USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 965 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 75 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 88 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 48 ASN : amide:sc= 0.962 X(o=0.65,f=0.59) USER MOD Set 2.2: A 50 SER OG : rot -29:sc= -0.0328 USER MOD Set 2.3: A 111 HIS : no HD1:sc= -0.28 K(o=0.65,f=-1) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -0.799 K(o=-0.8,f=-1.7) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 44:sc= 0.0506 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 HIS : no HD1:sc= -0.0254 X(o=-0.025,f=-0.00031) USER MOD Single : A 59 CYS SG : rot 152:sc= -1.12 USER MOD Single : A 60 GLN : amide:sc= -0.689 X(o=-0.69,f=-0.43) USER MOD Single : A 65 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.626) USER MOD Single : A 66 SER OG : rot 130:sc= -0.099 USER MOD Single : A 68 GLN : amide:sc= -0.137 X(o=-0.14,f=0) USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 GLN : amide:sc= -6.36! C(o=-6.4!,f=-7.9!) USER MOD Single : A 77 ASN : amide:sc= -0.205 K(o=-0.21,f=-2.7!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -2.69 K(o=-2.7,f=-5.5!) USER MOD Single : A 95 ASN : amide:sc= -4.21! C(o=-4.2!,f=-1.7!) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.241 USER MOD Single : A 109 TYR OH : rot 180:sc= -0.275 USER MOD Single : A 113 HIS : no HD1:sc= 0 X(o=0,f=-0.0026) USER MOD Single : A 114 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=-0.077) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 129 SER OG : rot -160:sc= -0.871 USER MOD Single : A 131 GLN : amide:sc= -0.0775 X(o=-0.078,f=0) USER MOD ----------------------------------------------------------------- ATOM 132 N ILE A 13 0.010 -14.005 8.189 1.00 0.00 N ATOM 133 CA ILE A 13 1.076 -13.068 7.856 1.00 0.00 C ATOM 134 C ILE A 13 0.995 -11.813 8.718 1.00 0.00 C ATOM 135 O ILE A 13 -0.002 -11.090 8.713 1.00 0.00 O ATOM 136 CB ILE A 13 1.025 -12.662 6.371 1.00 0.00 C ATOM 137 CG1 ILE A 13 0.839 -13.897 5.488 1.00 0.00 C ATOM 138 CG2 ILE A 13 2.290 -11.912 5.983 1.00 0.00 C ATOM 139 CD1 ILE A 13 0.115 -13.610 4.192 1.00 0.00 C ATOM 0 HA ILE A 13 2.018 -13.580 8.052 1.00 0.00 H new ATOM 0 HB ILE A 13 0.173 -11.999 6.220 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.817 -14.322 5.262 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.284 -14.652 6.045 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.239 -11.632 4.931 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.382 -11.014 6.593 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.157 -12.552 6.146 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.019 -14.531 3.617 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.877 -13.213 4.409 1.00 0.00 H new ATOM 0 HD13 ILE A 13 0.680 -12.879 3.614 1.00 0.00 H new ATOM 151 N PRO A 14 2.068 -11.545 9.477 1.00 0.00 N ATOM 152 CA PRO A 14 2.144 -10.375 10.357 1.00 0.00 C ATOM 153 C PRO A 14 2.247 -9.069 9.577 1.00 0.00 C ATOM 154 O PRO A 14 2.597 -9.066 8.397 1.00 0.00 O ATOM 155 CB PRO A 14 3.422 -10.620 11.162 1.00 0.00 C ATOM 156 CG PRO A 14 4.256 -11.497 10.293 1.00 0.00 C ATOM 157 CD PRO A 14 3.291 -12.364 9.533 1.00 0.00 C ATOM 0 HA PRO A 14 1.250 -10.268 10.972 1.00 0.00 H new ATOM 0 HB2 PRO A 14 3.934 -9.684 11.387 1.00 0.00 H new ATOM 0 HB3 PRO A 14 3.203 -11.101 12.115 1.00 0.00 H new ATOM 0 HG2 PRO A 14 4.868 -10.904 9.613 1.00 0.00 H new ATOM 0 HG3 PRO A 14 4.938 -12.102 10.890 1.00 0.00 H new ATOM 0 HD2 PRO A 14 3.662 -12.600 8.536 1.00 0.00 H new ATOM 0 HD3 PRO A 14 3.117 -13.312 10.041 1.00 0.00 H new ATOM 165 N ASP A 15 1.941 -7.962 10.244 1.00 0.00 N ATOM 166 CA ASP A 15 2.001 -6.648 9.613 1.00 0.00 C ATOM 167 C ASP A 15 3.447 -6.222 9.382 1.00 0.00 C ATOM 168 O ASP A 15 4.365 -6.722 10.034 1.00 0.00 O ATOM 169 CB ASP A 15 1.283 -5.611 10.478 1.00 0.00 C ATOM 170 CG ASP A 15 -0.222 -5.791 10.468 1.00 0.00 C ATOM 171 OD1 ASP A 15 -0.682 -6.950 10.541 1.00 0.00 O ATOM 172 OD2 ASP A 15 -0.941 -4.772 10.388 1.00 0.00 O ATOM 0 H ASP A 15 1.649 -7.948 11.221 1.00 0.00 H new ATOM 0 HA ASP A 15 1.501 -6.713 8.646 1.00 0.00 H new ATOM 0 HB2 ASP A 15 1.648 -5.682 11.503 1.00 0.00 H new ATOM 0 HB3 ASP A 15 1.529 -4.611 10.121 1.00 0.00 H new ATOM 177 N LEU A 16 3.644 -5.297 8.449 1.00 0.00 N ATOM 178 CA LEU A 16 4.979 -4.804 8.129 1.00 0.00 C ATOM 179 C LEU A 16 4.938 -3.327 7.750 1.00 0.00 C ATOM 180 O LEU A 16 4.202 -2.927 6.848 1.00 0.00 O ATOM 181 CB LEU A 16 5.586 -5.620 6.986 1.00 0.00 C ATOM 182 CG LEU A 16 7.109 -5.573 6.863 1.00 0.00 C ATOM 183 CD1 LEU A 16 7.637 -6.873 6.276 1.00 0.00 C ATOM 184 CD2 LEU A 16 7.539 -4.387 6.011 1.00 0.00 C ATOM 0 H LEU A 16 2.896 -4.873 7.901 1.00 0.00 H new ATOM 0 HA LEU A 16 5.602 -4.915 9.016 1.00 0.00 H new ATOM 0 HB2 LEU A 16 5.283 -6.660 7.108 1.00 0.00 H new ATOM 0 HB3 LEU A 16 5.155 -5.271 6.048 1.00 0.00 H new ATOM 0 HG LEU A 16 7.532 -5.450 7.860 1.00 0.00 H new ATOM 0 HD11 LEU A 16 8.723 -6.821 6.196 1.00 0.00 H new ATOM 0 HD12 LEU A 16 7.360 -7.704 6.925 1.00 0.00 H new ATOM 0 HD13 LEU A 16 7.207 -7.026 5.286 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.626 -4.369 5.934 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.106 -4.479 5.015 1.00 0.00 H new ATOM 0 HD23 LEU A 16 7.193 -3.462 6.473 1.00 0.00 H new ATOM 196 N LYS A 17 5.735 -2.521 8.443 1.00 0.00 N ATOM 197 CA LYS A 17 5.794 -1.089 8.177 1.00 0.00 C ATOM 198 C LYS A 17 6.687 -0.794 6.977 1.00 0.00 C ATOM 199 O LYS A 17 7.706 -1.454 6.771 1.00 0.00 O ATOM 200 CB LYS A 17 6.312 -0.342 9.408 1.00 0.00 C ATOM 201 CG LYS A 17 6.794 1.067 9.106 1.00 0.00 C ATOM 202 CD LYS A 17 8.259 1.081 8.703 1.00 0.00 C ATOM 203 CE LYS A 17 9.171 1.153 9.918 1.00 0.00 C ATOM 204 NZ LYS A 17 10.609 1.181 9.531 1.00 0.00 N ATOM 0 H LYS A 17 6.350 -2.836 9.194 1.00 0.00 H new ATOM 0 HA LYS A 17 4.785 -0.746 7.949 1.00 0.00 H new ATOM 0 HB2 LYS A 17 5.519 -0.294 10.154 1.00 0.00 H new ATOM 0 HB3 LYS A 17 7.131 -0.910 9.850 1.00 0.00 H new ATOM 0 HG2 LYS A 17 6.191 1.495 8.305 1.00 0.00 H new ATOM 0 HG3 LYS A 17 6.651 1.697 9.984 1.00 0.00 H new ATOM 0 HD2 LYS A 17 8.488 0.184 8.128 1.00 0.00 H new ATOM 0 HD3 LYS A 17 8.450 1.934 8.052 1.00 0.00 H new ATOM 0 HE2 LYS A 17 8.934 2.045 10.498 1.00 0.00 H new ATOM 0 HE3 LYS A 17 8.985 0.294 10.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 11.198 1.230 10.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 10.842 0.318 8.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 10.792 2.014 8.936 1.00 0.00 H new ATOM 218 N VAL A 18 6.300 0.202 6.187 1.00 0.00 N ATOM 219 CA VAL A 18 7.067 0.586 5.008 1.00 0.00 C ATOM 220 C VAL A 18 7.561 2.024 5.118 1.00 0.00 C ATOM 221 O VAL A 18 8.543 2.406 4.480 1.00 0.00 O ATOM 222 CB VAL A 18 6.233 0.438 3.722 1.00 0.00 C ATOM 223 CG1 VAL A 18 5.686 -0.976 3.599 1.00 0.00 C ATOM 224 CG2 VAL A 18 5.104 1.459 3.699 1.00 0.00 C ATOM 0 H VAL A 18 5.459 0.758 6.342 1.00 0.00 H new ATOM 0 HA VAL A 18 7.923 -0.086 4.955 1.00 0.00 H new ATOM 0 HB VAL A 18 6.881 0.627 2.866 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.099 -1.061 2.684 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.514 -1.685 3.567 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.052 -1.197 4.458 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.525 1.340 2.783 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.456 1.304 4.561 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.522 2.465 3.736 1.00 0.00 H new ATOM 234 N PHE A 19 6.874 2.819 5.931 1.00 0.00 N ATOM 235 CA PHE A 19 7.242 4.217 6.125 1.00 0.00 C ATOM 236 C PHE A 19 7.005 4.646 7.570 1.00 0.00 C ATOM 237 O PHE A 19 6.030 4.235 8.198 1.00 0.00 O ATOM 238 CB PHE A 19 6.442 5.113 5.177 1.00 0.00 C ATOM 239 CG PHE A 19 7.061 6.465 4.966 1.00 0.00 C ATOM 240 CD1 PHE A 19 6.824 7.498 5.860 1.00 0.00 C ATOM 241 CD2 PHE A 19 7.880 6.704 3.874 1.00 0.00 C ATOM 242 CE1 PHE A 19 7.392 8.743 5.667 1.00 0.00 C ATOM 243 CE2 PHE A 19 8.451 7.947 3.677 1.00 0.00 C ATOM 244 CZ PHE A 19 8.207 8.968 4.575 1.00 0.00 C ATOM 0 H PHE A 19 6.059 2.519 6.466 1.00 0.00 H new ATOM 0 HA PHE A 19 8.304 4.322 5.903 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.344 4.613 4.214 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.435 5.241 5.574 1.00 0.00 H new ATOM 0 HD1 PHE A 19 6.189 7.328 6.717 1.00 0.00 H new ATOM 0 HD2 PHE A 19 8.074 5.910 3.169 1.00 0.00 H new ATOM 0 HE1 PHE A 19 7.199 9.540 6.370 1.00 0.00 H new ATOM 0 HE2 PHE A 19 9.087 8.120 2.822 1.00 0.00 H new ATOM 0 HZ PHE A 19 8.653 9.940 4.423 1.00 0.00 H new ATOM 254 N GLU A 20 7.904 5.476 8.090 1.00 0.00 N ATOM 255 CA GLU A 20 7.794 5.960 9.461 1.00 0.00 C ATOM 256 C GLU A 20 8.219 7.422 9.558 1.00 0.00 C ATOM 257 O GLU A 20 9.309 7.793 9.120 1.00 0.00 O ATOM 258 CB GLU A 20 8.650 5.105 10.398 1.00 0.00 C ATOM 259 CG GLU A 20 8.474 5.450 11.867 1.00 0.00 C ATOM 260 CD GLU A 20 9.150 4.450 12.785 1.00 0.00 C ATOM 261 OE1 GLU A 20 9.233 3.262 12.411 1.00 0.00 O ATOM 262 OE2 GLU A 20 9.595 4.857 13.879 1.00 0.00 O ATOM 0 H GLU A 20 8.716 5.827 7.583 1.00 0.00 H new ATOM 0 HA GLU A 20 6.750 5.883 9.763 1.00 0.00 H new ATOM 0 HB2 GLU A 20 8.400 4.055 10.248 1.00 0.00 H new ATOM 0 HB3 GLU A 20 9.699 5.225 10.128 1.00 0.00 H new ATOM 0 HG2 GLU A 20 8.882 6.443 12.055 1.00 0.00 H new ATOM 0 HG3 GLU A 20 7.410 5.492 12.102 1.00 0.00 H new ATOM 269 N ARG A 21 7.351 8.248 10.133 1.00 0.00 N ATOM 270 CA ARG A 21 7.636 9.670 10.286 1.00 0.00 C ATOM 271 C ARG A 21 7.346 10.132 11.711 1.00 0.00 C ATOM 272 O ARG A 21 6.495 9.565 12.396 1.00 0.00 O ATOM 273 CB ARG A 21 6.805 10.487 9.295 1.00 0.00 C ATOM 274 CG ARG A 21 7.263 11.930 9.162 1.00 0.00 C ATOM 275 CD ARG A 21 6.780 12.550 7.859 1.00 0.00 C ATOM 276 NE ARG A 21 7.659 12.223 6.739 1.00 0.00 N ATOM 277 CZ ARG A 21 8.786 12.873 6.475 1.00 0.00 C ATOM 278 NH1 ARG A 21 9.170 13.881 7.247 1.00 0.00 N ATOM 279 NH2 ARG A 21 9.532 12.517 5.438 1.00 0.00 N ATOM 0 H ARG A 21 6.445 7.957 10.500 1.00 0.00 H new ATOM 0 HA ARG A 21 8.695 9.828 10.079 1.00 0.00 H new ATOM 0 HB2 ARG A 21 6.849 10.009 8.316 1.00 0.00 H new ATOM 0 HB3 ARG A 21 5.762 10.473 9.610 1.00 0.00 H new ATOM 0 HG2 ARG A 21 6.887 12.511 10.004 1.00 0.00 H new ATOM 0 HG3 ARG A 21 8.351 11.973 9.205 1.00 0.00 H new ATOM 0 HD2 ARG A 21 5.771 12.199 7.643 1.00 0.00 H new ATOM 0 HD3 ARG A 21 6.724 13.633 7.972 1.00 0.00 H new ATOM 0 HE ARG A 21 7.392 11.453 6.126 1.00 0.00 H new ATOM 0 HH11 ARG A 21 8.599 14.158 8.045 1.00 0.00 H new ATOM 0 HH12 ARG A 21 10.036 14.379 7.042 1.00 0.00 H new ATOM 0 HH21 ARG A 21 9.240 11.743 4.842 1.00 0.00 H new ATOM 0 HH22 ARG A 21 10.398 13.018 5.237 1.00 0.00 H new ATOM 293 N GLU A 22 8.061 11.164 12.150 1.00 0.00 N ATOM 294 CA GLU A 22 7.881 11.700 13.494 1.00 0.00 C ATOM 295 C GLU A 22 6.408 11.682 13.894 1.00 0.00 C ATOM 296 O GLU A 22 6.076 11.594 15.075 1.00 0.00 O ATOM 297 CB GLU A 22 8.426 13.128 13.575 1.00 0.00 C ATOM 298 CG GLU A 22 9.904 13.235 13.239 1.00 0.00 C ATOM 299 CD GLU A 22 10.794 12.995 14.443 1.00 0.00 C ATOM 300 OE1 GLU A 22 10.488 13.540 15.524 1.00 0.00 O ATOM 301 OE2 GLU A 22 11.796 12.263 14.304 1.00 0.00 O ATOM 0 H GLU A 22 8.769 11.645 11.595 1.00 0.00 H new ATOM 0 HA GLU A 22 8.436 11.068 14.187 1.00 0.00 H new ATOM 0 HB2 GLU A 22 7.860 13.763 12.893 1.00 0.00 H new ATOM 0 HB3 GLU A 22 8.262 13.514 14.581 1.00 0.00 H new ATOM 0 HG2 GLU A 22 10.149 12.512 12.461 1.00 0.00 H new ATOM 0 HG3 GLU A 22 10.110 14.225 12.831 1.00 0.00 H new ATOM 308 N GLY A 23 5.530 11.768 12.900 1.00 0.00 N ATOM 309 CA GLY A 23 4.103 11.761 13.168 1.00 0.00 C ATOM 310 C GLY A 23 3.340 10.854 12.223 1.00 0.00 C ATOM 311 O GLY A 23 2.413 10.157 12.634 1.00 0.00 O ATOM 0 H GLY A 23 5.781 11.842 11.914 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.931 11.438 14.195 1.00 0.00 H new ATOM 0 HA3 GLY A 23 3.716 12.776 13.084 1.00 0.00 H new ATOM 315 N VAL A 24 3.730 10.863 10.952 1.00 0.00 N ATOM 316 CA VAL A 24 3.076 10.036 9.946 1.00 0.00 C ATOM 317 C VAL A 24 3.668 8.631 9.921 1.00 0.00 C ATOM 318 O VAL A 24 4.880 8.460 9.793 1.00 0.00 O ATOM 319 CB VAL A 24 3.198 10.657 8.542 1.00 0.00 C ATOM 320 CG1 VAL A 24 2.815 9.645 7.474 1.00 0.00 C ATOM 321 CG2 VAL A 24 2.338 11.907 8.437 1.00 0.00 C ATOM 0 H VAL A 24 4.496 11.434 10.595 1.00 0.00 H new ATOM 0 HA VAL A 24 2.022 9.979 10.219 1.00 0.00 H new ATOM 0 HB VAL A 24 4.237 10.943 8.380 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.908 10.103 6.489 1.00 0.00 H new ATOM 0 HG12 VAL A 24 3.477 8.782 7.537 1.00 0.00 H new ATOM 0 HG13 VAL A 24 1.785 9.324 7.629 1.00 0.00 H new ATOM 0 HG21 VAL A 24 2.436 12.333 7.439 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.295 11.648 8.620 1.00 0.00 H new ATOM 0 HG23 VAL A 24 2.666 12.637 9.177 1.00 0.00 H new ATOM 331 N GLN A 25 2.803 7.629 10.043 1.00 0.00 N ATOM 332 CA GLN A 25 3.241 6.238 10.035 1.00 0.00 C ATOM 333 C GLN A 25 2.405 5.410 9.064 1.00 0.00 C ATOM 334 O GLN A 25 1.175 5.413 9.128 1.00 0.00 O ATOM 335 CB GLN A 25 3.149 5.643 11.441 1.00 0.00 C ATOM 336 CG GLN A 25 4.411 5.834 12.266 1.00 0.00 C ATOM 337 CD GLN A 25 4.135 5.863 13.757 1.00 0.00 C ATOM 338 OE1 GLN A 25 3.687 6.875 14.297 1.00 0.00 O ATOM 339 NE2 GLN A 25 4.403 4.751 14.431 1.00 0.00 N ATOM 0 H GLN A 25 1.796 7.754 10.148 1.00 0.00 H new ATOM 0 HA GLN A 25 4.280 6.213 9.705 1.00 0.00 H new ATOM 0 HB2 GLN A 25 2.310 6.099 11.965 1.00 0.00 H new ATOM 0 HB3 GLN A 25 2.934 4.577 11.362 1.00 0.00 H new ATOM 0 HG2 GLN A 25 5.110 5.027 12.045 1.00 0.00 H new ATOM 0 HG3 GLN A 25 4.895 6.765 11.972 1.00 0.00 H new ATOM 0 HE21 GLN A 25 4.773 3.936 13.943 1.00 0.00 H new ATOM 0 HE22 GLN A 25 4.239 4.712 15.437 1.00 0.00 H new ATOM 348 N LEU A 26 3.080 4.702 8.165 1.00 0.00 N ATOM 349 CA LEU A 26 2.400 3.869 7.180 1.00 0.00 C ATOM 350 C LEU A 26 2.681 2.391 7.429 1.00 0.00 C ATOM 351 O LEU A 26 3.836 1.975 7.514 1.00 0.00 O ATOM 352 CB LEU A 26 2.841 4.253 5.766 1.00 0.00 C ATOM 353 CG LEU A 26 1.949 3.758 4.627 1.00 0.00 C ATOM 354 CD1 LEU A 26 0.645 4.539 4.592 1.00 0.00 C ATOM 355 CD2 LEU A 26 2.675 3.870 3.294 1.00 0.00 C ATOM 0 H LEU A 26 4.098 4.688 8.098 1.00 0.00 H new ATOM 0 HA LEU A 26 1.327 4.037 7.278 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.900 5.340 5.708 1.00 0.00 H new ATOM 0 HB3 LEU A 26 3.849 3.870 5.605 1.00 0.00 H new ATOM 0 HG LEU A 26 1.715 2.708 4.804 1.00 0.00 H new ATOM 0 HD11 LEU A 26 0.023 4.173 3.775 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.117 4.408 5.537 1.00 0.00 H new ATOM 0 HD13 LEU A 26 0.858 5.597 4.439 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.025 3.513 2.495 1.00 0.00 H new ATOM 0 HD22 LEU A 26 2.939 4.911 3.110 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.582 3.266 3.322 1.00 0.00 H new ATOM 367 N ASN A 27 1.618 1.602 7.543 1.00 0.00 N ATOM 368 CA ASN A 27 1.751 0.169 7.780 1.00 0.00 C ATOM 369 C ASN A 27 1.310 -0.628 6.557 1.00 0.00 C ATOM 370 O ASN A 27 0.655 -0.097 5.658 1.00 0.00 O ATOM 371 CB ASN A 27 0.923 -0.246 8.999 1.00 0.00 C ATOM 372 CG ASN A 27 1.548 0.208 10.304 1.00 0.00 C ATOM 373 OD1 ASN A 27 2.460 -0.434 10.825 1.00 0.00 O ATOM 374 ND2 ASN A 27 1.058 1.321 10.839 1.00 0.00 N ATOM 0 H ASN A 27 0.655 1.931 7.475 1.00 0.00 H new ATOM 0 HA ASN A 27 2.802 -0.046 7.972 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -0.079 0.174 8.914 1.00 0.00 H new ATOM 0 HB3 ASN A 27 0.815 -1.331 9.009 1.00 0.00 H new ATOM 0 HD21 ASN A 27 1.438 1.675 11.717 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.301 1.821 10.372 1.00 0.00 H new ATOM 381 N LEU A 28 1.672 -1.906 6.528 1.00 0.00 N ATOM 382 CA LEU A 28 1.314 -2.778 5.415 1.00 0.00 C ATOM 383 C LEU A 28 0.687 -4.074 5.919 1.00 0.00 C ATOM 384 O LEU A 28 0.986 -4.533 7.022 1.00 0.00 O ATOM 385 CB LEU A 28 2.549 -3.092 4.569 1.00 0.00 C ATOM 386 CG LEU A 28 2.296 -3.357 3.085 1.00 0.00 C ATOM 387 CD1 LEU A 28 3.513 -2.973 2.258 1.00 0.00 C ATOM 388 CD2 LEU A 28 1.935 -4.818 2.858 1.00 0.00 C ATOM 0 H LEU A 28 2.213 -2.361 7.263 1.00 0.00 H new ATOM 0 HA LEU A 28 0.582 -2.257 4.798 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.245 -2.258 4.655 1.00 0.00 H new ATOM 0 HB3 LEU A 28 3.044 -3.965 4.994 1.00 0.00 H new ATOM 0 HG LEU A 28 1.456 -2.741 2.765 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.314 -3.169 1.204 1.00 0.00 H new ATOM 0 HD12 LEU A 28 3.727 -1.913 2.396 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.372 -3.561 2.580 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.758 -4.988 1.796 1.00 0.00 H new ATOM 0 HD22 LEU A 28 2.755 -5.452 3.196 1.00 0.00 H new ATOM 0 HD23 LEU A 28 1.033 -5.061 3.419 1.00 0.00 H new ATOM 400 N SER A 29 -0.183 -4.661 5.103 1.00 0.00 N ATOM 401 CA SER A 29 -0.854 -5.903 5.467 1.00 0.00 C ATOM 402 C SER A 29 -1.045 -6.796 4.244 1.00 0.00 C ATOM 403 O SER A 29 -1.315 -6.312 3.144 1.00 0.00 O ATOM 404 CB SER A 29 -2.209 -5.606 6.112 1.00 0.00 C ATOM 405 OG SER A 29 -2.759 -6.771 6.703 1.00 0.00 O ATOM 0 H SER A 29 -0.439 -4.296 4.186 1.00 0.00 H new ATOM 0 HA SER A 29 -0.225 -6.429 6.185 1.00 0.00 H new ATOM 0 HB2 SER A 29 -2.093 -4.831 6.869 1.00 0.00 H new ATOM 0 HB3 SER A 29 -2.896 -5.217 5.360 1.00 0.00 H new ATOM 0 HG SER A 29 -3.624 -6.554 7.110 1.00 0.00 H new ATOM 411 N PHE A 30 -0.903 -8.102 4.444 1.00 0.00 N ATOM 412 CA PHE A 30 -1.059 -9.063 3.359 1.00 0.00 C ATOM 413 C PHE A 30 -2.222 -10.011 3.635 1.00 0.00 C ATOM 414 O PHE A 30 -2.444 -10.423 4.774 1.00 0.00 O ATOM 415 CB PHE A 30 0.231 -9.862 3.168 1.00 0.00 C ATOM 416 CG PHE A 30 1.451 -9.002 3.005 1.00 0.00 C ATOM 417 CD1 PHE A 30 1.818 -8.527 1.756 1.00 0.00 C ATOM 418 CD2 PHE A 30 2.231 -8.666 4.100 1.00 0.00 C ATOM 419 CE1 PHE A 30 2.941 -7.736 1.602 1.00 0.00 C ATOM 420 CE2 PHE A 30 3.354 -7.875 3.953 1.00 0.00 C ATOM 421 CZ PHE A 30 3.709 -7.408 2.702 1.00 0.00 C ATOM 0 H PHE A 30 -0.680 -8.519 5.348 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.274 -8.510 2.445 1.00 0.00 H new ATOM 0 HB2 PHE A 30 0.372 -10.519 4.026 1.00 0.00 H new ATOM 0 HB3 PHE A 30 0.127 -10.501 2.291 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.219 -8.778 0.893 1.00 0.00 H new ATOM 0 HD2 PHE A 30 1.958 -9.027 5.080 1.00 0.00 H new ATOM 0 HE1 PHE A 30 3.218 -7.375 0.622 1.00 0.00 H new ATOM 0 HE2 PHE A 30 3.954 -7.622 4.815 1.00 0.00 H new ATOM 0 HZ PHE A 30 4.585 -6.788 2.585 1.00 0.00 H new ATOM 431 N ILE A 31 -2.961 -10.353 2.585 1.00 0.00 N ATOM 432 CA ILE A 31 -4.101 -11.252 2.713 1.00 0.00 C ATOM 433 C ILE A 31 -4.079 -12.325 1.629 1.00 0.00 C ATOM 434 O ILE A 31 -3.831 -12.035 0.459 1.00 0.00 O ATOM 435 CB ILE A 31 -5.434 -10.486 2.635 1.00 0.00 C ATOM 436 CG1 ILE A 31 -5.589 -9.563 3.845 1.00 0.00 C ATOM 437 CG2 ILE A 31 -6.600 -11.460 2.553 1.00 0.00 C ATOM 438 CD1 ILE A 31 -4.933 -8.212 3.662 1.00 0.00 C ATOM 0 H ILE A 31 -2.790 -10.021 1.636 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.021 -11.726 3.691 1.00 0.00 H new ATOM 0 HB ILE A 31 -5.432 -9.874 1.733 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -6.650 -9.418 4.048 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -5.161 -10.050 4.721 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -7.536 -10.904 2.498 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -6.494 -12.080 1.663 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -6.607 -12.095 3.439 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.083 -7.610 4.559 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.865 -8.346 3.489 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.378 -7.705 2.806 1.00 0.00 H new ATOM 450 N ARG A 32 -4.342 -13.566 2.027 1.00 0.00 N ATOM 451 CA ARG A 32 -4.354 -14.682 1.090 1.00 0.00 C ATOM 452 C ARG A 32 -5.667 -15.454 1.180 1.00 0.00 C ATOM 453 O ARG A 32 -5.853 -16.312 2.044 1.00 0.00 O ATOM 454 CB ARG A 32 -3.178 -15.620 1.367 1.00 0.00 C ATOM 455 CG ARG A 32 -1.820 -14.982 1.127 1.00 0.00 C ATOM 456 CD ARG A 32 -1.472 -14.949 -0.353 1.00 0.00 C ATOM 457 NE ARG A 32 -1.159 -16.278 -0.871 1.00 0.00 N ATOM 458 CZ ARG A 32 -0.697 -16.499 -2.097 1.00 0.00 C ATOM 459 NH1 ARG A 32 -0.496 -15.484 -2.926 1.00 0.00 N ATOM 460 NH2 ARG A 32 -0.435 -17.737 -2.495 1.00 0.00 N ATOM 0 H ARG A 32 -4.550 -13.823 2.992 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.259 -14.279 0.082 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -3.232 -15.961 2.401 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.272 -16.503 0.735 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -1.819 -13.967 1.525 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -1.055 -15.538 1.669 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -2.308 -14.529 -0.913 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -0.619 -14.288 -0.510 1.00 0.00 H new ATOM 0 HE ARG A 32 -1.303 -17.081 -0.258 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -0.696 -14.531 -2.623 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -0.141 -15.656 -3.867 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -0.588 -18.520 -1.860 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -0.080 -17.906 -3.436 1.00 0.00 H new ATOM 474 N PRO A 33 -6.600 -15.144 0.269 1.00 0.00 N ATOM 475 CA PRO A 33 -7.912 -15.797 0.225 1.00 0.00 C ATOM 476 C PRO A 33 -7.820 -17.253 -0.221 1.00 0.00 C ATOM 477 O PRO A 33 -6.987 -17.622 -1.048 1.00 0.00 O ATOM 478 CB PRO A 33 -8.686 -14.970 -0.805 1.00 0.00 C ATOM 479 CG PRO A 33 -7.636 -14.374 -1.678 1.00 0.00 C ATOM 480 CD PRO A 33 -6.447 -14.132 -0.790 1.00 0.00 C ATOM 0 HA PRO A 33 -8.384 -15.830 1.207 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.371 -15.594 -1.379 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -9.285 -14.198 -0.323 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -7.381 -15.047 -2.497 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -7.984 -13.443 -2.127 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.509 -14.256 -1.332 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -6.449 -13.121 -0.383 1.00 0.00 H new ATOM 488 N PRO A 34 -8.696 -18.100 0.338 1.00 0.00 N ATOM 489 CA PRO A 34 -8.735 -19.529 0.012 1.00 0.00 C ATOM 490 C PRO A 34 -9.239 -19.787 -1.403 1.00 0.00 C ATOM 491 O PRO A 34 -8.690 -20.618 -2.125 1.00 0.00 O ATOM 492 CB PRO A 34 -9.712 -20.102 1.041 1.00 0.00 C ATOM 493 CG PRO A 34 -10.586 -18.954 1.413 1.00 0.00 C ATOM 494 CD PRO A 34 -9.718 -17.729 1.332 1.00 0.00 C ATOM 0 HA PRO A 34 -7.744 -19.982 0.047 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -10.294 -20.923 0.621 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -9.186 -20.497 1.910 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -11.436 -18.875 0.735 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -10.990 -19.080 2.418 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -10.286 -16.854 1.017 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -9.272 -17.488 2.297 1.00 0.00 H new ATOM 502 N GLU A 35 -10.288 -19.069 -1.793 1.00 0.00 N ATOM 503 CA GLU A 35 -10.866 -19.222 -3.123 1.00 0.00 C ATOM 504 C GLU A 35 -9.812 -18.997 -4.203 1.00 0.00 C ATOM 505 O GLU A 35 -9.773 -19.709 -5.206 1.00 0.00 O ATOM 506 CB GLU A 35 -12.026 -18.243 -3.315 1.00 0.00 C ATOM 507 CG GLU A 35 -11.634 -16.788 -3.117 1.00 0.00 C ATOM 508 CD GLU A 35 -12.826 -15.897 -2.828 1.00 0.00 C ATOM 509 OE1 GLU A 35 -13.590 -16.215 -1.892 1.00 0.00 O ATOM 510 OE2 GLU A 35 -12.995 -14.883 -3.536 1.00 0.00 O ATOM 0 H GLU A 35 -10.754 -18.376 -1.207 1.00 0.00 H new ATOM 0 HA GLU A 35 -11.242 -20.241 -3.213 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -12.433 -18.367 -4.318 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -12.822 -18.495 -2.615 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -10.923 -16.716 -2.294 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -11.124 -16.428 -4.011 1.00 0.00 H new ATOM 517 N ASN A 36 -8.958 -18.000 -3.991 1.00 0.00 N ATOM 518 CA ASN A 36 -7.904 -17.680 -4.946 1.00 0.00 C ATOM 519 C ASN A 36 -6.551 -17.577 -4.249 1.00 0.00 C ATOM 520 O ASN A 36 -6.198 -16.548 -3.673 1.00 0.00 O ATOM 521 CB ASN A 36 -8.221 -16.367 -5.665 1.00 0.00 C ATOM 522 CG ASN A 36 -7.659 -16.328 -7.073 1.00 0.00 C ATOM 523 OD1 ASN A 36 -6.719 -17.053 -7.398 1.00 0.00 O ATOM 524 ND2 ASN A 36 -8.234 -15.479 -7.916 1.00 0.00 N ATOM 0 H ASN A 36 -8.976 -17.400 -3.166 1.00 0.00 H new ATOM 0 HA ASN A 36 -7.855 -18.486 -5.679 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -9.302 -16.229 -5.704 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -7.814 -15.534 -5.091 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -7.899 -15.409 -8.877 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -9.011 -14.897 -7.603 1.00 0.00 H new ATOM 531 N PRO A 37 -5.774 -18.669 -4.303 1.00 0.00 N ATOM 532 CA PRO A 37 -4.446 -18.727 -3.684 1.00 0.00 C ATOM 533 C PRO A 37 -3.431 -17.849 -4.406 1.00 0.00 C ATOM 534 O PRO A 37 -2.608 -17.186 -3.774 1.00 0.00 O ATOM 535 CB PRO A 37 -4.061 -20.203 -3.809 1.00 0.00 C ATOM 536 CG PRO A 37 -4.839 -20.700 -4.978 1.00 0.00 C ATOM 537 CD PRO A 37 -6.130 -19.931 -4.974 1.00 0.00 C ATOM 0 HA PRO A 37 -4.459 -18.361 -2.657 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -2.989 -20.320 -3.968 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -4.311 -20.755 -2.903 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.292 -20.540 -5.907 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -5.023 -21.771 -4.897 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -6.498 -19.758 -5.985 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -6.914 -20.465 -4.436 1.00 0.00 H new ATOM 545 N ALA A 38 -3.494 -17.847 -5.733 1.00 0.00 N ATOM 546 CA ALA A 38 -2.581 -17.048 -6.541 1.00 0.00 C ATOM 547 C ALA A 38 -2.891 -15.561 -6.409 1.00 0.00 C ATOM 548 O ALA A 38 -2.162 -14.716 -6.931 1.00 0.00 O ATOM 549 CB ALA A 38 -2.652 -17.477 -7.999 1.00 0.00 C ATOM 0 H ALA A 38 -4.168 -18.390 -6.272 1.00 0.00 H new ATOM 0 HA ALA A 38 -1.568 -17.216 -6.174 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -1.965 -16.872 -8.590 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -2.374 -18.528 -8.083 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -3.668 -17.339 -8.370 1.00 0.00 H new ATOM 555 N LEU A 39 -3.976 -15.247 -5.711 1.00 0.00 N ATOM 556 CA LEU A 39 -4.383 -13.860 -5.511 1.00 0.00 C ATOM 557 C LEU A 39 -3.874 -13.330 -4.174 1.00 0.00 C ATOM 558 O LEU A 39 -4.095 -13.941 -3.128 1.00 0.00 O ATOM 559 CB LEU A 39 -5.907 -13.741 -5.573 1.00 0.00 C ATOM 560 CG LEU A 39 -6.470 -12.320 -5.571 1.00 0.00 C ATOM 561 CD1 LEU A 39 -6.481 -11.748 -6.980 1.00 0.00 C ATOM 562 CD2 LEU A 39 -7.870 -12.301 -4.975 1.00 0.00 C ATOM 0 H LEU A 39 -4.590 -15.934 -5.274 1.00 0.00 H new ATOM 0 HA LEU A 39 -3.945 -13.260 -6.309 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -6.254 -14.247 -6.474 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.328 -14.278 -4.723 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.825 -11.696 -4.952 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -6.885 -10.736 -6.959 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -5.464 -11.724 -7.371 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -7.102 -12.373 -7.622 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -8.255 -11.281 -4.982 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -8.526 -12.940 -5.566 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -7.834 -12.668 -3.949 1.00 0.00 H new ATOM 574 N LEU A 40 -3.194 -12.190 -4.216 1.00 0.00 N ATOM 575 CA LEU A 40 -2.655 -11.575 -3.008 1.00 0.00 C ATOM 576 C LEU A 40 -3.250 -10.187 -2.791 1.00 0.00 C ATOM 577 O LEU A 40 -2.912 -9.238 -3.500 1.00 0.00 O ATOM 578 CB LEU A 40 -1.131 -11.482 -3.095 1.00 0.00 C ATOM 579 CG LEU A 40 -0.444 -10.668 -1.998 1.00 0.00 C ATOM 580 CD1 LEU A 40 -0.519 -11.398 -0.666 1.00 0.00 C ATOM 581 CD2 LEU A 40 1.003 -10.383 -2.372 1.00 0.00 C ATOM 0 H LEU A 40 -3.003 -11.672 -5.074 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.926 -12.203 -2.159 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.724 -12.493 -3.078 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.868 -11.048 -4.060 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.966 -9.716 -1.897 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.025 -10.804 0.103 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.563 -11.550 -0.392 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.023 -12.365 -0.752 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.476 -9.803 -1.580 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.538 -11.324 -2.501 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.033 -9.818 -3.303 1.00 0.00 H new ATOM 593 N LEU A 41 -4.135 -10.076 -1.807 1.00 0.00 N ATOM 594 CA LEU A 41 -4.775 -8.803 -1.494 1.00 0.00 C ATOM 595 C LEU A 41 -4.000 -8.054 -0.415 1.00 0.00 C ATOM 596 O LEU A 41 -3.885 -8.522 0.718 1.00 0.00 O ATOM 597 CB LEU A 41 -6.216 -9.033 -1.037 1.00 0.00 C ATOM 598 CG LEU A 41 -7.091 -9.871 -1.970 1.00 0.00 C ATOM 599 CD1 LEU A 41 -8.363 -10.307 -1.261 1.00 0.00 C ATOM 600 CD2 LEU A 41 -7.424 -9.089 -3.233 1.00 0.00 C ATOM 0 H LEU A 41 -4.426 -10.852 -1.212 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.780 -8.195 -2.399 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.193 -9.517 -0.061 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.692 -8.062 -0.900 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.534 -10.764 -2.254 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -8.973 -10.902 -1.941 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.106 -10.905 -0.387 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.924 -9.427 -0.946 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -8.047 -9.700 -3.886 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -7.961 -8.179 -2.966 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.502 -8.827 -3.752 1.00 0.00 H new ATOM 612 N ILE A 42 -3.473 -6.888 -0.773 1.00 0.00 N ATOM 613 CA ILE A 42 -2.713 -6.073 0.166 1.00 0.00 C ATOM 614 C ILE A 42 -3.518 -4.860 0.620 1.00 0.00 C ATOM 615 O ILE A 42 -4.391 -4.376 -0.101 1.00 0.00 O ATOM 616 CB ILE A 42 -1.386 -5.592 -0.452 1.00 0.00 C ATOM 617 CG1 ILE A 42 -0.386 -6.747 -0.528 1.00 0.00 C ATOM 618 CG2 ILE A 42 -0.812 -4.439 0.359 1.00 0.00 C ATOM 619 CD1 ILE A 42 0.688 -6.548 -1.575 1.00 0.00 C ATOM 0 H ILE A 42 -3.559 -6.487 -1.707 1.00 0.00 H new ATOM 0 HA ILE A 42 -2.496 -6.705 1.027 1.00 0.00 H new ATOM 0 HB ILE A 42 -1.580 -5.237 -1.464 1.00 0.00 H new ATOM 0 HG12 ILE A 42 0.086 -6.873 0.446 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -0.925 -7.670 -0.742 1.00 0.00 H new ATOM 0 HG21 ILE A 42 0.125 -4.110 -0.090 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -1.521 -3.611 0.367 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.629 -4.769 1.381 1.00 0.00 H new ATOM 0 HD11 ILE A 42 1.361 -7.405 -1.573 1.00 0.00 H new ATOM 0 HD12 ILE A 42 0.225 -6.452 -2.557 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.252 -5.643 -1.350 1.00 0.00 H new ATOM 631 N THR A 43 -3.219 -4.373 1.820 1.00 0.00 N ATOM 632 CA THR A 43 -3.914 -3.216 2.370 1.00 0.00 C ATOM 633 C THR A 43 -2.930 -2.211 2.958 1.00 0.00 C ATOM 634 O THR A 43 -1.810 -2.568 3.325 1.00 0.00 O ATOM 635 CB THR A 43 -4.919 -3.632 3.461 1.00 0.00 C ATOM 636 OG1 THR A 43 -5.751 -4.695 2.982 1.00 0.00 O ATOM 637 CG2 THR A 43 -5.785 -2.452 3.877 1.00 0.00 C ATOM 0 H THR A 43 -2.500 -4.762 2.430 1.00 0.00 H new ATOM 0 HA THR A 43 -4.455 -2.751 1.546 1.00 0.00 H new ATOM 0 HB THR A 43 -4.357 -3.975 4.330 1.00 0.00 H new ATOM 0 HG1 THR A 43 -6.386 -4.954 3.682 1.00 0.00 H new ATOM 0 HG21 THR A 43 -6.487 -2.770 4.648 1.00 0.00 H new ATOM 0 HG22 THR A 43 -5.152 -1.656 4.269 1.00 0.00 H new ATOM 0 HG23 THR A 43 -6.338 -2.084 3.013 1.00 0.00 H new ATOM 645 N ILE A 44 -3.355 -0.956 3.045 1.00 0.00 N ATOM 646 CA ILE A 44 -2.511 0.100 3.590 1.00 0.00 C ATOM 647 C ILE A 44 -3.197 0.806 4.755 1.00 0.00 C ATOM 648 O ILE A 44 -4.419 0.959 4.770 1.00 0.00 O ATOM 649 CB ILE A 44 -2.146 1.141 2.516 1.00 0.00 C ATOM 650 CG1 ILE A 44 -2.049 0.475 1.142 1.00 0.00 C ATOM 651 CG2 ILE A 44 -0.838 1.832 2.870 1.00 0.00 C ATOM 652 CD1 ILE A 44 -1.487 1.382 0.069 1.00 0.00 C ATOM 0 H ILE A 44 -4.279 -0.645 2.745 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.598 -0.378 3.945 1.00 0.00 H new ATOM 0 HB ILE A 44 -2.933 1.894 2.479 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.422 -0.413 1.221 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -3.041 0.139 0.839 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.594 2.565 2.101 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -0.941 2.335 3.831 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -0.040 1.092 2.932 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -1.447 0.844 -0.878 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -2.126 2.258 -0.038 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.482 1.698 0.349 1.00 0.00 H new ATOM 664 N THR A 45 -2.402 1.238 5.730 1.00 0.00 N ATOM 665 CA THR A 45 -2.932 1.929 6.898 1.00 0.00 C ATOM 666 C THR A 45 -2.109 3.170 7.223 1.00 0.00 C ATOM 667 O THR A 45 -1.135 3.101 7.973 1.00 0.00 O ATOM 668 CB THR A 45 -2.960 1.007 8.132 1.00 0.00 C ATOM 669 OG1 THR A 45 -3.705 -0.181 7.839 1.00 0.00 O ATOM 670 CG2 THR A 45 -3.579 1.718 9.325 1.00 0.00 C ATOM 0 H THR A 45 -1.389 1.121 5.733 1.00 0.00 H new ATOM 0 HA THR A 45 -3.952 2.227 6.653 1.00 0.00 H new ATOM 0 HB THR A 45 -1.933 0.740 8.382 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.717 -0.763 8.628 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.588 1.047 10.184 1.00 0.00 H new ATOM 0 HG22 THR A 45 -2.993 2.606 9.564 1.00 0.00 H new ATOM 0 HG23 THR A 45 -4.601 2.012 9.084 1.00 0.00 H new ATOM 678 N ALA A 46 -2.506 4.304 6.656 1.00 0.00 N ATOM 679 CA ALA A 46 -1.805 5.561 6.888 1.00 0.00 C ATOM 680 C ALA A 46 -2.396 6.306 8.080 1.00 0.00 C ATOM 681 O ALA A 46 -3.532 6.780 8.028 1.00 0.00 O ATOM 682 CB ALA A 46 -1.855 6.431 5.641 1.00 0.00 C ATOM 0 H ALA A 46 -3.310 4.378 6.032 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.764 5.332 7.116 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.328 7.366 5.829 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.380 5.906 4.812 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -2.893 6.644 5.388 1.00 0.00 H new ATOM 688 N THR A 47 -1.620 6.406 9.154 1.00 0.00 N ATOM 689 CA THR A 47 -2.067 7.093 10.359 1.00 0.00 C ATOM 690 C THR A 47 -1.331 8.414 10.545 1.00 0.00 C ATOM 691 O THR A 47 -0.122 8.497 10.335 1.00 0.00 O ATOM 692 CB THR A 47 -1.858 6.221 11.612 1.00 0.00 C ATOM 693 OG1 THR A 47 -0.728 5.362 11.428 1.00 0.00 O ATOM 694 CG2 THR A 47 -3.096 5.385 11.902 1.00 0.00 C ATOM 0 H THR A 47 -0.678 6.020 9.214 1.00 0.00 H new ATOM 0 HA THR A 47 -3.132 7.289 10.234 1.00 0.00 H new ATOM 0 HB THR A 47 -1.678 6.880 12.461 1.00 0.00 H new ATOM 0 HG1 THR A 47 0.008 5.871 11.029 1.00 0.00 H new ATOM 0 HG21 THR A 47 -2.925 4.778 12.791 1.00 0.00 H new ATOM 0 HG22 THR A 47 -3.948 6.043 12.071 1.00 0.00 H new ATOM 0 HG23 THR A 47 -3.303 4.734 11.052 1.00 0.00 H new ATOM 702 N ASN A 48 -2.068 9.447 10.941 1.00 0.00 N ATOM 703 CA ASN A 48 -1.484 10.766 11.156 1.00 0.00 C ATOM 704 C ASN A 48 -1.713 11.236 12.589 1.00 0.00 C ATOM 705 O ASN A 48 -2.825 11.154 13.111 1.00 0.00 O ATOM 706 CB ASN A 48 -2.081 11.776 10.174 1.00 0.00 C ATOM 707 CG ASN A 48 -1.406 13.132 10.258 1.00 0.00 C ATOM 708 OD1 ASN A 48 -0.204 13.225 10.508 1.00 0.00 O ATOM 709 ND2 ASN A 48 -2.179 14.191 10.050 1.00 0.00 N ATOM 0 H ASN A 48 -3.071 9.396 11.120 1.00 0.00 H new ATOM 0 HA ASN A 48 -0.410 10.693 10.985 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -1.989 11.390 9.159 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -3.146 11.890 10.377 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -1.781 15.129 10.094 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -3.171 14.066 9.846 1.00 0.00 H new ATOM 716 N PHE A 49 -0.652 11.729 13.220 1.00 0.00 N ATOM 717 CA PHE A 49 -0.737 12.212 14.594 1.00 0.00 C ATOM 718 C PHE A 49 -0.200 13.636 14.703 1.00 0.00 C ATOM 719 O PHE A 49 -0.638 14.412 15.552 1.00 0.00 O ATOM 720 CB PHE A 49 0.044 11.287 15.531 1.00 0.00 C ATOM 721 CG PHE A 49 -0.459 9.872 15.531 1.00 0.00 C ATOM 722 CD1 PHE A 49 -1.673 9.554 16.118 1.00 0.00 C ATOM 723 CD2 PHE A 49 0.283 8.859 14.945 1.00 0.00 C ATOM 724 CE1 PHE A 49 -2.137 8.252 16.120 1.00 0.00 C ATOM 725 CE2 PHE A 49 -0.176 7.555 14.944 1.00 0.00 C ATOM 726 CZ PHE A 49 -1.388 7.252 15.532 1.00 0.00 C ATOM 0 H PHE A 49 0.276 11.805 12.803 1.00 0.00 H new ATOM 0 HA PHE A 49 -1.786 12.214 14.889 1.00 0.00 H new ATOM 0 HB2 PHE A 49 1.094 11.291 15.240 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -0.007 11.683 16.545 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -2.263 10.332 16.579 1.00 0.00 H new ATOM 0 HD2 PHE A 49 1.231 9.091 14.483 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.085 8.017 16.581 1.00 0.00 H new ATOM 0 HE2 PHE A 49 0.412 6.775 14.484 1.00 0.00 H new ATOM 0 HZ PHE A 49 -1.750 6.234 15.532 1.00 0.00 H new ATOM 736 N SER A 50 0.751 13.972 13.838 1.00 0.00 N ATOM 737 CA SER A 50 1.351 15.301 13.839 1.00 0.00 C ATOM 738 C SER A 50 0.276 16.383 13.826 1.00 0.00 C ATOM 739 O SER A 50 -0.879 16.120 13.491 1.00 0.00 O ATOM 740 CB SER A 50 2.274 15.468 12.631 1.00 0.00 C ATOM 741 OG SER A 50 1.623 15.076 11.434 1.00 0.00 O ATOM 0 H SER A 50 1.123 13.342 13.127 1.00 0.00 H new ATOM 0 HA SER A 50 1.937 15.407 14.752 1.00 0.00 H new ATOM 0 HB2 SER A 50 2.591 16.508 12.553 1.00 0.00 H new ATOM 0 HB3 SER A 50 3.174 14.870 12.772 1.00 0.00 H new ATOM 0 HG SER A 50 0.958 14.385 11.635 1.00 0.00 H new ATOM 747 N GLU A 51 0.665 17.600 14.194 1.00 0.00 N ATOM 748 CA GLU A 51 -0.266 18.721 14.225 1.00 0.00 C ATOM 749 C GLU A 51 -0.447 19.318 12.832 1.00 0.00 C ATOM 750 O GLU A 51 -0.473 20.536 12.665 1.00 0.00 O ATOM 751 CB GLU A 51 0.230 19.798 15.192 1.00 0.00 C ATOM 752 CG GLU A 51 1.646 20.270 14.904 1.00 0.00 C ATOM 753 CD GLU A 51 2.085 21.394 15.822 1.00 0.00 C ATOM 754 OE1 GLU A 51 2.413 21.111 16.993 1.00 0.00 O ATOM 755 OE2 GLU A 51 2.100 22.558 15.368 1.00 0.00 O ATOM 0 H GLU A 51 1.617 17.834 14.474 1.00 0.00 H new ATOM 0 HA GLU A 51 -1.231 18.349 14.570 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -0.445 20.653 15.148 1.00 0.00 H new ATOM 0 HB3 GLU A 51 0.186 19.409 16.209 1.00 0.00 H new ATOM 0 HG2 GLU A 51 2.333 19.431 15.010 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.709 20.606 13.869 1.00 0.00 H new ATOM 762 N GLY A 52 -0.571 18.448 11.834 1.00 0.00 N ATOM 763 CA GLY A 52 -0.747 18.907 10.468 1.00 0.00 C ATOM 764 C GLY A 52 -1.697 18.028 9.680 1.00 0.00 C ATOM 765 O GLY A 52 -1.338 16.923 9.272 1.00 0.00 O ATOM 0 H GLY A 52 -0.553 17.434 11.947 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -1.126 19.929 10.477 1.00 0.00 H new ATOM 0 HA3 GLY A 52 0.221 18.930 9.968 1.00 0.00 H new ATOM 769 N ASP A 53 -2.913 18.518 9.465 1.00 0.00 N ATOM 770 CA ASP A 53 -3.919 17.769 8.720 1.00 0.00 C ATOM 771 C ASP A 53 -3.400 17.390 7.337 1.00 0.00 C ATOM 772 O ASP A 53 -2.871 18.231 6.609 1.00 0.00 O ATOM 773 CB ASP A 53 -5.203 18.588 8.590 1.00 0.00 C ATOM 774 CG ASP A 53 -4.938 20.081 8.569 1.00 0.00 C ATOM 775 OD1 ASP A 53 -4.548 20.629 9.621 1.00 0.00 O ATOM 776 OD2 ASP A 53 -5.121 20.701 7.500 1.00 0.00 O ATOM 0 H ASP A 53 -3.226 19.431 9.796 1.00 0.00 H new ATOM 0 HA ASP A 53 -4.136 16.853 9.270 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.722 18.301 7.676 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -5.867 18.351 9.421 1.00 0.00 H new ATOM 781 N VAL A 54 -3.554 16.119 6.980 1.00 0.00 N ATOM 782 CA VAL A 54 -3.101 15.628 5.684 1.00 0.00 C ATOM 783 C VAL A 54 -4.280 15.359 4.756 1.00 0.00 C ATOM 784 O VAL A 54 -5.003 14.375 4.921 1.00 0.00 O ATOM 785 CB VAL A 54 -2.272 14.339 5.830 1.00 0.00 C ATOM 786 CG1 VAL A 54 -2.164 13.618 4.494 1.00 0.00 C ATOM 787 CG2 VAL A 54 -0.892 14.654 6.387 1.00 0.00 C ATOM 0 H VAL A 54 -3.989 15.410 7.570 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.473 16.407 5.252 1.00 0.00 H new ATOM 0 HB VAL A 54 -2.781 13.678 6.532 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.575 12.709 4.617 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.161 13.358 4.139 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.679 14.269 3.767 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.319 13.732 6.484 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -0.373 15.334 5.711 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -0.993 15.123 7.366 1.00 0.00 H new ATOM 797 N THR A 55 -4.470 16.239 3.778 1.00 0.00 N ATOM 798 CA THR A 55 -5.562 16.097 2.823 1.00 0.00 C ATOM 799 C THR A 55 -5.032 15.864 1.413 1.00 0.00 C ATOM 800 O THR A 55 -3.825 15.918 1.175 1.00 0.00 O ATOM 801 CB THR A 55 -6.470 17.341 2.819 1.00 0.00 C ATOM 802 OG1 THR A 55 -5.733 18.484 2.372 1.00 0.00 O ATOM 803 CG2 THR A 55 -7.033 17.605 4.207 1.00 0.00 C ATOM 0 H THR A 55 -3.881 17.058 3.626 1.00 0.00 H new ATOM 0 HA THR A 55 -6.146 15.231 3.136 1.00 0.00 H new ATOM 0 HB THR A 55 -7.300 17.155 2.137 1.00 0.00 H new ATOM 0 HG1 THR A 55 -6.318 19.270 2.371 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.671 18.488 4.179 1.00 0.00 H new ATOM 0 HG22 THR A 55 -7.618 16.745 4.532 1.00 0.00 H new ATOM 0 HG23 THR A 55 -6.214 17.771 4.906 1.00 0.00 H new ATOM 811 N HIS A 56 -5.942 15.604 0.479 1.00 0.00 N ATOM 812 CA HIS A 56 -5.566 15.363 -0.910 1.00 0.00 C ATOM 813 C HIS A 56 -4.439 14.339 -0.997 1.00 0.00 C ATOM 814 O HIS A 56 -3.553 14.447 -1.846 1.00 0.00 O ATOM 815 CB HIS A 56 -5.137 16.670 -1.577 1.00 0.00 C ATOM 816 CG HIS A 56 -6.286 17.514 -2.035 1.00 0.00 C ATOM 817 ND1 HIS A 56 -6.424 18.844 -1.699 1.00 0.00 N ATOM 818 CD2 HIS A 56 -7.354 17.211 -2.810 1.00 0.00 C ATOM 819 CE1 HIS A 56 -7.528 19.322 -2.245 1.00 0.00 C ATOM 820 NE2 HIS A 56 -8.110 18.351 -2.925 1.00 0.00 N ATOM 0 H HIS A 56 -6.945 15.555 0.659 1.00 0.00 H new ATOM 0 HA HIS A 56 -6.435 14.965 -1.433 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -4.532 17.245 -0.876 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -4.502 16.440 -2.433 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -7.571 16.251 -3.255 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -7.892 20.334 -2.151 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -8.980 18.435 -3.450 1.00 0.00 H new ATOM 828 N PHE A 57 -4.477 13.347 -0.114 1.00 0.00 N ATOM 829 CA PHE A 57 -3.458 12.304 -0.091 1.00 0.00 C ATOM 830 C PHE A 57 -3.630 11.349 -1.268 1.00 0.00 C ATOM 831 O PHE A 57 -4.743 10.919 -1.574 1.00 0.00 O ATOM 832 CB PHE A 57 -3.523 11.527 1.225 1.00 0.00 C ATOM 833 CG PHE A 57 -2.947 10.143 1.134 1.00 0.00 C ATOM 834 CD1 PHE A 57 -1.586 9.955 0.954 1.00 0.00 C ATOM 835 CD2 PHE A 57 -3.766 9.030 1.226 1.00 0.00 C ATOM 836 CE1 PHE A 57 -1.052 8.683 0.869 1.00 0.00 C ATOM 837 CE2 PHE A 57 -3.239 7.755 1.143 1.00 0.00 C ATOM 838 CZ PHE A 57 -1.880 7.582 0.963 1.00 0.00 C ATOM 0 H PHE A 57 -5.203 13.243 0.595 1.00 0.00 H new ATOM 0 HA PHE A 57 -2.482 12.783 -0.174 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -2.988 12.085 1.994 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -4.562 11.459 1.546 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -0.934 10.813 0.879 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -4.829 9.160 1.364 1.00 0.00 H new ATOM 0 HE1 PHE A 57 0.011 8.550 0.729 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -3.888 6.895 1.219 1.00 0.00 H new ATOM 0 HZ PHE A 57 -1.466 6.587 0.896 1.00 0.00 H new ATOM 848 N ILE A 58 -2.522 11.021 -1.923 1.00 0.00 N ATOM 849 CA ILE A 58 -2.550 10.116 -3.066 1.00 0.00 C ATOM 850 C ILE A 58 -1.683 8.887 -2.815 1.00 0.00 C ATOM 851 O ILE A 58 -0.557 8.997 -2.329 1.00 0.00 O ATOM 852 CB ILE A 58 -2.069 10.816 -4.350 1.00 0.00 C ATOM 853 CG1 ILE A 58 -2.968 12.011 -4.674 1.00 0.00 C ATOM 854 CG2 ILE A 58 -2.045 9.834 -5.512 1.00 0.00 C ATOM 855 CD1 ILE A 58 -4.289 11.620 -5.300 1.00 0.00 C ATOM 0 H ILE A 58 -1.594 11.368 -1.682 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.587 9.806 -3.198 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.055 11.182 -4.188 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -3.160 12.570 -3.758 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -2.438 12.681 -5.351 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.703 10.344 -6.412 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -1.367 9.013 -5.280 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -3.048 9.441 -5.677 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -4.875 12.516 -5.503 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -4.106 11.087 -6.233 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -4.839 10.974 -4.615 1.00 0.00 H new ATOM 867 N CYS A 59 -2.215 7.717 -3.152 1.00 0.00 N ATOM 868 CA CYS A 59 -1.489 6.466 -2.964 1.00 0.00 C ATOM 869 C CYS A 59 -1.396 5.689 -4.274 1.00 0.00 C ATOM 870 O CYS A 59 -2.405 5.224 -4.803 1.00 0.00 O ATOM 871 CB CYS A 59 -2.174 5.610 -1.897 1.00 0.00 C ATOM 872 SG CYS A 59 -1.056 4.498 -1.013 1.00 0.00 S ATOM 0 H CYS A 59 -3.145 7.609 -3.556 1.00 0.00 H new ATOM 0 HA CYS A 59 -0.479 6.707 -2.633 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -2.660 6.267 -1.176 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -2.959 5.019 -2.369 1.00 0.00 H new ATOM 0 HG CYS A 59 -1.519 4.277 0.182 1.00 0.00 H new ATOM 878 N GLN A 60 -0.179 5.556 -4.791 1.00 0.00 N ATOM 879 CA GLN A 60 0.044 4.838 -6.041 1.00 0.00 C ATOM 880 C GLN A 60 1.086 3.739 -5.858 1.00 0.00 C ATOM 881 O GLN A 60 1.895 3.785 -4.932 1.00 0.00 O ATOM 882 CB GLN A 60 0.493 5.806 -7.136 1.00 0.00 C ATOM 883 CG GLN A 60 -0.601 6.757 -7.594 1.00 0.00 C ATOM 884 CD GLN A 60 -0.112 7.755 -8.625 1.00 0.00 C ATOM 885 OE1 GLN A 60 0.231 7.387 -9.749 1.00 0.00 O ATOM 886 NE2 GLN A 60 -0.079 9.028 -8.247 1.00 0.00 N ATOM 0 H GLN A 60 0.667 5.935 -4.365 1.00 0.00 H new ATOM 0 HA GLN A 60 -0.897 4.376 -6.339 1.00 0.00 H new ATOM 0 HB2 GLN A 60 1.339 6.388 -6.770 1.00 0.00 H new ATOM 0 HB3 GLN A 60 0.847 5.233 -7.993 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -1.426 6.181 -8.014 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -0.994 7.295 -6.731 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -0.373 9.288 -7.305 1.00 0.00 H new ATOM 0 HE22 GLN A 60 0.240 9.745 -8.898 1.00 0.00 H new ATOM 895 N ALA A 61 1.059 2.752 -6.748 1.00 0.00 N ATOM 896 CA ALA A 61 2.002 1.642 -6.686 1.00 0.00 C ATOM 897 C ALA A 61 2.219 1.028 -8.065 1.00 0.00 C ATOM 898 O ALA A 61 1.400 1.199 -8.967 1.00 0.00 O ATOM 899 CB ALA A 61 1.510 0.586 -5.707 1.00 0.00 C ATOM 0 H ALA A 61 0.395 2.699 -7.520 1.00 0.00 H new ATOM 0 HA ALA A 61 2.959 2.029 -6.335 1.00 0.00 H new ATOM 0 HB1 ALA A 61 2.224 -0.237 -5.671 1.00 0.00 H new ATOM 0 HB2 ALA A 61 1.413 1.027 -4.715 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.540 0.211 -6.033 1.00 0.00 H new ATOM 905 N ALA A 62 3.328 0.312 -8.221 1.00 0.00 N ATOM 906 CA ALA A 62 3.651 -0.328 -9.490 1.00 0.00 C ATOM 907 C ALA A 62 4.166 -1.747 -9.273 1.00 0.00 C ATOM 908 O ALA A 62 4.960 -1.998 -8.366 1.00 0.00 O ATOM 909 CB ALA A 62 4.678 0.498 -10.251 1.00 0.00 C ATOM 0 H ALA A 62 4.017 0.161 -7.485 1.00 0.00 H new ATOM 0 HA ALA A 62 2.738 -0.387 -10.082 1.00 0.00 H new ATOM 0 HB1 ALA A 62 4.910 0.008 -11.197 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.274 1.491 -10.446 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.587 0.587 -9.656 1.00 0.00 H new ATOM 915 N VAL A 63 3.709 -2.672 -10.111 1.00 0.00 N ATOM 916 CA VAL A 63 4.124 -4.066 -10.011 1.00 0.00 C ATOM 917 C VAL A 63 4.702 -4.563 -11.331 1.00 0.00 C ATOM 918 O VAL A 63 4.334 -4.102 -12.412 1.00 0.00 O ATOM 919 CB VAL A 63 2.948 -4.974 -9.604 1.00 0.00 C ATOM 920 CG1 VAL A 63 2.205 -4.384 -8.415 1.00 0.00 C ATOM 921 CG2 VAL A 63 2.007 -5.185 -10.780 1.00 0.00 C ATOM 0 H VAL A 63 3.051 -2.481 -10.867 1.00 0.00 H new ATOM 0 HA VAL A 63 4.893 -4.113 -9.240 1.00 0.00 H new ATOM 0 HB VAL A 63 3.346 -5.945 -9.308 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.378 -5.039 -8.142 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.887 -4.289 -7.570 1.00 0.00 H new ATOM 0 HG13 VAL A 63 1.817 -3.401 -8.680 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.182 -5.829 -10.475 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.614 -4.223 -11.109 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.550 -5.655 -11.600 1.00 0.00 H new ATOM 931 N PRO A 64 5.630 -5.528 -11.245 1.00 0.00 N ATOM 932 CA PRO A 64 6.279 -6.110 -12.423 1.00 0.00 C ATOM 933 C PRO A 64 5.324 -6.967 -13.247 1.00 0.00 C ATOM 934 O PRO A 64 4.404 -7.583 -12.708 1.00 0.00 O ATOM 935 CB PRO A 64 7.392 -6.975 -11.825 1.00 0.00 C ATOM 936 CG PRO A 64 6.914 -7.312 -10.455 1.00 0.00 C ATOM 937 CD PRO A 64 6.117 -6.125 -9.990 1.00 0.00 C ATOM 0 HA PRO A 64 6.638 -5.344 -13.110 1.00 0.00 H new ATOM 0 HB2 PRO A 64 7.557 -7.874 -12.419 1.00 0.00 H new ATOM 0 HB3 PRO A 64 8.339 -6.436 -11.793 1.00 0.00 H new ATOM 0 HG2 PRO A 64 6.301 -8.213 -10.466 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.752 -7.505 -9.786 1.00 0.00 H new ATOM 0 HD2 PRO A 64 5.294 -6.423 -9.341 1.00 0.00 H new ATOM 0 HD3 PRO A 64 6.732 -5.425 -9.424 1.00 0.00 H new ATOM 945 N LYS A 65 5.547 -7.003 -14.556 1.00 0.00 N ATOM 946 CA LYS A 65 4.708 -7.786 -15.455 1.00 0.00 C ATOM 947 C LYS A 65 4.369 -9.141 -14.842 1.00 0.00 C ATOM 948 O LYS A 65 3.238 -9.614 -14.945 1.00 0.00 O ATOM 949 CB LYS A 65 5.411 -7.984 -16.799 1.00 0.00 C ATOM 950 CG LYS A 65 5.523 -6.711 -17.621 1.00 0.00 C ATOM 951 CD LYS A 65 6.682 -6.781 -18.602 1.00 0.00 C ATOM 952 CE LYS A 65 6.267 -7.439 -19.909 1.00 0.00 C ATOM 953 NZ LYS A 65 6.243 -8.924 -19.800 1.00 0.00 N ATOM 0 H LYS A 65 6.303 -6.498 -15.019 1.00 0.00 H new ATOM 0 HA LYS A 65 3.780 -7.237 -15.615 1.00 0.00 H new ATOM 0 HB2 LYS A 65 6.411 -8.381 -16.622 1.00 0.00 H new ATOM 0 HB3 LYS A 65 4.869 -8.733 -17.376 1.00 0.00 H new ATOM 0 HG2 LYS A 65 4.593 -6.546 -18.166 1.00 0.00 H new ATOM 0 HG3 LYS A 65 5.659 -5.858 -16.956 1.00 0.00 H new ATOM 0 HD2 LYS A 65 7.053 -5.775 -18.801 1.00 0.00 H new ATOM 0 HD3 LYS A 65 7.504 -7.341 -18.156 1.00 0.00 H new ATOM 0 HE2 LYS A 65 5.279 -7.080 -20.198 1.00 0.00 H new ATOM 0 HE3 LYS A 65 6.957 -7.144 -20.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 6.413 -9.344 -20.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 6.985 -9.236 -19.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 5.315 -9.231 -19.446 1.00 0.00 H new ATOM 967 N SER A 66 5.357 -9.759 -14.202 1.00 0.00 N ATOM 968 CA SER A 66 5.164 -11.061 -13.574 1.00 0.00 C ATOM 969 C SER A 66 3.890 -11.076 -12.735 1.00 0.00 C ATOM 970 O SER A 66 3.129 -12.044 -12.757 1.00 0.00 O ATOM 971 CB SER A 66 6.369 -11.412 -12.699 1.00 0.00 C ATOM 972 OG SER A 66 6.269 -12.735 -12.201 1.00 0.00 O ATOM 0 H SER A 66 6.299 -9.379 -14.105 1.00 0.00 H new ATOM 0 HA SER A 66 5.067 -11.807 -14.363 1.00 0.00 H new ATOM 0 HB2 SER A 66 7.286 -11.306 -13.278 1.00 0.00 H new ATOM 0 HB3 SER A 66 6.435 -10.711 -11.867 1.00 0.00 H new ATOM 0 HG SER A 66 7.106 -13.214 -12.374 1.00 0.00 H new ATOM 978 N LEU A 67 3.664 -9.995 -11.996 1.00 0.00 N ATOM 979 CA LEU A 67 2.482 -9.882 -11.148 1.00 0.00 C ATOM 980 C LEU A 67 1.558 -8.776 -11.647 1.00 0.00 C ATOM 981 O LEU A 67 1.995 -7.852 -12.334 1.00 0.00 O ATOM 982 CB LEU A 67 2.892 -9.605 -9.701 1.00 0.00 C ATOM 983 CG LEU A 67 4.082 -10.409 -9.175 1.00 0.00 C ATOM 984 CD1 LEU A 67 4.648 -9.765 -7.919 1.00 0.00 C ATOM 985 CD2 LEU A 67 3.673 -11.849 -8.902 1.00 0.00 C ATOM 0 H LEU A 67 4.283 -9.185 -11.967 1.00 0.00 H new ATOM 0 HA LEU A 67 1.943 -10.828 -11.191 1.00 0.00 H new ATOM 0 HB2 LEU A 67 3.126 -8.544 -9.607 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.034 -9.800 -9.058 1.00 0.00 H new ATOM 0 HG LEU A 67 4.860 -10.412 -9.938 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.494 -10.351 -7.559 1.00 0.00 H new ATOM 0 HD12 LEU A 67 4.979 -8.752 -8.147 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.877 -9.730 -7.149 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.532 -12.407 -8.528 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.877 -11.866 -8.157 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.316 -12.307 -9.825 1.00 0.00 H new ATOM 997 N GLN A 68 0.280 -8.875 -11.296 1.00 0.00 N ATOM 998 CA GLN A 68 -0.705 -7.882 -11.707 1.00 0.00 C ATOM 999 C GLN A 68 -0.991 -6.899 -10.577 1.00 0.00 C ATOM 1000 O GLN A 68 -0.722 -7.183 -9.409 1.00 0.00 O ATOM 1001 CB GLN A 68 -2.001 -8.568 -12.143 1.00 0.00 C ATOM 1002 CG GLN A 68 -2.763 -7.804 -13.215 1.00 0.00 C ATOM 1003 CD GLN A 68 -4.218 -8.218 -13.302 1.00 0.00 C ATOM 1004 OE1 GLN A 68 -4.556 -9.210 -13.950 1.00 0.00 O ATOM 1005 NE2 GLN A 68 -5.090 -7.459 -12.649 1.00 0.00 N ATOM 0 H GLN A 68 -0.098 -9.633 -10.728 1.00 0.00 H new ATOM 0 HA GLN A 68 -0.294 -7.328 -12.551 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -1.767 -9.565 -12.516 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -2.645 -8.696 -11.273 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -2.705 -6.736 -13.006 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -2.285 -7.966 -14.181 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -4.766 -6.646 -12.125 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -6.084 -7.689 -12.672 1.00 0.00 H new ATOM 1014 N LEU A 69 -1.538 -5.741 -10.931 1.00 0.00 N ATOM 1015 CA LEU A 69 -1.860 -4.714 -9.947 1.00 0.00 C ATOM 1016 C LEU A 69 -3.212 -4.075 -10.249 1.00 0.00 C ATOM 1017 O LEU A 69 -3.542 -3.818 -11.406 1.00 0.00 O ATOM 1018 CB LEU A 69 -0.770 -3.641 -9.923 1.00 0.00 C ATOM 1019 CG LEU A 69 -0.982 -2.491 -8.939 1.00 0.00 C ATOM 1020 CD1 LEU A 69 -0.835 -2.980 -7.506 1.00 0.00 C ATOM 1021 CD2 LEU A 69 -0.004 -1.360 -9.221 1.00 0.00 C ATOM 0 H LEU A 69 -1.768 -5.490 -11.893 1.00 0.00 H new ATOM 0 HA LEU A 69 -1.914 -5.189 -8.968 1.00 0.00 H new ATOM 0 HB2 LEU A 69 0.180 -4.122 -9.690 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -0.678 -3.223 -10.925 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.995 -2.110 -9.069 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.989 -2.147 -6.820 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.575 -3.755 -7.308 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.165 -3.388 -7.362 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.170 -0.550 -8.511 1.00 0.00 H new ATOM 0 HD22 LEU A 69 1.017 -1.728 -9.120 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.158 -0.990 -10.235 1.00 0.00 H new ATOM 1033 N GLN A 70 -3.988 -3.821 -9.201 1.00 0.00 N ATOM 1034 CA GLN A 70 -5.304 -3.210 -9.355 1.00 0.00 C ATOM 1035 C GLN A 70 -5.534 -2.138 -8.295 1.00 0.00 C ATOM 1036 O GLN A 70 -5.349 -2.380 -7.102 1.00 0.00 O ATOM 1037 CB GLN A 70 -6.397 -4.276 -9.265 1.00 0.00 C ATOM 1038 CG GLN A 70 -6.660 -4.991 -10.580 1.00 0.00 C ATOM 1039 CD GLN A 70 -8.073 -5.532 -10.679 1.00 0.00 C ATOM 1040 OE1 GLN A 70 -8.998 -4.818 -11.065 1.00 0.00 O ATOM 1041 NE2 GLN A 70 -8.246 -6.802 -10.329 1.00 0.00 N ATOM 0 H GLN A 70 -3.729 -4.028 -8.236 1.00 0.00 H new ATOM 0 HA GLN A 70 -5.346 -2.738 -10.337 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -6.114 -5.011 -8.512 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -7.321 -3.809 -8.924 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -6.480 -4.302 -11.406 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -5.952 -5.813 -10.690 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -7.450 -7.357 -10.015 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -9.175 -7.222 -10.375 1.00 0.00 H new ATOM 1050 N LEU A 71 -5.937 -0.952 -8.739 1.00 0.00 N ATOM 1051 CA LEU A 71 -6.192 0.158 -7.828 1.00 0.00 C ATOM 1052 C LEU A 71 -7.681 0.280 -7.521 1.00 0.00 C ATOM 1053 O LEU A 71 -8.483 0.585 -8.403 1.00 0.00 O ATOM 1054 CB LEU A 71 -5.676 1.466 -8.431 1.00 0.00 C ATOM 1055 CG LEU A 71 -5.285 2.557 -7.433 1.00 0.00 C ATOM 1056 CD1 LEU A 71 -4.206 3.454 -8.018 1.00 0.00 C ATOM 1057 CD2 LEU A 71 -6.504 3.377 -7.034 1.00 0.00 C ATOM 0 H LEU A 71 -6.094 -0.735 -9.723 1.00 0.00 H new ATOM 0 HA LEU A 71 -5.663 -0.040 -6.896 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.808 1.240 -9.050 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -6.444 1.866 -9.093 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.885 2.078 -6.539 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -3.941 4.224 -7.294 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -3.324 2.857 -8.252 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -4.578 3.925 -8.928 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.207 4.148 -6.324 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.933 3.845 -7.920 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.246 2.725 -6.573 1.00 0.00 H new ATOM 1069 N GLN A 72 -8.043 0.041 -6.265 1.00 0.00 N ATOM 1070 CA GLN A 72 -9.435 0.125 -5.842 1.00 0.00 C ATOM 1071 C GLN A 72 -9.754 1.510 -5.289 1.00 0.00 C ATOM 1072 O GLN A 72 -8.884 2.185 -4.739 1.00 0.00 O ATOM 1073 CB GLN A 72 -9.735 -0.940 -4.785 1.00 0.00 C ATOM 1074 CG GLN A 72 -11.201 -1.334 -4.716 1.00 0.00 C ATOM 1075 CD GLN A 72 -11.622 -1.779 -3.330 1.00 0.00 C ATOM 1076 OE1 GLN A 72 -12.134 -2.884 -3.148 1.00 0.00 O ATOM 1077 NE2 GLN A 72 -11.407 -0.919 -2.341 1.00 0.00 N ATOM 0 H GLN A 72 -7.391 -0.212 -5.523 1.00 0.00 H new ATOM 0 HA GLN A 72 -10.064 -0.052 -6.715 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -9.139 -1.828 -4.996 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -9.421 -0.570 -3.809 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -11.815 -0.488 -5.024 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -11.390 -2.140 -5.425 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -10.980 -0.014 -2.536 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -11.669 -1.164 -1.386 1.00 0.00 H new ATOM 1086 N ALA A 73 -11.006 1.929 -5.441 1.00 0.00 N ATOM 1087 CA ALA A 73 -11.440 3.233 -4.956 1.00 0.00 C ATOM 1088 C ALA A 73 -11.098 3.412 -3.480 1.00 0.00 C ATOM 1089 O ALA A 73 -11.405 2.566 -2.640 1.00 0.00 O ATOM 1090 CB ALA A 73 -12.935 3.409 -5.178 1.00 0.00 C ATOM 0 H ALA A 73 -11.738 1.384 -5.897 1.00 0.00 H new ATOM 0 HA ALA A 73 -10.908 3.998 -5.521 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.245 4.387 -4.811 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.156 3.334 -6.243 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.477 2.631 -4.640 1.00 0.00 H new ATOM 1096 N PRO A 74 -10.446 4.538 -3.155 1.00 0.00 N ATOM 1097 CA PRO A 74 -10.048 4.853 -1.780 1.00 0.00 C ATOM 1098 C PRO A 74 -11.244 5.172 -0.889 1.00 0.00 C ATOM 1099 O PRO A 74 -12.392 5.114 -1.330 1.00 0.00 O ATOM 1100 CB PRO A 74 -9.158 6.088 -1.942 1.00 0.00 C ATOM 1101 CG PRO A 74 -9.615 6.720 -3.211 1.00 0.00 C ATOM 1102 CD PRO A 74 -10.047 5.590 -4.105 1.00 0.00 C ATOM 0 HA PRO A 74 -9.550 4.012 -1.297 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -9.269 6.769 -1.098 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -8.105 5.813 -1.994 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -10.439 7.410 -3.029 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -8.812 7.296 -3.671 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -10.874 5.883 -4.751 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -9.237 5.259 -4.754 1.00 0.00 H new ATOM 1110 N SER A 75 -10.967 5.510 0.366 1.00 0.00 N ATOM 1111 CA SER A 75 -12.021 5.835 1.320 1.00 0.00 C ATOM 1112 C SER A 75 -12.214 7.345 1.424 1.00 0.00 C ATOM 1113 O SER A 75 -13.338 7.833 1.532 1.00 0.00 O ATOM 1114 CB SER A 75 -11.688 5.257 2.697 1.00 0.00 C ATOM 1115 OG SER A 75 -11.608 3.842 2.650 1.00 0.00 O ATOM 0 H SER A 75 -10.022 5.566 0.746 1.00 0.00 H new ATOM 0 HA SER A 75 -12.950 5.391 0.962 1.00 0.00 H new ATOM 0 HB2 SER A 75 -10.741 5.667 3.048 1.00 0.00 H new ATOM 0 HB3 SER A 75 -12.451 5.558 3.415 1.00 0.00 H new ATOM 0 HG SER A 75 -11.392 3.497 3.541 1.00 0.00 H new ATOM 1121 N GLY A 76 -11.106 8.080 1.389 1.00 0.00 N ATOM 1122 CA GLY A 76 -11.173 9.527 1.480 1.00 0.00 C ATOM 1123 C GLY A 76 -9.803 10.174 1.447 1.00 0.00 C ATOM 1124 O GLY A 76 -8.879 9.722 2.122 1.00 0.00 O ATOM 0 H GLY A 76 -10.164 7.699 1.299 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -11.773 9.912 0.656 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.681 9.807 2.403 1.00 0.00 H new ATOM 1128 N ASN A 77 -9.671 11.235 0.657 1.00 0.00 N ATOM 1129 CA ASN A 77 -8.402 11.944 0.536 1.00 0.00 C ATOM 1130 C ASN A 77 -8.242 12.968 1.656 1.00 0.00 C ATOM 1131 O ASN A 77 -7.817 14.100 1.422 1.00 0.00 O ATOM 1132 CB ASN A 77 -8.310 12.640 -0.823 1.00 0.00 C ATOM 1133 CG ASN A 77 -8.299 11.656 -1.977 1.00 0.00 C ATOM 1134 OD1 ASN A 77 -8.667 10.491 -1.818 1.00 0.00 O ATOM 1135 ND2 ASN A 77 -7.876 12.120 -3.147 1.00 0.00 N ATOM 0 H ASN A 77 -10.426 11.622 0.092 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.597 11.213 0.618 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -9.154 13.321 -0.937 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -7.405 13.246 -0.857 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -7.847 11.504 -3.959 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -7.580 13.092 -3.233 1.00 0.00 H new ATOM 1142 N THR A 78 -8.586 12.563 2.875 1.00 0.00 N ATOM 1143 CA THR A 78 -8.482 13.444 4.031 1.00 0.00 C ATOM 1144 C THR A 78 -8.180 12.654 5.299 1.00 0.00 C ATOM 1145 O THR A 78 -8.870 11.686 5.618 1.00 0.00 O ATOM 1146 CB THR A 78 -9.776 14.253 4.239 1.00 0.00 C ATOM 1147 OG1 THR A 78 -10.053 15.043 3.077 1.00 0.00 O ATOM 1148 CG2 THR A 78 -9.659 15.157 5.457 1.00 0.00 C ATOM 0 H THR A 78 -8.939 11.630 3.087 1.00 0.00 H new ATOM 0 HA THR A 78 -7.661 14.132 3.831 1.00 0.00 H new ATOM 0 HB THR A 78 -10.594 13.552 4.404 1.00 0.00 H new ATOM 0 HG1 THR A 78 -10.878 15.553 3.217 1.00 0.00 H new ATOM 0 HG21 THR A 78 -10.585 15.718 5.584 1.00 0.00 H new ATOM 0 HG22 THR A 78 -9.478 14.550 6.344 1.00 0.00 H new ATOM 0 HG23 THR A 78 -8.830 15.851 5.317 1.00 0.00 H new ATOM 1156 N VAL A 79 -7.145 13.073 6.020 1.00 0.00 N ATOM 1157 CA VAL A 79 -6.753 12.405 7.255 1.00 0.00 C ATOM 1158 C VAL A 79 -6.673 13.394 8.413 1.00 0.00 C ATOM 1159 O VAL A 79 -6.015 14.431 8.332 1.00 0.00 O ATOM 1160 CB VAL A 79 -5.393 11.699 7.104 1.00 0.00 C ATOM 1161 CG1 VAL A 79 -4.958 11.087 8.427 1.00 0.00 C ATOM 1162 CG2 VAL A 79 -5.462 10.639 6.015 1.00 0.00 C ATOM 0 H VAL A 79 -6.563 13.872 5.770 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.519 11.660 7.469 1.00 0.00 H new ATOM 0 HB VAL A 79 -4.649 12.440 6.812 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -3.995 10.593 8.300 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -4.867 11.871 9.178 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -5.700 10.358 8.752 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -4.492 10.150 5.921 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.218 9.899 6.275 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.725 11.108 5.067 1.00 0.00 H new ATOM 1172 N PRO A 80 -7.359 13.067 9.518 1.00 0.00 N ATOM 1173 CA PRO A 80 -7.381 13.913 10.715 1.00 0.00 C ATOM 1174 C PRO A 80 -6.038 13.932 11.436 1.00 0.00 C ATOM 1175 O PRO A 80 -5.348 12.916 11.511 1.00 0.00 O ATOM 1176 CB PRO A 80 -8.450 13.257 11.593 1.00 0.00 C ATOM 1177 CG PRO A 80 -8.479 11.833 11.155 1.00 0.00 C ATOM 1178 CD PRO A 80 -8.165 11.846 9.685 1.00 0.00 C ATOM 0 HA PRO A 80 -7.589 14.955 10.474 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -8.200 13.341 12.651 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -9.421 13.733 11.457 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -7.748 11.241 11.705 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -9.456 11.387 11.342 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -7.612 10.956 9.384 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -9.072 11.877 9.081 1.00 0.00 H new ATOM 1186 N ALA A 81 -5.672 15.095 11.966 1.00 0.00 N ATOM 1187 CA ALA A 81 -4.412 15.246 12.683 1.00 0.00 C ATOM 1188 C ALA A 81 -4.573 14.888 14.156 1.00 0.00 C ATOM 1189 O ALA A 81 -3.672 15.117 14.963 1.00 0.00 O ATOM 1190 CB ALA A 81 -3.888 16.666 12.537 1.00 0.00 C ATOM 0 H ALA A 81 -6.231 15.947 11.912 1.00 0.00 H new ATOM 0 HA ALA A 81 -3.689 14.558 12.246 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.947 16.764 13.078 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.725 16.887 11.482 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.616 17.366 12.946 1.00 0.00 H new ATOM 1196 N ARG A 82 -5.727 14.326 14.502 1.00 0.00 N ATOM 1197 CA ARG A 82 -6.007 13.939 15.879 1.00 0.00 C ATOM 1198 C ARG A 82 -6.238 12.435 15.985 1.00 0.00 C ATOM 1199 O ARG A 82 -7.229 11.987 16.560 1.00 0.00 O ATOM 1200 CB ARG A 82 -7.231 14.692 16.405 1.00 0.00 C ATOM 1201 CG ARG A 82 -8.455 14.561 15.514 1.00 0.00 C ATOM 1202 CD ARG A 82 -8.505 15.665 14.469 1.00 0.00 C ATOM 1203 NE ARG A 82 -9.875 15.998 14.089 1.00 0.00 N ATOM 1204 CZ ARG A 82 -10.184 16.927 13.192 1.00 0.00 C ATOM 1205 NH1 ARG A 82 -9.224 17.612 12.585 1.00 0.00 N ATOM 1206 NH2 ARG A 82 -11.455 17.172 12.899 1.00 0.00 N ATOM 0 H ARG A 82 -6.483 14.129 13.847 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.140 14.200 16.486 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -7.475 14.321 17.400 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -6.980 15.747 16.511 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -8.443 13.590 15.019 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -9.357 14.596 16.125 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -8.010 16.555 14.858 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -7.949 15.352 13.585 1.00 0.00 H new ATOM 0 HE ARG A 82 -10.637 15.489 14.537 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -8.246 17.426 12.807 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -9.464 18.325 11.896 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -12.196 16.646 13.363 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -11.691 17.886 12.210 1.00 0.00 H new ATOM 1220 N GLY A 83 -5.315 11.658 15.424 1.00 0.00 N ATOM 1221 CA GLY A 83 -5.437 10.213 15.466 1.00 0.00 C ATOM 1222 C GLY A 83 -6.871 9.747 15.310 1.00 0.00 C ATOM 1223 O GLY A 83 -7.429 9.122 16.210 1.00 0.00 O ATOM 0 H GLY A 83 -4.486 12.004 14.942 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -4.828 9.777 14.674 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -5.040 9.845 16.412 1.00 0.00 H new ATOM 1227 N GLY A 84 -7.470 10.054 14.163 1.00 0.00 N ATOM 1228 CA GLY A 84 -8.843 9.656 13.914 1.00 0.00 C ATOM 1229 C GLY A 84 -8.941 8.311 13.222 1.00 0.00 C ATOM 1230 O GLY A 84 -8.854 7.265 13.866 1.00 0.00 O ATOM 0 H GLY A 84 -7.029 10.571 13.402 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -9.383 9.615 14.860 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.332 10.413 13.301 1.00 0.00 H new ATOM 1234 N LEU A 85 -9.122 8.336 11.906 1.00 0.00 N ATOM 1235 CA LEU A 85 -9.234 7.109 11.125 1.00 0.00 C ATOM 1236 C LEU A 85 -8.351 7.172 9.884 1.00 0.00 C ATOM 1237 O LEU A 85 -8.500 8.045 9.029 1.00 0.00 O ATOM 1238 CB LEU A 85 -10.689 6.870 10.719 1.00 0.00 C ATOM 1239 CG LEU A 85 -11.691 6.724 11.865 1.00 0.00 C ATOM 1240 CD1 LEU A 85 -12.168 8.090 12.334 1.00 0.00 C ATOM 1241 CD2 LEU A 85 -12.870 5.864 11.436 1.00 0.00 C ATOM 0 H LEU A 85 -9.194 9.193 11.357 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.897 6.280 11.747 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -11.009 7.698 10.086 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -10.731 5.968 10.109 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.191 6.230 12.699 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -12.880 7.966 13.150 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -11.316 8.673 12.682 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -12.650 8.611 11.507 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -13.573 5.771 12.264 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -13.370 6.329 10.586 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -12.513 4.875 11.150 1.00 0.00 H new ATOM 1253 N PRO A 86 -7.408 6.223 9.779 1.00 0.00 N ATOM 1254 CA PRO A 86 -6.484 6.147 8.643 1.00 0.00 C ATOM 1255 C PRO A 86 -7.183 5.733 7.353 1.00 0.00 C ATOM 1256 O PRO A 86 -8.351 5.341 7.367 1.00 0.00 O ATOM 1257 CB PRO A 86 -5.479 5.076 9.075 1.00 0.00 C ATOM 1258 CG PRO A 86 -6.224 4.228 10.047 1.00 0.00 C ATOM 1259 CD PRO A 86 -7.173 5.151 10.760 1.00 0.00 C ATOM 0 HA PRO A 86 -6.030 7.113 8.422 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -5.133 4.491 8.223 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -4.597 5.523 9.534 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -6.765 3.432 9.536 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -5.542 3.750 10.750 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -8.099 4.644 11.031 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -6.740 5.538 11.682 1.00 0.00 H new ATOM 1267 N ILE A 87 -6.463 5.821 6.240 1.00 0.00 N ATOM 1268 CA ILE A 87 -7.015 5.453 4.942 1.00 0.00 C ATOM 1269 C ILE A 87 -6.610 4.035 4.555 1.00 0.00 C ATOM 1270 O ILE A 87 -5.494 3.596 4.836 1.00 0.00 O ATOM 1271 CB ILE A 87 -6.556 6.426 3.840 1.00 0.00 C ATOM 1272 CG1 ILE A 87 -6.939 7.861 4.203 1.00 0.00 C ATOM 1273 CG2 ILE A 87 -7.162 6.032 2.501 1.00 0.00 C ATOM 1274 CD1 ILE A 87 -6.237 8.906 3.364 1.00 0.00 C ATOM 0 H ILE A 87 -5.496 6.144 6.211 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.100 5.506 5.033 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.471 6.371 3.756 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.017 7.980 4.090 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.708 8.035 5.254 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -6.829 6.729 1.732 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -6.843 5.023 2.240 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.249 6.062 2.571 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.557 9.900 3.677 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.159 8.814 3.496 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -6.488 8.758 2.314 1.00 0.00 H new ATOM 1286 N THR A 88 -7.525 3.321 3.905 1.00 0.00 N ATOM 1287 CA THR A 88 -7.264 1.953 3.478 1.00 0.00 C ATOM 1288 C THR A 88 -7.520 1.785 1.984 1.00 0.00 C ATOM 1289 O THR A 88 -8.521 2.271 1.459 1.00 0.00 O ATOM 1290 CB THR A 88 -8.136 0.946 4.252 1.00 0.00 C ATOM 1291 OG1 THR A 88 -9.519 1.292 4.120 1.00 0.00 O ATOM 1292 CG2 THR A 88 -7.753 0.920 5.725 1.00 0.00 C ATOM 0 H THR A 88 -8.453 3.669 3.663 1.00 0.00 H new ATOM 0 HA THR A 88 -6.214 1.751 3.690 1.00 0.00 H new ATOM 0 HB THR A 88 -7.969 -0.045 3.831 1.00 0.00 H new ATOM 0 HG1 THR A 88 -10.066 0.646 4.613 1.00 0.00 H new ATOM 0 HG21 THR A 88 -8.382 0.202 6.252 1.00 0.00 H new ATOM 0 HG22 THR A 88 -6.707 0.628 5.824 1.00 0.00 H new ATOM 0 HG23 THR A 88 -7.895 1.911 6.155 1.00 0.00 H new ATOM 1300 N GLN A 89 -6.609 1.094 1.307 1.00 0.00 N ATOM 1301 CA GLN A 89 -6.738 0.862 -0.127 1.00 0.00 C ATOM 1302 C GLN A 89 -6.534 -0.612 -0.461 1.00 0.00 C ATOM 1303 O GLN A 89 -5.625 -1.258 0.061 1.00 0.00 O ATOM 1304 CB GLN A 89 -5.727 1.716 -0.895 1.00 0.00 C ATOM 1305 CG GLN A 89 -6.247 3.098 -1.257 1.00 0.00 C ATOM 1306 CD GLN A 89 -7.282 3.061 -2.364 1.00 0.00 C ATOM 1307 OE1 GLN A 89 -8.213 2.255 -2.333 1.00 0.00 O ATOM 1308 NE2 GLN A 89 -7.124 3.935 -3.351 1.00 0.00 N ATOM 0 H GLN A 89 -5.774 0.685 1.728 1.00 0.00 H new ATOM 0 HA GLN A 89 -7.747 1.147 -0.427 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -4.824 1.823 -0.294 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -5.442 1.194 -1.808 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -6.684 3.561 -0.372 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -5.412 3.727 -1.566 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -6.338 4.585 -3.336 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -7.789 3.957 -4.124 1.00 0.00 H new ATOM 1317 N LEU A 90 -7.387 -1.138 -1.334 1.00 0.00 N ATOM 1318 CA LEU A 90 -7.301 -2.537 -1.738 1.00 0.00 C ATOM 1319 C LEU A 90 -6.513 -2.682 -3.035 1.00 0.00 C ATOM 1320 O LEU A 90 -6.653 -1.873 -3.953 1.00 0.00 O ATOM 1321 CB LEU A 90 -8.703 -3.125 -1.911 1.00 0.00 C ATOM 1322 CG LEU A 90 -8.794 -4.412 -2.732 1.00 0.00 C ATOM 1323 CD1 LEU A 90 -8.061 -5.545 -2.032 1.00 0.00 C ATOM 1324 CD2 LEU A 90 -10.249 -4.786 -2.977 1.00 0.00 C ATOM 0 H LEU A 90 -8.145 -0.617 -1.775 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.778 -3.085 -0.954 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.119 -3.318 -0.922 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -9.336 -2.372 -2.381 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.316 -4.240 -3.696 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.137 -6.452 -2.631 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -7.011 -5.278 -1.909 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.509 -5.718 -1.053 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -10.295 -5.704 -3.563 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -10.751 -4.939 -2.022 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -10.744 -3.983 -3.522 1.00 0.00 H new ATOM 1336 N PHE A 91 -5.685 -3.720 -3.106 1.00 0.00 N ATOM 1337 CA PHE A 91 -4.875 -3.972 -4.292 1.00 0.00 C ATOM 1338 C PHE A 91 -4.860 -5.459 -4.634 1.00 0.00 C ATOM 1339 O PHE A 91 -4.311 -6.272 -3.890 1.00 0.00 O ATOM 1340 CB PHE A 91 -3.445 -3.472 -4.075 1.00 0.00 C ATOM 1341 CG PHE A 91 -3.368 -2.017 -3.712 1.00 0.00 C ATOM 1342 CD1 PHE A 91 -3.591 -1.601 -2.409 1.00 0.00 C ATOM 1343 CD2 PHE A 91 -3.071 -1.064 -4.673 1.00 0.00 C ATOM 1344 CE1 PHE A 91 -3.521 -0.263 -2.072 1.00 0.00 C ATOM 1345 CE2 PHE A 91 -2.999 0.276 -4.342 1.00 0.00 C ATOM 1346 CZ PHE A 91 -3.223 0.677 -3.040 1.00 0.00 C ATOM 0 H PHE A 91 -5.558 -4.400 -2.356 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.319 -3.430 -5.127 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -2.979 -4.061 -3.285 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -2.867 -3.643 -4.983 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -3.822 -2.332 -1.648 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -2.894 -1.372 -5.693 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.699 0.048 -1.053 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -2.768 1.009 -5.101 1.00 0.00 H new ATOM 0 HZ PHE A 91 -3.165 1.723 -2.779 1.00 0.00 H new ATOM 1356 N ARG A 92 -5.466 -5.806 -5.765 1.00 0.00 N ATOM 1357 CA ARG A 92 -5.524 -7.194 -6.205 1.00 0.00 C ATOM 1358 C ARG A 92 -4.325 -7.536 -7.085 1.00 0.00 C ATOM 1359 O ARG A 92 -4.173 -6.996 -8.181 1.00 0.00 O ATOM 1360 CB ARG A 92 -6.822 -7.455 -6.971 1.00 0.00 C ATOM 1361 CG ARG A 92 -8.020 -7.709 -6.070 1.00 0.00 C ATOM 1362 CD ARG A 92 -9.329 -7.434 -6.793 1.00 0.00 C ATOM 1363 NE ARG A 92 -9.505 -6.015 -7.087 1.00 0.00 N ATOM 1364 CZ ARG A 92 -10.671 -5.472 -7.418 1.00 0.00 C ATOM 1365 NH1 ARG A 92 -11.759 -6.226 -7.496 1.00 0.00 N ATOM 1366 NH2 ARG A 92 -10.751 -4.172 -7.671 1.00 0.00 N ATOM 0 H ARG A 92 -5.923 -5.145 -6.393 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.498 -7.830 -5.320 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.035 -6.599 -7.611 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -6.681 -8.315 -7.625 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -8.004 -8.743 -5.725 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -7.952 -7.076 -5.185 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -9.356 -8.003 -7.723 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -10.161 -7.783 -6.181 1.00 0.00 H new ATOM 0 HE ARG A 92 -8.688 -5.407 -7.035 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -11.702 -7.226 -7.302 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -12.653 -5.806 -7.750 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -9.916 -3.589 -7.611 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -11.647 -3.756 -7.925 1.00 0.00 H new ATOM 1380 N ILE A 93 -3.477 -8.435 -6.597 1.00 0.00 N ATOM 1381 CA ILE A 93 -2.292 -8.849 -7.340 1.00 0.00 C ATOM 1382 C ILE A 93 -2.366 -10.325 -7.714 1.00 0.00 C ATOM 1383 O ILE A 93 -2.935 -11.135 -6.982 1.00 0.00 O ATOM 1384 CB ILE A 93 -1.006 -8.600 -6.531 1.00 0.00 C ATOM 1385 CG1 ILE A 93 -0.711 -7.101 -6.448 1.00 0.00 C ATOM 1386 CG2 ILE A 93 0.166 -9.342 -7.157 1.00 0.00 C ATOM 1387 CD1 ILE A 93 0.042 -6.701 -5.199 1.00 0.00 C ATOM 0 H ILE A 93 -3.588 -8.891 -5.691 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.262 -8.248 -8.249 1.00 0.00 H new ATOM 0 HB ILE A 93 -1.152 -8.979 -5.519 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.132 -6.804 -7.322 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -1.651 -6.551 -6.487 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.068 -9.156 -6.574 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.045 -10.411 -7.168 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.315 -8.991 -8.178 1.00 0.00 H new ATOM 0 HD11 ILE A 93 0.216 -5.625 -5.208 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -0.545 -6.966 -4.320 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.998 -7.223 -5.168 1.00 0.00 H new ATOM 1399 N LEU A 94 -1.786 -10.669 -8.859 1.00 0.00 N ATOM 1400 CA LEU A 94 -1.784 -12.049 -9.331 1.00 0.00 C ATOM 1401 C LEU A 94 -0.379 -12.642 -9.275 1.00 0.00 C ATOM 1402 O LEU A 94 0.578 -12.041 -9.760 1.00 0.00 O ATOM 1403 CB LEU A 94 -2.323 -12.121 -10.760 1.00 0.00 C ATOM 1404 CG LEU A 94 -3.835 -12.303 -10.899 1.00 0.00 C ATOM 1405 CD1 LEU A 94 -4.265 -13.647 -10.331 1.00 0.00 C ATOM 1406 CD2 LEU A 94 -4.574 -11.168 -10.207 1.00 0.00 C ATOM 0 H LEU A 94 -1.311 -10.011 -9.477 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.431 -12.632 -8.675 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.038 -11.207 -11.281 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.829 -12.947 -11.272 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.089 -12.282 -11.959 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.344 -13.759 -10.439 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -3.761 -14.448 -10.871 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -3.998 -13.698 -9.275 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.649 -11.314 -10.316 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.315 -11.157 -9.148 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.289 -10.219 -10.660 1.00 0.00 H new ATOM 1418 N ASN A 95 -0.265 -13.826 -8.681 1.00 0.00 N ATOM 1419 CA ASN A 95 1.023 -14.500 -8.563 1.00 0.00 C ATOM 1420 C ASN A 95 0.913 -15.960 -8.995 1.00 0.00 C ATOM 1421 O ASN A 95 1.419 -16.868 -8.334 1.00 0.00 O ATOM 1422 CB ASN A 95 1.535 -14.419 -7.124 1.00 0.00 C ATOM 1423 CG ASN A 95 2.784 -15.251 -6.907 1.00 0.00 C ATOM 1424 OD1 ASN A 95 2.775 -16.216 -6.142 1.00 0.00 O ATOM 1425 ND2 ASN A 95 3.866 -14.881 -7.581 1.00 0.00 N ATOM 0 H ASN A 95 -1.048 -14.338 -8.274 1.00 0.00 H new ATOM 0 HA ASN A 95 1.731 -13.996 -9.221 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.747 -13.379 -6.875 1.00 0.00 H new ATOM 0 HB3 ASN A 95 0.754 -14.757 -6.444 1.00 0.00 H new ATOM 0 HD21 ASN A 95 4.736 -15.403 -7.476 1.00 0.00 H new ATOM 0 HD22 ASN A 95 3.828 -14.074 -8.204 1.00 0.00 H new ATOM 1432 N PRO A 96 0.238 -16.192 -10.130 1.00 0.00 N ATOM 1433 CA PRO A 96 0.047 -17.539 -10.676 1.00 0.00 C ATOM 1434 C PRO A 96 1.344 -18.138 -11.210 1.00 0.00 C ATOM 1435 O PRO A 96 1.435 -19.344 -11.435 1.00 0.00 O ATOM 1436 CB PRO A 96 -0.951 -17.322 -11.816 1.00 0.00 C ATOM 1437 CG PRO A 96 -0.758 -15.902 -12.223 1.00 0.00 C ATOM 1438 CD PRO A 96 -0.392 -15.158 -10.968 1.00 0.00 C ATOM 0 HA PRO A 96 -0.298 -18.241 -9.917 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -0.758 -18.002 -12.646 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -1.974 -17.504 -11.487 1.00 0.00 H new ATOM 0 HG2 PRO A 96 0.029 -15.814 -12.972 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -1.667 -15.496 -12.666 1.00 0.00 H new ATOM 0 HD2 PRO A 96 0.293 -14.335 -11.174 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -1.270 -14.729 -10.485 1.00 0.00 H new ATOM 1446 N ASN A 97 2.345 -17.286 -11.409 1.00 0.00 N ATOM 1447 CA ASN A 97 3.637 -17.732 -11.917 1.00 0.00 C ATOM 1448 C ASN A 97 4.574 -18.100 -10.771 1.00 0.00 C ATOM 1449 O ASN A 97 5.740 -18.432 -10.989 1.00 0.00 O ATOM 1450 CB ASN A 97 4.273 -16.640 -12.780 1.00 0.00 C ATOM 1451 CG ASN A 97 3.876 -16.752 -14.239 1.00 0.00 C ATOM 1452 OD1 ASN A 97 4.640 -17.253 -15.065 1.00 0.00 O ATOM 1453 ND2 ASN A 97 2.677 -16.284 -14.564 1.00 0.00 N ATOM 0 H ASN A 97 2.286 -16.284 -11.226 1.00 0.00 H new ATOM 0 HA ASN A 97 3.473 -18.620 -12.528 1.00 0.00 H new ATOM 0 HB2 ASN A 97 3.977 -15.662 -12.400 1.00 0.00 H new ATOM 0 HB3 ASN A 97 5.358 -16.700 -12.696 1.00 0.00 H new ATOM 0 HD21 ASN A 97 2.356 -16.331 -15.531 1.00 0.00 H new ATOM 0 HD22 ASN A 97 2.077 -15.877 -13.847 1.00 0.00 H new ATOM 1460 N LYS A 98 4.057 -18.040 -9.549 1.00 0.00 N ATOM 1461 CA LYS A 98 4.845 -18.369 -8.367 1.00 0.00 C ATOM 1462 C LYS A 98 6.208 -17.685 -8.414 1.00 0.00 C ATOM 1463 O LYS A 98 7.230 -18.295 -8.103 1.00 0.00 O ATOM 1464 CB LYS A 98 5.027 -19.884 -8.255 1.00 0.00 C ATOM 1465 CG LYS A 98 3.767 -20.618 -7.829 1.00 0.00 C ATOM 1466 CD LYS A 98 4.006 -22.114 -7.712 1.00 0.00 C ATOM 1467 CE LYS A 98 2.707 -22.897 -7.822 1.00 0.00 C ATOM 1468 NZ LYS A 98 2.926 -24.361 -7.663 1.00 0.00 N ATOM 0 H LYS A 98 3.095 -17.766 -9.351 1.00 0.00 H new ATOM 0 HA LYS A 98 4.307 -18.008 -7.491 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.357 -20.274 -9.218 1.00 0.00 H new ATOM 0 HB3 LYS A 98 5.820 -20.094 -7.537 1.00 0.00 H new ATOM 0 HG2 LYS A 98 3.424 -20.227 -6.871 1.00 0.00 H new ATOM 0 HG3 LYS A 98 2.974 -20.431 -8.553 1.00 0.00 H new ATOM 0 HD2 LYS A 98 4.693 -22.436 -8.494 1.00 0.00 H new ATOM 0 HD3 LYS A 98 4.484 -22.333 -6.757 1.00 0.00 H new ATOM 0 HE2 LYS A 98 2.008 -22.550 -7.061 1.00 0.00 H new ATOM 0 HE3 LYS A 98 2.246 -22.702 -8.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 2.017 -24.859 -7.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 3.573 -24.698 -8.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 3.342 -24.550 -6.729 1.00 0.00 H new ATOM 1482 N ALA A 99 6.214 -16.414 -8.804 1.00 0.00 N ATOM 1483 CA ALA A 99 7.450 -15.647 -8.888 1.00 0.00 C ATOM 1484 C ALA A 99 7.427 -14.461 -7.929 1.00 0.00 C ATOM 1485 O ALA A 99 6.769 -13.449 -8.172 1.00 0.00 O ATOM 1486 CB ALA A 99 7.680 -15.170 -10.315 1.00 0.00 C ATOM 0 H ALA A 99 5.376 -15.894 -9.067 1.00 0.00 H new ATOM 0 HA ALA A 99 8.273 -16.300 -8.598 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.607 -14.598 -10.363 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.750 -16.031 -10.980 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.848 -14.538 -10.626 1.00 0.00 H new ATOM 1492 N PRO A 100 8.160 -14.587 -6.813 1.00 0.00 N ATOM 1493 CA PRO A 100 8.239 -13.535 -5.796 1.00 0.00 C ATOM 1494 C PRO A 100 9.012 -12.314 -6.283 1.00 0.00 C ATOM 1495 O PRO A 100 10.170 -12.420 -6.689 1.00 0.00 O ATOM 1496 CB PRO A 100 8.982 -14.212 -4.642 1.00 0.00 C ATOM 1497 CG PRO A 100 9.783 -15.290 -5.288 1.00 0.00 C ATOM 1498 CD PRO A 100 8.968 -15.765 -6.459 1.00 0.00 C ATOM 0 HA PRO A 100 7.253 -13.157 -5.524 1.00 0.00 H new ATOM 0 HB2 PRO A 100 9.622 -13.505 -4.114 1.00 0.00 H new ATOM 0 HB3 PRO A 100 8.287 -14.621 -3.909 1.00 0.00 H new ATOM 0 HG2 PRO A 100 10.753 -14.914 -5.614 1.00 0.00 H new ATOM 0 HG3 PRO A 100 9.976 -16.105 -4.590 1.00 0.00 H new ATOM 0 HD2 PRO A 100 9.602 -16.081 -7.288 1.00 0.00 H new ATOM 0 HD3 PRO A 100 8.342 -16.617 -6.194 1.00 0.00 H new ATOM 1506 N LEU A 101 8.365 -11.154 -6.240 1.00 0.00 N ATOM 1507 CA LEU A 101 8.992 -9.911 -6.677 1.00 0.00 C ATOM 1508 C LEU A 101 8.724 -8.787 -5.681 1.00 0.00 C ATOM 1509 O LEU A 101 8.135 -9.009 -4.623 1.00 0.00 O ATOM 1510 CB LEU A 101 8.475 -9.516 -8.061 1.00 0.00 C ATOM 1511 CG LEU A 101 9.066 -10.285 -9.243 1.00 0.00 C ATOM 1512 CD1 LEU A 101 8.233 -11.521 -9.545 1.00 0.00 C ATOM 1513 CD2 LEU A 101 9.158 -9.390 -10.470 1.00 0.00 C ATOM 0 H LEU A 101 7.407 -11.048 -5.907 1.00 0.00 H new ATOM 0 HA LEU A 101 10.068 -10.074 -6.731 1.00 0.00 H new ATOM 0 HB2 LEU A 101 7.393 -9.646 -8.073 1.00 0.00 H new ATOM 0 HB3 LEU A 101 8.670 -8.454 -8.210 1.00 0.00 H new ATOM 0 HG LEU A 101 10.073 -10.606 -8.976 1.00 0.00 H new ATOM 0 HD11 LEU A 101 8.668 -12.056 -10.389 1.00 0.00 H new ATOM 0 HD12 LEU A 101 8.218 -12.172 -8.671 1.00 0.00 H new ATOM 0 HD13 LEU A 101 7.214 -11.222 -9.792 1.00 0.00 H new ATOM 0 HD21 LEU A 101 9.581 -9.954 -11.301 1.00 0.00 H new ATOM 0 HD22 LEU A 101 8.162 -9.039 -10.739 1.00 0.00 H new ATOM 0 HD23 LEU A 101 9.797 -8.535 -10.250 1.00 0.00 H new ATOM 1525 N ARG A 102 9.159 -7.580 -6.029 1.00 0.00 N ATOM 1526 CA ARG A 102 8.966 -6.421 -5.166 1.00 0.00 C ATOM 1527 C ARG A 102 7.795 -5.571 -5.652 1.00 0.00 C ATOM 1528 O ARG A 102 7.195 -5.857 -6.689 1.00 0.00 O ATOM 1529 CB ARG A 102 10.239 -5.575 -5.120 1.00 0.00 C ATOM 1530 CG ARG A 102 10.470 -4.752 -6.377 1.00 0.00 C ATOM 1531 CD ARG A 102 11.333 -5.500 -7.381 1.00 0.00 C ATOM 1532 NE ARG A 102 11.836 -4.620 -8.433 1.00 0.00 N ATOM 1533 CZ ARG A 102 11.101 -4.211 -9.462 1.00 0.00 C ATOM 1534 NH1 ARG A 102 9.839 -4.599 -9.575 1.00 0.00 N ATOM 1535 NH2 ARG A 102 11.630 -3.410 -10.379 1.00 0.00 N ATOM 0 H ARG A 102 9.647 -7.380 -6.902 1.00 0.00 H new ATOM 0 HA ARG A 102 8.740 -6.780 -4.162 1.00 0.00 H new ATOM 0 HB2 ARG A 102 10.189 -4.905 -4.262 1.00 0.00 H new ATOM 0 HB3 ARG A 102 11.095 -6.231 -4.963 1.00 0.00 H new ATOM 0 HG2 ARG A 102 9.511 -4.505 -6.833 1.00 0.00 H new ATOM 0 HG3 ARG A 102 10.950 -3.810 -6.113 1.00 0.00 H new ATOM 0 HD2 ARG A 102 12.173 -5.963 -6.863 1.00 0.00 H new ATOM 0 HD3 ARG A 102 10.752 -6.306 -7.829 1.00 0.00 H new ATOM 0 HE ARG A 102 12.804 -4.302 -8.375 1.00 0.00 H new ATOM 0 HH11 ARG A 102 9.429 -5.213 -8.871 1.00 0.00 H new ATOM 0 HH12 ARG A 102 9.277 -4.283 -10.366 1.00 0.00 H new ATOM 0 HH21 ARG A 102 12.601 -3.108 -10.294 1.00 0.00 H new ATOM 0 HH22 ARG A 102 11.066 -3.096 -11.169 1.00 0.00 H new ATOM 1549 N LEU A 103 7.476 -4.526 -4.896 1.00 0.00 N ATOM 1550 CA LEU A 103 6.377 -3.635 -5.248 1.00 0.00 C ATOM 1551 C LEU A 103 6.749 -2.180 -4.981 1.00 0.00 C ATOM 1552 O LEU A 103 7.281 -1.848 -3.921 1.00 0.00 O ATOM 1553 CB LEU A 103 5.120 -4.005 -4.459 1.00 0.00 C ATOM 1554 CG LEU A 103 4.055 -2.914 -4.341 1.00 0.00 C ATOM 1555 CD1 LEU A 103 3.551 -2.509 -5.717 1.00 0.00 C ATOM 1556 CD2 LEU A 103 2.903 -3.385 -3.465 1.00 0.00 C ATOM 0 H LEU A 103 7.963 -4.275 -4.036 1.00 0.00 H new ATOM 0 HA LEU A 103 6.176 -3.750 -6.313 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.666 -4.879 -4.927 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.420 -4.301 -3.454 1.00 0.00 H new ATOM 0 HG LEU A 103 4.508 -2.041 -3.872 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.794 -1.732 -5.613 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.382 -2.129 -6.311 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.115 -3.376 -6.215 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.155 -2.596 -3.392 1.00 0.00 H new ATOM 0 HD22 LEU A 103 2.451 -4.274 -3.905 1.00 0.00 H new ATOM 0 HD23 LEU A 103 3.277 -3.623 -2.469 1.00 0.00 H new ATOM 1568 N LYS A 104 6.463 -1.314 -5.947 1.00 0.00 N ATOM 1569 CA LYS A 104 6.764 0.107 -5.816 1.00 0.00 C ATOM 1570 C LYS A 104 5.621 0.843 -5.125 1.00 0.00 C ATOM 1571 O LYS A 104 4.452 0.658 -5.468 1.00 0.00 O ATOM 1572 CB LYS A 104 7.024 0.723 -7.192 1.00 0.00 C ATOM 1573 CG LYS A 104 7.815 2.019 -7.139 1.00 0.00 C ATOM 1574 CD LYS A 104 8.528 2.291 -8.453 1.00 0.00 C ATOM 1575 CE LYS A 104 7.651 3.088 -9.407 1.00 0.00 C ATOM 1576 NZ LYS A 104 8.373 3.438 -10.662 1.00 0.00 N ATOM 0 H LYS A 104 6.023 -1.572 -6.830 1.00 0.00 H new ATOM 0 HA LYS A 104 7.661 0.209 -5.204 1.00 0.00 H new ATOM 0 HB2 LYS A 104 7.564 0.003 -7.807 1.00 0.00 H new ATOM 0 HB3 LYS A 104 6.069 0.910 -7.683 1.00 0.00 H new ATOM 0 HG2 LYS A 104 7.144 2.847 -6.910 1.00 0.00 H new ATOM 0 HG3 LYS A 104 8.545 1.968 -6.331 1.00 0.00 H new ATOM 0 HD2 LYS A 104 9.451 2.839 -8.261 1.00 0.00 H new ATOM 0 HD3 LYS A 104 8.809 1.346 -8.918 1.00 0.00 H new ATOM 0 HE2 LYS A 104 6.760 2.510 -9.650 1.00 0.00 H new ATOM 0 HE3 LYS A 104 7.315 4.001 -8.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 7.742 3.981 -11.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 9.210 4.011 -10.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 8.672 2.567 -11.145 1.00 0.00 H new ATOM 1590 N LEU A 105 5.965 1.680 -4.152 1.00 0.00 N ATOM 1591 CA LEU A 105 4.967 2.446 -3.414 1.00 0.00 C ATOM 1592 C LEU A 105 5.272 3.939 -3.475 1.00 0.00 C ATOM 1593 O LEU A 105 6.269 4.402 -2.921 1.00 0.00 O ATOM 1594 CB LEU A 105 4.916 1.984 -1.956 1.00 0.00 C ATOM 1595 CG LEU A 105 3.962 0.828 -1.652 1.00 0.00 C ATOM 1596 CD1 LEU A 105 3.986 0.493 -0.169 1.00 0.00 C ATOM 1597 CD2 LEU A 105 2.549 1.171 -2.100 1.00 0.00 C ATOM 0 H LEU A 105 6.927 1.845 -3.856 1.00 0.00 H new ATOM 0 HA LEU A 105 3.996 2.273 -3.878 1.00 0.00 H new ATOM 0 HB2 LEU A 105 5.921 1.689 -1.654 1.00 0.00 H new ATOM 0 HB3 LEU A 105 4.634 2.835 -1.336 1.00 0.00 H new ATOM 0 HG LEU A 105 4.295 -0.049 -2.207 1.00 0.00 H new ATOM 0 HD11 LEU A 105 3.301 -0.332 0.029 1.00 0.00 H new ATOM 0 HD12 LEU A 105 4.996 0.204 0.122 1.00 0.00 H new ATOM 0 HD13 LEU A 105 3.678 1.366 0.406 1.00 0.00 H new ATOM 0 HD21 LEU A 105 1.884 0.337 -1.876 1.00 0.00 H new ATOM 0 HD22 LEU A 105 2.206 2.061 -1.572 1.00 0.00 H new ATOM 0 HD23 LEU A 105 2.544 1.361 -3.173 1.00 0.00 H new ATOM 1609 N ARG A 106 4.406 4.688 -4.150 1.00 0.00 N ATOM 1610 CA ARG A 106 4.582 6.129 -4.283 1.00 0.00 C ATOM 1611 C ARG A 106 3.572 6.882 -3.422 1.00 0.00 C ATOM 1612 O ARG A 106 2.395 6.524 -3.371 1.00 0.00 O ATOM 1613 CB ARG A 106 4.435 6.549 -5.746 1.00 0.00 C ATOM 1614 CG ARG A 106 4.076 8.015 -5.925 1.00 0.00 C ATOM 1615 CD ARG A 106 4.386 8.497 -7.334 1.00 0.00 C ATOM 1616 NE ARG A 106 3.713 7.691 -8.349 1.00 0.00 N ATOM 1617 CZ ARG A 106 3.663 8.019 -9.635 1.00 0.00 C ATOM 1618 NH1 ARG A 106 4.244 9.132 -10.061 1.00 0.00 N ATOM 1619 NH2 ARG A 106 3.031 7.234 -10.498 1.00 0.00 N ATOM 0 H ARG A 106 3.575 4.320 -4.613 1.00 0.00 H new ATOM 0 HA ARG A 106 5.585 6.381 -3.939 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.369 6.346 -6.269 1.00 0.00 H new ATOM 0 HB3 ARG A 106 3.667 5.935 -6.216 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.016 8.159 -5.715 1.00 0.00 H new ATOM 0 HG3 ARG A 106 4.629 8.617 -5.204 1.00 0.00 H new ATOM 0 HD2 ARG A 106 4.080 9.538 -7.436 1.00 0.00 H new ATOM 0 HD3 ARG A 106 5.463 8.463 -7.500 1.00 0.00 H new ATOM 0 HE ARG A 106 3.256 6.828 -8.054 1.00 0.00 H new ATOM 0 HH11 ARG A 106 4.731 9.738 -9.401 1.00 0.00 H new ATOM 0 HH12 ARG A 106 4.204 9.382 -11.049 1.00 0.00 H new ATOM 0 HH21 ARG A 106 2.583 6.377 -10.174 1.00 0.00 H new ATOM 0 HH22 ARG A 106 2.994 7.488 -11.485 1.00 0.00 H new ATOM 1633 N LEU A 107 4.040 7.926 -2.747 1.00 0.00 N ATOM 1634 CA LEU A 107 3.179 8.729 -1.887 1.00 0.00 C ATOM 1635 C LEU A 107 3.298 10.211 -2.229 1.00 0.00 C ATOM 1636 O LEU A 107 4.401 10.746 -2.347 1.00 0.00 O ATOM 1637 CB LEU A 107 3.537 8.503 -0.417 1.00 0.00 C ATOM 1638 CG LEU A 107 3.319 7.086 0.116 1.00 0.00 C ATOM 1639 CD1 LEU A 107 3.840 6.966 1.540 1.00 0.00 C ATOM 1640 CD2 LEU A 107 1.846 6.713 0.052 1.00 0.00 C ATOM 0 H LEU A 107 5.011 8.236 -2.779 1.00 0.00 H new ATOM 0 HA LEU A 107 2.148 8.417 -2.055 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.585 8.766 -0.274 1.00 0.00 H new ATOM 0 HB3 LEU A 107 2.950 9.192 0.190 1.00 0.00 H new ATOM 0 HG LEU A 107 3.876 6.392 -0.513 1.00 0.00 H new ATOM 0 HD11 LEU A 107 3.677 5.951 1.903 1.00 0.00 H new ATOM 0 HD12 LEU A 107 4.907 7.190 1.557 1.00 0.00 H new ATOM 0 HD13 LEU A 107 3.311 7.670 2.182 1.00 0.00 H new ATOM 0 HD21 LEU A 107 1.710 5.702 0.435 1.00 0.00 H new ATOM 0 HD22 LEU A 107 1.267 7.411 0.657 1.00 0.00 H new ATOM 0 HD23 LEU A 107 1.504 6.758 -0.982 1.00 0.00 H new ATOM 1652 N THR A 108 2.155 10.871 -2.385 1.00 0.00 N ATOM 1653 CA THR A 108 2.131 12.291 -2.712 1.00 0.00 C ATOM 1654 C THR A 108 0.961 12.993 -2.030 1.00 0.00 C ATOM 1655 O THR A 108 -0.195 12.805 -2.410 1.00 0.00 O ATOM 1656 CB THR A 108 2.033 12.516 -4.232 1.00 0.00 C ATOM 1657 OG1 THR A 108 1.247 11.480 -4.832 1.00 0.00 O ATOM 1658 CG2 THR A 108 3.417 12.540 -4.865 1.00 0.00 C ATOM 0 H THR A 108 1.233 10.445 -2.290 1.00 0.00 H new ATOM 0 HA THR A 108 3.067 12.714 -2.349 1.00 0.00 H new ATOM 0 HB THR A 108 1.554 13.480 -4.404 1.00 0.00 H new ATOM 0 HG1 THR A 108 1.188 11.632 -5.798 1.00 0.00 H new ATOM 0 HG21 THR A 108 3.323 12.700 -5.939 1.00 0.00 H new ATOM 0 HG22 THR A 108 4.003 13.348 -4.427 1.00 0.00 H new ATOM 0 HG23 THR A 108 3.917 11.589 -4.682 1.00 0.00 H new ATOM 1666 N TYR A 109 1.269 13.802 -1.023 1.00 0.00 N ATOM 1667 CA TYR A 109 0.242 14.530 -0.287 1.00 0.00 C ATOM 1668 C TYR A 109 0.739 15.916 0.114 1.00 0.00 C ATOM 1669 O TYR A 109 1.875 16.290 -0.181 1.00 0.00 O ATOM 1670 CB TYR A 109 -0.175 13.746 0.959 1.00 0.00 C ATOM 1671 CG TYR A 109 0.970 13.449 1.900 1.00 0.00 C ATOM 1672 CD1 TYR A 109 1.919 12.484 1.587 1.00 0.00 C ATOM 1673 CD2 TYR A 109 1.103 14.133 3.102 1.00 0.00 C ATOM 1674 CE1 TYR A 109 2.967 12.208 2.443 1.00 0.00 C ATOM 1675 CE2 TYR A 109 2.149 13.865 3.964 1.00 0.00 C ATOM 1676 CZ TYR A 109 3.078 12.901 3.631 1.00 0.00 C ATOM 1677 OH TYR A 109 4.120 12.630 4.487 1.00 0.00 O ATOM 0 H TYR A 109 2.221 13.970 -0.698 1.00 0.00 H new ATOM 0 HA TYR A 109 -0.622 14.648 -0.940 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -0.937 14.311 1.495 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -0.633 12.806 0.650 1.00 0.00 H new ATOM 0 HD1 TYR A 109 1.836 11.940 0.658 1.00 0.00 H new ATOM 0 HD2 TYR A 109 0.377 14.887 3.367 1.00 0.00 H new ATOM 0 HE1 TYR A 109 3.696 11.454 2.184 1.00 0.00 H new ATOM 0 HE2 TYR A 109 2.239 14.407 4.894 1.00 0.00 H new ATOM 0 HH TYR A 109 4.052 13.206 5.277 1.00 0.00 H new ATOM 1687 N ASP A 110 -0.119 16.673 0.789 1.00 0.00 N ATOM 1688 CA ASP A 110 0.231 18.017 1.232 1.00 0.00 C ATOM 1689 C ASP A 110 0.182 18.117 2.754 1.00 0.00 C ATOM 1690 O ASP A 110 -0.885 18.005 3.360 1.00 0.00 O ATOM 1691 CB ASP A 110 -0.714 19.045 0.610 1.00 0.00 C ATOM 1692 CG ASP A 110 -0.539 19.159 -0.891 1.00 0.00 C ATOM 1693 OD1 ASP A 110 0.310 19.963 -1.330 1.00 0.00 O ATOM 1694 OD2 ASP A 110 -1.251 18.445 -1.628 1.00 0.00 O ATOM 0 H ASP A 110 -1.062 16.378 1.041 1.00 0.00 H new ATOM 0 HA ASP A 110 1.249 18.227 0.904 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -1.744 18.768 0.833 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -0.539 20.019 1.068 1.00 0.00 H new ATOM 1699 N HIS A 111 1.343 18.328 3.366 1.00 0.00 N ATOM 1700 CA HIS A 111 1.432 18.442 4.818 1.00 0.00 C ATOM 1701 C HIS A 111 1.804 19.864 5.229 1.00 0.00 C ATOM 1702 O HIS A 111 2.619 20.516 4.576 1.00 0.00 O ATOM 1703 CB HIS A 111 2.461 17.454 5.366 1.00 0.00 C ATOM 1704 CG HIS A 111 2.166 16.994 6.761 1.00 0.00 C ATOM 1705 ND1 HIS A 111 3.006 16.164 7.473 1.00 0.00 N ATOM 1706 CD2 HIS A 111 1.118 17.255 7.576 1.00 0.00 C ATOM 1707 CE1 HIS A 111 2.485 15.932 8.665 1.00 0.00 C ATOM 1708 NE2 HIS A 111 1.340 16.584 8.753 1.00 0.00 N ATOM 0 H HIS A 111 2.235 18.423 2.880 1.00 0.00 H new ATOM 0 HA HIS A 111 0.454 18.205 5.237 1.00 0.00 H new ATOM 0 HB2 HIS A 111 2.506 16.586 4.708 1.00 0.00 H new ATOM 0 HB3 HIS A 111 3.446 17.920 5.347 1.00 0.00 H new ATOM 0 HD2 HIS A 111 0.265 17.876 7.344 1.00 0.00 H new ATOM 0 HE1 HIS A 111 2.921 15.314 9.436 1.00 0.00 H new ATOM 0 HE2 HIS A 111 0.721 16.588 9.564 1.00 0.00 H new ATOM 1716 N PHE A 112 1.201 20.338 6.313 1.00 0.00 N ATOM 1717 CA PHE A 112 1.468 21.683 6.810 1.00 0.00 C ATOM 1718 C PHE A 112 1.617 22.670 5.656 1.00 0.00 C ATOM 1719 O PHE A 112 2.592 23.420 5.588 1.00 0.00 O ATOM 1720 CB PHE A 112 2.734 21.690 7.670 1.00 0.00 C ATOM 1721 CG PHE A 112 2.561 21.008 8.997 1.00 0.00 C ATOM 1722 CD1 PHE A 112 1.997 21.682 10.068 1.00 0.00 C ATOM 1723 CD2 PHE A 112 2.962 19.694 9.172 1.00 0.00 C ATOM 1724 CE1 PHE A 112 1.838 21.057 11.291 1.00 0.00 C ATOM 1725 CE2 PHE A 112 2.805 19.063 10.393 1.00 0.00 C ATOM 1726 CZ PHE A 112 2.241 19.746 11.453 1.00 0.00 C ATOM 0 H PHE A 112 0.524 19.811 6.865 1.00 0.00 H new ATOM 0 HA PHE A 112 0.620 21.992 7.422 1.00 0.00 H new ATOM 0 HB2 PHE A 112 3.539 21.201 7.121 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.044 22.721 7.838 1.00 0.00 H new ATOM 0 HD1 PHE A 112 1.678 22.707 9.946 1.00 0.00 H new ATOM 0 HD2 PHE A 112 3.402 19.156 8.346 1.00 0.00 H new ATOM 0 HE1 PHE A 112 1.399 21.594 12.119 1.00 0.00 H new ATOM 0 HE2 PHE A 112 3.123 18.038 10.517 1.00 0.00 H new ATOM 0 HZ PHE A 112 2.115 19.256 12.407 1.00 0.00 H new ATOM 1736 N HIS A 113 0.645 22.662 4.749 1.00 0.00 N ATOM 1737 CA HIS A 113 0.668 23.556 3.597 1.00 0.00 C ATOM 1738 C HIS A 113 1.983 23.426 2.834 1.00 0.00 C ATOM 1739 O HIS A 113 2.607 24.426 2.480 1.00 0.00 O ATOM 1740 CB HIS A 113 0.466 25.004 4.044 1.00 0.00 C ATOM 1741 CG HIS A 113 -0.596 25.166 5.087 1.00 0.00 C ATOM 1742 ND1 HIS A 113 -0.416 25.907 6.236 1.00 0.00 N ATOM 1743 CD2 HIS A 113 -1.858 24.680 5.149 1.00 0.00 C ATOM 1744 CE1 HIS A 113 -1.520 25.867 6.961 1.00 0.00 C ATOM 1745 NE2 HIS A 113 -2.410 25.129 6.323 1.00 0.00 N ATOM 0 H HIS A 113 -0.168 22.047 4.790 1.00 0.00 H new ATOM 0 HA HIS A 113 -0.147 23.272 2.932 1.00 0.00 H new ATOM 0 HB2 HIS A 113 1.408 25.390 4.433 1.00 0.00 H new ATOM 0 HB3 HIS A 113 0.207 25.611 3.176 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -2.341 24.055 4.412 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -1.669 26.355 7.913 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -3.355 24.926 6.650 1.00 0.00 H new ATOM 1753 N GLN A 114 2.397 22.187 2.585 1.00 0.00 N ATOM 1754 CA GLN A 114 3.638 21.927 1.866 1.00 0.00 C ATOM 1755 C GLN A 114 3.564 20.603 1.113 1.00 0.00 C ATOM 1756 O GLN A 114 2.980 19.634 1.599 1.00 0.00 O ATOM 1757 CB GLN A 114 4.821 21.911 2.836 1.00 0.00 C ATOM 1758 CG GLN A 114 5.217 23.291 3.335 1.00 0.00 C ATOM 1759 CD GLN A 114 6.421 23.255 4.256 1.00 0.00 C ATOM 1760 OE1 GLN A 114 7.017 22.200 4.476 1.00 0.00 O ATOM 1761 NE2 GLN A 114 6.785 24.410 4.801 1.00 0.00 N ATOM 0 H GLN A 114 1.891 21.349 2.871 1.00 0.00 H new ATOM 0 HA GLN A 114 3.783 22.728 1.141 1.00 0.00 H new ATOM 0 HB2 GLN A 114 4.571 21.283 3.691 1.00 0.00 H new ATOM 0 HB3 GLN A 114 5.678 21.452 2.343 1.00 0.00 H new ATOM 0 HG2 GLN A 114 5.436 23.933 2.482 1.00 0.00 H new ATOM 0 HG3 GLN A 114 4.374 23.738 3.862 1.00 0.00 H new ATOM 0 HE21 GLN A 114 6.262 25.260 4.591 1.00 0.00 H new ATOM 0 HE22 GLN A 114 7.587 24.447 5.430 1.00 0.00 H new ATOM 1770 N SER A 115 4.159 20.569 -0.075 1.00 0.00 N ATOM 1771 CA SER A 115 4.157 19.364 -0.896 1.00 0.00 C ATOM 1772 C SER A 115 5.155 18.341 -0.363 1.00 0.00 C ATOM 1773 O SER A 115 6.333 18.645 -0.176 1.00 0.00 O ATOM 1774 CB SER A 115 4.491 19.711 -2.348 1.00 0.00 C ATOM 1775 OG SER A 115 4.819 18.548 -3.088 1.00 0.00 O ATOM 0 H SER A 115 4.648 21.362 -0.490 1.00 0.00 H new ATOM 0 HA SER A 115 3.159 18.927 -0.854 1.00 0.00 H new ATOM 0 HB2 SER A 115 3.640 20.212 -2.810 1.00 0.00 H new ATOM 0 HB3 SER A 115 5.326 20.411 -2.375 1.00 0.00 H new ATOM 0 HG SER A 115 5.027 18.797 -4.013 1.00 0.00 H new ATOM 1781 N VAL A 116 4.674 17.125 -0.121 1.00 0.00 N ATOM 1782 CA VAL A 116 5.523 16.056 0.390 1.00 0.00 C ATOM 1783 C VAL A 116 5.562 14.876 -0.575 1.00 0.00 C ATOM 1784 O VAL A 116 4.643 14.058 -0.607 1.00 0.00 O ATOM 1785 CB VAL A 116 5.038 15.563 1.766 1.00 0.00 C ATOM 1786 CG1 VAL A 116 5.908 14.417 2.260 1.00 0.00 C ATOM 1787 CG2 VAL A 116 5.030 16.707 2.769 1.00 0.00 C ATOM 0 H VAL A 116 3.701 16.856 -0.271 1.00 0.00 H new ATOM 0 HA VAL A 116 6.526 16.471 0.493 1.00 0.00 H new ATOM 0 HB VAL A 116 4.018 15.194 1.661 1.00 0.00 H new ATOM 0 HG11 VAL A 116 5.550 14.082 3.234 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.858 13.591 1.551 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.940 14.756 2.350 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.685 16.341 3.736 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.038 17.108 2.872 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.361 17.493 2.419 1.00 0.00 H new ATOM 1797 N GLN A 117 6.631 14.796 -1.361 1.00 0.00 N ATOM 1798 CA GLN A 117 6.789 13.716 -2.327 1.00 0.00 C ATOM 1799 C GLN A 117 7.734 12.643 -1.796 1.00 0.00 C ATOM 1800 O GLN A 117 8.937 12.869 -1.673 1.00 0.00 O ATOM 1801 CB GLN A 117 7.316 14.265 -3.654 1.00 0.00 C ATOM 1802 CG GLN A 117 7.101 13.325 -4.830 1.00 0.00 C ATOM 1803 CD GLN A 117 7.104 14.047 -6.163 1.00 0.00 C ATOM 1804 OE1 GLN A 117 6.126 14.696 -6.532 1.00 0.00 O ATOM 1805 NE2 GLN A 117 8.208 13.937 -6.893 1.00 0.00 N ATOM 0 H GLN A 117 7.400 15.466 -1.348 1.00 0.00 H new ATOM 0 HA GLN A 117 5.811 13.263 -2.491 1.00 0.00 H new ATOM 0 HB2 GLN A 117 6.826 15.215 -3.865 1.00 0.00 H new ATOM 0 HB3 GLN A 117 8.382 14.471 -3.555 1.00 0.00 H new ATOM 0 HG2 GLN A 117 7.883 12.566 -4.831 1.00 0.00 H new ATOM 0 HG3 GLN A 117 6.151 12.805 -4.705 1.00 0.00 H new ATOM 0 HE21 GLN A 117 8.995 13.388 -6.547 1.00 0.00 H new ATOM 0 HE22 GLN A 117 8.269 14.401 -7.799 1.00 0.00 H new ATOM 1814 N GLU A 118 7.180 11.477 -1.482 1.00 0.00 N ATOM 1815 CA GLU A 118 7.974 10.370 -0.962 1.00 0.00 C ATOM 1816 C GLU A 118 7.794 9.121 -1.821 1.00 0.00 C ATOM 1817 O GLU A 118 6.673 8.657 -2.034 1.00 0.00 O ATOM 1818 CB GLU A 118 7.582 10.067 0.486 1.00 0.00 C ATOM 1819 CG GLU A 118 7.593 11.290 1.387 1.00 0.00 C ATOM 1820 CD GLU A 118 8.991 11.822 1.632 1.00 0.00 C ATOM 1821 OE1 GLU A 118 9.871 11.025 2.019 1.00 0.00 O ATOM 1822 OE2 GLU A 118 9.206 13.037 1.436 1.00 0.00 O ATOM 0 H GLU A 118 6.185 11.274 -1.578 1.00 0.00 H new ATOM 0 HA GLU A 118 9.023 10.664 -0.993 1.00 0.00 H new ATOM 0 HB2 GLU A 118 6.586 9.625 0.499 1.00 0.00 H new ATOM 0 HB3 GLU A 118 8.267 9.322 0.891 1.00 0.00 H new ATOM 0 HG2 GLU A 118 6.984 12.074 0.937 1.00 0.00 H new ATOM 0 HG3 GLU A 118 7.132 11.037 2.342 1.00 0.00 H new ATOM 1829 N ILE A 119 8.905 8.582 -2.311 1.00 0.00 N ATOM 1830 CA ILE A 119 8.871 7.388 -3.146 1.00 0.00 C ATOM 1831 C ILE A 119 9.865 6.343 -2.651 1.00 0.00 C ATOM 1832 O ILE A 119 11.068 6.596 -2.586 1.00 0.00 O ATOM 1833 CB ILE A 119 9.183 7.720 -4.617 1.00 0.00 C ATOM 1834 CG1 ILE A 119 8.193 8.759 -5.149 1.00 0.00 C ATOM 1835 CG2 ILE A 119 9.140 6.458 -5.465 1.00 0.00 C ATOM 1836 CD1 ILE A 119 8.753 9.610 -6.267 1.00 0.00 C ATOM 0 H ILE A 119 9.840 8.953 -2.144 1.00 0.00 H new ATOM 0 HA ILE A 119 7.860 6.986 -3.080 1.00 0.00 H new ATOM 0 HB ILE A 119 10.187 8.139 -4.674 1.00 0.00 H new ATOM 0 HG12 ILE A 119 7.299 8.248 -5.505 1.00 0.00 H new ATOM 0 HG13 ILE A 119 7.884 9.408 -4.329 1.00 0.00 H new ATOM 0 HG21 ILE A 119 9.363 6.709 -6.502 1.00 0.00 H new ATOM 0 HG22 ILE A 119 9.880 5.747 -5.097 1.00 0.00 H new ATOM 0 HG23 ILE A 119 8.147 6.013 -5.404 1.00 0.00 H new ATOM 0 HD11 ILE A 119 7.997 10.324 -6.595 1.00 0.00 H new ATOM 0 HD12 ILE A 119 9.630 10.149 -5.909 1.00 0.00 H new ATOM 0 HD13 ILE A 119 9.036 8.971 -7.104 1.00 0.00 H new ATOM 1848 N PHE A 120 9.354 5.166 -2.303 1.00 0.00 N ATOM 1849 CA PHE A 120 10.196 4.081 -1.815 1.00 0.00 C ATOM 1850 C PHE A 120 9.719 2.736 -2.356 1.00 0.00 C ATOM 1851 O PHE A 120 8.578 2.602 -2.795 1.00 0.00 O ATOM 1852 CB PHE A 120 10.197 4.056 -0.285 1.00 0.00 C ATOM 1853 CG PHE A 120 8.820 4.002 0.314 1.00 0.00 C ATOM 1854 CD1 PHE A 120 8.190 2.787 0.525 1.00 0.00 C ATOM 1855 CD2 PHE A 120 8.157 5.167 0.666 1.00 0.00 C ATOM 1856 CE1 PHE A 120 6.923 2.733 1.077 1.00 0.00 C ATOM 1857 CE2 PHE A 120 6.891 5.120 1.218 1.00 0.00 C ATOM 1858 CZ PHE A 120 6.273 3.902 1.423 1.00 0.00 C ATOM 0 H PHE A 120 8.360 4.940 -2.350 1.00 0.00 H new ATOM 0 HA PHE A 120 11.212 4.256 -2.170 1.00 0.00 H new ATOM 0 HB2 PHE A 120 10.767 3.192 0.056 1.00 0.00 H new ATOM 0 HB3 PHE A 120 10.711 4.943 0.085 1.00 0.00 H new ATOM 0 HD1 PHE A 120 8.694 1.871 0.255 1.00 0.00 H new ATOM 0 HD2 PHE A 120 8.635 6.122 0.507 1.00 0.00 H new ATOM 0 HE1 PHE A 120 6.443 1.779 1.237 1.00 0.00 H new ATOM 0 HE2 PHE A 120 6.385 6.035 1.489 1.00 0.00 H new ATOM 0 HZ PHE A 120 5.283 3.863 1.853 1.00 0.00 H new ATOM 1868 N GLU A 121 10.603 1.744 -2.321 1.00 0.00 N ATOM 1869 CA GLU A 121 10.273 0.410 -2.810 1.00 0.00 C ATOM 1870 C GLU A 121 10.387 -0.622 -1.692 1.00 0.00 C ATOM 1871 O GLU A 121 11.455 -0.805 -1.106 1.00 0.00 O ATOM 1872 CB GLU A 121 11.193 0.025 -3.970 1.00 0.00 C ATOM 1873 CG GLU A 121 11.040 0.918 -5.190 1.00 0.00 C ATOM 1874 CD GLU A 121 12.046 0.596 -6.278 1.00 0.00 C ATOM 1875 OE1 GLU A 121 13.183 1.107 -6.205 1.00 0.00 O ATOM 1876 OE2 GLU A 121 11.696 -0.167 -7.203 1.00 0.00 O ATOM 0 H GLU A 121 11.552 1.838 -1.960 1.00 0.00 H new ATOM 0 HA GLU A 121 9.242 0.425 -3.164 1.00 0.00 H new ATOM 0 HB2 GLU A 121 12.228 0.063 -3.630 1.00 0.00 H new ATOM 0 HB3 GLU A 121 10.989 -1.007 -4.257 1.00 0.00 H new ATOM 0 HG2 GLU A 121 10.032 0.811 -5.590 1.00 0.00 H new ATOM 0 HG3 GLU A 121 11.156 1.960 -4.890 1.00 0.00 H new ATOM 1883 N VAL A 122 9.278 -1.295 -1.400 1.00 0.00 N ATOM 1884 CA VAL A 122 9.253 -2.310 -0.353 1.00 0.00 C ATOM 1885 C VAL A 122 10.104 -3.515 -0.735 1.00 0.00 C ATOM 1886 O VAL A 122 9.901 -4.123 -1.785 1.00 0.00 O ATOM 1887 CB VAL A 122 7.815 -2.781 -0.063 1.00 0.00 C ATOM 1888 CG1 VAL A 122 7.790 -3.706 1.144 1.00 0.00 C ATOM 1889 CG2 VAL A 122 6.897 -1.587 0.152 1.00 0.00 C ATOM 0 H VAL A 122 8.385 -1.156 -1.874 1.00 0.00 H new ATOM 0 HA VAL A 122 9.665 -1.849 0.545 1.00 0.00 H new ATOM 0 HB VAL A 122 7.452 -3.339 -0.926 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.766 -4.029 1.334 1.00 0.00 H new ATOM 0 HG12 VAL A 122 8.415 -4.577 0.948 1.00 0.00 H new ATOM 0 HG13 VAL A 122 8.171 -3.176 2.017 1.00 0.00 H new ATOM 0 HG21 VAL A 122 5.885 -1.938 0.356 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.255 -1.001 0.998 1.00 0.00 H new ATOM 0 HG23 VAL A 122 6.892 -0.966 -0.744 1.00 0.00 H new ATOM 1899 N ASN A 123 11.057 -3.857 0.125 1.00 0.00 N ATOM 1900 CA ASN A 123 11.940 -4.991 -0.122 1.00 0.00 C ATOM 1901 C ASN A 123 11.904 -5.973 1.044 1.00 0.00 C ATOM 1902 O ASN A 123 12.628 -6.968 1.054 1.00 0.00 O ATOM 1903 CB ASN A 123 13.374 -4.507 -0.352 1.00 0.00 C ATOM 1904 CG ASN A 123 14.040 -4.046 0.930 1.00 0.00 C ATOM 1905 OD1 ASN A 123 13.676 -3.014 1.495 1.00 0.00 O ATOM 1906 ND2 ASN A 123 15.022 -4.809 1.394 1.00 0.00 N ATOM 0 H ASN A 123 11.238 -3.365 1.000 1.00 0.00 H new ATOM 0 HA ASN A 123 11.589 -5.505 -1.017 1.00 0.00 H new ATOM 0 HB2 ASN A 123 13.960 -5.313 -0.794 1.00 0.00 H new ATOM 0 HB3 ASN A 123 13.367 -3.687 -1.070 1.00 0.00 H new ATOM 0 HD21 ASN A 123 15.508 -4.548 2.252 1.00 0.00 H new ATOM 0 HD22 ASN A 123 15.290 -5.656 0.893 1.00 0.00 H new ATOM 1913 N ASN A 124 11.054 -5.687 2.026 1.00 0.00 N ATOM 1914 CA ASN A 124 10.923 -6.545 3.197 1.00 0.00 C ATOM 1915 C ASN A 124 9.643 -7.373 3.125 1.00 0.00 C ATOM 1916 O ASN A 124 9.013 -7.653 4.145 1.00 0.00 O ATOM 1917 CB ASN A 124 10.927 -5.703 4.475 1.00 0.00 C ATOM 1918 CG ASN A 124 12.080 -4.719 4.515 1.00 0.00 C ATOM 1919 OD1 ASN A 124 13.178 -5.012 4.042 1.00 0.00 O ATOM 1920 ND2 ASN A 124 11.834 -3.543 5.082 1.00 0.00 N ATOM 0 H ASN A 124 10.446 -4.868 2.033 1.00 0.00 H new ATOM 0 HA ASN A 124 11.774 -7.225 3.215 1.00 0.00 H new ATOM 0 HB2 ASN A 124 9.986 -5.159 4.551 1.00 0.00 H new ATOM 0 HB3 ASN A 124 10.985 -6.362 5.341 1.00 0.00 H new ATOM 0 HD21 ASN A 124 12.571 -2.840 5.138 1.00 0.00 H new ATOM 0 HD22 ASN A 124 10.908 -3.343 5.461 1.00 0.00 H new ATOM 1927 N LEU A 125 9.265 -7.762 1.912 1.00 0.00 N ATOM 1928 CA LEU A 125 8.061 -8.559 1.705 1.00 0.00 C ATOM 1929 C LEU A 125 8.185 -9.920 2.382 1.00 0.00 C ATOM 1930 O LEU A 125 9.258 -10.521 2.431 1.00 0.00 O ATOM 1931 CB LEU A 125 7.798 -8.743 0.209 1.00 0.00 C ATOM 1932 CG LEU A 125 7.200 -7.540 -0.521 1.00 0.00 C ATOM 1933 CD1 LEU A 125 7.330 -7.710 -2.026 1.00 0.00 C ATOM 1934 CD2 LEU A 125 5.742 -7.349 -0.127 1.00 0.00 C ATOM 0 H LEU A 125 9.775 -7.538 1.057 1.00 0.00 H new ATOM 0 HA LEU A 125 7.222 -8.027 2.153 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.739 -9.005 -0.275 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.126 -9.591 0.080 1.00 0.00 H new ATOM 0 HG LEU A 125 7.755 -6.649 -0.228 1.00 0.00 H new ATOM 0 HD11 LEU A 125 6.899 -6.844 -2.529 1.00 0.00 H new ATOM 0 HD12 LEU A 125 8.383 -7.797 -2.293 1.00 0.00 H new ATOM 0 HD13 LEU A 125 6.801 -8.611 -2.337 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.332 -6.489 -0.656 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.174 -8.241 -0.390 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.675 -7.180 0.948 1.00 0.00 H new ATOM 1946 N PRO A 126 7.061 -10.419 2.917 1.00 0.00 N ATOM 1947 CA PRO A 126 7.018 -11.716 3.599 1.00 0.00 C ATOM 1948 C PRO A 126 7.195 -12.884 2.635 1.00 0.00 C ATOM 1949 O PRO A 126 6.996 -12.742 1.429 1.00 0.00 O ATOM 1950 CB PRO A 126 5.619 -11.743 4.221 1.00 0.00 C ATOM 1951 CG PRO A 126 4.807 -10.834 3.366 1.00 0.00 C ATOM 1952 CD PRO A 126 5.746 -9.757 2.897 1.00 0.00 C ATOM 0 HA PRO A 126 7.824 -11.822 4.325 1.00 0.00 H new ATOM 0 HB2 PRO A 126 5.208 -12.753 4.227 1.00 0.00 H new ATOM 0 HB3 PRO A 126 5.639 -11.400 5.256 1.00 0.00 H new ATOM 0 HG2 PRO A 126 4.378 -11.373 2.521 1.00 0.00 H new ATOM 0 HG3 PRO A 126 3.975 -10.409 3.928 1.00 0.00 H new ATOM 0 HD2 PRO A 126 5.488 -9.406 1.898 1.00 0.00 H new ATOM 0 HD3 PRO A 126 5.723 -8.889 3.556 1.00 0.00 H new ATOM 1960 N VAL A 127 7.570 -14.040 3.175 1.00 0.00 N ATOM 1961 CA VAL A 127 7.772 -15.233 2.363 1.00 0.00 C ATOM 1962 C VAL A 127 6.459 -15.976 2.140 1.00 0.00 C ATOM 1963 O VAL A 127 6.282 -16.652 1.128 1.00 0.00 O ATOM 1964 CB VAL A 127 8.787 -16.191 3.016 1.00 0.00 C ATOM 1965 CG1 VAL A 127 8.268 -16.686 4.357 1.00 0.00 C ATOM 1966 CG2 VAL A 127 9.089 -17.359 2.088 1.00 0.00 C ATOM 0 H VAL A 127 7.740 -14.175 4.172 1.00 0.00 H new ATOM 0 HA VAL A 127 8.164 -14.899 1.402 1.00 0.00 H new ATOM 0 HB VAL A 127 9.714 -15.646 3.191 1.00 0.00 H new ATOM 0 HG11 VAL A 127 8.998 -17.361 4.803 1.00 0.00 H new ATOM 0 HG12 VAL A 127 8.107 -15.837 5.021 1.00 0.00 H new ATOM 0 HG13 VAL A 127 7.327 -17.216 4.210 1.00 0.00 H new ATOM 0 HG21 VAL A 127 9.808 -18.026 2.564 1.00 0.00 H new ATOM 0 HG22 VAL A 127 8.169 -17.906 1.880 1.00 0.00 H new ATOM 0 HG23 VAL A 127 9.507 -16.983 1.154 1.00 0.00 H new ATOM 1976 N GLU A 128 5.542 -15.844 3.094 1.00 0.00 N ATOM 1977 CA GLU A 128 4.245 -16.503 3.001 1.00 0.00 C ATOM 1978 C GLU A 128 3.453 -15.981 1.806 1.00 0.00 C ATOM 1979 O GLU A 128 2.882 -16.756 1.040 1.00 0.00 O ATOM 1980 CB GLU A 128 3.447 -16.290 4.289 1.00 0.00 C ATOM 1981 CG GLU A 128 3.903 -17.170 5.441 1.00 0.00 C ATOM 1982 CD GLU A 128 3.388 -18.592 5.328 1.00 0.00 C ATOM 1983 OE1 GLU A 128 2.333 -18.793 4.691 1.00 0.00 O ATOM 1984 OE2 GLU A 128 4.041 -19.504 5.877 1.00 0.00 O ATOM 0 H GLU A 128 5.673 -15.287 3.939 1.00 0.00 H new ATOM 0 HA GLU A 128 4.418 -17.570 2.861 1.00 0.00 H new ATOM 0 HB2 GLU A 128 3.528 -15.245 4.588 1.00 0.00 H new ATOM 0 HB3 GLU A 128 2.393 -16.484 4.090 1.00 0.00 H new ATOM 0 HG2 GLU A 128 4.992 -17.184 5.474 1.00 0.00 H new ATOM 0 HG3 GLU A 128 3.561 -16.737 6.381 1.00 0.00 H new ATOM 1991 N SER A 129 3.424 -14.660 1.655 1.00 0.00 N ATOM 1992 CA SER A 129 2.698 -14.033 0.557 1.00 0.00 C ATOM 1993 C SER A 129 2.801 -14.873 -0.712 1.00 0.00 C ATOM 1994 O SER A 129 1.790 -15.301 -1.270 1.00 0.00 O ATOM 1995 CB SER A 129 3.242 -12.627 0.296 1.00 0.00 C ATOM 1996 OG SER A 129 2.625 -11.675 1.146 1.00 0.00 O ATOM 0 H SER A 129 3.895 -14.004 2.279 1.00 0.00 H new ATOM 0 HA SER A 129 1.648 -13.963 0.841 1.00 0.00 H new ATOM 0 HB2 SER A 129 4.320 -12.616 0.455 1.00 0.00 H new ATOM 0 HB3 SER A 129 3.070 -12.355 -0.745 1.00 0.00 H new ATOM 0 HG SER A 129 2.742 -10.777 0.771 1.00 0.00 H new ATOM 2002 N TRP A 130 4.028 -15.105 -1.163 1.00 0.00 N ATOM 2003 CA TRP A 130 4.264 -15.895 -2.366 1.00 0.00 C ATOM 2004 C TRP A 130 4.241 -17.386 -2.052 1.00 0.00 C ATOM 2005 O TRP A 130 3.728 -18.185 -2.835 1.00 0.00 O ATOM 2006 CB TRP A 130 5.605 -15.514 -2.996 1.00 0.00 C ATOM 2007 CG TRP A 130 6.788 -15.964 -2.191 1.00 0.00 C ATOM 2008 CD1 TRP A 130 7.608 -15.180 -1.432 1.00 0.00 C ATOM 2009 CD2 TRP A 130 7.282 -17.302 -2.069 1.00 0.00 C ATOM 2010 NE1 TRP A 130 8.583 -15.950 -0.845 1.00 0.00 N ATOM 2011 CE2 TRP A 130 8.404 -17.255 -1.219 1.00 0.00 C ATOM 2012 CE3 TRP A 130 6.885 -18.535 -2.593 1.00 0.00 C ATOM 2013 CZ2 TRP A 130 9.132 -18.394 -0.884 1.00 0.00 C ATOM 2014 CZ3 TRP A 130 7.608 -19.664 -2.260 1.00 0.00 C ATOM 2015 CH2 TRP A 130 8.721 -19.588 -1.412 1.00 0.00 C ATOM 0 H TRP A 130 4.875 -14.757 -0.714 1.00 0.00 H new ATOM 0 HA TRP A 130 3.464 -15.680 -3.074 1.00 0.00 H new ATOM 0 HB2 TRP A 130 5.666 -15.949 -3.994 1.00 0.00 H new ATOM 0 HB3 TRP A 130 5.647 -14.432 -3.117 1.00 0.00 H new ATOM 0 HD1 TRP A 130 7.506 -14.112 -1.311 1.00 0.00 H new ATOM 0 HE1 TRP A 130 9.320 -15.605 -0.230 1.00 0.00 H new ATOM 0 HE3 TRP A 130 6.028 -18.604 -3.247 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 9.990 -18.337 -0.231 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 7.310 -20.622 -2.660 1.00 0.00 H new ATOM 0 HH2 TRP A 130 9.265 -20.489 -1.170 1.00 0.00 H new ATOM 2026 N GLN A 131 4.798 -17.754 -0.903 1.00 0.00 N ATOM 2027 CA GLN A 131 4.841 -19.151 -0.488 1.00 0.00 C ATOM 2028 C GLN A 131 3.459 -19.633 -0.059 1.00 0.00 C ATOM 2029 O GLN A 131 3.123 -20.808 -0.218 1.00 0.00 O ATOM 2030 CB GLN A 131 5.836 -19.333 0.660 1.00 0.00 C ATOM 2031 CG GLN A 131 6.105 -20.789 1.005 1.00 0.00 C ATOM 2032 CD GLN A 131 7.423 -20.983 1.729 1.00 0.00 C ATOM 2033 OE1 GLN A 131 7.581 -20.566 2.877 1.00 0.00 O ATOM 2034 NE2 GLN A 131 8.378 -21.619 1.061 1.00 0.00 N ATOM 0 H GLN A 131 5.226 -17.104 -0.243 1.00 0.00 H new ATOM 0 HA GLN A 131 5.166 -19.748 -1.340 1.00 0.00 H new ATOM 0 HB2 GLN A 131 6.777 -18.851 0.394 1.00 0.00 H new ATOM 0 HB3 GLN A 131 5.455 -18.823 1.545 1.00 0.00 H new ATOM 0 HG2 GLN A 131 5.294 -21.167 1.627 1.00 0.00 H new ATOM 0 HG3 GLN A 131 6.107 -21.381 0.090 1.00 0.00 H new ATOM 0 HE21 GLN A 131 8.204 -21.948 0.111 1.00 0.00 H new ATOM 0 HE22 GLN A 131 9.286 -21.779 1.498 1.00 0.00 H new