O ATOM 1447 CB ALA A 91 -2.067 -20.516 -3.639 1.00 0.00 C ATOM 0 H ALA A 91 -0.408 -21.319 -5.778 1.00 0.00 H new ATOM 0 HA ALA A 91 -3.239 -21.419 -5.157 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -2.875 -19.833 -3.376 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -2.091 -21.379 -2.974 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -1.111 -20.004 -3.534 1.00 0.00 H new ATOM 1453 N ASP A 92 -3.000 -19.081 -6.366 1.00 0.00 N ATOM 1454 CA ASP A 92 -2.782 -17.861 -7.140 1.00 0.00 C ATOM 1455 C ASP A 92 -3.735 -16.815 -6.583 1.00 0.00 C ATOM 1456 O ASP A 92 -4.947 -17.014 -6.629 1.00 0.00 O ATOM 1457 CB ASP A 92 -2.791 -18.085 -8.660 1.00 0.00 C ATOM 1458 CG ASP A 92 -1.425 -18.604 -9.168 1.00 0.00 C ATOM 1459 OD1 ASP A 92 -0.447 -17.814 -9.200 1.00 0.00 O ATOM 1460 OD2 ASP A 92 -1.291 -19.800 -9.516 1.00 0.00 O ATOM 0 H ASP A 92 -3.973 -19.289 -6.143 1.00 0.00 H new ATOM 0 HA ASP A 92 -1.768 -17.481 -7.019 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -3.571 -18.801 -8.918 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -3.036 -17.150 -9.165 1.00 0.00 H new ATOM 1465 N PRO A 93 -3.208 -15.746 -5.960 1.00 0.00 N ATOM 1466 CA PRO A 93 -4.016 -14.756 -5.269 1.00 0.00 C ATOM 1467 C PRO A 93 -4.887 -13.930 -6.212 1.00 0.00 C ATOM 1468 O PRO A 93 -4.569 -13.733 -7.385 1.00 0.00 O ATOM 1469 CB PRO A 93 -3.010 -13.866 -4.536 1.00 0.00 C ATOM 1470 CG PRO A 93 -1.811 -13.914 -5.480 1.00 0.00 C ATOM 1471 CD PRO A 93 -1.803 -15.372 -5.894 1.00 0.00 C ATOM 0 HA PRO A 93 -4.722 -15.240 -4.594 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -3.384 -12.851 -4.400 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -2.767 -14.252 -3.546 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -1.935 -13.247 -6.333 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -0.886 -13.625 -4.981 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -1.312 -15.507 -6.858 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -1.264 -15.985 -5.172 1.00 0.00 H new ATOM 1479 N THR A 94 -5.948 -13.370 -5.647 1.00 0.00 N ATOM 1480 CA THR A 94 -6.886 -12.481 -6.311 1.00 0.00 C ATOM 1481 C THR A 94 -7.216 -11.308 -5.386 1.00 0.00 C ATOM 1482 O THR A 94 -6.846 -11.293 -4.212 1.00 0.00 O ATOM 1483 CB THR A 94 -8.139 -13.287 -6.717 1.00 0.00 C ATOM 1484 OG1 THR A 94 -8.694 -13.987 -5.614 1.00 0.00 O ATOM 1485 CG2 THR A 94 -7.841 -14.314 -7.815 1.00 0.00 C ATOM 0 H THR A 94 -6.187 -13.532 -4.669 1.00 0.00 H new ATOM 0 HA THR A 94 -6.452 -12.063 -7.220 1.00 0.00 H new ATOM 0 HB THR A 94 -8.848 -12.548 -7.090 1.00 0.00 H new ATOM 0 HG1 THR A 94 -9.486 -14.484 -5.907 1.00 0.00 H new ATOM 0 HG21 THR A 94 -8.754 -14.855 -8.065 1.00 0.00 H new ATOM 0 HG22 THR A 94 -7.469 -13.801 -8.702 1.00 0.00 H new ATOM 0 HG23 THR A 94 -7.088 -15.018 -7.460 1.00 0.00 H new ATOM 1493 N VAL A 95 -7.900 -10.301 -5.916 1.00 0.00 N ATOM 1494 CA VAL A 95 -8.420 -9.166 -5.163 1.00 0.00 C ATOM 1495 C VAL A 95 -9.914 -9.043 -5.451 1.00 0.00 C ATOM 1496 O VAL A 95 -10.377 -9.489 -6.501 1.00 0.00 O ATOM 1497 CB VAL A 95 -7.631 -7.880 -5.454 1.00 0.00 C ATOM 1498 CG1 VAL A 95 -6.303 -7.887 -4.693 1.00 0.00 C ATOM 1499 CG2 VAL A 95 -7.372 -7.616 -6.947 1.00 0.00 C ATOM 0 H VAL A 95 -8.115 -10.250 -6.912 1.00 0.00 H new ATOM 0 HA VAL A 95 -8.290 -9.332 -4.094 1.00 0.00 H new ATOM 0 HB VAL A 95 -8.267 -7.065 -5.108 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -5.755 -6.970 -4.909 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -6.498 -7.950 -3.622 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -5.709 -8.746 -5.005 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -6.810 -6.689 -7.060 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.799 -8.442 -7.368 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -8.324 -7.530 -7.472 1.00 0.00 H new ATOM 1509 N ASN A 96 -10.662 -8.431 -4.531 1.00 0.00 N ATOM 1510 CA ASN A 96 -12.078 -8.123 -4.675 1.00 0.00 C ATOM 1511 C ASN A 96 -12.266 -6.640 -5.028 1.00 0.00 C ATOM 1512 O ASN A 96 -13.168 -5.968 -4.534 1.00 0.00 O ATOM 1513 CB ASN A 96 -12.853 -8.551 -3.421 1.00 0.00 C ATOM 1514 CG ASN A 96 -14.348 -8.741 -3.673 1.00 0.00 C ATOM 1515 OD1 ASN A 96 -14.869 -8.526 -4.760 1.00 0.00 O ATOM 1516 ND2 ASN A 96 -15.068 -9.233 -2.679 1.00 0.00 N ATOM 0 H ASN A 96 -10.281 -8.127 -3.635 1.00 0.00 H new ATOM 0 HA ASN A 96 -12.495 -8.697 -5.503 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -12.433 -9.483 -3.043 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -12.715 -7.801 -2.643 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -16.058 -9.434 -2.817 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -14.633 -9.412 -1.774 1.00 0.00 H new ATOM 1523 N VAL A 97 -11.337 -6.101 -5.815 1.00 0.00 N ATOM 1524 CA VAL A 97 -11.346 -4.765 -6.396 1.00 0.00 C ATOM 1525 C VAL A 97 -10.810 -4.918 -7.826 1.00 0.00 C ATOM 1526 O VAL A 97 -10.200 -5.949 -8.132 1.00 0.00 O ATOM 1527 CB VAL A 97 -10.502 -3.757 -5.589 1.00 0.00 C ATOM 1528 CG1 VAL A 97 -11.153 -3.346 -4.267 1.00 0.00 C ATOM 1529 CG2 VAL A 97 -9.061 -4.217 -5.322 1.00 0.00 C ATOM 0 H VAL A 97 -10.502 -6.624 -6.080 1.00 0.00 H new ATOM 0 HA VAL A 97 -12.357 -4.358 -6.385 1.00 0.00 H new ATOM 0 HB VAL A 97 -10.458 -2.887 -6.244 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -10.508 -2.636 -3.749 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -12.118 -2.881 -4.466 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -11.297 -4.228 -3.643 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.535 -3.453 -4.750 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -9.075 -5.148 -4.756 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.548 -4.377 -6.271 1.00 0.00 H new ATOM 1539 N PRO A 98 -11.031 -3.947 -8.725 1.00 0.00 N ATOM 1540 CA PRO A 98 -10.423 -4.002 -10.041 1.00 0.00 C ATOM 1541 C PRO A 98 -8.906 -3.799 -9.906 1.00 0.00 C ATOM 1542 O PRO A 98 -8.428 -3.206 -8.930 1.00 0.00 O ATOM 1543 CB PRO A 98 -11.089 -2.896 -10.865 1.00 0.00 C ATOM 1544 CG PRO A 98 -12.039 -2.156 -9.915 1.00 0.00 C ATOM 1545 CD PRO A 98 -11.723 -2.688 -8.520 1.00 0.00 C ATOM 0 HA PRO A 98 -10.567 -4.964 -10.534 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -10.343 -2.215 -11.275 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -11.635 -3.317 -11.709 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -11.885 -1.078 -9.968 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -13.080 -2.342 -10.179 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -11.101 -1.986 -7.965 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -12.635 -2.833 -7.941 1.00 0.00 H new ATOM 1553 N LEU A 99 -8.159 -4.243 -10.924 1.00 0.00 N ATOM 1554 CA LEU A 99 -6.705 -4.099 -11.001 1.00 0.00 C ATOM 1555 C LEU A 99 -6.276 -2.627 -11.084 1.00 0.00 C ATOM 1556 O LEU A 99 -5.097 -2.354 -10.925 1.00 0.00 O ATOM 1557 CB LEU A 99 -6.118 -4.908 -12.180 1.00 0.00 C ATOM 1558 CG LEU A 99 -5.896 -6.416 -11.978 1.00 0.00 C ATOM 1559 CD1 LEU A 99 -4.629 -6.659 -11.176 1.00 0.00 C ATOM 1560 CD2 LEU A 99 -7.068 -7.156 -11.321 1.00 0.00 C ATOM 0 H LEU A 99 -8.558 -4.721 -11.732 1.00 0.00 H new ATOM 0 HA LEU A 99 -6.300 -4.507 -10.075 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -6.780 -4.779 -13.036 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -5.160 -4.462 -12.448 1.00 0.00 H new ATOM 0 HG LEU A 99 -5.805 -6.828 -12.983 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.484 -7.731 -11.040 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.775 -6.242 -11.710 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.718 -6.179 -10.201 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -6.820 -8.213 -11.220 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -7.259 -6.732 -10.335 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -7.958 -7.050 -11.941 1.00 0.00 H new ATOM 1572 N LEU A 100 -7.186 -1.678 -11.302 1.00 0.00 N ATOM 1573 CA LEU A 100 -6.933 -0.242 -11.269 1.00 0.00 C ATOM 1574 C LEU A 100 -8.141 0.429 -10.626 1.00 0.00 C ATOM 1575 O LEU A 100 -9.213 -0.180 -10.549 1.00 0.00 O ATOM 1576 CB LEU A 100 -6.588 0.357 -12.644 1.00 0.00 C ATOM 1577 CG LEU A 100 -7.763 0.580 -13.611 1.00 0.00 C ATOM 1578 CD1 LEU A 100 -7.249 1.203 -14.911 1.00 0.00 C ATOM 1579 CD2 LEU A 100 -8.484 -0.732 -13.929 1.00 0.00 C ATOM 0 H LEU A 100 -8.158 -1.900 -11.515 1.00 0.00 H new ATOM 0 HA LEU A 100 -6.039 -0.055 -10.674 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -6.092 1.314 -12.484 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.866 -0.299 -13.130 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.472 1.252 -13.128 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -8.084 1.360 -15.594 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.774 2.159 -14.693 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -6.523 0.534 -15.373 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -9.308 -0.537 -14.615 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -7.785 -1.429 -14.391 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -8.873 -1.166 -13.008 1.00 0.00 H new ATOM 1591 N GLY A 101 -8.011 1.676 -10.190 1.00 0.00 N ATOM 1592 CA GLY A 101 -9.101 2.359 -9.518 1.00 0.00 C ATOM 1593 C GLY A 101 -8.604 3.619 -8.841 1.00 0.00 C ATOM 1594 O GLY A 101 -7.543 4.138 -9.169 1.00 0.00 O ATOM 0 H GLY A 101 -7.161 2.231 -10.291 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.879 2.610 -10.239 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.552 1.696 -8.779 1.00 0.00 H new ATOM 1598 N THR A 102 -9.382 4.134 -7.898 1.00 0.00 N ATOM 1599 CA THR A 102 -8.996 5.274 -7.085 1.00 0.00 C ATOM 1600 C THR A 102 -9.126 4.857 -5.622 1.00 0.00 C ATOM 1601 O THR A 102 -9.986 4.043 -5.271 1.00 0.00 O ATOM 1602 CB THR A 102 -9.834 6.509 -7.479 1.00 0.00 C ATOM 1603 OG1 THR A 102 -11.200 6.168 -7.641 1.00 0.00 O ATOM 1604 CG2 THR A 102 -9.371 7.111 -8.814 1.00 0.00 C ATOM 0 H THR A 102 -10.307 3.767 -7.676 1.00 0.00 H new ATOM 0 HA THR A 102 -7.961 5.573 -7.251 1.00 0.00 H new ATOM 0 HB THR A 102 -9.701 7.229 -6.671 1.00 0.00 H new ATOM 0 HG1 THR A 102 -11.710 6.968 -7.889 1.00 0.00 H new ATOM 0 HG21 THR A 102 -9.986 7.978 -9.055 1.00 0.00 H new ATOM 0 HG22 THR A 102 -8.328 7.418 -8.733 1.00 0.00 H new ATOM 0 HG23 THR A 102 -9.470 6.365 -9.603 1.00 0.00 H new ATOM 1612 N VAL A 103 -8.229 5.357 -4.777 1.00 0.00 N ATOM 1613 CA VAL A 103 -8.264 5.141 -3.339 1.00 0.00 C ATOM 1614 C VAL A 103 -9.412 6.035 -2.829 1.00 0.00 C ATOM 1615 O VAL A 103 -9.335 7.250 -3.005 1.00 0.00 O ATOM 1616 CB VAL A 103 -6.884 5.479 -2.733 1.00 0.00 C ATOM 1617 CG1 VAL A 103 -6.855 5.064 -1.261 1.00 0.00 C ATOM 1618 CG2 VAL A 103 -5.723 4.756 -3.443 1.00 0.00 C ATOM 0 H VAL A 103 -7.444 5.934 -5.081 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.453 4.107 -3.049 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.748 6.554 -2.855 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.881 5.303 -0.835 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.631 5.601 -0.716 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.032 3.991 -1.182 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.780 5.033 -2.973 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.864 3.678 -3.365 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.703 5.045 -4.494 1.00 0.00 H new ATOM 1628 N PRO A 104 -10.494 5.496 -2.238 1.00 0.00 N ATOM 1629 CA PRO A 104 -11.658 6.300 -1.875 1.00 0.00 C ATOM 1630 C PRO A 104 -11.477 7.185 -0.665 1.00 0.00 C ATOM 1631 O PRO A 104 -10.678 6.891 0.199 1.00 0.00 O ATOM 1632 CB PRO A 104 -12.809 5.303 -1.733 1.00 0.00 C ATOM 1633 CG PRO A 104 -12.077 4.056 -1.233 1.00 0.00 C ATOM 1634 CD PRO A 104 -10.742 4.091 -1.971 1.00 0.00 C ATOM 0 HA PRO A 104 -11.855 7.040 -2.650 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -13.563 5.646 -1.025 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -13.318 5.127 -2.681 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -11.937 4.082 -0.152 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -12.635 3.148 -1.460 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -9.946 3.658 -1.366 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -10.788 3.516 -2.896 1.00 0.00 H new ATOM 1642 N HIS A 105 -12.311 8.214 -0.501 1.00 0.00 N ATOM 1643 CA HIS A 105 -12.071 9.177 0.565 1.00 0.00 C ATOM 1644 C HIS A 105 -12.391 8.763 1.986 1.00 0.00 C ATOM 1645 O HIS A 105 -12.125 9.517 2.925 1.00 0.00 O ATOM 1646 CB HIS A 105 -12.578 10.568 0.187 1.00 0.00 C ATOM 1647 CG HIS A 105 -11.957 11.015 -1.102 1.00 0.00 C ATOM 1648 ND1 HIS A 105 -10.636 11.359 -1.247 1.00 0.00 N ATOM 1649 CD2 HIS A 105 -12.554 11.106 -2.328 1.00 0.00 C ATOM 1650 CE1 HIS A 105 -10.442 11.702 -2.526 1.00 0.00 C ATOM 1651 NE2 HIS A 105 -11.573 11.513 -3.226 1.00 0.00 N ATOM 0 H HIS A 105 -13.134 8.396 -1.076 1.00 0.00 H new ATOM 0 HA HIS A 105 -10.983 9.214 0.628 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -13.664 10.553 0.090 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -12.339 11.277 0.979 1.00 0.00 H new ATOM 0 HD1 HIS A 105 -9.929 11.354 -0.512 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -13.590 10.901 -2.556 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -9.514 12.075 -2.935 1.00 0.00 H new ATOM 1659 N LYS A 106 -13.137 7.683 2.167 1.00 0.00 N ATOM 1660 CA LYS A 106 -13.378 7.118 3.485 1.00 0.00 C ATOM 1661 C LYS A 106 -12.777 5.720 3.511 1.00 0.00 C ATOM 1662 O LYS A 106 -12.712 5.077 2.463 1.00 0.00 O ATOM 1663 CB LYS A 106 -14.847 7.207 3.933 1.00 0.00 C ATOM 1664 CG LYS A 106 -15.251 8.582 4.515 1.00 0.00 C ATOM 1665 CD LYS A 106 -15.994 9.574 3.598 1.00 0.00 C ATOM 1666 CE LYS A 106 -15.149 10.453 2.661 1.00 0.00 C ATOM 1667 NZ LYS A 106 -14.132 11.280 3.359 1.00 0.00 N ATOM 0 H LYS A 106 -13.590 7.176 1.407 1.00 0.00 H new ATOM 0 HA LYS A 106 -12.877 7.718 4.245 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -15.489 6.983 3.081 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -15.033 6.439 4.683 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -15.879 8.402 5.388 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -14.344 9.072 4.870 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -16.692 9.005 2.984 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -16.589 10.233 4.230 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -14.646 9.813 1.936 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -15.813 11.110 2.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -14.019 12.186 2.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -14.441 11.459 4.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -13.223 10.775 3.370 1.00 0.00 H new ATOM 1681 N ALA A 107 -12.370 5.280 4.706 1.00 0.00 N ATOM 1682 CA ALA A 107 -11.763 3.982 4.966 1.00 0.00 C ATOM 1683 C ALA A 107 -12.614 2.897 4.318 1.00 0.00 C ATOM 1684 O ALA A 107 -13.734 2.658 4.769 1.00 0.00 O ATOM 1685 CB ALA A 107 -11.635 3.771 6.480 1.00 0.00 C ATOM 0 H ALA A 107 -12.461 5.846 5.550 1.00 0.00 H new ATOM 0 HA ALA A 107 -10.762 3.935 4.536 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -11.181 2.800 6.675 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -11.010 4.556 6.905 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -12.624 3.807 6.937 1.00 0.00 H new ATOM 1691 N SER A 108 -12.108 2.296 3.246 1.00 0.00 N ATOM 1692 CA SER A 108 -12.799 1.247 2.519 1.00 0.00 C ATOM 1693 C SER A 108 -11.886 0.032 2.479 1.00 0.00 C ATOM 1694 O SER A 108 -10.669 0.168 2.319 1.00 0.00 O ATOM 1695 CB SER A 108 -13.163 1.726 1.118 1.00 0.00 C ATOM 1696 OG SER A 108 -13.909 2.932 1.176 1.00 0.00 O ATOM 0 H SER A 108 -11.195 2.530 2.856 1.00 0.00 H new ATOM 0 HA SER A 108 -13.733 0.982 3.014 1.00 0.00 H new ATOM 0 HB2 SER A 108 -12.255 1.882 0.535 1.00 0.00 H new ATOM 0 HB3 SER A 108 -13.743 0.959 0.606 1.00 0.00 H new ATOM 0 HG SER A 108 -13.361 3.637 1.580 1.00 0.00 H new ATOM 1702 N VAL A 109 -12.486 -1.137 2.671 1.00 0.00 N ATOM 1703 CA VAL A 109 -11.779 -2.399 2.792 1.00 0.00 C ATOM 1704 C VAL A 109 -11.412 -2.891 1.386 1.00 0.00 C ATOM 1705 O VAL A 109 -12.116 -2.610 0.415 1.00 0.00 O ATOM 1706 CB VAL A 109 -12.654 -3.411 3.578 1.00 0.00 C ATOM 1707 CG1 VAL A 109 -11.912 -4.707 3.949 1.00 0.00 C ATOM 1708 CG2 VAL A 109 -13.187 -2.811 4.895 1.00 0.00 C ATOM 0 H VAL A 109 -13.499 -1.232 2.748 1.00 0.00 H new ATOM 0 HA VAL A 109 -10.853 -2.281 3.355 1.00 0.00 H new ATOM 0 HB VAL A 109 -13.470 -3.643 2.893 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -12.585 -5.367 4.497 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -11.574 -5.206 3.041 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -11.051 -4.467 4.573 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -13.794 -3.553 5.413 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -12.349 -2.522 5.529 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -13.795 -1.934 4.675 1.00 0.00 H new ATOM 1718 N VAL A 110 -10.334 -3.662 1.290 1.00 0.00 N ATOM 1719 CA VAL A 110 -9.852 -4.341 0.102 1.00 0.00 C ATOM 1720 C VAL A 110 -9.620 -5.784 0.532 1.00 0.00 C ATOM 1721 O VAL A 110 -8.740 -6.053 1.351 1.00 0.00 O ATOM 1722 CB VAL A 110 -8.568 -3.666 -0.424 1.00 0.00 C ATOM 1723 CG1 VAL A 110 -8.010 -4.406 -1.649 1.00 0.00 C ATOM 1724 CG2 VAL A 110 -8.816 -2.205 -0.810 1.00 0.00 C ATOM 0 H VAL A 110 -9.736 -3.838 2.098 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.561 -4.296 -0.725 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.844 -3.706 0.390 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -7.106 -3.906 -1.996 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -7.774 -5.435 -1.376 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -8.754 -4.403 -2.446 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -7.889 -1.763 -1.176 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -9.574 -2.159 -1.592 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.162 -1.652 0.063 1.00 0.00 H new ATOM 1734 N GLN A 111 -10.452 -6.706 0.052 1.00 0.00 N ATOM 1735 CA GLN A 111 -10.252 -8.126 0.291 1.00 0.00 C ATOM 1736 C GLN A 111 -9.228 -8.631 -0.732 1.00 0.00 C ATOM 1737 O GLN A 111 -9.349 -8.341 -1.926 1.00 0.00 O ATOM 1738 CB GLN A 111 -11.597 -8.853 0.157 1.00 0.00 C ATOM 1739 CG GLN A 111 -11.525 -10.373 0.382 1.00 0.00 C ATOM 1740 CD GLN A 111 -12.819 -11.089 -0.014 1.00 0.00 C ATOM 1741 OE1 GLN A 111 -13.805 -10.482 -0.424 1.00 0.00 O ATOM 1742 NE2 GLN A 111 -12.846 -12.410 0.054 1.00 0.00 N ATOM 0 H GLN A 111 -11.276 -6.488 -0.508 1.00 0.00 H new ATOM 0 HA GLN A 111 -9.874 -8.316 1.296 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -12.300 -8.425 0.872 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -12.000 -8.664 -0.838 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -10.696 -10.783 -0.195 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -11.311 -10.571 1.432 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -12.030 -12.920 0.394 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -13.682 -12.918 -0.233 1.00 0.00 H new ATOM 1751 N VAL A 112 -8.266 -9.428 -0.274 1.00 0.00 N ATOM 1752 CA VAL A 112 -7.266 -10.121 -1.079 1.00 0.00 C ATOM 1753 C VAL A 112 -7.553 -11.605 -0.856 1.00 0.00 C ATOM 1754 O VAL A 112 -7.522 -12.041 0.292 1.00 0.00 O ATOM 1755 CB VAL A 112 -5.834 -9.735 -0.641 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -4.825 -10.130 -1.729 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -5.666 -8.231 -0.354 1.00 0.00 C ATOM 0 H VAL A 112 -8.158 -9.617 0.722 1.00 0.00 H new ATOM 0 HA VAL A 112 -7.323 -9.856 -2.135 1.00 0.00 H new ATOM 0 HB VAL A 112 -5.650 -10.276 0.287 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -3.820 -9.854 -1.411 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -4.870 -11.207 -1.894 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -5.068 -9.610 -2.656 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -4.638 -8.031 -0.052 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -5.897 -7.661 -1.254 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -6.344 -7.936 0.447 1.00 0.00 H new ATOM 1767 N GLY A 113 -7.932 -12.363 -1.884 1.00 0.00 N ATOM 1768 CA GLY A 113 -8.273 -13.766 -1.816 1.00 0.00 C ATOM 1769 C GLY A 113 -7.072 -14.642 -2.145 1.00 0.00 C ATOM 1770 O GLY A 113 -6.235 -14.245 -2.952 1.00 0.00 O ATOM 0 H GLY A 113 -8.010 -11.988 -2.829 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -8.639 -14.006 -0.818 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -9.084 -13.980 -2.512 1.00 0.00 H new ATOM 1774 N PHE A 114 -6.996 -15.847 -1.569 1.00 0.00 N ATOM 1775 CA PHE A 114 -5.886 -16.772 -1.773 1.00 0.00 C ATOM 1776 C PHE A 114 -6.405 -18.196 -2.052 1.00 0.00 C ATOM 1777 O PHE A 114 -6.320 -19.068 -1.172 1.00 0.00 O ATOM 1778 CB PHE A 114 -4.941 -16.772 -0.549 1.00 0.00 C ATOM 1779 CG PHE A 114 -4.646 -15.451 0.119 1.00 0.00 C ATOM 1780 CD1 PHE A 114 -4.219 -14.342 -0.629 1.00 0.00 C ATOM 1781 CD2 PHE A 114 -4.752 -15.353 1.518 1.00 0.00 C ATOM 1782 CE1 PHE A 114 -3.969 -13.122 0.012 1.00 0.00 C ATOM 1783 CE2 PHE A 114 -4.448 -14.146 2.159 1.00 0.00 C ATOM 1784 CZ PHE A 114 -4.090 -13.014 1.405 1.00 0.00 C ATOM 0 H PHE A 114 -7.715 -16.207 -0.941 1.00 0.00 H new ATOM 0 HA PHE A 114 -5.322 -16.436 -2.643 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -5.367 -17.438 0.202 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -3.992 -17.208 -0.860 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -4.084 -14.430 -1.697 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -5.068 -16.208 2.097 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -3.681 -12.259 -0.570 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -4.489 -14.084 3.236 1.00 0.00 H new ATOM 0 HZ PHE A 114 -3.910 -12.069 1.895 1.00 0.00 H new ATOM 1794 N PRO A 115 -6.951 -18.474 -3.246 1.00 0.00 N ATOM 1795 CA PRO A 115 -7.336 -19.827 -3.615 1.00 0.00 C ATOM 1796 C PRO A 115 -6.055 -20.647 -3.821 1.00 0.00 C ATOM 1797 O PRO A 115 -5.184 -20.246 -4.603 1.00 0.00 O ATOM 1798 CB PRO A 115 -8.176 -19.684 -4.886 1.00 0.00 C ATOM 1799 CG PRO A 115 -7.650 -18.400 -5.525 1.00 0.00 C ATOM 1800 CD PRO A 115 -7.238 -17.541 -4.327 1.00 0.00 C ATOM 0 HA PRO A 115 -7.922 -20.348 -2.858 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -8.050 -20.541 -5.548 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -9.239 -19.611 -4.657 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -6.805 -18.598 -6.185 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -8.416 -17.909 -6.126 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -6.363 -16.936 -4.563 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -8.036 -16.853 -4.047 1.00 0.00 H new ATOM 1808 N CYS A 116 -5.926 -21.755 -3.077 1.00 0.00 N ATOM 1809 CA CYS A 116 -4.843 -22.722 -3.231 1.00 0.00 C ATOM 1810 C CYS A 116 -5.430 -23.946 -3.926 1.00 0.00 C ATOM 1811 O CYS A 116 -6.620 -24.213 -3.751 1.00 0.00 O ATOM 1812 CB CYS A 116 -4.223 -23.131 -1.880 1.00 0.00 C ATOM 1813 SG CYS A 116 -2.557 -23.814 -2.046 1.00 0.00 S ATOM 0 H CYS A 116 -6.586 -22.004 -2.340 1.00 0.00 H new ATOM 0 HA CYS A 116 -4.040 -22.272 -3.814 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -4.190 -22.261 -1.224 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -4.866 -23.868 -1.400 1.00 0.00 H new ATOM 1818 N LEU A 117 -4.622 -24.708 -4.667 1.00 0.00 N ATOM 1819 CA LEU A 117 -5.141 -25.828 -5.455 1.00 0.00 C ATOM 1820 C LEU A 117 -5.399 -27.070 -4.593 1.00 0.00 C ATOM 1821 O LEU A 117 -5.987 -28.027 -5.084 1.00 0.00 O ATOM 1822 CB LEU A 117 -4.237 -26.179 -6.650 1.00 0.00 C ATOM 1823 CG LEU A 117 -3.832 -25.034 -7.606 1.00 0.00 C ATOM 1824 CD1 LEU A 117 -3.528 -25.606 -8.990 1.00 0.00 C ATOM 1825 CD2 LEU A 117 -4.822 -23.872 -7.768 1.00 0.00 C ATOM 0 H LEU A 117 -3.614 -24.572 -4.738 1.00 0.00 H new ATOM 0 HA LEU A 117 -6.097 -25.490 -5.855 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -3.324 -26.628 -6.259 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -4.742 -26.945 -7.239 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.960 -24.593 -7.122 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -3.243 -24.798 -9.663 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -2.710 -26.322 -8.916 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -4.414 -26.107 -9.380 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -4.413 -23.140 -8.465 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -5.768 -24.251 -8.153 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -4.988 -23.398 -6.801 1.00 0.00 H new ATOM 1837 N GLY A 118 -4.940 -27.071 -3.337 1.00 0.00 N ATOM 1838 CA GLY A 118 -5.204 -28.097 -2.342 1.00 0.00 C ATOM 1839 C GLY A 118 -4.775 -29.508 -2.725 1.00 0.00 C ATOM 1840 O GLY A 118 -5.428 -30.455 -2.300 1.00 0.00 O ATOM 0 H GLY A 118 -4.349 -26.321 -2.978 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -4.698 -27.820 -1.417 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -6.273 -28.106 -2.130 1.00 0.00 H new ATOM 1844 N LYS A 119 -3.697 -29.683 -3.500 1.00 0.00 N ATOM 1845 CA LYS A 119 -3.193 -31.029 -3.830 1.00 0.00 C ATOM 1846 C LYS A 119 -1.742 -31.258 -3.431 1.00 0.00 C ATOM 1847 O LYS A 119 -1.371 -32.407 -3.233 1.00 0.00 O ATOM 1848 CB LYS A 119 -3.486 -31.408 -5.288 1.00 0.00 C ATOM 1849 CG LYS A 119 -5.005 -31.392 -5.533 1.00 0.00 C ATOM 1850 CD LYS A 119 -5.481 -32.423 -6.553 1.00 0.00 C ATOM 1851 CE LYS A 119 -7.006 -32.295 -6.633 1.00 0.00 C ATOM 1852 NZ LYS A 119 -7.635 -33.436 -7.318 1.00 0.00 N ATOM 0 H LYS A 119 -3.159 -28.919 -3.909 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.758 -31.722 -3.206 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -2.992 -30.708 -5.962 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -3.083 -32.398 -5.505 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -5.517 -31.569 -4.587 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -5.297 -30.398 -5.873 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -5.026 -32.242 -7.527 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -5.193 -33.429 -6.249 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -7.413 -32.212 -5.625 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -7.263 -31.375 -7.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -8.642 -33.231 -7.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -7.162 -33.597 -8.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -7.546 -34.287 -6.728 1.00 0.00 H new ATOM 1866 N GLN A 120 -0.909 -30.219 -3.408 1.00 0.00 N ATOM 1867 CA GLN A 120 0.453 -30.313 -2.899 1.00 0.00 C ATOM 1868 C GLN A 120 0.387 -29.819 -1.446 1.00 0.00 C ATOM 1869 O GLN A 120 -0.512 -29.047 -1.094 1.00 0.00 O ATOM 1870 CB GLN A 120 1.408 -29.505 -3.794 1.00 0.00 C ATOM 1871 CG GLN A 120 2.883 -29.513 -3.359 1.00 0.00 C ATOM 1872 CD GLN A 120 3.479 -30.902 -3.156 1.00 0.00 C ATOM 1873 OE1 GLN A 120 3.502 -31.727 -4.058 1.00 0.00 O ATOM 1874 NE2 GLN A 120 3.984 -31.184 -1.963 1.00 0.00 N ATOM 0 H GLN A 120 -1.162 -29.289 -3.742 1.00 0.00 H new ATOM 0 HA GLN A 120 0.850 -31.328 -2.915 1.00 0.00 H new ATOM 0 HB2 GLN A 120 1.344 -29.895 -4.810 1.00 0.00 H new ATOM 0 HB3 GLN A 120 1.062 -28.472 -3.827 1.00 0.00 H new ATOM 0 HG2 GLN A 120 3.472 -28.986 -4.109 1.00 0.00 H new ATOM 0 HG3 GLN A 120 2.977 -28.953 -2.429 1.00 0.00 H new ATOM 0 HE21 GLN A 120 3.958 -30.486 -1.220 1.00 0.00 H new ATOM 0 HE22 GLN A 120 4.399 -32.099 -1.788 1.00 0.00 H new ATOM 1883 N ASP A 121 1.380 -30.173 -0.635 1.00 0.00 N ATOM 1884 CA ASP A 121 1.521 -29.730 0.747 1.00 0.00 C ATOM 1885 C ASP A 121 2.778 -28.875 0.806 1.00 0.00 C ATOM 1886 O ASP A 121 3.743 -29.158 0.083 1.00 0.00 O ATOM 1887 CB ASP A 121 1.684 -30.898 1.735 1.00 0.00 C ATOM 1888 CG ASP A 121 0.553 -31.915 1.687 1.00 0.00 C ATOM 1889 OD1 ASP A 121 -0.450 -31.683 2.394 1.00 0.00 O ATOM 1890 OD2 ASP A 121 0.703 -32.909 0.948 1.00 0.00 O ATOM 0 H ASP A 121 2.132 -30.795 -0.932 1.00 0.00 H new ATOM 0 HA ASP A 121 0.619 -29.189 1.035 1.00 0.00 H new ATOM 0 HB2 ASP A 121 2.625 -31.407 1.527 1.00 0.00 H new ATOM 0 HB3 ASP A 121 1.755 -30.497 2.746 1.00 0.00 H new ATOM 1895 N GLY A 122 2.812 -27.867 1.678 1.00 0.00 N ATOM 1896 CA GLY A 122 3.990 -27.031 1.870 1.00 0.00 C ATOM 1897 C GLY A 122 3.599 -25.578 2.077 1.00 0.00 C ATOM 1898 O GLY A 122 2.489 -25.277 2.515 1.00 0.00 O ATOM 0 H GLY A 122 2.022 -27.610 2.270 1.00 0.00 H new ATOM 0 HA2 GLY A 122 4.555 -27.385 2.732 1.00 0.00 H new ATOM 0 HA3 GLY A 122 4.645 -27.115 1.003 1.00 0.00 H new ATOM 1902 N VAL A 123 4.521 -24.663 1.776 1.00 0.00 N ATOM 1903 CA VAL A 123 4.275 -23.233 1.863 1.00 0.00 C ATOM 1904 C VAL A 123 4.609 -22.618 0.507 1.00 0.00 C ATOM 1905 O VAL A 123 5.765 -22.649 0.093 1.00 0.00 O ATOM 1906 CB VAL A 123 5.086 -22.611 3.022 1.00 0.00 C ATOM 1907 CG1 VAL A 123 4.673 -21.152 3.245 1.00 0.00 C ATOM 1908 CG2 VAL A 123 4.907 -23.359 4.354 1.00 0.00 C ATOM 0 H VAL A 123 5.463 -24.900 1.464 1.00 0.00 H new ATOM 0 HA VAL A 123 3.229 -23.029 2.090 1.00 0.00 H new ATOM 0 HB VAL A 123 6.131 -22.683 2.722 1.00 0.00 H new ATOM 0 HG11 VAL A 123 5.255 -20.730 4.065 1.00 0.00 H new ATOM 0 HG12 VAL A 123 4.858 -20.579 2.337 1.00 0.00 H new ATOM 0 HG13 VAL A 123 3.612 -21.108 3.492 1.00 0.00 H new ATOM 0 HG21 VAL A 123 5.502 -22.873 5.127 1.00 0.00 H new ATOM 0 HG22 VAL A 123 3.856 -23.343 4.642 1.00 0.00 H new ATOM 0 HG23 VAL A 123 5.236 -24.392 4.238 1.00 0.00 H new ATOM 1918 N ALA A 124 3.591 -22.101 -0.184 1.00 0.00 N ATOM 1919 CA ALA A 124 3.764 -21.358 -1.426 1.00 0.00 C ATOM 1920 C ALA A 124 3.989 -19.894 -1.027 1.00 0.00 C ATOM 1921 O ALA A 124 3.652 -19.491 0.090 1.00 0.00 O ATOM 1922 CB ALA A 124 2.532 -21.484 -2.352 1.00 0.00 C ATOM 0 H ALA A 124 2.618 -22.189 0.108 1.00 0.00 H new ATOM 0 HA ALA A 124 4.608 -21.757 -1.989 1.00 0.00 H new ATOM 0 HB1 ALA A 124 2.704 -20.915 -3.266 1.00 0.00 H new ATOM 0 HB2 ALA A 124 2.371 -22.533 -2.602 1.00 0.00 H new ATOM 0 HB3 ALA A 124 1.652 -21.093 -1.842 1.00 0.00 H new ATOM 1928 N ALA A 125 4.483 -19.065 -1.944 1.00 0.00 N ATOM 1929 CA ALA A 125 4.633 -17.622 -1.732 1.00 0.00 C ATOM 1930 C ALA A 125 3.855 -16.843 -2.791 1.00 0.00 C ATOM 1931 O ALA A 125 3.573 -17.382 -3.862 1.00 0.00 O ATOM 1932 CB ALA A 125 6.119 -17.244 -1.736 1.00 0.00 C ATOM 0 H ALA A 125 4.794 -19.376 -2.864 1.00 0.00 H new ATOM 0 HA ALA A 125 4.219 -17.358 -0.759 1.00 0.00 H new ATOM 0 HB1 ALA A 125 6.222 -16.170 -1.578 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.633 -17.779 -0.937 1.00 0.00 H new ATOM 0 HB3 ALA A 125 6.560 -17.513 -2.696 1.00 0.00 H new ATOM 1938 N PHE A 126 3.507 -15.586 -2.520 1.00 0.00 N ATOM 1939 CA PHE A 126 2.881 -14.682 -3.481 1.00 0.00 C ATOM 1940 C PHE A 126 3.219 -13.246 -3.113 1.00 0.00 C ATOM 1941 O PHE A 126 3.601 -12.986 -1.977 1.00 0.00 O ATOM 1942 CB PHE A 126 1.358 -14.915 -3.560 1.00 0.00 C ATOM 1943 CG PHE A 126 0.522 -14.401 -2.406 1.00 0.00 C ATOM 1944 CD1 PHE A 126 0.082 -13.061 -2.387 1.00 0.00 C ATOM 1945 CD2 PHE A 126 0.150 -15.274 -1.367 1.00 0.00 C ATOM 1946 CE1 PHE A 126 -0.660 -12.585 -1.295 1.00 0.00 C ATOM 1947 CE2 PHE A 126 -0.599 -14.798 -0.278 1.00 0.00 C ATOM 1948 CZ PHE A 126 -0.964 -13.441 -0.224 1.00 0.00 C ATOM 0 H PHE A 126 3.656 -15.159 -1.606 1.00 0.00 H new ATOM 0 HA PHE A 126 3.275 -14.886 -4.476 1.00 0.00 H new ATOM 0 HB2 PHE A 126 0.992 -14.452 -4.476 1.00 0.00 H new ATOM 0 HB3 PHE A 126 1.184 -15.987 -3.653 1.00 0.00 H new ATOM 0 HD1 PHE A 126 0.316 -12.403 -3.211 1.00 0.00 H new ATOM 0 HD2 PHE A 126 0.441 -16.313 -1.407 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -0.998 -11.559 -1.278 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -0.893 -15.471 0.514 1.00 0.00 H new ATOM 0 HZ PHE A 126 -1.480 -13.056 0.643 1.00 0.00 H new ATOM 1958 N GLU A 127 3.070 -12.314 -4.047 1.00 0.00 N ATOM 1959 CA GLU A 127 3.469 -10.930 -3.897 1.00 0.00 C ATOM 1960 C GLU A 127 2.455 -9.978 -4.516 1.00 0.00 C ATOM 1961 O GLU A 127 1.662 -10.367 -5.392 1.00 0.00 O ATOM 1962 CB GLU A 127 4.839 -10.732 -4.556 1.00 0.00 C ATOM 1963 CG GLU A 127 5.020 -11.483 -5.880 1.00 0.00 C ATOM 1964 CD GLU A 127 6.209 -10.979 -6.697 1.00 0.00 C ATOM 1965 OE1 GLU A 127 7.344 -11.004 -6.179 1.00 0.00 O ATOM 1966 OE2 GLU A 127 5.955 -10.635 -7.877 1.00 0.00 O ATOM 0 H GLU A 127 2.654 -12.513 -4.957 1.00 0.00 H new ATOM 0 HA GLU A 127 3.523 -10.702 -2.832 1.00 0.00 H new ATOM 0 HB2 GLU A 127 4.993 -9.667 -4.732 1.00 0.00 H new ATOM 0 HB3 GLU A 127 5.613 -11.055 -3.860 1.00 0.00 H new ATOM 0 HG2 GLU A 127 5.153 -12.545 -5.673 1.00 0.00 H new ATOM 0 HG3 GLU A 127 4.111 -11.385 -6.474 1.00 0.00 H new ATOM 1973 N VAL A 128 2.547 -8.730 -4.044 1.00 0.00 N ATOM 1974 CA VAL A 128 1.726 -7.583 -4.397 1.00 0.00 C ATOM 1975 C VAL A 128 2.670 -6.401 -4.662 1.00 0.00 C ATOM 1976 O VAL A 128 3.603 -6.176 -3.890 1.00 0.00 O ATOM 1977 CB VAL A 128 0.761 -7.286 -3.223 1.00 0.00 C ATOM 1978 CG1 VAL A 128 -0.057 -6.003 -3.438 1.00 0.00 C ATOM 1979 CG2 VAL A 128 -0.220 -8.446 -2.982 1.00 0.00 C ATOM 0 H VAL A 128 3.255 -8.484 -3.352 1.00 0.00 H new ATOM 0 HA VAL A 128 1.127 -7.769 -5.289 1.00 0.00 H new ATOM 0 HB VAL A 128 1.403 -7.156 -2.352 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -0.716 -5.844 -2.584 1.00 0.00 H new ATOM 0 HG12 VAL A 128 0.618 -5.153 -3.538 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -0.654 -6.100 -4.345 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -0.879 -8.198 -2.150 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -0.815 -8.612 -3.880 1.00 0.00 H new ATOM 0 HG23 VAL A 128 0.338 -9.351 -2.745 1.00 0.00 H new ATOM 1989 N ASP A 129 2.419 -5.639 -5.726 1.00 0.00 N ATOM 1990 CA ASP A 129 3.109 -4.404 -6.087 1.00 0.00 C ATOM 1991 C ASP A 129 2.042 -3.512 -6.717 1.00 0.00 C ATOM 1992 O ASP A 129 1.352 -3.952 -7.639 1.00 0.00 O ATOM 1993 CB ASP A 129 4.246 -4.675 -7.082 1.00 0.00 C ATOM 1994 CG ASP A 129 5.128 -3.443 -7.326 1.00 0.00 C ATOM 1995 OD1 ASP A 129 4.635 -2.294 -7.254 1.00 0.00 O ATOM 1996 OD2 ASP A 129 6.331 -3.645 -7.602 1.00 0.00 O ATOM 0 H ASP A 129 1.688 -5.881 -6.395 1.00 0.00 H new ATOM 0 HA ASP A 129 3.570 -3.936 -5.217 1.00 0.00 H new ATOM 0 HB2 ASP A 129 4.864 -5.491 -6.707 1.00 0.00 H new ATOM 0 HB3 ASP A 129 3.822 -5.006 -8.030 1.00 0.00 H new ATOM 2001 N VAL A 130 1.816 -2.313 -6.184 1.00 0.00 N ATOM 2002 CA VAL A 130 0.791 -1.391 -6.634 1.00 0.00 C ATOM 2003 C VAL A 130 1.431 -0.020 -6.698 1.00 0.00 C ATOM 2004 O VAL A 130 2.122 0.399 -5.760 1.00 0.00 O ATOM 2005 CB VAL A 130 -0.420 -1.419 -5.678 1.00 0.00 C ATOM 2006 CG1 VAL A 130 -1.631 -0.626 -6.179 1.00 0.00 C ATOM 2007 CG2 VAL A 130 -0.897 -2.854 -5.508 1.00 0.00 C ATOM 0 H VAL A 130 2.362 -1.951 -5.402 1.00 0.00 H new ATOM 0 HA VAL A 130 0.410 -1.669 -7.616 1.00 0.00 H new ATOM 0 HB VAL A 130 -0.066 -0.967 -4.752 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -2.439 -0.696 -5.450 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -1.352 0.419 -6.312 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -1.966 -1.036 -7.132 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -1.752 -2.875 -4.833 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -1.190 -3.257 -6.477 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -0.091 -3.458 -5.092 1.00 0.00 H new ATOM 2017 N ILE A 131 1.217 0.646 -7.820 1.00 0.00 N ATOM 2018 CA ILE A 131 1.611 2.015 -8.053 1.00 0.00 C ATOM 2019 C ILE A 131 0.368 2.860 -7.790 1.00 0.00 C ATOM 2020 O ILE A 131 -0.770 2.388 -7.741 1.00 0.00 O ATOM 2021 CB ILE A 131 2.197 2.251 -9.468 1.00 0.00 C ATOM 2022 CG1 ILE A 131 1.206 1.942 -10.599 1.00 0.00 C ATOM 2023 CG2 ILE A 131 3.542 1.545 -9.672 1.00 0.00 C ATOM 2024 CD1 ILE A 131 1.108 0.449 -10.986 1.00 0.00 C ATOM 0 H ILE A 131 0.745 0.227 -8.621 1.00 0.00 H new ATOM 0 HA ILE A 131 2.427 2.294 -7.386 1.00 0.00 H new ATOM 0 HB ILE A 131 2.389 3.322 -9.525 1.00 0.00 H new ATOM 0 HG12 ILE A 131 0.217 2.291 -10.302 1.00 0.00 H new ATOM 0 HG13 ILE A 131 1.494 2.513 -11.481 1.00 0.00 H new ATOM 0 HG21 ILE A 131 3.908 1.743 -10.679 1.00 0.00 H new ATOM 0 HG22 ILE A 131 4.263 1.918 -8.944 1.00 0.00 H new ATOM 0 HG23 ILE A 131 3.413 0.471 -9.537 1.00 0.00 H new ATOM 0 HD11 ILE A 131 0.384 0.329 -11.792 1.00 0.00 H new ATOM 0 HD12 ILE A 131 2.084 0.095 -11.318 1.00 0.00 H new ATOM 0 HD13 ILE A 131 0.787 -0.131 -10.121 1.00 0.00 H new ATOM 2036 N VAL A 132 0.610 4.141 -7.648 1.00 0.00 N ATOM 2037 CA VAL A 132 -0.344 5.163 -7.311 1.00 0.00 C ATOM 2038 C VAL A 132 0.080 6.386 -8.095 1.00 0.00 C ATOM 2039 O VAL A 132 1.265 6.737 -8.171 1.00 0.00 O ATOM 2040 CB VAL A 132 -0.397 5.373 -5.787 1.00 0.00 C ATOM 2041 CG1 VAL A 132 -0.967 6.741 -5.388 1.00 0.00 C ATOM 2042 CG2 VAL A 132 -1.254 4.295 -5.104 1.00 0.00 C ATOM 0 H VAL A 132 1.548 4.521 -7.775 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.367 4.900 -7.579 1.00 0.00 H new ATOM 0 HB VAL A 132 0.640 5.311 -5.456 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -0.978 6.828 -4.302 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -0.345 7.531 -5.809 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -1.983 6.837 -5.770 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -1.271 4.471 -4.029 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -2.271 4.337 -5.495 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -0.829 3.312 -5.304 1.00 0.00 H new ATOM 2052 N MET A 133 -0.912 7.011 -8.706 1.00 0.00 N ATOM 2053 CA MET A 133 -0.744 8.149 -9.584 1.00 0.00 C ATOM 2054 C MET A 133 -1.843 9.155 -9.287 1.00 0.00 C ATOM 2055 O MET A 133 -2.707 8.905 -8.447 1.00 0.00 O ATOM 2056 CB MET A 133 -0.860 7.707 -11.057 1.00 0.00 C ATOM 2057 CG MET A 133 0.004 6.507 -11.476 1.00 0.00 C ATOM 2058 SD MET A 133 -0.896 5.076 -12.133 1.00 0.00 S ATOM 2059 CE MET A 133 -2.132 4.774 -10.841 1.00 0.00 C ATOM 0 H MET A 133 -1.886 6.729 -8.599 1.00 0.00 H new ATOM 0 HA MET A 133 0.239 8.590 -9.420 1.00 0.00 H new ATOM 0 HB2 MET A 133 -1.903 7.466 -11.261 1.00 0.00 H new ATOM 0 HB3 MET A 133 -0.599 8.555 -11.691 1.00 0.00 H new ATOM 0 HG2 MET A 133 0.716 6.842 -12.230 1.00 0.00 H new ATOM 0 HG3 MET A 133 0.584 6.182 -10.612 1.00 0.00 H new ATOM 0 HE1 MET A 133 -2.668 3.850 -11.059 1.00 0.00 H new ATOM 0 HE2 MET A 133 -1.635 4.686 -9.875 1.00 0.00 H new ATOM 0 HE3 MET A 133 -2.838 5.604 -10.812 1.00 0.00 H new ATOM 2069 N ASN A 134 -1.778 10.324 -9.912 1.00 0.00 N ATOM 2070 CA ASN A 134 -2.858 11.294 -9.816 1.00 0.00 C ATOM 2071 C ASN A 134 -3.854 10.900 -10.928 1.00 0.00 C ATOM 2072 O ASN A 134 -3.607 9.938 -11.663 1.00 0.00 O ATOM 2073 CB ASN A 134 -2.334 12.736 -9.838 1.00 0.00 C ATOM 2074 CG ASN A 134 -1.996 13.312 -11.207 1.00 0.00 C ATOM 2075 OD1 ASN A 134 -1.783 12.608 -12.193 1.00 0.00 O ATOM 2076 ND2 ASN A 134 -1.881 14.624 -11.262 1.00 0.00 N ATOM 0 H ASN A 134 -0.991 10.621 -10.489 1.00 0.00 H new ATOM 0 HA ASN A 134 -3.382 11.273 -8.860 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -3.081 13.378 -9.372 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -1.440 12.784 -9.217 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -1.610 15.076 -12.135 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -2.063 15.187 -10.431 1.00 0.00 H new ATOM 2083 N SER A 135 -5.000 11.568 -11.040 1.00 0.00 N ATOM 2084 CA SER A 135 -6.057 11.174 -11.977 1.00 0.00 C ATOM 2085 C SER A 135 -5.565 11.158 -13.437 1.00 0.00 C ATOM 2086 O SER A 135 -6.016 10.334 -14.231 1.00 0.00 O ATOM 2087 CB SER A 135 -7.233 12.140 -11.766 1.00 0.00 C ATOM 2088 OG SER A 135 -8.463 11.621 -12.231 1.00 0.00 O ATOM 0 H SER A 135 -5.224 12.395 -10.487 1.00 0.00 H new ATOM 0 HA SER A 135 -6.374 10.150 -11.779 1.00 0.00 H new ATOM 0 HB2 SER A 135 -7.320 12.371 -10.704 1.00 0.00 H new ATOM 0 HB3 SER A 135 -7.023 13.078 -12.280 1.00 0.00 H new ATOM 0 HG SER A 135 -9.175 12.275 -12.071 1.00 0.00 H new ATOM 2094 N GLU A 136 -4.614 12.024 -13.798 1.00 0.00 N ATOM 2095 CA GLU A 136 -4.048 12.092 -15.144 1.00 0.00 C ATOM 2096 C GLU A 136 -2.963 11.028 -15.383 1.00 0.00 C ATOM 2097 O GLU A 136 -2.448 10.930 -16.497 1.00 0.00 O ATOM 2098 CB GLU A 136 -3.493 13.494 -15.457 1.00 0.00 C ATOM 2099 CG GLU A 136 -4.369 14.671 -14.995 1.00 0.00 C ATOM 2100 CD GLU A 136 -4.008 15.081 -13.565 1.00 0.00 C ATOM 2101 OE1 GLU A 136 -3.036 15.856 -13.419 1.00 0.00 O ATOM 2102 OE2 GLU A 136 -4.628 14.555 -12.611 1.00 0.00 O ATOM 0 H GLU A 136 -4.212 12.705 -13.154 1.00 0.00 H new ATOM 0 HA GLU A 136 -4.872 11.883 -15.827 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -2.512 13.589 -14.992 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -3.345 13.575 -16.534 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -4.234 15.518 -15.667 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -5.421 14.390 -15.044 1.00 0.00 H new ATOM 2109 N GLY A 137 -2.596 10.241 -14.366 1.00 0.00 N ATOM 2110 CA GLY A 137 -1.654 9.135 -14.484 1.00 0.00 C ATOM 2111 C GLY A 137 -0.222 9.493 -14.084 1.00 0.00 C ATOM 2112 O GLY A 137 0.671 8.660 -14.244 1.00 0.00 O ATOM 0 H GLY A 137 -2.956 10.362 -13.419 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -1.999 8.309 -13.861 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -1.654 8.779 -15.514 1.00 0.00 H new ATOM 2116 N ASN A 138 0.037 10.689 -13.540 1.00 0.00 N ATOM 2117 CA ASN A 138 1.376 11.036 -13.059 1.00 0.00 C ATOM 2118 C ASN A 138 1.670 10.223 -11.805 1.00 0.00 C ATOM 2119 O ASN A 138 0.988 10.395 -10.794 1.00 0.00 O ATOM 2120 CB ASN A 138 1.542 12.512 -12.702 1.00 0.00 C ATOM 2121 CG ASN A 138 1.292 13.457 -13.865 1.00 0.00 C ATOM 2122 OD1 ASN A 138 2.198 13.774 -14.626 1.00 0.00 O ATOM 2123 ND2 ASN A 138 0.065 13.928 -14.017 1.00 0.00 N ATOM 0 H ASN A 138 -0.658 11.426 -13.423 1.00 0.00 H new ATOM 0 HA ASN A 138 2.063 10.817 -13.876 1.00 0.00 H new ATOM 0 HB2 ASN A 138 0.856 12.759 -11.891 1.00 0.00 H new ATOM 0 HB3 ASN A 138 2.552 12.674 -12.326 1.00 0.00 H new ATOM 0 HD21 ASN A 138 -0.144 14.570 -14.781 1.00 0.00 H new ATOM 0 HD22 ASN A 138 -0.672 13.649 -13.370 1.00 0.00 H new ATOM 2130 N THR A 139 2.652 9.331 -11.861 1.00 0.00 N ATOM 2131 CA THR A 139 2.988 8.428 -10.764 1.00 0.00 C ATOM 2132 C THR A 139 3.595 9.242 -9.618 1.00 0.00 C ATOM 2133 O THR A 139 4.370 10.170 -9.857 1.00 0.00 O ATOM 2134 CB THR A 139 3.976 7.363 -11.260 1.00 0.00 C ATOM 2135 OG1 THR A 139 3.659 6.934 -12.573 1.00 0.00 O ATOM 2136 CG2 THR A 139 4.015 6.131 -10.344 1.00 0.00 C ATOM 0 H THR A 139 3.247 9.212 -12.681 1.00 0.00 H new ATOM 0 HA THR A 139 2.092 7.923 -10.403 1.00 0.00 H new ATOM 0 HB THR A 139 4.955 7.841 -11.252 1.00 0.00 H new ATOM 0 HG1 THR A 139 4.307 6.257 -12.861 1.00 0.00 H new ATOM 0 HG21 THR A 139 4.729 5.407 -10.738 1.00 0.00 H new ATOM 0 HG22 THR A 139 4.320 6.432 -9.342 1.00 0.00 H new ATOM 0 HG23 THR A 139 3.025 5.678 -10.301 1.00 0.00 H new ATOM 2144 N ILE A 140 3.261 8.872 -8.383 1.00 0.00 N ATOM 2145 CA ILE A 140 3.650 9.583 -7.169 1.00 0.00 C ATOM 2146 C ILE A 140 4.057 8.654 -6.022 1.00 0.00 C ATOM 2147 O ILE A 140 4.991 8.968 -5.288 1.00 0.00 O ATOM 2148 CB ILE A 140 2.583 10.590 -6.722 1.00 0.00 C ATOM 2149 CG1 ILE A 140 1.147 10.017 -6.694 1.00 0.00 C ATOM 2150 CG2 ILE A 140 2.775 11.895 -7.535 1.00 0.00 C ATOM 2151 CD1 ILE A 140 0.091 11.044 -7.076 1.00 0.00 C ATOM 0 H ILE A 140 2.695 8.044 -8.195 1.00 0.00 H new ATOM 0 HA ILE A 140 4.545 10.145 -7.437 1.00 0.00 H new ATOM 0 HB ILE A 140 2.727 10.834 -5.669 1.00 0.00 H new ATOM 0 HG12 ILE A 140 1.086 9.170 -7.377 1.00 0.00 H new ATOM 0 HG13 ILE A 140 0.932 9.637 -5.695 1.00 0.00 H new ATOM 0 HG21 ILE A 140 2.025 12.626 -7.232 1.00 0.00 H new ATOM 0 HG22 ILE A 140 3.770 12.297 -7.347 1.00 0.00 H new ATOM 0 HG23 ILE A 140 2.665 11.681 -8.598 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -0.896 10.583 -7.038 1.00 0.00 H new ATOM 0 HD12 ILE A 140 0.128 11.880 -6.378 1.00 0.00 H new ATOM 0 HD13 ILE A 140 0.284 11.406 -8.086 1.00 0.00 H new ATOM 2163 N LEU A 141 3.371 7.525 -5.856 1.00 0.00 N ATOM 2164 CA LEU A 141 3.579 6.577 -4.756 1.00 0.00 C ATOM 2165 C LEU A 141 3.619 5.167 -5.357 1.00 0.00 C ATOM 2166 O LEU A 141 2.968 4.911 -6.370 1.00 0.00 O ATOM 2167 CB LEU A 141 2.472 6.849 -3.704 1.00 0.00 C ATOM 2168 CG LEU A 141 2.366 5.998 -2.420 1.00 0.00 C ATOM 2169 CD1 LEU A 141 1.756 4.609 -2.610 1.00 0.00 C ATOM 2170 CD2 LEU A 141 3.711 5.897 -1.701 1.00 0.00 C ATOM 0 H LEU A 141 2.634 7.234 -6.499 1.00 0.00 H new ATOM 0 HA LEU A 141 4.525 6.689 -4.227 1.00 0.00 H new ATOM 0 HB2 LEU A 141 2.578 7.887 -3.390 1.00 0.00 H new ATOM 0 HB3 LEU A 141 1.515 6.768 -4.220 1.00 0.00 H new ATOM 0 HG LEU A 141 1.658 6.543 -1.795 1.00 0.00 H new ATOM 0 HD11 LEU A 141 1.725 4.091 -1.652 1.00 0.00 H new ATOM 0 HD12 LEU A 141 0.744 4.707 -3.002 1.00 0.00 H new ATOM 0 HD13 LEU A 141 2.364 4.038 -3.312 1.00 0.00 H new ATOM 0 HD21 LEU A 141 3.598 5.291 -0.802 1.00 0.00 H new ATOM 0 HD22 LEU A 141 4.443 5.433 -2.362 1.00 0.00 H new ATOM 0 HD23 LEU A 141 4.052 6.895 -1.425 1.00 0.00 H new ATOM 2182 N GLN A 142 4.408 4.253 -4.788 1.00 0.00 N ATOM 2183 CA GLN A 142 4.496 2.860 -5.218 1.00 0.00 C ATOM 2184 C GLN A 142 4.800 1.985 -3.996 1.00 0.00 C ATOM 2185 O GLN A 142 5.315 2.475 -2.989 1.00 0.00 O ATOM 2186 CB GLN A 142 5.501 2.760 -6.380 1.00 0.00 C ATOM 2187 CG GLN A 142 5.782 1.366 -6.972 1.00 0.00 C ATOM 2188 CD GLN A 142 6.805 0.523 -6.219 1.00 0.00 C ATOM 2189 OE1 GLN A 142 7.548 1.005 -5.367 1.00 0.00 O ATOM 2190 NE2 GLN A 142 6.862 -0.758 -6.519 1.00 0.00 N ATOM 0 H GLN A 142 5.016 4.468 -3.998 1.00 0.00 H new ATOM 0 HA GLN A 142 3.555 2.482 -5.618 1.00 0.00 H new ATOM 0 HB2 GLN A 142 5.144 3.400 -7.187 1.00 0.00 H new ATOM 0 HB3 GLN A 142 6.449 3.176 -6.039 1.00 0.00 H new ATOM 0 HG2 GLN A 142 4.843 0.813 -7.014 1.00 0.00 H new ATOM 0 HG3 GLN A 142 6.126 1.490 -7.999 1.00 0.00 H new ATOM 0 HE21 GLN A 142 6.239 -1.144 -7.228 1.00 0.00 H new ATOM 0 HE22 GLN A 142 7.529 -1.364 -6.042 1.00 0.00 H new ATOM 2199 N THR A 143 4.401 0.715 -4.060 1.00 0.00 N ATOM 2200 CA THR A 143 4.525 -0.258 -2.979 1.00 0.00 C ATOM 2201 C THR A 143 5.934 -0.851 -3.018 1.00 0.00 C ATOM 2202 O THR A 143 6.248 -1.570 -3.965 1.00 0.00 O ATOM 2203 CB THR A 143 3.440 -1.332 -3.150 1.00 0.00 C ATOM 2204 OG1 THR A 143 2.169 -0.716 -3.246 1.00 0.00 O ATOM 2205 CG2 THR A 143 3.392 -2.316 -1.977 1.00 0.00 C ATOM 0 H THR A 143 3.968 0.323 -4.896 1.00 0.00 H new ATOM 0 HA THR A 143 4.380 0.209 -2.005 1.00 0.00 H new ATOM 0 HB THR A 143 3.690 -1.883 -4.057 1.00 0.00 H new ATOM 0 HG1 THR A 143 2.071 -0.304 -4.130 1.00 0.00 H new ATOM 0 HG21 THR A 143 2.607 -3.052 -2.152 1.00 0.00 H new ATOM 0 HG22 THR A 143 4.353 -2.823 -1.888 1.00 0.00 H new ATOM 0 HG23 THR A 143 3.182 -1.773 -1.055 1.00 0.00 H new ATOM 2213 N PRO A 144 6.794 -0.622 -2.011 1.00 0.00 N ATOM 2214 CA PRO A 144 8.169 -1.061 -2.097 1.00 0.00 C ATOM 2215 C PRO A 144 8.227 -2.577 -2.215 1.00 0.00 C ATOM 2216 O PRO A 144 7.490 -3.318 -1.553 1.00 0.00 O ATOM 2217 CB PRO A 144 8.864 -0.582 -0.842 1.00 0.00 C ATOM 2218 CG PRO A 144 7.714 -0.529 0.170 1.00 0.00 C ATOM 2219 CD PRO A 144 6.489 -0.159 -0.672 1.00 0.00 C ATOM 0 HA PRO A 144 8.662 -0.652 -2.979 1.00 0.00 H new ATOM 0 HB2 PRO A 144 9.651 -1.267 -0.527 1.00 0.00 H new ATOM 0 HB3 PRO A 144 9.328 0.394 -0.982 1.00 0.00 H new ATOM 0 HG2 PRO A 144 7.579 -1.488 0.670 1.00 0.00 H new ATOM 0 HG3 PRO A 144 7.901 0.212 0.947 1.00 0.00 H new ATOM 0 HD2 PRO A 144 5.588 -0.636 -0.286 1.00 0.00 H new ATOM 0 HD3 PRO A 144 6.312 0.916 -0.658 1.00 0.00 H new ATOM 2227 N GLN A 145 9.189 -3.035 -3.006 1.00 0.00 N ATOM 2228 CA GLN A 145 9.256 -4.432 -3.312 1.00 0.00 C ATOM 2229 C GLN A 145 9.940 -5.156 -2.163 1.00 0.00 C ATOM 2230 O GLN A 145 11.105 -4.918 -1.853 1.00 0.00 O ATOM 2231 CB GLN A 145 9.975 -4.647 -4.654 1.00 0.00 C ATOM 2232 CG GLN A 145 9.202 -3.982 -5.808 1.00 0.00 C ATOM 2233 CD GLN A 145 9.781 -4.305 -7.185 1.00 0.00 C ATOM 2234 OE1 GLN A 145 10.971 -4.571 -7.336 1.00 0.00 O ATOM 2235 NE2 GLN A 145 8.954 -4.283 -8.212 1.00 0.00 N ATOM 0 H GLN A 145 9.915 -2.460 -3.434 1.00 0.00 H new ATOM 0 HA GLN A 145 8.254 -4.846 -3.423 1.00 0.00 H new ATOM 0 HB2 GLN A 145 10.982 -4.234 -4.601 1.00 0.00 H new ATOM 0 HB3 GLN A 145 10.078 -5.715 -4.848 1.00 0.00 H new ATOM 0 HG2 GLN A 145 8.162 -4.305 -5.774 1.00 0.00 H new ATOM 0 HG3 GLN A 145 9.205 -2.902 -5.664 1.00 0.00 H new ATOM 0 HE21 GLN A 145 7.969 -4.060 -8.069 1.00 0.00 H new ATOM 0 HE22 GLN A 145 9.299 -4.489 -9.149 1.00 0.00 H new ATOM 2244 N ASN A 146 9.132 -5.969 -1.494 1.00 0.00 N ATOM 2245 CA ASN A 146 9.283 -6.960 -0.427 1.00 0.00 C ATOM 2246 C ASN A 146 7.944 -7.478 0.089 1.00 0.00 C ATOM 2247 O ASN A 146 7.941 -8.437 0.857 1.00 0.00 O ATOM 2248 CB ASN A 146 10.442 -6.860 0.590 1.00 0.00 C ATOM 2249 CG ASN A 146 11.760 -7.437 0.086 1.00 0.00 C ATOM 2250 OD1 ASN A 146 11.982 -8.635 0.250 1.00 0.00 O ATOM 2251 ND2 ASN A 146 12.650 -6.672 -0.509 1.00 0.00 N ATOM 0 H ASN A 146 8.144 -5.937 -1.746 1.00 0.00 H new ATOM 0 HA ASN A 146 9.753 -7.779 -0.972 1.00 0.00 H new ATOM 0 HB2 ASN A 146 10.592 -5.813 0.852 1.00 0.00 H new ATOM 0 HB3 ASN A 146 10.156 -7.380 1.504 1.00 0.00 H new ATOM 0 HD21 ASN A 146 13.529 -7.072 -0.837 1.00 0.00 H new ATOM 0 HD22 ASN A 146 12.461 -5.679 -0.643 1.00 0.00 H new ATOM 2258 N ALA A 147 6.837 -6.824 -0.297 1.00 0.00 N ATOM 2259 CA ALA A 147 5.457 -7.171 0.020 1.00 0.00 C ATOM 2260 C ALA A 147 5.087 -8.539 -0.584 1.00 0.00 C ATOM 2261 O ALA A 147 4.386 -8.651 -1.595 1.00 0.00 O ATOM 2262 CB ALA A 147 4.546 -6.021 -0.440 1.00 0.00 C ATOM 0 H ALA A 147 6.894 -5.986 -0.876 1.00 0.00 H new ATOM 0 HA ALA A 147 5.322 -7.287 1.095 1.00 0.00 H new ATOM 0 HB1 ALA A 147 3.509 -6.264 -0.210 1.00 0.00 H new ATOM 0 HB2 ALA A 147 4.827 -5.104 0.079 1.00 0.00 H new ATOM 0 HB3 ALA A 147 4.655 -5.878 -1.515 1.00 0.00 H new ATOM 2268 N ILE A 148 5.602 -9.583 0.064 1.00 0.00 N ATOM 2269 CA ILE A 148 5.424 -10.992 -0.227 1.00 0.00 C ATOM 2270 C ILE A 148 4.762 -11.579 1.007 1.00 0.00 C ATOM 2271 O ILE A 148 5.089 -11.203 2.135 1.00 0.00 O ATOM 2272 CB ILE A 148 6.782 -11.682 -0.522 1.00 0.00 C ATOM 2273 CG1 ILE A 148 7.499 -11.001 -1.717 1.00 0.00 C ATOM 2274 CG2 ILE A 148 6.666 -13.217 -0.660 1.00 0.00 C ATOM 2275 CD1 ILE A 148 7.935 -11.929 -2.854 1.00 0.00 C ATOM 0 H ILE A 148 6.205 -9.445 0.875 1.00 0.00 H new ATOM 0 HA ILE A 148 4.815 -11.144 -1.118 1.00 0.00 H new ATOM 0 HB ILE A 148 7.419 -11.539 0.351 1.00 0.00 H new ATOM 0 HG12 ILE A 148 6.835 -10.241 -2.129 1.00 0.00 H new ATOM 0 HG13 ILE A 148 8.380 -10.483 -1.339 1.00 0.00 H new ATOM 0 HG21 ILE A 148 7.650 -13.639 -0.866 1.00 0.00 H new ATOM 0 HG22 ILE A 148 6.277 -13.637 0.268 1.00 0.00 H new ATOM 0 HG23 ILE A 148 5.989 -13.459 -1.479 1.00 0.00 H new ATOM 0 HD11 ILE A 148 8.424 -11.345 -3.633 1.00 0.00 H new ATOM 0 HD12 ILE A 148 8.630 -12.675 -2.469 1.00 0.00 H new ATOM 0 HD13 ILE A 148 7.061 -12.429 -3.271 1.00 0.00 H new ATOM 2287 N PHE A 149 3.900 -12.553 0.772 1.00 0.00 N ATOM 2288 CA PHE A 149 3.234 -13.344 1.787 1.00 0.00 C ATOM 2289 C PHE A 149 3.496 -14.810 1.441 1.00 0.00 C ATOM 2290 O PHE A 149 3.977 -15.134 0.349 1.00 0.00 O ATOM 2291 CB PHE A 149 1.726 -13.056 1.886 1.00 0.00 C ATOM 2292 CG PHE A 149 1.226 -11.629 1.736 1.00 0.00 C ATOM 2293 CD1 PHE A 149 1.345 -10.965 0.499 1.00 0.00 C ATOM 2294 CD2 PHE A 149 0.480 -11.031 2.770 1.00 0.00 C ATOM 2295 CE1 PHE A 149 0.712 -9.732 0.292 1.00 0.00 C ATOM 2296 CE2 PHE A 149 -0.200 -9.823 2.541 1.00 0.00 C ATOM 2297 CZ PHE A 149 -0.105 -9.187 1.291 1.00 0.00 C ATOM 0 H PHE A 149 3.635 -12.825 -0.175 1.00 0.00 H new ATOM 0 HA PHE A 149 3.632 -13.087 2.769 1.00 0.00 H new ATOM 0 HB2 PHE A 149 1.228 -13.658 1.126 1.00 0.00 H new ATOM 0 HB3 PHE A 149 1.387 -13.421 2.855 1.00 0.00 H new ATOM 0 HD1 PHE A 149 1.928 -11.409 -0.295 1.00 0.00 H new ATOM 0 HD2 PHE A 149 0.431 -11.502 3.741 1.00 0.00 H new ATOM 0 HE1 PHE A 149 0.854 -9.202 -0.638 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -0.796 -9.383 3.326 1.00 0.00 H new ATOM 0 HZ PHE A 149 -0.660 -8.280 1.101 1.00 0.00 H new ATOM 2307 N PHE A 150 3.162 -15.709 2.358 1.00 0.00 N ATOM 2308 CA PHE A 150 3.457 -17.124 2.266 1.00 0.00 C ATOM 2309 C PHE A 150 2.225 -17.895 2.707 1.00 0.00 C ATOM 2310 O PHE A 150 1.873 -17.846 3.884 1.00 0.00 O ATOM 2311 CB PHE A 150 4.663 -17.393 3.179 1.00 0.00 C ATOM 2312 CG PHE A 150 5.952 -16.778 2.663 1.00 0.00 C ATOM 2313 CD1 PHE A 150 6.257 -15.437 2.965 1.00 0.00 C ATOM 2314 CD2 PHE A 150 6.805 -17.510 1.818 1.00 0.00 C ATOM 2315 CE1 PHE A 150 7.386 -14.816 2.411 1.00 0.00 C ATOM 2316 CE2 PHE A 150 7.937 -16.890 1.257 1.00 0.00 C ATOM 2317 CZ PHE A 150 8.213 -15.539 1.534 1.00 0.00 C ATOM 0 H PHE A 150 2.662 -15.460 3.212 1.00 0.00 H new ATOM 0 HA PHE A 150 3.703 -17.439 1.252 1.00 0.00 H new ATOM 0 HB2 PHE A 150 4.453 -16.999 4.173 1.00 0.00 H new ATOM 0 HB3 PHE A 150 4.798 -18.469 3.284 1.00 0.00 H new ATOM 0 HD1 PHE A 150 5.614 -14.880 3.631 1.00 0.00 H new ATOM 0 HD2 PHE A 150 6.592 -18.546 1.600 1.00 0.00 H new ATOM 0 HE1 PHE A 150 7.618 -13.790 2.656 1.00 0.00 H new ATOM 0 HE2 PHE A 150 8.595 -17.453 0.612 1.00 0.00 H new ATOM 0 HZ PHE A 150 9.062 -15.056 1.072 1.00 0.00 H new ATOM 2327 N LYS A 151 1.572 -18.630 1.803 1.00 0.00 N ATOM 2328 CA LYS A 151 0.398 -19.412 2.171 1.00 0.00 C ATOM 2329 C LYS A 151 0.842 -20.847 2.369 1.00 0.00 C ATOM 2330 O LYS A 151 1.385 -21.468 1.462 1.00 0.00 O ATOM 2331 CB LYS A 151 -0.758 -19.312 1.161 1.00 0.00 C ATOM 2332 CG LYS A 151 -2.038 -19.714 1.918 1.00 0.00 C ATOM 2333 CD LYS A 151 -3.296 -19.869 1.060 1.00 0.00 C ATOM 2334 CE LYS A 151 -4.486 -19.744 2.020 1.00 0.00 C ATOM 2335 NZ LYS A 151 -5.793 -20.090 1.427 1.00 0.00 N ATOM 0 H LYS A 151 1.836 -18.697 0.820 1.00 0.00 H new ATOM 0 HA LYS A 151 -0.013 -19.002 3.094 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -0.842 -18.299 0.767 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -0.588 -19.972 0.310 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -1.853 -20.657 2.432 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -2.234 -18.966 2.686 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -3.337 -19.102 0.287 1.00 0.00 H new ATOM 0 HD3 LYS A 151 -3.305 -20.834 0.552 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -4.310 -20.389 2.881 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -4.530 -18.720 2.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 -6.555 -19.671 1.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 -5.843 -19.719 0.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 -5.903 -21.124 1.409 1.00 0.00 H new ATOM 2349 N THR A 152 0.575 -21.376 3.548 1.00 0.00 N ATOM 2350 CA THR A 152 0.803 -22.760 3.888 1.00 0.00 C ATOM 2351 C THR A 152 -0.429 -23.487 3.367 1.00 0.00 C ATOM 2352 O THR A 152 -1.528 -23.173 3.829 1.00 0.00 O ATOM 2353 CB THR A 152 0.886 -22.861 5.419 1.00 0.00 C ATOM 2354 OG1 THR A 152 1.840 -21.945 5.927 1.00 0.00 O ATOM 2355 CG2 THR A 152 1.204 -24.264 5.929 1.00 0.00 C ATOM 0 H THR A 152 0.181 -20.834 4.317 1.00 0.00 H new ATOM 0 HA THR A 152 1.719 -23.177 3.468 1.00 0.00 H new ATOM 0 HB THR A 152 -0.110 -22.612 5.785 1.00 0.00 H new ATOM 0 HG1 THR A 152 1.879 -22.021 6.903 1.00 0.00 H new ATOM 0 HG21 THR A 152 1.246 -24.254 7.018 1.00 0.00 H new ATOM 0 HG22 THR A 152 0.427 -24.955 5.602 1.00 0.00 H new ATOM 0 HG23 THR A 152 2.167 -24.586 5.532 1.00 0.00 H new ATOM 2363 N CYS A 153 -0.275 -24.394 2.405 1.00 0.00 N ATOM 2364 CA CYS A 153 -1.361 -25.225 1.904 1.00 0.00 C ATOM 2365 C CYS A 153 -1.075 -26.683 2.254 1.00 0.00 C ATOM 2366 O CYS A 153 0.050 -27.042 2.606 1.00 0.00 O ATOM 2367 CB CYS A 153 -1.555 -25.061 0.394 1.00 0.00 C ATOM 2368 SG CYS A 153 -1.653 -23.394 -0.273 1.00 0.00 S ATOM 0 H CYS A 153 0.619 -24.573 1.948 1.00 0.00 H new ATOM 0 HA CYS A 153 -2.289 -24.906 2.379 1.00 0.00 H new ATOM 0 HB2 CYS A 153 -0.731 -25.572 -0.105 1.00 0.00 H new ATOM 0 HB3 CYS A 153 -2.470 -25.585 0.117 1.00 0.00 H new ATOM 2373 N LEU A 154 -2.104 -27.517 2.143 1.00 0.00 N ATOM 2374 CA LEU A 154 -2.031 -28.952 2.315 1.00 0.00 C ATOM 2375 C LEU A 154 -2.970 -29.601 1.304 1.00 0.00 C ATOM 2376 O LEU A 154 -3.872 -28.927 0.790 1.00 0.00 O ATOM 2377 CB LEU A 154 -2.310 -29.327 3.780 1.00 0.00 C ATOM 2378 CG LEU A 154 -3.675 -28.941 4.380 1.00 0.00 C ATOM 2379 CD1 LEU A 154 -4.811 -29.886 3.982 1.00 0.00 C ATOM 2380 CD2 LEU A 154 -3.552 -28.952 5.910 1.00 0.00 C ATOM 0 H LEU A 154 -3.045 -27.193 1.922 1.00 0.00 H new ATOM 0 HA LEU A 154 -1.030 -29.333 2.113 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -2.197 -30.407 3.875 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -1.534 -28.870 4.395 1.00 0.00 H new ATOM 0 HG LEU A 154 -3.927 -27.955 3.989 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -5.741 -29.551 4.442 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -4.922 -29.886 2.898 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -4.581 -30.895 4.323 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -4.510 -28.681 6.354 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -3.266 -29.949 6.245 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -2.792 -28.234 6.219 1.00 0.00 H new ATOM 2392 N GLN A 155 -2.748 -30.880 1.024 1.00 0.00 N ATOM 2393 CA GLN A 155 -3.593 -31.694 0.168 1.00 0.00 C ATOM 2394 C GLN A 155 -4.936 -31.974 0.852 1.00 0.00 C ATOM 2395 O GLN A 155 -4.963 -32.525 1.955 1.00 0.00 O ATOM 2396 CB GLN A 155 -2.872 -33.004 -0.175 1.00 0.00 C ATOM 2397 CG GLN A 155 -3.741 -33.915 -1.067 1.00 0.00 C ATOM 2398 CD GLN A 155 -4.100 -35.248 -0.405 1.00 0.00 C ATOM 2399 OE1 GLN A 155 -3.879 -36.316 -0.963 1.00 0.00 O ATOM 2400 NE2 GLN A 155 -4.685 -35.226 0.785 1.00 0.00 N ATOM 0 H GLN A 155 -1.950 -31.392 1.400 1.00 0.00 H new ATOM 0 HA GLN A 155 -3.793 -31.152 -0.756 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -1.935 -32.781 -0.685 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -2.617 -33.531 0.744 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -4.659 -33.388 -1.327 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -3.211 -34.111 -1.999 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -4.868 -34.335 1.247 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -4.952 -36.100 1.238 1.00 0.00 H new ATOM 2409 N ALA A 156 -6.046 -31.688 0.171 1.00 0.00 N ATOM 2410 CA ALA A 156 -7.399 -31.975 0.632 1.00 0.00 C ATOM 2411 C ALA A 156 -8.363 -32.096 -0.552 1.00 0.00 C ATOM 2412 O ALA A 156 -8.577 -31.122 -1.274 1.00 0.00 O ATOM 2413 CB ALA A 156 -7.872 -30.861 1.577 1.00 0.00 C ATOM 0 H ALA A 156 -6.025 -31.237 -0.744 1.00 0.00 H new ATOM 0 HA ALA A 156 -7.388 -32.925 1.166 1.00 0.00 H new ATOM 0 HB1 ALA A 156 -8.884 -31.079 1.919 1.00 0.00 H new ATOM 0 HB2 ALA A 156 -7.203 -30.804 2.436 1.00 0.00 H new ATOM 0 HB3 ALA A 156 -7.866 -29.908 1.048 1.00 0.00 H new ATOM 2419 N GLU A 157 -8.937 -33.282 -0.738 1.00 0.00 N ATOM 2420 CA GLU A 157 -9.973 -33.656 -1.682 1.00 0.00 C ATOM 2421 C GLU A 157 -10.847 -34.672 -0.946 1.00 0.00 C ATOM 2422 O GLU A 157 -12.070 -34.675 -1.192 1.00 0.00 O ATOM 2423 CB GLU A 157 -9.324 -34.242 -2.943 1.00 0.00 C ATOM 2424 CG GLU A 157 -10.334 -34.436 -4.094 1.00 0.00 C ATOM 2425 CD GLU A 157 -9.670 -34.548 -5.477 1.00 0.00 C ATOM 2426 OE1 GLU A 157 -8.634 -35.238 -5.649 1.00 0.00 O ATOM 2427 OE2 GLU A 157 -10.101 -33.848 -6.429 1.00 0.00 O ATOM 2428 OXT GLU A 157 -10.272 -35.387 -0.089 1.00 0.00 O ATOM 0 H GLU A 157 -8.655 -34.082 -0.171 1.00 0.00 H new ATOM 0 HA GLU A 157 -10.578 -32.812 -2.014 1.00 0.00 H new ATOM 0 HB2 GLU A 157 -8.523 -33.582 -3.275 1.00 0.00 H new ATOM 0 HB3 GLU A 157 -8.867 -35.201 -2.700 1.00 0.00 H new ATOM 0 HG2 GLU A 157 -10.919 -35.336 -3.906 1.00 0.00 H new ATOM 0 HG3 GLU A 157 -11.031 -33.598 -4.101 1.00 0.00 H new