USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 949 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 21 MET CE :methyl 145:sc= -0.129 (180deg=0) USER MOD Set 1.2: A 178 SER OG : rot 67:sc= 0.841 USER MOD Set 1.3: A 182 GLN :FLIP amide:sc= -2.55 F(o=-3.4!,f=-1.8) USER MOD Set 2.1: A 100 MET CE :methyl 177:sc= 0 (180deg=-0.0137) USER MOD Set 2.2: A 147 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0756) USER MOD Set 3.1: A 77 TYR OH : rot 40:sc= 0.26 USER MOD Set 3.2: A 166 HIS : no HD1:sc= -1.73! X(o=-1.5!,f=-1) USER MOD Single : A 17 HIS : no HD1:sc= -0.121 X(o=-0.12,f=0) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 GLN : amide:sc= 0.143 K(o=0.14,f=-0.88) USER MOD Single : A 23 GLN : amide:sc= -0.577 K(o=-0.58,f=-1.4!) USER MOD Single : A 24 ASN :FLIP amide:sc= -0.0918 F(o=-0.95,f=-0.092) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= -1.38 K(o=-1.4,f=-4.7!) USER MOD Single : A 71 GLN : amide:sc= -0.406 X(o=-0.41,f=-0.025) USER MOD Single : A 72 LYS NZ :NH3+ -155:sc= -0.0665 (180deg=-0.429) USER MOD Single : A 76 GLN :FLIP amide:sc= -1.19 F(o=-2.1!,f=-1.2) USER MOD Single : A 80 MET CE :methyl -151:sc= -0.464 (180deg=-1.81!) USER MOD Single : A 89 MET CE :methyl -116:sc= -0.386 (180deg=-1.3) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= -1.73 K(o=-1.7,f=-4.5) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -2.61! C(o=-2.6!,f=-3.2!) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 67:sc= 0.888 USER MOD Single : A 103 SER OG : rot 104:sc= 1.24 USER MOD Single : A 104 SER OG : rot 94:sc= 0.83 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 130:sc= 0.0202 USER MOD Single : A 112 ASN :FLIP amide:sc= -0.639 F(o=-2.7,f=-0.64) USER MOD Single : A 113 MET CE :methyl -165:sc=-0.00288 (180deg=-0.2) USER MOD Single : A 114 ASN : amide:sc= -4.49! C(o=-4.5!,f=-8.3!) USER MOD Single : A 119 THR OG1 : rot 73:sc= -0.304 USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.0249 USER MOD Single : A 124 SER OG : rot 180:sc= -0.453 USER MOD Single : A 126 LYS NZ :NH3+ -111:sc= 0.295 (180deg=-0.257) USER MOD Single : A 127 ASN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 135 CYS SG : rot 170:sc= 0.445 USER MOD Single : A 141 SER OG : rot 130:sc= -0.0111 USER MOD Single : A 143 MET CE :methyl -134:sc= -0.16 (180deg=-4.16!) USER MOD Single : A 150 HIS : no HD1:sc= -0.14 X(o=-0.14,f=-0.5) USER MOD Single : A 151 THR OG1 : rot -9:sc= 1.08 USER MOD Single : A 156 MET CE :methyl -179:sc= 0 (180deg=-0.0014) USER MOD Single : A 158 THR OG1 : rot -157:sc= 1.13 USER MOD Single : A 165 CYS SG : rot 160:sc= 0 USER MOD Single : A 170 CYS SG : rot 110:sc= -3.33! USER MOD Single : A 173 ASN : amide:sc= 0.289 K(o=0.29,f=-5.5!) USER MOD Single : A 176 ASN : amide:sc= -0.16 X(o=-0.16,f=-0.38) USER MOD Single : A 185 CYS SG : rot -130:sc= 0.00567 USER MOD ----------------------------------------------------------------- ATOM 196 N HIS A 17 15.926 6.278 -7.217 1.00 0.00 N ATOM 197 CA HIS A 17 14.473 6.336 -7.105 1.00 0.00 C ATOM 198 C HIS A 17 14.004 5.727 -5.787 1.00 0.00 C ATOM 199 O HIS A 17 13.050 6.207 -5.174 1.00 0.00 O ATOM 200 CB HIS A 17 13.820 5.605 -8.279 1.00 0.00 C ATOM 201 CG HIS A 17 12.462 5.058 -7.964 1.00 0.00 C ATOM 202 ND1 HIS A 17 11.302 5.785 -8.131 1.00 0.00 N ATOM 203 CD2 HIS A 17 12.082 3.848 -7.492 1.00 0.00 C ATOM 204 CE1 HIS A 17 10.267 5.045 -7.773 1.00 0.00 C ATOM 205 NE2 HIS A 17 10.714 3.865 -7.382 1.00 0.00 N ATOM 0 HA HIS A 17 14.174 7.384 -7.127 1.00 0.00 H new ATOM 0 HB2 HIS A 17 13.740 6.290 -9.123 1.00 0.00 H new ATOM 0 HB3 HIS A 17 14.468 4.787 -8.593 1.00 0.00 H new ATOM 0 HD2 HIS A 17 12.734 3.022 -7.247 1.00 0.00 H new ATOM 0 HE1 HIS A 17 9.232 5.353 -7.796 1.00 0.00 H new ATOM 0 HE2 HIS A 17 10.136 3.092 -7.052 1.00 0.00 H new ATOM 213 N LEU A 18 14.680 4.667 -5.358 1.00 0.00 N ATOM 214 CA LEU A 18 14.333 3.991 -4.113 1.00 0.00 C ATOM 215 C LEU A 18 14.641 4.875 -2.909 1.00 0.00 C ATOM 216 O LEU A 18 13.828 4.999 -1.993 1.00 0.00 O ATOM 217 CB LEU A 18 15.095 2.669 -3.998 1.00 0.00 C ATOM 218 CG LEU A 18 14.632 1.544 -4.924 1.00 0.00 C ATOM 219 CD1 LEU A 18 15.646 0.412 -4.937 1.00 0.00 C ATOM 220 CD2 LEU A 18 13.263 1.032 -4.499 1.00 0.00 C ATOM 0 H LEU A 18 15.472 4.257 -5.854 1.00 0.00 H new ATOM 0 HA LEU A 18 13.262 3.786 -4.126 1.00 0.00 H new ATOM 0 HB2 LEU A 18 16.150 2.863 -4.194 1.00 0.00 H new ATOM 0 HB3 LEU A 18 15.021 2.319 -2.969 1.00 0.00 H new ATOM 0 HG LEU A 18 14.550 1.943 -5.935 1.00 0.00 H new ATOM 0 HD11 LEU A 18 15.299 -0.379 -5.601 1.00 0.00 H new ATOM 0 HD12 LEU A 18 16.606 0.788 -5.290 1.00 0.00 H new ATOM 0 HD13 LEU A 18 15.761 0.015 -3.928 1.00 0.00 H new ATOM 0 HD21 LEU A 18 12.950 0.232 -5.169 1.00 0.00 H new ATOM 0 HD22 LEU A 18 13.318 0.651 -3.479 1.00 0.00 H new ATOM 0 HD23 LEU A 18 12.540 1.847 -4.543 1.00 0.00 H new ATOM 232 N SER A 19 15.819 5.490 -2.919 1.00 0.00 N ATOM 233 CA SER A 19 16.236 6.362 -1.827 1.00 0.00 C ATOM 234 C SER A 19 15.107 7.307 -1.425 1.00 0.00 C ATOM 235 O SER A 19 14.859 7.529 -0.240 1.00 0.00 O ATOM 236 CB SER A 19 17.471 7.169 -2.233 1.00 0.00 C ATOM 237 OG SER A 19 18.643 6.376 -2.166 1.00 0.00 O ATOM 0 H SER A 19 16.502 5.401 -3.671 1.00 0.00 H new ATOM 0 HA SER A 19 16.485 5.736 -0.970 1.00 0.00 H new ATOM 0 HB2 SER A 19 17.343 7.550 -3.246 1.00 0.00 H new ATOM 0 HB3 SER A 19 17.576 8.034 -1.578 1.00 0.00 H new ATOM 0 HG SER A 19 19.418 6.914 -2.432 1.00 0.00 H new ATOM 243 N LYS A 20 14.424 7.860 -2.422 1.00 0.00 N ATOM 244 CA LYS A 20 13.320 8.780 -2.175 1.00 0.00 C ATOM 245 C LYS A 20 12.286 8.152 -1.247 1.00 0.00 C ATOM 246 O LYS A 20 11.938 8.723 -0.214 1.00 0.00 O ATOM 247 CB LYS A 20 12.658 9.180 -3.496 1.00 0.00 C ATOM 248 CG LYS A 20 13.380 10.302 -4.222 1.00 0.00 C ATOM 249 CD LYS A 20 14.521 9.771 -5.075 1.00 0.00 C ATOM 250 CE LYS A 20 14.867 10.731 -6.203 1.00 0.00 C ATOM 251 NZ LYS A 20 15.715 11.860 -5.730 1.00 0.00 N ATOM 0 H LYS A 20 14.616 7.687 -3.409 1.00 0.00 H new ATOM 0 HA LYS A 20 13.723 9.670 -1.692 1.00 0.00 H new ATOM 0 HB2 LYS A 20 12.611 8.308 -4.148 1.00 0.00 H new ATOM 0 HB3 LYS A 20 11.631 9.487 -3.300 1.00 0.00 H new ATOM 0 HG2 LYS A 20 12.674 10.842 -4.853 1.00 0.00 H new ATOM 0 HG3 LYS A 20 13.769 11.016 -3.496 1.00 0.00 H new ATOM 0 HD2 LYS A 20 15.400 9.610 -4.450 1.00 0.00 H new ATOM 0 HD3 LYS A 20 14.245 8.802 -5.492 1.00 0.00 H new ATOM 0 HE2 LYS A 20 15.389 10.191 -6.992 1.00 0.00 H new ATOM 0 HE3 LYS A 20 13.949 11.124 -6.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 15.929 12.492 -6.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 15.207 12.391 -4.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 16.602 11.487 -5.337 1.00 0.00 H new ATOM 265 N MET A 21 11.799 6.973 -1.621 1.00 0.00 N ATOM 266 CA MET A 21 10.807 6.267 -0.819 1.00 0.00 C ATOM 267 C MET A 21 11.206 6.254 0.653 1.00 0.00 C ATOM 268 O MET A 21 10.353 6.165 1.535 1.00 0.00 O ATOM 269 CB MET A 21 10.637 4.833 -1.326 1.00 0.00 C ATOM 270 CG MET A 21 9.916 4.742 -2.661 1.00 0.00 C ATOM 271 SD MET A 21 8.144 5.047 -2.516 1.00 0.00 S ATOM 272 CE MET A 21 7.554 4.347 -4.056 1.00 0.00 C ATOM 0 H MET A 21 12.075 6.487 -2.474 1.00 0.00 H new ATOM 0 HA MET A 21 9.858 6.794 -0.915 1.00 0.00 H new ATOM 0 HB2 MET A 21 11.620 4.371 -1.421 1.00 0.00 H new ATOM 0 HB3 MET A 21 10.084 4.257 -0.584 1.00 0.00 H new ATOM 0 HG2 MET A 21 10.349 5.464 -3.354 1.00 0.00 H new ATOM 0 HG3 MET A 21 10.077 3.753 -3.090 1.00 0.00 H new ATOM 0 HE1 MET A 21 6.577 3.890 -3.897 1.00 0.00 H new ATOM 0 HE2 MET A 21 7.469 5.135 -4.805 1.00 0.00 H new ATOM 0 HE3 MET A 21 8.256 3.590 -4.404 1.00 0.00 H new ATOM 282 N GLN A 22 12.507 6.343 0.909 1.00 0.00 N ATOM 283 CA GLN A 22 13.018 6.341 2.275 1.00 0.00 C ATOM 284 C GLN A 22 13.162 7.764 2.805 1.00 0.00 C ATOM 285 O GLN A 22 13.044 8.003 4.006 1.00 0.00 O ATOM 286 CB GLN A 22 14.367 5.622 2.336 1.00 0.00 C ATOM 287 CG GLN A 22 14.255 4.109 2.244 1.00 0.00 C ATOM 288 CD GLN A 22 15.604 3.420 2.301 1.00 0.00 C ATOM 289 OE1 GLN A 22 16.648 4.066 2.217 1.00 0.00 O ATOM 290 NE2 GLN A 22 15.588 2.099 2.444 1.00 0.00 N ATOM 0 H GLN A 22 13.226 6.417 0.189 1.00 0.00 H new ATOM 0 HA GLN A 22 12.303 5.810 2.903 1.00 0.00 H new ATOM 0 HB2 GLN A 22 14.998 5.981 1.523 1.00 0.00 H new ATOM 0 HB3 GLN A 22 14.868 5.885 3.268 1.00 0.00 H new ATOM 0 HG2 GLN A 22 13.630 3.744 3.059 1.00 0.00 H new ATOM 0 HG3 GLN A 22 13.753 3.841 1.314 1.00 0.00 H new ATOM 0 HE21 GLN A 22 14.699 1.604 2.510 1.00 0.00 H new ATOM 0 HE22 GLN A 22 16.465 1.580 2.488 1.00 0.00 H new ATOM 299 N GLN A 23 13.418 8.704 1.900 1.00 0.00 N ATOM 300 CA GLN A 23 13.579 10.103 2.278 1.00 0.00 C ATOM 301 C GLN A 23 12.321 10.631 2.960 1.00 0.00 C ATOM 302 O GLN A 23 12.294 10.817 4.175 1.00 0.00 O ATOM 303 CB GLN A 23 13.901 10.952 1.047 1.00 0.00 C ATOM 304 CG GLN A 23 15.257 10.644 0.433 1.00 0.00 C ATOM 305 CD GLN A 23 16.329 10.400 1.478 1.00 0.00 C ATOM 306 OE1 GLN A 23 16.424 11.127 2.467 1.00 0.00 O ATOM 307 NE2 GLN A 23 17.143 9.373 1.263 1.00 0.00 N ATOM 0 H GLN A 23 13.518 8.522 0.901 1.00 0.00 H new ATOM 0 HA GLN A 23 14.407 10.170 2.983 1.00 0.00 H new ATOM 0 HB2 GLN A 23 13.127 10.795 0.295 1.00 0.00 H new ATOM 0 HB3 GLN A 23 13.868 12.006 1.324 1.00 0.00 H new ATOM 0 HG2 GLN A 23 15.171 9.765 -0.206 1.00 0.00 H new ATOM 0 HG3 GLN A 23 15.560 11.474 -0.205 1.00 0.00 H new ATOM 0 HE21 GLN A 23 17.028 8.797 0.429 1.00 0.00 H new ATOM 0 HE22 GLN A 23 17.883 9.160 1.932 1.00 0.00 H new ATOM 316 N ASN A 24 11.281 10.871 2.168 1.00 0.00 N ATOM 317 CA ASN A 24 10.020 11.379 2.695 1.00 0.00 C ATOM 318 C ASN A 24 8.912 10.341 2.548 1.00 0.00 C ATOM 319 O ASN A 24 8.041 10.222 3.409 1.00 0.00 O ATOM 320 CB ASN A 24 9.624 12.669 1.974 1.00 0.00 C ATOM 321 CG ASN A 24 10.828 13.505 1.583 1.00 0.00 C ATOM 322 OD1 ASN A 24 11.803 13.593 2.479 1.00 0.00 O flip ATOM 323 ND2 ASN A 24 10.879 14.065 0.487 1.00 0.00 N flip ATOM 0 H ASN A 24 11.287 10.722 1.159 1.00 0.00 H new ATOM 0 HA ASN A 24 10.157 11.591 3.755 1.00 0.00 H new ATOM 0 HB2 ASN A 24 9.051 12.422 1.080 1.00 0.00 H new ATOM 0 HB3 ASN A 24 8.971 13.257 2.619 1.00 0.00 H new ATOM 0 HD21 ASN A 24 10.105 13.969 -0.171 1.00 0.00 H new ATOM 0 HD22 ASN A 24 11.695 14.624 0.237 1.00 0.00 H new ATOM 330 N GLY A 25 8.952 9.591 1.451 1.00 0.00 N ATOM 331 CA GLY A 25 7.946 8.572 1.212 1.00 0.00 C ATOM 332 C GLY A 25 6.925 8.998 0.176 1.00 0.00 C ATOM 333 O GLY A 25 6.850 10.172 -0.186 1.00 0.00 O ATOM 0 H GLY A 25 9.663 9.671 0.724 1.00 0.00 H new ATOM 0 HA2 GLY A 25 8.434 7.655 0.882 1.00 0.00 H new ATOM 0 HA3 GLY A 25 7.436 8.343 2.148 1.00 0.00 H new ATOM 337 N TYR A 26 6.139 8.041 -0.305 1.00 0.00 N ATOM 338 CA TYR A 26 5.120 8.322 -1.310 1.00 0.00 C ATOM 339 C TYR A 26 3.728 8.335 -0.685 1.00 0.00 C ATOM 340 O TYR A 26 3.078 7.296 -0.573 1.00 0.00 O ATOM 341 CB TYR A 26 5.179 7.283 -2.431 1.00 0.00 C ATOM 342 CG TYR A 26 4.351 7.651 -3.641 1.00 0.00 C ATOM 343 CD1 TYR A 26 2.978 7.438 -3.659 1.00 0.00 C ATOM 344 CD2 TYR A 26 4.942 8.209 -4.768 1.00 0.00 C ATOM 345 CE1 TYR A 26 2.218 7.772 -4.763 1.00 0.00 C ATOM 346 CE2 TYR A 26 4.190 8.548 -5.876 1.00 0.00 C ATOM 347 CZ TYR A 26 2.828 8.327 -5.869 1.00 0.00 C ATOM 348 OH TYR A 26 2.075 8.661 -6.971 1.00 0.00 O ATOM 0 H TYR A 26 6.188 7.064 -0.015 1.00 0.00 H new ATOM 0 HA TYR A 26 5.320 9.309 -1.728 1.00 0.00 H new ATOM 0 HB2 TYR A 26 6.216 7.150 -2.738 1.00 0.00 H new ATOM 0 HB3 TYR A 26 4.836 6.324 -2.044 1.00 0.00 H new ATOM 0 HD1 TYR A 26 2.497 7.004 -2.795 1.00 0.00 H new ATOM 0 HD2 TYR A 26 6.008 8.381 -4.778 1.00 0.00 H new ATOM 0 HE1 TYR A 26 1.152 7.600 -4.760 1.00 0.00 H new ATOM 0 HE2 TYR A 26 4.665 8.983 -6.743 1.00 0.00 H new ATOM 0 HH TYR A 26 2.657 9.041 -7.662 1.00 0.00 H new ATOM 358 N GLU A 27 3.278 9.519 -0.281 1.00 0.00 N ATOM 359 CA GLU A 27 1.964 9.667 0.332 1.00 0.00 C ATOM 360 C GLU A 27 0.863 9.629 -0.725 1.00 0.00 C ATOM 361 O GLU A 27 1.136 9.684 -1.923 1.00 0.00 O ATOM 362 CB GLU A 27 1.888 10.979 1.116 1.00 0.00 C ATOM 363 CG GLU A 27 2.292 10.840 2.575 1.00 0.00 C ATOM 364 CD GLU A 27 1.120 10.499 3.475 1.00 0.00 C ATOM 365 OE1 GLU A 27 0.211 9.777 3.015 1.00 0.00 O ATOM 366 OE2 GLU A 27 1.113 10.953 4.638 1.00 0.00 O ATOM 0 H GLU A 27 3.804 10.389 -0.367 1.00 0.00 H new ATOM 0 HA GLU A 27 1.815 8.833 1.017 1.00 0.00 H new ATOM 0 HB2 GLU A 27 2.533 11.716 0.638 1.00 0.00 H new ATOM 0 HB3 GLU A 27 0.870 11.365 1.065 1.00 0.00 H new ATOM 0 HG2 GLU A 27 3.052 10.064 2.665 1.00 0.00 H new ATOM 0 HG3 GLU A 27 2.746 11.772 2.913 1.00 0.00 H new ATOM 373 N ASN A 28 -0.382 9.534 -0.270 1.00 0.00 N ATOM 374 CA ASN A 28 -1.525 9.487 -1.175 1.00 0.00 C ATOM 375 C ASN A 28 -2.391 10.734 -1.022 1.00 0.00 C ATOM 376 O ASN A 28 -3.042 10.946 0.002 1.00 0.00 O ATOM 377 CB ASN A 28 -2.362 8.234 -0.909 1.00 0.00 C ATOM 378 CG ASN A 28 -3.419 8.009 -1.973 1.00 0.00 C ATOM 379 OD1 ASN A 28 -3.987 8.959 -2.511 1.00 0.00 O ATOM 380 ND2 ASN A 28 -3.688 6.745 -2.280 1.00 0.00 N ATOM 0 H ASN A 28 -0.625 9.488 0.720 1.00 0.00 H new ATOM 0 HA ASN A 28 -1.147 9.452 -2.197 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -1.706 7.365 -0.863 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -2.843 8.322 0.065 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -4.390 6.530 -2.988 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -3.192 5.989 -1.808 1.00 0.00 H new ATOM 939 N VAL A 70 -3.032 -7.026 -16.001 1.00 0.00 N ATOM 940 CA VAL A 70 -2.645 -6.897 -14.601 1.00 0.00 C ATOM 941 C VAL A 70 -1.173 -7.243 -14.404 1.00 0.00 C ATOM 942 O VAL A 70 -0.626 -8.092 -15.107 1.00 0.00 O ATOM 943 CB VAL A 70 -3.500 -7.805 -13.697 1.00 0.00 C ATOM 944 CG1 VAL A 70 -3.640 -9.190 -14.310 1.00 0.00 C ATOM 945 CG2 VAL A 70 -2.897 -7.888 -12.303 1.00 0.00 C ATOM 0 HA VAL A 70 -2.812 -5.857 -14.321 1.00 0.00 H new ATOM 0 HB VAL A 70 -4.496 -7.370 -13.612 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -4.247 -9.817 -13.657 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -4.120 -9.109 -15.285 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -2.653 -9.637 -14.428 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -3.514 -8.533 -11.678 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -1.890 -8.299 -12.366 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -2.855 -6.891 -11.865 1.00 0.00 H new ATOM 955 N GLN A 71 -0.539 -6.580 -13.442 1.00 0.00 N ATOM 956 CA GLN A 71 0.870 -6.818 -13.152 1.00 0.00 C ATOM 957 C GLN A 71 1.030 -7.793 -11.991 1.00 0.00 C ATOM 958 O GLN A 71 0.430 -7.616 -10.930 1.00 0.00 O ATOM 959 CB GLN A 71 1.575 -5.500 -12.828 1.00 0.00 C ATOM 960 CG GLN A 71 1.730 -4.581 -14.029 1.00 0.00 C ATOM 961 CD GLN A 71 1.988 -3.141 -13.633 1.00 0.00 C ATOM 962 OE1 GLN A 71 2.967 -2.532 -14.065 1.00 0.00 O ATOM 963 NE2 GLN A 71 1.108 -2.588 -12.807 1.00 0.00 N ATOM 0 H GLN A 71 -0.978 -5.874 -12.851 1.00 0.00 H new ATOM 0 HA GLN A 71 1.328 -7.259 -14.038 1.00 0.00 H new ATOM 0 HB2 GLN A 71 1.014 -4.979 -12.052 1.00 0.00 H new ATOM 0 HB3 GLN A 71 2.561 -5.717 -12.417 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.553 -4.936 -14.649 1.00 0.00 H new ATOM 0 HG3 GLN A 71 0.827 -4.630 -14.638 1.00 0.00 H new ATOM 0 HE21 GLN A 71 0.311 -3.130 -12.474 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.229 -1.621 -12.506 1.00 0.00 H new ATOM 972 N LYS A 72 1.843 -8.823 -12.197 1.00 0.00 N ATOM 973 CA LYS A 72 2.084 -9.827 -11.168 1.00 0.00 C ATOM 974 C LYS A 72 3.540 -9.804 -10.715 1.00 0.00 C ATOM 975 O LYS A 72 4.452 -10.027 -11.512 1.00 0.00 O ATOM 976 CB LYS A 72 1.723 -11.220 -11.690 1.00 0.00 C ATOM 977 CG LYS A 72 0.280 -11.342 -12.149 1.00 0.00 C ATOM 978 CD LYS A 72 0.137 -11.024 -13.628 1.00 0.00 C ATOM 979 CE LYS A 72 -1.007 -11.805 -14.258 1.00 0.00 C ATOM 980 NZ LYS A 72 -0.729 -13.267 -14.288 1.00 0.00 N ATOM 0 H LYS A 72 2.347 -8.985 -13.069 1.00 0.00 H new ATOM 0 HA LYS A 72 1.452 -9.592 -10.312 1.00 0.00 H new ATOM 0 HB2 LYS A 72 2.382 -11.470 -12.521 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.909 -11.953 -10.905 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -0.080 -12.353 -11.957 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.346 -10.665 -11.568 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -0.036 -9.956 -13.756 1.00 0.00 H new ATOM 0 HD3 LYS A 72 1.068 -11.260 -14.144 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.924 -11.621 -13.698 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -1.176 -11.446 -15.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -1.273 -13.708 -15.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 0.286 -13.424 -14.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -1.006 -13.692 -13.380 1.00 0.00 H new ATOM 994 N PHE A 73 3.752 -9.535 -9.431 1.00 0.00 N ATOM 995 CA PHE A 73 5.098 -9.484 -8.872 1.00 0.00 C ATOM 996 C PHE A 73 5.228 -10.427 -7.680 1.00 0.00 C ATOM 997 O PHE A 73 4.510 -10.296 -6.689 1.00 0.00 O ATOM 998 CB PHE A 73 5.442 -8.055 -8.447 1.00 0.00 C ATOM 999 CG PHE A 73 5.220 -7.037 -9.528 1.00 0.00 C ATOM 1000 CD1 PHE A 73 5.905 -7.122 -10.730 1.00 0.00 C ATOM 1001 CD2 PHE A 73 4.326 -5.995 -9.344 1.00 0.00 C ATOM 1002 CE1 PHE A 73 5.702 -6.187 -11.727 1.00 0.00 C ATOM 1003 CE2 PHE A 73 4.118 -5.058 -10.338 1.00 0.00 C ATOM 1004 CZ PHE A 73 4.809 -5.153 -11.531 1.00 0.00 C ATOM 0 H PHE A 73 3.009 -9.349 -8.758 1.00 0.00 H new ATOM 0 HA PHE A 73 5.798 -9.805 -9.644 1.00 0.00 H new ATOM 0 HB2 PHE A 73 4.840 -7.788 -7.579 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.486 -8.019 -8.134 1.00 0.00 H new ATOM 0 HD1 PHE A 73 6.606 -7.928 -10.889 1.00 0.00 H new ATOM 0 HD2 PHE A 73 3.785 -5.914 -8.413 1.00 0.00 H new ATOM 0 HE1 PHE A 73 6.242 -6.265 -12.659 1.00 0.00 H new ATOM 0 HE2 PHE A 73 3.416 -4.252 -10.183 1.00 0.00 H new ATOM 0 HZ PHE A 73 4.651 -4.420 -12.308 1.00 0.00 H new ATOM 1014 N ARG A 74 6.150 -11.379 -7.785 1.00 0.00 N ATOM 1015 CA ARG A 74 6.374 -12.346 -6.717 1.00 0.00 C ATOM 1016 C ARG A 74 6.942 -11.664 -5.476 1.00 0.00 C ATOM 1017 O ARG A 74 7.793 -10.780 -5.575 1.00 0.00 O ATOM 1018 CB ARG A 74 7.326 -13.447 -7.188 1.00 0.00 C ATOM 1019 CG ARG A 74 7.523 -14.559 -6.171 1.00 0.00 C ATOM 1020 CD ARG A 74 6.255 -15.377 -5.987 1.00 0.00 C ATOM 1021 NE ARG A 74 6.238 -16.560 -6.844 1.00 0.00 N ATOM 1022 CZ ARG A 74 7.020 -17.617 -6.653 1.00 0.00 C ATOM 1023 NH1 ARG A 74 7.875 -17.639 -5.640 1.00 0.00 N ATOM 1024 NH2 ARG A 74 6.946 -18.655 -7.476 1.00 0.00 N ATOM 0 H ARG A 74 6.753 -11.501 -8.598 1.00 0.00 H new ATOM 0 HA ARG A 74 5.414 -12.792 -6.458 1.00 0.00 H new ATOM 0 HB2 ARG A 74 6.942 -13.876 -8.113 1.00 0.00 H new ATOM 0 HB3 ARG A 74 8.294 -13.003 -7.421 1.00 0.00 H new ATOM 0 HG2 ARG A 74 8.334 -15.211 -6.496 1.00 0.00 H new ATOM 0 HG3 ARG A 74 7.822 -14.130 -5.215 1.00 0.00 H new ATOM 0 HD2 ARG A 74 6.169 -15.683 -4.944 1.00 0.00 H new ATOM 0 HD3 ARG A 74 5.387 -14.756 -6.209 1.00 0.00 H new ATOM 0 HE ARG A 74 5.590 -16.575 -7.632 1.00 0.00 H new ATOM 0 HH11 ARG A 74 7.934 -16.843 -5.005 1.00 0.00 H new ATOM 0 HH12 ARG A 74 8.474 -18.452 -5.496 1.00 0.00 H new ATOM 0 HH21 ARG A 74 6.289 -18.642 -8.256 1.00 0.00 H new ATOM 0 HH22 ARG A 74 7.547 -19.466 -7.329 1.00 0.00 H new ATOM 1038 N VAL A 75 6.465 -12.080 -4.307 1.00 0.00 N ATOM 1039 CA VAL A 75 6.925 -11.510 -3.047 1.00 0.00 C ATOM 1040 C VAL A 75 6.587 -12.424 -1.874 1.00 0.00 C ATOM 1041 O VAL A 75 6.060 -13.520 -2.062 1.00 0.00 O ATOM 1042 CB VAL A 75 6.304 -10.123 -2.798 1.00 0.00 C ATOM 1043 CG1 VAL A 75 6.836 -9.112 -3.802 1.00 0.00 C ATOM 1044 CG2 VAL A 75 4.786 -10.200 -2.861 1.00 0.00 C ATOM 0 H VAL A 75 5.760 -12.810 -4.207 1.00 0.00 H new ATOM 0 HA VAL A 75 8.007 -11.407 -3.123 1.00 0.00 H new ATOM 0 HB VAL A 75 6.587 -9.791 -1.799 1.00 0.00 H new ATOM 0 HG11 VAL A 75 6.386 -8.138 -3.611 1.00 0.00 H new ATOM 0 HG12 VAL A 75 7.919 -9.037 -3.704 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.585 -9.436 -4.812 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.364 -9.211 -2.683 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.480 -10.553 -3.846 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.425 -10.891 -2.100 1.00 0.00 H new ATOM 1054 N GLN A 76 6.894 -11.964 -0.665 1.00 0.00 N ATOM 1055 CA GLN A 76 6.622 -12.741 0.538 1.00 0.00 C ATOM 1056 C GLN A 76 5.807 -11.928 1.539 1.00 0.00 C ATOM 1057 O GLN A 76 6.049 -10.736 1.728 1.00 0.00 O ATOM 1058 CB GLN A 76 7.932 -13.199 1.182 1.00 0.00 C ATOM 1059 CG GLN A 76 8.503 -14.465 0.565 1.00 0.00 C ATOM 1060 CD GLN A 76 9.941 -14.717 0.974 1.00 0.00 C ATOM 1061 OE1 GLN A 76 10.128 -15.523 2.013 1.00 0.00 O flip ATOM 1062 NE2 GLN A 76 10.873 -14.193 0.364 1.00 0.00 N flip ATOM 0 H GLN A 76 7.331 -11.058 -0.493 1.00 0.00 H new ATOM 0 HA GLN A 76 6.041 -13.617 0.250 1.00 0.00 H new ATOM 0 HB2 GLN A 76 8.668 -12.399 1.097 1.00 0.00 H new ATOM 0 HB3 GLN A 76 7.765 -13.367 2.246 1.00 0.00 H new ATOM 0 HG2 GLN A 76 7.891 -15.317 0.861 1.00 0.00 H new ATOM 0 HG3 GLN A 76 8.446 -14.393 -0.521 1.00 0.00 H new ATOM 0 HE21 GLN A 76 10.683 -13.580 -0.429 1.00 0.00 H new ATOM 0 HE22 GLN A 76 11.835 -14.372 0.651 1.00 0.00 H new ATOM 1071 N TYR A 77 4.841 -12.580 2.176 1.00 0.00 N ATOM 1072 CA TYR A 77 3.988 -11.917 3.155 1.00 0.00 C ATOM 1073 C TYR A 77 4.439 -12.237 4.576 1.00 0.00 C ATOM 1074 O TYR A 77 4.178 -13.325 5.093 1.00 0.00 O ATOM 1075 CB TYR A 77 2.531 -12.340 2.963 1.00 0.00 C ATOM 1076 CG TYR A 77 1.571 -11.653 3.908 1.00 0.00 C ATOM 1077 CD1 TYR A 77 1.773 -10.335 4.297 1.00 0.00 C ATOM 1078 CD2 TYR A 77 0.463 -12.322 4.413 1.00 0.00 C ATOM 1079 CE1 TYR A 77 0.900 -9.703 5.161 1.00 0.00 C ATOM 1080 CE2 TYR A 77 -0.416 -11.698 5.276 1.00 0.00 C ATOM 1081 CZ TYR A 77 -0.194 -10.389 5.648 1.00 0.00 C ATOM 1082 OH TYR A 77 -1.067 -9.764 6.508 1.00 0.00 O ATOM 0 H TYR A 77 4.629 -13.567 2.032 1.00 0.00 H new ATOM 0 HA TYR A 77 4.070 -10.841 3.001 1.00 0.00 H new ATOM 0 HB2 TYR A 77 2.232 -12.127 1.937 1.00 0.00 H new ATOM 0 HB3 TYR A 77 2.454 -13.419 3.100 1.00 0.00 H new ATOM 0 HD1 TYR A 77 2.628 -9.795 3.917 1.00 0.00 H new ATOM 0 HD2 TYR A 77 0.286 -13.348 4.126 1.00 0.00 H new ATOM 0 HE1 TYR A 77 1.073 -8.678 5.454 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -1.273 -12.233 5.658 1.00 0.00 H new ATOM 0 HH TYR A 77 -1.213 -8.841 6.213 1.00 0.00 H new ATOM 1092 N LEU A 78 5.118 -11.283 5.204 1.00 0.00 N ATOM 1093 CA LEU A 78 5.606 -11.462 6.567 1.00 0.00 C ATOM 1094 C LEU A 78 4.446 -11.579 7.550 1.00 0.00 C ATOM 1095 O LEU A 78 4.526 -12.311 8.535 1.00 0.00 O ATOM 1096 CB LEU A 78 6.510 -10.292 6.963 1.00 0.00 C ATOM 1097 CG LEU A 78 7.932 -10.323 6.403 1.00 0.00 C ATOM 1098 CD1 LEU A 78 7.930 -9.982 4.921 1.00 0.00 C ATOM 1099 CD2 LEU A 78 8.829 -9.364 7.172 1.00 0.00 C ATOM 0 H LEU A 78 5.343 -10.378 4.791 1.00 0.00 H new ATOM 0 HA LEU A 78 6.182 -12.387 6.602 1.00 0.00 H new ATOM 0 HB2 LEU A 78 6.034 -9.366 6.640 1.00 0.00 H new ATOM 0 HB3 LEU A 78 6.570 -10.257 8.051 1.00 0.00 H new ATOM 0 HG LEU A 78 8.327 -11.332 6.522 1.00 0.00 H new ATOM 0 HD11 LEU A 78 8.951 -10.009 4.540 1.00 0.00 H new ATOM 0 HD12 LEU A 78 7.322 -10.708 4.381 1.00 0.00 H new ATOM 0 HD13 LEU A 78 7.516 -8.984 4.778 1.00 0.00 H new ATOM 0 HD21 LEU A 78 9.837 -9.399 6.760 1.00 0.00 H new ATOM 0 HD22 LEU A 78 8.437 -8.351 7.086 1.00 0.00 H new ATOM 0 HD23 LEU A 78 8.856 -9.654 8.222 1.00 0.00 H new ATOM 1111 N GLY A 79 3.367 -10.852 7.273 1.00 0.00 N ATOM 1112 CA GLY A 79 2.205 -10.891 8.142 1.00 0.00 C ATOM 1113 C GLY A 79 1.602 -9.518 8.364 1.00 0.00 C ATOM 1114 O GLY A 79 2.156 -8.511 7.925 1.00 0.00 O ATOM 0 H GLY A 79 3.277 -10.238 6.464 1.00 0.00 H new ATOM 0 HA2 GLY A 79 1.452 -11.549 7.708 1.00 0.00 H new ATOM 0 HA3 GLY A 79 2.488 -11.320 9.103 1.00 0.00 H new ATOM 1118 N MET A 80 0.462 -9.477 9.046 1.00 0.00 N ATOM 1119 CA MET A 80 -0.217 -8.217 9.325 1.00 0.00 C ATOM 1120 C MET A 80 0.324 -7.579 10.601 1.00 0.00 C ATOM 1121 O MET A 80 0.562 -8.264 11.596 1.00 0.00 O ATOM 1122 CB MET A 80 -1.725 -8.443 9.453 1.00 0.00 C ATOM 1123 CG MET A 80 -2.552 -7.201 9.163 1.00 0.00 C ATOM 1124 SD MET A 80 -2.526 -6.016 10.522 1.00 0.00 S ATOM 1125 CE MET A 80 -3.103 -7.040 11.874 1.00 0.00 C ATOM 0 H MET A 80 -0.011 -10.302 9.416 1.00 0.00 H new ATOM 0 HA MET A 80 -0.028 -7.539 8.493 1.00 0.00 H new ATOM 0 HB2 MET A 80 -2.025 -9.237 8.769 1.00 0.00 H new ATOM 0 HB3 MET A 80 -1.948 -8.791 10.462 1.00 0.00 H new ATOM 0 HG2 MET A 80 -2.175 -6.721 8.260 1.00 0.00 H new ATOM 0 HG3 MET A 80 -3.582 -7.494 8.961 1.00 0.00 H new ATOM 0 HE1 MET A 80 -3.622 -6.419 12.605 1.00 0.00 H new ATOM 0 HE2 MET A 80 -3.787 -7.797 11.491 1.00 0.00 H new ATOM 0 HE3 MET A 80 -2.252 -7.527 12.350 1.00 0.00 H new ATOM 1135 N LEU A 81 0.515 -6.265 10.564 1.00 0.00 N ATOM 1136 CA LEU A 81 1.028 -5.534 11.718 1.00 0.00 C ATOM 1137 C LEU A 81 0.292 -4.210 11.895 1.00 0.00 C ATOM 1138 O LEU A 81 0.376 -3.308 11.061 1.00 0.00 O ATOM 1139 CB LEU A 81 2.528 -5.280 11.560 1.00 0.00 C ATOM 1140 CG LEU A 81 3.326 -5.146 12.857 1.00 0.00 C ATOM 1141 CD1 LEU A 81 2.732 -4.059 13.739 1.00 0.00 C ATOM 1142 CD2 LEU A 81 3.367 -6.474 13.598 1.00 0.00 C ATOM 0 H LEU A 81 0.323 -5.684 9.748 1.00 0.00 H new ATOM 0 HA LEU A 81 0.861 -6.143 12.606 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.955 -6.096 10.977 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.662 -4.368 10.978 1.00 0.00 H new ATOM 0 HG LEU A 81 4.348 -4.862 12.605 1.00 0.00 H new ATOM 0 HD11 LEU A 81 3.313 -3.978 14.658 1.00 0.00 H new ATOM 0 HD12 LEU A 81 2.756 -3.107 13.209 1.00 0.00 H new ATOM 0 HD13 LEU A 81 1.700 -4.312 13.983 1.00 0.00 H new ATOM 0 HD21 LEU A 81 3.939 -6.359 14.519 1.00 0.00 H new ATOM 0 HD22 LEU A 81 2.351 -6.788 13.839 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.840 -7.228 12.968 1.00 0.00 H new ATOM 1154 N PRO A 82 -0.447 -4.088 13.008 1.00 0.00 N ATOM 1155 CA PRO A 82 -1.210 -2.876 13.323 1.00 0.00 C ATOM 1156 C PRO A 82 -0.308 -1.698 13.674 1.00 0.00 C ATOM 1157 O PRO A 82 0.751 -1.872 14.276 1.00 0.00 O ATOM 1158 CB PRO A 82 -2.047 -3.289 14.536 1.00 0.00 C ATOM 1159 CG PRO A 82 -1.275 -4.393 15.171 1.00 0.00 C ATOM 1160 CD PRO A 82 -0.594 -5.122 14.046 1.00 0.00 C ATOM 0 HA PRO A 82 -1.804 -2.536 12.474 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -2.184 -2.455 15.224 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -3.041 -3.622 14.236 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -0.546 -4.002 15.880 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -1.934 -5.061 15.727 1.00 0.00 H new ATOM 0 HD2 PRO A 82 0.372 -5.523 14.353 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -1.190 -5.963 13.693 1.00 0.00 H new ATOM 1168 N VAL A 83 -0.735 -0.498 13.294 1.00 0.00 N ATOM 1169 CA VAL A 83 0.033 0.710 13.570 1.00 0.00 C ATOM 1170 C VAL A 83 -0.824 1.759 14.269 1.00 0.00 C ATOM 1171 O VAL A 83 -2.053 1.693 14.237 1.00 0.00 O ATOM 1172 CB VAL A 83 0.613 1.315 12.278 1.00 0.00 C ATOM 1173 CG1 VAL A 83 1.850 0.547 11.837 1.00 0.00 C ATOM 1174 CG2 VAL A 83 -0.438 1.326 11.178 1.00 0.00 C ATOM 0 H VAL A 83 -1.609 -0.337 12.794 1.00 0.00 H new ATOM 0 HA VAL A 83 0.853 0.419 14.226 1.00 0.00 H new ATOM 0 HB VAL A 83 0.907 2.345 12.479 1.00 0.00 H new ATOM 0 HG11 VAL A 83 2.246 0.989 10.923 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.607 0.595 12.620 1.00 0.00 H new ATOM 0 HG13 VAL A 83 1.585 -0.494 11.652 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -0.012 1.757 10.272 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -0.764 0.306 10.976 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -1.292 1.924 11.497 1.00 0.00 H new ATOM 1184 N ASP A 84 -0.168 2.727 14.900 1.00 0.00 N ATOM 1185 CA ASP A 84 -0.870 3.793 15.606 1.00 0.00 C ATOM 1186 C ASP A 84 -1.122 4.982 14.683 1.00 0.00 C ATOM 1187 O ASP A 84 -2.107 5.703 14.839 1.00 0.00 O ATOM 1188 CB ASP A 84 -0.066 4.240 16.827 1.00 0.00 C ATOM 1189 CG ASP A 84 0.384 3.073 17.683 1.00 0.00 C ATOM 1190 OD1 ASP A 84 1.466 2.514 17.404 1.00 0.00 O ATOM 1191 OD2 ASP A 84 -0.345 2.717 18.633 1.00 0.00 O ATOM 0 H ASP A 84 0.849 2.795 14.937 1.00 0.00 H new ATOM 0 HA ASP A 84 -1.833 3.404 15.938 1.00 0.00 H new ATOM 0 HB2 ASP A 84 0.807 4.803 16.497 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -0.672 4.916 17.430 1.00 0.00 H new ATOM 1196 N ARG A 85 -0.223 5.181 13.724 1.00 0.00 N ATOM 1197 CA ARG A 85 -0.347 6.283 12.779 1.00 0.00 C ATOM 1198 C ARG A 85 -0.564 5.762 11.361 1.00 0.00 C ATOM 1199 O ARG A 85 -0.022 4.732 10.962 1.00 0.00 O ATOM 1200 CB ARG A 85 0.904 7.164 12.824 1.00 0.00 C ATOM 1201 CG ARG A 85 1.193 7.740 14.200 1.00 0.00 C ATOM 1202 CD ARG A 85 2.376 8.695 14.166 1.00 0.00 C ATOM 1203 NE ARG A 85 1.963 10.070 13.896 1.00 0.00 N ATOM 1204 CZ ARG A 85 2.811 11.088 13.802 1.00 0.00 C ATOM 1205 NH1 ARG A 85 4.113 10.886 13.956 1.00 0.00 N ATOM 1206 NH2 ARG A 85 2.358 12.310 13.554 1.00 0.00 N ATOM 0 H ARG A 85 0.598 4.593 13.582 1.00 0.00 H new ATOM 0 HA ARG A 85 -1.214 6.878 13.065 1.00 0.00 H new ATOM 0 HB2 ARG A 85 1.763 6.578 12.497 1.00 0.00 H new ATOM 0 HB3 ARG A 85 0.788 7.983 12.114 1.00 0.00 H new ATOM 0 HG2 ARG A 85 0.311 8.264 14.569 1.00 0.00 H new ATOM 0 HG3 ARG A 85 1.398 6.929 14.899 1.00 0.00 H new ATOM 0 HD2 ARG A 85 2.901 8.655 15.120 1.00 0.00 H new ATOM 0 HD3 ARG A 85 3.081 8.371 13.400 1.00 0.00 H new ATOM 0 HE ARG A 85 0.968 10.259 13.773 1.00 0.00 H new ATOM 0 HH11 ARG A 85 4.464 9.948 14.147 1.00 0.00 H new ATOM 0 HH12 ARG A 85 4.763 11.669 13.883 1.00 0.00 H new ATOM 0 HH21 ARG A 85 1.357 12.469 13.435 1.00 0.00 H new ATOM 0 HH22 ARG A 85 3.010 13.091 13.482 1.00 0.00 H new ATOM 1220 N PRO A 86 -1.377 6.490 10.581 1.00 0.00 N ATOM 1221 CA PRO A 86 -1.686 6.121 9.197 1.00 0.00 C ATOM 1222 C PRO A 86 -0.486 6.290 8.271 1.00 0.00 C ATOM 1223 O PRO A 86 -0.425 5.686 7.200 1.00 0.00 O ATOM 1224 CB PRO A 86 -2.801 7.095 8.809 1.00 0.00 C ATOM 1225 CG PRO A 86 -2.599 8.274 9.698 1.00 0.00 C ATOM 1226 CD PRO A 86 -2.058 7.730 10.991 1.00 0.00 C ATOM 0 HA PRO A 86 -1.969 5.072 9.109 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -2.734 7.375 7.758 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -3.785 6.650 8.958 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -1.903 8.984 9.252 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -3.537 8.806 9.860 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.369 8.429 11.464 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -2.854 7.533 11.709 1.00 0.00 H new ATOM 1234 N VAL A 87 0.469 7.114 8.691 1.00 0.00 N ATOM 1235 CA VAL A 87 1.669 7.361 7.900 1.00 0.00 C ATOM 1236 C VAL A 87 2.900 7.479 8.791 1.00 0.00 C ATOM 1237 O VAL A 87 2.813 7.337 10.010 1.00 0.00 O ATOM 1238 CB VAL A 87 1.532 8.644 7.059 1.00 0.00 C ATOM 1239 CG1 VAL A 87 0.380 8.516 6.074 1.00 0.00 C ATOM 1240 CG2 VAL A 87 1.343 9.854 7.961 1.00 0.00 C ATOM 0 H VAL A 87 0.435 7.622 9.575 1.00 0.00 H new ATOM 0 HA VAL A 87 1.789 6.508 7.232 1.00 0.00 H new ATOM 0 HB VAL A 87 2.451 8.785 6.489 1.00 0.00 H new ATOM 0 HG11 VAL A 87 0.298 9.432 5.489 1.00 0.00 H new ATOM 0 HG12 VAL A 87 0.564 7.674 5.407 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -0.549 8.350 6.620 1.00 0.00 H new ATOM 0 HG21 VAL A 87 1.248 10.752 7.350 1.00 0.00 H new ATOM 0 HG22 VAL A 87 0.441 9.725 8.559 1.00 0.00 H new ATOM 0 HG23 VAL A 87 2.205 9.954 8.621 1.00 0.00 H new ATOM 1250 N GLY A 88 4.048 7.742 8.174 1.00 0.00 N ATOM 1251 CA GLY A 88 5.281 7.876 8.927 1.00 0.00 C ATOM 1252 C GLY A 88 6.260 6.754 8.640 1.00 0.00 C ATOM 1253 O GLY A 88 5.867 5.595 8.517 1.00 0.00 O ATOM 0 H GLY A 88 4.146 7.865 7.166 1.00 0.00 H new ATOM 0 HA2 GLY A 88 5.748 8.831 8.687 1.00 0.00 H new ATOM 0 HA3 GLY A 88 5.053 7.891 9.993 1.00 0.00 H new ATOM 1257 N MET A 89 7.539 7.100 8.532 1.00 0.00 N ATOM 1258 CA MET A 89 8.577 6.113 8.257 1.00 0.00 C ATOM 1259 C MET A 89 8.960 5.359 9.527 1.00 0.00 C ATOM 1260 O MET A 89 9.128 4.140 9.509 1.00 0.00 O ATOM 1261 CB MET A 89 9.811 6.792 7.661 1.00 0.00 C ATOM 1262 CG MET A 89 9.787 6.873 6.143 1.00 0.00 C ATOM 1263 SD MET A 89 10.521 5.426 5.359 1.00 0.00 S ATOM 1264 CE MET A 89 9.059 4.453 5.005 1.00 0.00 C ATOM 0 H MET A 89 7.881 8.056 8.631 1.00 0.00 H new ATOM 0 HA MET A 89 8.182 5.397 7.536 1.00 0.00 H new ATOM 0 HB2 MET A 89 9.894 7.799 8.069 1.00 0.00 H new ATOM 0 HB3 MET A 89 10.702 6.247 7.974 1.00 0.00 H new ATOM 0 HG2 MET A 89 8.756 6.981 5.805 1.00 0.00 H new ATOM 0 HG3 MET A 89 10.323 7.766 5.822 1.00 0.00 H new ATOM 0 HE1 MET A 89 9.093 3.525 5.575 1.00 0.00 H new ATOM 0 HE2 MET A 89 8.170 5.018 5.284 1.00 0.00 H new ATOM 0 HE3 MET A 89 9.024 4.224 3.940 1.00 0.00 H new ATOM 1274 N ASP A 90 9.097 6.092 10.626 1.00 0.00 N ATOM 1275 CA ASP A 90 9.459 5.493 11.905 1.00 0.00 C ATOM 1276 C ASP A 90 8.415 4.470 12.341 1.00 0.00 C ATOM 1277 O ASP A 90 8.710 3.553 13.108 1.00 0.00 O ATOM 1278 CB ASP A 90 9.610 6.574 12.975 1.00 0.00 C ATOM 1279 CG ASP A 90 10.978 7.227 12.950 1.00 0.00 C ATOM 1280 OD1 ASP A 90 11.191 8.127 12.110 1.00 0.00 O ATOM 1281 OD2 ASP A 90 11.835 6.840 13.771 1.00 0.00 O ATOM 0 H ASP A 90 8.963 7.103 10.657 1.00 0.00 H new ATOM 0 HA ASP A 90 10.413 4.981 11.781 1.00 0.00 H new ATOM 0 HB2 ASP A 90 8.844 7.336 12.828 1.00 0.00 H new ATOM 0 HB3 ASP A 90 9.438 6.135 13.958 1.00 0.00 H new ATOM 1286 N THR A 91 7.192 4.633 11.847 1.00 0.00 N ATOM 1287 CA THR A 91 6.103 3.726 12.187 1.00 0.00 C ATOM 1288 C THR A 91 6.053 2.543 11.227 1.00 0.00 C ATOM 1289 O THR A 91 5.918 1.393 11.649 1.00 0.00 O ATOM 1290 CB THR A 91 4.742 4.448 12.165 1.00 0.00 C ATOM 1291 OG1 THR A 91 4.645 5.344 13.278 1.00 0.00 O ATOM 1292 CG2 THR A 91 3.598 3.448 12.212 1.00 0.00 C ATOM 0 H THR A 91 6.931 5.385 11.210 1.00 0.00 H new ATOM 0 HA THR A 91 6.297 3.364 13.197 1.00 0.00 H new ATOM 0 HB THR A 91 4.671 5.014 11.236 1.00 0.00 H new ATOM 0 HG1 THR A 91 3.778 5.800 13.256 1.00 0.00 H new ATOM 0 HG21 THR A 91 2.648 3.981 12.195 1.00 0.00 H new ATOM 0 HG22 THR A 91 3.658 2.786 11.348 1.00 0.00 H new ATOM 0 HG23 THR A 91 3.667 2.859 13.126 1.00 0.00 H new ATOM 1300 N LEU A 92 6.162 2.831 9.935 1.00 0.00 N ATOM 1301 CA LEU A 92 6.130 1.789 8.914 1.00 0.00 C ATOM 1302 C LEU A 92 7.253 0.779 9.131 1.00 0.00 C ATOM 1303 O LEU A 92 7.010 -0.423 9.224 1.00 0.00 O ATOM 1304 CB LEU A 92 6.249 2.410 7.521 1.00 0.00 C ATOM 1305 CG LEU A 92 5.978 1.472 6.343 1.00 0.00 C ATOM 1306 CD1 LEU A 92 5.404 2.246 5.166 1.00 0.00 C ATOM 1307 CD2 LEU A 92 7.252 0.746 5.936 1.00 0.00 C ATOM 0 H LEU A 92 6.273 3.777 9.569 1.00 0.00 H new ATOM 0 HA LEU A 92 5.177 1.266 8.992 1.00 0.00 H new ATOM 0 HB2 LEU A 92 5.556 3.249 7.459 1.00 0.00 H new ATOM 0 HB3 LEU A 92 7.254 2.818 7.411 1.00 0.00 H new ATOM 0 HG LEU A 92 5.244 0.729 6.656 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.218 1.563 4.337 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.468 2.720 5.463 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.114 3.011 4.853 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.041 0.083 5.097 1.00 0.00 H new ATOM 0 HD22 LEU A 92 8.008 1.474 5.642 1.00 0.00 H new ATOM 0 HD23 LEU A 92 7.621 0.160 6.777 1.00 0.00 H new ATOM 1319 N ASN A 93 8.482 1.277 9.211 1.00 0.00 N ATOM 1320 CA ASN A 93 9.643 0.419 9.419 1.00 0.00 C ATOM 1321 C ASN A 93 9.460 -0.452 10.659 1.00 0.00 C ATOM 1322 O ASN A 93 9.651 -1.667 10.611 1.00 0.00 O ATOM 1323 CB ASN A 93 10.910 1.264 9.557 1.00 0.00 C ATOM 1324 CG ASN A 93 11.504 1.641 8.214 1.00 0.00 C ATOM 1325 OD1 ASN A 93 12.612 1.226 7.873 1.00 0.00 O ATOM 1326 ND2 ASN A 93 10.766 2.431 7.442 1.00 0.00 N ATOM 0 H ASN A 93 8.700 2.270 9.135 1.00 0.00 H new ATOM 0 HA ASN A 93 9.743 -0.232 8.551 1.00 0.00 H new ATOM 0 HB2 ASN A 93 10.679 2.171 10.116 1.00 0.00 H new ATOM 0 HB3 ASN A 93 11.650 0.712 10.136 1.00 0.00 H new ATOM 0 HD21 ASN A 93 11.112 2.717 6.526 1.00 0.00 H new ATOM 0 HD22 ASN A 93 9.853 2.751 7.765 1.00 0.00 H new ATOM 1333 N SER A 94 9.089 0.179 11.769 1.00 0.00 N ATOM 1334 CA SER A 94 8.884 -0.536 13.022 1.00 0.00 C ATOM 1335 C SER A 94 8.171 -1.863 12.780 1.00 0.00 C ATOM 1336 O SER A 94 8.607 -2.911 13.256 1.00 0.00 O ATOM 1337 CB SER A 94 8.074 0.321 13.997 1.00 0.00 C ATOM 1338 OG SER A 94 8.242 -0.126 15.331 1.00 0.00 O ATOM 0 H SER A 94 8.924 1.184 11.825 1.00 0.00 H new ATOM 0 HA SER A 94 9.862 -0.743 13.457 1.00 0.00 H new ATOM 0 HB2 SER A 94 8.387 1.362 13.917 1.00 0.00 H new ATOM 0 HB3 SER A 94 7.018 0.284 13.728 1.00 0.00 H new ATOM 0 HG SER A 94 7.716 0.439 15.934 1.00 0.00 H new ATOM 1344 N ALA A 95 7.071 -1.809 12.036 1.00 0.00 N ATOM 1345 CA ALA A 95 6.297 -3.006 11.728 1.00 0.00 C ATOM 1346 C ALA A 95 7.178 -4.084 11.107 1.00 0.00 C ATOM 1347 O ALA A 95 7.275 -5.196 11.627 1.00 0.00 O ATOM 1348 CB ALA A 95 5.143 -2.663 10.798 1.00 0.00 C ATOM 0 H ALA A 95 6.696 -0.949 11.635 1.00 0.00 H new ATOM 0 HA ALA A 95 5.892 -3.398 12.661 1.00 0.00 H new ATOM 0 HB1 ALA A 95 4.574 -3.566 10.576 1.00 0.00 H new ATOM 0 HB2 ALA A 95 4.492 -1.933 11.279 1.00 0.00 H new ATOM 0 HB3 ALA A 95 5.535 -2.244 9.871 1.00 0.00 H new ATOM 1354 N ILE A 96 7.819 -3.749 9.992 1.00 0.00 N ATOM 1355 CA ILE A 96 8.692 -4.689 9.301 1.00 0.00 C ATOM 1356 C ILE A 96 9.476 -5.541 10.292 1.00 0.00 C ATOM 1357 O ILE A 96 9.489 -6.768 10.197 1.00 0.00 O ATOM 1358 CB ILE A 96 9.681 -3.960 8.372 1.00 0.00 C ATOM 1359 CG1 ILE A 96 8.924 -3.184 7.293 1.00 0.00 C ATOM 1360 CG2 ILE A 96 10.644 -4.954 7.740 1.00 0.00 C ATOM 1361 CD1 ILE A 96 9.780 -2.175 6.561 1.00 0.00 C ATOM 0 H ILE A 96 7.750 -2.833 9.548 1.00 0.00 H new ATOM 0 HA ILE A 96 8.050 -5.333 8.700 1.00 0.00 H new ATOM 0 HB ILE A 96 10.258 -3.251 8.965 1.00 0.00 H new ATOM 0 HG12 ILE A 96 8.511 -3.889 6.572 1.00 0.00 H new ATOM 0 HG13 ILE A 96 8.081 -2.668 7.752 1.00 0.00 H new ATOM 0 HG21 ILE A 96 11.337 -4.424 7.086 1.00 0.00 H new ATOM 0 HG22 ILE A 96 11.204 -5.466 8.523 1.00 0.00 H new ATOM 0 HG23 ILE A 96 10.083 -5.685 7.158 1.00 0.00 H new ATOM 0 HD11 ILE A 96 9.177 -1.663 5.811 1.00 0.00 H new ATOM 0 HD12 ILE A 96 10.172 -1.447 7.271 1.00 0.00 H new ATOM 0 HD13 ILE A 96 10.609 -2.687 6.072 1.00 0.00 H new ATOM 1373 N GLU A 97 10.129 -4.882 11.245 1.00 0.00 N ATOM 1374 CA GLU A 97 10.915 -5.581 12.255 1.00 0.00 C ATOM 1375 C GLU A 97 10.031 -6.499 13.094 1.00 0.00 C ATOM 1376 O GLU A 97 10.361 -7.663 13.315 1.00 0.00 O ATOM 1377 CB GLU A 97 11.630 -4.576 13.161 1.00 0.00 C ATOM 1378 CG GLU A 97 12.553 -3.630 12.411 1.00 0.00 C ATOM 1379 CD GLU A 97 13.329 -2.715 13.338 1.00 0.00 C ATOM 1380 OE1 GLU A 97 13.588 -3.119 14.491 1.00 0.00 O ATOM 1381 OE2 GLU A 97 13.679 -1.595 12.910 1.00 0.00 O ATOM 0 H GLU A 97 10.129 -3.866 11.338 1.00 0.00 H new ATOM 0 HA GLU A 97 11.658 -6.191 11.742 1.00 0.00 H new ATOM 0 HB2 GLU A 97 10.885 -3.991 13.700 1.00 0.00 H new ATOM 0 HB3 GLU A 97 12.209 -5.120 13.907 1.00 0.00 H new ATOM 0 HG2 GLU A 97 13.253 -4.211 11.811 1.00 0.00 H new ATOM 0 HG3 GLU A 97 11.965 -3.027 11.720 1.00 0.00 H new ATOM 1388 N ASN A 98 8.906 -5.965 13.558 1.00 0.00 N ATOM 1389 CA ASN A 98 7.974 -6.735 14.374 1.00 0.00 C ATOM 1390 C ASN A 98 7.761 -8.128 13.788 1.00 0.00 C ATOM 1391 O ASN A 98 7.923 -9.135 14.478 1.00 0.00 O ATOM 1392 CB ASN A 98 6.634 -6.005 14.482 1.00 0.00 C ATOM 1393 CG ASN A 98 5.908 -6.316 15.776 1.00 0.00 C ATOM 1394 OD1 ASN A 98 5.970 -7.437 16.282 1.00 0.00 O ATOM 1395 ND2 ASN A 98 5.215 -5.322 16.319 1.00 0.00 N ATOM 0 H ASN A 98 8.618 -5.002 13.383 1.00 0.00 H new ATOM 0 HA ASN A 98 8.404 -6.840 15.370 1.00 0.00 H new ATOM 0 HB2 ASN A 98 6.802 -4.930 14.413 1.00 0.00 H new ATOM 0 HB3 ASN A 98 6.003 -6.284 13.638 1.00 0.00 H new ATOM 0 HD21 ASN A 98 4.706 -5.471 17.190 1.00 0.00 H new ATOM 0 HD22 ASN A 98 5.192 -4.409 15.865 1.00 0.00 H new ATOM 1402 N LEU A 99 7.397 -8.177 12.511 1.00 0.00 N ATOM 1403 CA LEU A 99 7.162 -9.446 11.831 1.00 0.00 C ATOM 1404 C LEU A 99 8.478 -10.162 11.544 1.00 0.00 C ATOM 1405 O LEU A 99 8.630 -11.346 11.843 1.00 0.00 O ATOM 1406 CB LEU A 99 6.399 -9.214 10.526 1.00 0.00 C ATOM 1407 CG LEU A 99 5.097 -8.421 10.641 1.00 0.00 C ATOM 1408 CD1 LEU A 99 4.825 -7.651 9.358 1.00 0.00 C ATOM 1409 CD2 LEU A 99 3.934 -9.349 10.965 1.00 0.00 C ATOM 0 H LEU A 99 7.258 -7.353 11.926 1.00 0.00 H new ATOM 0 HA LEU A 99 6.563 -10.076 12.488 1.00 0.00 H new ATOM 0 HB2 LEU A 99 7.058 -8.693 9.831 1.00 0.00 H new ATOM 0 HB3 LEU A 99 6.172 -10.184 10.084 1.00 0.00 H new ATOM 0 HG LEU A 99 5.202 -7.704 11.455 1.00 0.00 H new ATOM 0 HD11 LEU A 99 3.894 -7.093 9.459 1.00 0.00 H new ATOM 0 HD12 LEU A 99 5.645 -6.958 9.169 1.00 0.00 H new ATOM 0 HD13 LEU A 99 4.741 -8.349 8.525 1.00 0.00 H new ATOM 0 HD21 LEU A 99 3.015 -8.767 11.043 1.00 0.00 H new ATOM 0 HD22 LEU A 99 3.828 -10.090 10.173 1.00 0.00 H new ATOM 0 HD23 LEU A 99 4.125 -9.855 11.911 1.00 0.00 H new ATOM 1421 N MET A 100 9.427 -9.434 10.965 1.00 0.00 N ATOM 1422 CA MET A 100 10.732 -9.999 10.641 1.00 0.00 C ATOM 1423 C MET A 100 11.226 -10.906 11.764 1.00 0.00 C ATOM 1424 O MET A 100 11.798 -11.967 11.513 1.00 0.00 O ATOM 1425 CB MET A 100 11.747 -8.882 10.388 1.00 0.00 C ATOM 1426 CG MET A 100 11.775 -8.403 8.946 1.00 0.00 C ATOM 1427 SD MET A 100 13.329 -7.597 8.513 1.00 0.00 S ATOM 1428 CE MET A 100 13.518 -8.119 6.810 1.00 0.00 C ATOM 0 H MET A 100 9.317 -8.452 10.711 1.00 0.00 H new ATOM 0 HA MET A 100 10.627 -10.596 9.735 1.00 0.00 H new ATOM 0 HB2 MET A 100 11.516 -8.038 11.038 1.00 0.00 H new ATOM 0 HB3 MET A 100 12.740 -9.235 10.664 1.00 0.00 H new ATOM 0 HG2 MET A 100 11.613 -9.252 8.282 1.00 0.00 H new ATOM 0 HG3 MET A 100 10.951 -7.708 8.782 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.409 -7.657 6.385 1.00 0.00 H new ATOM 0 HE2 MET A 100 13.618 -9.204 6.771 1.00 0.00 H new ATOM 0 HE3 MET A 100 12.642 -7.814 6.237 1.00 0.00 H new ATOM 1438 N THR A 101 11.001 -10.481 13.004 1.00 0.00 N ATOM 1439 CA THR A 101 11.424 -11.254 14.165 1.00 0.00 C ATOM 1440 C THR A 101 10.420 -12.354 14.489 1.00 0.00 C ATOM 1441 O THR A 101 10.782 -13.398 15.032 1.00 0.00 O ATOM 1442 CB THR A 101 11.602 -10.355 15.403 1.00 0.00 C ATOM 1443 OG1 THR A 101 12.183 -11.107 16.474 1.00 0.00 O ATOM 1444 CG2 THR A 101 10.267 -9.777 15.848 1.00 0.00 C ATOM 0 H THR A 101 10.528 -9.606 13.229 1.00 0.00 H new ATOM 0 HA THR A 101 12.383 -11.706 13.912 1.00 0.00 H new ATOM 0 HB THR A 101 12.265 -9.532 15.136 1.00 0.00 H new ATOM 0 HG1 THR A 101 12.295 -10.528 17.257 1.00 0.00 H new ATOM 0 HG21 THR A 101 10.418 -9.146 16.724 1.00 0.00 H new ATOM 0 HG22 THR A 101 9.841 -9.182 15.040 1.00 0.00 H new ATOM 0 HG23 THR A 101 9.585 -10.589 16.099 1.00 0.00 H new ATOM 1452 N SER A 102 9.157 -12.114 14.152 1.00 0.00 N ATOM 1453 CA SER A 102 8.099 -13.084 14.410 1.00 0.00 C ATOM 1454 C SER A 102 8.425 -14.427 13.765 1.00 0.00 C ATOM 1455 O SER A 102 8.421 -15.465 14.428 1.00 0.00 O ATOM 1456 CB SER A 102 6.761 -12.563 13.883 1.00 0.00 C ATOM 1457 OG SER A 102 6.294 -11.476 14.663 1.00 0.00 O ATOM 0 H SER A 102 8.841 -11.256 13.700 1.00 0.00 H new ATOM 0 HA SER A 102 8.025 -13.227 15.488 1.00 0.00 H new ATOM 0 HB2 SER A 102 6.873 -12.248 12.845 1.00 0.00 H new ATOM 0 HB3 SER A 102 6.024 -13.366 13.895 1.00 0.00 H new ATOM 0 HG SER A 102 6.889 -10.707 14.541 1.00 0.00 H new ATOM 1463 N SER A 103 8.708 -14.400 12.466 1.00 0.00 N ATOM 1464 CA SER A 103 9.032 -15.615 11.728 1.00 0.00 C ATOM 1465 C SER A 103 10.324 -15.441 10.936 1.00 0.00 C ATOM 1466 O SER A 103 10.957 -14.386 10.983 1.00 0.00 O ATOM 1467 CB SER A 103 7.887 -15.985 10.784 1.00 0.00 C ATOM 1468 OG SER A 103 7.493 -14.872 9.999 1.00 0.00 O ATOM 0 H SER A 103 8.719 -13.549 11.903 1.00 0.00 H new ATOM 0 HA SER A 103 9.174 -16.421 12.448 1.00 0.00 H new ATOM 0 HB2 SER A 103 8.198 -16.802 10.132 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.036 -16.345 11.363 1.00 0.00 H new ATOM 0 HG SER A 103 7.836 -14.977 9.087 1.00 0.00 H new ATOM 1474 N SER A 104 10.710 -16.485 10.208 1.00 0.00 N ATOM 1475 CA SER A 104 11.928 -16.450 9.408 1.00 0.00 C ATOM 1476 C SER A 104 11.637 -15.949 7.996 1.00 0.00 C ATOM 1477 O SER A 104 10.502 -16.014 7.523 1.00 0.00 O ATOM 1478 CB SER A 104 12.563 -17.840 9.347 1.00 0.00 C ATOM 1479 OG SER A 104 12.666 -18.411 10.640 1.00 0.00 O ATOM 0 H SER A 104 10.196 -17.365 10.156 1.00 0.00 H new ATOM 0 HA SER A 104 12.625 -15.760 9.883 1.00 0.00 H new ATOM 0 HB2 SER A 104 11.965 -18.488 8.706 1.00 0.00 H new ATOM 0 HB3 SER A 104 13.553 -17.771 8.896 1.00 0.00 H new ATOM 0 HG SER A 104 11.882 -18.974 10.813 1.00 0.00 H new ATOM 1485 N LYS A 105 12.670 -15.449 7.328 1.00 0.00 N ATOM 1486 CA LYS A 105 12.529 -14.938 5.970 1.00 0.00 C ATOM 1487 C LYS A 105 11.899 -15.986 5.057 1.00 0.00 C ATOM 1488 O LYS A 105 10.964 -15.692 4.313 1.00 0.00 O ATOM 1489 CB LYS A 105 13.892 -14.517 5.416 1.00 0.00 C ATOM 1490 CG LYS A 105 13.826 -13.935 4.015 1.00 0.00 C ATOM 1491 CD LYS A 105 14.983 -12.986 3.751 1.00 0.00 C ATOM 1492 CE LYS A 105 14.885 -12.359 2.368 1.00 0.00 C ATOM 1493 NZ LYS A 105 15.228 -13.331 1.293 1.00 0.00 N ATOM 0 H LYS A 105 13.616 -15.387 7.705 1.00 0.00 H new ATOM 0 HA LYS A 105 11.873 -14.068 6.003 1.00 0.00 H new ATOM 0 HB2 LYS A 105 14.335 -13.780 6.086 1.00 0.00 H new ATOM 0 HB3 LYS A 105 14.555 -15.382 5.410 1.00 0.00 H new ATOM 0 HG2 LYS A 105 13.842 -14.743 3.283 1.00 0.00 H new ATOM 0 HG3 LYS A 105 12.882 -13.405 3.884 1.00 0.00 H new ATOM 0 HD2 LYS A 105 14.991 -12.201 4.508 1.00 0.00 H new ATOM 0 HD3 LYS A 105 15.926 -13.526 3.841 1.00 0.00 H new ATOM 0 HE2 LYS A 105 13.874 -11.984 2.210 1.00 0.00 H new ATOM 0 HE3 LYS A 105 15.555 -11.501 2.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 15.149 -12.866 0.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 16.202 -13.670 1.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 14.573 -14.137 1.332 1.00 0.00 H new ATOM 1507 N GLU A 106 12.418 -17.208 5.121 1.00 0.00 N ATOM 1508 CA GLU A 106 11.905 -18.298 4.299 1.00 0.00 C ATOM 1509 C GLU A 106 10.546 -18.771 4.809 1.00 0.00 C ATOM 1510 O GLU A 106 9.706 -19.230 4.035 1.00 0.00 O ATOM 1511 CB GLU A 106 12.893 -19.467 4.289 1.00 0.00 C ATOM 1512 CG GLU A 106 14.293 -19.077 3.849 1.00 0.00 C ATOM 1513 CD GLU A 106 15.197 -20.277 3.644 1.00 0.00 C ATOM 1514 OE1 GLU A 106 15.859 -20.694 4.617 1.00 0.00 O ATOM 1515 OE2 GLU A 106 15.241 -20.800 2.511 1.00 0.00 O ATOM 0 H GLU A 106 13.192 -17.468 5.732 1.00 0.00 H new ATOM 0 HA GLU A 106 11.783 -17.926 3.282 1.00 0.00 H new ATOM 0 HB2 GLU A 106 12.943 -19.898 5.289 1.00 0.00 H new ATOM 0 HB3 GLU A 106 12.516 -20.245 3.625 1.00 0.00 H new ATOM 0 HG2 GLU A 106 14.233 -18.510 2.920 1.00 0.00 H new ATOM 0 HG3 GLU A 106 14.734 -18.418 4.597 1.00 0.00 H new ATOM 1522 N ASP A 107 10.339 -18.655 6.116 1.00 0.00 N ATOM 1523 CA ASP A 107 9.083 -19.070 6.730 1.00 0.00 C ATOM 1524 C ASP A 107 7.902 -18.341 6.097 1.00 0.00 C ATOM 1525 O ASP A 107 6.779 -18.845 6.092 1.00 0.00 O ATOM 1526 CB ASP A 107 9.115 -18.804 8.236 1.00 0.00 C ATOM 1527 CG ASP A 107 9.810 -19.910 9.005 1.00 0.00 C ATOM 1528 OD1 ASP A 107 9.924 -21.028 8.461 1.00 0.00 O ATOM 1529 OD2 ASP A 107 10.239 -19.658 10.151 1.00 0.00 O ATOM 0 H ASP A 107 11.024 -18.277 6.770 1.00 0.00 H new ATOM 0 HA ASP A 107 8.960 -20.140 6.560 1.00 0.00 H new ATOM 0 HB2 ASP A 107 9.625 -17.859 8.424 1.00 0.00 H new ATOM 0 HB3 ASP A 107 8.095 -18.695 8.604 1.00 0.00 H new ATOM 1534 N TRP A 108 8.163 -17.152 5.566 1.00 0.00 N ATOM 1535 CA TRP A 108 7.121 -16.353 4.931 1.00 0.00 C ATOM 1536 C TRP A 108 6.670 -16.989 3.621 1.00 0.00 C ATOM 1537 O TRP A 108 7.479 -17.324 2.755 1.00 0.00 O ATOM 1538 CB TRP A 108 7.624 -14.931 4.676 1.00 0.00 C ATOM 1539 CG TRP A 108 8.369 -14.347 5.838 1.00 0.00 C ATOM 1540 CD1 TRP A 108 8.179 -14.633 7.160 1.00 0.00 C ATOM 1541 CD2 TRP A 108 9.419 -13.376 5.782 1.00 0.00 C ATOM 1542 NE1 TRP A 108 9.049 -13.898 7.930 1.00 0.00 N ATOM 1543 CE2 TRP A 108 9.821 -13.120 7.108 1.00 0.00 C ATOM 1544 CE3 TRP A 108 10.061 -12.699 4.742 1.00 0.00 C ATOM 1545 CZ2 TRP A 108 10.833 -12.215 7.418 1.00 0.00 C ATOM 1546 CZ3 TRP A 108 11.066 -11.802 5.051 1.00 0.00 C ATOM 1547 CH2 TRP A 108 11.444 -11.567 6.379 1.00 0.00 C ATOM 0 H TRP A 108 9.087 -16.720 5.562 1.00 0.00 H new ATOM 0 HA TRP A 108 6.266 -16.312 5.606 1.00 0.00 H new ATOM 0 HB2 TRP A 108 8.275 -14.935 3.801 1.00 0.00 H new ATOM 0 HB3 TRP A 108 6.775 -14.290 4.439 1.00 0.00 H new ATOM 0 HD1 TRP A 108 7.452 -15.334 7.544 1.00 0.00 H new ATOM 0 HE1 TRP A 108 9.110 -13.927 8.948 1.00 0.00 H new ATOM 0 HE3 TRP A 108 9.777 -12.874 3.715 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 11.125 -12.031 8.441 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 11.569 -11.273 4.255 1.00 0.00 H new ATOM 0 HH2 TRP A 108 12.234 -10.860 6.587 1.00 0.00 H new ATOM 1558 N PRO A 109 5.349 -17.159 3.468 1.00 0.00 N ATOM 1559 CA PRO A 109 4.761 -17.755 2.265 1.00 0.00 C ATOM 1560 C PRO A 109 4.882 -16.844 1.048 1.00 0.00 C ATOM 1561 O PRO A 109 4.404 -15.710 1.060 1.00 0.00 O ATOM 1562 CB PRO A 109 3.290 -17.946 2.645 1.00 0.00 C ATOM 1563 CG PRO A 109 3.036 -16.924 3.699 1.00 0.00 C ATOM 1564 CD PRO A 109 4.326 -16.783 4.459 1.00 0.00 C ATOM 0 HA PRO A 109 5.265 -18.678 1.980 1.00 0.00 H new ATOM 0 HB2 PRO A 109 2.637 -17.799 1.785 1.00 0.00 H new ATOM 0 HB3 PRO A 109 3.105 -18.954 3.017 1.00 0.00 H new ATOM 0 HG2 PRO A 109 2.738 -15.973 3.257 1.00 0.00 H new ATOM 0 HG3 PRO A 109 2.227 -17.237 4.359 1.00 0.00 H new ATOM 0 HD2 PRO A 109 4.471 -15.765 4.819 1.00 0.00 H new ATOM 0 HD3 PRO A 109 4.352 -17.436 5.331 1.00 0.00 H new ATOM 1572 N SER A 110 5.525 -17.348 -0.001 1.00 0.00 N ATOM 1573 CA SER A 110 5.712 -16.578 -1.225 1.00 0.00 C ATOM 1574 C SER A 110 4.371 -16.280 -1.890 1.00 0.00 C ATOM 1575 O SER A 110 3.698 -17.183 -2.387 1.00 0.00 O ATOM 1576 CB SER A 110 6.619 -17.336 -2.196 1.00 0.00 C ATOM 1577 OG SER A 110 7.372 -16.440 -2.995 1.00 0.00 O ATOM 0 H SER A 110 5.925 -18.286 -0.027 1.00 0.00 H new ATOM 0 HA SER A 110 6.185 -15.632 -0.961 1.00 0.00 H new ATOM 0 HB2 SER A 110 7.294 -17.985 -1.637 1.00 0.00 H new ATOM 0 HB3 SER A 110 6.015 -17.979 -2.836 1.00 0.00 H new ATOM 0 HG SER A 110 8.318 -16.695 -2.969 1.00 0.00 H new ATOM 1583 N VAL A 111 3.990 -15.007 -1.894 1.00 0.00 N ATOM 1584 CA VAL A 111 2.730 -14.588 -2.498 1.00 0.00 C ATOM 1585 C VAL A 111 2.973 -13.736 -3.739 1.00 0.00 C ATOM 1586 O VAL A 111 4.088 -13.277 -3.980 1.00 0.00 O ATOM 1587 CB VAL A 111 1.867 -13.792 -1.502 1.00 0.00 C ATOM 1588 CG1 VAL A 111 1.614 -14.608 -0.243 1.00 0.00 C ATOM 1589 CG2 VAL A 111 2.532 -12.466 -1.163 1.00 0.00 C ATOM 0 H VAL A 111 4.535 -14.248 -1.486 1.00 0.00 H new ATOM 0 HA VAL A 111 2.198 -15.496 -2.782 1.00 0.00 H new ATOM 0 HB VAL A 111 0.905 -13.581 -1.969 1.00 0.00 H new ATOM 0 HG11 VAL A 111 1.002 -14.029 0.449 1.00 0.00 H new ATOM 0 HG12 VAL A 111 1.093 -15.529 -0.505 1.00 0.00 H new ATOM 0 HG13 VAL A 111 2.565 -14.852 0.230 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.909 -11.916 -0.458 1.00 0.00 H new ATOM 0 HG22 VAL A 111 3.508 -12.652 -0.715 1.00 0.00 H new ATOM 0 HG23 VAL A 111 2.656 -11.878 -2.073 1.00 0.00 H new ATOM 1599 N ASN A 112 1.919 -13.528 -4.522 1.00 0.00 N ATOM 1600 CA ASN A 112 2.017 -12.730 -5.739 1.00 0.00 C ATOM 1601 C ASN A 112 1.259 -11.415 -5.589 1.00 0.00 C ATOM 1602 O ASN A 112 0.175 -11.374 -5.008 1.00 0.00 O ATOM 1603 CB ASN A 112 1.470 -13.514 -6.933 1.00 0.00 C ATOM 1604 CG ASN A 112 2.275 -14.767 -7.220 1.00 0.00 C ATOM 1605 OD1 ASN A 112 2.274 -15.700 -6.274 1.00 0.00 O flip ATOM 1606 ND2 ASN A 112 2.890 -14.895 -8.279 1.00 0.00 N flip ATOM 0 H ASN A 112 0.988 -13.901 -4.336 1.00 0.00 H new ATOM 0 HA ASN A 112 3.069 -12.505 -5.913 1.00 0.00 H new ATOM 0 HB2 ASN A 112 0.433 -13.788 -6.740 1.00 0.00 H new ATOM 0 HB3 ASN A 112 1.472 -12.874 -7.816 1.00 0.00 H new ATOM 0 HD21 ASN A 112 2.863 -14.152 -8.978 1.00 0.00 H new ATOM 0 HD22 ASN A 112 3.427 -15.744 -8.458 1.00 0.00 H new ATOM 1613 N MET A 113 1.836 -10.342 -6.119 1.00 0.00 N ATOM 1614 CA MET A 113 1.214 -9.025 -6.046 1.00 0.00 C ATOM 1615 C MET A 113 0.424 -8.726 -7.316 1.00 0.00 C ATOM 1616 O MET A 113 0.992 -8.328 -8.332 1.00 0.00 O ATOM 1617 CB MET A 113 2.276 -7.946 -5.827 1.00 0.00 C ATOM 1618 CG MET A 113 1.698 -6.587 -5.468 1.00 0.00 C ATOM 1619 SD MET A 113 2.952 -5.429 -4.889 1.00 0.00 S ATOM 1620 CE MET A 113 3.267 -6.066 -3.244 1.00 0.00 C ATOM 0 H MET A 113 2.733 -10.358 -6.604 1.00 0.00 H new ATOM 0 HA MET A 113 0.525 -9.023 -5.201 1.00 0.00 H new ATOM 0 HB2 MET A 113 2.949 -8.267 -5.032 1.00 0.00 H new ATOM 0 HB3 MET A 113 2.875 -7.849 -6.732 1.00 0.00 H new ATOM 0 HG2 MET A 113 1.197 -6.168 -6.341 1.00 0.00 H new ATOM 0 HG3 MET A 113 0.940 -6.712 -4.695 1.00 0.00 H new ATOM 0 HE1 MET A 113 3.810 -5.320 -2.663 1.00 0.00 H new ATOM 0 HE2 MET A 113 2.320 -6.290 -2.753 1.00 0.00 H new ATOM 0 HE3 MET A 113 3.863 -6.976 -3.314 1.00 0.00 H new ATOM 1630 N ASN A 114 -0.889 -8.921 -7.251 1.00 0.00 N ATOM 1631 CA ASN A 114 -1.757 -8.673 -8.397 1.00 0.00 C ATOM 1632 C ASN A 114 -2.188 -7.210 -8.446 1.00 0.00 C ATOM 1633 O ASN A 114 -3.146 -6.812 -7.783 1.00 0.00 O ATOM 1634 CB ASN A 114 -2.989 -9.578 -8.336 1.00 0.00 C ATOM 1635 CG ASN A 114 -3.535 -9.905 -9.712 1.00 0.00 C ATOM 1636 OD1 ASN A 114 -2.783 -10.015 -10.681 1.00 0.00 O ATOM 1637 ND2 ASN A 114 -4.850 -10.060 -9.805 1.00 0.00 N ATOM 0 H ASN A 114 -1.375 -9.250 -6.417 1.00 0.00 H new ATOM 0 HA ASN A 114 -1.194 -8.898 -9.303 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -2.731 -10.503 -7.821 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -3.766 -9.091 -7.746 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -5.275 -10.279 -10.706 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -5.435 -9.960 -8.976 1.00 0.00 H new ATOM 1644 N VAL A 115 -1.475 -6.414 -9.236 1.00 0.00 N ATOM 1645 CA VAL A 115 -1.784 -4.996 -9.373 1.00 0.00 C ATOM 1646 C VAL A 115 -2.678 -4.743 -10.583 1.00 0.00 C ATOM 1647 O VAL A 115 -2.216 -4.763 -11.723 1.00 0.00 O ATOM 1648 CB VAL A 115 -0.503 -4.153 -9.510 1.00 0.00 C ATOM 1649 CG1 VAL A 115 -0.841 -2.732 -9.936 1.00 0.00 C ATOM 1650 CG2 VAL A 115 0.278 -4.155 -8.205 1.00 0.00 C ATOM 0 H VAL A 115 -0.679 -6.727 -9.791 1.00 0.00 H new ATOM 0 HA VAL A 115 -2.311 -4.698 -8.467 1.00 0.00 H new ATOM 0 HB VAL A 115 0.123 -4.599 -10.283 1.00 0.00 H new ATOM 0 HG11 VAL A 115 0.077 -2.151 -10.028 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -1.355 -2.753 -10.897 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -1.488 -2.272 -9.189 1.00 0.00 H new ATOM 0 HG21 VAL A 115 1.180 -3.554 -8.320 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.339 -3.734 -7.411 1.00 0.00 H new ATOM 0 HG23 VAL A 115 0.553 -5.178 -7.947 1.00 0.00 H new ATOM 1660 N ALA A 116 -3.959 -4.505 -10.325 1.00 0.00 N ATOM 1661 CA ALA A 116 -4.918 -4.246 -11.392 1.00 0.00 C ATOM 1662 C ALA A 116 -5.947 -3.205 -10.965 1.00 0.00 C ATOM 1663 O ALA A 116 -6.272 -3.088 -9.784 1.00 0.00 O ATOM 1664 CB ALA A 116 -5.610 -5.536 -11.805 1.00 0.00 C ATOM 0 H ALA A 116 -4.357 -4.486 -9.386 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.372 -3.849 -12.248 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -6.323 -5.327 -12.602 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -4.867 -6.250 -12.161 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -6.137 -5.957 -10.948 1.00 0.00 H new ATOM 1670 N ASP A 117 -6.455 -2.450 -11.933 1.00 0.00 N ATOM 1671 CA ASP A 117 -7.447 -1.418 -11.657 1.00 0.00 C ATOM 1672 C ASP A 117 -7.103 -0.662 -10.378 1.00 0.00 C ATOM 1673 O ASP A 117 -7.950 -0.486 -9.502 1.00 0.00 O ATOM 1674 CB ASP A 117 -8.840 -2.039 -11.538 1.00 0.00 C ATOM 1675 CG ASP A 117 -9.946 -1.020 -11.732 1.00 0.00 C ATOM 1676 OD1 ASP A 117 -10.331 -0.368 -10.739 1.00 0.00 O ATOM 1677 OD2 ASP A 117 -10.428 -0.877 -12.875 1.00 0.00 O ATOM 0 H ASP A 117 -6.196 -2.534 -12.916 1.00 0.00 H new ATOM 0 HA ASP A 117 -7.442 -0.712 -12.487 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -8.946 -2.832 -12.279 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -8.945 -2.503 -10.557 1.00 0.00 H new ATOM 1682 N ALA A 118 -5.855 -0.217 -10.277 1.00 0.00 N ATOM 1683 CA ALA A 118 -5.399 0.521 -9.106 1.00 0.00 C ATOM 1684 C ALA A 118 -5.810 -0.184 -7.818 1.00 0.00 C ATOM 1685 O ALA A 118 -6.221 0.456 -6.850 1.00 0.00 O ATOM 1686 CB ALA A 118 -5.947 1.940 -9.130 1.00 0.00 C ATOM 0 H ALA A 118 -5.141 -0.355 -10.993 1.00 0.00 H new ATOM 0 HA ALA A 118 -4.310 0.563 -9.135 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -5.598 2.480 -8.249 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -5.599 2.449 -10.029 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -7.037 1.909 -9.129 1.00 0.00 H new ATOM 1692 N THR A 119 -5.698 -1.509 -7.813 1.00 0.00 N ATOM 1693 CA THR A 119 -6.059 -2.302 -6.645 1.00 0.00 C ATOM 1694 C THR A 119 -4.984 -3.335 -6.327 1.00 0.00 C ATOM 1695 O THR A 119 -4.713 -4.231 -7.127 1.00 0.00 O ATOM 1696 CB THR A 119 -7.404 -3.025 -6.851 1.00 0.00 C ATOM 1697 OG1 THR A 119 -8.484 -2.092 -6.735 1.00 0.00 O ATOM 1698 CG2 THR A 119 -7.580 -4.141 -5.832 1.00 0.00 C ATOM 0 H THR A 119 -5.360 -2.055 -8.605 1.00 0.00 H new ATOM 0 HA THR A 119 -6.151 -1.609 -5.809 1.00 0.00 H new ATOM 0 HB THR A 119 -7.407 -3.462 -7.849 1.00 0.00 H new ATOM 0 HG1 THR A 119 -8.505 -1.516 -7.527 1.00 0.00 H new ATOM 0 HG21 THR A 119 -8.536 -4.637 -5.997 1.00 0.00 H new ATOM 0 HG22 THR A 119 -6.772 -4.865 -5.942 1.00 0.00 H new ATOM 0 HG23 THR A 119 -7.557 -3.722 -4.826 1.00 0.00 H new ATOM 1706 N VAL A 120 -4.373 -3.205 -5.154 1.00 0.00 N ATOM 1707 CA VAL A 120 -3.328 -4.128 -4.729 1.00 0.00 C ATOM 1708 C VAL A 120 -3.924 -5.373 -4.081 1.00 0.00 C ATOM 1709 O VAL A 120 -4.504 -5.305 -2.997 1.00 0.00 O ATOM 1710 CB VAL A 120 -2.358 -3.461 -3.736 1.00 0.00 C ATOM 1711 CG1 VAL A 120 -1.391 -4.485 -3.163 1.00 0.00 C ATOM 1712 CG2 VAL A 120 -1.605 -2.324 -4.411 1.00 0.00 C ATOM 0 H VAL A 120 -4.584 -2.469 -4.481 1.00 0.00 H new ATOM 0 HA VAL A 120 -2.778 -4.416 -5.625 1.00 0.00 H new ATOM 0 HB VAL A 120 -2.938 -3.045 -2.912 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -0.714 -3.995 -2.464 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -1.950 -5.262 -2.642 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -0.815 -4.934 -3.972 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -0.924 -1.863 -3.695 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -1.036 -2.715 -5.254 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -2.315 -1.578 -4.767 1.00 0.00 H new ATOM 1722 N THR A 121 -3.777 -6.511 -4.752 1.00 0.00 N ATOM 1723 CA THR A 121 -4.301 -7.772 -4.243 1.00 0.00 C ATOM 1724 C THR A 121 -3.190 -8.803 -4.077 1.00 0.00 C ATOM 1725 O THR A 121 -2.380 -9.007 -4.981 1.00 0.00 O ATOM 1726 CB THR A 121 -5.385 -8.347 -5.174 1.00 0.00 C ATOM 1727 OG1 THR A 121 -6.294 -7.312 -5.566 1.00 0.00 O ATOM 1728 CG2 THR A 121 -6.150 -9.468 -4.487 1.00 0.00 C ATOM 0 H THR A 121 -3.299 -6.585 -5.650 1.00 0.00 H new ATOM 0 HA THR A 121 -4.744 -7.560 -3.270 1.00 0.00 H new ATOM 0 HB THR A 121 -4.894 -8.753 -6.059 1.00 0.00 H new ATOM 0 HG1 THR A 121 -6.979 -7.686 -6.159 1.00 0.00 H new ATOM 0 HG21 THR A 121 -6.910 -9.858 -5.164 1.00 0.00 H new ATOM 0 HG22 THR A 121 -5.460 -10.267 -4.217 1.00 0.00 H new ATOM 0 HG23 THR A 121 -6.629 -9.083 -3.587 1.00 0.00 H new ATOM 1736 N VAL A 122 -3.158 -9.450 -2.917 1.00 0.00 N ATOM 1737 CA VAL A 122 -2.147 -10.461 -2.633 1.00 0.00 C ATOM 1738 C VAL A 122 -2.681 -11.863 -2.903 1.00 0.00 C ATOM 1739 O VAL A 122 -3.322 -12.470 -2.044 1.00 0.00 O ATOM 1740 CB VAL A 122 -1.666 -10.380 -1.172 1.00 0.00 C ATOM 1741 CG1 VAL A 122 -0.699 -11.513 -0.864 1.00 0.00 C ATOM 1742 CG2 VAL A 122 -1.021 -9.029 -0.899 1.00 0.00 C ATOM 0 H VAL A 122 -3.821 -9.292 -2.158 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.305 -10.261 -3.296 1.00 0.00 H new ATOM 0 HB VAL A 122 -2.531 -10.484 -0.516 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.370 -11.439 0.173 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -1.198 -12.470 -1.019 1.00 0.00 H new ATOM 0 HG13 VAL A 122 0.165 -11.443 -1.525 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -0.687 -8.988 0.138 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -0.166 -8.893 -1.562 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.748 -8.236 -1.077 1.00 0.00 H new ATOM 1752 N ILE A 123 -2.414 -12.372 -4.101 1.00 0.00 N ATOM 1753 CA ILE A 123 -2.866 -13.704 -4.483 1.00 0.00 C ATOM 1754 C ILE A 123 -1.804 -14.754 -4.177 1.00 0.00 C ATOM 1755 O ILE A 123 -0.626 -14.568 -4.483 1.00 0.00 O ATOM 1756 CB ILE A 123 -3.221 -13.770 -5.981 1.00 0.00 C ATOM 1757 CG1 ILE A 123 -4.062 -12.556 -6.382 1.00 0.00 C ATOM 1758 CG2 ILE A 123 -3.961 -15.061 -6.294 1.00 0.00 C ATOM 1759 CD1 ILE A 123 -5.490 -12.621 -5.886 1.00 0.00 C ATOM 0 H ILE A 123 -1.887 -11.882 -4.824 1.00 0.00 H new ATOM 0 HA ILE A 123 -3.760 -13.914 -3.896 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.297 -13.755 -6.559 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -3.591 -11.653 -5.993 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.067 -12.470 -7.469 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -4.205 -15.092 -7.356 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -3.330 -15.913 -6.041 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -4.880 -15.105 -5.709 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -6.028 -11.729 -6.207 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -5.978 -13.505 -6.296 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -5.495 -12.676 -4.797 1.00 0.00 H new ATOM 1771 N SER A 124 -2.230 -15.860 -3.574 1.00 0.00 N ATOM 1772 CA SER A 124 -1.315 -16.940 -3.225 1.00 0.00 C ATOM 1773 C SER A 124 -0.550 -17.423 -4.453 1.00 0.00 C ATOM 1774 O SER A 124 -0.911 -17.106 -5.586 1.00 0.00 O ATOM 1775 CB SER A 124 -2.084 -18.105 -2.598 1.00 0.00 C ATOM 1776 OG SER A 124 -1.416 -19.335 -2.820 1.00 0.00 O ATOM 0 H SER A 124 -3.202 -16.031 -3.317 1.00 0.00 H new ATOM 0 HA SER A 124 -0.597 -16.555 -2.500 1.00 0.00 H new ATOM 0 HB2 SER A 124 -2.196 -17.936 -1.527 1.00 0.00 H new ATOM 0 HB3 SER A 124 -3.088 -18.151 -3.020 1.00 0.00 H new ATOM 0 HG SER A 124 -1.926 -20.063 -2.408 1.00 0.00 H new ATOM 1782 N GLU A 125 0.508 -18.193 -4.219 1.00 0.00 N ATOM 1783 CA GLU A 125 1.325 -18.719 -5.306 1.00 0.00 C ATOM 1784 C GLU A 125 0.576 -19.804 -6.074 1.00 0.00 C ATOM 1785 O GLU A 125 0.511 -19.780 -7.303 1.00 0.00 O ATOM 1786 CB GLU A 125 2.640 -19.280 -4.761 1.00 0.00 C ATOM 1787 CG GLU A 125 2.529 -19.827 -3.348 1.00 0.00 C ATOM 1788 CD GLU A 125 3.732 -20.658 -2.947 1.00 0.00 C ATOM 1789 OE1 GLU A 125 4.859 -20.308 -3.357 1.00 0.00 O ATOM 1790 OE2 GLU A 125 3.547 -21.659 -2.224 1.00 0.00 O ATOM 0 H GLU A 125 0.819 -18.466 -3.287 1.00 0.00 H new ATOM 0 HA GLU A 125 1.544 -17.899 -5.990 1.00 0.00 H new ATOM 0 HB2 GLU A 125 2.989 -20.073 -5.422 1.00 0.00 H new ATOM 0 HB3 GLU A 125 3.396 -18.495 -4.779 1.00 0.00 H new ATOM 0 HG2 GLU A 125 2.416 -18.998 -2.650 1.00 0.00 H new ATOM 0 HG3 GLU A 125 1.629 -20.436 -3.268 1.00 0.00 H new ATOM 1797 N LYS A 126 0.011 -20.757 -5.339 1.00 0.00 N ATOM 1798 CA LYS A 126 -0.735 -21.852 -5.948 1.00 0.00 C ATOM 1799 C LYS A 126 -2.168 -21.429 -6.255 1.00 0.00 C ATOM 1800 O LYS A 126 -2.550 -21.295 -7.417 1.00 0.00 O ATOM 1801 CB LYS A 126 -0.740 -23.070 -5.021 1.00 0.00 C ATOM 1802 CG LYS A 126 0.464 -23.978 -5.205 1.00 0.00 C ATOM 1803 CD LYS A 126 0.505 -25.070 -4.149 1.00 0.00 C ATOM 1804 CE LYS A 126 1.280 -24.625 -2.918 1.00 0.00 C ATOM 1805 NZ LYS A 126 2.740 -24.520 -3.189 1.00 0.00 N ATOM 0 H LYS A 126 0.056 -20.793 -4.321 1.00 0.00 H new ATOM 0 HA LYS A 126 -0.244 -22.117 -6.884 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -0.773 -22.729 -3.986 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -1.649 -23.646 -5.196 1.00 0.00 H new ATOM 0 HG2 LYS A 126 0.432 -24.430 -6.196 1.00 0.00 H new ATOM 0 HG3 LYS A 126 1.378 -23.387 -5.154 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -0.512 -25.339 -3.863 1.00 0.00 H new ATOM 0 HD3 LYS A 126 0.966 -25.965 -4.567 1.00 0.00 H new ATOM 0 HE2 LYS A 126 0.903 -23.659 -2.581 1.00 0.00 H new ATOM 0 HE3 LYS A 126 1.111 -25.334 -2.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 3.244 -25.269 -2.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 2.912 -24.627 -4.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 3.085 -23.591 -2.875 1.00 0.00 H new ATOM 1819 N ASN A 127 -2.957 -21.218 -5.206 1.00 0.00 N ATOM 1820 CA ASN A 127 -4.347 -20.809 -5.365 1.00 0.00 C ATOM 1821 C ASN A 127 -4.438 -19.422 -5.993 1.00 0.00 C ATOM 1822 O ASN A 127 -3.498 -18.631 -5.912 1.00 0.00 O ATOM 1823 CB ASN A 127 -5.061 -20.817 -4.012 1.00 0.00 C ATOM 1824 CG ASN A 127 -5.065 -22.190 -3.368 1.00 0.00 C ATOM 1825 OD1 ASN A 127 -4.880 -23.204 -4.042 1.00 0.00 O ATOM 1826 ND2 ASN A 127 -5.276 -22.229 -2.058 1.00 0.00 N ATOM 0 H ASN A 127 -2.657 -21.324 -4.237 1.00 0.00 H new ATOM 0 HA ASN A 127 -4.835 -21.522 -6.030 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -4.575 -20.107 -3.343 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -6.088 -20.478 -4.145 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -5.289 -23.125 -1.570 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -5.425 -21.363 -1.539 1.00 0.00 H new ATOM 1833 N GLU A 128 -5.576 -19.133 -6.616 1.00 0.00 N ATOM 1834 CA GLU A 128 -5.789 -17.841 -7.257 1.00 0.00 C ATOM 1835 C GLU A 128 -6.928 -17.081 -6.584 1.00 0.00 C ATOM 1836 O GLU A 128 -6.916 -15.852 -6.523 1.00 0.00 O ATOM 1837 CB GLU A 128 -6.096 -18.029 -8.744 1.00 0.00 C ATOM 1838 CG GLU A 128 -5.622 -16.876 -9.614 1.00 0.00 C ATOM 1839 CD GLU A 128 -4.212 -17.077 -10.132 1.00 0.00 C ATOM 1840 OE1 GLU A 128 -3.312 -17.349 -9.310 1.00 0.00 O ATOM 1841 OE2 GLU A 128 -4.007 -16.962 -11.358 1.00 0.00 O ATOM 0 H GLU A 128 -6.364 -19.776 -6.690 1.00 0.00 H new ATOM 0 HA GLU A 128 -4.874 -17.258 -7.153 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -5.627 -18.950 -9.089 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -7.172 -18.151 -8.872 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -6.302 -16.759 -10.458 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -5.665 -15.951 -9.040 1.00 0.00 H new ATOM 1848 N GLU A 129 -7.910 -17.821 -6.081 1.00 0.00 N ATOM 1849 CA GLU A 129 -9.057 -17.217 -5.413 1.00 0.00 C ATOM 1850 C GLU A 129 -8.801 -17.072 -3.916 1.00 0.00 C ATOM 1851 O GLU A 129 -9.727 -16.853 -3.136 1.00 0.00 O ATOM 1852 CB GLU A 129 -10.314 -18.058 -5.648 1.00 0.00 C ATOM 1853 CG GLU A 129 -10.165 -19.508 -5.218 1.00 0.00 C ATOM 1854 CD GLU A 129 -11.447 -20.300 -5.386 1.00 0.00 C ATOM 1855 OE1 GLU A 129 -11.735 -20.727 -6.524 1.00 0.00 O ATOM 1856 OE2 GLU A 129 -12.161 -20.494 -4.381 1.00 0.00 O ATOM 0 H GLU A 129 -7.935 -18.840 -6.123 1.00 0.00 H new ATOM 0 HA GLU A 129 -9.209 -16.224 -5.836 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -11.147 -17.611 -5.106 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -10.570 -18.026 -6.707 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -9.373 -19.977 -5.802 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -9.854 -19.544 -4.174 1.00 0.00 H new ATOM 1863 N GLU A 130 -7.537 -17.198 -3.522 1.00 0.00 N ATOM 1864 CA GLU A 130 -7.160 -17.083 -2.119 1.00 0.00 C ATOM 1865 C GLU A 130 -7.226 -15.631 -1.655 1.00 0.00 C ATOM 1866 O GLU A 130 -7.609 -15.347 -0.520 1.00 0.00 O ATOM 1867 CB GLU A 130 -5.750 -17.636 -1.900 1.00 0.00 C ATOM 1868 CG GLU A 130 -5.153 -17.264 -0.553 1.00 0.00 C ATOM 1869 CD GLU A 130 -5.785 -18.026 0.596 1.00 0.00 C ATOM 1870 OE1 GLU A 130 -5.536 -19.245 0.709 1.00 0.00 O ATOM 1871 OE2 GLU A 130 -6.528 -17.403 1.383 1.00 0.00 O ATOM 0 H GLU A 130 -6.758 -17.380 -4.155 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.867 -17.667 -1.530 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -5.777 -18.722 -1.989 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -5.097 -17.268 -2.691 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -4.081 -17.460 -0.568 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -5.279 -16.194 -0.387 1.00 0.00 H new ATOM 1878 N VAL A 131 -6.849 -14.715 -2.541 1.00 0.00 N ATOM 1879 CA VAL A 131 -6.866 -13.292 -2.225 1.00 0.00 C ATOM 1880 C VAL A 131 -6.487 -13.049 -0.768 1.00 0.00 C ATOM 1881 O VAL A 131 -7.187 -12.340 -0.043 1.00 0.00 O ATOM 1882 CB VAL A 131 -8.250 -12.673 -2.494 1.00 0.00 C ATOM 1883 CG1 VAL A 131 -9.323 -13.393 -1.690 1.00 0.00 C ATOM 1884 CG2 VAL A 131 -8.240 -11.186 -2.173 1.00 0.00 C ATOM 0 H VAL A 131 -6.528 -14.933 -3.484 1.00 0.00 H new ATOM 0 HA VAL A 131 -6.131 -12.815 -2.874 1.00 0.00 H new ATOM 0 HB VAL A 131 -8.482 -12.792 -3.552 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -10.294 -12.942 -1.893 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -9.345 -14.445 -1.974 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -9.099 -13.309 -0.627 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -9.226 -10.765 -2.369 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -7.986 -11.042 -1.123 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -7.501 -10.684 -2.797 1.00 0.00 H new ATOM 1894 N LEU A 132 -5.375 -13.640 -0.345 1.00 0.00 N ATOM 1895 CA LEU A 132 -4.901 -13.488 1.026 1.00 0.00 C ATOM 1896 C LEU A 132 -5.212 -12.092 1.558 1.00 0.00 C ATOM 1897 O LEU A 132 -5.720 -11.938 2.668 1.00 0.00 O ATOM 1898 CB LEU A 132 -3.396 -13.750 1.099 1.00 0.00 C ATOM 1899 CG LEU A 132 -2.951 -15.185 0.815 1.00 0.00 C ATOM 1900 CD1 LEU A 132 -1.444 -15.246 0.613 1.00 0.00 C ATOM 1901 CD2 LEU A 132 -3.377 -16.110 1.946 1.00 0.00 C ATOM 0 H LEU A 132 -4.785 -14.229 -0.932 1.00 0.00 H new ATOM 0 HA LEU A 132 -5.421 -14.218 1.647 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -2.897 -13.089 0.390 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -3.047 -13.472 2.094 1.00 0.00 H new ATOM 0 HG LEU A 132 -3.434 -15.520 -0.103 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -1.145 -16.275 0.412 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -1.164 -14.615 -0.231 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -0.942 -14.892 1.513 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -3.052 -17.127 1.726 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -2.922 -15.777 2.879 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -4.462 -16.089 2.044 1.00 0.00 H new ATOM 1913 N VAL A 133 -4.905 -11.077 0.756 1.00 0.00 N ATOM 1914 CA VAL A 133 -5.154 -9.694 1.144 1.00 0.00 C ATOM 1915 C VAL A 133 -5.753 -8.899 -0.011 1.00 0.00 C ATOM 1916 O VAL A 133 -5.412 -9.120 -1.172 1.00 0.00 O ATOM 1917 CB VAL A 133 -3.861 -9.001 1.614 1.00 0.00 C ATOM 1918 CG1 VAL A 133 -4.093 -7.510 1.803 1.00 0.00 C ATOM 1919 CG2 VAL A 133 -3.353 -9.638 2.898 1.00 0.00 C ATOM 0 H VAL A 133 -4.483 -11.187 -0.166 1.00 0.00 H new ATOM 0 HA VAL A 133 -5.864 -9.720 1.971 1.00 0.00 H new ATOM 0 HB VAL A 133 -3.099 -9.130 0.845 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -3.169 -7.037 2.135 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -4.407 -7.068 0.858 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -4.870 -7.355 2.552 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -2.439 -9.136 3.216 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -4.110 -9.541 3.676 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.146 -10.694 2.723 1.00 0.00 H new ATOM 1929 N GLU A 134 -6.647 -7.972 0.317 1.00 0.00 N ATOM 1930 CA GLU A 134 -7.294 -7.143 -0.694 1.00 0.00 C ATOM 1931 C GLU A 134 -7.167 -5.663 -0.347 1.00 0.00 C ATOM 1932 O GLU A 134 -7.932 -5.136 0.461 1.00 0.00 O ATOM 1933 CB GLU A 134 -8.771 -7.522 -0.827 1.00 0.00 C ATOM 1934 CG GLU A 134 -9.405 -7.052 -2.125 1.00 0.00 C ATOM 1935 CD GLU A 134 -10.814 -7.582 -2.311 1.00 0.00 C ATOM 1936 OE1 GLU A 134 -11.634 -7.423 -1.383 1.00 0.00 O ATOM 1937 OE2 GLU A 134 -11.096 -8.154 -3.385 1.00 0.00 O ATOM 0 H GLU A 134 -6.940 -7.776 1.274 1.00 0.00 H new ATOM 0 HA GLU A 134 -6.794 -7.319 -1.646 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -8.867 -8.605 -0.757 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -9.323 -7.098 0.012 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -9.426 -5.962 -2.141 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -8.787 -7.372 -2.964 1.00 0.00 H new ATOM 1944 N CYS A 135 -6.195 -4.999 -0.963 1.00 0.00 N ATOM 1945 CA CYS A 135 -5.966 -3.579 -0.719 1.00 0.00 C ATOM 1946 C CYS A 135 -6.195 -2.765 -1.988 1.00 0.00 C ATOM 1947 O CYS A 135 -5.826 -3.189 -3.084 1.00 0.00 O ATOM 1948 CB CYS A 135 -4.544 -3.352 -0.203 1.00 0.00 C ATOM 1949 SG CYS A 135 -4.016 -1.623 -0.231 1.00 0.00 S ATOM 0 H CYS A 135 -5.553 -5.421 -1.634 1.00 0.00 H new ATOM 0 HA CYS A 135 -6.677 -3.246 0.037 1.00 0.00 H new ATOM 0 HB2 CYS A 135 -4.476 -3.725 0.819 1.00 0.00 H new ATOM 0 HB3 CYS A 135 -3.852 -3.942 -0.804 1.00 0.00 H new ATOM 0 HG CYS A 135 -2.894 -1.502 0.413 1.00 0.00 H new ATOM 1955 N ARG A 136 -6.807 -1.596 -1.833 1.00 0.00 N ATOM 1956 CA ARG A 136 -7.088 -0.724 -2.967 1.00 0.00 C ATOM 1957 C ARG A 136 -6.293 0.575 -2.865 1.00 0.00 C ATOM 1958 O ARG A 136 -6.318 1.250 -1.836 1.00 0.00 O ATOM 1959 CB ARG A 136 -8.584 -0.415 -3.042 1.00 0.00 C ATOM 1960 CG ARG A 136 -9.430 -1.600 -3.476 1.00 0.00 C ATOM 1961 CD ARG A 136 -10.899 -1.223 -3.594 1.00 0.00 C ATOM 1962 NE ARG A 136 -11.624 -2.121 -4.489 1.00 0.00 N ATOM 1963 CZ ARG A 136 -12.822 -1.845 -4.994 1.00 0.00 C ATOM 1964 NH1 ARG A 136 -13.425 -0.704 -4.694 1.00 0.00 N ATOM 1965 NH2 ARG A 136 -13.418 -2.713 -5.802 1.00 0.00 N ATOM 0 H ARG A 136 -7.118 -1.231 -0.933 1.00 0.00 H new ATOM 0 HA ARG A 136 -6.786 -1.244 -3.876 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -8.925 -0.074 -2.064 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -8.742 0.408 -3.739 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -9.071 -1.973 -4.435 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -9.318 -2.411 -2.757 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -11.360 -1.246 -2.606 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -10.982 -0.200 -3.961 1.00 0.00 H new ATOM 0 HE ARG A 136 -11.187 -3.008 -4.740 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -12.970 -0.034 -4.074 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -14.344 -0.495 -5.083 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -12.957 -3.592 -6.036 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -14.337 -2.501 -6.189 1.00 0.00 H new ATOM 1979 N VAL A 137 -5.588 0.918 -3.938 1.00 0.00 N ATOM 1980 CA VAL A 137 -4.787 2.135 -3.970 1.00 0.00 C ATOM 1981 C VAL A 137 -5.594 3.337 -3.489 1.00 0.00 C ATOM 1982 O VAL A 137 -5.060 4.236 -2.839 1.00 0.00 O ATOM 1983 CB VAL A 137 -4.255 2.421 -5.387 1.00 0.00 C ATOM 1984 CG1 VAL A 137 -3.455 3.714 -5.406 1.00 0.00 C ATOM 1985 CG2 VAL A 137 -3.414 1.256 -5.884 1.00 0.00 C ATOM 0 H VAL A 137 -5.556 0.369 -4.797 1.00 0.00 H new ATOM 0 HA VAL A 137 -3.943 1.976 -3.299 1.00 0.00 H new ATOM 0 HB VAL A 137 -5.105 2.539 -6.059 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -3.087 3.900 -6.415 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -4.093 4.541 -5.094 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -2.611 3.629 -4.722 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -3.046 1.474 -6.886 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -2.569 1.105 -5.212 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -4.023 0.353 -5.910 1.00 0.00 H new ATOM 1995 N ARG A 138 -6.882 3.345 -3.814 1.00 0.00 N ATOM 1996 CA ARG A 138 -7.763 4.436 -3.416 1.00 0.00 C ATOM 1997 C ARG A 138 -7.776 4.600 -1.899 1.00 0.00 C ATOM 1998 O ARG A 138 -7.819 5.718 -1.385 1.00 0.00 O ATOM 1999 CB ARG A 138 -9.184 4.185 -3.925 1.00 0.00 C ATOM 2000 CG ARG A 138 -9.342 4.398 -5.422 1.00 0.00 C ATOM 2001 CD ARG A 138 -9.623 5.856 -5.749 1.00 0.00 C ATOM 2002 NE ARG A 138 -9.141 6.222 -7.079 1.00 0.00 N ATOM 2003 CZ ARG A 138 -9.424 7.376 -7.672 1.00 0.00 C ATOM 2004 NH1 ARG A 138 -10.182 8.273 -7.056 1.00 0.00 N ATOM 2005 NH2 ARG A 138 -8.947 7.636 -8.883 1.00 0.00 N ATOM 0 H ARG A 138 -7.339 2.608 -4.352 1.00 0.00 H new ATOM 0 HA ARG A 138 -7.383 5.356 -3.860 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -9.473 3.163 -3.680 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -9.872 4.846 -3.398 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -8.435 4.077 -5.934 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -10.156 3.777 -5.795 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -10.696 6.041 -5.689 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -9.147 6.493 -5.003 1.00 0.00 H new ATOM 0 HE ARG A 138 -8.555 5.554 -7.580 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -10.549 8.077 -6.125 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -10.398 9.159 -7.514 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -8.362 6.949 -9.359 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -9.165 8.523 -9.337 1.00 0.00 H new ATOM 2019 N PHE A 139 -7.740 3.478 -1.188 1.00 0.00 N ATOM 2020 CA PHE A 139 -7.749 3.496 0.270 1.00 0.00 C ATOM 2021 C PHE A 139 -6.329 3.590 0.821 1.00 0.00 C ATOM 2022 O PHE A 139 -6.128 3.815 2.016 1.00 0.00 O ATOM 2023 CB PHE A 139 -8.436 2.241 0.812 1.00 0.00 C ATOM 2024 CG PHE A 139 -9.929 2.372 0.914 1.00 0.00 C ATOM 2025 CD1 PHE A 139 -10.509 3.027 1.989 1.00 0.00 C ATOM 2026 CD2 PHE A 139 -10.753 1.842 -0.066 1.00 0.00 C ATOM 2027 CE1 PHE A 139 -11.882 3.148 2.086 1.00 0.00 C ATOM 2028 CE2 PHE A 139 -12.127 1.961 0.025 1.00 0.00 C ATOM 2029 CZ PHE A 139 -12.692 2.616 1.102 1.00 0.00 C ATOM 0 H PHE A 139 -7.704 2.545 -1.598 1.00 0.00 H new ATOM 0 HA PHE A 139 -8.305 4.375 0.595 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -8.197 1.397 0.165 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -8.031 2.012 1.798 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -9.880 3.448 2.760 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -10.316 1.330 -0.911 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -12.321 3.658 2.930 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -12.758 1.542 -0.745 1.00 0.00 H new ATOM 0 HZ PHE A 139 -13.765 2.712 1.174 1.00 0.00 H new ATOM 2039 N LEU A 140 -5.347 3.417 -0.057 1.00 0.00 N ATOM 2040 CA LEU A 140 -3.945 3.481 0.341 1.00 0.00 C ATOM 2041 C LEU A 140 -3.592 4.868 0.868 1.00 0.00 C ATOM 2042 O LEU A 140 -3.608 5.849 0.124 1.00 0.00 O ATOM 2043 CB LEU A 140 -3.042 3.128 -0.842 1.00 0.00 C ATOM 2044 CG LEU A 140 -1.597 2.766 -0.499 1.00 0.00 C ATOM 2045 CD1 LEU A 140 -1.017 1.831 -1.549 1.00 0.00 C ATOM 2046 CD2 LEU A 140 -0.748 4.022 -0.373 1.00 0.00 C ATOM 0 H LEU A 140 -5.496 3.231 -1.049 1.00 0.00 H new ATOM 0 HA LEU A 140 -3.786 2.757 1.140 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -3.488 2.289 -1.376 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -3.030 3.974 -1.529 1.00 0.00 H new ATOM 0 HG LEU A 140 -1.590 2.249 0.461 1.00 0.00 H new ATOM 0 HD11 LEU A 140 0.012 1.584 -1.288 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -1.610 0.917 -1.590 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -1.037 2.320 -2.523 1.00 0.00 H new ATOM 0 HD21 LEU A 140 0.277 3.745 -0.129 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -0.762 4.567 -1.317 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -1.151 4.656 0.417 1.00 0.00 H new ATOM 2058 N SER A 141 -3.272 4.943 2.156 1.00 0.00 N ATOM 2059 CA SER A 141 -2.916 6.210 2.784 1.00 0.00 C ATOM 2060 C SER A 141 -1.485 6.606 2.434 1.00 0.00 C ATOM 2061 O SER A 141 -1.243 7.683 1.888 1.00 0.00 O ATOM 2062 CB SER A 141 -3.074 6.113 4.302 1.00 0.00 C ATOM 2063 OG SER A 141 -2.436 4.953 4.809 1.00 0.00 O ATOM 0 H SER A 141 -3.252 4.141 2.785 1.00 0.00 H new ATOM 0 HA SER A 141 -3.590 6.978 2.404 1.00 0.00 H new ATOM 0 HB2 SER A 141 -2.650 7.000 4.772 1.00 0.00 H new ATOM 0 HB3 SER A 141 -4.133 6.091 4.560 1.00 0.00 H new ATOM 0 HG SER A 141 -1.852 5.201 5.556 1.00 0.00 H new ATOM 2069 N PHE A 142 -0.540 5.729 2.753 1.00 0.00 N ATOM 2070 CA PHE A 142 0.868 5.986 2.474 1.00 0.00 C ATOM 2071 C PHE A 142 1.635 4.679 2.293 1.00 0.00 C ATOM 2072 O PHE A 142 1.290 3.658 2.886 1.00 0.00 O ATOM 2073 CB PHE A 142 1.493 6.804 3.606 1.00 0.00 C ATOM 2074 CG PHE A 142 2.971 6.584 3.759 1.00 0.00 C ATOM 2075 CD1 PHE A 142 3.849 6.972 2.760 1.00 0.00 C ATOM 2076 CD2 PHE A 142 3.482 5.991 4.902 1.00 0.00 C ATOM 2077 CE1 PHE A 142 5.210 6.770 2.898 1.00 0.00 C ATOM 2078 CE2 PHE A 142 4.842 5.788 5.046 1.00 0.00 C ATOM 2079 CZ PHE A 142 5.707 6.179 4.043 1.00 0.00 C ATOM 0 H PHE A 142 -0.723 4.833 3.205 1.00 0.00 H new ATOM 0 HA PHE A 142 0.930 6.555 1.546 1.00 0.00 H new ATOM 0 HB2 PHE A 142 1.308 7.863 3.423 1.00 0.00 H new ATOM 0 HB3 PHE A 142 0.997 6.551 4.543 1.00 0.00 H new ATOM 0 HD1 PHE A 142 3.466 7.437 1.864 1.00 0.00 H new ATOM 0 HD2 PHE A 142 2.810 5.684 5.690 1.00 0.00 H new ATOM 0 HE1 PHE A 142 5.884 7.074 2.111 1.00 0.00 H new ATOM 0 HE2 PHE A 142 5.227 5.324 5.942 1.00 0.00 H new ATOM 0 HZ PHE A 142 6.770 6.023 4.154 1.00 0.00 H new ATOM 2089 N MET A 143 2.676 4.720 1.468 1.00 0.00 N ATOM 2090 CA MET A 143 3.492 3.540 1.208 1.00 0.00 C ATOM 2091 C MET A 143 4.974 3.898 1.185 1.00 0.00 C ATOM 2092 O MET A 143 5.346 5.021 0.846 1.00 0.00 O ATOM 2093 CB MET A 143 3.090 2.898 -0.121 1.00 0.00 C ATOM 2094 CG MET A 143 3.140 3.857 -1.299 1.00 0.00 C ATOM 2095 SD MET A 143 3.225 3.005 -2.886 1.00 0.00 S ATOM 2096 CE MET A 143 2.280 4.121 -3.921 1.00 0.00 C ATOM 0 H MET A 143 2.974 5.558 0.968 1.00 0.00 H new ATOM 0 HA MET A 143 3.321 2.827 2.014 1.00 0.00 H new ATOM 0 HB2 MET A 143 3.750 2.054 -0.322 1.00 0.00 H new ATOM 0 HB3 MET A 143 2.080 2.498 -0.031 1.00 0.00 H new ATOM 0 HG2 MET A 143 2.257 4.495 -1.281 1.00 0.00 H new ATOM 0 HG3 MET A 143 4.007 4.510 -1.195 1.00 0.00 H new ATOM 0 HE1 MET A 143 1.577 3.549 -4.526 1.00 0.00 H new ATOM 0 HE2 MET A 143 1.731 4.823 -3.293 1.00 0.00 H new ATOM 0 HE3 MET A 143 2.956 4.672 -4.575 1.00 0.00 H new ATOM 2106 N GLY A 144 5.817 2.936 1.548 1.00 0.00 N ATOM 2107 CA GLY A 144 7.249 3.170 1.563 1.00 0.00 C ATOM 2108 C GLY A 144 8.046 1.887 1.690 1.00 0.00 C ATOM 2109 O GLY A 144 7.496 0.792 1.567 1.00 0.00 O ATOM 0 H GLY A 144 5.533 1.998 1.832 1.00 0.00 H new ATOM 0 HA2 GLY A 144 7.539 3.685 0.647 1.00 0.00 H new ATOM 0 HA3 GLY A 144 7.497 3.832 2.393 1.00 0.00 H new ATOM 2113 N VAL A 145 9.345 2.021 1.936 1.00 0.00 N ATOM 2114 CA VAL A 145 10.219 0.863 2.080 1.00 0.00 C ATOM 2115 C VAL A 145 11.021 0.936 3.374 1.00 0.00 C ATOM 2116 O VAL A 145 11.423 2.016 3.807 1.00 0.00 O ATOM 2117 CB VAL A 145 11.192 0.743 0.892 1.00 0.00 C ATOM 2118 CG1 VAL A 145 10.443 0.864 -0.427 1.00 0.00 C ATOM 2119 CG2 VAL A 145 12.285 1.796 0.991 1.00 0.00 C ATOM 0 H VAL A 145 9.816 2.920 2.040 1.00 0.00 H new ATOM 0 HA VAL A 145 9.576 -0.017 2.104 1.00 0.00 H new ATOM 0 HB VAL A 145 11.661 -0.240 0.927 1.00 0.00 H new ATOM 0 HG11 VAL A 145 11.147 0.777 -1.255 1.00 0.00 H new ATOM 0 HG12 VAL A 145 9.700 0.070 -0.498 1.00 0.00 H new ATOM 0 HG13 VAL A 145 9.945 1.832 -0.475 1.00 0.00 H new ATOM 0 HG21 VAL A 145 12.964 1.697 0.144 1.00 0.00 H new ATOM 0 HG22 VAL A 145 11.836 2.789 0.982 1.00 0.00 H new ATOM 0 HG23 VAL A 145 12.840 1.658 1.919 1.00 0.00 H new ATOM 2129 N GLY A 146 11.252 -0.220 3.988 1.00 0.00 N ATOM 2130 CA GLY A 146 12.006 -0.265 5.227 1.00 0.00 C ATOM 2131 C GLY A 146 13.466 0.093 5.031 1.00 0.00 C ATOM 2132 O GLY A 146 13.873 0.497 3.941 1.00 0.00 O ATOM 0 H GLY A 146 10.930 -1.127 3.649 1.00 0.00 H new ATOM 0 HA2 GLY A 146 11.560 0.423 5.945 1.00 0.00 H new ATOM 0 HA3 GLY A 146 11.935 -1.265 5.656 1.00 0.00 H new ATOM 2136 N LYS A 147 14.257 -0.053 6.088 1.00 0.00 N ATOM 2137 CA LYS A 147 15.680 0.258 6.029 1.00 0.00 C ATOM 2138 C LYS A 147 16.321 -0.360 4.790 1.00 0.00 C ATOM 2139 O LYS A 147 17.302 0.162 4.261 1.00 0.00 O ATOM 2140 CB LYS A 147 16.387 -0.249 7.288 1.00 0.00 C ATOM 2141 CG LYS A 147 16.543 -1.759 7.332 1.00 0.00 C ATOM 2142 CD LYS A 147 15.312 -2.431 7.916 1.00 0.00 C ATOM 2143 CE LYS A 147 15.564 -3.903 8.203 1.00 0.00 C ATOM 2144 NZ LYS A 147 15.443 -4.737 6.975 1.00 0.00 N ATOM 0 H LYS A 147 13.936 -0.385 6.997 1.00 0.00 H new ATOM 0 HA LYS A 147 15.787 1.341 5.971 1.00 0.00 H new ATOM 0 HB2 LYS A 147 17.373 0.212 7.351 1.00 0.00 H new ATOM 0 HB3 LYS A 147 15.827 0.076 8.165 1.00 0.00 H new ATOM 0 HG2 LYS A 147 16.721 -2.137 6.325 1.00 0.00 H new ATOM 0 HG3 LYS A 147 17.417 -2.018 7.929 1.00 0.00 H new ATOM 0 HD2 LYS A 147 15.022 -1.924 8.836 1.00 0.00 H new ATOM 0 HD3 LYS A 147 14.478 -2.332 7.221 1.00 0.00 H new ATOM 0 HE2 LYS A 147 16.560 -4.025 8.628 1.00 0.00 H new ATOM 0 HE3 LYS A 147 14.854 -4.254 8.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 15.453 -5.744 7.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 14.550 -4.514 6.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 16.241 -4.537 6.339 1.00 0.00 H new ATOM 2158 N ASP A 148 15.759 -1.474 4.332 1.00 0.00 N ATOM 2159 CA ASP A 148 16.274 -2.161 3.154 1.00 0.00 C ATOM 2160 C ASP A 148 15.250 -2.143 2.023 1.00 0.00 C ATOM 2161 O ASP A 148 14.124 -2.611 2.184 1.00 0.00 O ATOM 2162 CB ASP A 148 16.644 -3.604 3.500 1.00 0.00 C ATOM 2163 CG ASP A 148 18.063 -3.730 4.019 1.00 0.00 C ATOM 2164 OD1 ASP A 148 18.488 -2.855 4.803 1.00 0.00 O ATOM 2165 OD2 ASP A 148 18.748 -4.703 3.643 1.00 0.00 O ATOM 0 H ASP A 148 14.947 -1.920 4.759 1.00 0.00 H new ATOM 0 HA ASP A 148 17.168 -1.635 2.819 1.00 0.00 H new ATOM 0 HB2 ASP A 148 15.951 -3.984 4.251 1.00 0.00 H new ATOM 0 HB3 ASP A 148 16.528 -4.228 2.614 1.00 0.00 H new ATOM 2170 N VAL A 149 15.650 -1.597 0.879 1.00 0.00 N ATOM 2171 CA VAL A 149 14.768 -1.517 -0.279 1.00 0.00 C ATOM 2172 C VAL A 149 14.021 -2.828 -0.493 1.00 0.00 C ATOM 2173 O VAL A 149 12.833 -2.833 -0.817 1.00 0.00 O ATOM 2174 CB VAL A 149 15.552 -1.171 -1.559 1.00 0.00 C ATOM 2175 CG1 VAL A 149 16.257 0.168 -1.409 1.00 0.00 C ATOM 2176 CG2 VAL A 149 16.548 -2.274 -1.887 1.00 0.00 C ATOM 0 H VAL A 149 16.579 -1.204 0.730 1.00 0.00 H new ATOM 0 HA VAL A 149 14.050 -0.722 -0.075 1.00 0.00 H new ATOM 0 HB VAL A 149 14.847 -1.091 -2.386 1.00 0.00 H new ATOM 0 HG11 VAL A 149 16.805 0.395 -2.323 1.00 0.00 H new ATOM 0 HG12 VAL A 149 15.519 0.949 -1.225 1.00 0.00 H new ATOM 0 HG13 VAL A 149 16.952 0.121 -0.571 1.00 0.00 H new ATOM 0 HG21 VAL A 149 17.093 -2.014 -2.794 1.00 0.00 H new ATOM 0 HG22 VAL A 149 17.250 -2.387 -1.061 1.00 0.00 H new ATOM 0 HG23 VAL A 149 16.015 -3.212 -2.041 1.00 0.00 H new ATOM 2186 N HIS A 150 14.724 -3.941 -0.308 1.00 0.00 N ATOM 2187 CA HIS A 150 14.127 -5.261 -0.479 1.00 0.00 C ATOM 2188 C HIS A 150 12.749 -5.322 0.172 1.00 0.00 C ATOM 2189 O HIS A 150 11.810 -5.889 -0.387 1.00 0.00 O ATOM 2190 CB HIS A 150 15.035 -6.336 0.119 1.00 0.00 C ATOM 2191 CG HIS A 150 16.404 -6.369 -0.487 1.00 0.00 C ATOM 2192 ND1 HIS A 150 17.472 -5.666 0.030 1.00 0.00 N ATOM 2193 CD2 HIS A 150 16.877 -7.026 -1.571 1.00 0.00 C ATOM 2194 CE1 HIS A 150 18.543 -5.889 -0.712 1.00 0.00 C ATOM 2195 NE2 HIS A 150 18.208 -6.711 -1.690 1.00 0.00 N ATOM 0 H HIS A 150 15.708 -3.955 -0.040 1.00 0.00 H new ATOM 0 HA HIS A 150 14.013 -5.446 -1.547 1.00 0.00 H new ATOM 0 HB2 HIS A 150 15.126 -6.167 1.192 1.00 0.00 H new ATOM 0 HB3 HIS A 150 14.565 -7.311 -0.012 1.00 0.00 H new ATOM 0 HD2 HIS A 150 16.312 -7.677 -2.222 1.00 0.00 H new ATOM 0 HE1 HIS A 150 19.525 -5.470 -0.547 1.00 0.00 H new ATOM 0 HE2 HIS A 150 18.836 -7.056 -2.416 1.00 0.00 H new ATOM 2204 N THR A 151 12.634 -4.734 1.359 1.00 0.00 N ATOM 2205 CA THR A 151 11.371 -4.723 2.088 1.00 0.00 C ATOM 2206 C THR A 151 10.458 -3.610 1.588 1.00 0.00 C ATOM 2207 O THR A 151 10.867 -2.452 1.495 1.00 0.00 O ATOM 2208 CB THR A 151 11.598 -4.546 3.601 1.00 0.00 C ATOM 2209 OG1 THR A 151 12.352 -3.354 3.847 1.00 0.00 O ATOM 2210 CG2 THR A 151 12.330 -5.745 4.183 1.00 0.00 C ATOM 0 H THR A 151 13.400 -4.259 1.836 1.00 0.00 H new ATOM 0 HA THR A 151 10.894 -5.687 1.910 1.00 0.00 H new ATOM 0 HB THR A 151 10.625 -4.466 4.085 1.00 0.00 H new ATOM 0 HG1 THR A 151 12.677 -2.991 2.997 1.00 0.00 H new ATOM 0 HG21 THR A 151 12.479 -5.597 5.253 1.00 0.00 H new ATOM 0 HG22 THR A 151 11.739 -6.646 4.020 1.00 0.00 H new ATOM 0 HG23 THR A 151 13.298 -5.853 3.694 1.00 0.00 H new ATOM 2218 N PHE A 152 9.219 -3.967 1.267 1.00 0.00 N ATOM 2219 CA PHE A 152 8.246 -2.997 0.777 1.00 0.00 C ATOM 2220 C PHE A 152 6.898 -3.181 1.468 1.00 0.00 C ATOM 2221 O PHE A 152 6.232 -4.201 1.292 1.00 0.00 O ATOM 2222 CB PHE A 152 8.078 -3.134 -0.738 1.00 0.00 C ATOM 2223 CG PHE A 152 6.871 -2.419 -1.274 1.00 0.00 C ATOM 2224 CD1 PHE A 152 6.772 -1.040 -1.191 1.00 0.00 C ATOM 2225 CD2 PHE A 152 5.835 -3.127 -1.862 1.00 0.00 C ATOM 2226 CE1 PHE A 152 5.661 -0.380 -1.682 1.00 0.00 C ATOM 2227 CE2 PHE A 152 4.722 -2.473 -2.356 1.00 0.00 C ATOM 2228 CZ PHE A 152 4.636 -1.097 -2.267 1.00 0.00 C ATOM 0 H PHE A 152 8.865 -4.921 1.337 1.00 0.00 H new ATOM 0 HA PHE A 152 8.618 -1.999 1.007 1.00 0.00 H new ATOM 0 HB2 PHE A 152 8.969 -2.746 -1.231 1.00 0.00 H new ATOM 0 HB3 PHE A 152 8.007 -4.191 -0.994 1.00 0.00 H new ATOM 0 HD1 PHE A 152 7.572 -0.474 -0.737 1.00 0.00 H new ATOM 0 HD2 PHE A 152 5.898 -4.203 -1.935 1.00 0.00 H new ATOM 0 HE1 PHE A 152 5.595 0.695 -1.608 1.00 0.00 H new ATOM 0 HE2 PHE A 152 3.921 -3.037 -2.811 1.00 0.00 H new ATOM 0 HZ PHE A 152 3.769 -0.583 -2.654 1.00 0.00 H new ATOM 2238 N ALA A 153 6.504 -2.186 2.255 1.00 0.00 N ATOM 2239 CA ALA A 153 5.236 -2.236 2.972 1.00 0.00 C ATOM 2240 C ALA A 153 4.392 -0.999 2.682 1.00 0.00 C ATOM 2241 O ALA A 153 4.887 -0.010 2.142 1.00 0.00 O ATOM 2242 CB ALA A 153 5.480 -2.372 4.468 1.00 0.00 C ATOM 0 H ALA A 153 7.044 -1.335 2.412 1.00 0.00 H new ATOM 0 HA ALA A 153 4.685 -3.110 2.624 1.00 0.00 H new ATOM 0 HB1 ALA A 153 4.524 -2.408 4.991 1.00 0.00 H new ATOM 0 HB2 ALA A 153 6.036 -3.289 4.664 1.00 0.00 H new ATOM 0 HB3 ALA A 153 6.055 -1.516 4.822 1.00 0.00 H new ATOM 2248 N PHE A 154 3.115 -1.062 3.044 1.00 0.00 N ATOM 2249 CA PHE A 154 2.201 0.052 2.821 1.00 0.00 C ATOM 2250 C PHE A 154 1.095 0.068 3.872 1.00 0.00 C ATOM 2251 O PHE A 154 0.678 -0.981 4.365 1.00 0.00 O ATOM 2252 CB PHE A 154 1.589 -0.034 1.421 1.00 0.00 C ATOM 2253 CG PHE A 154 0.780 -1.279 1.197 1.00 0.00 C ATOM 2254 CD1 PHE A 154 -0.426 -1.465 1.853 1.00 0.00 C ATOM 2255 CD2 PHE A 154 1.225 -2.265 0.330 1.00 0.00 C ATOM 2256 CE1 PHE A 154 -1.174 -2.609 1.649 1.00 0.00 C ATOM 2257 CE2 PHE A 154 0.482 -3.411 0.122 1.00 0.00 C ATOM 2258 CZ PHE A 154 -0.719 -3.584 0.783 1.00 0.00 C ATOM 0 H PHE A 154 2.690 -1.873 3.493 1.00 0.00 H new ATOM 0 HA PHE A 154 2.770 0.978 2.905 1.00 0.00 H new ATOM 0 HB2 PHE A 154 0.954 0.837 1.256 1.00 0.00 H new ATOM 0 HB3 PHE A 154 2.388 0.009 0.681 1.00 0.00 H new ATOM 0 HD1 PHE A 154 -0.786 -0.707 2.532 1.00 0.00 H new ATOM 0 HD2 PHE A 154 2.163 -2.136 -0.189 1.00 0.00 H new ATOM 0 HE1 PHE A 154 -2.113 -2.740 2.166 1.00 0.00 H new ATOM 0 HE2 PHE A 154 0.840 -4.171 -0.557 1.00 0.00 H new ATOM 0 HZ PHE A 154 -1.301 -4.480 0.623 1.00 0.00 H new ATOM 2268 N ILE A 155 0.625 1.264 4.210 1.00 0.00 N ATOM 2269 CA ILE A 155 -0.433 1.416 5.201 1.00 0.00 C ATOM 2270 C ILE A 155 -1.793 1.589 4.532 1.00 0.00 C ATOM 2271 O ILE A 155 -1.971 2.461 3.683 1.00 0.00 O ATOM 2272 CB ILE A 155 -0.171 2.621 6.124 1.00 0.00 C ATOM 2273 CG1 ILE A 155 1.084 2.382 6.966 1.00 0.00 C ATOM 2274 CG2 ILE A 155 -1.375 2.875 7.018 1.00 0.00 C ATOM 2275 CD1 ILE A 155 1.641 3.642 7.592 1.00 0.00 C ATOM 0 H ILE A 155 0.960 2.141 3.812 1.00 0.00 H new ATOM 0 HA ILE A 155 -0.438 0.505 5.799 1.00 0.00 H new ATOM 0 HB ILE A 155 -0.009 3.505 5.507 1.00 0.00 H new ATOM 0 HG12 ILE A 155 0.852 1.666 7.755 1.00 0.00 H new ATOM 0 HG13 ILE A 155 1.851 1.928 6.339 1.00 0.00 H new ATOM 0 HG21 ILE A 155 -1.174 3.729 7.664 1.00 0.00 H new ATOM 0 HG22 ILE A 155 -2.249 3.084 6.401 1.00 0.00 H new ATOM 0 HG23 ILE A 155 -1.566 1.994 7.630 1.00 0.00 H new ATOM 0 HD11 ILE A 155 2.529 3.397 8.174 1.00 0.00 H new ATOM 0 HD12 ILE A 155 1.905 4.352 6.808 1.00 0.00 H new ATOM 0 HD13 ILE A 155 0.890 4.086 8.246 1.00 0.00 H new ATOM 2287 N MET A 156 -2.748 0.752 4.923 1.00 0.00 N ATOM 2288 CA MET A 156 -4.094 0.814 4.363 1.00 0.00 C ATOM 2289 C MET A 156 -5.141 0.869 5.470 1.00 0.00 C ATOM 2290 O MET A 156 -4.835 0.634 6.639 1.00 0.00 O ATOM 2291 CB MET A 156 -4.350 -0.395 3.461 1.00 0.00 C ATOM 2292 CG MET A 156 -4.499 -1.701 4.223 1.00 0.00 C ATOM 2293 SD MET A 156 -6.152 -1.920 4.910 1.00 0.00 S ATOM 2294 CE MET A 156 -6.836 -3.120 3.769 1.00 0.00 C ATOM 0 H MET A 156 -2.616 0.023 5.625 1.00 0.00 H new ATOM 0 HA MET A 156 -4.172 1.724 3.769 1.00 0.00 H new ATOM 0 HB2 MET A 156 -5.254 -0.218 2.879 1.00 0.00 H new ATOM 0 HB3 MET A 156 -3.528 -0.489 2.752 1.00 0.00 H new ATOM 0 HG2 MET A 156 -4.274 -2.534 3.557 1.00 0.00 H new ATOM 0 HG3 MET A 156 -3.767 -1.732 5.030 1.00 0.00 H new ATOM 0 HE1 MET A 156 -7.865 -3.345 4.051 1.00 0.00 H new ATOM 0 HE2 MET A 156 -6.818 -2.712 2.758 1.00 0.00 H new ATOM 0 HE3 MET A 156 -6.242 -4.034 3.803 1.00 0.00 H new ATOM 2304 N ASP A 157 -6.377 1.179 5.094 1.00 0.00 N ATOM 2305 CA ASP A 157 -7.470 1.264 6.056 1.00 0.00 C ATOM 2306 C ASP A 157 -8.465 0.126 5.848 1.00 0.00 C ATOM 2307 O ASP A 157 -8.756 -0.261 4.716 1.00 0.00 O ATOM 2308 CB ASP A 157 -8.183 2.611 5.933 1.00 0.00 C ATOM 2309 CG ASP A 157 -9.488 2.649 6.705 1.00 0.00 C ATOM 2310 OD1 ASP A 157 -10.393 1.854 6.378 1.00 0.00 O ATOM 2311 OD2 ASP A 157 -9.603 3.474 7.635 1.00 0.00 O ATOM 0 H ASP A 157 -6.647 1.376 4.130 1.00 0.00 H new ATOM 0 HA ASP A 157 -7.048 1.176 7.057 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -7.526 3.401 6.297 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -8.380 2.820 4.881 1.00 0.00 H new ATOM 2316 N THR A 158 -8.985 -0.407 6.950 1.00 0.00 N ATOM 2317 CA THR A 158 -9.946 -1.501 6.889 1.00 0.00 C ATOM 2318 C THR A 158 -11.338 -1.034 7.299 1.00 0.00 C ATOM 2319 O THR A 158 -12.321 -1.302 6.610 1.00 0.00 O ATOM 2320 CB THR A 158 -9.522 -2.671 7.796 1.00 0.00 C ATOM 2321 OG1 THR A 158 -9.250 -2.193 9.118 1.00 0.00 O ATOM 2322 CG2 THR A 158 -8.290 -3.369 7.240 1.00 0.00 C ATOM 0 H THR A 158 -8.756 -0.098 7.895 1.00 0.00 H new ATOM 0 HA THR A 158 -9.971 -1.843 5.854 1.00 0.00 H new ATOM 0 HB THR A 158 -10.341 -3.389 7.831 1.00 0.00 H new ATOM 0 HG1 THR A 158 -8.655 -2.822 9.577 1.00 0.00 H new ATOM 0 HG21 THR A 158 -8.010 -4.192 7.898 1.00 0.00 H new ATOM 0 HG22 THR A 158 -8.510 -3.758 6.246 1.00 0.00 H new ATOM 0 HG23 THR A 158 -7.466 -2.658 7.177 1.00 0.00 H new ATOM 2368 N ARG A 162 -9.382 2.703 11.043 1.00 0.00 N ATOM 2369 CA ARG A 162 -8.251 1.859 11.409 1.00 0.00 C ATOM 2370 C ARG A 162 -7.239 1.781 10.268 1.00 0.00 C ATOM 2371 O ARG A 162 -7.592 1.943 9.100 1.00 0.00 O ATOM 2372 CB ARG A 162 -8.733 0.454 11.774 1.00 0.00 C ATOM 2373 CG ARG A 162 -9.286 0.348 13.186 1.00 0.00 C ATOM 2374 CD ARG A 162 -9.218 -1.080 13.705 1.00 0.00 C ATOM 2375 NE ARG A 162 -10.133 -1.966 12.990 1.00 0.00 N ATOM 2376 CZ ARG A 162 -10.135 -3.287 13.130 1.00 0.00 C ATOM 2377 NH1 ARG A 162 -9.276 -3.871 13.954 1.00 0.00 N ATOM 2378 NH2 ARG A 162 -10.998 -4.026 12.445 1.00 0.00 N ATOM 0 HA ARG A 162 -7.763 2.305 12.275 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -9.504 0.148 11.067 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -7.904 -0.245 11.664 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -8.722 1.004 13.849 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -10.320 0.693 13.200 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -8.199 -1.454 13.605 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -9.459 -1.091 14.768 1.00 0.00 H new ATOM 0 HE ARG A 162 -10.807 -1.548 12.349 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -8.611 -3.306 14.482 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -9.280 -4.886 14.060 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -11.660 -3.580 11.810 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -10.999 -5.040 12.553 1.00 0.00 H new ATOM 2392 N PHE A 163 -5.981 1.532 10.616 1.00 0.00 N ATOM 2393 CA PHE A 163 -4.918 1.434 9.623 1.00 0.00 C ATOM 2394 C PHE A 163 -4.034 0.220 9.890 1.00 0.00 C ATOM 2395 O PHE A 163 -3.535 0.036 11.000 1.00 0.00 O ATOM 2396 CB PHE A 163 -4.070 2.708 9.625 1.00 0.00 C ATOM 2397 CG PHE A 163 -4.862 3.955 9.895 1.00 0.00 C ATOM 2398 CD1 PHE A 163 -5.989 4.251 9.145 1.00 0.00 C ATOM 2399 CD2 PHE A 163 -4.479 4.832 10.897 1.00 0.00 C ATOM 2400 CE1 PHE A 163 -6.720 5.398 9.391 1.00 0.00 C ATOM 2401 CE2 PHE A 163 -5.206 5.980 11.148 1.00 0.00 C ATOM 2402 CZ PHE A 163 -6.328 6.264 10.393 1.00 0.00 C ATOM 0 H PHE A 163 -5.673 1.394 11.579 1.00 0.00 H new ATOM 0 HA PHE A 163 -5.380 1.315 8.643 1.00 0.00 H new ATOM 0 HB2 PHE A 163 -3.288 2.613 10.379 1.00 0.00 H new ATOM 0 HB3 PHE A 163 -3.572 2.805 8.660 1.00 0.00 H new ATOM 0 HD1 PHE A 163 -6.300 3.578 8.360 1.00 0.00 H new ATOM 0 HD2 PHE A 163 -3.602 4.616 11.489 1.00 0.00 H new ATOM 0 HE1 PHE A 163 -7.597 5.617 8.800 1.00 0.00 H new ATOM 0 HE2 PHE A 163 -4.898 6.654 11.933 1.00 0.00 H new ATOM 0 HZ PHE A 163 -6.897 7.161 10.586 1.00 0.00 H new ATOM 2412 N GLU A 164 -3.846 -0.605 8.865 1.00 0.00 N ATOM 2413 CA GLU A 164 -3.023 -1.803 8.990 1.00 0.00 C ATOM 2414 C GLU A 164 -1.773 -1.697 8.122 1.00 0.00 C ATOM 2415 O GLU A 164 -1.778 -1.029 7.086 1.00 0.00 O ATOM 2416 CB GLU A 164 -3.827 -3.044 8.597 1.00 0.00 C ATOM 2417 CG GLU A 164 -4.758 -3.538 9.691 1.00 0.00 C ATOM 2418 CD GLU A 164 -6.034 -2.724 9.783 1.00 0.00 C ATOM 2419 OE1 GLU A 164 -5.940 -1.484 9.901 1.00 0.00 O ATOM 2420 OE2 GLU A 164 -7.127 -3.327 9.737 1.00 0.00 O ATOM 0 H GLU A 164 -4.252 -0.466 7.940 1.00 0.00 H new ATOM 0 HA GLU A 164 -2.714 -1.894 10.031 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -4.414 -2.819 7.706 1.00 0.00 H new ATOM 0 HB3 GLU A 164 -3.137 -3.844 8.330 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -5.010 -4.582 9.504 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -4.239 -3.502 10.649 1.00 0.00 H new ATOM 2427 N CYS A 165 -0.704 -2.359 8.550 1.00 0.00 N ATOM 2428 CA CYS A 165 0.554 -2.339 7.814 1.00 0.00 C ATOM 2429 C CYS A 165 0.878 -3.720 7.253 1.00 0.00 C ATOM 2430 O CYS A 165 0.953 -4.701 7.994 1.00 0.00 O ATOM 2431 CB CYS A 165 1.692 -1.863 8.718 1.00 0.00 C ATOM 2432 SG CYS A 165 3.300 -1.773 7.897 1.00 0.00 S ATOM 0 H CYS A 165 -0.684 -2.917 9.404 1.00 0.00 H new ATOM 0 HA CYS A 165 0.447 -1.644 6.981 1.00 0.00 H new ATOM 0 HB2 CYS A 165 1.441 -0.878 9.111 1.00 0.00 H new ATOM 0 HB3 CYS A 165 1.769 -2.536 9.572 1.00 0.00 H new ATOM 0 HG CYS A 165 4.087 -0.986 8.569 1.00 0.00 H new ATOM 2438 N HIS A 166 1.069 -3.790 5.939 1.00 0.00 N ATOM 2439 CA HIS A 166 1.384 -5.052 5.279 1.00 0.00 C ATOM 2440 C HIS A 166 2.746 -4.982 4.596 1.00 0.00 C ATOM 2441 O HIS A 166 2.938 -4.223 3.646 1.00 0.00 O ATOM 2442 CB HIS A 166 0.304 -5.398 4.254 1.00 0.00 C ATOM 2443 CG HIS A 166 -1.059 -5.564 4.852 1.00 0.00 C ATOM 2444 ND1 HIS A 166 -1.462 -6.711 5.501 1.00 0.00 N ATOM 2445 CD2 HIS A 166 -2.114 -4.717 4.898 1.00 0.00 C ATOM 2446 CE1 HIS A 166 -2.707 -6.564 5.920 1.00 0.00 C ATOM 2447 NE2 HIS A 166 -3.125 -5.362 5.567 1.00 0.00 N ATOM 0 H HIS A 166 1.011 -2.988 5.311 1.00 0.00 H new ATOM 0 HA HIS A 166 1.418 -5.833 6.038 1.00 0.00 H new ATOM 0 HB2 HIS A 166 0.267 -4.613 3.499 1.00 0.00 H new ATOM 0 HB3 HIS A 166 0.582 -6.320 3.743 1.00 0.00 H new ATOM 0 HD2 HIS A 166 -2.153 -3.720 4.485 1.00 0.00 H new ATOM 0 HE1 HIS A 166 -3.284 -7.301 6.459 1.00 0.00 H new ATOM 0 HE2 HIS A 166 -4.049 -4.975 5.760 1.00 0.00 H new ATOM 2455 N VAL A 167 3.691 -5.778 5.087 1.00 0.00 N ATOM 2456 CA VAL A 167 5.035 -5.808 4.525 1.00 0.00 C ATOM 2457 C VAL A 167 5.153 -6.870 3.438 1.00 0.00 C ATOM 2458 O VAL A 167 4.499 -7.911 3.498 1.00 0.00 O ATOM 2459 CB VAL A 167 6.093 -6.081 5.611 1.00 0.00 C ATOM 2460 CG1 VAL A 167 7.495 -5.909 5.047 1.00 0.00 C ATOM 2461 CG2 VAL A 167 5.875 -5.166 6.807 1.00 0.00 C ATOM 0 H VAL A 167 3.549 -6.411 5.874 1.00 0.00 H new ATOM 0 HA VAL A 167 5.217 -4.825 4.090 1.00 0.00 H new ATOM 0 HB VAL A 167 5.987 -7.113 5.946 1.00 0.00 H new ATOM 0 HG11 VAL A 167 8.228 -6.106 5.829 1.00 0.00 H new ATOM 0 HG12 VAL A 167 7.645 -6.608 4.225 1.00 0.00 H new ATOM 0 HG13 VAL A 167 7.618 -4.889 4.683 1.00 0.00 H new ATOM 0 HG21 VAL A 167 6.631 -5.372 7.565 1.00 0.00 H new ATOM 0 HG22 VAL A 167 5.954 -4.126 6.489 1.00 0.00 H new ATOM 0 HG23 VAL A 167 4.884 -5.343 7.225 1.00 0.00 H new ATOM 2471 N PHE A 168 5.993 -6.600 2.443 1.00 0.00 N ATOM 2472 CA PHE A 168 6.197 -7.533 1.341 1.00 0.00 C ATOM 2473 C PHE A 168 7.623 -7.439 0.806 1.00 0.00 C ATOM 2474 O PHE A 168 8.102 -6.355 0.474 1.00 0.00 O ATOM 2475 CB PHE A 168 5.198 -7.253 0.216 1.00 0.00 C ATOM 2476 CG PHE A 168 3.764 -7.406 0.635 1.00 0.00 C ATOM 2477 CD1 PHE A 168 3.223 -8.663 0.853 1.00 0.00 C ATOM 2478 CD2 PHE A 168 2.958 -6.294 0.813 1.00 0.00 C ATOM 2479 CE1 PHE A 168 1.903 -8.807 1.238 1.00 0.00 C ATOM 2480 CE2 PHE A 168 1.637 -6.431 1.198 1.00 0.00 C ATOM 2481 CZ PHE A 168 1.110 -7.690 1.412 1.00 0.00 C ATOM 0 H PHE A 168 6.543 -5.743 2.378 1.00 0.00 H new ATOM 0 HA PHE A 168 6.035 -8.543 1.718 1.00 0.00 H new ATOM 0 HB2 PHE A 168 5.354 -6.239 -0.153 1.00 0.00 H new ATOM 0 HB3 PHE A 168 5.400 -7.929 -0.615 1.00 0.00 H new ATOM 0 HD1 PHE A 168 3.839 -9.540 0.721 1.00 0.00 H new ATOM 0 HD2 PHE A 168 3.366 -5.308 0.649 1.00 0.00 H new ATOM 0 HE1 PHE A 168 1.492 -9.792 1.403 1.00 0.00 H new ATOM 0 HE2 PHE A 168 1.019 -5.556 1.331 1.00 0.00 H new ATOM 0 HZ PHE A 168 0.079 -7.800 1.715 1.00 0.00 H new ATOM 2491 N TRP A 169 8.295 -8.582 0.726 1.00 0.00 N ATOM 2492 CA TRP A 169 9.666 -8.629 0.233 1.00 0.00 C ATOM 2493 C TRP A 169 9.694 -8.743 -1.288 1.00 0.00 C ATOM 2494 O TRP A 169 8.981 -9.560 -1.871 1.00 0.00 O ATOM 2495 CB TRP A 169 10.415 -9.807 0.858 1.00 0.00 C ATOM 2496 CG TRP A 169 11.874 -9.831 0.518 1.00 0.00 C ATOM 2497 CD1 TRP A 169 12.440 -10.306 -0.631 1.00 0.00 C ATOM 2498 CD2 TRP A 169 12.953 -9.362 1.334 1.00 0.00 C ATOM 2499 NE1 TRP A 169 13.806 -10.161 -0.577 1.00 0.00 N ATOM 2500 CE2 TRP A 169 14.145 -9.583 0.618 1.00 0.00 C ATOM 2501 CE3 TRP A 169 13.027 -8.775 2.600 1.00 0.00 C ATOM 2502 CZ2 TRP A 169 15.394 -9.238 1.127 1.00 0.00 C ATOM 2503 CZ3 TRP A 169 14.267 -8.433 3.104 1.00 0.00 C ATOM 2504 CH2 TRP A 169 15.437 -8.665 2.369 1.00 0.00 C ATOM 0 H TRP A 169 7.913 -9.488 0.996 1.00 0.00 H new ATOM 0 HA TRP A 169 10.160 -7.700 0.519 1.00 0.00 H new ATOM 0 HB2 TRP A 169 10.302 -9.766 1.941 1.00 0.00 H new ATOM 0 HB3 TRP A 169 9.956 -10.738 0.525 1.00 0.00 H new ATOM 0 HD1 TRP A 169 11.895 -10.733 -1.460 1.00 0.00 H new ATOM 0 HE1 TRP A 169 14.461 -10.439 -1.308 1.00 0.00 H new ATOM 0 HE3 TRP A 169 12.131 -8.592 3.174 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 16.297 -9.416 0.562 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 14.336 -7.979 4.082 1.00 0.00 H new ATOM 0 HH2 TRP A 169 16.391 -8.386 2.791 1.00 0.00 H new ATOM 2515 N CYS A 170 10.519 -7.919 -1.923 1.00 0.00 N ATOM 2516 CA CYS A 170 10.639 -7.928 -3.377 1.00 0.00 C ATOM 2517 C CYS A 170 11.964 -8.545 -3.810 1.00 0.00 C ATOM 2518 O CYS A 170 12.931 -8.560 -3.048 1.00 0.00 O ATOM 2519 CB CYS A 170 10.521 -6.506 -3.927 1.00 0.00 C ATOM 2520 SG CYS A 170 8.833 -5.858 -3.942 1.00 0.00 S ATOM 0 H CYS A 170 11.115 -7.236 -1.455 1.00 0.00 H new ATOM 0 HA CYS A 170 9.828 -8.535 -3.780 1.00 0.00 H new ATOM 0 HB2 CYS A 170 11.148 -5.844 -3.330 1.00 0.00 H new ATOM 0 HB3 CYS A 170 10.915 -6.487 -4.943 1.00 0.00 H new ATOM 0 HG CYS A 170 8.720 -4.922 -3.047 1.00 0.00 H new ATOM 2526 N GLU A 171 12.001 -9.054 -5.038 1.00 0.00 N ATOM 2527 CA GLU A 171 13.208 -9.675 -5.570 1.00 0.00 C ATOM 2528 C GLU A 171 13.367 -9.368 -7.057 1.00 0.00 C ATOM 2529 O GLU A 171 12.464 -9.592 -7.863 1.00 0.00 O ATOM 2530 CB GLU A 171 13.168 -11.189 -5.352 1.00 0.00 C ATOM 2531 CG GLU A 171 13.419 -11.604 -3.912 1.00 0.00 C ATOM 2532 CD GLU A 171 13.807 -13.064 -3.785 1.00 0.00 C ATOM 2533 OE1 GLU A 171 14.999 -13.382 -3.981 1.00 0.00 O ATOM 2534 OE2 GLU A 171 12.918 -13.890 -3.488 1.00 0.00 O ATOM 0 H GLU A 171 11.210 -9.048 -5.682 1.00 0.00 H new ATOM 0 HA GLU A 171 14.064 -9.261 -5.037 1.00 0.00 H new ATOM 0 HB2 GLU A 171 12.195 -11.567 -5.666 1.00 0.00 H new ATOM 0 HB3 GLU A 171 13.914 -11.660 -5.992 1.00 0.00 H new ATOM 0 HG2 GLU A 171 14.211 -10.984 -3.492 1.00 0.00 H new ATOM 0 HG3 GLU A 171 12.521 -11.418 -3.322 1.00 0.00 H new ATOM 2541 N PRO A 172 14.544 -8.844 -7.429 1.00 0.00 N ATOM 2542 CA PRO A 172 15.627 -8.573 -6.479 1.00 0.00 C ATOM 2543 C PRO A 172 15.298 -7.418 -5.539 1.00 0.00 C ATOM 2544 O PRO A 172 15.422 -7.542 -4.321 1.00 0.00 O ATOM 2545 CB PRO A 172 16.808 -8.208 -7.381 1.00 0.00 C ATOM 2546 CG PRO A 172 16.184 -7.697 -8.634 1.00 0.00 C ATOM 2547 CD PRO A 172 14.908 -8.473 -8.807 1.00 0.00 C ATOM 0 HA PRO A 172 15.819 -9.425 -5.827 1.00 0.00 H new ATOM 0 HB2 PRO A 172 17.441 -7.452 -6.917 1.00 0.00 H new ATOM 0 HB3 PRO A 172 17.439 -9.075 -7.578 1.00 0.00 H new ATOM 0 HG2 PRO A 172 15.984 -6.628 -8.563 1.00 0.00 H new ATOM 0 HG3 PRO A 172 16.847 -7.841 -9.487 1.00 0.00 H new ATOM 0 HD2 PRO A 172 14.132 -7.870 -9.279 1.00 0.00 H new ATOM 0 HD3 PRO A 172 15.054 -9.352 -9.434 1.00 0.00 H new ATOM 2555 N ASN A 173 14.877 -6.296 -6.113 1.00 0.00 N ATOM 2556 CA ASN A 173 14.530 -5.118 -5.325 1.00 0.00 C ATOM 2557 C ASN A 173 13.066 -4.740 -5.528 1.00 0.00 C ATOM 2558 O ASN A 173 12.375 -5.320 -6.365 1.00 0.00 O ATOM 2559 CB ASN A 173 15.430 -3.941 -5.707 1.00 0.00 C ATOM 2560 CG ASN A 173 15.423 -3.668 -7.199 1.00 0.00 C ATOM 2561 OD1 ASN A 173 14.787 -4.387 -7.970 1.00 0.00 O ATOM 2562 ND2 ASN A 173 16.133 -2.624 -7.612 1.00 0.00 N ATOM 0 H ASN A 173 14.768 -6.177 -7.120 1.00 0.00 H new ATOM 0 HA ASN A 173 14.682 -5.357 -4.273 1.00 0.00 H new ATOM 0 HB2 ASN A 173 15.101 -3.048 -5.176 1.00 0.00 H new ATOM 0 HB3 ASN A 173 16.450 -4.147 -5.383 1.00 0.00 H new ATOM 0 HD21 ASN A 173 16.166 -2.390 -8.604 1.00 0.00 H new ATOM 0 HD22 ASN A 173 16.645 -2.056 -6.937 1.00 0.00 H new ATOM 2569 N ALA A 174 12.600 -3.764 -4.755 1.00 0.00 N ATOM 2570 CA ALA A 174 11.220 -3.307 -4.851 1.00 0.00 C ATOM 2571 C ALA A 174 11.108 -2.082 -5.752 1.00 0.00 C ATOM 2572 O ALA A 174 10.279 -1.203 -5.521 1.00 0.00 O ATOM 2573 CB ALA A 174 10.669 -2.998 -3.467 1.00 0.00 C ATOM 0 H ALA A 174 13.159 -3.275 -4.056 1.00 0.00 H new ATOM 0 HA ALA A 174 10.629 -4.108 -5.296 1.00 0.00 H new ATOM 0 HB1 ALA A 174 9.637 -2.658 -3.554 1.00 0.00 H new ATOM 0 HB2 ALA A 174 10.704 -3.897 -2.852 1.00 0.00 H new ATOM 0 HB3 ALA A 174 11.271 -2.217 -3.002 1.00 0.00 H new ATOM 2579 N ALA A 175 11.950 -2.031 -6.780 1.00 0.00 N ATOM 2580 CA ALA A 175 11.945 -0.914 -7.716 1.00 0.00 C ATOM 2581 C ALA A 175 10.771 -1.014 -8.684 1.00 0.00 C ATOM 2582 O ALA A 175 10.009 -0.062 -8.851 1.00 0.00 O ATOM 2583 CB ALA A 175 13.259 -0.861 -8.482 1.00 0.00 C ATOM 0 H ALA A 175 12.644 -2.750 -6.985 1.00 0.00 H new ATOM 0 HA ALA A 175 11.833 0.007 -7.143 1.00 0.00 H new ATOM 0 HB1 ALA A 175 13.241 -0.022 -9.177 1.00 0.00 H new ATOM 0 HB2 ALA A 175 14.084 -0.734 -7.781 1.00 0.00 H new ATOM 0 HB3 ALA A 175 13.394 -1.789 -9.037 1.00 0.00 H new ATOM 2589 N ASN A 176 10.630 -2.173 -9.319 1.00 0.00 N ATOM 2590 CA ASN A 176 9.549 -2.397 -10.271 1.00 0.00 C ATOM 2591 C ASN A 176 8.210 -2.529 -9.553 1.00 0.00 C ATOM 2592 O ASN A 176 7.189 -2.024 -10.020 1.00 0.00 O ATOM 2593 CB ASN A 176 9.823 -3.654 -11.099 1.00 0.00 C ATOM 2594 CG ASN A 176 11.293 -3.820 -11.430 1.00 0.00 C ATOM 2595 OD1 ASN A 176 12.023 -4.521 -10.729 1.00 0.00 O ATOM 2596 ND2 ASN A 176 11.735 -3.174 -12.502 1.00 0.00 N ATOM 0 H ASN A 176 11.251 -2.972 -9.191 1.00 0.00 H new ATOM 0 HA ASN A 176 9.500 -1.535 -10.937 1.00 0.00 H new ATOM 0 HB2 ASN A 176 9.476 -4.530 -10.550 1.00 0.00 H new ATOM 0 HB3 ASN A 176 9.248 -3.609 -12.024 1.00 0.00 H new ATOM 0 HD21 ASN A 176 12.715 -3.248 -12.774 1.00 0.00 H new ATOM 0 HD22 ASN A 176 11.094 -2.604 -13.054 1.00 0.00 H new ATOM 2603 N VAL A 177 8.221 -3.211 -8.412 1.00 0.00 N ATOM 2604 CA VAL A 177 7.009 -3.409 -7.627 1.00 0.00 C ATOM 2605 C VAL A 177 6.486 -2.085 -7.080 1.00 0.00 C ATOM 2606 O VAL A 177 5.374 -1.665 -7.401 1.00 0.00 O ATOM 2607 CB VAL A 177 7.251 -4.376 -6.453 1.00 0.00 C ATOM 2608 CG1 VAL A 177 6.037 -4.421 -5.538 1.00 0.00 C ATOM 2609 CG2 VAL A 177 7.592 -5.766 -6.970 1.00 0.00 C ATOM 0 H VAL A 177 9.057 -3.636 -8.011 1.00 0.00 H new ATOM 0 HA VAL A 177 6.266 -3.842 -8.297 1.00 0.00 H new ATOM 0 HB VAL A 177 8.099 -4.011 -5.873 1.00 0.00 H new ATOM 0 HG11 VAL A 177 6.227 -5.110 -4.715 1.00 0.00 H new ATOM 0 HG12 VAL A 177 5.844 -3.425 -5.141 1.00 0.00 H new ATOM 0 HG13 VAL A 177 5.169 -4.761 -6.102 1.00 0.00 H new ATOM 0 HG21 VAL A 177 7.760 -6.437 -6.127 1.00 0.00 H new ATOM 0 HG22 VAL A 177 6.766 -6.142 -7.574 1.00 0.00 H new ATOM 0 HG23 VAL A 177 8.494 -5.716 -7.579 1.00 0.00 H new ATOM 2619 N SER A 178 7.296 -1.432 -6.254 1.00 0.00 N ATOM 2620 CA SER A 178 6.914 -0.156 -5.659 1.00 0.00 C ATOM 2621 C SER A 178 6.547 0.858 -6.739 1.00 0.00 C ATOM 2622 O SER A 178 5.744 1.761 -6.509 1.00 0.00 O ATOM 2623 CB SER A 178 8.053 0.390 -4.796 1.00 0.00 C ATOM 2624 OG SER A 178 7.556 1.230 -3.768 1.00 0.00 O ATOM 0 H SER A 178 8.221 -1.765 -5.981 1.00 0.00 H new ATOM 0 HA SER A 178 6.040 -0.323 -5.030 1.00 0.00 H new ATOM 0 HB2 SER A 178 8.609 -0.438 -4.356 1.00 0.00 H new ATOM 0 HB3 SER A 178 8.751 0.948 -5.420 1.00 0.00 H new ATOM 0 HG SER A 178 7.029 0.697 -3.137 1.00 0.00 H new ATOM 2630 N GLU A 179 7.144 0.701 -7.917 1.00 0.00 N ATOM 2631 CA GLU A 179 6.881 1.603 -9.031 1.00 0.00 C ATOM 2632 C GLU A 179 5.520 1.313 -9.657 1.00 0.00 C ATOM 2633 O GLU A 179 4.707 2.217 -9.847 1.00 0.00 O ATOM 2634 CB GLU A 179 7.979 1.475 -10.090 1.00 0.00 C ATOM 2635 CG GLU A 179 7.621 2.118 -11.419 1.00 0.00 C ATOM 2636 CD GLU A 179 7.681 3.632 -11.370 1.00 0.00 C ATOM 2637 OE1 GLU A 179 7.267 4.210 -10.344 1.00 0.00 O ATOM 2638 OE2 GLU A 179 8.142 4.239 -12.360 1.00 0.00 O ATOM 0 H GLU A 179 7.812 -0.042 -8.123 1.00 0.00 H new ATOM 0 HA GLU A 179 6.874 2.622 -8.645 1.00 0.00 H new ATOM 0 HB2 GLU A 179 8.893 1.931 -9.710 1.00 0.00 H new ATOM 0 HB3 GLU A 179 8.193 0.419 -10.253 1.00 0.00 H new ATOM 0 HG2 GLU A 179 8.303 1.756 -12.189 1.00 0.00 H new ATOM 0 HG3 GLU A 179 6.618 1.807 -11.710 1.00 0.00 H new ATOM 2645 N ALA A 180 5.280 0.045 -9.976 1.00 0.00 N ATOM 2646 CA ALA A 180 4.018 -0.366 -10.579 1.00 0.00 C ATOM 2647 C ALA A 180 2.831 0.169 -9.786 1.00 0.00 C ATOM 2648 O ALA A 180 1.943 0.817 -10.339 1.00 0.00 O ATOM 2649 CB ALA A 180 3.950 -1.882 -10.678 1.00 0.00 C ATOM 0 H ALA A 180 5.943 -0.715 -9.827 1.00 0.00 H new ATOM 0 HA ALA A 180 3.969 0.055 -11.583 1.00 0.00 H new ATOM 0 HB1 ALA A 180 3.002 -2.175 -11.130 1.00 0.00 H new ATOM 0 HB2 ALA A 180 4.773 -2.244 -11.294 1.00 0.00 H new ATOM 0 HB3 ALA A 180 4.026 -2.315 -9.681 1.00 0.00 H new ATOM 2655 N VAL A 181 2.822 -0.108 -8.485 1.00 0.00 N ATOM 2656 CA VAL A 181 1.743 0.346 -7.615 1.00 0.00 C ATOM 2657 C VAL A 181 1.629 1.866 -7.629 1.00 0.00 C ATOM 2658 O VAL A 181 0.528 2.415 -7.592 1.00 0.00 O ATOM 2659 CB VAL A 181 1.954 -0.129 -6.165 1.00 0.00 C ATOM 2660 CG1 VAL A 181 3.297 0.351 -5.636 1.00 0.00 C ATOM 2661 CG2 VAL A 181 0.818 0.353 -5.276 1.00 0.00 C ATOM 0 H VAL A 181 3.549 -0.644 -8.011 1.00 0.00 H new ATOM 0 HA VAL A 181 0.821 -0.088 -8.001 1.00 0.00 H new ATOM 0 HB VAL A 181 1.955 -1.219 -6.154 1.00 0.00 H new ATOM 0 HG11 VAL A 181 3.428 0.006 -4.610 1.00 0.00 H new ATOM 0 HG12 VAL A 181 4.097 -0.049 -6.259 1.00 0.00 H new ATOM 0 HG13 VAL A 181 3.329 1.440 -5.659 1.00 0.00 H new ATOM 0 HG21 VAL A 181 0.983 0.008 -4.255 1.00 0.00 H new ATOM 0 HG22 VAL A 181 0.782 1.442 -5.290 1.00 0.00 H new ATOM 0 HG23 VAL A 181 -0.127 -0.046 -5.645 1.00 0.00 H new ATOM 2671 N GLN A 182 2.773 2.540 -7.682 1.00 0.00 N ATOM 2672 CA GLN A 182 2.801 3.997 -7.700 1.00 0.00 C ATOM 2673 C GLN A 182 2.088 4.540 -8.934 1.00 0.00 C ATOM 2674 O GLN A 182 1.122 5.295 -8.823 1.00 0.00 O ATOM 2675 CB GLN A 182 4.245 4.502 -7.668 1.00 0.00 C ATOM 2676 CG GLN A 182 4.365 5.981 -7.338 1.00 0.00 C ATOM 2677 CD GLN A 182 5.761 6.521 -7.581 1.00 0.00 C ATOM 2678 OE1 GLN A 182 6.537 6.660 -6.513 1.00 0.00 O flip ATOM 2679 NE2 GLN A 182 6.137 6.810 -8.717 1.00 0.00 N flip ATOM 0 H GLN A 182 3.693 2.100 -7.713 1.00 0.00 H new ATOM 0 HA GLN A 182 2.279 4.356 -6.813 1.00 0.00 H new ATOM 0 HB2 GLN A 182 4.806 3.927 -6.931 1.00 0.00 H new ATOM 0 HB3 GLN A 182 4.708 4.316 -8.637 1.00 0.00 H new ATOM 0 HG2 GLN A 182 3.652 6.543 -7.941 1.00 0.00 H new ATOM 0 HG3 GLN A 182 4.095 6.140 -6.294 1.00 0.00 H new ATOM 0 HE21 GLN A 182 5.507 6.687 -9.510 1.00 0.00 H new ATOM 0 HE22 GLN A 182 7.079 7.172 -8.866 1.00 0.00 H new ATOM 2688 N ALA A 183 2.570 4.151 -10.110 1.00 0.00 N ATOM 2689 CA ALA A 183 1.978 4.597 -11.364 1.00 0.00 C ATOM 2690 C ALA A 183 0.458 4.480 -11.326 1.00 0.00 C ATOM 2691 O ALA A 183 -0.254 5.346 -11.834 1.00 0.00 O ATOM 2692 CB ALA A 183 2.541 3.795 -12.528 1.00 0.00 C ATOM 0 H ALA A 183 3.370 3.527 -10.220 1.00 0.00 H new ATOM 0 HA ALA A 183 2.232 5.648 -11.503 1.00 0.00 H new ATOM 0 HB1 ALA A 183 2.090 4.139 -13.459 1.00 0.00 H new ATOM 0 HB2 ALA A 183 3.621 3.933 -12.576 1.00 0.00 H new ATOM 0 HB3 ALA A 183 2.316 2.738 -12.384 1.00 0.00 H new ATOM 2698 N ALA A 184 -0.033 3.404 -10.720 1.00 0.00 N ATOM 2699 CA ALA A 184 -1.469 3.176 -10.615 1.00 0.00 C ATOM 2700 C ALA A 184 -2.179 4.398 -10.042 1.00 0.00 C ATOM 2701 O ALA A 184 -3.247 4.786 -10.516 1.00 0.00 O ATOM 2702 CB ALA A 184 -1.747 1.951 -9.756 1.00 0.00 C ATOM 0 H ALA A 184 0.542 2.677 -10.295 1.00 0.00 H new ATOM 0 HA ALA A 184 -1.858 3.000 -11.618 1.00 0.00 H new ATOM 0 HB1 ALA A 184 -2.823 1.792 -9.686 1.00 0.00 H new ATOM 0 HB2 ALA A 184 -1.280 1.076 -10.208 1.00 0.00 H new ATOM 0 HB3 ALA A 184 -1.337 2.106 -8.758 1.00 0.00 H new ATOM 2708 N CYS A 185 -1.580 4.999 -9.021 1.00 0.00 N ATOM 2709 CA CYS A 185 -2.156 6.177 -8.382 1.00 0.00 C ATOM 2710 C CYS A 185 -2.687 7.156 -9.425 1.00 0.00 C ATOM 2711 O CYS A 185 -3.566 7.968 -9.137 1.00 0.00 O ATOM 2712 CB CYS A 185 -1.113 6.868 -7.502 1.00 0.00 C ATOM 2713 SG CYS A 185 -0.512 5.851 -6.133 1.00 0.00 S ATOM 0 H CYS A 185 -0.696 4.690 -8.617 1.00 0.00 H new ATOM 0 HA CYS A 185 -2.988 5.851 -7.758 1.00 0.00 H new ATOM 0 HB2 CYS A 185 -0.266 7.160 -8.123 1.00 0.00 H new ATOM 0 HB3 CYS A 185 -1.544 7.784 -7.098 1.00 0.00 H new ATOM 0 HG CYS A 185 -0.579 6.530 -5.026 1.00 0.00 H new