USER MOD reduce.3.24.130724 H: found=0, std=0, add=863, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 864 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 98 ASN : amide:sc= -0.205 K(o=-0.53,f=-3!) USER MOD Set 1.2: A 99 ASN :FLIP amide:sc= -0.327 F(o=-1.8,f=-0.53) USER MOD Set 2.1: A 50 ASN : amide:sc= -0.855 K(o=-0.84,f=-3.1!) USER MOD Set 2.2: A 53 GLN :FLIP amide:sc= 0.014 F(o=-2.4,f=-0.84) USER MOD Set 3.1: A 42 THR OG1 : rot -68:sc= 0.871 USER MOD Set 3.2: A 43 CYS SG : rot 180:sc= -0.371 USER MOD Set 4.1: A 39 ASN : amide:sc= 0.243 X(o=0.64,f=0.18) USER MOD Set 4.2: A 54 TYR OH : rot 28:sc= 0.402 USER MOD Set 5.1: A 36 TYR OH : rot 180:sc= -0.0615 USER MOD Set 5.2: A 85 MET CE :methyl -142:sc= -0.959 (180deg=-0.161) USER MOD Single : A 28 THR OG1 : rot 168:sc= 0.0439 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 149:sc= 0.294 (180deg=-1.22!) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0.434 X(o=0.43,f=0) USER MOD Single : A 60 THR OG1 : rot 91:sc= 1.2 USER MOD Single : A 61 MET CE :methyl -139:sc= -0.116 (180deg=-1.02) USER MOD Single : A 64 THR OG1 : rot 170:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.105) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot -25:sc= 0.205 USER MOD Single : A 69 MET CE :methyl -152:sc= -1.23 (180deg=-2.9) USER MOD Single : A 79 ASN :FLIP amide:sc= 0 F(o=-1.7,f=0) USER MOD Single : A 88 CYS SG : rot 60:sc= -2.85! USER MOD Single : A 93 ASN : amide:sc= 0.157 K(o=0.16,f=-1.3) USER MOD Single : A 103 GLN :FLIP amide:sc= -0.0131 F(o=-1.8,f=-0.013) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 158:sc= 0.953 (180deg=0.295) USER MOD Single : A 113 HIS : no HE2:sc= 0.0115 K(o=0.012,f=-0.73) USER MOD Single : A 114 SER OG : rot 41:sc= 0.229 USER MOD Single : A 116 THR OG1 : rot 150:sc= 0 USER MOD Single : A 123 SER OG : rot -160:sc= -0.914 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 CYS SG : rot 176:sc= -2.75 USER MOD Single : A 135 CYS SG : rot -18:sc= 0.0124 USER MOD ----------------------------------------------------------------- ATOM 130 N ALA A 27 8.830 -14.103 -11.874 1.00 0.00 N ATOM 131 CA ALA A 27 8.215 -15.344 -11.383 1.00 0.00 C ATOM 132 C ALA A 27 8.557 -16.561 -12.278 1.00 0.00 C ATOM 133 O ALA A 27 8.649 -17.686 -11.775 1.00 0.00 O ATOM 134 CB ALA A 27 6.687 -15.157 -11.280 1.00 0.00 C ATOM 0 HA ALA A 27 8.625 -15.554 -10.395 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.231 -16.078 -10.916 1.00 0.00 H new ATOM 0 HB2 ALA A 27 6.466 -14.344 -10.588 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.283 -14.917 -12.263 1.00 0.00 H new ATOM 140 N THR A 28 8.747 -16.324 -13.598 1.00 0.00 N ATOM 141 CA THR A 28 9.029 -17.396 -14.574 1.00 0.00 C ATOM 142 C THR A 28 10.545 -17.678 -14.662 1.00 0.00 C ATOM 143 O THR A 28 11.350 -16.741 -14.709 1.00 0.00 O ATOM 144 CB THR A 28 8.485 -17.032 -15.990 1.00 0.00 C ATOM 145 OG1 THR A 28 7.204 -16.394 -15.861 1.00 0.00 O ATOM 146 CG2 THR A 28 8.343 -18.286 -16.890 1.00 0.00 C ATOM 0 H THR A 28 8.709 -15.392 -14.010 1.00 0.00 H new ATOM 0 HA THR A 28 8.519 -18.293 -14.223 1.00 0.00 H new ATOM 0 HB THR A 28 9.200 -16.357 -16.460 1.00 0.00 H new ATOM 0 HG1 THR A 28 6.948 -15.997 -16.720 1.00 0.00 H new ATOM 0 HG21 THR A 28 7.961 -17.991 -17.867 1.00 0.00 H new ATOM 0 HG22 THR A 28 9.317 -18.761 -17.009 1.00 0.00 H new ATOM 0 HG23 THR A 28 7.651 -18.989 -16.427 1.00 0.00 H new ATOM 154 N SER A 29 10.912 -18.974 -14.705 1.00 0.00 N ATOM 155 CA SER A 29 12.314 -19.428 -14.711 1.00 0.00 C ATOM 156 C SER A 29 12.917 -19.384 -16.145 1.00 0.00 C ATOM 157 O SER A 29 12.243 -19.773 -17.109 1.00 0.00 O ATOM 158 CB SER A 29 12.390 -20.855 -14.130 1.00 0.00 C ATOM 159 OG SER A 29 11.910 -20.903 -12.793 1.00 0.00 O ATOM 0 H SER A 29 10.238 -19.739 -14.737 1.00 0.00 H new ATOM 0 HA SER A 29 12.904 -18.753 -14.091 1.00 0.00 H new ATOM 0 HB2 SER A 29 11.805 -21.533 -14.752 1.00 0.00 H new ATOM 0 HB3 SER A 29 13.422 -21.206 -14.159 1.00 0.00 H new ATOM 0 HG SER A 29 11.971 -21.821 -12.456 1.00 0.00 H new ATOM 165 N PRO A 30 14.221 -18.960 -16.291 1.00 0.00 N ATOM 166 CA PRO A 30 14.873 -18.713 -17.613 1.00 0.00 C ATOM 167 C PRO A 30 15.173 -19.980 -18.435 1.00 0.00 C ATOM 168 O PRO A 30 15.614 -19.865 -19.578 1.00 0.00 O ATOM 169 CB PRO A 30 16.189 -17.995 -17.214 1.00 0.00 C ATOM 170 CG PRO A 30 16.505 -18.561 -15.880 1.00 0.00 C ATOM 171 CD PRO A 30 15.174 -18.690 -15.179 1.00 0.00 C ATOM 0 HA PRO A 30 14.216 -18.144 -18.271 1.00 0.00 H new ATOM 0 HB2 PRO A 30 16.986 -18.191 -17.931 1.00 0.00 H new ATOM 0 HB3 PRO A 30 16.058 -16.914 -17.170 1.00 0.00 H new ATOM 0 HG2 PRO A 30 16.998 -19.529 -15.970 1.00 0.00 H new ATOM 0 HG3 PRO A 30 17.180 -17.909 -15.326 1.00 0.00 H new ATOM 0 HD2 PRO A 30 15.181 -19.501 -14.450 1.00 0.00 H new ATOM 0 HD3 PRO A 30 14.914 -17.779 -14.640 1.00 0.00 H new ATOM 179 N LYS A 31 14.928 -21.174 -17.860 1.00 0.00 N ATOM 180 CA LYS A 31 15.232 -22.455 -18.529 1.00 0.00 C ATOM 181 C LYS A 31 14.057 -22.771 -19.455 1.00 0.00 C ATOM 182 O LYS A 31 14.247 -23.064 -20.633 1.00 0.00 O ATOM 183 CB LYS A 31 15.489 -23.581 -17.476 1.00 0.00 C ATOM 184 CG LYS A 31 16.228 -24.850 -18.004 1.00 0.00 C ATOM 185 CD LYS A 31 15.326 -25.855 -18.761 1.00 0.00 C ATOM 186 CE LYS A 31 14.266 -26.503 -17.848 1.00 0.00 C ATOM 187 NZ LYS A 31 13.486 -27.546 -18.560 1.00 0.00 N ATOM 0 H LYS A 31 14.519 -21.278 -16.931 1.00 0.00 H new ATOM 0 HA LYS A 31 16.147 -22.388 -19.118 1.00 0.00 H new ATOM 0 HB2 LYS A 31 16.071 -23.160 -16.656 1.00 0.00 H new ATOM 0 HB3 LYS A 31 14.530 -23.889 -17.060 1.00 0.00 H new ATOM 0 HG2 LYS A 31 17.034 -24.535 -18.667 1.00 0.00 H new ATOM 0 HG3 LYS A 31 16.691 -25.362 -17.160 1.00 0.00 H new ATOM 0 HD2 LYS A 31 14.827 -25.342 -19.584 1.00 0.00 H new ATOM 0 HD3 LYS A 31 15.947 -26.635 -19.201 1.00 0.00 H new ATOM 0 HE2 LYS A 31 14.755 -26.945 -16.980 1.00 0.00 H new ATOM 0 HE3 LYS A 31 13.589 -25.734 -17.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 13.194 -28.282 -17.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 12.642 -27.116 -18.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 14.074 -27.972 -19.304 1.00 0.00 H new ATOM 201 N THR A 32 12.845 -22.670 -18.877 1.00 0.00 N ATOM 202 CA THR A 32 11.567 -22.715 -19.593 1.00 0.00 C ATOM 203 C THR A 32 11.540 -21.689 -20.750 1.00 0.00 C ATOM 204 O THR A 32 11.159 -22.015 -21.898 1.00 0.00 O ATOM 205 CB THR A 32 10.430 -22.391 -18.568 1.00 0.00 C ATOM 206 OG1 THR A 32 10.342 -23.430 -17.582 1.00 0.00 O ATOM 207 CG2 THR A 32 9.068 -22.184 -19.232 1.00 0.00 C ATOM 0 H THR A 32 12.731 -22.552 -17.870 1.00 0.00 H new ATOM 0 HA THR A 32 11.427 -23.705 -20.027 1.00 0.00 H new ATOM 0 HB THR A 32 10.697 -21.448 -18.091 1.00 0.00 H new ATOM 0 HG1 THR A 32 9.629 -23.217 -16.945 1.00 0.00 H new ATOM 0 HG21 THR A 32 8.321 -21.963 -18.469 1.00 0.00 H new ATOM 0 HG22 THR A 32 9.128 -21.352 -19.933 1.00 0.00 H new ATOM 0 HG23 THR A 32 8.783 -23.090 -19.767 1.00 0.00 H new ATOM 215 N ILE A 33 11.962 -20.452 -20.406 1.00 0.00 N ATOM 216 CA ILE A 33 12.037 -19.322 -21.339 1.00 0.00 C ATOM 217 C ILE A 33 12.947 -19.668 -22.515 1.00 0.00 C ATOM 218 O ILE A 33 12.537 -19.547 -23.675 1.00 0.00 O ATOM 219 CB ILE A 33 12.529 -18.013 -20.600 1.00 0.00 C ATOM 220 CG1 ILE A 33 11.520 -17.630 -19.466 1.00 0.00 C ATOM 221 CG2 ILE A 33 12.766 -16.832 -21.578 1.00 0.00 C ATOM 222 CD1 ILE A 33 10.091 -17.426 -19.933 1.00 0.00 C ATOM 0 H ILE A 33 12.262 -20.215 -19.460 1.00 0.00 H new ATOM 0 HA ILE A 33 11.038 -19.125 -21.727 1.00 0.00 H new ATOM 0 HB ILE A 33 13.498 -18.228 -20.150 1.00 0.00 H new ATOM 0 HG12 ILE A 33 11.532 -18.413 -18.708 1.00 0.00 H new ATOM 0 HG13 ILE A 33 11.865 -16.715 -18.985 1.00 0.00 H new ATOM 0 HG21 ILE A 33 13.102 -15.959 -21.019 1.00 0.00 H new ATOM 0 HG22 ILE A 33 13.526 -17.111 -22.308 1.00 0.00 H new ATOM 0 HG23 ILE A 33 11.836 -16.596 -22.095 1.00 0.00 H new ATOM 0 HD11 ILE A 33 9.464 -17.164 -19.081 1.00 0.00 H new ATOM 0 HD12 ILE A 33 10.060 -16.621 -20.668 1.00 0.00 H new ATOM 0 HD13 ILE A 33 9.722 -18.346 -20.386 1.00 0.00 H new ATOM 234 N LEU A 34 14.149 -20.169 -22.177 1.00 0.00 N ATOM 235 CA LEU A 34 15.162 -20.593 -23.150 1.00 0.00 C ATOM 236 C LEU A 34 14.586 -21.654 -24.103 1.00 0.00 C ATOM 237 O LEU A 34 14.777 -21.549 -25.303 1.00 0.00 O ATOM 238 CB LEU A 34 16.435 -21.093 -22.393 1.00 0.00 C ATOM 239 CG LEU A 34 17.644 -21.607 -23.266 1.00 0.00 C ATOM 240 CD1 LEU A 34 19.002 -21.378 -22.566 1.00 0.00 C ATOM 241 CD2 LEU A 34 17.491 -23.101 -23.619 1.00 0.00 C ATOM 0 H LEU A 34 14.444 -20.291 -21.208 1.00 0.00 H new ATOM 0 HA LEU A 34 15.456 -19.746 -23.770 1.00 0.00 H new ATOM 0 HB2 LEU A 34 16.795 -20.278 -21.765 1.00 0.00 H new ATOM 0 HB3 LEU A 34 16.134 -21.900 -21.725 1.00 0.00 H new ATOM 0 HG LEU A 34 17.628 -21.022 -24.186 1.00 0.00 H new ATOM 0 HD11 LEU A 34 19.806 -21.747 -23.203 1.00 0.00 H new ATOM 0 HD12 LEU A 34 19.143 -20.312 -22.384 1.00 0.00 H new ATOM 0 HD13 LEU A 34 19.017 -21.913 -21.616 1.00 0.00 H new ATOM 0 HD21 LEU A 34 18.341 -23.422 -24.221 1.00 0.00 H new ATOM 0 HD22 LEU A 34 17.453 -23.689 -22.702 1.00 0.00 H new ATOM 0 HD23 LEU A 34 16.570 -23.249 -24.184 1.00 0.00 H new ATOM 253 N GLU A 35 13.848 -22.640 -23.552 1.00 0.00 N ATOM 254 CA GLU A 35 13.300 -23.776 -24.327 1.00 0.00 C ATOM 255 C GLU A 35 12.319 -23.321 -25.411 1.00 0.00 C ATOM 256 O GLU A 35 12.406 -23.787 -26.554 1.00 0.00 O ATOM 257 CB GLU A 35 12.599 -24.797 -23.404 1.00 0.00 C ATOM 258 CG GLU A 35 13.556 -25.547 -22.461 1.00 0.00 C ATOM 259 CD GLU A 35 12.830 -26.495 -21.502 1.00 0.00 C ATOM 260 OE1 GLU A 35 12.073 -26.006 -20.638 1.00 0.00 O ATOM 261 OE2 GLU A 35 13.029 -27.727 -21.582 1.00 0.00 O ATOM 0 H GLU A 35 13.615 -22.672 -22.560 1.00 0.00 H new ATOM 0 HA GLU A 35 14.152 -24.251 -24.813 1.00 0.00 H new ATOM 0 HB2 GLU A 35 11.850 -24.277 -22.807 1.00 0.00 H new ATOM 0 HB3 GLU A 35 12.068 -25.523 -24.019 1.00 0.00 H new ATOM 0 HG2 GLU A 35 14.270 -26.117 -23.055 1.00 0.00 H new ATOM 0 HG3 GLU A 35 14.129 -24.822 -21.882 1.00 0.00 H new ATOM 268 N TYR A 36 11.370 -22.423 -25.049 1.00 0.00 N ATOM 269 CA TYR A 36 10.353 -21.951 -26.016 1.00 0.00 C ATOM 270 C TYR A 36 10.982 -20.969 -27.039 1.00 0.00 C ATOM 271 O TYR A 36 10.483 -20.843 -28.168 1.00 0.00 O ATOM 272 CB TYR A 36 9.070 -21.401 -25.300 1.00 0.00 C ATOM 273 CG TYR A 36 8.992 -19.898 -24.916 1.00 0.00 C ATOM 274 CD1 TYR A 36 8.642 -18.925 -25.866 1.00 0.00 C ATOM 275 CD2 TYR A 36 9.179 -19.467 -23.607 1.00 0.00 C ATOM 276 CE1 TYR A 36 8.497 -17.601 -25.528 1.00 0.00 C ATOM 277 CE2 TYR A 36 9.017 -18.137 -23.265 1.00 0.00 C ATOM 278 CZ TYR A 36 8.681 -17.211 -24.227 1.00 0.00 C ATOM 279 OH TYR A 36 8.502 -15.894 -23.878 1.00 0.00 O ATOM 0 H TYR A 36 11.289 -22.020 -24.116 1.00 0.00 H new ATOM 0 HA TYR A 36 10.000 -22.805 -26.594 1.00 0.00 H new ATOM 0 HB2 TYR A 36 8.218 -21.618 -25.945 1.00 0.00 H new ATOM 0 HB3 TYR A 36 8.933 -21.979 -24.386 1.00 0.00 H new ATOM 0 HD1 TYR A 36 8.482 -19.226 -26.891 1.00 0.00 H new ATOM 0 HD2 TYR A 36 9.455 -20.182 -22.846 1.00 0.00 H new ATOM 0 HE1 TYR A 36 8.240 -16.872 -26.283 1.00 0.00 H new ATOM 0 HE2 TYR A 36 9.154 -17.824 -22.241 1.00 0.00 H new ATOM 0 HH TYR A 36 8.670 -15.784 -22.919 1.00 0.00 H new ATOM 289 N ILE A 37 12.093 -20.307 -26.634 1.00 0.00 N ATOM 290 CA ILE A 37 12.959 -19.527 -27.550 1.00 0.00 C ATOM 291 C ILE A 37 13.562 -20.452 -28.641 1.00 0.00 C ATOM 292 O ILE A 37 13.433 -20.170 -29.841 1.00 0.00 O ATOM 293 CB ILE A 37 14.120 -18.784 -26.754 1.00 0.00 C ATOM 294 CG1 ILE A 37 13.549 -17.616 -25.882 1.00 0.00 C ATOM 295 CG2 ILE A 37 15.251 -18.280 -27.687 1.00 0.00 C ATOM 296 CD1 ILE A 37 14.565 -16.930 -24.977 1.00 0.00 C ATOM 0 H ILE A 37 12.413 -20.299 -25.665 1.00 0.00 H new ATOM 0 HA ILE A 37 12.341 -18.768 -28.031 1.00 0.00 H new ATOM 0 HB ILE A 37 14.566 -19.523 -26.088 1.00 0.00 H new ATOM 0 HG12 ILE A 37 13.112 -16.869 -26.544 1.00 0.00 H new ATOM 0 HG13 ILE A 37 12.740 -18.006 -25.264 1.00 0.00 H new ATOM 0 HG21 ILE A 37 16.017 -17.781 -27.093 1.00 0.00 H new ATOM 0 HG22 ILE A 37 15.693 -19.126 -28.213 1.00 0.00 H new ATOM 0 HG23 ILE A 37 14.839 -17.578 -28.412 1.00 0.00 H new ATOM 0 HD11 ILE A 37 14.074 -16.136 -24.414 1.00 0.00 H new ATOM 0 HD12 ILE A 37 14.986 -17.659 -24.284 1.00 0.00 H new ATOM 0 HD13 ILE A 37 15.364 -16.504 -25.584 1.00 0.00 H new ATOM 308 N ILE A 38 14.197 -21.566 -28.200 1.00 0.00 N ATOM 309 CA ILE A 38 14.833 -22.554 -29.102 1.00 0.00 C ATOM 310 C ILE A 38 13.785 -23.118 -30.075 1.00 0.00 C ATOM 311 O ILE A 38 14.004 -23.132 -31.287 1.00 0.00 O ATOM 312 CB ILE A 38 15.513 -23.746 -28.302 1.00 0.00 C ATOM 313 CG1 ILE A 38 16.567 -23.212 -27.269 1.00 0.00 C ATOM 314 CG2 ILE A 38 16.145 -24.802 -29.256 1.00 0.00 C ATOM 315 CD1 ILE A 38 17.705 -22.386 -27.841 1.00 0.00 C ATOM 0 H ILE A 38 14.282 -21.803 -27.212 1.00 0.00 H new ATOM 0 HA ILE A 38 15.618 -22.036 -29.653 1.00 0.00 H new ATOM 0 HB ILE A 38 14.722 -24.248 -27.744 1.00 0.00 H new ATOM 0 HG12 ILE A 38 16.044 -22.608 -26.527 1.00 0.00 H new ATOM 0 HG13 ILE A 38 16.994 -24.066 -26.742 1.00 0.00 H new ATOM 0 HG21 ILE A 38 16.599 -25.599 -28.667 1.00 0.00 H new ATOM 0 HG22 ILE A 38 15.371 -25.221 -29.899 1.00 0.00 H new ATOM 0 HG23 ILE A 38 16.908 -24.326 -29.871 1.00 0.00 H new ATOM 0 HD11 ILE A 38 18.368 -22.073 -27.035 1.00 0.00 H new ATOM 0 HD12 ILE A 38 18.264 -22.985 -28.559 1.00 0.00 H new ATOM 0 HD13 ILE A 38 17.300 -21.506 -28.340 1.00 0.00 H new ATOM 327 N ASN A 39 12.625 -23.505 -29.504 1.00 0.00 N ATOM 328 CA ASN A 39 11.482 -24.075 -30.244 1.00 0.00 C ATOM 329 C ASN A 39 10.992 -23.102 -31.329 1.00 0.00 C ATOM 330 O ASN A 39 10.634 -23.526 -32.416 1.00 0.00 O ATOM 331 CB ASN A 39 10.313 -24.411 -29.268 1.00 0.00 C ATOM 332 CG ASN A 39 9.103 -25.090 -29.947 1.00 0.00 C ATOM 333 OD1 ASN A 39 9.249 -25.831 -30.917 1.00 0.00 O ATOM 334 ND2 ASN A 39 7.898 -24.852 -29.439 1.00 0.00 N ATOM 0 H ASN A 39 12.455 -23.429 -28.501 1.00 0.00 H new ATOM 0 HA ASN A 39 11.818 -24.993 -30.726 1.00 0.00 H new ATOM 0 HB2 ASN A 39 10.688 -25.064 -28.480 1.00 0.00 H new ATOM 0 HB3 ASN A 39 9.978 -23.491 -28.788 1.00 0.00 H new ATOM 0 HD21 ASN A 39 7.074 -25.287 -29.854 1.00 0.00 H new ATOM 0 HD22 ASN A 39 7.797 -24.234 -28.634 1.00 0.00 H new ATOM 341 N PHE A 40 10.987 -21.797 -31.006 1.00 0.00 N ATOM 342 CA PHE A 40 10.594 -20.738 -31.955 1.00 0.00 C ATOM 343 C PHE A 40 11.565 -20.659 -33.160 1.00 0.00 C ATOM 344 O PHE A 40 11.130 -20.633 -34.320 1.00 0.00 O ATOM 345 CB PHE A 40 10.514 -19.367 -31.225 1.00 0.00 C ATOM 346 CG PHE A 40 10.251 -18.176 -32.154 1.00 0.00 C ATOM 347 CD1 PHE A 40 9.145 -18.170 -33.010 1.00 0.00 C ATOM 348 CD2 PHE A 40 11.113 -17.081 -32.185 1.00 0.00 C ATOM 349 CE1 PHE A 40 8.920 -17.116 -33.868 1.00 0.00 C ATOM 350 CE2 PHE A 40 10.879 -16.024 -33.039 1.00 0.00 C ATOM 351 CZ PHE A 40 9.783 -16.042 -33.880 1.00 0.00 C ATOM 0 H PHE A 40 11.253 -21.447 -30.086 1.00 0.00 H new ATOM 0 HA PHE A 40 9.609 -20.989 -32.347 1.00 0.00 H new ATOM 0 HB2 PHE A 40 9.723 -19.412 -30.477 1.00 0.00 H new ATOM 0 HB3 PHE A 40 11.449 -19.197 -30.690 1.00 0.00 H new ATOM 0 HD1 PHE A 40 8.458 -19.003 -32.998 1.00 0.00 H new ATOM 0 HD2 PHE A 40 11.974 -17.060 -31.533 1.00 0.00 H new ATOM 0 HE1 PHE A 40 8.068 -17.132 -34.531 1.00 0.00 H new ATOM 0 HE2 PHE A 40 11.554 -15.181 -33.050 1.00 0.00 H new ATOM 0 HZ PHE A 40 9.602 -15.213 -34.548 1.00 0.00 H new ATOM 361 N PHE A 41 12.876 -20.612 -32.866 1.00 0.00 N ATOM 362 CA PHE A 41 13.907 -20.386 -33.900 1.00 0.00 C ATOM 363 C PHE A 41 14.193 -21.639 -34.753 1.00 0.00 C ATOM 364 O PHE A 41 14.648 -21.496 -35.891 1.00 0.00 O ATOM 365 CB PHE A 41 15.209 -19.818 -33.262 1.00 0.00 C ATOM 366 CG PHE A 41 15.053 -18.366 -32.779 1.00 0.00 C ATOM 367 CD1 PHE A 41 14.867 -17.339 -33.703 1.00 0.00 C ATOM 368 CD2 PHE A 41 15.069 -18.029 -31.427 1.00 0.00 C ATOM 369 CE1 PHE A 41 14.704 -16.028 -33.299 1.00 0.00 C ATOM 370 CE2 PHE A 41 14.910 -16.712 -31.018 1.00 0.00 C ATOM 371 CZ PHE A 41 14.726 -15.711 -31.955 1.00 0.00 C ATOM 0 H PHE A 41 13.249 -20.727 -31.923 1.00 0.00 H new ATOM 0 HA PHE A 41 13.506 -19.643 -34.589 1.00 0.00 H new ATOM 0 HB2 PHE A 41 15.500 -20.447 -32.420 1.00 0.00 H new ATOM 0 HB3 PHE A 41 16.017 -19.868 -33.992 1.00 0.00 H new ATOM 0 HD1 PHE A 41 14.850 -17.573 -34.757 1.00 0.00 H new ATOM 0 HD2 PHE A 41 15.207 -18.803 -30.687 1.00 0.00 H new ATOM 0 HE1 PHE A 41 14.559 -15.251 -34.035 1.00 0.00 H new ATOM 0 HE2 PHE A 41 14.930 -16.468 -29.966 1.00 0.00 H new ATOM 0 HZ PHE A 41 14.600 -14.687 -31.637 1.00 0.00 H new ATOM 381 N THR A 42 13.918 -22.853 -34.229 1.00 0.00 N ATOM 382 CA THR A 42 14.193 -24.120 -34.963 1.00 0.00 C ATOM 383 C THR A 42 12.911 -24.751 -35.540 1.00 0.00 C ATOM 384 O THR A 42 12.983 -25.505 -36.515 1.00 0.00 O ATOM 385 CB THR A 42 14.919 -25.170 -34.056 1.00 0.00 C ATOM 386 OG1 THR A 42 14.105 -25.481 -32.914 1.00 0.00 O ATOM 387 CG2 THR A 42 16.301 -24.674 -33.584 1.00 0.00 C ATOM 0 H THR A 42 13.508 -22.989 -33.305 1.00 0.00 H new ATOM 0 HA THR A 42 14.849 -23.848 -35.790 1.00 0.00 H new ATOM 0 HB THR A 42 15.074 -26.065 -34.658 1.00 0.00 H new ATOM 0 HG1 THR A 42 14.048 -24.696 -32.329 1.00 0.00 H new ATOM 0 HG21 THR A 42 16.767 -25.435 -32.958 1.00 0.00 H new ATOM 0 HG22 THR A 42 16.933 -24.480 -34.450 1.00 0.00 H new ATOM 0 HG23 THR A 42 16.181 -23.756 -33.009 1.00 0.00 H new ATOM 395 N CYS A 43 11.747 -24.444 -34.942 1.00 0.00 N ATOM 396 CA CYS A 43 10.461 -25.096 -35.279 1.00 0.00 C ATOM 397 C CYS A 43 9.295 -24.088 -35.145 1.00 0.00 C ATOM 398 O CYS A 43 9.520 -22.876 -35.075 1.00 0.00 O ATOM 399 CB CYS A 43 10.251 -26.320 -34.347 1.00 0.00 C ATOM 400 SG CYS A 43 11.553 -27.576 -34.447 1.00 0.00 S ATOM 0 H CYS A 43 11.667 -23.737 -34.211 1.00 0.00 H new ATOM 0 HA CYS A 43 10.484 -25.439 -36.313 1.00 0.00 H new ATOM 0 HB2 CYS A 43 10.182 -25.969 -33.318 1.00 0.00 H new ATOM 0 HB3 CYS A 43 9.296 -26.785 -34.590 1.00 0.00 H new ATOM 0 HG CYS A 43 11.281 -28.549 -33.629 1.00 0.00 H new ATOM 406 N GLY A 44 8.046 -24.600 -35.155 1.00 0.00 N ATOM 407 CA GLY A 44 6.851 -23.771 -34.952 1.00 0.00 C ATOM 408 C GLY A 44 5.578 -24.498 -35.360 1.00 0.00 C ATOM 409 O GLY A 44 5.634 -25.660 -35.784 1.00 0.00 O ATOM 0 H GLY A 44 7.844 -25.589 -35.303 1.00 0.00 H new ATOM 0 HA2 GLY A 44 6.784 -23.483 -33.903 1.00 0.00 H new ATOM 0 HA3 GLY A 44 6.945 -22.852 -35.530 1.00 0.00 H new ATOM 413 N GLY A 45 4.425 -23.815 -35.224 1.00 0.00 N ATOM 414 CA GLY A 45 3.126 -24.361 -35.659 1.00 0.00 C ATOM 415 C GLY A 45 2.141 -24.600 -34.527 1.00 0.00 C ATOM 416 O GLY A 45 1.016 -25.030 -34.783 1.00 0.00 O ATOM 0 H GLY A 45 4.368 -22.882 -34.815 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.678 -23.674 -36.377 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.297 -25.302 -36.182 1.00 0.00 H new ATOM 420 N ILE A 46 2.558 -24.359 -33.270 1.00 0.00 N ATOM 421 CA ILE A 46 1.682 -24.540 -32.092 1.00 0.00 C ATOM 422 C ILE A 46 0.875 -23.249 -31.841 1.00 0.00 C ATOM 423 O ILE A 46 1.425 -22.144 -31.952 1.00 0.00 O ATOM 424 CB ILE A 46 2.513 -24.888 -30.803 1.00 0.00 C ATOM 425 CG1 ILE A 46 3.562 -26.009 -31.104 1.00 0.00 C ATOM 426 CG2 ILE A 46 1.573 -25.306 -29.631 1.00 0.00 C ATOM 427 CD1 ILE A 46 4.540 -26.273 -29.971 1.00 0.00 C ATOM 0 H ILE A 46 3.499 -24.037 -33.041 1.00 0.00 H new ATOM 0 HA ILE A 46 1.009 -25.371 -32.301 1.00 0.00 H new ATOM 0 HB ILE A 46 3.054 -23.992 -30.497 1.00 0.00 H new ATOM 0 HG12 ILE A 46 3.032 -26.934 -31.333 1.00 0.00 H new ATOM 0 HG13 ILE A 46 4.124 -25.734 -31.996 1.00 0.00 H new ATOM 0 HG21 ILE A 46 2.171 -25.542 -28.751 1.00 0.00 H new ATOM 0 HG22 ILE A 46 0.894 -24.486 -29.399 1.00 0.00 H new ATOM 0 HG23 ILE A 46 0.996 -26.183 -29.923 1.00 0.00 H new ATOM 0 HD11 ILE A 46 5.231 -27.064 -30.264 1.00 0.00 H new ATOM 0 HD12 ILE A 46 5.100 -25.363 -29.754 1.00 0.00 H new ATOM 0 HD13 ILE A 46 3.991 -26.582 -29.081 1.00 0.00 H new ATOM 439 N ARG A 47 -0.416 -23.392 -31.481 1.00 0.00 N ATOM 440 CA ARG A 47 -1.317 -22.240 -31.249 1.00 0.00 C ATOM 441 C ARG A 47 -1.853 -22.186 -29.804 1.00 0.00 C ATOM 442 O ARG A 47 -2.030 -21.088 -29.269 1.00 0.00 O ATOM 443 CB ARG A 47 -2.511 -22.223 -32.256 1.00 0.00 C ATOM 444 CG ARG A 47 -3.398 -23.497 -32.312 1.00 0.00 C ATOM 445 CD ARG A 47 -2.816 -24.619 -33.193 1.00 0.00 C ATOM 446 NE ARG A 47 -2.590 -24.161 -34.576 1.00 0.00 N ATOM 447 CZ ARG A 47 -1.975 -24.862 -35.538 1.00 0.00 C ATOM 448 NH1 ARG A 47 -1.562 -26.104 -35.333 1.00 0.00 N ATOM 449 NH2 ARG A 47 -1.779 -24.306 -36.716 1.00 0.00 N ATOM 0 H ARG A 47 -0.862 -24.299 -31.343 1.00 0.00 H new ATOM 0 HA ARG A 47 -0.706 -21.352 -31.414 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.150 -21.375 -32.011 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -2.111 -22.043 -33.254 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -3.537 -23.877 -31.300 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -4.384 -23.226 -32.689 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -1.875 -24.967 -32.766 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -3.498 -25.469 -33.198 1.00 0.00 H new ATOM 0 HE ARG A 47 -2.931 -23.231 -34.821 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -1.710 -26.548 -34.426 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -1.096 -26.617 -36.082 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -2.094 -23.351 -36.888 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -1.312 -24.830 -37.456 1.00 0.00 H new ATOM 463 N ARG A 48 -2.053 -23.367 -29.173 1.00 0.00 N ATOM 464 CA ARG A 48 -2.814 -23.507 -27.903 1.00 0.00 C ATOM 465 C ARG A 48 -2.343 -22.527 -26.801 1.00 0.00 C ATOM 466 O ARG A 48 -3.131 -21.711 -26.320 1.00 0.00 O ATOM 467 CB ARG A 48 -2.745 -24.968 -27.382 1.00 0.00 C ATOM 468 CG ARG A 48 -3.593 -25.242 -26.114 1.00 0.00 C ATOM 469 CD ARG A 48 -5.105 -25.043 -26.343 1.00 0.00 C ATOM 470 NE ARG A 48 -5.665 -26.065 -27.246 1.00 0.00 N ATOM 471 CZ ARG A 48 -6.880 -26.029 -27.812 1.00 0.00 C ATOM 472 NH1 ARG A 48 -7.673 -24.969 -27.689 1.00 0.00 N ATOM 473 NH2 ARG A 48 -7.290 -27.066 -28.522 1.00 0.00 N ATOM 0 H ARG A 48 -1.692 -24.252 -29.528 1.00 0.00 H new ATOM 0 HA ARG A 48 -3.848 -23.250 -28.135 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -3.075 -25.639 -28.175 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -1.705 -25.215 -27.168 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -3.414 -26.263 -25.778 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -3.263 -24.580 -25.313 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -5.625 -25.081 -25.386 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -5.281 -24.053 -26.763 1.00 0.00 H new ATOM 0 HE ARG A 48 -5.076 -26.870 -27.459 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -7.361 -24.158 -27.154 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -8.593 -24.967 -28.129 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -6.685 -27.879 -28.633 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -8.212 -27.053 -28.958 1.00 0.00 H new ATOM 487 N ARG A 49 -1.057 -22.604 -26.430 1.00 0.00 N ATOM 488 CA ARG A 49 -0.453 -21.702 -25.417 1.00 0.00 C ATOM 489 C ARG A 49 0.781 -20.990 -25.988 1.00 0.00 C ATOM 490 O ARG A 49 1.570 -20.393 -25.244 1.00 0.00 O ATOM 491 CB ARG A 49 -0.087 -22.474 -24.106 1.00 0.00 C ATOM 492 CG ARG A 49 0.972 -23.613 -24.238 1.00 0.00 C ATOM 493 CD ARG A 49 0.394 -24.932 -24.792 1.00 0.00 C ATOM 494 NE ARG A 49 -0.750 -25.403 -23.985 1.00 0.00 N ATOM 495 CZ ARG A 49 -1.136 -26.677 -23.846 1.00 0.00 C ATOM 496 NH1 ARG A 49 -0.446 -27.660 -24.394 1.00 0.00 N ATOM 497 NH2 ARG A 49 -2.214 -26.957 -23.133 1.00 0.00 N ATOM 0 H ARG A 49 -0.403 -23.285 -26.816 1.00 0.00 H new ATOM 0 HA ARG A 49 -1.199 -20.949 -25.161 1.00 0.00 H new ATOM 0 HB2 ARG A 49 0.279 -21.752 -23.376 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -1.001 -22.905 -23.698 1.00 0.00 H new ATOM 0 HG2 ARG A 49 1.777 -23.276 -24.891 1.00 0.00 H new ATOM 0 HG3 ARG A 49 1.414 -23.802 -23.260 1.00 0.00 H new ATOM 0 HD2 ARG A 49 0.077 -24.786 -25.825 1.00 0.00 H new ATOM 0 HD3 ARG A 49 1.172 -25.695 -24.803 1.00 0.00 H new ATOM 0 HE ARG A 49 -1.293 -24.695 -23.490 1.00 0.00 H new ATOM 0 HH11 ARG A 49 0.395 -27.454 -24.933 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -0.754 -28.626 -24.278 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -2.745 -26.205 -22.694 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -2.515 -27.925 -23.022 1.00 0.00 H new ATOM 511 N ASN A 50 0.921 -21.005 -27.323 1.00 0.00 N ATOM 512 CA ASN A 50 2.135 -20.515 -28.012 1.00 0.00 C ATOM 513 C ASN A 50 1.795 -19.462 -29.080 1.00 0.00 C ATOM 514 O ASN A 50 2.580 -19.243 -30.001 1.00 0.00 O ATOM 515 CB ASN A 50 2.935 -21.724 -28.592 1.00 0.00 C ATOM 516 CG ASN A 50 3.503 -22.678 -27.504 1.00 0.00 C ATOM 517 OD1 ASN A 50 3.630 -23.873 -27.713 1.00 0.00 O ATOM 518 ND2 ASN A 50 3.887 -22.150 -26.348 1.00 0.00 N ATOM 0 H ASN A 50 0.202 -21.355 -27.956 1.00 0.00 H new ATOM 0 HA ASN A 50 2.773 -20.008 -27.288 1.00 0.00 H new ATOM 0 HB2 ASN A 50 2.285 -22.292 -29.257 1.00 0.00 H new ATOM 0 HB3 ASN A 50 3.759 -21.346 -29.197 1.00 0.00 H new ATOM 0 HD21 ASN A 50 4.292 -22.745 -25.625 1.00 0.00 H new ATOM 0 HD22 ASN A 50 3.777 -21.150 -26.183 1.00 0.00 H new ATOM 525 N GLU A 51 0.616 -18.798 -28.949 1.00 0.00 N ATOM 526 CA GLU A 51 0.264 -17.635 -29.799 1.00 0.00 C ATOM 527 C GLU A 51 0.679 -16.326 -29.122 1.00 0.00 C ATOM 528 O GLU A 51 1.559 -15.638 -29.627 1.00 0.00 O ATOM 529 CB GLU A 51 -1.248 -17.607 -30.166 1.00 0.00 C ATOM 530 CG GLU A 51 -1.636 -18.626 -31.246 1.00 0.00 C ATOM 531 CD GLU A 51 -3.101 -18.530 -31.700 1.00 0.00 C ATOM 532 OE1 GLU A 51 -3.993 -19.035 -30.984 1.00 0.00 O ATOM 533 OE2 GLU A 51 -3.363 -17.953 -32.776 1.00 0.00 O ATOM 0 H GLU A 51 -0.100 -19.048 -28.267 1.00 0.00 H new ATOM 0 HA GLU A 51 0.818 -17.741 -30.732 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -1.835 -17.800 -29.268 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.512 -16.607 -30.510 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -0.988 -18.487 -32.112 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -1.449 -19.631 -30.867 1.00 0.00 H new ATOM 540 N THR A 52 0.077 -16.015 -27.956 1.00 0.00 N ATOM 541 CA THR A 52 0.318 -14.734 -27.252 1.00 0.00 C ATOM 542 C THR A 52 1.694 -14.729 -26.545 1.00 0.00 C ATOM 543 O THR A 52 2.387 -13.700 -26.528 1.00 0.00 O ATOM 544 CB THR A 52 -0.824 -14.438 -26.222 1.00 0.00 C ATOM 545 OG1 THR A 52 -2.094 -14.595 -26.863 1.00 0.00 O ATOM 546 CG2 THR A 52 -0.735 -13.011 -25.642 1.00 0.00 C ATOM 0 H THR A 52 -0.581 -16.633 -27.480 1.00 0.00 H new ATOM 0 HA THR A 52 0.321 -13.944 -28.003 1.00 0.00 H new ATOM 0 HB THR A 52 -0.711 -15.144 -25.399 1.00 0.00 H new ATOM 0 HG1 THR A 52 -2.810 -14.412 -26.220 1.00 0.00 H new ATOM 0 HG21 THR A 52 -1.548 -12.855 -24.933 1.00 0.00 H new ATOM 0 HG22 THR A 52 0.220 -12.884 -25.132 1.00 0.00 H new ATOM 0 HG23 THR A 52 -0.814 -12.284 -26.450 1.00 0.00 H new ATOM 554 N GLN A 53 2.080 -15.899 -25.991 1.00 0.00 N ATOM 555 CA GLN A 53 3.375 -16.085 -25.296 1.00 0.00 C ATOM 556 C GLN A 53 4.548 -15.821 -26.249 1.00 0.00 C ATOM 557 O GLN A 53 5.504 -15.109 -25.908 1.00 0.00 O ATOM 558 CB GLN A 53 3.477 -17.529 -24.722 1.00 0.00 C ATOM 559 CG GLN A 53 4.862 -17.886 -24.115 1.00 0.00 C ATOM 560 CD GLN A 53 4.986 -19.306 -23.545 1.00 0.00 C ATOM 561 OE1 GLN A 53 4.223 -20.253 -24.070 1.00 0.00 O flip ATOM 562 NE2 GLN A 53 5.771 -19.548 -22.632 1.00 0.00 N flip ATOM 0 H GLN A 53 1.504 -16.741 -26.012 1.00 0.00 H new ATOM 0 HA GLN A 53 3.425 -15.369 -24.476 1.00 0.00 H new ATOM 0 HB2 GLN A 53 2.714 -17.655 -23.953 1.00 0.00 H new ATOM 0 HB3 GLN A 53 3.249 -18.239 -25.517 1.00 0.00 H new ATOM 0 HG2 GLN A 53 5.622 -17.755 -24.885 1.00 0.00 H new ATOM 0 HG3 GLN A 53 5.086 -17.173 -23.321 1.00 0.00 H new ATOM 0 HE21 GLN A 53 6.348 -18.802 -22.244 1.00 0.00 H new ATOM 0 HE22 GLN A 53 5.846 -20.495 -22.262 1.00 0.00 H new ATOM 571 N TYR A 54 4.437 -16.385 -27.460 1.00 0.00 N ATOM 572 CA TYR A 54 5.428 -16.188 -28.516 1.00 0.00 C ATOM 573 C TYR A 54 5.306 -14.780 -29.091 1.00 0.00 C ATOM 574 O TYR A 54 6.319 -14.149 -29.309 1.00 0.00 O ATOM 575 CB TYR A 54 5.303 -17.270 -29.628 1.00 0.00 C ATOM 576 CG TYR A 54 5.929 -18.632 -29.262 1.00 0.00 C ATOM 577 CD1 TYR A 54 5.677 -19.240 -28.030 1.00 0.00 C ATOM 578 CD2 TYR A 54 6.783 -19.301 -30.145 1.00 0.00 C ATOM 579 CE1 TYR A 54 6.248 -20.449 -27.701 1.00 0.00 C ATOM 580 CE2 TYR A 54 7.349 -20.514 -29.814 1.00 0.00 C ATOM 581 CZ TYR A 54 7.079 -21.081 -28.594 1.00 0.00 C ATOM 582 OH TYR A 54 7.658 -22.277 -28.259 1.00 0.00 O ATOM 0 H TYR A 54 3.659 -16.987 -27.730 1.00 0.00 H new ATOM 0 HA TYR A 54 6.421 -16.298 -28.079 1.00 0.00 H new ATOM 0 HB2 TYR A 54 4.248 -17.418 -29.857 1.00 0.00 H new ATOM 0 HB3 TYR A 54 5.777 -16.898 -30.536 1.00 0.00 H new ATOM 0 HD1 TYR A 54 5.022 -18.753 -27.323 1.00 0.00 H new ATOM 0 HD2 TYR A 54 7.003 -18.859 -31.105 1.00 0.00 H new ATOM 0 HE1 TYR A 54 6.043 -20.900 -26.741 1.00 0.00 H new ATOM 0 HE2 TYR A 54 8.002 -21.016 -30.512 1.00 0.00 H new ATOM 0 HH TYR A 54 7.086 -22.750 -27.619 1.00 0.00 H new ATOM 592 N GLN A 55 4.063 -14.283 -29.274 1.00 0.00 N ATOM 593 CA GLN A 55 3.793 -12.945 -29.859 1.00 0.00 C ATOM 594 C GLN A 55 4.552 -11.842 -29.111 1.00 0.00 C ATOM 595 O GLN A 55 5.121 -10.951 -29.742 1.00 0.00 O ATOM 596 CB GLN A 55 2.272 -12.629 -29.859 1.00 0.00 C ATOM 597 CG GLN A 55 1.889 -11.220 -30.369 1.00 0.00 C ATOM 598 CD GLN A 55 2.270 -10.961 -31.829 1.00 0.00 C ATOM 599 OE1 GLN A 55 1.505 -11.260 -32.742 1.00 0.00 O ATOM 600 NE2 GLN A 55 3.443 -10.379 -32.057 1.00 0.00 N ATOM 0 H GLN A 55 3.218 -14.795 -29.022 1.00 0.00 H new ATOM 0 HA GLN A 55 4.147 -12.970 -30.890 1.00 0.00 H new ATOM 0 HB2 GLN A 55 1.764 -13.371 -30.475 1.00 0.00 H new ATOM 0 HB3 GLN A 55 1.894 -12.745 -28.843 1.00 0.00 H new ATOM 0 HG2 GLN A 55 0.814 -11.084 -30.255 1.00 0.00 H new ATOM 0 HG3 GLN A 55 2.373 -10.473 -29.740 1.00 0.00 H new ATOM 0 HE21 GLN A 55 4.056 -10.143 -31.276 1.00 0.00 H new ATOM 0 HE22 GLN A 55 3.730 -10.168 -33.013 1.00 0.00 H new ATOM 609 N GLU A 56 4.569 -11.939 -27.767 1.00 0.00 N ATOM 610 CA GLU A 56 5.306 -10.993 -26.918 1.00 0.00 C ATOM 611 C GLU A 56 6.805 -11.031 -27.261 1.00 0.00 C ATOM 612 O GLU A 56 7.424 -9.990 -27.414 1.00 0.00 O ATOM 613 CB GLU A 56 5.085 -11.295 -25.417 1.00 0.00 C ATOM 614 CG GLU A 56 5.611 -10.188 -24.472 1.00 0.00 C ATOM 615 CD GLU A 56 5.463 -10.540 -22.983 1.00 0.00 C ATOM 616 OE1 GLU A 56 4.307 -10.639 -22.503 1.00 0.00 O ATOM 617 OE2 GLU A 56 6.492 -10.730 -22.291 1.00 0.00 O ATOM 0 H GLU A 56 4.078 -12.667 -27.248 1.00 0.00 H new ATOM 0 HA GLU A 56 4.923 -9.991 -27.115 1.00 0.00 H new ATOM 0 HB2 GLU A 56 4.019 -11.436 -25.238 1.00 0.00 H new ATOM 0 HB3 GLU A 56 5.577 -12.235 -25.169 1.00 0.00 H new ATOM 0 HG2 GLU A 56 6.662 -10.002 -24.692 1.00 0.00 H new ATOM 0 HG3 GLU A 56 5.074 -9.261 -24.674 1.00 0.00 H new ATOM 624 N LEU A 57 7.350 -12.253 -27.415 1.00 0.00 N ATOM 625 CA LEU A 57 8.752 -12.473 -27.835 1.00 0.00 C ATOM 626 C LEU A 57 9.000 -11.879 -29.242 1.00 0.00 C ATOM 627 O LEU A 57 10.041 -11.271 -29.461 1.00 0.00 O ATOM 628 CB LEU A 57 9.089 -14.002 -27.765 1.00 0.00 C ATOM 629 CG LEU A 57 10.564 -14.458 -28.109 1.00 0.00 C ATOM 630 CD1 LEU A 57 10.886 -15.812 -27.457 1.00 0.00 C ATOM 631 CD2 LEU A 57 10.832 -14.550 -29.633 1.00 0.00 C ATOM 0 H LEU A 57 6.833 -13.117 -27.252 1.00 0.00 H new ATOM 0 HA LEU A 57 9.424 -11.953 -27.153 1.00 0.00 H new ATOM 0 HB2 LEU A 57 8.860 -14.348 -26.757 1.00 0.00 H new ATOM 0 HB3 LEU A 57 8.413 -14.524 -28.442 1.00 0.00 H new ATOM 0 HG LEU A 57 11.217 -13.685 -27.704 1.00 0.00 H new ATOM 0 HD11 LEU A 57 11.906 -16.104 -27.709 1.00 0.00 H new ATOM 0 HD12 LEU A 57 10.789 -15.727 -26.375 1.00 0.00 H new ATOM 0 HD13 LEU A 57 10.191 -16.567 -27.825 1.00 0.00 H new ATOM 0 HD21 LEU A 57 11.861 -14.868 -29.803 1.00 0.00 H new ATOM 0 HD22 LEU A 57 10.150 -15.274 -30.079 1.00 0.00 H new ATOM 0 HD23 LEU A 57 10.674 -13.573 -30.090 1.00 0.00 H new ATOM 643 N ILE A 58 8.032 -12.057 -30.177 1.00 0.00 N ATOM 644 CA ILE A 58 8.145 -11.578 -31.579 1.00 0.00 C ATOM 645 C ILE A 58 8.314 -10.056 -31.609 1.00 0.00 C ATOM 646 O ILE A 58 9.237 -9.553 -32.240 1.00 0.00 O ATOM 647 CB ILE A 58 6.897 -12.018 -32.494 1.00 0.00 C ATOM 648 CG1 ILE A 58 7.102 -13.442 -33.116 1.00 0.00 C ATOM 649 CG2 ILE A 58 6.573 -10.998 -33.631 1.00 0.00 C ATOM 650 CD1 ILE A 58 7.111 -14.589 -32.138 1.00 0.00 C ATOM 0 H ILE A 58 7.153 -12.536 -29.981 1.00 0.00 H new ATOM 0 HA ILE A 58 9.030 -12.053 -32.003 1.00 0.00 H new ATOM 0 HB ILE A 58 6.044 -12.040 -31.815 1.00 0.00 H new ATOM 0 HG12 ILE A 58 6.311 -13.617 -33.845 1.00 0.00 H new ATOM 0 HG13 ILE A 58 8.045 -13.447 -33.662 1.00 0.00 H new ATOM 0 HG21 ILE A 58 5.721 -11.356 -34.209 1.00 0.00 H new ATOM 0 HG22 ILE A 58 6.332 -10.029 -33.193 1.00 0.00 H new ATOM 0 HG23 ILE A 58 7.439 -10.895 -34.285 1.00 0.00 H new ATOM 0 HD11 ILE A 58 7.259 -15.525 -32.676 1.00 0.00 H new ATOM 0 HD12 ILE A 58 7.921 -14.450 -31.422 1.00 0.00 H new ATOM 0 HD13 ILE A 58 6.159 -14.622 -31.608 1.00 0.00 H new ATOM 662 N GLU A 59 7.413 -9.345 -30.909 1.00 0.00 N ATOM 663 CA GLU A 59 7.368 -7.872 -30.922 1.00 0.00 C ATOM 664 C GLU A 59 8.519 -7.278 -30.095 1.00 0.00 C ATOM 665 O GLU A 59 9.096 -6.278 -30.490 1.00 0.00 O ATOM 666 CB GLU A 59 5.979 -7.364 -30.443 1.00 0.00 C ATOM 667 CG GLU A 59 5.560 -7.811 -29.030 1.00 0.00 C ATOM 668 CD GLU A 59 4.094 -7.479 -28.698 1.00 0.00 C ATOM 669 OE1 GLU A 59 3.787 -6.290 -28.460 1.00 0.00 O ATOM 670 OE2 GLU A 59 3.245 -8.395 -28.682 1.00 0.00 O ATOM 0 H GLU A 59 6.698 -9.773 -30.321 1.00 0.00 H new ATOM 0 HA GLU A 59 7.505 -7.529 -31.947 1.00 0.00 H new ATOM 0 HB2 GLU A 59 5.979 -6.274 -30.475 1.00 0.00 H new ATOM 0 HB3 GLU A 59 5.223 -7.704 -31.151 1.00 0.00 H new ATOM 0 HG2 GLU A 59 5.712 -8.886 -28.936 1.00 0.00 H new ATOM 0 HG3 GLU A 59 6.209 -7.332 -28.297 1.00 0.00 H new ATOM 677 N THR A 60 8.878 -7.936 -28.976 1.00 0.00 N ATOM 678 CA THR A 60 10.003 -7.496 -28.114 1.00 0.00 C ATOM 679 C THR A 60 11.361 -7.635 -28.860 1.00 0.00 C ATOM 680 O THR A 60 12.207 -6.726 -28.799 1.00 0.00 O ATOM 681 CB THR A 60 10.019 -8.288 -26.759 1.00 0.00 C ATOM 682 OG1 THR A 60 8.779 -8.066 -26.066 1.00 0.00 O ATOM 683 CG2 THR A 60 11.184 -7.882 -25.834 1.00 0.00 C ATOM 0 H THR A 60 8.406 -8.777 -28.643 1.00 0.00 H new ATOM 0 HA THR A 60 9.855 -6.442 -27.881 1.00 0.00 H new ATOM 0 HB THR A 60 10.153 -9.341 -27.008 1.00 0.00 H new ATOM 0 HG1 THR A 60 8.132 -8.754 -26.325 1.00 0.00 H new ATOM 0 HG21 THR A 60 11.139 -8.465 -24.914 1.00 0.00 H new ATOM 0 HG22 THR A 60 12.132 -8.072 -26.338 1.00 0.00 H new ATOM 0 HG23 THR A 60 11.106 -6.821 -25.595 1.00 0.00 H new ATOM 691 N MET A 61 11.537 -8.775 -29.575 1.00 0.00 N ATOM 692 CA MET A 61 12.707 -9.014 -30.456 1.00 0.00 C ATOM 693 C MET A 61 12.719 -7.986 -31.588 1.00 0.00 C ATOM 694 O MET A 61 13.685 -7.256 -31.740 1.00 0.00 O ATOM 695 CB MET A 61 12.712 -10.457 -31.060 1.00 0.00 C ATOM 696 CG MET A 61 13.208 -11.559 -30.113 1.00 0.00 C ATOM 697 SD MET A 61 14.991 -11.464 -29.807 1.00 0.00 S ATOM 698 CE MET A 61 15.696 -11.769 -31.434 1.00 0.00 C ATOM 0 H MET A 61 10.875 -9.551 -29.557 1.00 0.00 H new ATOM 0 HA MET A 61 13.602 -8.911 -29.843 1.00 0.00 H new ATOM 0 HB2 MET A 61 11.700 -10.703 -31.380 1.00 0.00 H new ATOM 0 HB3 MET A 61 13.338 -10.458 -31.953 1.00 0.00 H new ATOM 0 HG2 MET A 61 12.676 -11.485 -29.165 1.00 0.00 H new ATOM 0 HG3 MET A 61 12.967 -12.534 -30.538 1.00 0.00 H new ATOM 0 HE1 MET A 61 16.565 -12.420 -31.338 1.00 0.00 H new ATOM 0 HE2 MET A 61 14.951 -12.249 -32.069 1.00 0.00 H new ATOM 0 HE3 MET A 61 16.000 -10.823 -31.882 1.00 0.00 H new ATOM 708 N ALA A 62 11.602 -7.913 -32.338 1.00 0.00 N ATOM 709 CA ALA A 62 11.457 -7.038 -33.521 1.00 0.00 C ATOM 710 C ALA A 62 11.806 -5.583 -33.187 1.00 0.00 C ATOM 711 O ALA A 62 12.545 -4.947 -33.931 1.00 0.00 O ATOM 712 CB ALA A 62 10.034 -7.133 -34.100 1.00 0.00 C ATOM 0 H ALA A 62 10.767 -8.464 -32.139 1.00 0.00 H new ATOM 0 HA ALA A 62 12.162 -7.386 -34.276 1.00 0.00 H new ATOM 0 HB1 ALA A 62 9.951 -6.481 -34.969 1.00 0.00 H new ATOM 0 HB2 ALA A 62 9.830 -8.162 -34.397 1.00 0.00 H new ATOM 0 HB3 ALA A 62 9.312 -6.824 -33.344 1.00 0.00 H new ATOM 718 N GLU A 63 11.318 -5.108 -32.022 1.00 0.00 N ATOM 719 CA GLU A 63 11.539 -3.730 -31.548 1.00 0.00 C ATOM 720 C GLU A 63 12.997 -3.489 -31.124 1.00 0.00 C ATOM 721 O GLU A 63 13.568 -2.461 -31.486 1.00 0.00 O ATOM 722 CB GLU A 63 10.567 -3.371 -30.401 1.00 0.00 C ATOM 723 CG GLU A 63 9.100 -3.200 -30.859 1.00 0.00 C ATOM 724 CD GLU A 63 8.145 -2.875 -29.708 1.00 0.00 C ATOM 725 OE1 GLU A 63 8.275 -1.775 -29.121 1.00 0.00 O ATOM 726 OE2 GLU A 63 7.273 -3.705 -29.370 1.00 0.00 O ATOM 0 H GLU A 63 10.758 -5.673 -31.383 1.00 0.00 H new ATOM 0 HA GLU A 63 11.334 -3.069 -32.390 1.00 0.00 H new ATOM 0 HB2 GLU A 63 10.612 -4.151 -29.641 1.00 0.00 H new ATOM 0 HB3 GLU A 63 10.901 -2.447 -29.930 1.00 0.00 H new ATOM 0 HG2 GLU A 63 9.048 -2.404 -31.602 1.00 0.00 H new ATOM 0 HG3 GLU A 63 8.770 -4.116 -31.349 1.00 0.00 H new ATOM 733 N THR A 64 13.597 -4.434 -30.368 1.00 0.00 N ATOM 734 CA THR A 64 14.996 -4.281 -29.877 1.00 0.00 C ATOM 735 C THR A 64 16.006 -4.363 -31.051 1.00 0.00 C ATOM 736 O THR A 64 17.089 -3.765 -31.008 1.00 0.00 O ATOM 737 CB THR A 64 15.344 -5.332 -28.757 1.00 0.00 C ATOM 738 OG1 THR A 64 16.503 -4.923 -28.016 1.00 0.00 O ATOM 739 CG2 THR A 64 15.596 -6.738 -29.314 1.00 0.00 C ATOM 0 H THR A 64 13.146 -5.304 -30.084 1.00 0.00 H new ATOM 0 HA THR A 64 15.076 -3.292 -29.426 1.00 0.00 H new ATOM 0 HB THR A 64 14.470 -5.373 -28.107 1.00 0.00 H new ATOM 0 HG1 THR A 64 16.608 -5.498 -27.229 1.00 0.00 H new ATOM 0 HG21 THR A 64 15.831 -7.417 -28.495 1.00 0.00 H new ATOM 0 HG22 THR A 64 14.704 -7.089 -29.832 1.00 0.00 H new ATOM 0 HG23 THR A 64 16.433 -6.708 -30.012 1.00 0.00 H new ATOM 747 N LEU A 65 15.599 -5.089 -32.111 1.00 0.00 N ATOM 748 CA LEU A 65 16.365 -5.230 -33.354 1.00 0.00 C ATOM 749 C LEU A 65 16.303 -3.923 -34.159 1.00 0.00 C ATOM 750 O LEU A 65 17.333 -3.306 -34.402 1.00 0.00 O ATOM 751 CB LEU A 65 15.814 -6.417 -34.194 1.00 0.00 C ATOM 752 CG LEU A 65 16.061 -7.850 -33.619 1.00 0.00 C ATOM 753 CD1 LEU A 65 15.173 -8.893 -34.341 1.00 0.00 C ATOM 754 CD2 LEU A 65 17.557 -8.237 -33.685 1.00 0.00 C ATOM 0 H LEU A 65 14.716 -5.599 -32.123 1.00 0.00 H new ATOM 0 HA LEU A 65 17.406 -5.438 -33.108 1.00 0.00 H new ATOM 0 HB2 LEU A 65 14.740 -6.279 -34.317 1.00 0.00 H new ATOM 0 HB3 LEU A 65 16.258 -6.367 -35.188 1.00 0.00 H new ATOM 0 HG LEU A 65 15.778 -7.841 -32.566 1.00 0.00 H new ATOM 0 HD11 LEU A 65 15.362 -9.882 -33.924 1.00 0.00 H new ATOM 0 HD12 LEU A 65 14.123 -8.635 -34.202 1.00 0.00 H new ATOM 0 HD13 LEU A 65 15.408 -8.897 -35.405 1.00 0.00 H new ATOM 0 HD21 LEU A 65 17.692 -9.239 -33.277 1.00 0.00 H new ATOM 0 HD22 LEU A 65 17.892 -8.219 -34.722 1.00 0.00 H new ATOM 0 HD23 LEU A 65 18.143 -7.526 -33.102 1.00 0.00 H new ATOM 766 N LYS A 66 15.075 -3.489 -34.526 1.00 0.00 N ATOM 767 CA LYS A 66 14.841 -2.278 -35.362 1.00 0.00 C ATOM 768 C LYS A 66 15.292 -0.988 -34.638 1.00 0.00 C ATOM 769 O LYS A 66 15.547 0.033 -35.285 1.00 0.00 O ATOM 770 CB LYS A 66 13.350 -2.176 -35.801 1.00 0.00 C ATOM 771 CG LYS A 66 12.353 -1.940 -34.644 1.00 0.00 C ATOM 772 CD LYS A 66 10.868 -2.091 -35.065 1.00 0.00 C ATOM 773 CE LYS A 66 10.408 -0.994 -36.031 1.00 0.00 C ATOM 774 NZ LYS A 66 10.426 0.345 -35.390 1.00 0.00 N ATOM 0 H LYS A 66 14.215 -3.965 -34.253 1.00 0.00 H new ATOM 0 HA LYS A 66 15.451 -2.382 -36.259 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.251 -1.362 -36.520 1.00 0.00 H new ATOM 0 HB3 LYS A 66 13.074 -3.094 -36.319 1.00 0.00 H new ATOM 0 HG2 LYS A 66 12.568 -2.645 -33.841 1.00 0.00 H new ATOM 0 HG3 LYS A 66 12.508 -0.939 -34.240 1.00 0.00 H new ATOM 0 HD2 LYS A 66 10.726 -3.064 -35.534 1.00 0.00 H new ATOM 0 HD3 LYS A 66 10.239 -2.071 -34.175 1.00 0.00 H new ATOM 0 HE2 LYS A 66 11.055 -0.986 -36.908 1.00 0.00 H new ATOM 0 HE3 LYS A 66 9.400 -1.216 -36.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 9.938 1.030 -36.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 9.942 0.296 -34.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 11.410 0.649 -35.248 1.00 0.00 H new ATOM 788 N SER A 67 15.403 -1.066 -33.290 1.00 0.00 N ATOM 789 CA SER A 67 15.909 0.040 -32.444 1.00 0.00 C ATOM 790 C SER A 67 17.395 0.344 -32.755 1.00 0.00 C ATOM 791 O SER A 67 17.838 1.496 -32.664 1.00 0.00 O ATOM 792 CB SER A 67 15.744 -0.314 -30.942 1.00 0.00 C ATOM 793 OG SER A 67 16.084 0.776 -30.096 1.00 0.00 O ATOM 0 H SER A 67 15.144 -1.898 -32.759 1.00 0.00 H new ATOM 0 HA SER A 67 15.323 0.931 -32.668 1.00 0.00 H new ATOM 0 HB2 SER A 67 14.713 -0.613 -30.751 1.00 0.00 H new ATOM 0 HB3 SER A 67 16.374 -1.170 -30.700 1.00 0.00 H new ATOM 0 HG SER A 67 15.965 0.513 -29.160 1.00 0.00 H new ATOM 799 N THR A 68 18.161 -0.707 -33.105 1.00 0.00 N ATOM 800 CA THR A 68 19.609 -0.602 -33.422 1.00 0.00 C ATOM 801 C THR A 68 19.887 -0.841 -34.931 1.00 0.00 C ATOM 802 O THR A 68 21.006 -0.620 -35.407 1.00 0.00 O ATOM 803 CB THR A 68 20.430 -1.595 -32.533 1.00 0.00 C ATOM 804 OG1 THR A 68 21.833 -1.410 -32.736 1.00 0.00 O ATOM 805 CG2 THR A 68 20.071 -3.063 -32.796 1.00 0.00 C ATOM 0 H THR A 68 17.798 -1.657 -33.178 1.00 0.00 H new ATOM 0 HA THR A 68 19.930 0.415 -33.196 1.00 0.00 H new ATOM 0 HB THR A 68 20.169 -1.368 -31.499 1.00 0.00 H new ATOM 0 HG1 THR A 68 21.987 -1.027 -33.625 1.00 0.00 H new ATOM 0 HG21 THR A 68 20.671 -3.705 -32.152 1.00 0.00 H new ATOM 0 HG22 THR A 68 19.014 -3.223 -32.584 1.00 0.00 H new ATOM 0 HG23 THR A 68 20.273 -3.306 -33.839 1.00 0.00 H new ATOM 813 N MET A 69 18.852 -1.284 -35.670 1.00 0.00 N ATOM 814 CA MET A 69 18.898 -1.427 -37.144 1.00 0.00 C ATOM 815 C MET A 69 18.673 -0.053 -37.811 1.00 0.00 C ATOM 816 O MET A 69 18.059 0.828 -37.193 1.00 0.00 O ATOM 817 CB MET A 69 17.806 -2.434 -37.634 1.00 0.00 C ATOM 818 CG MET A 69 18.127 -3.922 -37.398 1.00 0.00 C ATOM 819 SD MET A 69 19.316 -4.578 -38.584 1.00 0.00 S ATOM 820 CE MET A 69 18.417 -4.382 -40.124 1.00 0.00 C ATOM 0 H MET A 69 17.956 -1.554 -35.264 1.00 0.00 H new ATOM 0 HA MET A 69 19.879 -1.811 -37.424 1.00 0.00 H new ATOM 0 HB2 MET A 69 16.867 -2.198 -37.133 1.00 0.00 H new ATOM 0 HB3 MET A 69 17.645 -2.279 -38.701 1.00 0.00 H new ATOM 0 HG2 MET A 69 18.520 -4.048 -36.389 1.00 0.00 H new ATOM 0 HG3 MET A 69 17.206 -4.501 -37.456 1.00 0.00 H new ATOM 0 HE1 MET A 69 18.746 -5.139 -40.836 1.00 0.00 H new ATOM 0 HE2 MET A 69 17.349 -4.497 -39.939 1.00 0.00 H new ATOM 0 HE3 MET A 69 18.609 -3.390 -40.534 1.00 0.00 H new ATOM 830 N PRO A 70 19.188 0.166 -39.071 1.00 0.00 N ATOM 831 CA PRO A 70 18.776 1.321 -39.895 1.00 0.00 C ATOM 832 C PRO A 70 17.247 1.275 -40.156 1.00 0.00 C ATOM 833 O PRO A 70 16.519 2.180 -39.739 1.00 0.00 O ATOM 834 CB PRO A 70 19.620 1.186 -41.194 1.00 0.00 C ATOM 835 CG PRO A 70 20.099 -0.237 -41.201 1.00 0.00 C ATOM 836 CD PRO A 70 20.226 -0.650 -39.754 1.00 0.00 C ATOM 0 HA PRO A 70 18.952 2.285 -39.417 1.00 0.00 H new ATOM 0 HB2 PRO A 70 19.021 1.405 -42.078 1.00 0.00 H new ATOM 0 HB3 PRO A 70 20.457 1.884 -41.195 1.00 0.00 H new ATOM 0 HG2 PRO A 70 19.396 -0.881 -41.729 1.00 0.00 H new ATOM 0 HG3 PRO A 70 21.056 -0.322 -41.715 1.00 0.00 H new ATOM 0 HD2 PRO A 70 20.048 -1.717 -39.624 1.00 0.00 H new ATOM 0 HD3 PRO A 70 21.222 -0.443 -39.363 1.00 0.00 H new ATOM 844 N ASP A 71 16.769 0.186 -40.806 1.00 0.00 N ATOM 845 CA ASP A 71 15.325 -0.097 -40.962 1.00 0.00 C ATOM 846 C ASP A 71 15.107 -1.614 -40.825 1.00 0.00 C ATOM 847 O ASP A 71 14.802 -2.111 -39.733 1.00 0.00 O ATOM 848 CB ASP A 71 14.782 0.372 -42.358 1.00 0.00 C ATOM 849 CG ASP A 71 15.003 1.858 -42.660 1.00 0.00 C ATOM 850 OD1 ASP A 71 16.087 2.212 -43.179 1.00 0.00 O ATOM 851 OD2 ASP A 71 14.110 2.679 -42.367 1.00 0.00 O ATOM 0 H ASP A 71 17.372 -0.516 -41.234 1.00 0.00 H new ATOM 0 HA ASP A 71 14.784 0.453 -40.192 1.00 0.00 H new ATOM 0 HB2 ASP A 71 15.262 -0.219 -43.138 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.714 0.159 -42.408 1.00 0.00 H new ATOM 856 N ARG A 72 15.426 -2.350 -41.919 1.00 0.00 N ATOM 857 CA ARG A 72 15.061 -3.778 -42.132 1.00 0.00 C ATOM 858 C ARG A 72 15.932 -4.324 -43.279 1.00 0.00 C ATOM 859 O ARG A 72 16.283 -3.569 -44.192 1.00 0.00 O ATOM 860 CB ARG A 72 13.552 -3.938 -42.554 1.00 0.00 C ATOM 861 CG ARG A 72 12.486 -3.526 -41.495 1.00 0.00 C ATOM 862 CD ARG A 72 11.278 -2.775 -42.101 1.00 0.00 C ATOM 863 NE ARG A 72 11.695 -1.547 -42.819 1.00 0.00 N ATOM 864 CZ ARG A 72 11.059 -0.367 -42.790 1.00 0.00 C ATOM 865 NH1 ARG A 72 10.020 -0.167 -42.007 1.00 0.00 N ATOM 866 NH2 ARG A 72 11.491 0.630 -43.528 1.00 0.00 N ATOM 0 H ARG A 72 15.957 -1.960 -42.698 1.00 0.00 H new ATOM 0 HA ARG A 72 15.219 -4.318 -41.198 1.00 0.00 H new ATOM 0 HB2 ARG A 72 13.385 -3.346 -43.454 1.00 0.00 H new ATOM 0 HB3 ARG A 72 13.381 -4.981 -42.822 1.00 0.00 H new ATOM 0 HG2 ARG A 72 12.129 -4.419 -40.983 1.00 0.00 H new ATOM 0 HG3 ARG A 72 12.957 -2.894 -40.743 1.00 0.00 H new ATOM 0 HD2 ARG A 72 10.748 -3.435 -42.788 1.00 0.00 H new ATOM 0 HD3 ARG A 72 10.579 -2.512 -41.307 1.00 0.00 H new ATOM 0 HE ARG A 72 12.541 -1.605 -43.386 1.00 0.00 H new ATOM 0 HH11 ARG A 72 9.683 -0.918 -41.405 1.00 0.00 H new ATOM 0 HH12 ARG A 72 9.552 0.739 -42.002 1.00 0.00 H new ATOM 0 HH21 ARG A 72 12.310 0.506 -44.123 1.00 0.00 H new ATOM 0 HH22 ARG A 72 11.007 1.528 -43.506 1.00 0.00 H new ATOM 880 N GLY A 73 16.288 -5.620 -43.231 1.00 0.00 N ATOM 881 CA GLY A 73 16.961 -6.293 -44.366 1.00 0.00 C ATOM 882 C GLY A 73 18.476 -6.130 -44.389 1.00 0.00 C ATOM 883 O GLY A 73 19.177 -6.971 -44.960 1.00 0.00 O ATOM 0 H GLY A 73 16.124 -6.223 -42.425 1.00 0.00 H new ATOM 0 HA2 GLY A 73 16.723 -7.356 -44.334 1.00 0.00 H new ATOM 0 HA3 GLY A 73 16.552 -5.902 -45.298 1.00 0.00 H new ATOM 887 N ALA A 74 18.978 -5.034 -43.792 1.00 0.00 N ATOM 888 CA ALA A 74 20.423 -4.805 -43.583 1.00 0.00 C ATOM 889 C ALA A 74 20.987 -5.855 -42.574 1.00 0.00 C ATOM 890 O ALA A 74 20.185 -6.536 -41.909 1.00 0.00 O ATOM 891 CB ALA A 74 20.625 -3.354 -43.094 1.00 0.00 C ATOM 0 H ALA A 74 18.392 -4.278 -43.439 1.00 0.00 H new ATOM 0 HA ALA A 74 20.974 -4.932 -44.515 1.00 0.00 H new ATOM 0 HB1 ALA A 74 21.687 -3.168 -42.935 1.00 0.00 H new ATOM 0 HB2 ALA A 74 20.244 -2.661 -43.844 1.00 0.00 H new ATOM 0 HB3 ALA A 74 20.087 -3.207 -42.158 1.00 0.00 H new ATOM 897 N PRO A 75 22.355 -6.037 -42.455 1.00 0.00 N ATOM 898 CA PRO A 75 22.954 -6.989 -41.483 1.00 0.00 C ATOM 899 C PRO A 75 22.451 -6.730 -40.044 1.00 0.00 C ATOM 900 O PRO A 75 22.705 -5.664 -39.466 1.00 0.00 O ATOM 901 CB PRO A 75 24.493 -6.751 -41.613 1.00 0.00 C ATOM 902 CG PRO A 75 24.616 -5.433 -42.319 1.00 0.00 C ATOM 903 CD PRO A 75 23.425 -5.364 -43.244 1.00 0.00 C ATOM 0 HA PRO A 75 22.678 -8.023 -41.691 1.00 0.00 H new ATOM 0 HB2 PRO A 75 24.973 -6.723 -40.635 1.00 0.00 H new ATOM 0 HB3 PRO A 75 24.971 -7.550 -42.180 1.00 0.00 H new ATOM 0 HG2 PRO A 75 24.612 -4.605 -41.610 1.00 0.00 H new ATOM 0 HG3 PRO A 75 25.551 -5.371 -42.876 1.00 0.00 H new ATOM 0 HD2 PRO A 75 23.161 -4.335 -43.488 1.00 0.00 H new ATOM 0 HD3 PRO A 75 23.615 -5.876 -44.187 1.00 0.00 H new ATOM 911 N LEU A 76 21.676 -7.701 -39.529 1.00 0.00 N ATOM 912 CA LEU A 76 21.141 -7.701 -38.148 1.00 0.00 C ATOM 913 C LEU A 76 22.280 -7.657 -37.082 1.00 0.00 C ATOM 914 O LEU A 76 23.395 -8.124 -37.358 1.00 0.00 O ATOM 915 CB LEU A 76 20.177 -8.937 -37.944 1.00 0.00 C ATOM 916 CG LEU A 76 20.545 -10.290 -38.666 1.00 0.00 C ATOM 917 CD1 LEU A 76 21.891 -10.882 -38.216 1.00 0.00 C ATOM 918 CD2 LEU A 76 19.415 -11.329 -38.506 1.00 0.00 C ATOM 0 H LEU A 76 21.397 -8.522 -40.066 1.00 0.00 H new ATOM 0 HA LEU A 76 20.560 -6.790 -38.003 1.00 0.00 H new ATOM 0 HB2 LEU A 76 20.111 -9.136 -36.874 1.00 0.00 H new ATOM 0 HB3 LEU A 76 19.181 -8.642 -38.275 1.00 0.00 H new ATOM 0 HG LEU A 76 20.656 -10.042 -39.722 1.00 0.00 H new ATOM 0 HD11 LEU A 76 22.078 -11.811 -38.754 1.00 0.00 H new ATOM 0 HD12 LEU A 76 22.690 -10.172 -38.429 1.00 0.00 H new ATOM 0 HD13 LEU A 76 21.860 -11.083 -37.145 1.00 0.00 H new ATOM 0 HD21 LEU A 76 19.695 -12.252 -39.013 1.00 0.00 H new ATOM 0 HD22 LEU A 76 19.254 -11.531 -37.447 1.00 0.00 H new ATOM 0 HD23 LEU A 76 18.497 -10.938 -38.944 1.00 0.00 H new ATOM 930 N PRO A 77 22.021 -7.074 -35.856 1.00 0.00 N ATOM 931 CA PRO A 77 23.037 -6.981 -34.772 1.00 0.00 C ATOM 932 C PRO A 77 23.470 -8.374 -34.266 1.00 0.00 C ATOM 933 O PRO A 77 22.662 -9.308 -34.224 1.00 0.00 O ATOM 934 CB PRO A 77 22.301 -6.177 -33.658 1.00 0.00 C ATOM 935 CG PRO A 77 20.849 -6.432 -33.922 1.00 0.00 C ATOM 936 CD PRO A 77 20.724 -6.461 -35.426 1.00 0.00 C ATOM 0 HA PRO A 77 23.961 -6.507 -35.104 1.00 0.00 H new ATOM 0 HB2 PRO A 77 22.591 -6.517 -32.664 1.00 0.00 H new ATOM 0 HB3 PRO A 77 22.535 -5.114 -33.713 1.00 0.00 H new ATOM 0 HG2 PRO A 77 20.528 -7.376 -33.481 1.00 0.00 H new ATOM 0 HG3 PRO A 77 20.226 -5.649 -33.489 1.00 0.00 H new ATOM 0 HD2 PRO A 77 19.869 -7.055 -35.749 1.00 0.00 H new ATOM 0 HD3 PRO A 77 20.592 -5.461 -35.840 1.00 0.00 H new ATOM 944 N GLU A 78 24.753 -8.490 -33.886 1.00 0.00 N ATOM 945 CA GLU A 78 25.346 -9.738 -33.407 1.00 0.00 C ATOM 946 C GLU A 78 24.892 -10.014 -31.968 1.00 0.00 C ATOM 947 O GLU A 78 24.597 -11.147 -31.611 1.00 0.00 O ATOM 948 CB GLU A 78 26.897 -9.674 -33.506 1.00 0.00 C ATOM 949 CG GLU A 78 27.427 -9.433 -34.944 1.00 0.00 C ATOM 950 CD GLU A 78 28.953 -9.235 -35.000 1.00 0.00 C ATOM 951 OE1 GLU A 78 29.419 -8.102 -34.760 1.00 0.00 O ATOM 952 OE2 GLU A 78 29.691 -10.208 -35.261 1.00 0.00 O ATOM 0 H GLU A 78 25.409 -7.710 -33.905 1.00 0.00 H new ATOM 0 HA GLU A 78 25.006 -10.560 -34.036 1.00 0.00 H new ATOM 0 HB2 GLU A 78 27.260 -8.877 -32.857 1.00 0.00 H new ATOM 0 HB3 GLU A 78 27.314 -10.607 -33.128 1.00 0.00 H new ATOM 0 HG2 GLU A 78 27.153 -10.280 -35.572 1.00 0.00 H new ATOM 0 HG3 GLU A 78 26.937 -8.554 -35.363 1.00 0.00 H new ATOM 959 N ASN A 79 24.829 -8.956 -31.146 1.00 0.00 N ATOM 960 CA ASN A 79 24.405 -9.063 -29.739 1.00 0.00 C ATOM 961 C ASN A 79 23.002 -8.458 -29.600 1.00 0.00 C ATOM 962 O ASN A 79 22.787 -7.298 -29.968 1.00 0.00 O ATOM 963 CB ASN A 79 25.420 -8.359 -28.786 1.00 0.00 C ATOM 964 CG ASN A 79 26.768 -9.097 -28.609 1.00 0.00 C ATOM 965 OD1 ASN A 79 27.274 -9.752 -29.646 1.00 0.00 O flip ATOM 966 ND2 ASN A 79 27.369 -9.050 -27.541 1.00 0.00 N flip ATOM 0 H ASN A 79 25.069 -8.007 -31.434 1.00 0.00 H new ATOM 0 HA ASN A 79 24.378 -10.113 -29.449 1.00 0.00 H new ATOM 0 HB2 ASN A 79 25.618 -7.357 -29.167 1.00 0.00 H new ATOM 0 HB3 ASN A 79 24.955 -8.242 -27.807 1.00 0.00 H new ATOM 0 HD21 ASN A 79 26.968 -8.543 -26.752 1.00 0.00 H new ATOM 0 HD22 ASN A 79 28.270 -9.518 -27.442 1.00 0.00 H new ATOM 973 N ILE A 80 22.042 -9.277 -29.135 1.00 0.00 N ATOM 974 CA ILE A 80 20.653 -8.857 -28.870 1.00 0.00 C ATOM 975 C ILE A 80 20.394 -8.945 -27.351 1.00 0.00 C ATOM 976 O ILE A 80 20.296 -10.048 -26.800 1.00 0.00 O ATOM 977 CB ILE A 80 19.587 -9.747 -29.645 1.00 0.00 C ATOM 978 CG1 ILE A 80 19.806 -9.727 -31.211 1.00 0.00 C ATOM 979 CG2 ILE A 80 18.136 -9.311 -29.287 1.00 0.00 C ATOM 980 CD1 ILE A 80 20.936 -10.608 -31.742 1.00 0.00 C ATOM 0 H ILE A 80 22.210 -10.262 -28.930 1.00 0.00 H new ATOM 0 HA ILE A 80 20.536 -7.835 -29.230 1.00 0.00 H new ATOM 0 HB ILE A 80 19.736 -10.775 -29.316 1.00 0.00 H new ATOM 0 HG12 ILE A 80 18.877 -10.034 -31.691 1.00 0.00 H new ATOM 0 HG13 ILE A 80 19.999 -8.699 -31.518 1.00 0.00 H new ATOM 0 HG21 ILE A 80 17.425 -9.934 -29.829 1.00 0.00 H new ATOM 0 HG22 ILE A 80 17.976 -9.426 -28.215 1.00 0.00 H new ATOM 0 HG23 ILE A 80 17.990 -8.267 -29.566 1.00 0.00 H new ATOM 0 HD11 ILE A 80 20.992 -10.514 -32.826 1.00 0.00 H new ATOM 0 HD12 ILE A 80 21.881 -10.292 -31.301 1.00 0.00 H new ATOM 0 HD13 ILE A 80 20.742 -11.647 -31.478 1.00 0.00 H new ATOM 992 N ILE A 81 20.311 -7.779 -26.681 1.00 0.00 N ATOM 993 CA ILE A 81 20.047 -7.697 -25.229 1.00 0.00 C ATOM 994 C ILE A 81 18.534 -7.647 -24.969 1.00 0.00 C ATOM 995 O ILE A 81 17.832 -6.785 -25.511 1.00 0.00 O ATOM 996 CB ILE A 81 20.720 -6.432 -24.570 1.00 0.00 C ATOM 997 CG1 ILE A 81 22.255 -6.421 -24.855 1.00 0.00 C ATOM 998 CG2 ILE A 81 20.435 -6.365 -23.037 1.00 0.00 C ATOM 999 CD1 ILE A 81 23.028 -7.563 -24.215 1.00 0.00 C ATOM 0 H ILE A 81 20.425 -6.869 -27.128 1.00 0.00 H new ATOM 0 HA ILE A 81 20.481 -8.589 -24.777 1.00 0.00 H new ATOM 0 HB ILE A 81 20.278 -5.543 -25.021 1.00 0.00 H new ATOM 0 HG12 ILE A 81 22.411 -6.454 -25.933 1.00 0.00 H new ATOM 0 HG13 ILE A 81 22.670 -5.477 -24.502 1.00 0.00 H new ATOM 0 HG21 ILE A 81 20.914 -5.481 -22.616 1.00 0.00 H new ATOM 0 HG22 ILE A 81 19.359 -6.310 -22.869 1.00 0.00 H new ATOM 0 HG23 ILE A 81 20.832 -7.258 -22.554 1.00 0.00 H new ATOM 0 HD11 ILE A 81 24.085 -7.473 -24.467 1.00 0.00 H new ATOM 0 HD12 ILE A 81 22.909 -7.522 -23.132 1.00 0.00 H new ATOM 0 HD13 ILE A 81 22.646 -8.514 -24.586 1.00 0.00 H new ATOM 1011 N LEU A 82 18.062 -8.582 -24.138 1.00 0.00 N ATOM 1012 CA LEU A 82 16.679 -8.628 -23.630 1.00 0.00 C ATOM 1013 C LEU A 82 16.725 -8.935 -22.126 1.00 0.00 C ATOM 1014 O LEU A 82 16.581 -10.083 -21.705 1.00 0.00 O ATOM 1015 CB LEU A 82 15.834 -9.684 -24.395 1.00 0.00 C ATOM 1016 CG LEU A 82 15.547 -9.388 -25.899 1.00 0.00 C ATOM 1017 CD1 LEU A 82 14.759 -10.539 -26.561 1.00 0.00 C ATOM 1018 CD2 LEU A 82 14.804 -8.043 -26.056 1.00 0.00 C ATOM 0 H LEU A 82 18.640 -9.347 -23.790 1.00 0.00 H new ATOM 0 HA LEU A 82 16.197 -7.664 -23.792 1.00 0.00 H new ATOM 0 HB2 LEU A 82 16.346 -10.644 -24.328 1.00 0.00 H new ATOM 0 HB3 LEU A 82 14.879 -9.795 -23.881 1.00 0.00 H new ATOM 0 HG LEU A 82 16.505 -9.312 -26.414 1.00 0.00 H new ATOM 0 HD11 LEU A 82 14.576 -10.299 -27.609 1.00 0.00 H new ATOM 0 HD12 LEU A 82 15.337 -11.461 -26.495 1.00 0.00 H new ATOM 0 HD13 LEU A 82 13.807 -10.670 -26.047 1.00 0.00 H new ATOM 0 HD21 LEU A 82 14.613 -7.854 -27.112 1.00 0.00 H new ATOM 0 HD22 LEU A 82 13.857 -8.085 -25.518 1.00 0.00 H new ATOM 0 HD23 LEU A 82 15.417 -7.239 -25.649 1.00 0.00 H new ATOM 1030 N ASP A 83 16.961 -7.877 -21.341 1.00 0.00 N ATOM 1031 CA ASP A 83 17.195 -7.957 -19.884 1.00 0.00 C ATOM 1032 C ASP A 83 15.955 -8.462 -19.115 1.00 0.00 C ATOM 1033 O ASP A 83 16.080 -9.068 -18.046 1.00 0.00 O ATOM 1034 CB ASP A 83 17.631 -6.563 -19.340 1.00 0.00 C ATOM 1035 CG ASP A 83 16.544 -5.470 -19.477 1.00 0.00 C ATOM 1036 OD1 ASP A 83 16.103 -5.199 -20.618 1.00 0.00 O ATOM 1037 OD2 ASP A 83 16.125 -4.880 -18.453 1.00 0.00 O ATOM 0 H ASP A 83 16.996 -6.923 -21.701 1.00 0.00 H new ATOM 0 HA ASP A 83 17.992 -8.683 -19.722 1.00 0.00 H new ATOM 0 HB2 ASP A 83 17.902 -6.662 -18.289 1.00 0.00 H new ATOM 0 HB3 ASP A 83 18.526 -6.240 -19.871 1.00 0.00 H new ATOM 1042 N ASP A 84 14.764 -8.193 -19.670 1.00 0.00 N ATOM 1043 CA ASP A 84 13.475 -8.490 -19.011 1.00 0.00 C ATOM 1044 C ASP A 84 12.590 -9.400 -19.898 1.00 0.00 C ATOM 1045 O ASP A 84 11.362 -9.285 -19.876 1.00 0.00 O ATOM 1046 CB ASP A 84 12.756 -7.146 -18.647 1.00 0.00 C ATOM 1047 CG ASP A 84 11.657 -7.314 -17.573 1.00 0.00 C ATOM 1048 OD1 ASP A 84 11.969 -7.203 -16.368 1.00 0.00 O ATOM 1049 OD2 ASP A 84 10.477 -7.563 -17.921 1.00 0.00 O ATOM 0 H ASP A 84 14.663 -7.763 -20.589 1.00 0.00 H new ATOM 0 HA ASP A 84 13.660 -9.042 -18.089 1.00 0.00 H new ATOM 0 HB2 ASP A 84 13.497 -6.430 -18.290 1.00 0.00 H new ATOM 0 HB3 ASP A 84 12.312 -6.723 -19.548 1.00 0.00 H new ATOM 1054 N MET A 85 13.190 -10.319 -20.684 1.00 0.00 N ATOM 1055 CA MET A 85 12.388 -11.220 -21.552 1.00 0.00 C ATOM 1056 C MET A 85 11.669 -12.252 -20.652 1.00 0.00 C ATOM 1057 O MET A 85 12.240 -13.291 -20.287 1.00 0.00 O ATOM 1058 CB MET A 85 13.258 -11.906 -22.646 1.00 0.00 C ATOM 1059 CG MET A 85 12.621 -11.909 -24.051 1.00 0.00 C ATOM 1060 SD MET A 85 10.987 -12.677 -24.124 1.00 0.00 S ATOM 1061 CE MET A 85 11.393 -14.390 -23.818 1.00 0.00 C ATOM 0 H MET A 85 14.199 -10.459 -20.739 1.00 0.00 H new ATOM 0 HA MET A 85 11.647 -10.633 -22.094 1.00 0.00 H new ATOM 0 HB2 MET A 85 14.222 -11.400 -22.698 1.00 0.00 H new ATOM 0 HB3 MET A 85 13.454 -12.935 -22.346 1.00 0.00 H new ATOM 0 HG2 MET A 85 12.543 -10.881 -24.404 1.00 0.00 H new ATOM 0 HG3 MET A 85 13.287 -12.432 -24.738 1.00 0.00 H new ATOM 0 HE1 MET A 85 10.765 -15.029 -24.438 1.00 0.00 H new ATOM 0 HE2 MET A 85 12.441 -14.565 -24.062 1.00 0.00 H new ATOM 0 HE3 MET A 85 11.222 -14.622 -22.767 1.00 0.00 H new ATOM 1071 N ASP A 86 10.438 -11.872 -20.256 1.00 0.00 N ATOM 1072 CA ASP A 86 9.664 -12.512 -19.182 1.00 0.00 C ATOM 1073 C ASP A 86 10.520 -12.621 -17.892 1.00 0.00 C ATOM 1074 O ASP A 86 10.674 -13.699 -17.302 1.00 0.00 O ATOM 1075 CB ASP A 86 9.053 -13.874 -19.638 1.00 0.00 C ATOM 1076 CG ASP A 86 7.923 -14.415 -18.725 1.00 0.00 C ATOM 1077 OD1 ASP A 86 7.386 -13.668 -17.867 1.00 0.00 O ATOM 1078 OD2 ASP A 86 7.530 -15.586 -18.895 1.00 0.00 O ATOM 0 H ASP A 86 9.945 -11.091 -20.688 1.00 0.00 H new ATOM 0 HA ASP A 86 8.809 -11.880 -18.944 1.00 0.00 H new ATOM 0 HB2 ASP A 86 8.662 -13.761 -20.649 1.00 0.00 H new ATOM 0 HB3 ASP A 86 9.850 -14.616 -19.686 1.00 0.00 H new ATOM 1083 N GLY A 87 11.132 -11.469 -17.521 1.00 0.00 N ATOM 1084 CA GLY A 87 11.950 -11.346 -16.310 1.00 0.00 C ATOM 1085 C GLY A 87 13.339 -11.956 -16.423 1.00 0.00 C ATOM 1086 O GLY A 87 14.147 -11.825 -15.495 1.00 0.00 O ATOM 0 H GLY A 87 11.066 -10.605 -18.059 1.00 0.00 H new ATOM 0 HA2 GLY A 87 12.050 -10.290 -16.060 1.00 0.00 H new ATOM 0 HA3 GLY A 87 11.424 -11.821 -15.482 1.00 0.00 H new ATOM 1090 N CYS A 88 13.620 -12.614 -17.566 1.00 0.00 N ATOM 1091 CA CYS A 88 14.866 -13.340 -17.794 1.00 0.00 C ATOM 1092 C CYS A 88 15.797 -12.516 -18.694 1.00 0.00 C ATOM 1093 O CYS A 88 15.399 -12.066 -19.785 1.00 0.00 O ATOM 1094 CB CYS A 88 14.546 -14.711 -18.408 1.00 0.00 C ATOM 1095 SG CYS A 88 13.418 -15.686 -17.386 1.00 0.00 S ATOM 0 H CYS A 88 12.977 -12.651 -18.357 1.00 0.00 H new ATOM 0 HA CYS A 88 15.384 -13.501 -16.849 1.00 0.00 H new ATOM 0 HB2 CYS A 88 14.105 -14.569 -19.395 1.00 0.00 H new ATOM 0 HB3 CYS A 88 15.473 -15.266 -18.550 1.00 0.00 H new ATOM 0 HG CYS A 88 12.301 -15.039 -17.234 1.00 0.00 H new ATOM 1101 N ARG A 89 17.026 -12.314 -18.202 1.00 0.00 N ATOM 1102 CA ARG A 89 18.080 -11.566 -18.890 1.00 0.00 C ATOM 1103 C ARG A 89 18.750 -12.487 -19.930 1.00 0.00 C ATOM 1104 O ARG A 89 19.640 -13.268 -19.590 1.00 0.00 O ATOM 1105 CB ARG A 89 19.094 -11.014 -17.818 1.00 0.00 C ATOM 1106 CG ARG A 89 20.097 -9.923 -18.299 1.00 0.00 C ATOM 1107 CD ARG A 89 21.242 -10.463 -19.167 1.00 0.00 C ATOM 1108 NE ARG A 89 22.155 -9.399 -19.593 1.00 0.00 N ATOM 1109 CZ ARG A 89 23.181 -9.557 -20.434 1.00 0.00 C ATOM 1110 NH1 ARG A 89 23.553 -10.769 -20.829 1.00 0.00 N ATOM 1111 NH2 ARG A 89 23.867 -8.498 -20.838 1.00 0.00 N ATOM 0 H ARG A 89 17.319 -12.675 -17.294 1.00 0.00 H new ATOM 0 HA ARG A 89 17.675 -10.709 -19.428 1.00 0.00 H new ATOM 0 HB2 ARG A 89 18.520 -10.606 -16.986 1.00 0.00 H new ATOM 0 HB3 ARG A 89 19.667 -11.855 -17.428 1.00 0.00 H new ATOM 0 HG2 ARG A 89 19.552 -9.168 -18.865 1.00 0.00 H new ATOM 0 HG3 ARG A 89 20.520 -9.424 -17.427 1.00 0.00 H new ATOM 0 HD2 ARG A 89 21.798 -11.215 -18.607 1.00 0.00 H new ATOM 0 HD3 ARG A 89 20.829 -10.959 -20.045 1.00 0.00 H new ATOM 0 HE ARG A 89 21.995 -8.464 -19.218 1.00 0.00 H new ATOM 0 HH11 ARG A 89 23.054 -11.591 -20.490 1.00 0.00 H new ATOM 0 HH12 ARG A 89 24.338 -10.878 -21.471 1.00 0.00 H new ATOM 0 HH21 ARG A 89 23.611 -7.568 -20.507 1.00 0.00 H new ATOM 0 HH22 ARG A 89 24.651 -8.613 -21.480 1.00 0.00 H new ATOM 1125 N VAL A 90 18.298 -12.397 -21.188 1.00 0.00 N ATOM 1126 CA VAL A 90 18.862 -13.169 -22.313 1.00 0.00 C ATOM 1127 C VAL A 90 19.666 -12.263 -23.256 1.00 0.00 C ATOM 1128 O VAL A 90 19.250 -11.151 -23.583 1.00 0.00 O ATOM 1129 CB VAL A 90 17.772 -14.004 -23.102 1.00 0.00 C ATOM 1130 CG1 VAL A 90 16.485 -13.212 -23.359 1.00 0.00 C ATOM 1131 CG2 VAL A 90 18.333 -14.610 -24.425 1.00 0.00 C ATOM 0 H VAL A 90 17.528 -11.785 -21.459 1.00 0.00 H new ATOM 0 HA VAL A 90 19.543 -13.899 -21.876 1.00 0.00 H new ATOM 0 HB VAL A 90 17.508 -14.834 -22.446 1.00 0.00 H new ATOM 0 HG11 VAL A 90 15.776 -13.836 -23.903 1.00 0.00 H new ATOM 0 HG12 VAL A 90 16.047 -12.910 -22.407 1.00 0.00 H new ATOM 0 HG13 VAL A 90 16.715 -12.325 -23.950 1.00 0.00 H new ATOM 0 HG21 VAL A 90 17.548 -15.173 -24.929 1.00 0.00 H new ATOM 0 HG22 VAL A 90 18.678 -13.806 -25.076 1.00 0.00 H new ATOM 0 HG23 VAL A 90 19.166 -15.275 -24.196 1.00 0.00 H new ATOM 1141 N GLU A 91 20.835 -12.775 -23.661 1.00 0.00 N ATOM 1142 CA GLU A 91 21.731 -12.151 -24.625 1.00 0.00 C ATOM 1143 C GLU A 91 21.963 -13.149 -25.771 1.00 0.00 C ATOM 1144 O GLU A 91 22.567 -14.212 -25.566 1.00 0.00 O ATOM 1145 CB GLU A 91 23.064 -11.775 -23.928 1.00 0.00 C ATOM 1146 CG GLU A 91 24.072 -11.009 -24.812 1.00 0.00 C ATOM 1147 CD GLU A 91 25.344 -10.590 -24.048 1.00 0.00 C ATOM 1148 OE1 GLU A 91 25.235 -9.878 -23.038 1.00 0.00 O ATOM 1149 OE2 GLU A 91 26.455 -10.928 -24.466 1.00 0.00 O ATOM 0 H GLU A 91 21.189 -13.665 -23.311 1.00 0.00 H new ATOM 0 HA GLU A 91 21.297 -11.235 -25.026 1.00 0.00 H new ATOM 0 HB2 GLU A 91 22.839 -11.168 -23.051 1.00 0.00 H new ATOM 0 HB3 GLU A 91 23.539 -12.688 -23.570 1.00 0.00 H new ATOM 0 HG2 GLU A 91 24.353 -11.635 -25.659 1.00 0.00 H new ATOM 0 HG3 GLU A 91 23.589 -10.120 -25.218 1.00 0.00 H new ATOM 1156 N PHE A 92 21.411 -12.836 -26.953 1.00 0.00 N ATOM 1157 CA PHE A 92 21.632 -13.632 -28.168 1.00 0.00 C ATOM 1158 C PHE A 92 22.964 -13.204 -28.795 1.00 0.00 C ATOM 1159 O PHE A 92 23.108 -12.057 -29.224 1.00 0.00 O ATOM 1160 CB PHE A 92 20.479 -13.435 -29.177 1.00 0.00 C ATOM 1161 CG PHE A 92 19.108 -13.875 -28.661 1.00 0.00 C ATOM 1162 CD1 PHE A 92 18.743 -15.213 -28.704 1.00 0.00 C ATOM 1163 CD2 PHE A 92 18.188 -12.962 -28.144 1.00 0.00 C ATOM 1164 CE1 PHE A 92 17.509 -15.630 -28.252 1.00 0.00 C ATOM 1165 CE2 PHE A 92 16.952 -13.381 -27.694 1.00 0.00 C ATOM 1166 CZ PHE A 92 16.609 -14.716 -27.749 1.00 0.00 C ATOM 0 H PHE A 92 20.803 -12.029 -27.093 1.00 0.00 H new ATOM 0 HA PHE A 92 21.663 -14.690 -27.906 1.00 0.00 H new ATOM 0 HB2 PHE A 92 20.429 -12.382 -29.453 1.00 0.00 H new ATOM 0 HB3 PHE A 92 20.708 -13.992 -30.086 1.00 0.00 H new ATOM 0 HD1 PHE A 92 19.437 -15.940 -29.098 1.00 0.00 H new ATOM 0 HD2 PHE A 92 18.446 -11.914 -28.095 1.00 0.00 H new ATOM 0 HE1 PHE A 92 17.247 -16.677 -28.292 1.00 0.00 H new ATOM 0 HE2 PHE A 92 16.251 -12.661 -27.298 1.00 0.00 H new ATOM 0 HZ PHE A 92 15.641 -15.043 -27.400 1.00 0.00 H new ATOM 1176 N ASN A 93 23.934 -14.121 -28.825 1.00 0.00 N ATOM 1177 CA ASN A 93 25.279 -13.854 -29.348 1.00 0.00 C ATOM 1178 C ASN A 93 25.507 -14.642 -30.635 1.00 0.00 C ATOM 1179 O ASN A 93 25.713 -15.856 -30.607 1.00 0.00 O ATOM 1180 CB ASN A 93 26.359 -14.213 -28.295 1.00 0.00 C ATOM 1181 CG ASN A 93 26.296 -13.306 -27.071 1.00 0.00 C ATOM 1182 OD1 ASN A 93 25.636 -13.617 -26.082 1.00 0.00 O ATOM 1183 ND2 ASN A 93 26.960 -12.164 -27.144 1.00 0.00 N ATOM 0 H ASN A 93 23.809 -15.075 -28.486 1.00 0.00 H new ATOM 0 HA ASN A 93 25.360 -12.790 -29.568 1.00 0.00 H new ATOM 0 HB2 ASN A 93 26.230 -15.250 -27.984 1.00 0.00 H new ATOM 0 HB3 ASN A 93 27.347 -14.138 -28.750 1.00 0.00 H new ATOM 0 HD21 ASN A 93 26.934 -11.508 -26.363 1.00 0.00 H new ATOM 0 HD22 ASN A 93 27.498 -11.939 -27.981 1.00 0.00 H new ATOM 1190 N LEU A 94 25.409 -13.938 -31.764 1.00 0.00 N ATOM 1191 CA LEU A 94 25.848 -14.442 -33.063 1.00 0.00 C ATOM 1192 C LEU A 94 27.380 -14.591 -33.044 1.00 0.00 C ATOM 1193 O LEU A 94 28.061 -13.808 -32.363 1.00 0.00 O ATOM 1194 CB LEU A 94 25.409 -13.476 -34.197 1.00 0.00 C ATOM 1195 CG LEU A 94 23.887 -13.159 -34.256 1.00 0.00 C ATOM 1196 CD1 LEU A 94 23.539 -12.223 -35.429 1.00 0.00 C ATOM 1197 CD2 LEU A 94 23.046 -14.432 -34.318 1.00 0.00 C ATOM 0 H LEU A 94 25.020 -12.996 -31.801 1.00 0.00 H new ATOM 0 HA LEU A 94 25.389 -15.412 -33.254 1.00 0.00 H new ATOM 0 HB2 LEU A 94 25.953 -12.539 -34.083 1.00 0.00 H new ATOM 0 HB3 LEU A 94 25.710 -13.905 -35.153 1.00 0.00 H new ATOM 0 HG LEU A 94 23.643 -12.638 -33.330 1.00 0.00 H new ATOM 0 HD11 LEU A 94 22.467 -12.028 -35.433 1.00 0.00 H new ATOM 0 HD12 LEU A 94 24.079 -11.283 -35.317 1.00 0.00 H new ATOM 0 HD13 LEU A 94 23.825 -12.695 -36.369 1.00 0.00 H new ATOM 0 HD21 LEU A 94 21.989 -14.168 -34.358 1.00 0.00 H new ATOM 0 HD22 LEU A 94 23.312 -15.001 -35.209 1.00 0.00 H new ATOM 0 HD23 LEU A 94 23.236 -15.037 -33.431 1.00 0.00 H new ATOM 1209 N PRO A 95 27.947 -15.581 -33.786 1.00 0.00 N ATOM 1210 CA PRO A 95 29.389 -15.864 -33.750 1.00 0.00 C ATOM 1211 C PRO A 95 30.208 -14.766 -34.450 1.00 0.00 C ATOM 1212 O PRO A 95 29.675 -13.974 -35.242 1.00 0.00 O ATOM 1213 CB PRO A 95 29.492 -17.213 -34.493 1.00 0.00 C ATOM 1214 CG PRO A 95 28.375 -17.163 -35.474 1.00 0.00 C ATOM 1215 CD PRO A 95 27.242 -16.470 -34.753 1.00 0.00 C ATOM 0 HA PRO A 95 29.791 -15.898 -32.738 1.00 0.00 H new ATOM 0 HB2 PRO A 95 30.456 -17.324 -34.990 1.00 0.00 H new ATOM 0 HB3 PRO A 95 29.387 -18.055 -33.809 1.00 0.00 H new ATOM 0 HG2 PRO A 95 28.664 -16.615 -36.371 1.00 0.00 H new ATOM 0 HG3 PRO A 95 28.085 -18.165 -35.791 1.00 0.00 H new ATOM 0 HD2 PRO A 95 26.616 -15.901 -35.440 1.00 0.00 H new ATOM 0 HD3 PRO A 95 26.592 -17.183 -34.245 1.00 0.00 H new ATOM 1223 N GLY A 96 31.504 -14.752 -34.149 1.00 0.00 N ATOM 1224 CA GLY A 96 32.440 -13.813 -34.751 1.00 0.00 C ATOM 1225 C GLY A 96 32.864 -14.247 -36.148 1.00 0.00 C ATOM 1226 O GLY A 96 32.596 -15.386 -36.560 1.00 0.00 O ATOM 0 H GLY A 96 31.933 -15.392 -33.481 1.00 0.00 H new ATOM 0 HA2 GLY A 96 31.981 -12.826 -34.802 1.00 0.00 H new ATOM 0 HA3 GLY A 96 33.321 -13.722 -34.116 1.00 0.00 H new ATOM 1230 N GLU A 97 33.541 -13.340 -36.861 1.00 0.00 N ATOM 1231 CA GLU A 97 34.017 -13.565 -38.246 1.00 0.00 C ATOM 1232 C GLU A 97 35.039 -14.728 -38.337 1.00 0.00 C ATOM 1233 O GLU A 97 35.139 -15.399 -39.369 1.00 0.00 O ATOM 1234 CB GLU A 97 34.612 -12.242 -38.805 1.00 0.00 C ATOM 1235 CG GLU A 97 35.779 -11.663 -37.971 1.00 0.00 C ATOM 1236 CD GLU A 97 36.228 -10.273 -38.445 1.00 0.00 C ATOM 1237 OE1 GLU A 97 37.105 -10.184 -39.329 1.00 0.00 O ATOM 1238 OE2 GLU A 97 35.695 -9.261 -37.950 1.00 0.00 O ATOM 0 H GLU A 97 33.780 -12.418 -36.497 1.00 0.00 H new ATOM 0 HA GLU A 97 33.165 -13.864 -38.857 1.00 0.00 H new ATOM 0 HB2 GLU A 97 34.961 -12.416 -39.823 1.00 0.00 H new ATOM 0 HB3 GLU A 97 33.818 -11.497 -38.863 1.00 0.00 H new ATOM 0 HG2 GLU A 97 35.476 -11.603 -36.926 1.00 0.00 H new ATOM 0 HG3 GLU A 97 36.626 -12.347 -38.019 1.00 0.00 H new ATOM 1245 N ASN A 98 35.769 -14.974 -37.231 1.00 0.00 N ATOM 1246 CA ASN A 98 36.810 -16.019 -37.150 1.00 0.00 C ATOM 1247 C ASN A 98 36.266 -17.365 -36.630 1.00 0.00 C ATOM 1248 O ASN A 98 37.027 -18.331 -36.532 1.00 0.00 O ATOM 1249 CB ASN A 98 37.982 -15.528 -36.253 1.00 0.00 C ATOM 1250 CG ASN A 98 37.588 -15.117 -34.818 1.00 0.00 C ATOM 1251 OD1 ASN A 98 36.628 -15.614 -34.228 1.00 0.00 O ATOM 1252 ND2 ASN A 98 38.354 -14.212 -34.232 1.00 0.00 N ATOM 0 H ASN A 98 35.653 -14.450 -36.363 1.00 0.00 H new ATOM 0 HA ASN A 98 37.169 -16.196 -38.164 1.00 0.00 H new ATOM 0 HB2 ASN A 98 38.729 -16.320 -36.194 1.00 0.00 H new ATOM 0 HB3 ASN A 98 38.458 -14.676 -36.739 1.00 0.00 H new ATOM 0 HD21 ASN A 98 38.154 -13.916 -33.277 1.00 0.00 H new ATOM 0 HD22 ASN A 98 39.145 -13.811 -34.735 1.00 0.00 H new ATOM 1259 N ASN A 99 34.960 -17.433 -36.292 1.00 0.00 N ATOM 1260 CA ASN A 99 34.347 -18.665 -35.736 1.00 0.00 C ATOM 1261 C ASN A 99 34.165 -19.729 -36.834 1.00 0.00 C ATOM 1262 O ASN A 99 33.861 -19.403 -37.989 1.00 0.00 O ATOM 1263 CB ASN A 99 32.989 -18.371 -35.036 1.00 0.00 C ATOM 1264 CG ASN A 99 33.107 -17.597 -33.709 1.00 0.00 C ATOM 1265 OD1 ASN A 99 33.991 -16.613 -33.636 1.00 0.00 O flip ATOM 1266 ND2 ASN A 99 32.355 -17.849 -32.770 1.00 0.00 N flip ATOM 0 H ASN A 99 34.310 -16.654 -36.393 1.00 0.00 H new ATOM 0 HA ASN A 99 35.031 -19.053 -34.981 1.00 0.00 H new ATOM 0 HB2 ASN A 99 32.359 -17.802 -35.719 1.00 0.00 H new ATOM 0 HB3 ASN A 99 32.481 -19.316 -34.846 1.00 0.00 H new ATOM 0 HD21 ASN A 99 31.681 -18.611 -32.846 1.00 0.00 H new ATOM 0 HD22 ASN A 99 32.405 -17.296 -31.914 1.00 0.00 H new ATOM 1273 N GLU A 100 34.377 -20.998 -36.455 1.00 0.00 N ATOM 1274 CA GLU A 100 34.278 -22.152 -37.367 1.00 0.00 C ATOM 1275 C GLU A 100 32.876 -22.794 -37.281 1.00 0.00 C ATOM 1276 O GLU A 100 32.349 -23.293 -38.286 1.00 0.00 O ATOM 1277 CB GLU A 100 35.385 -23.195 -37.021 1.00 0.00 C ATOM 1278 CG GLU A 100 35.531 -24.357 -38.030 1.00 0.00 C ATOM 1279 CD GLU A 100 35.885 -23.883 -39.456 1.00 0.00 C ATOM 1280 OE1 GLU A 100 37.056 -23.532 -39.697 1.00 0.00 O ATOM 1281 OE2 GLU A 100 34.994 -23.852 -40.336 1.00 0.00 O ATOM 0 H GLU A 100 34.624 -21.256 -35.500 1.00 0.00 H new ATOM 0 HA GLU A 100 34.428 -21.808 -38.390 1.00 0.00 H new ATOM 0 HB2 GLU A 100 36.341 -22.676 -36.948 1.00 0.00 H new ATOM 0 HB3 GLU A 100 35.173 -23.613 -36.037 1.00 0.00 H new ATOM 0 HG2 GLU A 100 36.304 -25.040 -37.679 1.00 0.00 H new ATOM 0 HG3 GLU A 100 34.599 -24.921 -38.062 1.00 0.00 H new ATOM 1288 N ALA A 101 32.280 -22.759 -36.067 1.00 0.00 N ATOM 1289 CA ALA A 101 30.970 -23.392 -35.785 1.00 0.00 C ATOM 1290 C ALA A 101 29.808 -22.671 -36.495 1.00 0.00 C ATOM 1291 O ALA A 101 28.907 -23.324 -37.039 1.00 0.00 O ATOM 1292 CB ALA A 101 30.726 -23.432 -34.268 1.00 0.00 C ATOM 0 H ALA A 101 32.691 -22.293 -35.258 1.00 0.00 H new ATOM 0 HA ALA A 101 31.004 -24.408 -36.178 1.00 0.00 H new ATOM 0 HB1 ALA A 101 29.762 -23.898 -34.067 1.00 0.00 H new ATOM 0 HB2 ALA A 101 31.516 -24.010 -33.788 1.00 0.00 H new ATOM 0 HB3 ALA A 101 30.727 -22.416 -33.872 1.00 0.00 H new ATOM 1298 N GLY A 102 29.862 -21.321 -36.491 1.00 0.00 N ATOM 1299 CA GLY A 102 28.827 -20.486 -37.106 1.00 0.00 C ATOM 1300 C GLY A 102 27.443 -20.699 -36.491 1.00 0.00 C ATOM 1301 O GLY A 102 26.475 -20.971 -37.209 1.00 0.00 O ATOM 0 H GLY A 102 30.621 -20.791 -36.063 1.00 0.00 H new ATOM 0 HA2 GLY A 102 29.106 -19.437 -37.004 1.00 0.00 H new ATOM 0 HA3 GLY A 102 28.781 -20.701 -38.174 1.00 0.00 H new ATOM 1305 N GLN A 103 27.356 -20.599 -35.154 1.00 0.00 N ATOM 1306 CA GLN A 103 26.110 -20.865 -34.402 1.00 0.00 C ATOM 1307 C GLN A 103 25.829 -19.744 -33.401 1.00 0.00 C ATOM 1308 O GLN A 103 26.748 -19.063 -32.939 1.00 0.00 O ATOM 1309 CB GLN A 103 26.190 -22.224 -33.655 1.00 0.00 C ATOM 1310 CG GLN A 103 26.343 -23.457 -34.570 1.00 0.00 C ATOM 1311 CD GLN A 103 26.253 -24.795 -33.833 1.00 0.00 C ATOM 1312 OE1 GLN A 103 25.441 -24.859 -32.782 1.00 0.00 O flip ATOM 1313 NE2 GLN A 103 26.882 -25.776 -34.229 1.00 0.00 N flip ATOM 0 H GLN A 103 28.143 -20.333 -34.562 1.00 0.00 H new ATOM 0 HA GLN A 103 25.294 -20.908 -35.123 1.00 0.00 H new ATOM 0 HB2 GLN A 103 27.033 -22.194 -32.965 1.00 0.00 H new ATOM 0 HB3 GLN A 103 25.290 -22.345 -33.053 1.00 0.00 H new ATOM 0 HG2 GLN A 103 25.570 -23.425 -35.338 1.00 0.00 H new ATOM 0 HG3 GLN A 103 27.304 -23.400 -35.082 1.00 0.00 H new ATOM 0 HE21 GLN A 103 27.497 -25.695 -35.039 1.00 0.00 H new ATOM 0 HE22 GLN A 103 26.788 -26.670 -33.748 1.00 0.00 H new ATOM 1322 N VAL A 104 24.542 -19.585 -33.080 1.00 0.00 N ATOM 1323 CA VAL A 104 24.043 -18.577 -32.142 1.00 0.00 C ATOM 1324 C VAL A 104 24.024 -19.154 -30.721 1.00 0.00 C ATOM 1325 O VAL A 104 23.393 -20.188 -30.475 1.00 0.00 O ATOM 1326 CB VAL A 104 22.591 -18.125 -32.536 1.00 0.00 C ATOM 1327 CG1 VAL A 104 22.083 -16.938 -31.674 1.00 0.00 C ATOM 1328 CG2 VAL A 104 22.511 -17.822 -34.044 1.00 0.00 C ATOM 0 H VAL A 104 23.802 -20.166 -33.474 1.00 0.00 H new ATOM 0 HA VAL A 104 24.706 -17.713 -32.181 1.00 0.00 H new ATOM 0 HB VAL A 104 21.919 -18.956 -32.323 1.00 0.00 H new ATOM 0 HG11 VAL A 104 21.075 -16.666 -31.988 1.00 0.00 H new ATOM 0 HG12 VAL A 104 22.070 -17.230 -30.624 1.00 0.00 H new ATOM 0 HG13 VAL A 104 22.747 -16.083 -31.804 1.00 0.00 H new ATOM 0 HG21 VAL A 104 21.498 -17.510 -34.299 1.00 0.00 H new ATOM 0 HG22 VAL A 104 23.210 -17.023 -34.292 1.00 0.00 H new ATOM 0 HG23 VAL A 104 22.768 -18.718 -34.609 1.00 0.00 H new ATOM 1338 N ILE A 105 24.714 -18.474 -29.804 1.00 0.00 N ATOM 1339 CA ILE A 105 24.767 -18.849 -28.386 1.00 0.00 C ATOM 1340 C ILE A 105 23.733 -17.993 -27.634 1.00 0.00 C ATOM 1341 O ILE A 105 23.894 -16.771 -27.529 1.00 0.00 O ATOM 1342 CB ILE A 105 26.213 -18.641 -27.762 1.00 0.00 C ATOM 1343 CG1 ILE A 105 27.297 -19.575 -28.435 1.00 0.00 C ATOM 1344 CG2 ILE A 105 26.194 -18.848 -26.223 1.00 0.00 C ATOM 1345 CD1 ILE A 105 27.733 -19.181 -29.845 1.00 0.00 C ATOM 0 H ILE A 105 25.257 -17.639 -30.025 1.00 0.00 H new ATOM 0 HA ILE A 105 24.539 -19.911 -28.291 1.00 0.00 H new ATOM 0 HB ILE A 105 26.499 -17.610 -27.970 1.00 0.00 H new ATOM 0 HG12 ILE A 105 28.179 -19.595 -27.795 1.00 0.00 H new ATOM 0 HG13 ILE A 105 26.904 -20.591 -28.468 1.00 0.00 H new ATOM 0 HG21 ILE A 105 27.197 -18.699 -25.823 1.00 0.00 H new ATOM 0 HG22 ILE A 105 25.512 -18.130 -25.768 1.00 0.00 H new ATOM 0 HG23 ILE A 105 25.859 -19.860 -25.996 1.00 0.00 H new ATOM 0 HD11 ILE A 105 28.477 -19.890 -30.207 1.00 0.00 H new ATOM 0 HD12 ILE A 105 26.869 -19.191 -30.509 1.00 0.00 H new ATOM 0 HD13 ILE A 105 28.164 -18.180 -29.826 1.00 0.00 H new ATOM 1357 N VAL A 106 22.666 -18.635 -27.141 1.00 0.00 N ATOM 1358 CA VAL A 106 21.624 -17.972 -26.351 1.00 0.00 C ATOM 1359 C VAL A 106 22.012 -18.075 -24.857 1.00 0.00 C ATOM 1360 O VAL A 106 22.276 -19.171 -24.332 1.00 0.00 O ATOM 1361 CB VAL A 106 20.183 -18.572 -26.651 1.00 0.00 C ATOM 1362 CG1 VAL A 106 19.907 -18.571 -28.176 1.00 0.00 C ATOM 1363 CG2 VAL A 106 19.978 -19.990 -26.070 1.00 0.00 C ATOM 0 H VAL A 106 22.502 -19.632 -27.280 1.00 0.00 H new ATOM 0 HA VAL A 106 21.560 -16.920 -26.630 1.00 0.00 H new ATOM 0 HB VAL A 106 19.466 -17.924 -26.147 1.00 0.00 H new ATOM 0 HG11 VAL A 106 18.917 -18.985 -28.367 1.00 0.00 H new ATOM 0 HG12 VAL A 106 19.952 -17.549 -28.553 1.00 0.00 H new ATOM 0 HG13 VAL A 106 20.657 -19.178 -28.682 1.00 0.00 H new ATOM 0 HG21 VAL A 106 18.974 -20.340 -26.311 1.00 0.00 H new ATOM 0 HG22 VAL A 106 20.713 -20.670 -26.502 1.00 0.00 H new ATOM 0 HG23 VAL A 106 20.102 -19.961 -24.988 1.00 0.00 H new ATOM 1373 N ARG A 107 22.140 -16.912 -24.212 1.00 0.00 N ATOM 1374 CA ARG A 107 22.573 -16.803 -22.814 1.00 0.00 C ATOM 1375 C ARG A 107 21.422 -16.237 -21.976 1.00 0.00 C ATOM 1376 O ARG A 107 21.310 -15.024 -21.826 1.00 0.00 O ATOM 1377 CB ARG A 107 23.822 -15.870 -22.780 1.00 0.00 C ATOM 1378 CG ARG A 107 24.455 -15.614 -21.393 1.00 0.00 C ATOM 1379 CD ARG A 107 25.040 -16.881 -20.762 1.00 0.00 C ATOM 1380 NE ARG A 107 25.802 -16.586 -19.531 1.00 0.00 N ATOM 1381 CZ ARG A 107 26.887 -17.255 -19.103 1.00 0.00 C ATOM 1382 NH1 ARG A 107 27.377 -18.281 -19.791 1.00 0.00 N ATOM 1383 NH2 ARG A 107 27.487 -16.880 -17.985 1.00 0.00 N ATOM 0 H ARG A 107 21.945 -16.011 -24.648 1.00 0.00 H new ATOM 0 HA ARG A 107 22.840 -17.774 -22.397 1.00 0.00 H new ATOM 0 HB2 ARG A 107 24.585 -16.298 -23.429 1.00 0.00 H new ATOM 0 HB3 ARG A 107 23.541 -14.908 -23.209 1.00 0.00 H new ATOM 0 HG2 ARG A 107 25.242 -14.866 -21.491 1.00 0.00 H new ATOM 0 HG3 ARG A 107 23.700 -15.197 -20.726 1.00 0.00 H new ATOM 0 HD2 ARG A 107 24.233 -17.576 -20.531 1.00 0.00 H new ATOM 0 HD3 ARG A 107 25.692 -17.377 -21.482 1.00 0.00 H new ATOM 0 HE ARG A 107 25.477 -15.808 -18.957 1.00 0.00 H new ATOM 0 HH11 ARG A 107 26.929 -18.573 -20.660 1.00 0.00 H new ATOM 0 HH12 ARG A 107 28.201 -18.776 -19.450 1.00 0.00 H new ATOM 0 HH21 ARG A 107 27.126 -16.088 -17.453 1.00 0.00 H new ATOM 0 HH22 ARG A 107 28.310 -17.383 -17.655 1.00 0.00 H new ATOM 1397 N VAL A 108 20.570 -17.121 -21.424 1.00 0.00 N ATOM 1398 CA VAL A 108 19.383 -16.702 -20.650 1.00 0.00 C ATOM 1399 C VAL A 108 19.655 -16.934 -19.146 1.00 0.00 C ATOM 1400 O VAL A 108 19.558 -18.053 -18.656 1.00 0.00 O ATOM 1401 CB VAL A 108 18.076 -17.488 -21.101 1.00 0.00 C ATOM 1402 CG1 VAL A 108 16.791 -16.784 -20.609 1.00 0.00 C ATOM 1403 CG2 VAL A 108 18.039 -17.722 -22.631 1.00 0.00 C ATOM 0 H VAL A 108 20.681 -18.132 -21.499 1.00 0.00 H new ATOM 0 HA VAL A 108 19.203 -15.644 -20.839 1.00 0.00 H new ATOM 0 HB VAL A 108 18.117 -18.469 -20.627 1.00 0.00 H new ATOM 0 HG11 VAL A 108 15.918 -17.349 -20.936 1.00 0.00 H new ATOM 0 HG12 VAL A 108 16.801 -16.729 -19.520 1.00 0.00 H new ATOM 0 HG13 VAL A 108 16.747 -15.777 -21.023 1.00 0.00 H new ATOM 0 HG21 VAL A 108 17.130 -18.262 -22.895 1.00 0.00 H new ATOM 0 HG22 VAL A 108 18.053 -16.762 -23.146 1.00 0.00 H new ATOM 0 HG23 VAL A 108 18.908 -18.307 -22.931 1.00 0.00 H new ATOM 1413 N SER A 109 19.985 -15.861 -18.428 1.00 0.00 N ATOM 1414 CA SER A 109 20.294 -15.881 -16.983 1.00 0.00 C ATOM 1415 C SER A 109 19.221 -15.100 -16.209 1.00 0.00 C ATOM 1416 O SER A 109 18.544 -14.250 -16.793 1.00 0.00 O ATOM 1417 CB SER A 109 21.695 -15.253 -16.762 1.00 0.00 C ATOM 1418 OG SER A 109 21.774 -13.946 -17.329 1.00 0.00 O ATOM 0 H SER A 109 20.049 -14.928 -18.836 1.00 0.00 H new ATOM 0 HA SER A 109 20.299 -16.907 -16.616 1.00 0.00 H new ATOM 0 HB2 SER A 109 21.908 -15.202 -15.694 1.00 0.00 H new ATOM 0 HB3 SER A 109 22.457 -15.892 -17.209 1.00 0.00 H new ATOM 0 HG SER A 109 22.668 -13.575 -17.173 1.00 0.00 H new ATOM 1424 N LYS A 110 19.075 -15.392 -14.905 1.00 0.00 N ATOM 1425 CA LYS A 110 18.126 -14.685 -14.029 1.00 0.00 C ATOM 1426 C LYS A 110 18.483 -14.948 -12.554 1.00 0.00 C ATOM 1427 O LYS A 110 18.170 -16.028 -12.023 1.00 0.00 O ATOM 1428 CB LYS A 110 16.663 -15.133 -14.314 1.00 0.00 C ATOM 1429 CG LYS A 110 15.587 -14.255 -13.628 1.00 0.00 C ATOM 1430 CD LYS A 110 14.214 -14.957 -13.501 1.00 0.00 C ATOM 1431 CE LYS A 110 14.254 -16.131 -12.506 1.00 0.00 C ATOM 1432 NZ LYS A 110 12.908 -16.693 -12.266 1.00 0.00 N ATOM 0 H LYS A 110 19.609 -16.121 -14.431 1.00 0.00 H new ATOM 0 HA LYS A 110 18.198 -13.617 -14.233 1.00 0.00 H new ATOM 0 HB2 LYS A 110 16.494 -15.121 -15.391 1.00 0.00 H new ATOM 0 HB3 LYS A 110 16.539 -16.164 -13.984 1.00 0.00 H new ATOM 0 HG2 LYS A 110 15.937 -13.974 -12.635 1.00 0.00 H new ATOM 0 HG3 LYS A 110 15.465 -13.333 -14.196 1.00 0.00 H new ATOM 0 HD2 LYS A 110 13.466 -14.233 -13.177 1.00 0.00 H new ATOM 0 HD3 LYS A 110 13.902 -15.322 -14.480 1.00 0.00 H new ATOM 0 HE2 LYS A 110 14.910 -16.911 -12.891 1.00 0.00 H new ATOM 0 HE3 LYS A 110 14.680 -15.793 -11.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 12.996 -17.668 -11.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 12.411 -16.114 -11.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 12.368 -16.693 -13.155 1.00 0.00 H new ATOM 1446 N GLY A 111 19.158 -13.966 -11.922 1.00 0.00 N ATOM 1447 CA GLY A 111 19.495 -14.013 -10.496 1.00 0.00 C ATOM 1448 C GLY A 111 20.468 -15.137 -10.139 1.00 0.00 C ATOM 1449 O GLY A 111 21.685 -14.975 -10.270 1.00 0.00 O ATOM 0 H GLY A 111 19.482 -13.121 -12.392 1.00 0.00 H new ATOM 0 HA2 GLY A 111 19.931 -13.058 -10.201 1.00 0.00 H new ATOM 0 HA3 GLY A 111 18.579 -14.138 -9.918 1.00 0.00 H new ATOM 1453 N ASP A 112 19.912 -16.284 -9.710 1.00 0.00 N ATOM 1454 CA ASP A 112 20.682 -17.483 -9.323 1.00 0.00 C ATOM 1455 C ASP A 112 20.980 -18.344 -10.562 1.00 0.00 C ATOM 1456 O ASP A 112 22.053 -18.947 -10.671 1.00 0.00 O ATOM 1457 CB ASP A 112 19.889 -18.307 -8.261 1.00 0.00 C ATOM 1458 CG ASP A 112 18.567 -18.919 -8.789 1.00 0.00 C ATOM 1459 OD1 ASP A 112 17.710 -18.167 -9.311 1.00 0.00 O ATOM 1460 OD2 ASP A 112 18.389 -20.149 -8.712 1.00 0.00 O ATOM 0 H ASP A 112 18.903 -16.407 -9.621 1.00 0.00 H new ATOM 0 HA ASP A 112 21.629 -17.170 -8.884 1.00 0.00 H new ATOM 0 HB2 ASP A 112 20.526 -19.111 -7.891 1.00 0.00 H new ATOM 0 HB3 ASP A 112 19.664 -17.662 -7.411 1.00 0.00 H new ATOM 1465 N HIS A 113 20.016 -18.358 -11.507 1.00 0.00 N ATOM 1466 CA HIS A 113 20.070 -19.194 -12.718 1.00 0.00 C ATOM 1467 C HIS A 113 20.983 -18.575 -13.784 1.00 0.00 C ATOM 1468 O HIS A 113 21.108 -17.356 -13.877 1.00 0.00 O ATOM 1469 CB HIS A 113 18.643 -19.405 -13.294 1.00 0.00 C ATOM 1470 CG HIS A 113 17.863 -20.563 -12.723 1.00 0.00 C ATOM 1471 ND1 HIS A 113 18.063 -21.082 -11.463 1.00 0.00 N ATOM 1472 CD2 HIS A 113 16.879 -21.315 -13.275 1.00 0.00 C ATOM 1473 CE1 HIS A 113 17.235 -22.085 -11.262 1.00 0.00 C ATOM 1474 NE2 HIS A 113 16.509 -22.248 -12.346 1.00 0.00 N ATOM 0 H HIS A 113 19.174 -17.785 -11.448 1.00 0.00 H new ATOM 0 HA HIS A 113 20.487 -20.161 -12.436 1.00 0.00 H new ATOM 0 HB2 HIS A 113 18.069 -18.492 -13.133 1.00 0.00 H new ATOM 0 HB3 HIS A 113 18.725 -19.544 -14.372 1.00 0.00 H new ATOM 0 HD1 HIS A 113 18.748 -20.741 -10.789 1.00 0.00 H new ATOM 0 HD2 HIS A 113 16.464 -21.199 -14.265 1.00 0.00 H new ATOM 0 HE1 HIS A 113 17.164 -22.674 -10.360 1.00 0.00 H new ATOM 1483 N SER A 114 21.577 -19.449 -14.600 1.00 0.00 N ATOM 1484 CA SER A 114 22.429 -19.085 -15.736 1.00 0.00 C ATOM 1485 C SER A 114 22.345 -20.232 -16.755 1.00 0.00 C ATOM 1486 O SER A 114 22.969 -21.290 -16.577 1.00 0.00 O ATOM 1487 CB SER A 114 23.889 -18.810 -15.271 1.00 0.00 C ATOM 1488 OG SER A 114 24.402 -19.876 -14.481 1.00 0.00 O ATOM 0 H SER A 114 21.476 -20.458 -14.486 1.00 0.00 H new ATOM 0 HA SER A 114 22.087 -18.160 -16.200 1.00 0.00 H new ATOM 0 HB2 SER A 114 24.527 -18.664 -16.143 1.00 0.00 H new ATOM 0 HB3 SER A 114 23.919 -17.884 -14.696 1.00 0.00 H new ATOM 0 HG SER A 114 24.125 -20.733 -14.868 1.00 0.00 H new ATOM 1494 N GLU A 115 21.521 -20.032 -17.791 1.00 0.00 N ATOM 1495 CA GLU A 115 21.208 -21.056 -18.798 1.00 0.00 C ATOM 1496 C GLU A 115 21.864 -20.653 -20.118 1.00 0.00 C ATOM 1497 O GLU A 115 21.851 -19.470 -20.479 1.00 0.00 O ATOM 1498 CB GLU A 115 19.660 -21.188 -18.986 1.00 0.00 C ATOM 1499 CG GLU A 115 18.832 -21.200 -17.683 1.00 0.00 C ATOM 1500 CD GLU A 115 19.262 -22.279 -16.677 1.00 0.00 C ATOM 1501 OE1 GLU A 115 19.207 -23.478 -17.021 1.00 0.00 O ATOM 1502 OE2 GLU A 115 19.632 -21.936 -15.530 1.00 0.00 O ATOM 0 H GLU A 115 21.047 -19.144 -17.956 1.00 0.00 H new ATOM 0 HA GLU A 115 21.591 -22.022 -18.468 1.00 0.00 H new ATOM 0 HB2 GLU A 115 19.315 -20.362 -19.608 1.00 0.00 H new ATOM 0 HB3 GLU A 115 19.455 -22.107 -19.535 1.00 0.00 H new ATOM 0 HG2 GLU A 115 18.910 -20.223 -17.207 1.00 0.00 H new ATOM 0 HG3 GLU A 115 17.782 -21.350 -17.934 1.00 0.00 H new ATOM 1509 N THR A 116 22.455 -21.622 -20.824 1.00 0.00 N ATOM 1510 CA THR A 116 23.111 -21.378 -22.118 1.00 0.00 C ATOM 1511 C THR A 116 22.878 -22.574 -23.052 1.00 0.00 C ATOM 1512 O THR A 116 22.968 -23.727 -22.612 1.00 0.00 O ATOM 1513 CB THR A 116 24.646 -21.110 -21.944 1.00 0.00 C ATOM 1514 OG1 THR A 116 24.848 -20.076 -20.972 1.00 0.00 O ATOM 1515 CG2 THR A 116 25.311 -20.667 -23.258 1.00 0.00 C ATOM 0 H THR A 116 22.494 -22.594 -20.519 1.00 0.00 H new ATOM 0 HA THR A 116 22.671 -20.484 -22.559 1.00 0.00 H new ATOM 0 HB THR A 116 25.100 -22.048 -21.623 1.00 0.00 H new ATOM 0 HG1 THR A 116 25.702 -20.220 -20.514 1.00 0.00 H new ATOM 0 HG21 THR A 116 26.373 -20.493 -23.088 1.00 0.00 H new ATOM 0 HG22 THR A 116 25.187 -21.447 -24.010 1.00 0.00 H new ATOM 0 HG23 THR A 116 24.845 -19.747 -23.610 1.00 0.00 H new ATOM 1523 N ARG A 117 22.575 -22.282 -24.328 1.00 0.00 N ATOM 1524 CA ARG A 117 22.295 -23.311 -25.351 1.00 0.00 C ATOM 1525 C ARG A 117 22.606 -22.737 -26.750 1.00 0.00 C ATOM 1526 O ARG A 117 22.767 -21.524 -26.900 1.00 0.00 O ATOM 1527 CB ARG A 117 20.814 -23.775 -25.219 1.00 0.00 C ATOM 1528 CG ARG A 117 20.419 -25.040 -26.019 1.00 0.00 C ATOM 1529 CD ARG A 117 19.027 -25.553 -25.611 1.00 0.00 C ATOM 1530 NE ARG A 117 18.550 -26.682 -26.411 1.00 0.00 N ATOM 1531 CZ ARG A 117 17.467 -27.425 -26.118 1.00 0.00 C ATOM 1532 NH1 ARG A 117 16.778 -27.224 -24.993 1.00 0.00 N ATOM 1533 NH2 ARG A 117 17.075 -28.365 -26.954 1.00 0.00 N ATOM 0 H ARG A 117 22.517 -21.327 -24.682 1.00 0.00 H new ATOM 0 HA ARG A 117 22.930 -24.185 -25.204 1.00 0.00 H new ATOM 0 HB2 ARG A 117 20.605 -23.957 -24.165 1.00 0.00 H new ATOM 0 HB3 ARG A 117 20.169 -22.955 -25.535 1.00 0.00 H new ATOM 0 HG2 ARG A 117 20.427 -24.815 -27.085 1.00 0.00 H new ATOM 0 HG3 ARG A 117 21.159 -25.823 -25.853 1.00 0.00 H new ATOM 0 HD2 ARG A 117 19.053 -25.850 -24.562 1.00 0.00 H new ATOM 0 HD3 ARG A 117 18.311 -24.735 -25.693 1.00 0.00 H new ATOM 0 HE ARG A 117 19.076 -26.923 -27.251 1.00 0.00 H new ATOM 0 HH11 ARG A 117 17.070 -26.498 -24.339 1.00 0.00 H new ATOM 0 HH12 ARG A 117 15.959 -27.797 -24.787 1.00 0.00 H new ATOM 0 HH21 ARG A 117 17.592 -28.527 -27.818 1.00 0.00 H new ATOM 0 HH22 ARG A 117 16.255 -28.931 -26.737 1.00 0.00 H new ATOM 1547 N GLU A 118 22.721 -23.610 -27.763 1.00 0.00 N ATOM 1548 CA GLU A 118 23.031 -23.211 -29.152 1.00 0.00 C ATOM 1549 C GLU A 118 21.838 -23.468 -30.078 1.00 0.00 C ATOM 1550 O GLU A 118 21.005 -24.346 -29.818 1.00 0.00 O ATOM 1551 CB GLU A 118 24.281 -23.970 -29.680 1.00 0.00 C ATOM 1552 CG GLU A 118 25.591 -23.632 -28.937 1.00 0.00 C ATOM 1553 CD GLU A 118 26.811 -24.346 -29.535 1.00 0.00 C ATOM 1554 OE1 GLU A 118 27.360 -23.856 -30.544 1.00 0.00 O ATOM 1555 OE2 GLU A 118 27.209 -25.415 -29.015 1.00 0.00 O ATOM 0 H GLU A 118 22.602 -24.616 -27.645 1.00 0.00 H new ATOM 0 HA GLU A 118 23.244 -22.142 -29.147 1.00 0.00 H new ATOM 0 HB2 GLU A 118 24.100 -25.042 -29.603 1.00 0.00 H new ATOM 0 HB3 GLU A 118 24.409 -23.743 -30.739 1.00 0.00 H new ATOM 0 HG2 GLU A 118 25.754 -22.555 -28.968 1.00 0.00 H new ATOM 0 HG3 GLU A 118 25.491 -23.909 -27.888 1.00 0.00 H new ATOM 1562 N ILE A 119 21.767 -22.652 -31.138 1.00 0.00 N ATOM 1563 CA ILE A 119 20.880 -22.837 -32.297 1.00 0.00 C ATOM 1564 C ILE A 119 21.673 -22.495 -33.576 1.00 0.00 C ATOM 1565 O ILE A 119 22.553 -21.629 -33.527 1.00 0.00 O ATOM 1566 CB ILE A 119 19.562 -21.948 -32.217 1.00 0.00 C ATOM 1567 CG1 ILE A 119 19.876 -20.493 -31.734 1.00 0.00 C ATOM 1568 CG2 ILE A 119 18.479 -22.613 -31.335 1.00 0.00 C ATOM 1569 CD1 ILE A 119 18.668 -19.568 -31.620 1.00 0.00 C ATOM 0 H ILE A 119 22.345 -21.815 -31.216 1.00 0.00 H new ATOM 0 HA ILE A 119 20.549 -23.875 -32.308 1.00 0.00 H new ATOM 0 HB ILE A 119 19.161 -21.877 -33.228 1.00 0.00 H new ATOM 0 HG12 ILE A 119 20.363 -20.548 -30.761 1.00 0.00 H new ATOM 0 HG13 ILE A 119 20.592 -20.045 -32.424 1.00 0.00 H new ATOM 0 HG21 ILE A 119 17.594 -21.977 -31.304 1.00 0.00 H new ATOM 0 HG22 ILE A 119 18.214 -23.584 -31.754 1.00 0.00 H new ATOM 0 HG23 ILE A 119 18.865 -22.747 -30.324 1.00 0.00 H new ATOM 0 HD11 ILE A 119 18.993 -18.585 -31.278 1.00 0.00 H new ATOM 0 HD12 ILE A 119 18.189 -19.473 -32.595 1.00 0.00 H new ATOM 0 HD13 ILE A 119 17.957 -19.984 -30.906 1.00 0.00 H new ATOM 1581 N PRO A 120 21.400 -23.180 -34.736 1.00 0.00 N ATOM 1582 CA PRO A 120 22.069 -22.868 -36.023 1.00 0.00 C ATOM 1583 C PRO A 120 21.794 -21.410 -36.475 1.00 0.00 C ATOM 1584 O PRO A 120 20.674 -20.896 -36.297 1.00 0.00 O ATOM 1585 CB PRO A 120 21.472 -23.913 -37.012 1.00 0.00 C ATOM 1586 CG PRO A 120 20.206 -24.398 -36.363 1.00 0.00 C ATOM 1587 CD PRO A 120 20.452 -24.320 -34.878 1.00 0.00 C ATOM 0 HA PRO A 120 23.155 -22.931 -35.960 1.00 0.00 H new ATOM 0 HB2 PRO A 120 21.268 -23.463 -37.984 1.00 0.00 H new ATOM 0 HB3 PRO A 120 22.167 -24.736 -37.181 1.00 0.00 H new ATOM 0 HG2 PRO A 120 19.356 -23.779 -36.652 1.00 0.00 H new ATOM 0 HG3 PRO A 120 19.976 -25.419 -36.668 1.00 0.00 H new ATOM 0 HD2 PRO A 120 19.528 -24.143 -34.328 1.00 0.00 H new ATOM 0 HD3 PRO A 120 20.879 -25.246 -34.494 1.00 0.00 H new ATOM 1595 N LEU A 121 22.832 -20.760 -37.052 1.00 0.00 N ATOM 1596 CA LEU A 121 22.794 -19.328 -37.432 1.00 0.00 C ATOM 1597 C LEU A 121 21.711 -19.086 -38.500 1.00 0.00 C ATOM 1598 O LEU A 121 20.973 -18.111 -38.414 1.00 0.00 O ATOM 1599 CB LEU A 121 24.197 -18.851 -37.947 1.00 0.00 C ATOM 1600 CG LEU A 121 24.655 -17.378 -37.606 1.00 0.00 C ATOM 1601 CD1 LEU A 121 26.020 -17.065 -38.257 1.00 0.00 C ATOM 1602 CD2 LEU A 121 23.606 -16.297 -37.980 1.00 0.00 C ATOM 0 H LEU A 121 23.720 -21.214 -37.267 1.00 0.00 H new ATOM 0 HA LEU A 121 22.543 -18.744 -36.547 1.00 0.00 H new ATOM 0 HB2 LEU A 121 24.948 -19.534 -37.549 1.00 0.00 H new ATOM 0 HB3 LEU A 121 24.209 -18.961 -39.031 1.00 0.00 H new ATOM 0 HG LEU A 121 24.756 -17.337 -36.521 1.00 0.00 H new ATOM 0 HD11 LEU A 121 26.316 -16.046 -38.009 1.00 0.00 H new ATOM 0 HD12 LEU A 121 26.770 -17.762 -37.883 1.00 0.00 H new ATOM 0 HD13 LEU A 121 25.939 -17.166 -39.339 1.00 0.00 H new ATOM 0 HD21 LEU A 121 23.990 -15.311 -37.717 1.00 0.00 H new ATOM 0 HD22 LEU A 121 23.410 -16.336 -39.051 1.00 0.00 H new ATOM 0 HD23 LEU A 121 22.681 -16.484 -37.435 1.00 0.00 H new ATOM 1614 N ALA A 122 21.628 -20.010 -39.480 1.00 0.00 N ATOM 1615 CA ALA A 122 20.668 -19.940 -40.601 1.00 0.00 C ATOM 1616 C ALA A 122 19.214 -19.825 -40.096 1.00 0.00 C ATOM 1617 O ALA A 122 18.438 -19.010 -40.603 1.00 0.00 O ATOM 1618 CB ALA A 122 20.840 -21.176 -41.508 1.00 0.00 C ATOM 0 H ALA A 122 22.230 -20.832 -39.516 1.00 0.00 H new ATOM 0 HA ALA A 122 20.878 -19.040 -41.180 1.00 0.00 H new ATOM 0 HB1 ALA A 122 20.131 -21.123 -42.334 1.00 0.00 H new ATOM 0 HB2 ALA A 122 21.856 -21.199 -41.902 1.00 0.00 H new ATOM 0 HB3 ALA A 122 20.655 -22.081 -40.929 1.00 0.00 H new ATOM 1624 N SER A 123 18.893 -20.624 -39.060 1.00 0.00 N ATOM 1625 CA SER A 123 17.562 -20.641 -38.431 1.00 0.00 C ATOM 1626 C SER A 123 17.240 -19.287 -37.774 1.00 0.00 C ATOM 1627 O SER A 123 16.255 -18.635 -38.136 1.00 0.00 O ATOM 1628 CB SER A 123 17.486 -21.769 -37.381 1.00 0.00 C ATOM 1629 OG SER A 123 17.701 -23.030 -37.979 1.00 0.00 O ATOM 0 H SER A 123 19.552 -21.277 -38.636 1.00 0.00 H new ATOM 0 HA SER A 123 16.822 -20.825 -39.210 1.00 0.00 H new ATOM 0 HB2 SER A 123 18.231 -21.599 -36.604 1.00 0.00 H new ATOM 0 HB3 SER A 123 16.510 -21.754 -36.895 1.00 0.00 H new ATOM 0 HG SER A 123 17.346 -23.733 -37.396 1.00 0.00 H new ATOM 1635 N PHE A 124 18.124 -18.857 -36.849 1.00 0.00 N ATOM 1636 CA PHE A 124 17.942 -17.610 -36.082 1.00 0.00 C ATOM 1637 C PHE A 124 17.852 -16.405 -37.021 1.00 0.00 C ATOM 1638 O PHE A 124 17.000 -15.542 -36.825 1.00 0.00 O ATOM 1639 CB PHE A 124 19.102 -17.405 -35.070 1.00 0.00 C ATOM 1640 CG PHE A 124 19.006 -16.123 -34.209 1.00 0.00 C ATOM 1641 CD1 PHE A 124 19.536 -14.903 -34.650 1.00 0.00 C ATOM 1642 CD2 PHE A 124 18.381 -16.142 -32.967 1.00 0.00 C ATOM 1643 CE1 PHE A 124 19.438 -13.759 -33.879 1.00 0.00 C ATOM 1644 CE2 PHE A 124 18.283 -14.997 -32.199 1.00 0.00 C ATOM 1645 CZ PHE A 124 18.811 -13.806 -32.654 1.00 0.00 C ATOM 0 H PHE A 124 18.979 -19.362 -36.615 1.00 0.00 H new ATOM 0 HA PHE A 124 17.008 -17.695 -35.527 1.00 0.00 H new ATOM 0 HB2 PHE A 124 19.140 -18.268 -34.405 1.00 0.00 H new ATOM 0 HB3 PHE A 124 20.043 -17.385 -35.620 1.00 0.00 H new ATOM 0 HD1 PHE A 124 20.030 -14.855 -35.609 1.00 0.00 H new ATOM 0 HD2 PHE A 124 17.965 -17.067 -32.596 1.00 0.00 H new ATOM 0 HE1 PHE A 124 19.853 -12.829 -34.238 1.00 0.00 H new ATOM 0 HE2 PHE A 124 17.791 -15.035 -31.238 1.00 0.00 H new ATOM 0 HZ PHE A 124 18.733 -12.913 -32.051 1.00 0.00 H new ATOM 1655 N GLU A 125 18.737 -16.372 -38.041 1.00 0.00 N ATOM 1656 CA GLU A 125 18.851 -15.239 -38.968 1.00 0.00 C ATOM 1657 C GLU A 125 17.593 -15.105 -39.825 1.00 0.00 C ATOM 1658 O GLU A 125 17.010 -14.032 -39.845 1.00 0.00 O ATOM 1659 CB GLU A 125 20.122 -15.320 -39.865 1.00 0.00 C ATOM 1660 CG GLU A 125 20.204 -14.197 -40.943 1.00 0.00 C ATOM 1661 CD GLU A 125 21.592 -14.017 -41.572 1.00 0.00 C ATOM 1662 OE1 GLU A 125 21.953 -14.804 -42.466 1.00 0.00 O ATOM 1663 OE2 GLU A 125 22.323 -13.076 -41.176 1.00 0.00 O ATOM 0 H GLU A 125 19.388 -17.131 -38.240 1.00 0.00 H new ATOM 0 HA GLU A 125 18.954 -14.344 -38.354 1.00 0.00 H new ATOM 0 HB2 GLU A 125 21.007 -15.267 -39.231 1.00 0.00 H new ATOM 0 HB3 GLU A 125 20.143 -16.290 -40.362 1.00 0.00 H new ATOM 0 HG2 GLU A 125 19.487 -14.417 -41.734 1.00 0.00 H new ATOM 0 HG3 GLU A 125 19.899 -13.253 -40.490 1.00 0.00 H new ATOM 1670 N LYS A 126 17.158 -16.202 -40.494 1.00 0.00 N ATOM 1671 CA LYS A 126 15.973 -16.163 -41.397 1.00 0.00 C ATOM 1672 C LYS A 126 14.712 -15.734 -40.613 1.00 0.00 C ATOM 1673 O LYS A 126 13.874 -14.982 -41.128 1.00 0.00 O ATOM 1674 CB LYS A 126 15.732 -17.536 -42.102 1.00 0.00 C ATOM 1675 CG LYS A 126 15.251 -18.665 -41.164 1.00 0.00 C ATOM 1676 CD LYS A 126 14.952 -19.990 -41.882 1.00 0.00 C ATOM 1677 CE LYS A 126 14.433 -21.061 -40.907 1.00 0.00 C ATOM 1678 NZ LYS A 126 14.202 -22.358 -41.579 1.00 0.00 N ATOM 0 H LYS A 126 17.603 -17.118 -40.429 1.00 0.00 H new ATOM 0 HA LYS A 126 16.178 -15.426 -42.174 1.00 0.00 H new ATOM 0 HB2 LYS A 126 14.994 -17.399 -42.892 1.00 0.00 H new ATOM 0 HB3 LYS A 126 16.659 -17.851 -42.582 1.00 0.00 H new ATOM 0 HG2 LYS A 126 16.012 -18.840 -40.403 1.00 0.00 H new ATOM 0 HG3 LYS A 126 14.351 -18.334 -40.645 1.00 0.00 H new ATOM 0 HD2 LYS A 126 14.212 -19.821 -42.664 1.00 0.00 H new ATOM 0 HD3 LYS A 126 15.857 -20.351 -42.371 1.00 0.00 H new ATOM 0 HE2 LYS A 126 15.152 -21.195 -40.099 1.00 0.00 H new ATOM 0 HE3 LYS A 126 13.504 -20.718 -40.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 13.853 -23.051 -40.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 13.496 -22.237 -42.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 15.094 -22.699 -41.991 1.00 0.00 H new ATOM 1692 N ILE A 127 14.616 -16.199 -39.346 1.00 0.00 N ATOM 1693 CA ILE A 127 13.510 -15.842 -38.446 1.00 0.00 C ATOM 1694 C ILE A 127 13.611 -14.354 -38.031 1.00 0.00 C ATOM 1695 O ILE A 127 12.619 -13.636 -38.068 1.00 0.00 O ATOM 1696 CB ILE A 127 13.487 -16.773 -37.168 1.00 0.00 C ATOM 1697 CG1 ILE A 127 13.222 -18.274 -37.551 1.00 0.00 C ATOM 1698 CG2 ILE A 127 12.447 -16.279 -36.134 1.00 0.00 C ATOM 1699 CD1 ILE A 127 11.838 -18.563 -38.118 1.00 0.00 C ATOM 0 H ILE A 127 15.301 -16.828 -38.927 1.00 0.00 H new ATOM 0 HA ILE A 127 12.575 -15.993 -38.986 1.00 0.00 H new ATOM 0 HB ILE A 127 14.474 -16.717 -36.709 1.00 0.00 H new ATOM 0 HG12 ILE A 127 13.969 -18.583 -38.282 1.00 0.00 H new ATOM 0 HG13 ILE A 127 13.370 -18.890 -36.664 1.00 0.00 H new ATOM 0 HG21 ILE A 127 12.454 -16.939 -35.267 1.00 0.00 H new ATOM 0 HG22 ILE A 127 12.698 -15.266 -35.821 1.00 0.00 H new ATOM 0 HG23 ILE A 127 11.455 -16.284 -36.585 1.00 0.00 H new ATOM 0 HD11 ILE A 127 11.754 -19.625 -38.350 1.00 0.00 H new ATOM 0 HD12 ILE A 127 11.080 -18.292 -37.383 1.00 0.00 H new ATOM 0 HD13 ILE A 127 11.688 -17.980 -39.027 1.00 0.00 H new ATOM 1711 N CYS A 128 14.832 -13.913 -37.682 1.00 0.00 N ATOM 1712 CA CYS A 128 15.113 -12.539 -37.203 1.00 0.00 C ATOM 1713 C CYS A 128 14.847 -11.499 -38.308 1.00 0.00 C ATOM 1714 O CYS A 128 14.335 -10.407 -38.033 1.00 0.00 O ATOM 1715 CB CYS A 128 16.572 -12.439 -36.710 1.00 0.00 C ATOM 1716 SG CYS A 128 17.071 -10.797 -36.156 1.00 0.00 S ATOM 0 H CYS A 128 15.663 -14.503 -37.723 1.00 0.00 H new ATOM 0 HA CYS A 128 14.441 -12.323 -36.372 1.00 0.00 H new ATOM 0 HB2 CYS A 128 16.713 -13.142 -35.889 1.00 0.00 H new ATOM 0 HB3 CYS A 128 17.236 -12.753 -37.516 1.00 0.00 H new ATOM 0 HG CYS A 128 18.281 -10.847 -35.685 1.00 0.00 H new ATOM 1722 N ARG A 129 15.175 -11.876 -39.566 1.00 0.00 N ATOM 1723 CA ARG A 129 14.881 -11.067 -40.765 1.00 0.00 C ATOM 1724 C ARG A 129 13.362 -10.981 -40.947 1.00 0.00 C ATOM 1725 O ARG A 129 12.820 -9.903 -41.176 1.00 0.00 O ATOM 1726 CB ARG A 129 15.517 -11.685 -42.049 1.00 0.00 C ATOM 1727 CG ARG A 129 17.047 -11.846 -42.031 1.00 0.00 C ATOM 1728 CD ARG A 129 17.808 -10.523 -41.935 1.00 0.00 C ATOM 1729 NE ARG A 129 19.264 -10.772 -41.845 1.00 0.00 N ATOM 1730 CZ ARG A 129 20.221 -10.102 -42.494 1.00 0.00 C ATOM 1731 NH1 ARG A 129 19.921 -9.103 -43.305 1.00 0.00 N ATOM 1732 NH2 ARG A 129 21.488 -10.435 -42.311 1.00 0.00 N ATOM 0 H ARG A 129 15.652 -12.753 -39.775 1.00 0.00 H new ATOM 0 HA ARG A 129 15.310 -10.076 -40.621 1.00 0.00 H new ATOM 0 HB2 ARG A 129 15.070 -12.665 -42.217 1.00 0.00 H new ATOM 0 HB3 ARG A 129 15.247 -11.061 -42.901 1.00 0.00 H new ATOM 0 HG2 ARG A 129 17.326 -12.477 -41.187 1.00 0.00 H new ATOM 0 HG3 ARG A 129 17.358 -12.368 -42.936 1.00 0.00 H new ATOM 0 HD2 ARG A 129 17.591 -9.907 -42.808 1.00 0.00 H new ATOM 0 HD3 ARG A 129 17.473 -9.966 -41.060 1.00 0.00 H new ATOM 0 HE ARG A 129 19.566 -11.527 -41.229 1.00 0.00 H new ATOM 0 HH11 ARG A 129 18.947 -8.833 -43.443 1.00 0.00 H new ATOM 0 HH12 ARG A 129 20.663 -8.602 -43.793 1.00 0.00 H new ATOM 0 HH21 ARG A 129 21.728 -11.198 -41.678 1.00 0.00 H new ATOM 0 HH22 ARG A 129 22.225 -9.929 -42.803 1.00 0.00 H new ATOM 1746 N ALA A 130 12.695 -12.149 -40.809 1.00 0.00 N ATOM 1747 CA ALA A 130 11.227 -12.269 -40.910 1.00 0.00 C ATOM 1748 C ALA A 130 10.510 -11.436 -39.826 1.00 0.00 C ATOM 1749 O ALA A 130 9.405 -10.973 -40.056 1.00 0.00 O ATOM 1750 CB ALA A 130 10.798 -13.749 -40.836 1.00 0.00 C ATOM 0 H ALA A 130 13.163 -13.036 -40.624 1.00 0.00 H new ATOM 0 HA ALA A 130 10.929 -11.868 -41.879 1.00 0.00 H new ATOM 0 HB1 ALA A 130 9.713 -13.818 -40.912 1.00 0.00 H new ATOM 0 HB2 ALA A 130 11.255 -14.302 -41.657 1.00 0.00 H new ATOM 0 HB3 ALA A 130 11.123 -14.175 -39.887 1.00 0.00 H new ATOM 1756 N LEU A 131 11.155 -11.248 -38.654 1.00 0.00 N ATOM 1757 CA LEU A 131 10.617 -10.398 -37.562 1.00 0.00 C ATOM 1758 C LEU A 131 10.741 -8.913 -37.932 1.00 0.00 C ATOM 1759 O LEU A 131 9.793 -8.142 -37.740 1.00 0.00 O ATOM 1760 CB LEU A 131 11.329 -10.689 -36.208 1.00 0.00 C ATOM 1761 CG LEU A 131 11.168 -12.144 -35.652 1.00 0.00 C ATOM 1762 CD1 LEU A 131 11.842 -12.304 -34.266 1.00 0.00 C ATOM 1763 CD2 LEU A 131 9.679 -12.575 -35.624 1.00 0.00 C ATOM 0 H LEU A 131 12.055 -11.675 -38.436 1.00 0.00 H new ATOM 0 HA LEU A 131 9.562 -10.641 -37.437 1.00 0.00 H new ATOM 0 HB2 LEU A 131 12.392 -10.481 -36.326 1.00 0.00 H new ATOM 0 HB3 LEU A 131 10.949 -9.991 -35.462 1.00 0.00 H new ATOM 0 HG LEU A 131 11.686 -12.816 -36.336 1.00 0.00 H new ATOM 0 HD11 LEU A 131 11.709 -13.327 -33.913 1.00 0.00 H new ATOM 0 HD12 LEU A 131 12.906 -12.085 -34.352 1.00 0.00 H new ATOM 0 HD13 LEU A 131 11.385 -11.613 -33.557 1.00 0.00 H new ATOM 0 HD21 LEU A 131 9.601 -13.590 -35.233 1.00 0.00 H new ATOM 0 HD22 LEU A 131 9.115 -11.896 -34.985 1.00 0.00 H new ATOM 0 HD23 LEU A 131 9.272 -12.543 -36.635 1.00 0.00 H new ATOM 1775 N LEU A 132 11.922 -8.543 -38.482 1.00 0.00 N ATOM 1776 CA LEU A 132 12.197 -7.178 -38.991 1.00 0.00 C ATOM 1777 C LEU A 132 11.143 -6.755 -40.029 1.00 0.00 C ATOM 1778 O LEU A 132 10.584 -5.651 -39.957 1.00 0.00 O ATOM 1779 CB LEU A 132 13.619 -7.114 -39.632 1.00 0.00 C ATOM 1780 CG LEU A 132 14.828 -7.246 -38.647 1.00 0.00 C ATOM 1781 CD1 LEU A 132 16.173 -7.408 -39.409 1.00 0.00 C ATOM 1782 CD2 LEU A 132 14.868 -6.038 -37.673 1.00 0.00 C ATOM 0 H LEU A 132 12.710 -9.182 -38.585 1.00 0.00 H new ATOM 0 HA LEU A 132 12.151 -6.490 -38.147 1.00 0.00 H new ATOM 0 HB2 LEU A 132 13.695 -7.907 -40.376 1.00 0.00 H new ATOM 0 HB3 LEU A 132 13.713 -6.167 -40.164 1.00 0.00 H new ATOM 0 HG LEU A 132 14.686 -8.153 -38.059 1.00 0.00 H new ATOM 0 HD11 LEU A 132 16.989 -7.497 -38.692 1.00 0.00 H new ATOM 0 HD12 LEU A 132 16.135 -8.304 -40.028 1.00 0.00 H new ATOM 0 HD13 LEU A 132 16.340 -6.537 -40.042 1.00 0.00 H new ATOM 0 HD21 LEU A 132 15.715 -6.145 -36.995 1.00 0.00 H new ATOM 0 HD22 LEU A 132 14.974 -5.115 -38.243 1.00 0.00 H new ATOM 0 HD23 LEU A 132 13.943 -6.005 -37.097 1.00 0.00 H new ATOM 1794 N PHE A 133 10.878 -7.666 -40.983 1.00 0.00 N ATOM 1795 CA PHE A 133 9.948 -7.422 -42.087 1.00 0.00 C ATOM 1796 C PHE A 133 8.503 -7.407 -41.567 1.00 0.00 C ATOM 1797 O PHE A 133 7.860 -6.370 -41.613 1.00 0.00 O ATOM 1798 CB PHE A 133 10.110 -8.489 -43.213 1.00 0.00 C ATOM 1799 CG PHE A 133 11.534 -8.656 -43.761 1.00 0.00 C ATOM 1800 CD1 PHE A 133 12.427 -7.582 -43.800 1.00 0.00 C ATOM 1801 CD2 PHE A 133 11.980 -9.895 -44.232 1.00 0.00 C ATOM 1802 CE1 PHE A 133 13.706 -7.740 -44.285 1.00 0.00 C ATOM 1803 CE2 PHE A 133 13.266 -10.050 -44.721 1.00 0.00 C ATOM 1804 CZ PHE A 133 14.129 -8.973 -44.743 1.00 0.00 C ATOM 0 H PHE A 133 11.306 -8.592 -41.005 1.00 0.00 H new ATOM 0 HA PHE A 133 10.182 -6.448 -42.516 1.00 0.00 H new ATOM 0 HB2 PHE A 133 9.771 -9.451 -42.830 1.00 0.00 H new ATOM 0 HB3 PHE A 133 9.450 -8.224 -44.039 1.00 0.00 H new ATOM 0 HD1 PHE A 133 12.109 -6.613 -43.444 1.00 0.00 H new ATOM 0 HD2 PHE A 133 11.312 -10.743 -44.214 1.00 0.00 H new ATOM 0 HE1 PHE A 133 14.381 -6.897 -44.307 1.00 0.00 H new ATOM 0 HE2 PHE A 133 13.594 -11.013 -45.085 1.00 0.00 H new ATOM 0 HZ PHE A 133 15.135 -9.094 -45.118 1.00 0.00 H new ATOM 1814 N ARG A 134 8.044 -8.554 -41.009 1.00 0.00 N ATOM 1815 CA ARG A 134 6.628 -8.785 -40.603 1.00 0.00 C ATOM 1816 C ARG A 134 6.105 -7.703 -39.623 1.00 0.00 C ATOM 1817 O ARG A 134 4.913 -7.365 -39.660 1.00 0.00 O ATOM 1818 CB ARG A 134 6.458 -10.191 -39.956 1.00 0.00 C ATOM 1819 CG ARG A 134 4.993 -10.660 -39.758 1.00 0.00 C ATOM 1820 CD ARG A 134 4.326 -11.113 -41.071 1.00 0.00 C ATOM 1821 NE ARG A 134 4.907 -12.380 -41.560 1.00 0.00 N ATOM 1822 CZ ARG A 134 5.182 -12.684 -42.833 1.00 0.00 C ATOM 1823 NH1 ARG A 134 5.005 -11.800 -43.804 1.00 0.00 N ATOM 1824 NH2 ARG A 134 5.661 -13.881 -43.113 1.00 0.00 N ATOM 0 H ARG A 134 8.649 -9.354 -40.825 1.00 0.00 H new ATOM 0 HA ARG A 134 6.035 -8.726 -41.516 1.00 0.00 H new ATOM 0 HB2 ARG A 134 6.975 -10.923 -40.577 1.00 0.00 H new ATOM 0 HB3 ARG A 134 6.955 -10.188 -38.986 1.00 0.00 H new ATOM 0 HG2 ARG A 134 4.974 -11.483 -39.044 1.00 0.00 H new ATOM 0 HG3 ARG A 134 4.412 -9.847 -39.323 1.00 0.00 H new ATOM 0 HD2 ARG A 134 3.255 -11.239 -40.912 1.00 0.00 H new ATOM 0 HD3 ARG A 134 4.447 -10.339 -41.829 1.00 0.00 H new ATOM 0 HE ARG A 134 5.119 -13.091 -40.860 1.00 0.00 H new ATOM 0 HH11 ARG A 134 4.653 -10.868 -43.587 1.00 0.00 H new ATOM 0 HH12 ARG A 134 5.221 -12.052 -44.769 1.00 0.00 H new ATOM 0 HH21 ARG A 134 5.816 -14.556 -42.364 1.00 0.00 H new ATOM 0 HH22 ARG A 134 5.877 -14.131 -44.078 1.00 0.00 H new ATOM 1838 N CYS A 135 7.009 -7.177 -38.761 1.00 0.00 N ATOM 1839 CA CYS A 135 6.689 -6.123 -37.760 1.00 0.00 C ATOM 1840 C CYS A 135 5.976 -4.906 -38.391 1.00 0.00 C ATOM 1841 O CYS A 135 5.113 -4.276 -37.761 1.00 0.00 O ATOM 1842 CB CYS A 135 7.986 -5.649 -37.059 1.00 0.00 C ATOM 1843 SG CYS A 135 7.751 -4.335 -35.836 1.00 0.00 S ATOM 0 H CYS A 135 7.985 -7.471 -38.738 1.00 0.00 H new ATOM 0 HA CYS A 135 6.007 -6.568 -37.035 1.00 0.00 H new ATOM 0 HB2 CYS A 135 8.450 -6.504 -36.568 1.00 0.00 H new ATOM 0 HB3 CYS A 135 8.685 -5.299 -37.818 1.00 0.00 H new ATOM 0 HG CYS A 135 6.599 -3.764 -36.029 1.00 0.00 H new ATOM 1849 N GLU A 136 6.357 -4.590 -39.649 1.00 0.00 N ATOM 1850 CA GLU A 136 5.858 -3.418 -40.392 1.00 0.00 C ATOM 1851 C GLU A 136 5.401 -3.842 -41.802 1.00 0.00 C ATOM 1852 O GLU A 136 4.221 -3.740 -42.140 1.00 0.00 O ATOM 1853 CB GLU A 136 6.975 -2.341 -40.481 1.00 0.00 C ATOM 1854 CG GLU A 136 7.528 -1.906 -39.108 1.00 0.00 C ATOM 1855 CD GLU A 136 8.655 -0.875 -39.199 1.00 0.00 C ATOM 1856 OE1 GLU A 136 9.828 -1.269 -39.362 1.00 0.00 O ATOM 1857 OE2 GLU A 136 8.370 0.334 -39.121 1.00 0.00 O ATOM 0 H GLU A 136 7.026 -5.149 -40.179 1.00 0.00 H new ATOM 0 HA GLU A 136 5.003 -2.994 -39.866 1.00 0.00 H new ATOM 0 HB2 GLU A 136 7.794 -2.729 -41.086 1.00 0.00 H new ATOM 0 HB3 GLU A 136 6.583 -1.466 -40.999 1.00 0.00 H new ATOM 0 HG2 GLU A 136 6.714 -1.491 -38.513 1.00 0.00 H new ATOM 0 HG3 GLU A 136 7.894 -2.785 -38.578 1.00 0.00 H new