USER MOD reduce.3.24.130724 H: found=0, std=0, add=918, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 920 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 124 MET CE :methyl 151:sc= -0.455 (180deg=-0.0767) USER MOD Set 1.2: A 144 MET CE :methyl -120:sc= -0.355 (180deg=0) USER MOD Set 2.1: A 94 LYS NZ :NH3+ -124:sc= 0.242 (180deg=0) USER MOD Set 2.2: A 107 HIS :FLIP no HD1:sc= -0.107 F(o=-1.5,f=0.14) USER MOD Set 3.1: A 60 ASN : amide:sc= -2.49 K(o=-2.5,f=-14!) USER MOD Set 3.2: A 62 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 36 MET CE :methyl 141:sc= -1.87 (180deg=-0.507) USER MOD Set 4.2: A 51 MET CE :methyl -177:sc= -1.49 (180deg=-1.4) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= -0.28 (180deg=-0.28) USER MOD Single : A 26 THR OG1 : rot -88:sc= 1.02 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 75:sc= 0.183 USER MOD Single : A 41 GLN : amide:sc= -0.391 X(o=-0.39,f=-0.57) USER MOD Single : A 42 ASN : amide:sc= -2.99! C(o=-3!,f=-4.1!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN :FLIP amide:sc= -0.655 F(o=-1.5!,f=-0.66) USER MOD Single : A 53 ASN : amide:sc= 0.614 K(o=0.61,f=-0.026) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl 177:sc= -1.39 (180deg=-1.45) USER MOD Single : A 72 MET CE :methyl 157:sc= -0.0579 (180deg=-0.4) USER MOD Single : A 97 ASN : amide:sc= -2.91 K(o=-2.9,f=-9.4!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0.0145 USER MOD Single : A 109 MET CE :methyl 164:sc= -1.03 (180deg=-1.23) USER MOD Single : A 110 THR OG1 : rot 68:sc= 0.199 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 161:sc= -0.0356 (180deg=-0.309) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=-0.0052) USER MOD Single : A 137 ASN : amide:sc= -1.41 K(o=-1.4,f=-9.4!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 145 MET CE :methyl 163:sc= -0.264 (180deg=-0.662) USER MOD Single : A 146 THR OG1 : rot 62:sc= 0.7 USER MOD ----------------------------------------------------------------- ATOM 120 N ILE A 9 -3.464 -2.717 -15.243 1.00 0.00 N ATOM 121 CA ILE A 9 -2.391 -3.694 -15.106 1.00 0.00 C ATOM 122 C ILE A 9 -1.176 -3.296 -15.936 1.00 0.00 C ATOM 123 O ILE A 9 -0.044 -3.331 -15.454 1.00 0.00 O ATOM 124 CB ILE A 9 -2.853 -5.100 -15.533 1.00 0.00 C ATOM 125 CG1 ILE A 9 -4.212 -5.426 -14.911 1.00 0.00 C ATOM 126 CG2 ILE A 9 -1.818 -6.141 -15.134 1.00 0.00 C ATOM 127 CD1 ILE A 9 -4.268 -5.180 -13.419 1.00 0.00 C ATOM 0 HA ILE A 9 -2.116 -3.715 -14.052 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.958 -5.118 -16.618 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.979 -4.825 -15.399 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -4.452 -6.471 -15.108 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -2.159 -7.129 -15.442 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -0.869 -5.916 -15.621 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -1.684 -6.125 -14.052 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -5.260 -5.432 -13.046 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -3.524 -5.801 -12.920 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -4.060 -4.130 -13.215 1.00 0.00 H new ATOM 139 N ALA A 10 -1.418 -2.917 -17.187 1.00 0.00 N ATOM 140 CA ALA A 10 -0.344 -2.508 -18.083 1.00 0.00 C ATOM 141 C ALA A 10 0.437 -1.333 -17.504 1.00 0.00 C ATOM 142 O ALA A 10 1.665 -1.306 -17.559 1.00 0.00 O ATOM 143 CB ALA A 10 -0.906 -2.149 -19.451 1.00 0.00 C ATOM 0 H ALA A 10 -2.349 -2.885 -17.603 1.00 0.00 H new ATOM 0 HA ALA A 10 0.343 -3.347 -18.194 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -0.093 -1.845 -20.110 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -1.412 -3.016 -19.875 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -1.616 -1.328 -19.349 1.00 0.00 H new ATOM 149 N GLU A 11 -0.286 -0.363 -16.952 1.00 0.00 N ATOM 150 CA GLU A 11 0.341 0.815 -16.365 1.00 0.00 C ATOM 151 C GLU A 11 1.261 0.425 -15.212 1.00 0.00 C ATOM 152 O GLU A 11 2.404 0.877 -15.134 1.00 0.00 O ATOM 153 CB GLU A 11 -0.726 1.795 -15.871 1.00 0.00 C ATOM 154 CG GLU A 11 -1.566 2.393 -16.987 1.00 0.00 C ATOM 155 CD GLU A 11 -2.129 3.754 -16.627 1.00 0.00 C ATOM 156 OE1 GLU A 11 -2.925 3.831 -15.667 1.00 0.00 O ATOM 157 OE2 GLU A 11 -1.776 4.741 -17.305 1.00 0.00 O ATOM 0 H GLU A 11 -1.305 -0.370 -16.899 1.00 0.00 H new ATOM 0 HA GLU A 11 0.940 1.299 -17.137 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -1.383 1.281 -15.169 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -0.240 2.601 -15.321 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -0.958 2.482 -17.887 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -2.386 1.715 -17.223 1.00 0.00 H new ATOM 164 N PHE A 12 0.755 -0.418 -14.318 1.00 0.00 N ATOM 165 CA PHE A 12 1.530 -0.869 -13.168 1.00 0.00 C ATOM 166 C PHE A 12 2.534 -1.943 -13.576 1.00 0.00 C ATOM 167 O PHE A 12 3.512 -2.195 -12.871 1.00 0.00 O ATOM 168 CB PHE A 12 0.600 -1.412 -12.081 1.00 0.00 C ATOM 169 CG PHE A 12 -0.192 -0.344 -11.381 1.00 0.00 C ATOM 170 CD1 PHE A 12 -1.430 0.048 -11.864 1.00 0.00 C ATOM 171 CD2 PHE A 12 0.303 0.268 -10.241 1.00 0.00 C ATOM 172 CE1 PHE A 12 -2.161 1.030 -11.223 1.00 0.00 C ATOM 173 CE2 PHE A 12 -0.424 1.250 -9.595 1.00 0.00 C ATOM 174 CZ PHE A 12 -1.657 1.633 -10.087 1.00 0.00 C ATOM 0 H PHE A 12 -0.188 -0.803 -14.368 1.00 0.00 H new ATOM 0 HA PHE A 12 2.079 -0.014 -12.774 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -0.088 -2.129 -12.528 1.00 0.00 H new ATOM 0 HB3 PHE A 12 1.193 -1.955 -11.345 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -1.829 -0.420 -12.752 1.00 0.00 H new ATOM 0 HD2 PHE A 12 1.267 -0.025 -9.853 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -3.125 1.326 -11.610 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -0.028 1.718 -8.706 1.00 0.00 H new ATOM 0 HZ PHE A 12 -2.225 2.402 -9.585 1.00 0.00 H new ATOM 184 N LYS A 13 2.285 -2.574 -14.718 1.00 0.00 N ATOM 185 CA LYS A 13 3.167 -3.620 -15.223 1.00 0.00 C ATOM 186 C LYS A 13 4.614 -3.139 -15.266 1.00 0.00 C ATOM 187 O LYS A 13 5.482 -3.698 -14.596 1.00 0.00 O ATOM 188 CB LYS A 13 2.723 -4.059 -16.620 1.00 0.00 C ATOM 189 CG LYS A 13 3.021 -5.518 -16.923 1.00 0.00 C ATOM 190 CD LYS A 13 1.847 -6.413 -16.564 1.00 0.00 C ATOM 191 CE LYS A 13 0.906 -6.597 -17.745 1.00 0.00 C ATOM 192 NZ LYS A 13 1.371 -7.675 -18.662 1.00 0.00 N ATOM 0 H LYS A 13 1.479 -2.379 -15.312 1.00 0.00 H new ATOM 0 HA LYS A 13 3.106 -4.471 -14.544 1.00 0.00 H new ATOM 0 HB2 LYS A 13 1.652 -3.887 -16.722 1.00 0.00 H new ATOM 0 HB3 LYS A 13 3.219 -3.434 -17.363 1.00 0.00 H new ATOM 0 HG2 LYS A 13 3.255 -5.630 -17.982 1.00 0.00 H new ATOM 0 HG3 LYS A 13 3.904 -5.833 -16.366 1.00 0.00 H new ATOM 0 HD2 LYS A 13 2.216 -7.385 -16.236 1.00 0.00 H new ATOM 0 HD3 LYS A 13 1.301 -5.980 -15.726 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -0.093 -6.837 -17.380 1.00 0.00 H new ATOM 0 HE3 LYS A 13 0.828 -5.660 -18.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 0.703 -7.769 -19.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 2.313 -7.435 -19.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 1.422 -8.575 -18.143 1.00 0.00 H new ATOM 206 N GLU A 14 4.864 -2.100 -16.056 1.00 0.00 N ATOM 207 CA GLU A 14 6.207 -1.545 -16.184 1.00 0.00 C ATOM 208 C GLU A 14 6.803 -1.242 -14.812 1.00 0.00 C ATOM 209 O GLU A 14 7.953 -1.581 -14.535 1.00 0.00 O ATOM 210 CB GLU A 14 6.177 -0.272 -17.032 1.00 0.00 C ATOM 211 CG GLU A 14 5.573 -0.473 -18.411 1.00 0.00 C ATOM 212 CD GLU A 14 6.597 -0.918 -19.438 1.00 0.00 C ATOM 213 OE1 GLU A 14 7.612 -0.211 -19.606 1.00 0.00 O ATOM 214 OE2 GLU A 14 6.382 -1.972 -20.072 1.00 0.00 O ATOM 0 H GLU A 14 4.156 -1.626 -16.616 1.00 0.00 H new ATOM 0 HA GLU A 14 6.834 -2.287 -16.678 1.00 0.00 H new ATOM 0 HB2 GLU A 14 5.608 0.493 -16.504 1.00 0.00 H new ATOM 0 HB3 GLU A 14 7.194 0.105 -17.142 1.00 0.00 H new ATOM 0 HG2 GLU A 14 4.778 -1.216 -18.350 1.00 0.00 H new ATOM 0 HG3 GLU A 14 5.114 0.459 -18.742 1.00 0.00 H new ATOM 221 N ALA A 15 6.012 -0.600 -13.958 1.00 0.00 N ATOM 222 CA ALA A 15 6.460 -0.252 -12.616 1.00 0.00 C ATOM 223 C ALA A 15 6.757 -1.502 -11.795 1.00 0.00 C ATOM 224 O ALA A 15 7.602 -1.483 -10.899 1.00 0.00 O ATOM 225 CB ALA A 15 5.416 0.605 -11.916 1.00 0.00 C ATOM 0 H ALA A 15 5.058 -0.311 -14.172 1.00 0.00 H new ATOM 0 HA ALA A 15 7.383 0.320 -12.706 1.00 0.00 H new ATOM 0 HB1 ALA A 15 5.764 0.857 -10.914 1.00 0.00 H new ATOM 0 HB2 ALA A 15 5.255 1.520 -12.486 1.00 0.00 H new ATOM 0 HB3 ALA A 15 4.479 0.052 -11.846 1.00 0.00 H new ATOM 231 N PHE A 16 6.057 -2.588 -12.105 1.00 0.00 N ATOM 232 CA PHE A 16 6.245 -3.848 -11.394 1.00 0.00 C ATOM 233 C PHE A 16 7.312 -4.702 -12.073 1.00 0.00 C ATOM 234 O PHE A 16 7.752 -5.714 -11.528 1.00 0.00 O ATOM 235 CB PHE A 16 4.926 -4.620 -11.325 1.00 0.00 C ATOM 236 CG PHE A 16 5.003 -5.863 -10.485 1.00 0.00 C ATOM 237 CD1 PHE A 16 5.004 -5.781 -9.102 1.00 0.00 C ATOM 238 CD2 PHE A 16 5.073 -7.113 -11.078 1.00 0.00 C ATOM 239 CE1 PHE A 16 5.075 -6.923 -8.326 1.00 0.00 C ATOM 240 CE2 PHE A 16 5.144 -8.259 -10.308 1.00 0.00 C ATOM 241 CZ PHE A 16 5.144 -8.163 -8.930 1.00 0.00 C ATOM 0 H PHE A 16 5.354 -2.621 -12.844 1.00 0.00 H new ATOM 0 HA PHE A 16 6.578 -3.619 -10.382 1.00 0.00 H new ATOM 0 HB2 PHE A 16 4.152 -3.966 -10.923 1.00 0.00 H new ATOM 0 HB3 PHE A 16 4.620 -4.892 -12.335 1.00 0.00 H new ATOM 0 HD1 PHE A 16 4.949 -4.814 -8.625 1.00 0.00 H new ATOM 0 HD2 PHE A 16 5.072 -7.193 -12.155 1.00 0.00 H new ATOM 0 HE1 PHE A 16 5.077 -6.845 -7.249 1.00 0.00 H new ATOM 0 HE2 PHE A 16 5.199 -9.227 -10.783 1.00 0.00 H new ATOM 0 HZ PHE A 16 5.198 -9.057 -8.326 1.00 0.00 H new ATOM 251 N SER A 17 7.723 -4.286 -13.267 1.00 0.00 N ATOM 252 CA SER A 17 8.735 -5.014 -14.024 1.00 0.00 C ATOM 253 C SER A 17 10.136 -4.531 -13.661 1.00 0.00 C ATOM 254 O SER A 17 11.069 -5.327 -13.547 1.00 0.00 O ATOM 255 CB SER A 17 8.498 -4.846 -15.526 1.00 0.00 C ATOM 256 OG SER A 17 7.653 -5.867 -16.027 1.00 0.00 O ATOM 0 H SER A 17 7.371 -3.449 -13.731 1.00 0.00 H new ATOM 0 HA SER A 17 8.656 -6.070 -13.767 1.00 0.00 H new ATOM 0 HB2 SER A 17 8.050 -3.871 -15.720 1.00 0.00 H new ATOM 0 HB3 SER A 17 9.452 -4.869 -16.053 1.00 0.00 H new ATOM 0 HG SER A 17 7.516 -5.736 -16.988 1.00 0.00 H new ATOM 262 N LEU A 18 10.276 -3.223 -13.480 1.00 0.00 N ATOM 263 CA LEU A 18 11.563 -2.632 -13.130 1.00 0.00 C ATOM 264 C LEU A 18 12.104 -3.234 -11.838 1.00 0.00 C ATOM 265 O LEU A 18 13.295 -3.527 -11.728 1.00 0.00 O ATOM 266 CB LEU A 18 11.426 -1.116 -12.982 1.00 0.00 C ATOM 267 CG LEU A 18 10.616 -0.629 -11.780 1.00 0.00 C ATOM 268 CD1 LEU A 18 11.521 -0.412 -10.578 1.00 0.00 C ATOM 269 CD2 LEU A 18 9.868 0.651 -12.125 1.00 0.00 C ATOM 0 H LEU A 18 9.514 -2.551 -13.570 1.00 0.00 H new ATOM 0 HA LEU A 18 12.267 -2.850 -13.933 1.00 0.00 H new ATOM 0 HB2 LEU A 18 12.425 -0.685 -12.920 1.00 0.00 H new ATOM 0 HB3 LEU A 18 10.966 -0.723 -13.888 1.00 0.00 H new ATOM 0 HG LEU A 18 9.885 -1.396 -11.524 1.00 0.00 H new ATOM 0 HD11 LEU A 18 10.926 -0.066 -9.733 1.00 0.00 H new ATOM 0 HD12 LEU A 18 12.011 -1.350 -10.317 1.00 0.00 H new ATOM 0 HD13 LEU A 18 12.276 0.336 -10.821 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.297 0.983 -11.258 1.00 0.00 H new ATOM 0 HD22 LEU A 18 10.582 1.425 -12.408 1.00 0.00 H new ATOM 0 HD23 LEU A 18 9.189 0.463 -12.957 1.00 0.00 H new ATOM 281 N PHE A 19 11.222 -3.418 -10.861 1.00 0.00 N ATOM 282 CA PHE A 19 11.611 -3.987 -9.576 1.00 0.00 C ATOM 283 C PHE A 19 11.934 -5.472 -9.714 1.00 0.00 C ATOM 284 O PHE A 19 12.996 -5.929 -9.291 1.00 0.00 O ATOM 285 CB PHE A 19 10.495 -3.790 -8.548 1.00 0.00 C ATOM 286 CG PHE A 19 10.577 -2.479 -7.819 1.00 0.00 C ATOM 287 CD1 PHE A 19 11.524 -2.280 -6.827 1.00 0.00 C ATOM 288 CD2 PHE A 19 9.707 -1.445 -8.126 1.00 0.00 C ATOM 289 CE1 PHE A 19 11.602 -1.075 -6.155 1.00 0.00 C ATOM 290 CE2 PHE A 19 9.780 -0.238 -7.457 1.00 0.00 C ATOM 291 CZ PHE A 19 10.728 -0.053 -6.470 1.00 0.00 C ATOM 0 H PHE A 19 10.233 -3.181 -10.935 1.00 0.00 H new ATOM 0 HA PHE A 19 12.507 -3.468 -9.234 1.00 0.00 H new ATOM 0 HB2 PHE A 19 9.531 -3.857 -9.053 1.00 0.00 H new ATOM 0 HB3 PHE A 19 10.532 -4.603 -7.823 1.00 0.00 H new ATOM 0 HD1 PHE A 19 12.209 -3.076 -6.576 1.00 0.00 H new ATOM 0 HD2 PHE A 19 8.963 -1.584 -8.897 1.00 0.00 H new ATOM 0 HE1 PHE A 19 12.345 -0.933 -5.385 1.00 0.00 H new ATOM 0 HE2 PHE A 19 9.096 0.560 -7.706 1.00 0.00 H new ATOM 0 HZ PHE A 19 10.786 0.889 -5.945 1.00 0.00 H new ATOM 301 N ASP A 20 11.011 -6.219 -10.309 1.00 0.00 N ATOM 302 CA ASP A 20 11.196 -7.653 -10.503 1.00 0.00 C ATOM 303 C ASP A 20 12.368 -7.927 -11.440 1.00 0.00 C ATOM 304 O ASP A 20 12.246 -7.799 -12.659 1.00 0.00 O ATOM 305 CB ASP A 20 9.920 -8.282 -11.065 1.00 0.00 C ATOM 306 CG ASP A 20 9.886 -9.786 -10.880 1.00 0.00 C ATOM 307 OD1 ASP A 20 10.958 -10.378 -10.638 1.00 0.00 O ATOM 308 OD2 ASP A 20 8.787 -10.372 -10.979 1.00 0.00 O ATOM 0 H ASP A 20 10.127 -5.856 -10.665 1.00 0.00 H new ATOM 0 HA ASP A 20 11.416 -8.101 -9.534 1.00 0.00 H new ATOM 0 HB2 ASP A 20 9.053 -7.839 -10.574 1.00 0.00 H new ATOM 0 HB3 ASP A 20 9.840 -8.048 -12.126 1.00 0.00 H new ATOM 313 N LYS A 21 13.504 -8.304 -10.863 1.00 0.00 N ATOM 314 CA LYS A 21 14.699 -8.596 -11.645 1.00 0.00 C ATOM 315 C LYS A 21 14.726 -10.061 -12.070 1.00 0.00 C ATOM 316 O LYS A 21 15.041 -10.378 -13.217 1.00 0.00 O ATOM 317 CB LYS A 21 15.956 -8.266 -10.837 1.00 0.00 C ATOM 318 CG LYS A 21 15.868 -6.947 -10.087 1.00 0.00 C ATOM 319 CD LYS A 21 15.895 -5.763 -11.039 1.00 0.00 C ATOM 320 CE LYS A 21 16.361 -4.496 -10.339 1.00 0.00 C ATOM 321 NZ LYS A 21 17.838 -4.328 -10.422 1.00 0.00 N ATOM 0 H LYS A 21 13.622 -8.414 -9.856 1.00 0.00 H new ATOM 0 HA LYS A 21 14.677 -7.976 -12.541 1.00 0.00 H new ATOM 0 HB2 LYS A 21 16.140 -9.069 -10.123 1.00 0.00 H new ATOM 0 HB3 LYS A 21 16.813 -8.235 -11.510 1.00 0.00 H new ATOM 0 HG2 LYS A 21 14.950 -6.922 -9.499 1.00 0.00 H new ATOM 0 HG3 LYS A 21 16.698 -6.870 -9.385 1.00 0.00 H new ATOM 0 HD2 LYS A 21 16.558 -5.983 -11.876 1.00 0.00 H new ATOM 0 HD3 LYS A 21 14.899 -5.606 -11.454 1.00 0.00 H new ATOM 0 HE2 LYS A 21 15.871 -3.632 -10.788 1.00 0.00 H new ATOM 0 HE3 LYS A 21 16.057 -4.526 -9.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 18.116 -3.453 -9.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 18.306 -5.140 -9.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 18.126 -4.273 -11.420 1.00 0.00 H new ATOM 335 N ASP A 22 14.393 -10.949 -11.140 1.00 0.00 N ATOM 336 CA ASP A 22 14.377 -12.380 -11.419 1.00 0.00 C ATOM 337 C ASP A 22 13.346 -12.712 -12.494 1.00 0.00 C ATOM 338 O ASP A 22 13.640 -13.428 -13.450 1.00 0.00 O ATOM 339 CB ASP A 22 14.073 -13.167 -10.143 1.00 0.00 C ATOM 340 CG ASP A 22 12.980 -12.524 -9.313 1.00 0.00 C ATOM 341 OD1 ASP A 22 11.828 -12.463 -9.792 1.00 0.00 O ATOM 342 OD2 ASP A 22 13.276 -12.081 -8.183 1.00 0.00 O ATOM 0 H ASP A 22 14.130 -10.703 -10.186 1.00 0.00 H new ATOM 0 HA ASP A 22 15.363 -12.665 -11.786 1.00 0.00 H new ATOM 0 HB2 ASP A 22 13.775 -14.182 -10.408 1.00 0.00 H new ATOM 0 HB3 ASP A 22 14.980 -13.247 -9.544 1.00 0.00 H new ATOM 347 N GLY A 23 12.136 -12.186 -12.329 1.00 0.00 N ATOM 348 CA GLY A 23 11.080 -12.439 -13.292 1.00 0.00 C ATOM 349 C GLY A 23 10.105 -13.499 -12.818 1.00 0.00 C ATOM 350 O GLY A 23 9.611 -14.298 -13.614 1.00 0.00 O ATOM 0 H GLY A 23 11.868 -11.590 -11.546 1.00 0.00 H new ATOM 0 HA2 GLY A 23 10.539 -11.513 -13.485 1.00 0.00 H new ATOM 0 HA3 GLY A 23 11.522 -12.753 -14.237 1.00 0.00 H new ATOM 354 N ASP A 24 9.829 -13.507 -11.519 1.00 0.00 N ATOM 355 CA ASP A 24 8.907 -14.478 -10.940 1.00 0.00 C ATOM 356 C ASP A 24 7.527 -13.861 -10.734 1.00 0.00 C ATOM 357 O ASP A 24 6.516 -14.425 -11.149 1.00 0.00 O ATOM 358 CB ASP A 24 9.451 -14.998 -9.608 1.00 0.00 C ATOM 359 CG ASP A 24 9.237 -14.017 -8.473 1.00 0.00 C ATOM 360 OD1 ASP A 24 8.106 -13.957 -7.945 1.00 0.00 O ATOM 361 OD2 ASP A 24 10.200 -13.311 -8.110 1.00 0.00 O ATOM 0 H ASP A 24 10.230 -12.853 -10.847 1.00 0.00 H new ATOM 0 HA ASP A 24 8.812 -15.312 -11.635 1.00 0.00 H new ATOM 0 HB2 ASP A 24 8.965 -15.943 -9.364 1.00 0.00 H new ATOM 0 HB3 ASP A 24 10.516 -15.205 -9.710 1.00 0.00 H new ATOM 366 N GLY A 25 7.494 -12.699 -10.088 1.00 0.00 N ATOM 367 CA GLY A 25 6.234 -12.026 -9.836 1.00 0.00 C ATOM 368 C GLY A 25 6.112 -11.538 -8.406 1.00 0.00 C ATOM 369 O GLY A 25 5.016 -11.221 -7.941 1.00 0.00 O ATOM 0 H GLY A 25 8.318 -12.212 -9.735 1.00 0.00 H new ATOM 0 HA2 GLY A 25 6.136 -11.179 -10.515 1.00 0.00 H new ATOM 0 HA3 GLY A 25 5.412 -12.707 -10.055 1.00 0.00 H new ATOM 373 N THR A 26 7.239 -11.479 -7.705 1.00 0.00 N ATOM 374 CA THR A 26 7.254 -11.030 -6.318 1.00 0.00 C ATOM 375 C THR A 26 8.456 -10.133 -6.044 1.00 0.00 C ATOM 376 O THR A 26 9.558 -10.391 -6.528 1.00 0.00 O ATOM 377 CB THR A 26 7.283 -12.221 -5.342 1.00 0.00 C ATOM 378 OG1 THR A 26 8.448 -13.019 -5.578 1.00 0.00 O ATOM 379 CG2 THR A 26 6.036 -13.077 -5.496 1.00 0.00 C ATOM 0 H THR A 26 8.154 -11.737 -8.075 1.00 0.00 H new ATOM 0 HA THR A 26 6.337 -10.463 -6.159 1.00 0.00 H new ATOM 0 HB THR A 26 7.312 -11.829 -4.325 1.00 0.00 H new ATOM 0 HG1 THR A 26 8.252 -13.689 -6.266 1.00 0.00 H new ATOM 0 HG21 THR A 26 6.079 -13.912 -4.797 1.00 0.00 H new ATOM 0 HG22 THR A 26 5.153 -12.474 -5.287 1.00 0.00 H new ATOM 0 HG23 THR A 26 5.981 -13.460 -6.515 1.00 0.00 H new ATOM 387 N ILE A 27 8.236 -9.079 -5.265 1.00 0.00 N ATOM 388 CA ILE A 27 9.303 -8.145 -4.925 1.00 0.00 C ATOM 389 C ILE A 27 9.803 -8.376 -3.503 1.00 0.00 C ATOM 390 O ILE A 27 9.088 -8.127 -2.532 1.00 0.00 O ATOM 391 CB ILE A 27 8.836 -6.684 -5.062 1.00 0.00 C ATOM 392 CG1 ILE A 27 8.422 -6.391 -6.505 1.00 0.00 C ATOM 393 CG2 ILE A 27 9.937 -5.733 -4.617 1.00 0.00 C ATOM 394 CD1 ILE A 27 7.669 -5.089 -6.665 1.00 0.00 C ATOM 0 H ILE A 27 7.329 -8.850 -4.858 1.00 0.00 H new ATOM 0 HA ILE A 27 10.117 -8.325 -5.627 1.00 0.00 H new ATOM 0 HB ILE A 27 7.970 -6.533 -4.418 1.00 0.00 H new ATOM 0 HG12 ILE A 27 9.313 -6.365 -7.132 1.00 0.00 H new ATOM 0 HG13 ILE A 27 7.800 -7.208 -6.869 1.00 0.00 H new ATOM 0 HG21 ILE A 27 9.592 -4.704 -4.719 1.00 0.00 H new ATOM 0 HG22 ILE A 27 10.188 -5.929 -3.575 1.00 0.00 H new ATOM 0 HG23 ILE A 27 10.820 -5.883 -5.238 1.00 0.00 H new ATOM 0 HD11 ILE A 27 7.407 -4.946 -7.713 1.00 0.00 H new ATOM 0 HD12 ILE A 27 6.760 -5.119 -6.065 1.00 0.00 H new ATOM 0 HD13 ILE A 27 8.297 -4.262 -6.332 1.00 0.00 H new ATOM 406 N THR A 28 11.039 -8.853 -3.387 1.00 0.00 N ATOM 407 CA THR A 28 11.637 -9.117 -2.084 1.00 0.00 C ATOM 408 C THR A 28 12.730 -8.104 -1.765 1.00 0.00 C ATOM 409 O THR A 28 13.141 -7.326 -2.627 1.00 0.00 O ATOM 410 CB THR A 28 12.231 -10.536 -2.016 1.00 0.00 C ATOM 411 OG1 THR A 28 13.348 -10.643 -2.906 1.00 0.00 O ATOM 412 CG2 THR A 28 11.185 -11.579 -2.380 1.00 0.00 C ATOM 0 H THR A 28 11.645 -9.064 -4.180 1.00 0.00 H new ATOM 0 HA THR A 28 10.839 -9.030 -1.346 1.00 0.00 H new ATOM 0 HB THR A 28 12.562 -10.718 -0.994 1.00 0.00 H new ATOM 0 HG1 THR A 28 13.721 -11.548 -2.855 1.00 0.00 H new ATOM 0 HG21 THR A 28 11.628 -12.573 -2.325 1.00 0.00 H new ATOM 0 HG22 THR A 28 10.349 -11.515 -1.683 1.00 0.00 H new ATOM 0 HG23 THR A 28 10.827 -11.397 -3.393 1.00 0.00 H new ATOM 420 N THR A 29 13.200 -8.119 -0.522 1.00 0.00 N ATOM 421 CA THR A 29 14.247 -7.202 -0.089 1.00 0.00 C ATOM 422 C THR A 29 15.354 -7.100 -1.131 1.00 0.00 C ATOM 423 O THR A 29 16.003 -6.062 -1.264 1.00 0.00 O ATOM 424 CB THR A 29 14.860 -7.642 1.254 1.00 0.00 C ATOM 425 OG1 THR A 29 15.426 -8.951 1.128 1.00 0.00 O ATOM 426 CG2 THR A 29 13.810 -7.641 2.354 1.00 0.00 C ATOM 0 H THR A 29 12.872 -8.757 0.203 1.00 0.00 H new ATOM 0 HA THR A 29 13.779 -6.226 0.037 1.00 0.00 H new ATOM 0 HB THR A 29 15.643 -6.932 1.521 1.00 0.00 H new ATOM 0 HG1 THR A 29 15.815 -9.223 1.985 1.00 0.00 H new ATOM 0 HG21 THR A 29 14.266 -7.955 3.293 1.00 0.00 H new ATOM 0 HG22 THR A 29 13.402 -6.636 2.467 1.00 0.00 H new ATOM 0 HG23 THR A 29 13.008 -8.331 2.092 1.00 0.00 H new ATOM 434 N LYS A 30 15.566 -8.184 -1.871 1.00 0.00 N ATOM 435 CA LYS A 30 16.594 -8.217 -2.904 1.00 0.00 C ATOM 436 C LYS A 30 16.241 -7.279 -4.054 1.00 0.00 C ATOM 437 O LYS A 30 16.999 -6.365 -4.376 1.00 0.00 O ATOM 438 CB LYS A 30 16.771 -9.643 -3.431 1.00 0.00 C ATOM 439 CG LYS A 30 18.194 -9.963 -3.854 1.00 0.00 C ATOM 440 CD LYS A 30 18.377 -9.815 -5.355 1.00 0.00 C ATOM 441 CE LYS A 30 18.895 -8.432 -5.720 1.00 0.00 C ATOM 442 NZ LYS A 30 19.477 -8.401 -7.090 1.00 0.00 N ATOM 0 H LYS A 30 15.039 -9.052 -1.774 1.00 0.00 H new ATOM 0 HA LYS A 30 17.531 -7.881 -2.459 1.00 0.00 H new ATOM 0 HB2 LYS A 30 16.463 -10.348 -2.658 1.00 0.00 H new ATOM 0 HB3 LYS A 30 16.106 -9.792 -4.282 1.00 0.00 H new ATOM 0 HG2 LYS A 30 18.886 -9.300 -3.335 1.00 0.00 H new ATOM 0 HG3 LYS A 30 18.443 -10.981 -3.555 1.00 0.00 H new ATOM 0 HD2 LYS A 30 19.074 -10.572 -5.714 1.00 0.00 H new ATOM 0 HD3 LYS A 30 17.426 -9.993 -5.858 1.00 0.00 H new ATOM 0 HE2 LYS A 30 18.081 -7.710 -5.655 1.00 0.00 H new ATOM 0 HE3 LYS A 30 19.651 -8.125 -4.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 19.818 -7.441 -7.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 20.271 -9.071 -7.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 18.749 -8.669 -7.783 1.00 0.00 H new ATOM 456 N GLU A 31 15.084 -7.511 -4.667 1.00 0.00 N ATOM 457 CA GLU A 31 14.632 -6.685 -5.780 1.00 0.00 C ATOM 458 C GLU A 31 14.335 -5.262 -5.316 1.00 0.00 C ATOM 459 O GLU A 31 14.743 -4.290 -5.954 1.00 0.00 O ATOM 460 CB GLU A 31 13.384 -7.295 -6.422 1.00 0.00 C ATOM 461 CG GLU A 31 13.614 -8.678 -7.007 1.00 0.00 C ATOM 462 CD GLU A 31 12.368 -9.541 -6.972 1.00 0.00 C ATOM 463 OE1 GLU A 31 11.374 -9.176 -7.634 1.00 0.00 O ATOM 464 OE2 GLU A 31 12.387 -10.583 -6.283 1.00 0.00 O ATOM 0 H GLU A 31 14.444 -8.263 -4.412 1.00 0.00 H new ATOM 0 HA GLU A 31 15.431 -6.648 -6.520 1.00 0.00 H new ATOM 0 HB2 GLU A 31 12.593 -7.353 -5.675 1.00 0.00 H new ATOM 0 HB3 GLU A 31 13.030 -6.631 -7.210 1.00 0.00 H new ATOM 0 HG2 GLU A 31 13.955 -8.580 -8.038 1.00 0.00 H new ATOM 0 HG3 GLU A 31 14.411 -9.175 -6.453 1.00 0.00 H new ATOM 471 N LEU A 32 13.620 -5.146 -4.202 1.00 0.00 N ATOM 472 CA LEU A 32 13.267 -3.842 -3.652 1.00 0.00 C ATOM 473 C LEU A 32 14.493 -3.147 -3.068 1.00 0.00 C ATOM 474 O LEU A 32 14.663 -1.938 -3.217 1.00 0.00 O ATOM 475 CB LEU A 32 12.193 -3.996 -2.574 1.00 0.00 C ATOM 476 CG LEU A 32 11.813 -2.722 -1.818 1.00 0.00 C ATOM 477 CD1 LEU A 32 11.083 -1.754 -2.736 1.00 0.00 C ATOM 478 CD2 LEU A 32 10.959 -3.056 -0.604 1.00 0.00 C ATOM 0 H LEU A 32 13.274 -5.939 -3.662 1.00 0.00 H new ATOM 0 HA LEU A 32 12.875 -3.227 -4.462 1.00 0.00 H new ATOM 0 HB2 LEU A 32 11.294 -4.400 -3.040 1.00 0.00 H new ATOM 0 HB3 LEU A 32 12.536 -4.735 -1.850 1.00 0.00 H new ATOM 0 HG LEU A 32 12.728 -2.242 -1.472 1.00 0.00 H new ATOM 0 HD11 LEU A 32 10.821 -0.854 -2.181 1.00 0.00 H new ATOM 0 HD12 LEU A 32 11.729 -1.489 -3.573 1.00 0.00 H new ATOM 0 HD13 LEU A 32 10.175 -2.225 -3.113 1.00 0.00 H new ATOM 0 HD21 LEU A 32 10.698 -2.137 -0.079 1.00 0.00 H new ATOM 0 HD22 LEU A 32 10.048 -3.560 -0.927 1.00 0.00 H new ATOM 0 HD23 LEU A 32 11.518 -3.710 0.065 1.00 0.00 H new ATOM 490 N GLY A 33 15.347 -3.921 -2.406 1.00 0.00 N ATOM 491 CA GLY A 33 16.548 -3.363 -1.812 1.00 0.00 C ATOM 492 C GLY A 33 17.545 -2.895 -2.853 1.00 0.00 C ATOM 493 O GLY A 33 18.336 -1.985 -2.602 1.00 0.00 O ATOM 0 H GLY A 33 15.229 -4.925 -2.270 1.00 0.00 H new ATOM 0 HA2 GLY A 33 16.277 -2.525 -1.170 1.00 0.00 H new ATOM 0 HA3 GLY A 33 17.017 -4.113 -1.175 1.00 0.00 H new ATOM 497 N THR A 34 17.512 -3.521 -4.025 1.00 0.00 N ATOM 498 CA THR A 34 18.422 -3.165 -5.107 1.00 0.00 C ATOM 499 C THR A 34 17.974 -1.885 -5.804 1.00 0.00 C ATOM 500 O THR A 34 18.793 -1.145 -6.350 1.00 0.00 O ATOM 501 CB THR A 34 18.524 -4.295 -6.149 1.00 0.00 C ATOM 502 OG1 THR A 34 19.830 -4.303 -6.737 1.00 0.00 O ATOM 503 CG2 THR A 34 17.474 -4.125 -7.236 1.00 0.00 C ATOM 0 H THR A 34 16.865 -4.277 -4.249 1.00 0.00 H new ATOM 0 HA THR A 34 19.402 -3.006 -4.657 1.00 0.00 H new ATOM 0 HB THR A 34 18.349 -5.244 -5.642 1.00 0.00 H new ATOM 0 HG1 THR A 34 19.887 -5.025 -7.397 1.00 0.00 H new ATOM 0 HG21 THR A 34 17.566 -4.934 -7.960 1.00 0.00 H new ATOM 0 HG22 THR A 34 16.480 -4.149 -6.789 1.00 0.00 H new ATOM 0 HG23 THR A 34 17.623 -3.170 -7.739 1.00 0.00 H new ATOM 511 N VAL A 35 16.670 -1.630 -5.782 1.00 0.00 N ATOM 512 CA VAL A 35 16.114 -0.438 -6.411 1.00 0.00 C ATOM 513 C VAL A 35 15.958 0.694 -5.401 1.00 0.00 C ATOM 514 O VAL A 35 16.053 1.869 -5.752 1.00 0.00 O ATOM 515 CB VAL A 35 14.745 -0.729 -7.053 1.00 0.00 C ATOM 516 CG1 VAL A 35 13.867 0.512 -7.026 1.00 0.00 C ATOM 517 CG2 VAL A 35 14.922 -1.236 -8.477 1.00 0.00 C ATOM 0 H VAL A 35 15.979 -2.233 -5.335 1.00 0.00 H new ATOM 0 HA VAL A 35 16.815 -0.134 -7.189 1.00 0.00 H new ATOM 0 HB VAL A 35 14.249 -1.507 -6.473 1.00 0.00 H new ATOM 0 HG11 VAL A 35 12.904 0.286 -7.484 1.00 0.00 H new ATOM 0 HG12 VAL A 35 13.713 0.826 -5.994 1.00 0.00 H new ATOM 0 HG13 VAL A 35 14.354 1.314 -7.581 1.00 0.00 H new ATOM 0 HG21 VAL A 35 13.945 -1.437 -8.916 1.00 0.00 H new ATOM 0 HG22 VAL A 35 15.438 -0.481 -9.070 1.00 0.00 H new ATOM 0 HG23 VAL A 35 15.510 -2.154 -8.466 1.00 0.00 H new ATOM 527 N MET A 36 15.719 0.331 -4.145 1.00 0.00 N ATOM 528 CA MET A 36 15.552 1.316 -3.084 1.00 0.00 C ATOM 529 C MET A 36 16.855 2.068 -2.830 1.00 0.00 C ATOM 530 O MET A 36 16.849 3.276 -2.594 1.00 0.00 O ATOM 531 CB MET A 36 15.083 0.636 -1.796 1.00 0.00 C ATOM 532 CG MET A 36 13.599 0.311 -1.786 1.00 0.00 C ATOM 533 SD MET A 36 12.568 1.776 -1.578 1.00 0.00 S ATOM 534 CE MET A 36 12.918 2.197 0.127 1.00 0.00 C ATOM 0 H MET A 36 15.637 -0.638 -3.838 1.00 0.00 H new ATOM 0 HA MET A 36 14.796 2.033 -3.404 1.00 0.00 H new ATOM 0 HB2 MET A 36 15.649 -0.285 -1.654 1.00 0.00 H new ATOM 0 HB3 MET A 36 15.310 1.284 -0.949 1.00 0.00 H new ATOM 0 HG2 MET A 36 13.334 -0.186 -2.719 1.00 0.00 H new ATOM 0 HG3 MET A 36 13.391 -0.393 -0.980 1.00 0.00 H new ATOM 0 HE1 MET A 36 12.986 3.280 0.228 1.00 0.00 H new ATOM 0 HE2 MET A 36 12.118 1.822 0.766 1.00 0.00 H new ATOM 0 HE3 MET A 36 13.864 1.745 0.427 1.00 0.00 H new ATOM 544 N ARG A 37 17.969 1.346 -2.881 1.00 0.00 N ATOM 545 CA ARG A 37 19.279 1.945 -2.655 1.00 0.00 C ATOM 546 C ARG A 37 19.677 2.840 -3.825 1.00 0.00 C ATOM 547 O ARG A 37 20.558 3.690 -3.698 1.00 0.00 O ATOM 548 CB ARG A 37 20.334 0.856 -2.451 1.00 0.00 C ATOM 549 CG ARG A 37 20.413 -0.138 -3.599 1.00 0.00 C ATOM 550 CD ARG A 37 21.172 0.440 -4.783 1.00 0.00 C ATOM 551 NE ARG A 37 21.868 -0.594 -5.544 1.00 0.00 N ATOM 552 CZ ARG A 37 23.054 -1.085 -5.203 1.00 0.00 C ATOM 553 NH1 ARG A 37 23.673 -0.639 -4.119 1.00 0.00 N ATOM 554 NH2 ARG A 37 23.623 -2.025 -5.946 1.00 0.00 N ATOM 0 H ARG A 37 17.991 0.345 -3.077 1.00 0.00 H new ATOM 0 HA ARG A 37 19.220 2.557 -1.755 1.00 0.00 H new ATOM 0 HB2 ARG A 37 21.309 1.326 -2.321 1.00 0.00 H new ATOM 0 HB3 ARG A 37 20.114 0.317 -1.529 1.00 0.00 H new ATOM 0 HG2 ARG A 37 20.905 -1.050 -3.260 1.00 0.00 H new ATOM 0 HG3 ARG A 37 19.406 -0.416 -3.911 1.00 0.00 H new ATOM 0 HD2 ARG A 37 20.477 0.966 -5.438 1.00 0.00 H new ATOM 0 HD3 ARG A 37 21.893 1.176 -4.427 1.00 0.00 H new ATOM 0 HE ARG A 37 21.419 -0.959 -6.384 1.00 0.00 H new ATOM 0 HH11 ARG A 37 23.239 0.083 -3.544 1.00 0.00 H new ATOM 0 HH12 ARG A 37 24.584 -1.018 -3.860 1.00 0.00 H new ATOM 0 HH21 ARG A 37 23.150 -2.372 -6.780 1.00 0.00 H new ATOM 0 HH22 ARG A 37 24.534 -2.401 -5.683 1.00 0.00 H new ATOM 568 N SER A 38 19.021 2.642 -4.964 1.00 0.00 N ATOM 569 CA SER A 38 19.308 3.428 -6.158 1.00 0.00 C ATOM 570 C SER A 38 18.879 4.880 -5.970 1.00 0.00 C ATOM 571 O SER A 38 19.484 5.796 -6.529 1.00 0.00 O ATOM 572 CB SER A 38 18.598 2.828 -7.373 1.00 0.00 C ATOM 573 OG SER A 38 19.159 1.575 -7.725 1.00 0.00 O ATOM 0 H SER A 38 18.287 1.944 -5.085 1.00 0.00 H new ATOM 0 HA SER A 38 20.385 3.405 -6.327 1.00 0.00 H new ATOM 0 HB2 SER A 38 17.537 2.706 -7.155 1.00 0.00 H new ATOM 0 HB3 SER A 38 18.673 3.514 -8.217 1.00 0.00 H new ATOM 0 HG SER A 38 18.869 0.895 -7.082 1.00 0.00 H new ATOM 579 N LEU A 39 17.832 5.082 -5.178 1.00 0.00 N ATOM 580 CA LEU A 39 17.320 6.422 -4.914 1.00 0.00 C ATOM 581 C LEU A 39 18.148 7.120 -3.840 1.00 0.00 C ATOM 582 O LEU A 39 18.358 8.331 -3.892 1.00 0.00 O ATOM 583 CB LEU A 39 15.854 6.354 -4.481 1.00 0.00 C ATOM 584 CG LEU A 39 14.930 5.519 -5.369 1.00 0.00 C ATOM 585 CD1 LEU A 39 14.704 4.144 -4.760 1.00 0.00 C ATOM 586 CD2 LEU A 39 13.605 6.236 -5.581 1.00 0.00 C ATOM 0 H LEU A 39 17.321 4.335 -4.707 1.00 0.00 H new ATOM 0 HA LEU A 39 17.393 7.000 -5.835 1.00 0.00 H new ATOM 0 HB2 LEU A 39 15.813 5.952 -3.469 1.00 0.00 H new ATOM 0 HB3 LEU A 39 15.462 7.370 -4.436 1.00 0.00 H new ATOM 0 HG LEU A 39 15.409 5.389 -6.339 1.00 0.00 H new ATOM 0 HD11 LEU A 39 14.044 3.564 -5.405 1.00 0.00 H new ATOM 0 HD12 LEU A 39 15.659 3.629 -4.661 1.00 0.00 H new ATOM 0 HD13 LEU A 39 14.246 4.252 -3.777 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.960 5.628 -6.215 1.00 0.00 H new ATOM 0 HD22 LEU A 39 13.120 6.397 -4.618 1.00 0.00 H new ATOM 0 HD23 LEU A 39 13.784 7.197 -6.062 1.00 0.00 H new ATOM 598 N GLY A 40 18.617 6.345 -2.866 1.00 0.00 N ATOM 599 CA GLY A 40 19.419 6.906 -1.794 1.00 0.00 C ATOM 600 C GLY A 40 18.946 6.462 -0.424 1.00 0.00 C ATOM 601 O GLY A 40 19.167 7.154 0.569 1.00 0.00 O ATOM 0 H GLY A 40 18.456 5.340 -2.800 1.00 0.00 H new ATOM 0 HA2 GLY A 40 20.459 6.610 -1.929 1.00 0.00 H new ATOM 0 HA3 GLY A 40 19.387 7.994 -1.851 1.00 0.00 H new ATOM 605 N GLN A 41 18.293 5.306 -0.371 1.00 0.00 N ATOM 606 CA GLN A 41 17.785 4.773 0.888 1.00 0.00 C ATOM 607 C GLN A 41 18.757 3.758 1.480 1.00 0.00 C ATOM 608 O GLN A 41 19.391 4.015 2.503 1.00 0.00 O ATOM 609 CB GLN A 41 16.417 4.123 0.676 1.00 0.00 C ATOM 610 CG GLN A 41 15.325 5.112 0.300 1.00 0.00 C ATOM 611 CD GLN A 41 15.423 6.411 1.075 1.00 0.00 C ATOM 612 OE1 GLN A 41 15.461 6.412 2.306 1.00 0.00 O ATOM 613 NE2 GLN A 41 15.463 7.528 0.357 1.00 0.00 N ATOM 0 H GLN A 41 18.103 4.721 -1.184 1.00 0.00 H new ATOM 0 HA GLN A 41 17.681 5.601 1.589 1.00 0.00 H new ATOM 0 HB2 GLN A 41 16.499 3.370 -0.108 1.00 0.00 H new ATOM 0 HB3 GLN A 41 16.126 3.603 1.588 1.00 0.00 H new ATOM 0 HG2 GLN A 41 15.384 5.325 -0.767 1.00 0.00 H new ATOM 0 HG3 GLN A 41 14.351 4.658 0.481 1.00 0.00 H new ATOM 0 HE21 GLN A 41 15.429 7.481 -0.661 1.00 0.00 H new ATOM 0 HE22 GLN A 41 15.528 8.432 0.824 1.00 0.00 H new ATOM 622 N ASN A 42 18.869 2.604 0.830 1.00 0.00 N ATOM 623 CA ASN A 42 19.763 1.549 1.294 1.00 0.00 C ATOM 624 C ASN A 42 19.350 1.054 2.676 1.00 0.00 C ATOM 625 O ASN A 42 20.143 1.029 3.617 1.00 0.00 O ATOM 626 CB ASN A 42 21.207 2.056 1.332 1.00 0.00 C ATOM 627 CG ASN A 42 21.874 2.005 -0.029 1.00 0.00 C ATOM 628 OD1 ASN A 42 21.700 2.905 -0.851 1.00 0.00 O ATOM 629 ND2 ASN A 42 22.641 0.949 -0.272 1.00 0.00 N ATOM 0 H ASN A 42 18.352 2.376 -0.019 1.00 0.00 H new ATOM 0 HA ASN A 42 19.695 0.716 0.594 1.00 0.00 H new ATOM 0 HB2 ASN A 42 21.219 3.081 1.701 1.00 0.00 H new ATOM 0 HB3 ASN A 42 21.781 1.456 2.038 1.00 0.00 H new ATOM 0 HD21 ASN A 42 23.115 0.859 -1.170 1.00 0.00 H new ATOM 0 HD22 ASN A 42 22.756 0.228 0.440 1.00 0.00 H new ATOM 636 N PRO A 43 18.077 0.648 2.803 1.00 0.00 N ATOM 637 CA PRO A 43 17.529 0.145 4.066 1.00 0.00 C ATOM 638 C PRO A 43 18.103 -1.216 4.445 1.00 0.00 C ATOM 639 O PRO A 43 18.616 -1.944 3.595 1.00 0.00 O ATOM 640 CB PRO A 43 16.029 0.032 3.782 1.00 0.00 C ATOM 641 CG PRO A 43 15.935 -0.138 2.305 1.00 0.00 C ATOM 642 CD PRO A 43 17.076 0.650 1.724 1.00 0.00 C ATOM 0 HA PRO A 43 17.770 0.799 4.904 1.00 0.00 H new ATOM 0 HB2 PRO A 43 15.589 -0.816 4.307 1.00 0.00 H new ATOM 0 HB3 PRO A 43 15.495 0.923 4.113 1.00 0.00 H new ATOM 0 HG2 PRO A 43 16.006 -1.190 2.028 1.00 0.00 H new ATOM 0 HG3 PRO A 43 14.978 0.226 1.930 1.00 0.00 H new ATOM 0 HD2 PRO A 43 17.463 0.187 0.816 1.00 0.00 H new ATOM 0 HD3 PRO A 43 16.772 1.663 1.460 1.00 0.00 H new ATOM 650 N THR A 44 18.013 -1.555 5.728 1.00 0.00 N ATOM 651 CA THR A 44 18.524 -2.828 6.220 1.00 0.00 C ATOM 652 C THR A 44 17.419 -3.877 6.281 1.00 0.00 C ATOM 653 O THR A 44 16.235 -3.543 6.310 1.00 0.00 O ATOM 654 CB THR A 44 19.153 -2.679 7.618 1.00 0.00 C ATOM 655 OG1 THR A 44 18.198 -2.121 8.527 1.00 0.00 O ATOM 656 CG2 THR A 44 20.388 -1.792 7.563 1.00 0.00 C ATOM 0 H THR A 44 17.591 -0.965 6.445 1.00 0.00 H new ATOM 0 HA THR A 44 19.292 -3.153 5.518 1.00 0.00 H new ATOM 0 HB THR A 44 19.451 -3.668 7.967 1.00 0.00 H new ATOM 0 HG1 THR A 44 18.605 -2.031 9.414 1.00 0.00 H new ATOM 0 HG21 THR A 44 20.815 -1.701 8.562 1.00 0.00 H new ATOM 0 HG22 THR A 44 21.124 -2.235 6.892 1.00 0.00 H new ATOM 0 HG23 THR A 44 20.110 -0.804 7.196 1.00 0.00 H new ATOM 664 N GLU A 45 17.815 -5.146 6.302 1.00 0.00 N ATOM 665 CA GLU A 45 16.856 -6.243 6.360 1.00 0.00 C ATOM 666 C GLU A 45 15.645 -5.863 7.208 1.00 0.00 C ATOM 667 O GLU A 45 14.520 -5.809 6.712 1.00 0.00 O ATOM 668 CB GLU A 45 17.519 -7.499 6.931 1.00 0.00 C ATOM 669 CG GLU A 45 18.149 -8.389 5.874 1.00 0.00 C ATOM 670 CD GLU A 45 18.486 -9.771 6.400 1.00 0.00 C ATOM 671 OE1 GLU A 45 19.191 -9.859 7.427 1.00 0.00 O ATOM 672 OE2 GLU A 45 18.045 -10.764 5.784 1.00 0.00 O ATOM 0 H GLU A 45 18.792 -5.439 6.280 1.00 0.00 H new ATOM 0 HA GLU A 45 16.516 -6.449 5.345 1.00 0.00 H new ATOM 0 HB2 GLU A 45 18.285 -7.202 7.647 1.00 0.00 H new ATOM 0 HB3 GLU A 45 16.775 -8.074 7.481 1.00 0.00 H new ATOM 0 HG2 GLU A 45 17.467 -8.482 5.029 1.00 0.00 H new ATOM 0 HG3 GLU A 45 19.057 -7.916 5.500 1.00 0.00 H new ATOM 679 N ALA A 46 15.885 -5.602 8.488 1.00 0.00 N ATOM 680 CA ALA A 46 14.816 -5.226 9.405 1.00 0.00 C ATOM 681 C ALA A 46 13.909 -4.168 8.785 1.00 0.00 C ATOM 682 O ALA A 46 12.685 -4.252 8.885 1.00 0.00 O ATOM 683 CB ALA A 46 15.398 -4.721 10.717 1.00 0.00 C ATOM 0 H ALA A 46 16.811 -5.644 8.914 1.00 0.00 H new ATOM 0 HA ALA A 46 14.214 -6.112 9.605 1.00 0.00 H new ATOM 0 HB1 ALA A 46 14.588 -4.444 11.392 1.00 0.00 H new ATOM 0 HB2 ALA A 46 15.999 -5.507 11.175 1.00 0.00 H new ATOM 0 HB3 ALA A 46 16.025 -3.850 10.526 1.00 0.00 H new ATOM 689 N GLU A 47 14.517 -3.173 8.147 1.00 0.00 N ATOM 690 CA GLU A 47 13.762 -2.099 7.513 1.00 0.00 C ATOM 691 C GLU A 47 12.980 -2.619 6.310 1.00 0.00 C ATOM 692 O GLU A 47 11.759 -2.477 6.241 1.00 0.00 O ATOM 693 CB GLU A 47 14.703 -0.974 7.075 1.00 0.00 C ATOM 694 CG GLU A 47 15.443 -0.316 8.228 1.00 0.00 C ATOM 695 CD GLU A 47 14.576 0.664 8.995 1.00 0.00 C ATOM 696 OE1 GLU A 47 14.252 1.733 8.437 1.00 0.00 O ATOM 697 OE2 GLU A 47 14.220 0.360 10.153 1.00 0.00 O ATOM 0 H GLU A 47 15.529 -3.088 8.056 1.00 0.00 H new ATOM 0 HA GLU A 47 13.054 -1.708 8.243 1.00 0.00 H new ATOM 0 HB2 GLU A 47 15.430 -1.374 6.369 1.00 0.00 H new ATOM 0 HB3 GLU A 47 14.127 -0.216 6.544 1.00 0.00 H new ATOM 0 HG2 GLU A 47 15.804 -1.086 8.910 1.00 0.00 H new ATOM 0 HG3 GLU A 47 16.319 0.205 7.842 1.00 0.00 H new ATOM 704 N LEU A 48 13.693 -3.222 5.365 1.00 0.00 N ATOM 705 CA LEU A 48 13.067 -3.764 4.163 1.00 0.00 C ATOM 706 C LEU A 48 11.843 -4.601 4.518 1.00 0.00 C ATOM 707 O LEU A 48 10.753 -4.376 3.993 1.00 0.00 O ATOM 708 CB LEU A 48 14.070 -4.612 3.380 1.00 0.00 C ATOM 709 CG LEU A 48 15.245 -3.858 2.757 1.00 0.00 C ATOM 710 CD1 LEU A 48 16.426 -4.792 2.543 1.00 0.00 C ATOM 711 CD2 LEU A 48 14.829 -3.212 1.444 1.00 0.00 C ATOM 0 H LEU A 48 14.704 -3.348 5.407 1.00 0.00 H new ATOM 0 HA LEU A 48 12.745 -2.928 3.542 1.00 0.00 H new ATOM 0 HB2 LEU A 48 14.468 -5.377 4.047 1.00 0.00 H new ATOM 0 HB3 LEU A 48 13.534 -5.130 2.585 1.00 0.00 H new ATOM 0 HG LEU A 48 15.551 -3.070 3.445 1.00 0.00 H new ATOM 0 HD11 LEU A 48 17.253 -4.237 2.099 1.00 0.00 H new ATOM 0 HD12 LEU A 48 16.740 -5.207 3.501 1.00 0.00 H new ATOM 0 HD13 LEU A 48 16.133 -5.602 1.876 1.00 0.00 H new ATOM 0 HD21 LEU A 48 15.678 -2.680 1.015 1.00 0.00 H new ATOM 0 HD22 LEU A 48 14.495 -3.983 0.749 1.00 0.00 H new ATOM 0 HD23 LEU A 48 14.015 -2.510 1.626 1.00 0.00 H new ATOM 723 N GLN A 49 12.031 -5.566 5.413 1.00 0.00 N ATOM 724 CA GLN A 49 10.941 -6.435 5.838 1.00 0.00 C ATOM 725 C GLN A 49 9.760 -5.618 6.352 1.00 0.00 C ATOM 726 O GLN A 49 8.648 -5.721 5.834 1.00 0.00 O ATOM 727 CB GLN A 49 11.422 -7.397 6.926 1.00 0.00 C ATOM 728 CG GLN A 49 11.992 -8.697 6.381 1.00 0.00 C ATOM 729 CD GLN A 49 10.973 -9.493 5.589 1.00 0.00 C ATOM 730 OE1 GLN A 49 10.857 -9.191 4.301 1.00 0.00 O flip ATOM 731 NE2 GLN A 49 10.298 -10.370 6.128 1.00 0.00 N flip ATOM 0 H GLN A 49 12.927 -5.765 5.857 1.00 0.00 H new ATOM 0 HA GLN A 49 10.612 -7.010 4.973 1.00 0.00 H new ATOM 0 HB2 GLN A 49 12.183 -6.900 7.528 1.00 0.00 H new ATOM 0 HB3 GLN A 49 10.589 -7.626 7.591 1.00 0.00 H new ATOM 0 HG2 GLN A 49 12.849 -8.475 5.745 1.00 0.00 H new ATOM 0 HG3 GLN A 49 12.358 -9.304 7.209 1.00 0.00 H new ATOM 0 HE21 GLN A 49 10.420 -10.569 7.121 1.00 0.00 H new ATOM 0 HE22 GLN A 49 9.617 -10.897 5.582 1.00 0.00 H new ATOM 740 N ASP A 50 10.010 -4.806 7.373 1.00 0.00 N ATOM 741 CA ASP A 50 8.968 -3.969 7.957 1.00 0.00 C ATOM 742 C ASP A 50 8.204 -3.216 6.872 1.00 0.00 C ATOM 743 O ASP A 50 6.981 -3.096 6.930 1.00 0.00 O ATOM 744 CB ASP A 50 9.576 -2.979 8.951 1.00 0.00 C ATOM 745 CG ASP A 50 9.637 -3.536 10.360 1.00 0.00 C ATOM 746 OD1 ASP A 50 10.358 -4.532 10.573 1.00 0.00 O ATOM 747 OD2 ASP A 50 8.962 -2.975 11.249 1.00 0.00 O ATOM 0 H ASP A 50 10.925 -4.709 7.814 1.00 0.00 H new ATOM 0 HA ASP A 50 8.269 -4.618 8.485 1.00 0.00 H new ATOM 0 HB2 ASP A 50 10.581 -2.713 8.625 1.00 0.00 H new ATOM 0 HB3 ASP A 50 8.988 -2.061 8.951 1.00 0.00 H new ATOM 752 N MET A 51 8.935 -2.709 5.885 1.00 0.00 N ATOM 753 CA MET A 51 8.326 -1.968 4.786 1.00 0.00 C ATOM 754 C MET A 51 7.465 -2.884 3.923 1.00 0.00 C ATOM 755 O MET A 51 6.338 -2.537 3.567 1.00 0.00 O ATOM 756 CB MET A 51 9.406 -1.307 3.928 1.00 0.00 C ATOM 757 CG MET A 51 10.095 -0.137 4.613 1.00 0.00 C ATOM 758 SD MET A 51 11.076 0.856 3.472 1.00 0.00 S ATOM 759 CE MET A 51 12.108 -0.403 2.727 1.00 0.00 C ATOM 0 H MET A 51 9.949 -2.797 5.823 1.00 0.00 H new ATOM 0 HA MET A 51 7.687 -1.195 5.213 1.00 0.00 H new ATOM 0 HB2 MET A 51 10.154 -2.053 3.662 1.00 0.00 H new ATOM 0 HB3 MET A 51 8.957 -0.960 2.997 1.00 0.00 H new ATOM 0 HG2 MET A 51 9.344 0.496 5.086 1.00 0.00 H new ATOM 0 HG3 MET A 51 10.740 -0.514 5.407 1.00 0.00 H new ATOM 0 HE1 MET A 51 12.809 0.064 2.035 1.00 0.00 H new ATOM 0 HE2 MET A 51 12.662 -0.927 3.506 1.00 0.00 H new ATOM 0 HE3 MET A 51 11.482 -1.113 2.186 1.00 0.00 H new ATOM 769 N ILE A 52 8.002 -4.053 3.590 1.00 0.00 N ATOM 770 CA ILE A 52 7.281 -5.018 2.770 1.00 0.00 C ATOM 771 C ILE A 52 6.009 -5.490 3.466 1.00 0.00 C ATOM 772 O ILE A 52 4.956 -5.613 2.841 1.00 0.00 O ATOM 773 CB ILE A 52 8.156 -6.241 2.440 1.00 0.00 C ATOM 774 CG1 ILE A 52 9.311 -5.837 1.521 1.00 0.00 C ATOM 775 CG2 ILE A 52 7.317 -7.335 1.796 1.00 0.00 C ATOM 776 CD1 ILE A 52 10.365 -6.910 1.366 1.00 0.00 C ATOM 0 H ILE A 52 8.934 -4.354 3.876 1.00 0.00 H new ATOM 0 HA ILE A 52 7.017 -4.509 1.843 1.00 0.00 H new ATOM 0 HB ILE A 52 8.574 -6.630 3.368 1.00 0.00 H new ATOM 0 HG12 ILE A 52 8.912 -5.587 0.538 1.00 0.00 H new ATOM 0 HG13 ILE A 52 9.779 -4.934 1.914 1.00 0.00 H new ATOM 0 HG21 ILE A 52 7.950 -8.193 1.569 1.00 0.00 H new ATOM 0 HG22 ILE A 52 6.527 -7.639 2.482 1.00 0.00 H new ATOM 0 HG23 ILE A 52 6.872 -6.958 0.875 1.00 0.00 H new ATOM 0 HD11 ILE A 52 11.152 -6.554 0.701 1.00 0.00 H new ATOM 0 HD12 ILE A 52 10.792 -7.144 2.341 1.00 0.00 H new ATOM 0 HD13 ILE A 52 9.912 -7.807 0.944 1.00 0.00 H new ATOM 788 N ASN A 53 6.114 -5.751 4.765 1.00 0.00 N ATOM 789 CA ASN A 53 4.971 -6.209 5.547 1.00 0.00 C ATOM 790 C ASN A 53 3.802 -5.237 5.421 1.00 0.00 C ATOM 791 O ASN A 53 2.644 -5.649 5.364 1.00 0.00 O ATOM 792 CB ASN A 53 5.363 -6.365 7.018 1.00 0.00 C ATOM 793 CG ASN A 53 6.025 -7.700 7.301 1.00 0.00 C ATOM 794 OD1 ASN A 53 5.357 -8.675 7.646 1.00 0.00 O ATOM 795 ND2 ASN A 53 7.344 -7.748 7.157 1.00 0.00 N ATOM 0 H ASN A 53 6.978 -5.653 5.298 1.00 0.00 H new ATOM 0 HA ASN A 53 4.659 -7.178 5.156 1.00 0.00 H new ATOM 0 HB2 ASN A 53 6.042 -5.559 7.298 1.00 0.00 H new ATOM 0 HB3 ASN A 53 4.474 -6.264 7.641 1.00 0.00 H new ATOM 0 HD21 ASN A 53 7.845 -8.619 7.334 1.00 0.00 H new ATOM 0 HD22 ASN A 53 7.856 -6.914 6.869 1.00 0.00 H new ATOM 802 N GLU A 54 4.114 -3.946 5.378 1.00 0.00 N ATOM 803 CA GLU A 54 3.089 -2.916 5.259 1.00 0.00 C ATOM 804 C GLU A 54 2.259 -3.118 3.994 1.00 0.00 C ATOM 805 O GLU A 54 1.044 -2.921 3.998 1.00 0.00 O ATOM 806 CB GLU A 54 3.729 -1.526 5.244 1.00 0.00 C ATOM 807 CG GLU A 54 3.943 -0.940 6.630 1.00 0.00 C ATOM 808 CD GLU A 54 2.644 -0.737 7.384 1.00 0.00 C ATOM 809 OE1 GLU A 54 1.910 0.217 7.054 1.00 0.00 O ATOM 810 OE2 GLU A 54 2.361 -1.532 8.305 1.00 0.00 O ATOM 0 H GLU A 54 5.068 -3.588 5.424 1.00 0.00 H new ATOM 0 HA GLU A 54 2.430 -2.995 6.123 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.689 -1.583 4.730 1.00 0.00 H new ATOM 0 HB3 GLU A 54 3.098 -0.851 4.667 1.00 0.00 H new ATOM 0 HG2 GLU A 54 4.592 -1.601 7.204 1.00 0.00 H new ATOM 0 HG3 GLU A 54 4.460 0.015 6.541 1.00 0.00 H new ATOM 817 N VAL A 55 2.924 -3.513 2.913 1.00 0.00 N ATOM 818 CA VAL A 55 2.249 -3.743 1.642 1.00 0.00 C ATOM 819 C VAL A 55 1.654 -5.145 1.581 1.00 0.00 C ATOM 820 O VAL A 55 0.553 -5.342 1.067 1.00 0.00 O ATOM 821 CB VAL A 55 3.211 -3.554 0.453 1.00 0.00 C ATOM 822 CG1 VAL A 55 2.561 -4.023 -0.839 1.00 0.00 C ATOM 823 CG2 VAL A 55 3.644 -2.100 0.345 1.00 0.00 C ATOM 0 H VAL A 55 3.930 -3.680 2.892 1.00 0.00 H new ATOM 0 HA VAL A 55 1.447 -3.008 1.572 1.00 0.00 H new ATOM 0 HB VAL A 55 4.099 -4.162 0.626 1.00 0.00 H new ATOM 0 HG11 VAL A 55 3.255 -3.882 -1.668 1.00 0.00 H new ATOM 0 HG12 VAL A 55 2.306 -5.079 -0.755 1.00 0.00 H new ATOM 0 HG13 VAL A 55 1.655 -3.444 -1.022 1.00 0.00 H new ATOM 0 HG21 VAL A 55 4.323 -1.984 -0.500 1.00 0.00 H new ATOM 0 HG22 VAL A 55 2.768 -1.470 0.195 1.00 0.00 H new ATOM 0 HG23 VAL A 55 4.152 -1.803 1.262 1.00 0.00 H new ATOM 833 N ASP A 56 2.389 -6.117 2.110 1.00 0.00 N ATOM 834 CA ASP A 56 1.933 -7.502 2.118 1.00 0.00 C ATOM 835 C ASP A 56 0.492 -7.598 2.611 1.00 0.00 C ATOM 836 O ASP A 56 0.244 -7.758 3.806 1.00 0.00 O ATOM 837 CB ASP A 56 2.844 -8.357 3.001 1.00 0.00 C ATOM 838 CG ASP A 56 2.938 -9.791 2.519 1.00 0.00 C ATOM 839 OD1 ASP A 56 1.986 -10.562 2.765 1.00 0.00 O ATOM 840 OD2 ASP A 56 3.962 -10.143 1.898 1.00 0.00 O ATOM 0 H ASP A 56 3.303 -5.971 2.539 1.00 0.00 H new ATOM 0 HA ASP A 56 1.974 -7.877 1.095 1.00 0.00 H new ATOM 0 HB2 ASP A 56 3.841 -7.918 3.022 1.00 0.00 H new ATOM 0 HB3 ASP A 56 2.469 -8.345 4.024 1.00 0.00 H new ATOM 845 N ALA A 57 -0.453 -7.497 1.683 1.00 0.00 N ATOM 846 CA ALA A 57 -1.869 -7.573 2.023 1.00 0.00 C ATOM 847 C ALA A 57 -2.296 -9.014 2.278 1.00 0.00 C ATOM 848 O ALA A 57 -2.778 -9.347 3.361 1.00 0.00 O ATOM 849 CB ALA A 57 -2.711 -6.959 0.915 1.00 0.00 C ATOM 0 H ALA A 57 -0.264 -7.362 0.690 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.028 -7.007 2.941 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -3.766 -7.023 1.182 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -2.432 -5.913 0.783 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -2.539 -7.500 -0.015 1.00 0.00 H new ATOM 855 N ASP A 58 -2.116 -9.866 1.275 1.00 0.00 N ATOM 856 CA ASP A 58 -2.482 -11.273 1.391 1.00 0.00 C ATOM 857 C ASP A 58 -2.006 -11.851 2.720 1.00 0.00 C ATOM 858 O ASP A 58 -2.744 -12.563 3.399 1.00 0.00 O ATOM 859 CB ASP A 58 -1.889 -12.074 0.230 1.00 0.00 C ATOM 860 CG ASP A 58 -0.443 -12.459 0.472 1.00 0.00 C ATOM 861 OD1 ASP A 58 -0.205 -13.434 1.216 1.00 0.00 O ATOM 862 OD2 ASP A 58 0.450 -11.786 -0.082 1.00 0.00 O ATOM 0 H ASP A 58 -1.719 -9.607 0.372 1.00 0.00 H new ATOM 0 HA ASP A 58 -3.569 -11.344 1.353 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -2.481 -12.976 0.075 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -1.957 -11.486 -0.685 1.00 0.00 H new ATOM 867 N GLY A 59 -0.766 -11.539 3.085 1.00 0.00 N ATOM 868 CA GLY A 59 -0.212 -12.036 4.330 1.00 0.00 C ATOM 869 C GLY A 59 0.769 -13.172 4.116 1.00 0.00 C ATOM 870 O GLY A 59 0.830 -14.107 4.913 1.00 0.00 O ATOM 0 H GLY A 59 -0.136 -10.951 2.540 1.00 0.00 H new ATOM 0 HA2 GLY A 59 0.289 -11.221 4.852 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -1.023 -12.377 4.974 1.00 0.00 H new ATOM 874 N ASN A 60 1.538 -13.091 3.035 1.00 0.00 N ATOM 875 CA ASN A 60 2.520 -14.121 2.717 1.00 0.00 C ATOM 876 C ASN A 60 3.919 -13.694 3.152 1.00 0.00 C ATOM 877 O ASN A 60 4.642 -14.457 3.789 1.00 0.00 O ATOM 878 CB ASN A 60 2.510 -14.419 1.216 1.00 0.00 C ATOM 879 CG ASN A 60 2.871 -13.204 0.383 1.00 0.00 C ATOM 880 OD1 ASN A 60 2.666 -12.066 0.804 1.00 0.00 O ATOM 881 ND2 ASN A 60 3.412 -13.442 -0.806 1.00 0.00 N ATOM 0 H ASN A 60 1.500 -12.323 2.365 1.00 0.00 H new ATOM 0 HA ASN A 60 2.250 -15.025 3.263 1.00 0.00 H new ATOM 0 HB2 ASN A 60 3.214 -15.224 1.003 1.00 0.00 H new ATOM 0 HB3 ASN A 60 1.521 -14.775 0.925 1.00 0.00 H new ATOM 0 HD21 ASN A 60 3.676 -12.664 -1.411 1.00 0.00 H new ATOM 0 HD22 ASN A 60 3.564 -14.402 -1.114 1.00 0.00 H new ATOM 888 N GLY A 61 4.292 -12.466 2.803 1.00 0.00 N ATOM 889 CA GLY A 61 5.601 -11.957 3.166 1.00 0.00 C ATOM 890 C GLY A 61 6.275 -11.223 2.024 1.00 0.00 C ATOM 891 O GLY A 61 7.049 -10.290 2.245 1.00 0.00 O ATOM 0 H GLY A 61 3.710 -11.815 2.275 1.00 0.00 H new ATOM 0 HA2 GLY A 61 5.502 -11.284 4.018 1.00 0.00 H new ATOM 0 HA3 GLY A 61 6.234 -12.785 3.485 1.00 0.00 H new ATOM 895 N THR A 62 5.983 -11.644 0.797 1.00 0.00 N ATOM 896 CA THR A 62 6.568 -11.021 -0.384 1.00 0.00 C ATOM 897 C THR A 62 5.515 -10.264 -1.184 1.00 0.00 C ATOM 898 O THR A 62 4.411 -10.763 -1.405 1.00 0.00 O ATOM 899 CB THR A 62 7.236 -12.067 -1.296 1.00 0.00 C ATOM 900 OG1 THR A 62 6.265 -13.020 -1.743 1.00 0.00 O ATOM 901 CG2 THR A 62 8.359 -12.785 -0.564 1.00 0.00 C ATOM 0 H THR A 62 5.345 -12.414 0.595 1.00 0.00 H new ATOM 0 HA THR A 62 7.325 -10.320 -0.031 1.00 0.00 H new ATOM 0 HB THR A 62 7.658 -11.549 -2.157 1.00 0.00 H new ATOM 0 HG1 THR A 62 6.698 -13.680 -2.323 1.00 0.00 H new ATOM 0 HG21 THR A 62 8.816 -13.519 -1.228 1.00 0.00 H new ATOM 0 HG22 THR A 62 9.111 -12.061 -0.252 1.00 0.00 H new ATOM 0 HG23 THR A 62 7.956 -13.291 0.313 1.00 0.00 H new ATOM 909 N ILE A 63 5.863 -9.057 -1.618 1.00 0.00 N ATOM 910 CA ILE A 63 4.948 -8.231 -2.396 1.00 0.00 C ATOM 911 C ILE A 63 4.714 -8.826 -3.781 1.00 0.00 C ATOM 912 O ILE A 63 5.564 -9.539 -4.313 1.00 0.00 O ATOM 913 CB ILE A 63 5.478 -6.794 -2.550 1.00 0.00 C ATOM 914 CG1 ILE A 63 5.735 -6.172 -1.175 1.00 0.00 C ATOM 915 CG2 ILE A 63 4.494 -5.948 -3.344 1.00 0.00 C ATOM 916 CD1 ILE A 63 6.701 -5.009 -1.209 1.00 0.00 C ATOM 0 H ILE A 63 6.773 -8.629 -1.444 1.00 0.00 H new ATOM 0 HA ILE A 63 4.005 -8.204 -1.850 1.00 0.00 H new ATOM 0 HB ILE A 63 6.421 -6.827 -3.096 1.00 0.00 H new ATOM 0 HG12 ILE A 63 4.787 -5.835 -0.755 1.00 0.00 H new ATOM 0 HG13 ILE A 63 6.125 -6.939 -0.506 1.00 0.00 H new ATOM 0 HG21 ILE A 63 4.883 -4.935 -3.444 1.00 0.00 H new ATOM 0 HG22 ILE A 63 4.356 -6.383 -4.334 1.00 0.00 H new ATOM 0 HG23 ILE A 63 3.537 -5.919 -2.824 1.00 0.00 H new ATOM 0 HD11 ILE A 63 6.836 -4.618 -0.200 1.00 0.00 H new ATOM 0 HD12 ILE A 63 7.662 -5.345 -1.599 1.00 0.00 H new ATOM 0 HD13 ILE A 63 6.303 -4.224 -1.852 1.00 0.00 H new ATOM 928 N ASP A 64 3.556 -8.526 -4.359 1.00 0.00 N ATOM 929 CA ASP A 64 3.211 -9.028 -5.684 1.00 0.00 C ATOM 930 C ASP A 64 2.552 -7.937 -6.523 1.00 0.00 C ATOM 931 O ASP A 64 2.523 -6.770 -6.132 1.00 0.00 O ATOM 932 CB ASP A 64 2.278 -10.234 -5.568 1.00 0.00 C ATOM 933 CG ASP A 64 1.093 -9.964 -4.661 1.00 0.00 C ATOM 934 OD1 ASP A 64 0.985 -8.831 -4.148 1.00 0.00 O ATOM 935 OD2 ASP A 64 0.274 -10.887 -4.465 1.00 0.00 O ATOM 0 H ASP A 64 2.841 -7.938 -3.931 1.00 0.00 H new ATOM 0 HA ASP A 64 4.131 -9.337 -6.180 1.00 0.00 H new ATOM 0 HB2 ASP A 64 1.918 -10.508 -6.560 1.00 0.00 H new ATOM 0 HB3 ASP A 64 2.838 -11.087 -5.185 1.00 0.00 H new ATOM 940 N PHE A 65 2.024 -8.326 -7.679 1.00 0.00 N ATOM 941 CA PHE A 65 1.366 -7.381 -8.575 1.00 0.00 C ATOM 942 C PHE A 65 0.248 -6.635 -7.853 1.00 0.00 C ATOM 943 O PHE A 65 0.137 -5.411 -7.926 1.00 0.00 O ATOM 944 CB PHE A 65 0.803 -8.111 -9.796 1.00 0.00 C ATOM 945 CG PHE A 65 0.718 -7.250 -11.023 1.00 0.00 C ATOM 946 CD1 PHE A 65 -0.136 -6.159 -11.062 1.00 0.00 C ATOM 947 CD2 PHE A 65 1.492 -7.531 -12.138 1.00 0.00 C ATOM 948 CE1 PHE A 65 -0.216 -5.365 -12.191 1.00 0.00 C ATOM 949 CE2 PHE A 65 1.416 -6.740 -13.269 1.00 0.00 C ATOM 950 CZ PHE A 65 0.561 -5.656 -13.295 1.00 0.00 C ATOM 0 H PHE A 65 2.039 -9.288 -8.017 1.00 0.00 H new ATOM 0 HA PHE A 65 2.108 -6.655 -8.905 1.00 0.00 H new ATOM 0 HB2 PHE A 65 1.429 -8.977 -10.012 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -0.191 -8.488 -9.557 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -0.745 -5.927 -10.201 1.00 0.00 H new ATOM 0 HD2 PHE A 65 2.162 -8.378 -12.123 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -0.886 -4.518 -12.210 1.00 0.00 H new ATOM 0 HE2 PHE A 65 2.025 -6.969 -14.131 1.00 0.00 H new ATOM 0 HZ PHE A 65 0.500 -5.037 -14.178 1.00 0.00 H new ATOM 960 N PRO A 66 -0.602 -7.389 -7.140 1.00 0.00 N ATOM 961 CA PRO A 66 -1.727 -6.822 -6.392 1.00 0.00 C ATOM 962 C PRO A 66 -1.269 -6.017 -5.180 1.00 0.00 C ATOM 963 O PRO A 66 -1.590 -4.836 -5.051 1.00 0.00 O ATOM 964 CB PRO A 66 -2.516 -8.056 -5.947 1.00 0.00 C ATOM 965 CG PRO A 66 -1.511 -9.155 -5.912 1.00 0.00 C ATOM 966 CD PRO A 66 -0.529 -8.854 -7.010 1.00 0.00 C ATOM 0 HA PRO A 66 -2.307 -6.124 -6.995 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -2.970 -7.904 -4.968 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -3.325 -8.281 -6.642 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -1.013 -9.197 -4.944 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -1.986 -10.123 -6.068 1.00 0.00 H new ATOM 0 HD2 PRO A 66 0.477 -9.185 -6.751 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -0.800 -9.354 -7.940 1.00 0.00 H new ATOM 974 N GLU A 67 -0.519 -6.665 -4.294 1.00 0.00 N ATOM 975 CA GLU A 67 -0.018 -6.008 -3.092 1.00 0.00 C ATOM 976 C GLU A 67 0.849 -4.805 -3.451 1.00 0.00 C ATOM 977 O GLU A 67 0.824 -3.781 -2.768 1.00 0.00 O ATOM 978 CB GLU A 67 0.785 -6.995 -2.242 1.00 0.00 C ATOM 979 CG GLU A 67 0.014 -8.252 -1.878 1.00 0.00 C ATOM 980 CD GLU A 67 0.923 -9.435 -1.606 1.00 0.00 C ATOM 981 OE1 GLU A 67 1.905 -9.267 -0.852 1.00 0.00 O ATOM 982 OE2 GLU A 67 0.653 -10.528 -2.146 1.00 0.00 O ATOM 0 H GLU A 67 -0.245 -7.643 -4.386 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.874 -5.657 -2.516 1.00 0.00 H new ATOM 0 HB2 GLU A 67 1.688 -7.277 -2.783 1.00 0.00 H new ATOM 0 HB3 GLU A 67 1.105 -6.497 -1.327 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.596 -8.057 -0.996 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.669 -8.502 -2.689 1.00 0.00 H new ATOM 989 N PHE A 68 1.618 -4.937 -4.527 1.00 0.00 N ATOM 990 CA PHE A 68 2.495 -3.863 -4.976 1.00 0.00 C ATOM 991 C PHE A 68 1.710 -2.571 -5.184 1.00 0.00 C ATOM 992 O PHE A 68 2.153 -1.491 -4.789 1.00 0.00 O ATOM 993 CB PHE A 68 3.199 -4.260 -6.276 1.00 0.00 C ATOM 994 CG PHE A 68 3.948 -3.130 -6.921 1.00 0.00 C ATOM 995 CD1 PHE A 68 4.949 -2.462 -6.234 1.00 0.00 C ATOM 996 CD2 PHE A 68 3.651 -2.734 -8.216 1.00 0.00 C ATOM 997 CE1 PHE A 68 5.641 -1.422 -6.825 1.00 0.00 C ATOM 998 CE2 PHE A 68 4.340 -1.695 -8.812 1.00 0.00 C ATOM 999 CZ PHE A 68 5.335 -1.037 -8.116 1.00 0.00 C ATOM 0 H PHE A 68 1.651 -5.778 -5.104 1.00 0.00 H new ATOM 0 HA PHE A 68 3.244 -3.692 -4.203 1.00 0.00 H new ATOM 0 HB2 PHE A 68 3.893 -5.075 -6.070 1.00 0.00 H new ATOM 0 HB3 PHE A 68 2.459 -4.642 -6.979 1.00 0.00 H new ATOM 0 HD1 PHE A 68 5.191 -2.758 -5.224 1.00 0.00 H new ATOM 0 HD2 PHE A 68 2.873 -3.243 -8.765 1.00 0.00 H new ATOM 0 HE1 PHE A 68 6.420 -0.911 -6.278 1.00 0.00 H new ATOM 0 HE2 PHE A 68 4.100 -1.397 -9.822 1.00 0.00 H new ATOM 0 HZ PHE A 68 5.873 -0.223 -8.580 1.00 0.00 H new ATOM 1009 N LEU A 69 0.543 -2.689 -5.808 1.00 0.00 N ATOM 1010 CA LEU A 69 -0.305 -1.531 -6.070 1.00 0.00 C ATOM 1011 C LEU A 69 -0.452 -0.669 -4.820 1.00 0.00 C ATOM 1012 O LEU A 69 -0.655 0.542 -4.907 1.00 0.00 O ATOM 1013 CB LEU A 69 -1.682 -1.983 -6.557 1.00 0.00 C ATOM 1014 CG LEU A 69 -1.846 -2.126 -8.071 1.00 0.00 C ATOM 1015 CD1 LEU A 69 -2.853 -3.218 -8.398 1.00 0.00 C ATOM 1016 CD2 LEU A 69 -2.272 -0.803 -8.689 1.00 0.00 C ATOM 0 H LEU A 69 0.162 -3.574 -6.142 1.00 0.00 H new ATOM 0 HA LEU A 69 0.170 -0.932 -6.847 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -1.911 -2.943 -6.095 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -2.424 -1.270 -6.197 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.883 -2.409 -8.496 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -2.957 -3.305 -9.480 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -2.506 -4.167 -7.989 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -3.819 -2.965 -7.960 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.384 -0.924 -9.766 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -3.223 -0.490 -8.258 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.515 -0.046 -8.485 1.00 0.00 H new ATOM 1028 N THR A 70 -0.345 -1.302 -3.656 1.00 0.00 N ATOM 1029 CA THR A 70 -0.465 -0.594 -2.388 1.00 0.00 C ATOM 1030 C THR A 70 0.754 0.284 -2.131 1.00 0.00 C ATOM 1031 O THR A 70 0.627 1.415 -1.660 1.00 0.00 O ATOM 1032 CB THR A 70 -0.634 -1.574 -1.211 1.00 0.00 C ATOM 1033 OG1 THR A 70 -1.875 -2.278 -1.334 1.00 0.00 O ATOM 1034 CG2 THR A 70 -0.594 -0.836 0.118 1.00 0.00 C ATOM 0 H THR A 70 -0.175 -2.304 -3.565 1.00 0.00 H new ATOM 0 HA THR A 70 -1.353 0.034 -2.460 1.00 0.00 H new ATOM 0 HB THR A 70 0.191 -2.285 -1.238 1.00 0.00 H new ATOM 0 HG1 THR A 70 -1.974 -2.900 -0.583 1.00 0.00 H new ATOM 0 HG21 THR A 70 -0.715 -1.549 0.934 1.00 0.00 H new ATOM 0 HG22 THR A 70 0.363 -0.325 0.222 1.00 0.00 H new ATOM 0 HG23 THR A 70 -1.401 -0.104 0.152 1.00 0.00 H new ATOM 1042 N MET A 71 1.933 -0.242 -2.444 1.00 0.00 N ATOM 1043 CA MET A 71 3.175 0.497 -2.248 1.00 0.00 C ATOM 1044 C MET A 71 3.243 1.702 -3.181 1.00 0.00 C ATOM 1045 O MET A 71 3.565 2.811 -2.754 1.00 0.00 O ATOM 1046 CB MET A 71 4.380 -0.416 -2.487 1.00 0.00 C ATOM 1047 CG MET A 71 5.717 0.285 -2.312 1.00 0.00 C ATOM 1048 SD MET A 71 7.082 -0.871 -2.086 1.00 0.00 S ATOM 1049 CE MET A 71 6.812 -1.988 -3.459 1.00 0.00 C ATOM 0 H MET A 71 2.055 -1.176 -2.834 1.00 0.00 H new ATOM 0 HA MET A 71 3.198 0.855 -1.219 1.00 0.00 H new ATOM 0 HB2 MET A 71 4.328 -1.260 -1.799 1.00 0.00 H new ATOM 0 HB3 MET A 71 4.322 -0.824 -3.496 1.00 0.00 H new ATOM 0 HG2 MET A 71 5.914 0.907 -3.185 1.00 0.00 H new ATOM 0 HG3 MET A 71 5.664 0.951 -1.451 1.00 0.00 H new ATOM 0 HE1 MET A 71 7.609 -2.731 -3.486 1.00 0.00 H new ATOM 0 HE2 MET A 71 5.852 -2.490 -3.336 1.00 0.00 H new ATOM 0 HE3 MET A 71 6.810 -1.424 -4.392 1.00 0.00 H new ATOM 1059 N MET A 72 2.938 1.477 -4.454 1.00 0.00 N ATOM 1060 CA MET A 72 2.964 2.546 -5.446 1.00 0.00 C ATOM 1061 C MET A 72 2.074 3.708 -5.017 1.00 0.00 C ATOM 1062 O MET A 72 2.389 4.870 -5.272 1.00 0.00 O ATOM 1063 CB MET A 72 2.510 2.018 -6.809 1.00 0.00 C ATOM 1064 CG MET A 72 3.564 1.183 -7.518 1.00 0.00 C ATOM 1065 SD MET A 72 3.453 1.304 -9.314 1.00 0.00 S ATOM 1066 CE MET A 72 4.013 2.986 -9.575 1.00 0.00 C ATOM 0 H MET A 72 2.670 0.565 -4.823 1.00 0.00 H new ATOM 0 HA MET A 72 3.989 2.907 -5.527 1.00 0.00 H new ATOM 0 HB2 MET A 72 1.611 1.417 -6.676 1.00 0.00 H new ATOM 0 HB3 MET A 72 2.238 2.861 -7.444 1.00 0.00 H new ATOM 0 HG2 MET A 72 4.554 1.506 -7.196 1.00 0.00 H new ATOM 0 HG3 MET A 72 3.456 0.140 -7.221 1.00 0.00 H new ATOM 0 HE1 MET A 72 4.389 3.091 -10.593 1.00 0.00 H new ATOM 0 HE2 MET A 72 3.181 3.674 -9.423 1.00 0.00 H new ATOM 0 HE3 MET A 72 4.810 3.218 -8.868 1.00 0.00 H new ATOM 1284 N ARG A 86 5.663 15.190 -16.631 1.00 0.00 N ATOM 1285 CA ARG A 86 4.467 14.885 -17.408 1.00 0.00 C ATOM 1286 C ARG A 86 3.934 16.137 -18.098 1.00 0.00 C ATOM 1287 O ARG A 86 3.674 16.131 -19.301 1.00 0.00 O ATOM 1288 CB ARG A 86 3.386 14.287 -16.506 1.00 0.00 C ATOM 1289 CG ARG A 86 3.680 12.862 -16.066 1.00 0.00 C ATOM 1290 CD ARG A 86 3.171 11.850 -17.080 1.00 0.00 C ATOM 1291 NE ARG A 86 1.727 11.949 -17.276 1.00 0.00 N ATOM 1292 CZ ARG A 86 0.837 11.335 -16.503 1.00 0.00 C ATOM 1293 NH1 ARG A 86 1.242 10.582 -15.489 1.00 0.00 N ATOM 1294 NH2 ARG A 86 -0.460 11.474 -16.745 1.00 0.00 N ATOM 0 HA ARG A 86 4.736 14.156 -18.173 1.00 0.00 H new ATOM 0 HB2 ARG A 86 3.273 14.915 -15.622 1.00 0.00 H new ATOM 0 HB3 ARG A 86 2.433 14.306 -17.034 1.00 0.00 H new ATOM 0 HG2 ARG A 86 4.754 12.736 -15.932 1.00 0.00 H new ATOM 0 HG3 ARG A 86 3.214 12.675 -15.098 1.00 0.00 H new ATOM 0 HD2 ARG A 86 3.677 12.005 -18.033 1.00 0.00 H new ATOM 0 HD3 ARG A 86 3.423 10.844 -16.745 1.00 0.00 H new ATOM 0 HE ARG A 86 1.383 12.520 -18.048 1.00 0.00 H new ATOM 0 HH11 ARG A 86 2.239 10.473 -15.301 1.00 0.00 H new ATOM 0 HH12 ARG A 86 0.557 10.112 -14.897 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -0.774 12.052 -17.524 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -1.143 11.003 -16.152 1.00 0.00 H new ATOM 1308 N GLU A 87 3.773 17.208 -17.327 1.00 0.00 N ATOM 1309 CA GLU A 87 3.269 18.467 -17.866 1.00 0.00 C ATOM 1310 C GLU A 87 3.865 18.747 -19.242 1.00 0.00 C ATOM 1311 O GLU A 87 3.144 19.044 -20.194 1.00 0.00 O ATOM 1312 CB GLU A 87 3.591 19.620 -16.913 1.00 0.00 C ATOM 1313 CG GLU A 87 2.750 19.618 -15.648 1.00 0.00 C ATOM 1314 CD GLU A 87 1.361 20.184 -15.869 1.00 0.00 C ATOM 1315 OE1 GLU A 87 0.806 19.979 -16.969 1.00 0.00 O ATOM 1316 OE2 GLU A 87 0.830 20.833 -14.944 1.00 0.00 O ATOM 0 H GLU A 87 3.984 17.230 -16.329 1.00 0.00 H new ATOM 0 HA GLU A 87 2.187 18.382 -17.969 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.645 19.570 -16.639 1.00 0.00 H new ATOM 0 HB3 GLU A 87 3.443 20.565 -17.436 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.667 18.598 -15.273 1.00 0.00 H new ATOM 0 HG3 GLU A 87 3.257 20.200 -14.878 1.00 0.00 H new ATOM 1323 N ALA A 88 5.187 18.652 -19.338 1.00 0.00 N ATOM 1324 CA ALA A 88 5.881 18.893 -20.597 1.00 0.00 C ATOM 1325 C ALA A 88 5.424 17.914 -21.673 1.00 0.00 C ATOM 1326 O ALA A 88 5.204 18.296 -22.822 1.00 0.00 O ATOM 1327 CB ALA A 88 7.386 18.797 -20.398 1.00 0.00 C ATOM 0 H ALA A 88 5.799 18.410 -18.559 1.00 0.00 H new ATOM 0 HA ALA A 88 5.634 19.901 -20.931 1.00 0.00 H new ATOM 0 HB1 ALA A 88 7.891 18.979 -21.347 1.00 0.00 H new ATOM 0 HB2 ALA A 88 7.705 19.541 -19.668 1.00 0.00 H new ATOM 0 HB3 ALA A 88 7.642 17.801 -20.036 1.00 0.00 H new ATOM 1333 N PHE A 89 5.283 16.648 -21.293 1.00 0.00 N ATOM 1334 CA PHE A 89 4.854 15.613 -22.226 1.00 0.00 C ATOM 1335 C PHE A 89 3.479 15.937 -22.802 1.00 0.00 C ATOM 1336 O PHE A 89 3.209 15.677 -23.975 1.00 0.00 O ATOM 1337 CB PHE A 89 4.820 14.251 -21.529 1.00 0.00 C ATOM 1338 CG PHE A 89 3.823 13.298 -22.124 1.00 0.00 C ATOM 1339 CD1 PHE A 89 3.949 12.873 -23.437 1.00 0.00 C ATOM 1340 CD2 PHE A 89 2.760 12.827 -21.371 1.00 0.00 C ATOM 1341 CE1 PHE A 89 3.033 11.997 -23.987 1.00 0.00 C ATOM 1342 CE2 PHE A 89 1.841 11.950 -21.915 1.00 0.00 C ATOM 1343 CZ PHE A 89 1.978 11.534 -23.225 1.00 0.00 C ATOM 0 H PHE A 89 5.460 16.315 -20.345 1.00 0.00 H new ATOM 0 HA PHE A 89 5.572 15.576 -23.045 1.00 0.00 H new ATOM 0 HB2 PHE A 89 5.812 13.803 -21.576 1.00 0.00 H new ATOM 0 HB3 PHE A 89 4.586 14.397 -20.474 1.00 0.00 H new ATOM 0 HD1 PHE A 89 4.773 13.231 -24.037 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.648 13.149 -20.346 1.00 0.00 H new ATOM 0 HE1 PHE A 89 3.142 11.674 -25.012 1.00 0.00 H new ATOM 0 HE2 PHE A 89 1.017 11.590 -21.317 1.00 0.00 H new ATOM 0 HZ PHE A 89 1.262 10.848 -23.653 1.00 0.00 H new ATOM 1353 N ARG A 90 2.613 16.504 -21.969 1.00 0.00 N ATOM 1354 CA ARG A 90 1.265 16.862 -22.394 1.00 0.00 C ATOM 1355 C ARG A 90 1.299 18.006 -23.403 1.00 0.00 C ATOM 1356 O ARG A 90 0.646 17.949 -24.445 1.00 0.00 O ATOM 1357 CB ARG A 90 0.415 17.258 -21.186 1.00 0.00 C ATOM 1358 CG ARG A 90 0.175 16.118 -20.210 1.00 0.00 C ATOM 1359 CD ARG A 90 -0.199 16.636 -18.830 1.00 0.00 C ATOM 1360 NE ARG A 90 0.025 15.634 -17.790 1.00 0.00 N ATOM 1361 CZ ARG A 90 -0.538 15.685 -16.588 1.00 0.00 C ATOM 1362 NH1 ARG A 90 -1.353 16.683 -16.275 1.00 0.00 N ATOM 1363 NH2 ARG A 90 -0.285 14.736 -15.695 1.00 0.00 N ATOM 0 H ARG A 90 2.821 16.726 -20.995 1.00 0.00 H new ATOM 0 HA ARG A 90 0.819 15.991 -22.874 1.00 0.00 H new ATOM 0 HB2 ARG A 90 0.905 18.078 -20.661 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -0.546 17.634 -21.536 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -0.621 15.476 -20.587 1.00 0.00 H new ATOM 0 HG3 ARG A 90 1.073 15.504 -20.138 1.00 0.00 H new ATOM 0 HD2 ARG A 90 0.387 17.528 -18.606 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -1.247 16.934 -18.826 1.00 0.00 H new ATOM 0 HE ARG A 90 0.647 14.853 -17.998 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -1.549 17.415 -16.958 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -1.784 16.719 -15.351 1.00 0.00 H new ATOM 0 HH21 ARG A 90 0.342 13.967 -15.932 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -0.718 14.776 -14.772 1.00 0.00 H new ATOM 1377 N VAL A 91 2.065 19.045 -23.086 1.00 0.00 N ATOM 1378 CA VAL A 91 2.185 20.203 -23.964 1.00 0.00 C ATOM 1379 C VAL A 91 2.316 19.776 -25.422 1.00 0.00 C ATOM 1380 O VAL A 91 1.579 20.248 -26.287 1.00 0.00 O ATOM 1381 CB VAL A 91 3.399 21.072 -23.585 1.00 0.00 C ATOM 1382 CG1 VAL A 91 3.541 22.241 -24.548 1.00 0.00 C ATOM 1383 CG2 VAL A 91 3.273 21.565 -22.151 1.00 0.00 C ATOM 0 H VAL A 91 2.612 19.109 -22.227 1.00 0.00 H new ATOM 0 HA VAL A 91 1.275 20.789 -23.840 1.00 0.00 H new ATOM 0 HB VAL A 91 4.299 20.461 -23.658 1.00 0.00 H new ATOM 0 HG11 VAL A 91 4.404 22.843 -24.264 1.00 0.00 H new ATOM 0 HG12 VAL A 91 3.680 21.863 -25.561 1.00 0.00 H new ATOM 0 HG13 VAL A 91 2.641 22.855 -24.510 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.139 22.177 -21.899 1.00 0.00 H new ATOM 0 HG22 VAL A 91 2.366 22.160 -22.049 1.00 0.00 H new ATOM 0 HG23 VAL A 91 3.224 20.711 -21.476 1.00 0.00 H new ATOM 1393 N PHE A 92 3.259 18.878 -25.687 1.00 0.00 N ATOM 1394 CA PHE A 92 3.488 18.386 -27.041 1.00 0.00 C ATOM 1395 C PHE A 92 2.252 17.669 -27.575 1.00 0.00 C ATOM 1396 O PHE A 92 1.858 17.861 -28.725 1.00 0.00 O ATOM 1397 CB PHE A 92 4.691 17.441 -27.067 1.00 0.00 C ATOM 1398 CG PHE A 92 5.987 18.111 -26.711 1.00 0.00 C ATOM 1399 CD1 PHE A 92 6.457 19.180 -27.456 1.00 0.00 C ATOM 1400 CD2 PHE A 92 6.736 17.671 -25.631 1.00 0.00 C ATOM 1401 CE1 PHE A 92 7.650 19.800 -27.132 1.00 0.00 C ATOM 1402 CE2 PHE A 92 7.929 18.287 -25.301 1.00 0.00 C ATOM 1403 CZ PHE A 92 8.387 19.351 -26.053 1.00 0.00 C ATOM 0 H PHE A 92 3.877 18.476 -24.982 1.00 0.00 H new ATOM 0 HA PHE A 92 3.695 19.243 -27.682 1.00 0.00 H new ATOM 0 HB2 PHE A 92 4.513 16.620 -26.373 1.00 0.00 H new ATOM 0 HB3 PHE A 92 4.778 17.004 -28.062 1.00 0.00 H new ATOM 0 HD1 PHE A 92 5.885 19.534 -28.301 1.00 0.00 H new ATOM 0 HD2 PHE A 92 6.384 16.838 -25.041 1.00 0.00 H new ATOM 0 HE1 PHE A 92 8.005 20.633 -27.721 1.00 0.00 H new ATOM 0 HE2 PHE A 92 8.502 17.936 -24.456 1.00 0.00 H new ATOM 0 HZ PHE A 92 9.320 19.831 -25.798 1.00 0.00 H new ATOM 1413 N ASP A 93 1.645 16.841 -26.731 1.00 0.00 N ATOM 1414 CA ASP A 93 0.453 16.094 -27.117 1.00 0.00 C ATOM 1415 C ASP A 93 -0.716 17.037 -27.382 1.00 0.00 C ATOM 1416 O ASP A 93 -1.598 17.202 -26.538 1.00 0.00 O ATOM 1417 CB ASP A 93 0.079 15.091 -26.025 1.00 0.00 C ATOM 1418 CG ASP A 93 -0.980 14.107 -26.482 1.00 0.00 C ATOM 1419 OD1 ASP A 93 -0.940 13.698 -27.661 1.00 0.00 O ATOM 1420 OD2 ASP A 93 -1.849 13.746 -25.661 1.00 0.00 O ATOM 0 H ASP A 93 1.959 16.670 -25.776 1.00 0.00 H new ATOM 0 HA ASP A 93 0.674 15.552 -28.036 1.00 0.00 H new ATOM 0 HB2 ASP A 93 0.970 14.544 -25.717 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -0.283 15.630 -25.149 1.00 0.00 H new ATOM 1425 N LYS A 94 -0.717 17.655 -28.558 1.00 0.00 N ATOM 1426 CA LYS A 94 -1.778 18.581 -28.936 1.00 0.00 C ATOM 1427 C LYS A 94 -3.126 17.869 -28.997 1.00 0.00 C ATOM 1428 O LYS A 94 -4.049 18.202 -28.253 1.00 0.00 O ATOM 1429 CB LYS A 94 -1.466 19.222 -30.290 1.00 0.00 C ATOM 1430 CG LYS A 94 -0.385 20.287 -30.223 1.00 0.00 C ATOM 1431 CD LYS A 94 -0.954 21.634 -29.809 1.00 0.00 C ATOM 1432 CE LYS A 94 -1.373 22.457 -31.017 1.00 0.00 C ATOM 1433 NZ LYS A 94 -2.098 23.696 -30.620 1.00 0.00 N ATOM 0 H LYS A 94 0.006 17.531 -29.267 1.00 0.00 H new ATOM 0 HA LYS A 94 -1.833 19.361 -28.176 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.156 18.444 -30.988 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -2.377 19.666 -30.691 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.384 19.982 -29.513 1.00 0.00 H new ATOM 0 HG3 LYS A 94 0.098 20.378 -31.196 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.813 21.482 -29.155 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -0.209 22.184 -29.234 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -0.491 22.723 -31.599 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -2.011 21.854 -31.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -3.028 23.718 -31.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.227 23.707 -29.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -1.546 24.529 -30.909 1.00 0.00 H new ATOM 1447 N ASP A 95 -3.232 16.889 -29.887 1.00 0.00 N ATOM 1448 CA ASP A 95 -4.466 16.128 -30.043 1.00 0.00 C ATOM 1449 C ASP A 95 -5.015 15.698 -28.687 1.00 0.00 C ATOM 1450 O ASP A 95 -6.215 15.794 -28.433 1.00 0.00 O ATOM 1451 CB ASP A 95 -4.225 14.900 -30.923 1.00 0.00 C ATOM 1452 CG ASP A 95 -3.234 13.932 -30.306 1.00 0.00 C ATOM 1453 OD1 ASP A 95 -2.323 14.393 -29.589 1.00 0.00 O ATOM 1454 OD2 ASP A 95 -3.371 12.713 -30.542 1.00 0.00 O ATOM 0 H ASP A 95 -2.478 16.603 -30.512 1.00 0.00 H new ATOM 0 HA ASP A 95 -5.202 16.772 -30.525 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -5.172 14.387 -31.093 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -3.857 15.221 -31.897 1.00 0.00 H new ATOM 1459 N GLY A 96 -4.128 15.222 -27.818 1.00 0.00 N ATOM 1460 CA GLY A 96 -4.543 14.783 -26.499 1.00 0.00 C ATOM 1461 C GLY A 96 -4.990 13.335 -26.483 1.00 0.00 C ATOM 1462 O GLY A 96 -6.023 13.003 -25.904 1.00 0.00 O ATOM 0 H GLY A 96 -3.129 15.133 -28.005 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -3.717 14.913 -25.800 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -5.359 15.416 -26.149 1.00 0.00 H new ATOM 1466 N ASN A 97 -4.209 12.470 -27.124 1.00 0.00 N ATOM 1467 CA ASN A 97 -4.532 11.049 -27.183 1.00 0.00 C ATOM 1468 C ASN A 97 -3.504 10.225 -26.413 1.00 0.00 C ATOM 1469 O ASN A 97 -3.846 9.239 -25.762 1.00 0.00 O ATOM 1470 CB ASN A 97 -4.592 10.579 -28.638 1.00 0.00 C ATOM 1471 CG ASN A 97 -3.216 10.318 -29.218 1.00 0.00 C ATOM 1472 OD1 ASN A 97 -2.305 11.134 -29.076 1.00 0.00 O ATOM 1473 ND2 ASN A 97 -3.059 9.176 -29.878 1.00 0.00 N ATOM 0 H ASN A 97 -3.350 12.728 -27.609 1.00 0.00 H new ATOM 0 HA ASN A 97 -5.508 10.904 -26.720 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -5.188 9.668 -28.698 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -5.100 11.333 -29.240 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -2.155 8.946 -30.292 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -3.842 8.529 -29.971 1.00 0.00 H new ATOM 1480 N GLY A 98 -2.243 10.639 -26.491 1.00 0.00 N ATOM 1481 CA GLY A 98 -1.185 9.929 -25.797 1.00 0.00 C ATOM 1482 C GLY A 98 0.162 10.090 -26.473 1.00 0.00 C ATOM 1483 O GLY A 98 1.184 10.248 -25.805 1.00 0.00 O ATOM 0 H GLY A 98 -1.935 11.453 -27.022 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.119 10.293 -24.772 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.437 8.870 -25.744 1.00 0.00 H new ATOM 1487 N TYR A 99 0.165 10.049 -27.800 1.00 0.00 N ATOM 1488 CA TYR A 99 1.397 10.187 -28.567 1.00 0.00 C ATOM 1489 C TYR A 99 1.554 11.611 -29.092 1.00 0.00 C ATOM 1490 O TYR A 99 0.616 12.407 -29.051 1.00 0.00 O ATOM 1491 CB TYR A 99 1.412 9.197 -29.733 1.00 0.00 C ATOM 1492 CG TYR A 99 1.585 7.758 -29.302 1.00 0.00 C ATOM 1493 CD1 TYR A 99 0.726 7.181 -28.376 1.00 0.00 C ATOM 1494 CD2 TYR A 99 2.609 6.975 -29.823 1.00 0.00 C ATOM 1495 CE1 TYR A 99 0.882 5.866 -27.979 1.00 0.00 C ATOM 1496 CE2 TYR A 99 2.771 5.660 -29.434 1.00 0.00 C ATOM 1497 CZ TYR A 99 1.905 5.110 -28.511 1.00 0.00 C ATOM 1498 OH TYR A 99 2.063 3.800 -28.120 1.00 0.00 O ATOM 0 H TYR A 99 -0.673 9.921 -28.368 1.00 0.00 H new ATOM 0 HA TYR A 99 2.234 9.968 -27.904 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.480 9.291 -30.291 1.00 0.00 H new ATOM 0 HB3 TYR A 99 2.220 9.463 -30.415 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.078 7.770 -27.959 1.00 0.00 H new ATOM 0 HD2 TYR A 99 3.289 7.403 -30.544 1.00 0.00 H new ATOM 0 HE1 TYR A 99 0.206 5.433 -27.256 1.00 0.00 H new ATOM 0 HE2 TYR A 99 3.571 5.065 -29.850 1.00 0.00 H new ATOM 0 HH TYR A 99 2.829 3.409 -28.589 1.00 0.00 H new ATOM 1508 N ILE A 100 2.747 11.923 -29.587 1.00 0.00 N ATOM 1509 CA ILE A 100 3.028 13.250 -30.123 1.00 0.00 C ATOM 1510 C ILE A 100 3.596 13.163 -31.535 1.00 0.00 C ATOM 1511 O ILE A 100 4.740 12.752 -31.731 1.00 0.00 O ATOM 1512 CB ILE A 100 4.019 14.019 -29.229 1.00 0.00 C ATOM 1513 CG1 ILE A 100 3.481 14.116 -27.800 1.00 0.00 C ATOM 1514 CG2 ILE A 100 4.278 15.406 -29.799 1.00 0.00 C ATOM 1515 CD1 ILE A 100 4.567 14.167 -26.748 1.00 0.00 C ATOM 0 H ILE A 100 3.534 11.276 -29.628 1.00 0.00 H new ATOM 0 HA ILE A 100 2.080 13.788 -30.148 1.00 0.00 H new ATOM 0 HB ILE A 100 4.963 13.475 -29.205 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.861 15.008 -27.714 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.836 13.259 -27.604 1.00 0.00 H new ATOM 0 HG21 ILE A 100 4.980 15.938 -29.157 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.699 15.315 -30.800 1.00 0.00 H new ATOM 0 HG23 ILE A 100 3.341 15.960 -29.849 1.00 0.00 H new ATOM 0 HD11 ILE A 100 4.113 14.235 -25.759 1.00 0.00 H new ATOM 0 HD12 ILE A 100 5.174 13.263 -26.807 1.00 0.00 H new ATOM 0 HD13 ILE A 100 5.198 15.039 -26.918 1.00 0.00 H new ATOM 1527 N SER A 101 2.790 13.555 -32.516 1.00 0.00 N ATOM 1528 CA SER A 101 3.212 13.521 -33.912 1.00 0.00 C ATOM 1529 C SER A 101 4.039 14.754 -34.261 1.00 0.00 C ATOM 1530 O SER A 101 3.999 15.762 -33.555 1.00 0.00 O ATOM 1531 CB SER A 101 1.993 13.433 -34.833 1.00 0.00 C ATOM 1532 OG SER A 101 1.141 14.552 -34.659 1.00 0.00 O ATOM 0 H SER A 101 1.841 13.900 -32.370 1.00 0.00 H new ATOM 0 HA SER A 101 3.833 12.637 -34.056 1.00 0.00 H new ATOM 0 HB2 SER A 101 2.321 13.379 -35.871 1.00 0.00 H new ATOM 0 HB3 SER A 101 1.441 12.516 -34.625 1.00 0.00 H new ATOM 0 HG SER A 101 0.371 14.473 -35.259 1.00 0.00 H new ATOM 1538 N ALA A 102 4.789 14.666 -35.354 1.00 0.00 N ATOM 1539 CA ALA A 102 5.625 15.774 -35.799 1.00 0.00 C ATOM 1540 C ALA A 102 4.806 17.050 -35.958 1.00 0.00 C ATOM 1541 O ALA A 102 5.216 18.122 -35.514 1.00 0.00 O ATOM 1542 CB ALA A 102 6.317 15.422 -37.107 1.00 0.00 C ATOM 0 H ALA A 102 4.835 13.838 -35.948 1.00 0.00 H new ATOM 0 HA ALA A 102 6.384 15.953 -35.037 1.00 0.00 H new ATOM 0 HB1 ALA A 102 6.938 16.259 -37.427 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.942 14.541 -36.962 1.00 0.00 H new ATOM 0 HB3 ALA A 102 5.568 15.213 -37.871 1.00 0.00 H new ATOM 1548 N ALA A 103 3.646 16.927 -36.595 1.00 0.00 N ATOM 1549 CA ALA A 103 2.768 18.071 -36.811 1.00 0.00 C ATOM 1550 C ALA A 103 2.288 18.654 -35.487 1.00 0.00 C ATOM 1551 O ALA A 103 2.437 19.849 -35.234 1.00 0.00 O ATOM 1552 CB ALA A 103 1.581 17.669 -37.674 1.00 0.00 C ATOM 0 H ALA A 103 3.292 16.047 -36.970 1.00 0.00 H new ATOM 0 HA ALA A 103 3.338 18.841 -37.331 1.00 0.00 H new ATOM 0 HB1 ALA A 103 0.934 18.532 -37.827 1.00 0.00 H new ATOM 0 HB2 ALA A 103 1.938 17.307 -38.638 1.00 0.00 H new ATOM 0 HB3 ALA A 103 1.020 16.879 -37.175 1.00 0.00 H new ATOM 1558 N GLU A 104 1.712 17.801 -34.645 1.00 0.00 N ATOM 1559 CA GLU A 104 1.209 18.234 -33.346 1.00 0.00 C ATOM 1560 C GLU A 104 2.223 19.130 -32.641 1.00 0.00 C ATOM 1561 O GLU A 104 1.942 20.293 -32.347 1.00 0.00 O ATOM 1562 CB GLU A 104 0.887 17.022 -32.470 1.00 0.00 C ATOM 1563 CG GLU A 104 -0.471 16.404 -32.759 1.00 0.00 C ATOM 1564 CD GLU A 104 -0.688 15.099 -32.020 1.00 0.00 C ATOM 1565 OE1 GLU A 104 -0.194 14.972 -30.880 1.00 0.00 O ATOM 1566 OE2 GLU A 104 -1.353 14.203 -32.582 1.00 0.00 O ATOM 0 H GLU A 104 1.582 16.808 -34.839 1.00 0.00 H new ATOM 0 HA GLU A 104 0.297 18.807 -33.511 1.00 0.00 H new ATOM 0 HB2 GLU A 104 1.659 16.266 -32.613 1.00 0.00 H new ATOM 0 HB3 GLU A 104 0.925 17.321 -31.423 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -1.254 17.109 -32.480 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -0.566 16.230 -33.831 1.00 0.00 H new ATOM 1573 N LEU A 105 3.402 18.581 -32.371 1.00 0.00 N ATOM 1574 CA LEU A 105 4.459 19.329 -31.700 1.00 0.00 C ATOM 1575 C LEU A 105 4.932 20.496 -32.561 1.00 0.00 C ATOM 1576 O LEU A 105 5.023 21.630 -32.092 1.00 0.00 O ATOM 1577 CB LEU A 105 5.637 18.408 -31.377 1.00 0.00 C ATOM 1578 CG LEU A 105 6.936 19.100 -30.963 1.00 0.00 C ATOM 1579 CD1 LEU A 105 7.810 18.155 -30.153 1.00 0.00 C ATOM 1580 CD2 LEU A 105 7.686 19.604 -32.188 1.00 0.00 C ATOM 0 H LEU A 105 3.650 17.620 -32.607 1.00 0.00 H new ATOM 0 HA LEU A 105 4.053 19.729 -30.771 1.00 0.00 H new ATOM 0 HB2 LEU A 105 5.336 17.734 -30.575 1.00 0.00 H new ATOM 0 HB3 LEU A 105 5.840 17.791 -32.252 1.00 0.00 H new ATOM 0 HG LEU A 105 6.685 19.956 -30.337 1.00 0.00 H new ATOM 0 HD11 LEU A 105 8.730 18.665 -29.867 1.00 0.00 H new ATOM 0 HD12 LEU A 105 7.275 17.843 -29.256 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.053 17.279 -30.754 1.00 0.00 H new ATOM 0 HD21 LEU A 105 8.608 20.094 -31.874 1.00 0.00 H new ATOM 0 HD22 LEU A 105 7.925 18.763 -32.840 1.00 0.00 H new ATOM 0 HD23 LEU A 105 7.063 20.316 -32.729 1.00 0.00 H new ATOM 1592 N ARG A 106 5.229 20.209 -33.824 1.00 0.00 N ATOM 1593 CA ARG A 106 5.691 21.235 -34.752 1.00 0.00 C ATOM 1594 C ARG A 106 5.002 22.568 -34.476 1.00 0.00 C ATOM 1595 O ARG A 106 5.638 23.622 -34.488 1.00 0.00 O ATOM 1596 CB ARG A 106 5.429 20.802 -36.196 1.00 0.00 C ATOM 1597 CG ARG A 106 5.653 21.909 -37.213 1.00 0.00 C ATOM 1598 CD ARG A 106 4.992 21.585 -38.544 1.00 0.00 C ATOM 1599 NE ARG A 106 5.578 22.343 -39.645 1.00 0.00 N ATOM 1600 CZ ARG A 106 5.179 23.562 -39.992 1.00 0.00 C ATOM 1601 NH1 ARG A 106 4.199 24.157 -39.326 1.00 0.00 N ATOM 1602 NH2 ARG A 106 5.762 24.188 -41.007 1.00 0.00 N ATOM 0 H ARG A 106 5.158 19.275 -34.228 1.00 0.00 H new ATOM 0 HA ARG A 106 6.764 21.364 -34.608 1.00 0.00 H new ATOM 0 HB2 ARG A 106 6.079 19.961 -36.438 1.00 0.00 H new ATOM 0 HB3 ARG A 106 4.402 20.446 -36.279 1.00 0.00 H new ATOM 0 HG2 ARG A 106 5.254 22.846 -36.826 1.00 0.00 H new ATOM 0 HG3 ARG A 106 6.723 22.056 -37.363 1.00 0.00 H new ATOM 0 HD2 ARG A 106 5.089 20.518 -38.746 1.00 0.00 H new ATOM 0 HD3 ARG A 106 3.926 21.802 -38.482 1.00 0.00 H new ATOM 0 HE ARG A 106 6.335 21.914 -40.177 1.00 0.00 H new ATOM 0 HH11 ARG A 106 3.749 23.679 -38.545 1.00 0.00 H new ATOM 0 HH12 ARG A 106 3.895 25.093 -39.594 1.00 0.00 H new ATOM 0 HH21 ARG A 106 6.517 23.733 -41.521 1.00 0.00 H new ATOM 0 HH22 ARG A 106 5.455 25.124 -41.273 1.00 0.00 H new ATOM 1616 N HIS A 107 3.697 22.513 -34.229 1.00 0.00 N ATOM 1617 CA HIS A 107 2.921 23.717 -33.950 1.00 0.00 C ATOM 1618 C HIS A 107 3.374 24.365 -32.645 1.00 0.00 C ATOM 1619 O HIS A 107 3.559 25.580 -32.576 1.00 0.00 O ATOM 1620 CB HIS A 107 1.431 23.382 -33.876 1.00 0.00 C ATOM 1621 CG HIS A 107 0.562 24.573 -33.612 1.00 0.00 C ATOM 1622 ND1 HIS A 107 0.033 25.046 -32.459 1.00 0.00 N flip ATOM 1623 CD2 HIS A 107 0.140 25.431 -34.606 1.00 0.00 C flip ATOM 1624 CE1 HIS A 107 -0.689 26.170 -32.774 1.00 0.00 C flip ATOM 1625 NE2 HIS A 107 -0.609 26.382 -34.075 1.00 0.00 N flip ATOM 0 H HIS A 107 3.155 21.649 -34.216 1.00 0.00 H new ATOM 0 HA HIS A 107 3.087 24.424 -34.763 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.124 22.919 -34.814 1.00 0.00 H new ATOM 0 HB3 HIS A 107 1.271 22.644 -33.089 1.00 0.00 H new ATOM 0 HD2 HIS A 107 0.383 25.340 -35.654 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -1.235 26.782 -32.071 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -1.050 27.149 -34.583 1.00 0.00 H new ATOM 1634 N VAL A 108 3.551 23.547 -31.613 1.00 0.00 N ATOM 1635 CA VAL A 108 3.982 24.041 -30.311 1.00 0.00 C ATOM 1636 C VAL A 108 5.312 24.779 -30.417 1.00 0.00 C ATOM 1637 O VAL A 108 5.418 25.945 -30.039 1.00 0.00 O ATOM 1638 CB VAL A 108 4.124 22.893 -29.294 1.00 0.00 C ATOM 1639 CG1 VAL A 108 4.625 23.421 -27.958 1.00 0.00 C ATOM 1640 CG2 VAL A 108 2.799 22.164 -29.126 1.00 0.00 C ATOM 0 H VAL A 108 3.403 22.539 -31.653 1.00 0.00 H new ATOM 0 HA VAL A 108 3.213 24.731 -29.963 1.00 0.00 H new ATOM 0 HB VAL A 108 4.858 22.183 -29.674 1.00 0.00 H new ATOM 0 HG11 VAL A 108 4.719 22.595 -27.253 1.00 0.00 H new ATOM 0 HG12 VAL A 108 5.598 23.894 -28.095 1.00 0.00 H new ATOM 0 HG13 VAL A 108 3.918 24.153 -27.568 1.00 0.00 H new ATOM 0 HG21 VAL A 108 2.917 21.356 -28.404 1.00 0.00 H new ATOM 0 HG22 VAL A 108 2.042 22.862 -28.768 1.00 0.00 H new ATOM 0 HG23 VAL A 108 2.487 21.751 -30.085 1.00 0.00 H new ATOM 1650 N MET A 109 6.325 24.090 -30.933 1.00 0.00 N ATOM 1651 CA MET A 109 7.649 24.681 -31.090 1.00 0.00 C ATOM 1652 C MET A 109 7.550 26.097 -31.650 1.00 0.00 C ATOM 1653 O MET A 109 8.296 26.990 -31.246 1.00 0.00 O ATOM 1654 CB MET A 109 8.512 23.816 -32.010 1.00 0.00 C ATOM 1655 CG MET A 109 9.064 22.572 -31.333 1.00 0.00 C ATOM 1656 SD MET A 109 10.542 22.910 -30.357 1.00 0.00 S ATOM 1657 CE MET A 109 9.861 22.911 -28.701 1.00 0.00 C ATOM 0 H MET A 109 6.254 23.123 -31.249 1.00 0.00 H new ATOM 0 HA MET A 109 8.116 24.730 -30.106 1.00 0.00 H new ATOM 0 HB2 MET A 109 7.920 23.517 -32.875 1.00 0.00 H new ATOM 0 HB3 MET A 109 9.342 24.415 -32.384 1.00 0.00 H new ATOM 0 HG2 MET A 109 8.297 22.144 -30.687 1.00 0.00 H new ATOM 0 HG3 MET A 109 9.297 21.824 -32.091 1.00 0.00 H new ATOM 0 HE1 MET A 109 10.669 22.822 -27.975 1.00 0.00 H new ATOM 0 HE2 MET A 109 9.321 23.842 -28.530 1.00 0.00 H new ATOM 0 HE3 MET A 109 9.177 22.070 -28.588 1.00 0.00 H new ATOM 1667 N THR A 110 6.624 26.296 -32.583 1.00 0.00 N ATOM 1668 CA THR A 110 6.428 27.602 -33.199 1.00 0.00 C ATOM 1669 C THR A 110 6.267 28.689 -32.143 1.00 0.00 C ATOM 1670 O THR A 110 6.918 29.731 -32.208 1.00 0.00 O ATOM 1671 CB THR A 110 5.193 27.609 -34.119 1.00 0.00 C ATOM 1672 OG1 THR A 110 5.314 26.583 -35.110 1.00 0.00 O ATOM 1673 CG2 THR A 110 5.032 28.961 -34.799 1.00 0.00 C ATOM 0 H THR A 110 5.998 25.569 -32.928 1.00 0.00 H new ATOM 0 HA THR A 110 7.317 27.807 -33.795 1.00 0.00 H new ATOM 0 HB THR A 110 4.311 27.420 -33.507 1.00 0.00 H new ATOM 0 HG1 THR A 110 5.249 25.704 -34.681 1.00 0.00 H new ATOM 0 HG21 THR A 110 4.153 28.942 -35.444 1.00 0.00 H new ATOM 0 HG22 THR A 110 4.910 29.736 -34.043 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.917 29.174 -35.398 1.00 0.00 H new ATOM 1681 N ASN A 111 5.397 28.439 -31.170 1.00 0.00 N ATOM 1682 CA ASN A 111 5.151 29.399 -30.100 1.00 0.00 C ATOM 1683 C ASN A 111 6.459 30.011 -29.608 1.00 0.00 C ATOM 1684 O ASN A 111 6.554 31.224 -29.413 1.00 0.00 O ATOM 1685 CB ASN A 111 4.423 28.721 -28.937 1.00 0.00 C ATOM 1686 CG ASN A 111 2.915 28.793 -29.078 1.00 0.00 C ATOM 1687 OD1 ASN A 111 2.301 27.954 -29.737 1.00 0.00 O ATOM 1688 ND2 ASN A 111 2.310 29.800 -28.458 1.00 0.00 N ATOM 0 H ASN A 111 4.851 27.580 -31.100 1.00 0.00 H new ATOM 0 HA ASN A 111 4.524 30.197 -30.497 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.730 27.677 -28.879 1.00 0.00 H new ATOM 0 HB3 ASN A 111 4.721 29.193 -28.001 1.00 0.00 H new ATOM 0 HD21 ASN A 111 1.297 29.901 -28.517 1.00 0.00 H new ATOM 0 HD22 ASN A 111 2.859 30.473 -27.922 1.00 0.00 H new ATOM 1695 N LEU A 112 7.464 29.166 -29.409 1.00 0.00 N ATOM 1696 CA LEU A 112 8.767 29.624 -28.940 1.00 0.00 C ATOM 1697 C LEU A 112 9.105 30.992 -29.523 1.00 0.00 C ATOM 1698 O LEU A 112 9.589 31.876 -28.817 1.00 0.00 O ATOM 1699 CB LEU A 112 9.851 28.613 -29.319 1.00 0.00 C ATOM 1700 CG LEU A 112 9.837 27.292 -28.549 1.00 0.00 C ATOM 1701 CD1 LEU A 112 10.815 26.305 -29.165 1.00 0.00 C ATOM 1702 CD2 LEU A 112 10.165 27.527 -27.082 1.00 0.00 C ATOM 0 H LEU A 112 7.402 28.160 -29.565 1.00 0.00 H new ATOM 0 HA LEU A 112 8.725 29.713 -27.854 1.00 0.00 H new ATOM 0 HB2 LEU A 112 9.757 28.392 -30.382 1.00 0.00 H new ATOM 0 HB3 LEU A 112 10.824 29.083 -29.176 1.00 0.00 H new ATOM 0 HG LEU A 112 8.836 26.866 -28.613 1.00 0.00 H new ATOM 0 HD11 LEU A 112 10.791 25.371 -28.604 1.00 0.00 H new ATOM 0 HD12 LEU A 112 10.535 26.113 -30.201 1.00 0.00 H new ATOM 0 HD13 LEU A 112 11.822 26.722 -29.133 1.00 0.00 H new ATOM 0 HD21 LEU A 112 10.151 26.576 -26.549 1.00 0.00 H new ATOM 0 HD22 LEU A 112 11.155 27.975 -26.998 1.00 0.00 H new ATOM 0 HD23 LEU A 112 9.425 28.198 -26.647 1.00 0.00 H new ATOM 1714 N GLY A 113 8.846 31.160 -30.816 1.00 0.00 N ATOM 1715 CA GLY A 113 9.127 32.424 -31.471 1.00 0.00 C ATOM 1716 C GLY A 113 10.044 32.266 -32.667 1.00 0.00 C ATOM 1717 O GLY A 113 10.860 33.142 -32.952 1.00 0.00 O ATOM 0 H GLY A 113 8.446 30.443 -31.422 1.00 0.00 H new ATOM 0 HA2 GLY A 113 8.190 32.879 -31.793 1.00 0.00 H new ATOM 0 HA3 GLY A 113 9.584 33.107 -30.755 1.00 0.00 H new ATOM 1721 N GLU A 114 9.911 31.144 -33.369 1.00 0.00 N ATOM 1722 CA GLU A 114 10.737 30.874 -34.539 1.00 0.00 C ATOM 1723 C GLU A 114 9.908 30.246 -35.656 1.00 0.00 C ATOM 1724 O GLU A 114 8.706 30.027 -35.506 1.00 0.00 O ATOM 1725 CB GLU A 114 11.898 29.949 -34.169 1.00 0.00 C ATOM 1726 CG GLU A 114 12.698 30.427 -32.969 1.00 0.00 C ATOM 1727 CD GLU A 114 14.158 30.022 -33.042 1.00 0.00 C ATOM 1728 OE1 GLU A 114 14.804 30.318 -34.069 1.00 0.00 O ATOM 1729 OE2 GLU A 114 14.653 29.410 -32.073 1.00 0.00 O ATOM 0 H GLU A 114 9.240 30.409 -33.147 1.00 0.00 H new ATOM 0 HA GLU A 114 11.138 31.823 -34.896 1.00 0.00 H new ATOM 0 HB2 GLU A 114 11.506 28.953 -33.961 1.00 0.00 H new ATOM 0 HB3 GLU A 114 12.565 29.856 -35.026 1.00 0.00 H new ATOM 0 HG2 GLU A 114 12.629 31.513 -32.900 1.00 0.00 H new ATOM 0 HG3 GLU A 114 12.257 30.021 -32.058 1.00 0.00 H new ATOM 1736 N LYS A 115 10.560 29.957 -36.778 1.00 0.00 N ATOM 1737 CA LYS A 115 9.886 29.354 -37.921 1.00 0.00 C ATOM 1738 C LYS A 115 10.527 28.019 -38.288 1.00 0.00 C ATOM 1739 O LYS A 115 11.606 27.978 -38.881 1.00 0.00 O ATOM 1740 CB LYS A 115 9.931 30.300 -39.124 1.00 0.00 C ATOM 1741 CG LYS A 115 9.022 31.508 -38.980 1.00 0.00 C ATOM 1742 CD LYS A 115 9.399 32.608 -39.959 1.00 0.00 C ATOM 1743 CE LYS A 115 8.841 32.334 -41.347 1.00 0.00 C ATOM 1744 NZ LYS A 115 7.357 32.452 -41.382 1.00 0.00 N ATOM 0 H LYS A 115 11.555 30.131 -36.919 1.00 0.00 H new ATOM 0 HA LYS A 115 8.847 29.176 -37.645 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.956 30.642 -39.269 1.00 0.00 H new ATOM 0 HB3 LYS A 115 9.649 29.748 -40.021 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.988 31.208 -39.148 1.00 0.00 H new ATOM 0 HG3 LYS A 115 9.082 31.890 -37.961 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.022 33.564 -39.596 1.00 0.00 H new ATOM 0 HD3 LYS A 115 10.484 32.693 -40.012 1.00 0.00 H new ATOM 0 HE2 LYS A 115 9.278 33.035 -42.059 1.00 0.00 H new ATOM 0 HE3 LYS A 115 9.133 31.333 -41.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 7.042 32.580 -42.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 6.931 31.587 -40.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 7.060 33.271 -40.814 1.00 0.00 H new ATOM 1758 N LEU A 116 9.855 26.929 -37.933 1.00 0.00 N ATOM 1759 CA LEU A 116 10.358 25.591 -38.226 1.00 0.00 C ATOM 1760 C LEU A 116 9.478 24.892 -39.257 1.00 0.00 C ATOM 1761 O LEU A 116 8.355 25.321 -39.524 1.00 0.00 O ATOM 1762 CB LEU A 116 10.424 24.757 -36.945 1.00 0.00 C ATOM 1763 CG LEU A 116 11.242 25.352 -35.799 1.00 0.00 C ATOM 1764 CD1 LEU A 116 11.074 24.521 -34.536 1.00 0.00 C ATOM 1765 CD2 LEU A 116 12.711 25.447 -36.185 1.00 0.00 C ATOM 0 H LEU A 116 8.961 26.945 -37.442 1.00 0.00 H new ATOM 0 HA LEU A 116 11.362 25.690 -38.640 1.00 0.00 H new ATOM 0 HB2 LEU A 116 9.407 24.591 -36.591 1.00 0.00 H new ATOM 0 HB3 LEU A 116 10.839 23.780 -37.192 1.00 0.00 H new ATOM 0 HG LEU A 116 10.874 26.358 -35.600 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.663 24.960 -33.731 1.00 0.00 H new ATOM 0 HD12 LEU A 116 10.023 24.504 -34.249 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.415 23.503 -34.722 1.00 0.00 H new ATOM 0 HD21 LEU A 116 13.278 25.873 -35.357 1.00 0.00 H new ATOM 0 HD22 LEU A 116 13.093 24.452 -36.412 1.00 0.00 H new ATOM 0 HD23 LEU A 116 12.816 26.085 -37.063 1.00 0.00 H new ATOM 1777 N THR A 117 9.995 23.811 -39.834 1.00 0.00 N ATOM 1778 CA THR A 117 9.256 23.052 -40.834 1.00 0.00 C ATOM 1779 C THR A 117 9.368 21.553 -40.580 1.00 0.00 C ATOM 1780 O THR A 117 10.234 21.104 -39.829 1.00 0.00 O ATOM 1781 CB THR A 117 9.760 23.359 -42.257 1.00 0.00 C ATOM 1782 OG1 THR A 117 11.161 23.080 -42.352 1.00 0.00 O ATOM 1783 CG2 THR A 117 9.501 24.813 -42.621 1.00 0.00 C ATOM 0 H THR A 117 10.923 23.442 -39.625 1.00 0.00 H new ATOM 0 HA THR A 117 8.212 23.354 -40.753 1.00 0.00 H new ATOM 0 HB THR A 117 9.216 22.724 -42.956 1.00 0.00 H new ATOM 0 HG1 THR A 117 11.473 23.276 -43.260 1.00 0.00 H new ATOM 0 HG21 THR A 117 9.865 25.006 -43.630 1.00 0.00 H new ATOM 0 HG22 THR A 117 8.431 25.014 -42.577 1.00 0.00 H new ATOM 0 HG23 THR A 117 10.021 25.463 -41.917 1.00 0.00 H new ATOM 1791 N ASP A 118 8.488 20.783 -41.211 1.00 0.00 N ATOM 1792 CA ASP A 118 8.490 19.333 -41.054 1.00 0.00 C ATOM 1793 C ASP A 118 9.916 18.793 -41.009 1.00 0.00 C ATOM 1794 O ASP A 118 10.206 17.842 -40.285 1.00 0.00 O ATOM 1795 CB ASP A 118 7.718 18.674 -42.198 1.00 0.00 C ATOM 1796 CG ASP A 118 6.235 18.557 -41.905 1.00 0.00 C ATOM 1797 OD1 ASP A 118 5.733 19.337 -41.068 1.00 0.00 O ATOM 1798 OD2 ASP A 118 5.577 17.685 -42.510 1.00 0.00 O ATOM 0 H ASP A 118 7.764 21.139 -41.836 1.00 0.00 H new ATOM 0 HA ASP A 118 8.000 19.094 -40.110 1.00 0.00 H new ATOM 0 HB2 ASP A 118 7.860 19.254 -43.110 1.00 0.00 H new ATOM 0 HB3 ASP A 118 8.128 17.681 -42.384 1.00 0.00 H new ATOM 1803 N GLU A 119 10.801 19.406 -41.789 1.00 0.00 N ATOM 1804 CA GLU A 119 12.196 18.985 -41.839 1.00 0.00 C ATOM 1805 C GLU A 119 12.870 19.176 -40.484 1.00 0.00 C ATOM 1806 O GLU A 119 13.422 18.234 -39.916 1.00 0.00 O ATOM 1807 CB GLU A 119 12.951 19.772 -42.912 1.00 0.00 C ATOM 1808 CG GLU A 119 12.552 19.403 -44.331 1.00 0.00 C ATOM 1809 CD GLU A 119 12.766 17.933 -44.634 1.00 0.00 C ATOM 1810 OE1 GLU A 119 13.646 17.318 -43.994 1.00 0.00 O ATOM 1811 OE2 GLU A 119 12.056 17.397 -45.510 1.00 0.00 O ATOM 0 H GLU A 119 10.577 20.195 -42.395 1.00 0.00 H new ATOM 0 HA GLU A 119 12.220 17.925 -42.092 1.00 0.00 H new ATOM 0 HB2 GLU A 119 12.776 20.837 -42.760 1.00 0.00 H new ATOM 0 HB3 GLU A 119 14.021 19.604 -42.789 1.00 0.00 H new ATOM 0 HG2 GLU A 119 11.502 19.653 -44.486 1.00 0.00 H new ATOM 0 HG3 GLU A 119 13.130 20.003 -45.034 1.00 0.00 H new ATOM 1818 N GLU A 120 12.821 20.401 -39.972 1.00 0.00 N ATOM 1819 CA GLU A 120 13.428 20.716 -38.684 1.00 0.00 C ATOM 1820 C GLU A 120 12.942 19.754 -37.604 1.00 0.00 C ATOM 1821 O GLU A 120 13.741 19.171 -36.870 1.00 0.00 O ATOM 1822 CB GLU A 120 13.107 22.157 -38.282 1.00 0.00 C ATOM 1823 CG GLU A 120 13.665 23.195 -39.241 1.00 0.00 C ATOM 1824 CD GLU A 120 15.101 22.911 -39.638 1.00 0.00 C ATOM 1825 OE1 GLU A 120 15.979 22.937 -38.750 1.00 0.00 O ATOM 1826 OE2 GLU A 120 15.345 22.662 -40.837 1.00 0.00 O ATOM 0 H GLU A 120 12.367 21.192 -40.429 1.00 0.00 H new ATOM 0 HA GLU A 120 14.508 20.607 -38.784 1.00 0.00 H new ATOM 0 HB2 GLU A 120 12.025 22.276 -38.221 1.00 0.00 H new ATOM 0 HB3 GLU A 120 13.505 22.344 -37.285 1.00 0.00 H new ATOM 0 HG2 GLU A 120 13.044 23.228 -40.136 1.00 0.00 H new ATOM 0 HG3 GLU A 120 13.608 24.180 -38.778 1.00 0.00 H new ATOM 1833 N VAL A 121 11.626 19.594 -37.512 1.00 0.00 N ATOM 1834 CA VAL A 121 11.031 18.703 -36.522 1.00 0.00 C ATOM 1835 C VAL A 121 11.417 17.252 -36.787 1.00 0.00 C ATOM 1836 O VAL A 121 11.728 16.503 -35.861 1.00 0.00 O ATOM 1837 CB VAL A 121 9.496 18.821 -36.512 1.00 0.00 C ATOM 1838 CG1 VAL A 121 8.889 17.813 -35.546 1.00 0.00 C ATOM 1839 CG2 VAL A 121 9.073 20.237 -36.152 1.00 0.00 C ATOM 0 H VAL A 121 10.951 20.070 -38.111 1.00 0.00 H new ATOM 0 HA VAL A 121 11.417 19.007 -35.549 1.00 0.00 H new ATOM 0 HB VAL A 121 9.125 18.599 -37.513 1.00 0.00 H new ATOM 0 HG11 VAL A 121 7.803 17.911 -35.552 1.00 0.00 H new ATOM 0 HG12 VAL A 121 9.164 16.804 -35.853 1.00 0.00 H new ATOM 0 HG13 VAL A 121 9.264 18.001 -34.540 1.00 0.00 H new ATOM 0 HG21 VAL A 121 7.985 20.302 -36.150 1.00 0.00 H new ATOM 0 HG22 VAL A 121 9.454 20.490 -35.163 1.00 0.00 H new ATOM 0 HG23 VAL A 121 9.477 20.935 -36.885 1.00 0.00 H new ATOM 1849 N ASP A 122 11.395 16.862 -38.056 1.00 0.00 N ATOM 1850 CA ASP A 122 11.744 15.500 -38.444 1.00 0.00 C ATOM 1851 C ASP A 122 12.997 15.031 -37.711 1.00 0.00 C ATOM 1852 O ASP A 122 13.031 13.928 -37.166 1.00 0.00 O ATOM 1853 CB ASP A 122 11.962 15.418 -39.956 1.00 0.00 C ATOM 1854 CG ASP A 122 10.687 15.087 -40.707 1.00 0.00 C ATOM 1855 OD1 ASP A 122 9.597 15.440 -40.210 1.00 0.00 O ATOM 1856 OD2 ASP A 122 10.780 14.477 -41.792 1.00 0.00 O ATOM 0 H ASP A 122 11.139 17.470 -38.834 1.00 0.00 H new ATOM 0 HA ASP A 122 10.917 14.846 -38.168 1.00 0.00 H new ATOM 0 HB2 ASP A 122 12.356 16.369 -40.316 1.00 0.00 H new ATOM 0 HB3 ASP A 122 12.715 14.659 -40.171 1.00 0.00 H new ATOM 1861 N GLU A 123 14.024 15.875 -37.704 1.00 0.00 N ATOM 1862 CA GLU A 123 15.279 15.545 -37.039 1.00 0.00 C ATOM 1863 C GLU A 123 15.043 15.198 -35.572 1.00 0.00 C ATOM 1864 O GLU A 123 15.740 14.360 -35.002 1.00 0.00 O ATOM 1865 CB GLU A 123 16.262 16.712 -37.148 1.00 0.00 C ATOM 1866 CG GLU A 123 16.624 17.073 -38.578 1.00 0.00 C ATOM 1867 CD GLU A 123 17.949 17.803 -38.679 1.00 0.00 C ATOM 1868 OE1 GLU A 123 18.978 17.226 -38.269 1.00 0.00 O ATOM 1869 OE2 GLU A 123 17.956 18.953 -39.167 1.00 0.00 O ATOM 0 H GLU A 123 14.012 16.792 -38.151 1.00 0.00 H new ATOM 0 HA GLU A 123 15.705 14.673 -37.536 1.00 0.00 H new ATOM 0 HB2 GLU A 123 15.830 17.586 -36.660 1.00 0.00 H new ATOM 0 HB3 GLU A 123 17.173 16.461 -36.604 1.00 0.00 H new ATOM 0 HG2 GLU A 123 16.668 16.164 -39.178 1.00 0.00 H new ATOM 0 HG3 GLU A 123 15.837 17.697 -39.001 1.00 0.00 H new ATOM 1876 N MET A 124 14.056 15.851 -34.968 1.00 0.00 N ATOM 1877 CA MET A 124 13.727 15.612 -33.567 1.00 0.00 C ATOM 1878 C MET A 124 13.012 14.275 -33.397 1.00 0.00 C ATOM 1879 O MET A 124 13.404 13.453 -32.568 1.00 0.00 O ATOM 1880 CB MET A 124 12.852 16.744 -33.026 1.00 0.00 C ATOM 1881 CG MET A 124 12.203 16.425 -31.689 1.00 0.00 C ATOM 1882 SD MET A 124 11.836 17.904 -30.724 1.00 0.00 S ATOM 1883 CE MET A 124 11.193 17.175 -29.220 1.00 0.00 C ATOM 0 H MET A 124 13.470 16.549 -35.426 1.00 0.00 H new ATOM 0 HA MET A 124 14.658 15.581 -33.001 1.00 0.00 H new ATOM 0 HB2 MET A 124 13.459 17.643 -32.920 1.00 0.00 H new ATOM 0 HB3 MET A 124 12.073 16.970 -33.754 1.00 0.00 H new ATOM 0 HG2 MET A 124 11.281 15.870 -31.861 1.00 0.00 H new ATOM 0 HG3 MET A 124 12.864 15.776 -31.115 1.00 0.00 H new ATOM 0 HE1 MET A 124 11.398 17.837 -28.378 1.00 0.00 H new ATOM 0 HE2 MET A 124 10.117 17.033 -29.316 1.00 0.00 H new ATOM 0 HE3 MET A 124 11.673 16.211 -29.049 1.00 0.00 H new ATOM 1893 N ILE A 125 11.963 14.066 -34.185 1.00 0.00 N ATOM 1894 CA ILE A 125 11.195 12.829 -34.121 1.00 0.00 C ATOM 1895 C ILE A 125 12.103 11.611 -34.256 1.00 0.00 C ATOM 1896 O ILE A 125 11.857 10.570 -33.646 1.00 0.00 O ATOM 1897 CB ILE A 125 10.119 12.777 -35.221 1.00 0.00 C ATOM 1898 CG1 ILE A 125 9.124 13.926 -35.046 1.00 0.00 C ATOM 1899 CG2 ILE A 125 9.399 11.437 -35.195 1.00 0.00 C ATOM 1900 CD1 ILE A 125 8.171 13.729 -33.887 1.00 0.00 C ATOM 0 H ILE A 125 11.626 14.737 -34.875 1.00 0.00 H new ATOM 0 HA ILE A 125 10.708 12.810 -33.146 1.00 0.00 H new ATOM 0 HB ILE A 125 10.606 12.887 -36.190 1.00 0.00 H new ATOM 0 HG12 ILE A 125 9.676 14.854 -34.898 1.00 0.00 H new ATOM 0 HG13 ILE A 125 8.548 14.040 -35.964 1.00 0.00 H new ATOM 0 HG21 ILE A 125 8.641 11.416 -35.978 1.00 0.00 H new ATOM 0 HG22 ILE A 125 10.117 10.635 -35.363 1.00 0.00 H new ATOM 0 HG23 ILE A 125 8.922 11.299 -34.225 1.00 0.00 H new ATOM 0 HD11 ILE A 125 7.495 14.582 -33.823 1.00 0.00 H new ATOM 0 HD12 ILE A 125 7.593 12.818 -34.042 1.00 0.00 H new ATOM 0 HD13 ILE A 125 8.738 13.645 -32.960 1.00 0.00 H new ATOM 1912 N ARG A 126 13.154 11.749 -35.058 1.00 0.00 N ATOM 1913 CA ARG A 126 14.099 10.660 -35.273 1.00 0.00 C ATOM 1914 C ARG A 126 15.094 10.569 -34.120 1.00 0.00 C ATOM 1915 O ARG A 126 16.123 9.902 -34.227 1.00 0.00 O ATOM 1916 CB ARG A 126 14.847 10.858 -36.592 1.00 0.00 C ATOM 1917 CG ARG A 126 15.938 11.915 -36.521 1.00 0.00 C ATOM 1918 CD ARG A 126 16.962 11.734 -37.631 1.00 0.00 C ATOM 1919 NE ARG A 126 17.946 10.706 -37.305 1.00 0.00 N ATOM 1920 CZ ARG A 126 19.043 10.937 -36.594 1.00 0.00 C ATOM 1921 NH1 ARG A 126 19.295 12.155 -36.135 1.00 0.00 N ATOM 1922 NH2 ARG A 126 19.891 9.949 -36.339 1.00 0.00 N ATOM 0 H ARG A 126 13.372 12.604 -35.569 1.00 0.00 H new ATOM 0 HA ARG A 126 13.536 9.728 -35.319 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.291 9.909 -36.894 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.133 11.137 -37.367 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.491 12.906 -36.595 1.00 0.00 H new ATOM 0 HG3 ARG A 126 16.436 11.861 -35.553 1.00 0.00 H new ATOM 0 HD2 ARG A 126 16.451 11.466 -38.556 1.00 0.00 H new ATOM 0 HD3 ARG A 126 17.472 12.680 -37.811 1.00 0.00 H new ATOM 0 HE ARG A 126 17.781 9.758 -37.642 1.00 0.00 H new ATOM 0 HH11 ARG A 126 18.645 12.917 -36.328 1.00 0.00 H new ATOM 0 HH12 ARG A 126 20.139 12.330 -35.589 1.00 0.00 H new ATOM 0 HH21 ARG A 126 19.701 9.010 -36.689 1.00 0.00 H new ATOM 0 HH22 ARG A 126 20.733 10.128 -35.793 1.00 0.00 H new ATOM 1936 N GLU A 127 14.779 11.243 -33.019 1.00 0.00 N ATOM 1937 CA GLU A 127 15.647 11.239 -31.847 1.00 0.00 C ATOM 1938 C GLU A 127 14.949 10.589 -30.655 1.00 0.00 C ATOM 1939 O GLU A 127 15.576 9.886 -29.863 1.00 0.00 O ATOM 1940 CB GLU A 127 16.067 12.666 -31.490 1.00 0.00 C ATOM 1941 CG GLU A 127 17.378 12.742 -30.726 1.00 0.00 C ATOM 1942 CD GLU A 127 17.525 14.035 -29.948 1.00 0.00 C ATOM 1943 OE1 GLU A 127 16.911 14.150 -28.866 1.00 0.00 O ATOM 1944 OE2 GLU A 127 18.254 14.933 -30.419 1.00 0.00 O ATOM 0 H GLU A 127 13.930 11.798 -32.914 1.00 0.00 H new ATOM 0 HA GLU A 127 16.536 10.656 -32.088 1.00 0.00 H new ATOM 0 HB2 GLU A 127 16.156 13.249 -32.406 1.00 0.00 H new ATOM 0 HB3 GLU A 127 15.281 13.128 -30.893 1.00 0.00 H new ATOM 0 HG2 GLU A 127 17.443 11.899 -30.038 1.00 0.00 H new ATOM 0 HG3 GLU A 127 18.208 12.647 -31.426 1.00 0.00 H new ATOM 1951 N ALA A 128 13.648 10.831 -30.536 1.00 0.00 N ATOM 1952 CA ALA A 128 12.864 10.269 -29.443 1.00 0.00 C ATOM 1953 C ALA A 128 11.998 9.112 -29.927 1.00 0.00 C ATOM 1954 O ALA A 128 11.770 8.147 -29.197 1.00 0.00 O ATOM 1955 CB ALA A 128 12.000 11.347 -28.804 1.00 0.00 C ATOM 0 H ALA A 128 13.115 11.412 -31.183 1.00 0.00 H new ATOM 0 HA ALA A 128 13.555 9.882 -28.694 1.00 0.00 H new ATOM 0 HB1 ALA A 128 11.420 10.913 -27.989 1.00 0.00 H new ATOM 0 HB2 ALA A 128 12.638 12.140 -28.413 1.00 0.00 H new ATOM 0 HB3 ALA A 128 11.323 11.761 -29.551 1.00 0.00 H new ATOM 1961 N ASP A 129 11.516 9.215 -31.161 1.00 0.00 N ATOM 1962 CA ASP A 129 10.674 8.176 -31.743 1.00 0.00 C ATOM 1963 C ASP A 129 11.414 6.843 -31.794 1.00 0.00 C ATOM 1964 O ASP A 129 12.288 6.639 -32.637 1.00 0.00 O ATOM 1965 CB ASP A 129 10.228 8.580 -33.149 1.00 0.00 C ATOM 1966 CG ASP A 129 9.065 7.746 -33.649 1.00 0.00 C ATOM 1967 OD1 ASP A 129 8.825 6.661 -33.079 1.00 0.00 O ATOM 1968 OD2 ASP A 129 8.394 8.179 -34.610 1.00 0.00 O ATOM 0 H ASP A 129 11.694 10.008 -31.778 1.00 0.00 H new ATOM 0 HA ASP A 129 9.794 8.059 -31.111 1.00 0.00 H new ATOM 0 HB2 ASP A 129 9.943 9.632 -33.148 1.00 0.00 H new ATOM 0 HB3 ASP A 129 11.067 8.477 -33.837 1.00 0.00 H new ATOM 1973 N ILE A 130 11.058 5.940 -30.887 1.00 0.00 N ATOM 1974 CA ILE A 130 11.688 4.627 -30.829 1.00 0.00 C ATOM 1975 C ILE A 130 11.061 3.672 -31.840 1.00 0.00 C ATOM 1976 O ILE A 130 11.756 3.093 -32.675 1.00 0.00 O ATOM 1977 CB ILE A 130 11.578 4.011 -29.422 1.00 0.00 C ATOM 1978 CG1 ILE A 130 11.982 5.036 -28.360 1.00 0.00 C ATOM 1979 CG2 ILE A 130 12.445 2.765 -29.320 1.00 0.00 C ATOM 1980 CD1 ILE A 130 13.479 5.200 -28.217 1.00 0.00 C ATOM 0 H ILE A 130 10.337 6.093 -30.182 1.00 0.00 H new ATOM 0 HA ILE A 130 12.741 4.771 -31.072 1.00 0.00 H new ATOM 0 HB ILE A 130 10.541 3.724 -29.247 1.00 0.00 H new ATOM 0 HG12 ILE A 130 11.541 6.001 -28.612 1.00 0.00 H new ATOM 0 HG13 ILE A 130 11.564 4.736 -27.399 1.00 0.00 H new ATOM 0 HG21 ILE A 130 12.357 2.341 -28.320 1.00 0.00 H new ATOM 0 HG22 ILE A 130 12.115 2.031 -30.056 1.00 0.00 H new ATOM 0 HG23 ILE A 130 13.485 3.029 -29.512 1.00 0.00 H new ATOM 0 HD11 ILE A 130 13.692 5.942 -27.447 1.00 0.00 H new ATOM 0 HD12 ILE A 130 13.924 4.246 -27.935 1.00 0.00 H new ATOM 0 HD13 ILE A 130 13.901 5.531 -29.166 1.00 0.00 H new ATOM 1992 N ASP A 131 9.745 3.513 -31.758 1.00 0.00 N ATOM 1993 CA ASP A 131 9.023 2.631 -32.668 1.00 0.00 C ATOM 1994 C ASP A 131 9.291 3.011 -34.121 1.00 0.00 C ATOM 1995 O ASP A 131 9.573 2.152 -34.956 1.00 0.00 O ATOM 1996 CB ASP A 131 7.522 2.686 -32.382 1.00 0.00 C ATOM 1997 CG ASP A 131 7.068 4.061 -31.934 1.00 0.00 C ATOM 1998 OD1 ASP A 131 7.060 4.986 -32.773 1.00 0.00 O ATOM 1999 OD2 ASP A 131 6.722 4.214 -30.743 1.00 0.00 O ATOM 0 H ASP A 131 9.156 3.983 -31.071 1.00 0.00 H new ATOM 0 HA ASP A 131 9.379 1.613 -32.506 1.00 0.00 H new ATOM 0 HB2 ASP A 131 6.973 2.400 -33.279 1.00 0.00 H new ATOM 0 HB3 ASP A 131 7.275 1.956 -31.611 1.00 0.00 H new ATOM 2004 N GLY A 132 9.201 4.304 -34.416 1.00 0.00 N ATOM 2005 CA GLY A 132 9.435 4.775 -35.768 1.00 0.00 C ATOM 2006 C GLY A 132 8.148 4.965 -36.547 1.00 0.00 C ATOM 2007 O GLY A 132 8.054 4.570 -37.709 1.00 0.00 O ATOM 0 H GLY A 132 8.970 5.034 -33.742 1.00 0.00 H new ATOM 0 HA2 GLY A 132 9.977 5.720 -35.731 1.00 0.00 H new ATOM 0 HA3 GLY A 132 10.072 4.063 -36.293 1.00 0.00 H new ATOM 2011 N ASP A 133 7.154 5.569 -35.906 1.00 0.00 N ATOM 2012 CA ASP A 133 5.866 5.810 -36.546 1.00 0.00 C ATOM 2013 C ASP A 133 5.575 7.305 -36.636 1.00 0.00 C ATOM 2014 O ASP A 133 4.430 7.714 -36.820 1.00 0.00 O ATOM 2015 CB ASP A 133 4.749 5.106 -35.773 1.00 0.00 C ATOM 2016 CG ASP A 133 4.870 5.302 -34.275 1.00 0.00 C ATOM 2017 OD1 ASP A 133 5.363 6.369 -33.854 1.00 0.00 O ATOM 2018 OD2 ASP A 133 4.471 4.388 -33.522 1.00 0.00 O ATOM 0 H ASP A 133 7.215 5.901 -34.943 1.00 0.00 H new ATOM 0 HA ASP A 133 5.909 5.405 -37.557 1.00 0.00 H new ATOM 0 HB2 ASP A 133 3.784 5.485 -36.109 1.00 0.00 H new ATOM 0 HB3 ASP A 133 4.770 4.040 -36.000 1.00 0.00 H new ATOM 2023 N GLY A 134 6.621 8.115 -36.505 1.00 0.00 N ATOM 2024 CA GLY A 134 6.457 9.555 -36.573 1.00 0.00 C ATOM 2025 C GLY A 134 5.664 10.105 -35.404 1.00 0.00 C ATOM 2026 O GLY A 134 4.978 11.118 -35.534 1.00 0.00 O ATOM 0 H GLY A 134 7.579 7.800 -36.353 1.00 0.00 H new ATOM 0 HA2 GLY A 134 7.439 10.028 -36.597 1.00 0.00 H new ATOM 0 HA3 GLY A 134 5.954 9.817 -37.504 1.00 0.00 H new ATOM 2030 N GLN A 135 5.756 9.433 -34.261 1.00 0.00 N ATOM 2031 CA GLN A 135 5.039 9.860 -33.065 1.00 0.00 C ATOM 2032 C GLN A 135 5.918 9.724 -31.826 1.00 0.00 C ATOM 2033 O GLN A 135 6.857 8.929 -31.803 1.00 0.00 O ATOM 2034 CB GLN A 135 3.761 9.038 -32.891 1.00 0.00 C ATOM 2035 CG GLN A 135 3.005 8.806 -34.190 1.00 0.00 C ATOM 2036 CD GLN A 135 1.518 8.604 -33.971 1.00 0.00 C ATOM 2037 OE1 GLN A 135 0.717 9.511 -34.196 1.00 0.00 O ATOM 2038 NE2 GLN A 135 1.142 7.409 -33.531 1.00 0.00 N ATOM 0 H GLN A 135 6.319 8.592 -34.138 1.00 0.00 H new ATOM 0 HA GLN A 135 4.774 10.910 -33.186 1.00 0.00 H new ATOM 0 HB2 GLN A 135 4.016 8.074 -32.452 1.00 0.00 H new ATOM 0 HB3 GLN A 135 3.105 9.547 -32.184 1.00 0.00 H new ATOM 0 HG2 GLN A 135 3.159 9.658 -34.853 1.00 0.00 H new ATOM 0 HG3 GLN A 135 3.416 7.932 -34.694 1.00 0.00 H new ATOM 0 HE21 GLN A 135 1.841 6.686 -33.358 1.00 0.00 H new ATOM 0 HE22 GLN A 135 0.155 7.214 -33.366 1.00 0.00 H new ATOM 2047 N VAL A 136 5.606 10.506 -30.797 1.00 0.00 N ATOM 2048 CA VAL A 136 6.367 10.473 -29.554 1.00 0.00 C ATOM 2049 C VAL A 136 5.441 10.493 -28.342 1.00 0.00 C ATOM 2050 O VAL A 136 4.776 11.493 -28.074 1.00 0.00 O ATOM 2051 CB VAL A 136 7.343 11.660 -29.461 1.00 0.00 C ATOM 2052 CG1 VAL A 136 8.041 11.674 -28.109 1.00 0.00 C ATOM 2053 CG2 VAL A 136 8.357 11.606 -30.593 1.00 0.00 C ATOM 0 H VAL A 136 4.832 11.170 -30.800 1.00 0.00 H new ATOM 0 HA VAL A 136 6.937 9.544 -29.557 1.00 0.00 H new ATOM 0 HB VAL A 136 6.773 12.584 -29.558 1.00 0.00 H new ATOM 0 HG11 VAL A 136 8.727 12.520 -28.062 1.00 0.00 H new ATOM 0 HG12 VAL A 136 7.298 11.765 -27.317 1.00 0.00 H new ATOM 0 HG13 VAL A 136 8.599 10.747 -27.978 1.00 0.00 H new ATOM 0 HG21 VAL A 136 9.039 12.453 -30.511 1.00 0.00 H new ATOM 0 HG22 VAL A 136 8.923 10.677 -30.530 1.00 0.00 H new ATOM 0 HG23 VAL A 136 7.837 11.650 -31.550 1.00 0.00 H new ATOM 2063 N ASN A 137 5.404 9.383 -27.613 1.00 0.00 N ATOM 2064 CA ASN A 137 4.560 9.274 -26.429 1.00 0.00 C ATOM 2065 C ASN A 137 5.315 9.714 -25.179 1.00 0.00 C ATOM 2066 O ASN A 137 6.478 10.112 -25.252 1.00 0.00 O ATOM 2067 CB ASN A 137 4.066 7.835 -26.260 1.00 0.00 C ATOM 2068 CG ASN A 137 5.131 6.923 -25.682 1.00 0.00 C ATOM 2069 OD1 ASN A 137 5.265 6.800 -24.465 1.00 0.00 O ATOM 2070 ND2 ASN A 137 5.895 6.278 -26.556 1.00 0.00 N ATOM 0 H ASN A 137 5.949 8.546 -27.821 1.00 0.00 H new ATOM 0 HA ASN A 137 3.702 9.933 -26.564 1.00 0.00 H new ATOM 0 HB2 ASN A 137 3.192 7.828 -25.608 1.00 0.00 H new ATOM 0 HB3 ASN A 137 3.745 7.448 -27.227 1.00 0.00 H new ATOM 0 HD21 ASN A 137 6.628 5.650 -26.227 1.00 0.00 H new ATOM 0 HD22 ASN A 137 5.748 6.410 -27.557 1.00 0.00 H new ATOM 2077 N TYR A 138 4.647 9.639 -24.034 1.00 0.00 N ATOM 2078 CA TYR A 138 5.255 10.032 -22.768 1.00 0.00 C ATOM 2079 C TYR A 138 6.621 9.377 -22.593 1.00 0.00 C ATOM 2080 O TYR A 138 7.629 10.059 -22.412 1.00 0.00 O ATOM 2081 CB TYR A 138 4.342 9.652 -21.601 1.00 0.00 C ATOM 2082 CG TYR A 138 5.005 9.775 -20.248 1.00 0.00 C ATOM 2083 CD1 TYR A 138 5.190 11.018 -19.653 1.00 0.00 C ATOM 2084 CD2 TYR A 138 5.449 8.650 -19.564 1.00 0.00 C ATOM 2085 CE1 TYR A 138 5.796 11.135 -18.418 1.00 0.00 C ATOM 2086 CE2 TYR A 138 6.055 8.758 -18.328 1.00 0.00 C ATOM 2087 CZ TYR A 138 6.227 10.003 -17.759 1.00 0.00 C ATOM 2088 OH TYR A 138 6.831 10.115 -16.528 1.00 0.00 O ATOM 0 H TYR A 138 3.685 9.310 -23.956 1.00 0.00 H new ATOM 0 HA TYR A 138 5.390 11.114 -22.779 1.00 0.00 H new ATOM 0 HB2 TYR A 138 3.457 10.288 -21.621 1.00 0.00 H new ATOM 0 HB3 TYR A 138 4.001 8.626 -21.737 1.00 0.00 H new ATOM 0 HD1 TYR A 138 4.854 11.907 -20.166 1.00 0.00 H new ATOM 0 HD2 TYR A 138 5.318 7.674 -20.007 1.00 0.00 H new ATOM 0 HE1 TYR A 138 5.932 12.108 -17.970 1.00 0.00 H new ATOM 0 HE2 TYR A 138 6.392 7.873 -17.810 1.00 0.00 H new ATOM 0 HH TYR A 138 7.074 9.224 -16.200 1.00 0.00 H new ATOM 2098 N GLU A 139 6.645 8.049 -22.649 1.00 0.00 N ATOM 2099 CA GLU A 139 7.888 7.301 -22.497 1.00 0.00 C ATOM 2100 C GLU A 139 8.971 7.851 -23.420 1.00 0.00 C ATOM 2101 O GLU A 139 9.949 8.441 -22.964 1.00 0.00 O ATOM 2102 CB GLU A 139 7.655 5.817 -22.792 1.00 0.00 C ATOM 2103 CG GLU A 139 8.844 4.935 -22.449 1.00 0.00 C ATOM 2104 CD GLU A 139 8.514 3.457 -22.522 1.00 0.00 C ATOM 2105 OE1 GLU A 139 7.941 3.026 -23.545 1.00 0.00 O ATOM 2106 OE2 GLU A 139 8.830 2.731 -21.556 1.00 0.00 O ATOM 0 H GLU A 139 5.819 7.469 -22.798 1.00 0.00 H new ATOM 0 HA GLU A 139 8.225 7.411 -21.466 1.00 0.00 H new ATOM 0 HB2 GLU A 139 6.786 5.475 -22.230 1.00 0.00 H new ATOM 0 HB3 GLU A 139 7.418 5.698 -23.849 1.00 0.00 H new ATOM 0 HG2 GLU A 139 9.664 5.155 -23.133 1.00 0.00 H new ATOM 0 HG3 GLU A 139 9.193 5.176 -21.445 1.00 0.00 H new ATOM 2113 N GLU A 140 8.787 7.652 -24.722 1.00 0.00 N ATOM 2114 CA GLU A 140 9.749 8.126 -25.710 1.00 0.00 C ATOM 2115 C GLU A 140 10.227 9.535 -25.370 1.00 0.00 C ATOM 2116 O GLU A 140 11.403 9.861 -25.537 1.00 0.00 O ATOM 2117 CB GLU A 140 9.128 8.110 -27.108 1.00 0.00 C ATOM 2118 CG GLU A 140 8.807 6.714 -27.615 1.00 0.00 C ATOM 2119 CD GLU A 140 7.911 6.729 -28.838 1.00 0.00 C ATOM 2120 OE1 GLU A 140 8.042 7.661 -29.659 1.00 0.00 O ATOM 2121 OE2 GLU A 140 7.079 5.808 -28.975 1.00 0.00 O ATOM 0 H GLU A 140 7.981 7.166 -25.116 1.00 0.00 H new ATOM 0 HA GLU A 140 10.608 7.455 -25.695 1.00 0.00 H new ATOM 0 HB2 GLU A 140 8.213 8.703 -27.097 1.00 0.00 H new ATOM 0 HB3 GLU A 140 9.812 8.593 -27.806 1.00 0.00 H new ATOM 0 HG2 GLU A 140 9.736 6.197 -27.856 1.00 0.00 H new ATOM 0 HG3 GLU A 140 8.322 6.146 -26.821 1.00 0.00 H new ATOM 2128 N PHE A 141 9.307 10.367 -24.893 1.00 0.00 N ATOM 2129 CA PHE A 141 9.633 11.741 -24.532 1.00 0.00 C ATOM 2130 C PHE A 141 10.512 11.782 -23.285 1.00 0.00 C ATOM 2131 O PHE A 141 11.480 12.539 -23.218 1.00 0.00 O ATOM 2132 CB PHE A 141 8.353 12.546 -24.293 1.00 0.00 C ATOM 2133 CG PHE A 141 8.552 13.738 -23.402 1.00 0.00 C ATOM 2134 CD1 PHE A 141 9.201 14.869 -23.870 1.00 0.00 C ATOM 2135 CD2 PHE A 141 8.089 13.728 -22.096 1.00 0.00 C ATOM 2136 CE1 PHE A 141 9.386 15.967 -23.051 1.00 0.00 C ATOM 2137 CE2 PHE A 141 8.270 14.824 -21.273 1.00 0.00 C ATOM 2138 CZ PHE A 141 8.919 15.945 -21.752 1.00 0.00 C ATOM 0 H PHE A 141 8.330 10.113 -24.748 1.00 0.00 H new ATOM 0 HA PHE A 141 10.185 12.186 -25.360 1.00 0.00 H new ATOM 0 HB2 PHE A 141 7.960 12.881 -25.253 1.00 0.00 H new ATOM 0 HB3 PHE A 141 7.600 11.893 -23.851 1.00 0.00 H new ATOM 0 HD1 PHE A 141 9.566 14.893 -24.886 1.00 0.00 H new ATOM 0 HD2 PHE A 141 7.581 12.854 -21.717 1.00 0.00 H new ATOM 0 HE1 PHE A 141 9.896 16.842 -23.427 1.00 0.00 H new ATOM 0 HE2 PHE A 141 7.904 14.804 -20.257 1.00 0.00 H new ATOM 0 HZ PHE A 141 9.061 16.803 -21.112 1.00 0.00 H new ATOM 2148 N VAL A 142 10.167 10.961 -22.298 1.00 0.00 N ATOM 2149 CA VAL A 142 10.924 10.902 -21.053 1.00 0.00 C ATOM 2150 C VAL A 142 12.364 10.469 -21.305 1.00 0.00 C ATOM 2151 O VAL A 142 13.297 11.008 -20.712 1.00 0.00 O ATOM 2152 CB VAL A 142 10.276 9.931 -20.048 1.00 0.00 C ATOM 2153 CG1 VAL A 142 11.119 9.826 -18.787 1.00 0.00 C ATOM 2154 CG2 VAL A 142 8.859 10.375 -19.717 1.00 0.00 C ATOM 0 H VAL A 142 9.368 10.328 -22.336 1.00 0.00 H new ATOM 0 HA VAL A 142 10.919 11.907 -20.631 1.00 0.00 H new ATOM 0 HB VAL A 142 10.225 8.943 -20.505 1.00 0.00 H new ATOM 0 HG11 VAL A 142 10.645 9.136 -18.089 1.00 0.00 H new ATOM 0 HG12 VAL A 142 12.113 9.458 -19.043 1.00 0.00 H new ATOM 0 HG13 VAL A 142 11.204 10.809 -18.324 1.00 0.00 H new ATOM 0 HG21 VAL A 142 8.416 9.678 -19.006 1.00 0.00 H new ATOM 0 HG22 VAL A 142 8.883 11.373 -19.280 1.00 0.00 H new ATOM 0 HG23 VAL A 142 8.261 10.393 -20.628 1.00 0.00 H new ATOM 2164 N GLN A 143 12.535 9.491 -22.190 1.00 0.00 N ATOM 2165 CA GLN A 143 13.862 8.986 -22.520 1.00 0.00 C ATOM 2166 C GLN A 143 14.744 10.096 -23.083 1.00 0.00 C ATOM 2167 O GLN A 143 15.849 10.331 -22.595 1.00 0.00 O ATOM 2168 CB GLN A 143 13.758 7.841 -23.530 1.00 0.00 C ATOM 2169 CG GLN A 143 12.637 6.861 -23.224 1.00 0.00 C ATOM 2170 CD GLN A 143 12.957 5.449 -23.675 1.00 0.00 C ATOM 2171 OE1 GLN A 143 12.540 5.019 -24.751 1.00 0.00 O ATOM 2172 NE2 GLN A 143 13.701 4.719 -22.853 1.00 0.00 N ATOM 0 H GLN A 143 11.772 9.034 -22.690 1.00 0.00 H new ATOM 0 HA GLN A 143 14.319 8.614 -21.603 1.00 0.00 H new ATOM 0 HB2 GLN A 143 13.603 8.258 -24.525 1.00 0.00 H new ATOM 0 HB3 GLN A 143 14.705 7.301 -23.554 1.00 0.00 H new ATOM 0 HG2 GLN A 143 12.443 6.861 -22.151 1.00 0.00 H new ATOM 0 HG3 GLN A 143 11.723 7.196 -23.714 1.00 0.00 H new ATOM 0 HE21 GLN A 143 14.025 5.115 -21.971 1.00 0.00 H new ATOM 0 HE22 GLN A 143 13.948 3.762 -23.104 1.00 0.00 H new ATOM 2181 N MET A 144 14.247 10.776 -24.111 1.00 0.00 N ATOM 2182 CA MET A 144 14.990 11.862 -24.739 1.00 0.00 C ATOM 2183 C MET A 144 15.502 12.846 -23.692 1.00 0.00 C ATOM 2184 O MET A 144 16.667 13.244 -23.718 1.00 0.00 O ATOM 2185 CB MET A 144 14.107 12.593 -25.753 1.00 0.00 C ATOM 2186 CG MET A 144 14.694 13.911 -26.231 1.00 0.00 C ATOM 2187 SD MET A 144 13.706 14.682 -27.527 1.00 0.00 S ATOM 2188 CE MET A 144 13.233 16.212 -26.727 1.00 0.00 C ATOM 0 H MET A 144 13.333 10.594 -24.527 1.00 0.00 H new ATOM 0 HA MET A 144 15.846 11.431 -25.257 1.00 0.00 H new ATOM 0 HB2 MET A 144 13.943 11.944 -26.614 1.00 0.00 H new ATOM 0 HB3 MET A 144 13.131 12.781 -25.304 1.00 0.00 H new ATOM 0 HG2 MET A 144 14.776 14.595 -25.386 1.00 0.00 H new ATOM 0 HG3 MET A 144 15.704 13.741 -26.603 1.00 0.00 H new ATOM 0 HE1 MET A 144 12.146 16.268 -26.663 1.00 0.00 H new ATOM 0 HE2 MET A 144 13.658 16.245 -25.724 1.00 0.00 H new ATOM 0 HE3 MET A 144 13.606 17.056 -27.307 1.00 0.00 H new ATOM 2198 N MET A 145 14.625 13.236 -22.772 1.00 0.00 N ATOM 2199 CA MET A 145 14.991 14.173 -21.716 1.00 0.00 C ATOM 2200 C MET A 145 16.311 13.771 -21.066 1.00 0.00 C ATOM 2201 O MET A 145 17.159 14.618 -20.783 1.00 0.00 O ATOM 2202 CB MET A 145 13.887 14.238 -20.659 1.00 0.00 C ATOM 2203 CG MET A 145 12.523 14.599 -21.225 1.00 0.00 C ATOM 2204 SD MET A 145 11.545 15.606 -20.094 1.00 0.00 S ATOM 2205 CE MET A 145 11.800 17.238 -20.788 1.00 0.00 C ATOM 0 H MET A 145 13.657 12.918 -22.737 1.00 0.00 H new ATOM 0 HA MET A 145 15.113 15.159 -22.165 1.00 0.00 H new ATOM 0 HB2 MET A 145 13.819 13.273 -20.157 1.00 0.00 H new ATOM 0 HB3 MET A 145 14.163 14.972 -19.902 1.00 0.00 H new ATOM 0 HG2 MET A 145 12.655 15.138 -22.163 1.00 0.00 H new ATOM 0 HG3 MET A 145 11.976 13.685 -21.456 1.00 0.00 H new ATOM 0 HE1 MET A 145 11.041 17.919 -20.404 1.00 0.00 H new ATOM 0 HE2 MET A 145 12.789 17.602 -20.509 1.00 0.00 H new ATOM 0 HE3 MET A 145 11.725 17.187 -21.874 1.00 0.00 H new ATOM 2215 N THR A 146 16.479 12.473 -20.831 1.00 0.00 N ATOM 2216 CA THR A 146 17.695 11.960 -20.212 1.00 0.00 C ATOM 2217 C THR A 146 18.511 11.138 -21.204 1.00 0.00 C ATOM 2218 O THR A 146 18.676 9.930 -21.035 1.00 0.00 O ATOM 2219 CB THR A 146 17.375 11.090 -18.982 1.00 0.00 C ATOM 2220 OG1 THR A 146 16.625 9.937 -19.378 1.00 0.00 O ATOM 2221 CG2 THR A 146 16.588 11.883 -17.949 1.00 0.00 C ATOM 0 H THR A 146 15.788 11.758 -21.060 1.00 0.00 H new ATOM 0 HA THR A 146 18.278 12.825 -19.894 1.00 0.00 H new ATOM 0 HB THR A 146 18.317 10.773 -18.534 1.00 0.00 H new ATOM 0 HG1 THR A 146 17.163 9.391 -19.989 1.00 0.00 H new ATOM 0 HG21 THR A 146 16.373 11.248 -17.089 1.00 0.00 H new ATOM 0 HG22 THR A 146 17.174 12.744 -17.627 1.00 0.00 H new ATOM 0 HG23 THR A 146 15.652 12.226 -18.390 1.00 0.00 H new