USER MOD reduce.3.24.130724 H: found=0, std=0, add=972, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 972 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 164 ASN : amide:sc= -0.794 K(o=-0.66,f=-5.3!) USER MOD Set 1.2: A 167 ASN : amide:sc= 0.136 K(o=-0.66,f=-2.1!) USER MOD Set 2.1: A 134 MET CE :methyl -142:sc= -2.35! (180deg=-3.83!) USER MOD Set 2.2: A 176 CYS SG : rot 55:sc= 0.486 USER MOD Set 3.1: A 85 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 89 ASN : amide:sc= -2.08! K(o=-2.1!,f=-1.5) USER MOD Set 4.1: A 68 TYR OH : rot 45:sc= -0.529 USER MOD Set 4.2: A 157 HIS : no HD1:sc= 0.0313 X(o=-0.5,f=-0.82) USER MOD Set 5.1: A 28 ASN : amide:sc= -1.48 K(o=-1.5,f=-10!) USER MOD Set 5.2: A 30 THR OG1 : rot 180:sc= 0 USER MOD Set 6.1: A 19 SER OG : rot 180:sc= 0 USER MOD Set 6.2: A 23 GLN : amide:sc= -0.853 K(o=-0.85,f=-1.6!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl 175:sc= 0 (180deg=-0.0247) USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0498) USER MOD Single : A 67 GLN : amide:sc= 0.315 X(o=0.31,f=0) USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl 163:sc= -4.14! (180deg=-5.26!) USER MOD Single : A 82 THR OG1 : rot 150:sc= 0 USER MOD Single : A 84 ASN : amide:sc= -0.218 X(o=-0.22,f=-0.25) USER MOD Single : A 91 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= -2.73! USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -0.648 K(o=-0.65,f=-6.4e-05) USER MOD Single : A 104 MET CE :methyl -115:sc= -0.411 (180deg=-2.97!) USER MOD Single : A 105 ASN : amide:sc= -1.14 K(o=-1.1,f=-4.3!) USER MOD Single : A 110 THR OG1 : rot 60:sc= 0.734 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 ASN : amide:sc= -0.712 K(o=-0.71,f=-4.2!) USER MOD Single : A 126 CYS SG : rot -178:sc= 0.742 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0545) USER MOD Single : A 141 HIS : no HD1:sc= -1.32 X(o=-1.3,f=-1.1) USER MOD Single : A 142 THR OG1 : rot 51:sc= 0.279 USER MOD Single : A 147 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 149 THR OG1 : rot -94:sc= 0.821 USER MOD Single : A 151 ASN : amide:sc= -0.141 K(o=-0.14,f=-2.3!) USER MOD Single : A 152 GLN : amide:sc= -0.0264 X(o=-0.026,f=0) USER MOD Single : A 156 CYS SG : rot 160:sc= -0.832 USER MOD Single : A 161 CYS SG : rot 170:sc= -2.34! USER MOD Single : A 169 SER OG : rot -7:sc= 1.12 USER MOD Single : A 173 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 213 N LEU A 18 -3.747 8.541 -11.916 1.00 0.00 N ATOM 214 CA LEU A 18 -4.423 7.317 -11.498 1.00 0.00 C ATOM 215 C LEU A 18 -4.411 6.279 -12.616 1.00 0.00 C ATOM 216 O LEU A 18 -4.519 5.079 -12.363 1.00 0.00 O ATOM 217 CB LEU A 18 -5.864 7.623 -11.086 1.00 0.00 C ATOM 218 CG LEU A 18 -6.066 8.081 -9.641 1.00 0.00 C ATOM 219 CD1 LEU A 18 -7.520 8.455 -9.398 1.00 0.00 C ATOM 220 CD2 LEU A 18 -5.623 6.996 -8.671 1.00 0.00 C ATOM 0 HA LEU A 18 -3.886 6.908 -10.642 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.254 8.395 -11.749 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -6.465 6.729 -11.250 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.452 8.965 -9.471 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.645 8.778 -8.365 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -7.804 9.266 -10.069 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -8.155 7.589 -9.586 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.774 7.339 -7.648 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -6.210 6.094 -8.841 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.567 6.777 -8.828 1.00 0.00 H new ATOM 232 N SER A 19 -4.276 6.749 -13.852 1.00 0.00 N ATOM 233 CA SER A 19 -4.251 5.862 -15.008 1.00 0.00 C ATOM 234 C SER A 19 -3.050 4.923 -14.947 1.00 0.00 C ATOM 235 O SER A 19 -3.203 3.704 -14.860 1.00 0.00 O ATOM 236 CB SER A 19 -4.210 6.677 -16.302 1.00 0.00 C ATOM 237 OG SER A 19 -3.764 5.885 -17.390 1.00 0.00 O ATOM 0 H SER A 19 -4.182 7.739 -14.078 1.00 0.00 H new ATOM 0 HA SER A 19 -5.161 5.262 -14.994 1.00 0.00 H new ATOM 0 HB2 SER A 19 -5.203 7.072 -16.518 1.00 0.00 H new ATOM 0 HB3 SER A 19 -3.547 7.533 -16.175 1.00 0.00 H new ATOM 0 HG SER A 19 -3.748 6.428 -18.205 1.00 0.00 H new ATOM 243 N LYS A 20 -1.854 5.499 -14.993 1.00 0.00 N ATOM 244 CA LYS A 20 -0.625 4.717 -14.941 1.00 0.00 C ATOM 245 C LYS A 20 -0.689 3.675 -13.828 1.00 0.00 C ATOM 246 O LYS A 20 -0.200 2.557 -13.984 1.00 0.00 O ATOM 247 CB LYS A 20 0.580 5.635 -14.726 1.00 0.00 C ATOM 248 CG LYS A 20 0.850 5.952 -13.265 1.00 0.00 C ATOM 249 CD LYS A 20 2.172 6.679 -13.087 1.00 0.00 C ATOM 250 CE LYS A 20 3.355 5.756 -13.340 1.00 0.00 C ATOM 251 NZ LYS A 20 4.654 6.436 -13.084 1.00 0.00 N ATOM 0 H LYS A 20 -1.710 6.506 -15.066 1.00 0.00 H new ATOM 0 HA LYS A 20 -0.514 4.199 -15.894 1.00 0.00 H new ATOM 0 HB2 LYS A 20 1.465 5.166 -15.157 1.00 0.00 H new ATOM 0 HB3 LYS A 20 0.417 6.567 -15.267 1.00 0.00 H new ATOM 0 HG2 LYS A 20 0.040 6.565 -12.869 1.00 0.00 H new ATOM 0 HG3 LYS A 20 0.861 5.028 -12.687 1.00 0.00 H new ATOM 0 HD2 LYS A 20 2.217 7.526 -13.771 1.00 0.00 H new ATOM 0 HD3 LYS A 20 2.233 7.082 -12.076 1.00 0.00 H new ATOM 0 HE2 LYS A 20 3.273 4.877 -12.700 1.00 0.00 H new ATOM 0 HE3 LYS A 20 3.327 5.404 -14.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 5.435 5.774 -13.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 4.744 7.260 -13.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 4.692 6.750 -12.093 1.00 0.00 H new ATOM 265 N MET A 21 -1.296 4.050 -12.707 1.00 0.00 N ATOM 266 CA MET A 21 -1.426 3.147 -11.570 1.00 0.00 C ATOM 267 C MET A 21 -2.168 1.875 -11.968 1.00 0.00 C ATOM 268 O MET A 21 -1.762 0.771 -11.608 1.00 0.00 O ATOM 269 CB MET A 21 -2.160 3.841 -10.421 1.00 0.00 C ATOM 270 CG MET A 21 -1.235 4.582 -9.469 1.00 0.00 C ATOM 271 SD MET A 21 -0.653 3.541 -8.117 1.00 0.00 S ATOM 272 CE MET A 21 0.887 4.357 -7.701 1.00 0.00 C ATOM 0 H MET A 21 -1.705 4.973 -12.562 1.00 0.00 H new ATOM 0 HA MET A 21 -0.424 2.874 -11.239 1.00 0.00 H new ATOM 0 HB2 MET A 21 -2.882 4.545 -10.835 1.00 0.00 H new ATOM 0 HB3 MET A 21 -2.725 3.097 -9.860 1.00 0.00 H new ATOM 0 HG2 MET A 21 -0.378 4.963 -10.024 1.00 0.00 H new ATOM 0 HG3 MET A 21 -1.758 5.446 -9.058 1.00 0.00 H new ATOM 0 HE1 MET A 21 1.324 3.883 -6.822 1.00 0.00 H new ATOM 0 HE2 MET A 21 1.580 4.276 -8.539 1.00 0.00 H new ATOM 0 HE3 MET A 21 0.696 5.409 -7.489 1.00 0.00 H new ATOM 282 N GLN A 22 -3.258 2.039 -12.711 1.00 0.00 N ATOM 283 CA GLN A 22 -4.056 0.903 -13.157 1.00 0.00 C ATOM 284 C GLN A 22 -3.390 0.198 -14.333 1.00 0.00 C ATOM 285 O GLN A 22 -3.398 -1.030 -14.417 1.00 0.00 O ATOM 286 CB GLN A 22 -5.461 1.363 -13.551 1.00 0.00 C ATOM 287 CG GLN A 22 -6.291 1.858 -12.377 1.00 0.00 C ATOM 288 CD GLN A 22 -7.373 2.833 -12.798 1.00 0.00 C ATOM 289 OE1 GLN A 22 -7.103 3.822 -13.479 1.00 0.00 O ATOM 290 NE2 GLN A 22 -8.608 2.558 -12.394 1.00 0.00 N ATOM 0 H GLN A 22 -3.608 2.947 -13.017 1.00 0.00 H new ATOM 0 HA GLN A 22 -4.131 0.197 -12.330 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -5.379 2.161 -14.289 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -5.984 0.536 -14.032 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -6.750 1.006 -11.876 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -5.636 2.339 -11.651 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -8.787 1.727 -11.831 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -9.377 3.178 -12.647 1.00 0.00 H new ATOM 299 N GLN A 23 -2.816 0.982 -15.240 1.00 0.00 N ATOM 300 CA GLN A 23 -2.147 0.431 -16.412 1.00 0.00 C ATOM 301 C GLN A 23 -1.137 -0.638 -16.010 1.00 0.00 C ATOM 302 O GLN A 23 -1.319 -1.819 -16.305 1.00 0.00 O ATOM 303 CB GLN A 23 -1.446 1.543 -17.195 1.00 0.00 C ATOM 304 CG GLN A 23 -2.405 2.520 -17.855 1.00 0.00 C ATOM 305 CD GLN A 23 -3.650 1.842 -18.393 1.00 0.00 C ATOM 306 OE1 GLN A 23 -3.573 0.792 -19.030 1.00 0.00 O ATOM 307 NE2 GLN A 23 -4.808 2.442 -18.137 1.00 0.00 N ATOM 0 H GLN A 23 -2.801 2.000 -15.185 1.00 0.00 H new ATOM 0 HA GLN A 23 -2.903 -0.030 -17.047 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -0.788 2.092 -16.521 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -0.814 1.094 -17.961 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -2.695 3.283 -17.133 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -1.893 3.031 -18.670 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -4.825 3.312 -17.605 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -5.680 2.033 -18.473 1.00 0.00 H new ATOM 316 N ASN A 24 -0.072 -0.216 -15.336 1.00 0.00 N ATOM 317 CA ASN A 24 0.967 -1.139 -14.894 1.00 0.00 C ATOM 318 C ASN A 24 1.185 -1.032 -13.388 1.00 0.00 C ATOM 319 O ASN A 24 1.530 -2.012 -12.729 1.00 0.00 O ATOM 320 CB ASN A 24 2.277 -0.854 -15.631 1.00 0.00 C ATOM 321 CG ASN A 24 2.173 -1.123 -17.120 1.00 0.00 C ATOM 322 OD1 ASN A 24 2.429 -2.236 -17.580 1.00 0.00 O ATOM 323 ND2 ASN A 24 1.797 -0.102 -17.881 1.00 0.00 N ATOM 0 H ASN A 24 0.094 0.758 -15.084 1.00 0.00 H new ATOM 0 HA ASN A 24 0.640 -2.153 -15.125 1.00 0.00 H new ATOM 0 HB2 ASN A 24 2.562 0.186 -15.471 1.00 0.00 H new ATOM 0 HB3 ASN A 24 3.070 -1.470 -15.208 1.00 0.00 H new ATOM 0 HD21 ASN A 24 1.710 -0.223 -18.890 1.00 0.00 H new ATOM 0 HD22 ASN A 24 1.595 0.803 -17.456 1.00 0.00 H new ATOM 330 N GLY A 25 0.979 0.166 -12.849 1.00 0.00 N ATOM 331 CA GLY A 25 1.157 0.379 -11.424 1.00 0.00 C ATOM 332 C GLY A 25 2.484 1.034 -11.097 1.00 0.00 C ATOM 333 O GLY A 25 2.917 1.956 -11.789 1.00 0.00 O ATOM 0 H GLY A 25 0.692 0.993 -13.373 1.00 0.00 H new ATOM 0 HA2 GLY A 25 0.345 1.002 -11.049 1.00 0.00 H new ATOM 0 HA3 GLY A 25 1.090 -0.578 -10.906 1.00 0.00 H new ATOM 337 N TYR A 26 3.132 0.559 -10.039 1.00 0.00 N ATOM 338 CA TYR A 26 4.416 1.108 -9.619 1.00 0.00 C ATOM 339 C TYR A 26 5.214 0.079 -8.824 1.00 0.00 C ATOM 340 O TYR A 26 4.794 -0.353 -7.751 1.00 0.00 O ATOM 341 CB TYR A 26 4.205 2.367 -8.777 1.00 0.00 C ATOM 342 CG TYR A 26 5.486 3.106 -8.461 1.00 0.00 C ATOM 343 CD1 TYR A 26 6.350 2.647 -7.474 1.00 0.00 C ATOM 344 CD2 TYR A 26 5.833 4.261 -9.150 1.00 0.00 C ATOM 345 CE1 TYR A 26 7.521 3.319 -7.181 1.00 0.00 C ATOM 346 CE2 TYR A 26 7.002 4.939 -8.865 1.00 0.00 C ATOM 347 CZ TYR A 26 7.843 4.464 -7.879 1.00 0.00 C ATOM 348 OH TYR A 26 9.009 5.136 -7.592 1.00 0.00 O ATOM 0 H TYR A 26 2.789 -0.205 -9.457 1.00 0.00 H new ATOM 0 HA TYR A 26 4.982 1.368 -10.514 1.00 0.00 H new ATOM 0 HB2 TYR A 26 3.529 3.039 -9.306 1.00 0.00 H new ATOM 0 HB3 TYR A 26 3.715 2.092 -7.843 1.00 0.00 H new ATOM 0 HD1 TYR A 26 6.102 1.750 -6.927 1.00 0.00 H new ATOM 0 HD2 TYR A 26 5.177 4.635 -9.922 1.00 0.00 H new ATOM 0 HE1 TYR A 26 8.181 2.950 -6.410 1.00 0.00 H new ATOM 0 HE2 TYR A 26 7.257 5.836 -9.410 1.00 0.00 H new ATOM 0 HH TYR A 26 9.086 5.921 -8.174 1.00 0.00 H new ATOM 358 N GLU A 27 6.368 -0.308 -9.359 1.00 0.00 N ATOM 359 CA GLU A 27 7.225 -1.286 -8.700 1.00 0.00 C ATOM 360 C GLU A 27 8.451 -0.612 -8.090 1.00 0.00 C ATOM 361 O GLU A 27 9.267 -0.026 -8.800 1.00 0.00 O ATOM 362 CB GLU A 27 7.664 -2.364 -9.693 1.00 0.00 C ATOM 363 CG GLU A 27 6.517 -2.958 -10.493 1.00 0.00 C ATOM 364 CD GLU A 27 6.220 -2.176 -11.758 1.00 0.00 C ATOM 365 OE1 GLU A 27 7.139 -1.499 -12.264 1.00 0.00 O ATOM 366 OE2 GLU A 27 5.070 -2.241 -12.240 1.00 0.00 O ATOM 0 H GLU A 27 6.730 0.041 -10.246 1.00 0.00 H new ATOM 0 HA GLU A 27 6.651 -1.752 -7.899 1.00 0.00 H new ATOM 0 HB2 GLU A 27 8.393 -1.937 -10.381 1.00 0.00 H new ATOM 0 HB3 GLU A 27 8.169 -3.163 -9.150 1.00 0.00 H new ATOM 0 HG2 GLU A 27 6.758 -3.988 -10.756 1.00 0.00 H new ATOM 0 HG3 GLU A 27 5.623 -2.988 -9.871 1.00 0.00 H new ATOM 373 N ASN A 28 8.571 -0.698 -6.770 1.00 0.00 N ATOM 374 CA ASN A 28 9.695 -0.096 -6.063 1.00 0.00 C ATOM 375 C ASN A 28 11.021 -0.640 -6.587 1.00 0.00 C ATOM 376 O ASN A 28 11.298 -1.838 -6.523 1.00 0.00 O ATOM 377 CB ASN A 28 9.581 -0.360 -4.560 1.00 0.00 C ATOM 378 CG ASN A 28 10.460 0.566 -3.742 1.00 0.00 C ATOM 379 OD1 ASN A 28 11.405 1.161 -4.260 1.00 0.00 O ATOM 380 ND2 ASN A 28 10.151 0.691 -2.456 1.00 0.00 N ATOM 0 H ASN A 28 7.903 -1.179 -6.168 1.00 0.00 H new ATOM 0 HA ASN A 28 9.668 0.979 -6.239 1.00 0.00 H new ATOM 0 HB2 ASN A 28 8.543 -0.239 -4.250 1.00 0.00 H new ATOM 0 HB3 ASN A 28 9.856 -1.394 -4.354 1.00 0.00 H new ATOM 0 HD21 ASN A 28 10.706 1.300 -1.855 1.00 0.00 H new ATOM 0 HD22 ASN A 28 9.358 0.178 -2.070 1.00 0.00 H new ATOM 387 N PRO A 29 11.862 0.261 -7.117 1.00 0.00 N ATOM 388 CA PRO A 29 13.173 -0.104 -7.661 1.00 0.00 C ATOM 389 C PRO A 29 14.155 -0.526 -6.574 1.00 0.00 C ATOM 390 O PRO A 29 15.114 -1.253 -6.836 1.00 0.00 O ATOM 391 CB PRO A 29 13.647 1.183 -8.340 1.00 0.00 C ATOM 392 CG PRO A 29 12.931 2.275 -7.622 1.00 0.00 C ATOM 393 CD PRO A 29 11.597 1.705 -7.226 1.00 0.00 C ATOM 0 HA PRO A 29 13.111 -0.959 -8.334 1.00 0.00 H new ATOM 0 HB2 PRO A 29 14.728 1.298 -8.259 1.00 0.00 H new ATOM 0 HB3 PRO A 29 13.405 1.182 -9.403 1.00 0.00 H new ATOM 0 HG2 PRO A 29 13.492 2.599 -6.746 1.00 0.00 H new ATOM 0 HG3 PRO A 29 12.808 3.148 -8.263 1.00 0.00 H new ATOM 0 HD2 PRO A 29 11.246 2.122 -6.282 1.00 0.00 H new ATOM 0 HD3 PRO A 29 10.832 1.918 -7.972 1.00 0.00 H new ATOM 401 N THR A 30 13.910 -0.066 -5.351 1.00 0.00 N ATOM 402 CA THR A 30 14.773 -0.394 -4.223 1.00 0.00 C ATOM 403 C THR A 30 14.615 -1.855 -3.817 1.00 0.00 C ATOM 404 O THR A 30 15.495 -2.430 -3.176 1.00 0.00 O ATOM 405 CB THR A 30 14.472 0.500 -3.006 1.00 0.00 C ATOM 406 OG1 THR A 30 14.520 1.880 -3.388 1.00 0.00 O ATOM 407 CG2 THR A 30 15.470 0.244 -1.887 1.00 0.00 C ATOM 0 H THR A 30 13.120 0.535 -5.116 1.00 0.00 H new ATOM 0 HA THR A 30 15.798 -0.218 -4.548 1.00 0.00 H new ATOM 0 HB THR A 30 13.473 0.258 -2.643 1.00 0.00 H new ATOM 0 HG1 THR A 30 14.326 2.442 -2.609 1.00 0.00 H new ATOM 0 HG21 THR A 30 15.237 0.887 -1.038 1.00 0.00 H new ATOM 0 HG22 THR A 30 15.411 -0.800 -1.579 1.00 0.00 H new ATOM 0 HG23 THR A 30 16.478 0.461 -2.241 1.00 0.00 H new ATOM 824 N VAL A 61 4.336 14.937 8.503 1.00 0.00 N ATOM 825 CA VAL A 61 3.604 13.678 8.445 1.00 0.00 C ATOM 826 C VAL A 61 2.239 13.865 7.791 1.00 0.00 C ATOM 827 O VAL A 61 1.576 14.881 7.997 1.00 0.00 O ATOM 828 CB VAL A 61 3.409 13.076 9.850 1.00 0.00 C ATOM 829 CG1 VAL A 61 2.971 14.149 10.835 1.00 0.00 C ATOM 830 CG2 VAL A 61 2.402 11.937 9.807 1.00 0.00 C ATOM 0 HA VAL A 61 4.201 12.993 7.844 1.00 0.00 H new ATOM 0 HB VAL A 61 4.364 12.673 10.189 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.838 13.705 11.822 1.00 0.00 H new ATOM 0 HG12 VAL A 61 3.732 14.928 10.887 1.00 0.00 H new ATOM 0 HG13 VAL A 61 2.028 14.584 10.503 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.277 11.524 10.808 1.00 0.00 H new ATOM 0 HG22 VAL A 61 1.444 12.312 9.447 1.00 0.00 H new ATOM 0 HG23 VAL A 61 2.762 11.158 9.135 1.00 0.00 H new ATOM 840 N GLN A 62 1.827 12.877 7.003 1.00 0.00 N ATOM 841 CA GLN A 62 0.540 12.934 6.319 1.00 0.00 C ATOM 842 C GLN A 62 -0.396 11.843 6.828 1.00 0.00 C ATOM 843 O GLN A 62 -0.009 10.679 6.939 1.00 0.00 O ATOM 844 CB GLN A 62 0.736 12.790 4.808 1.00 0.00 C ATOM 845 CG GLN A 62 1.271 14.047 4.142 1.00 0.00 C ATOM 846 CD GLN A 62 1.674 13.816 2.699 1.00 0.00 C ATOM 847 OE1 GLN A 62 0.838 13.851 1.795 1.00 0.00 O ATOM 848 NE2 GLN A 62 2.961 13.577 2.474 1.00 0.00 N ATOM 0 H GLN A 62 2.364 12.029 6.823 1.00 0.00 H new ATOM 0 HA GLN A 62 0.087 13.903 6.530 1.00 0.00 H new ATOM 0 HB2 GLN A 62 1.424 11.966 4.616 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -0.217 12.523 4.350 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.511 14.827 4.183 1.00 0.00 H new ATOM 0 HG3 GLN A 62 2.132 14.412 4.702 1.00 0.00 H new ATOM 0 HE21 GLN A 62 3.620 13.557 3.253 1.00 0.00 H new ATOM 0 HE22 GLN A 62 3.291 13.413 1.523 1.00 0.00 H new ATOM 857 N LYS A 63 -1.629 12.226 7.138 1.00 0.00 N ATOM 858 CA LYS A 63 -2.623 11.282 7.636 1.00 0.00 C ATOM 859 C LYS A 63 -3.828 11.217 6.703 1.00 0.00 C ATOM 860 O LYS A 63 -4.443 12.239 6.396 1.00 0.00 O ATOM 861 CB LYS A 63 -3.074 11.679 9.043 1.00 0.00 C ATOM 862 CG LYS A 63 -2.180 11.137 10.144 1.00 0.00 C ATOM 863 CD LYS A 63 -2.568 11.694 11.503 1.00 0.00 C ATOM 864 CE LYS A 63 -1.430 11.567 12.504 1.00 0.00 C ATOM 865 NZ LYS A 63 -0.361 12.574 12.260 1.00 0.00 N ATOM 0 H LYS A 63 -1.965 13.185 7.053 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.162 10.295 7.674 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -3.103 12.766 9.113 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -4.091 11.322 9.204 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -2.245 10.049 10.164 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -1.142 11.391 9.929 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -2.849 12.742 11.401 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -3.444 11.165 11.878 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -1.820 11.689 13.514 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -1.005 10.565 12.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 0.309 12.569 13.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 0.143 12.339 11.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -0.787 13.519 12.173 1.00 0.00 H new ATOM 879 N PHE A 64 -4.161 10.011 6.256 1.00 0.00 N ATOM 880 CA PHE A 64 -5.293 9.814 5.358 1.00 0.00 C ATOM 881 C PHE A 64 -6.347 8.917 6.001 1.00 0.00 C ATOM 882 O PHE A 64 -6.021 7.907 6.626 1.00 0.00 O ATOM 883 CB PHE A 64 -4.823 9.201 4.037 1.00 0.00 C ATOM 884 CG PHE A 64 -3.872 10.079 3.274 1.00 0.00 C ATOM 885 CD1 PHE A 64 -2.506 9.985 3.481 1.00 0.00 C ATOM 886 CD2 PHE A 64 -4.346 10.997 2.351 1.00 0.00 C ATOM 887 CE1 PHE A 64 -1.628 10.791 2.780 1.00 0.00 C ATOM 888 CE2 PHE A 64 -3.473 11.805 1.647 1.00 0.00 C ATOM 889 CZ PHE A 64 -2.112 11.703 1.863 1.00 0.00 C ATOM 0 H PHE A 64 -3.663 9.155 6.501 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.741 10.788 5.160 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.339 8.246 4.241 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -5.692 8.992 3.413 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -2.122 9.274 4.198 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -5.409 11.082 2.180 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.565 10.707 2.949 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -3.854 12.516 0.929 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.428 12.335 1.316 1.00 0.00 H new ATOM 899 N ARG A 65 -7.612 9.294 5.844 1.00 0.00 N ATOM 900 CA ARG A 65 -8.714 8.526 6.410 1.00 0.00 C ATOM 901 C ARG A 65 -9.199 7.465 5.427 1.00 0.00 C ATOM 902 O ARG A 65 -9.966 7.757 4.510 1.00 0.00 O ATOM 903 CB ARG A 65 -9.871 9.454 6.786 1.00 0.00 C ATOM 904 CG ARG A 65 -11.023 8.743 7.476 1.00 0.00 C ATOM 905 CD ARG A 65 -12.294 9.577 7.440 1.00 0.00 C ATOM 906 NE ARG A 65 -12.794 9.753 6.079 1.00 0.00 N ATOM 907 CZ ARG A 65 -14.045 10.100 5.795 1.00 0.00 C ATOM 908 NH1 ARG A 65 -14.917 10.307 6.771 1.00 0.00 N ATOM 909 NH2 ARG A 65 -14.424 10.240 4.531 1.00 0.00 N ATOM 0 H ARG A 65 -7.899 10.127 5.329 1.00 0.00 H new ATOM 0 HA ARG A 65 -8.351 8.026 7.308 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -9.496 10.241 7.441 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -10.243 9.940 5.884 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -11.202 7.783 6.991 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -10.754 8.532 8.511 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -13.060 9.097 8.049 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -12.100 10.553 7.884 1.00 0.00 H new ATOM 0 HE ARG A 65 -12.148 9.601 5.304 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -14.629 10.200 7.744 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -15.876 10.573 6.550 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -13.755 10.081 3.777 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -15.384 10.506 4.313 1.00 0.00 H new ATOM 923 N VAL A 66 -8.745 6.231 5.625 1.00 0.00 N ATOM 924 CA VAL A 66 -9.132 5.126 4.757 1.00 0.00 C ATOM 925 C VAL A 66 -9.755 3.989 5.559 1.00 0.00 C ATOM 926 O VAL A 66 -9.892 4.080 6.778 1.00 0.00 O ATOM 927 CB VAL A 66 -7.925 4.582 3.968 1.00 0.00 C ATOM 928 CG1 VAL A 66 -7.344 5.662 3.069 1.00 0.00 C ATOM 929 CG2 VAL A 66 -6.868 4.042 4.920 1.00 0.00 C ATOM 0 H VAL A 66 -8.109 5.972 6.379 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.868 5.518 4.055 1.00 0.00 H new ATOM 0 HB VAL A 66 -8.265 3.762 3.335 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -6.493 5.259 2.520 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -8.105 5.997 2.364 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -7.017 6.505 3.678 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -6.022 3.662 4.347 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -6.529 4.841 5.579 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -7.294 3.236 5.517 1.00 0.00 H new ATOM 939 N GLN A 67 -10.131 2.919 4.865 1.00 0.00 N ATOM 940 CA GLN A 67 -10.740 1.764 5.514 1.00 0.00 C ATOM 941 C GLN A 67 -9.882 0.517 5.323 1.00 0.00 C ATOM 942 O GLN A 67 -9.080 0.440 4.392 1.00 0.00 O ATOM 943 CB GLN A 67 -12.144 1.522 4.957 1.00 0.00 C ATOM 944 CG GLN A 67 -13.220 2.351 5.639 1.00 0.00 C ATOM 945 CD GLN A 67 -14.460 2.517 4.783 1.00 0.00 C ATOM 946 OE1 GLN A 67 -14.486 3.329 3.858 1.00 0.00 O ATOM 947 NE2 GLN A 67 -15.497 1.745 5.086 1.00 0.00 N ATOM 0 H GLN A 67 -10.025 2.828 3.855 1.00 0.00 H new ATOM 0 HA GLN A 67 -10.811 1.974 6.581 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -12.146 1.746 3.890 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -12.390 0.465 5.062 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -13.495 1.878 6.582 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -12.817 3.334 5.882 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -15.432 1.085 5.861 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -16.358 1.812 4.544 1.00 0.00 H new ATOM 956 N TYR A 68 -10.057 -0.456 6.210 1.00 0.00 N ATOM 957 CA TYR A 68 -9.297 -1.699 6.140 1.00 0.00 C ATOM 958 C TYR A 68 -10.136 -2.817 5.530 1.00 0.00 C ATOM 959 O TYR A 68 -11.275 -3.048 5.938 1.00 0.00 O ATOM 960 CB TYR A 68 -8.819 -2.107 7.535 1.00 0.00 C ATOM 961 CG TYR A 68 -7.515 -2.871 7.528 1.00 0.00 C ATOM 962 CD1 TYR A 68 -7.352 -4.000 6.735 1.00 0.00 C ATOM 963 CD2 TYR A 68 -6.445 -2.465 8.316 1.00 0.00 C ATOM 964 CE1 TYR A 68 -6.162 -4.701 6.726 1.00 0.00 C ATOM 965 CE2 TYR A 68 -5.251 -3.159 8.313 1.00 0.00 C ATOM 966 CZ TYR A 68 -5.114 -4.277 7.516 1.00 0.00 C ATOM 967 OH TYR A 68 -3.927 -4.972 7.511 1.00 0.00 O ATOM 0 H TYR A 68 -10.718 -0.408 6.986 1.00 0.00 H new ATOM 0 HA TYR A 68 -8.430 -1.530 5.501 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -8.703 -1.212 8.146 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -9.587 -2.719 8.008 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -8.170 -4.335 6.115 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -6.549 -1.591 8.942 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -6.053 -5.577 6.103 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -4.429 -2.829 8.931 1.00 0.00 H new ATOM 0 HH TYR A 68 -3.679 -5.189 6.588 1.00 0.00 H new ATOM 977 N LEU A 69 -9.565 -3.509 4.550 1.00 0.00 N ATOM 978 CA LEU A 69 -10.258 -4.605 3.882 1.00 0.00 C ATOM 979 C LEU A 69 -9.808 -5.952 4.437 1.00 0.00 C ATOM 980 O LEU A 69 -10.621 -6.851 4.650 1.00 0.00 O ATOM 981 CB LEU A 69 -10.005 -4.551 2.375 1.00 0.00 C ATOM 982 CG LEU A 69 -10.981 -3.701 1.560 1.00 0.00 C ATOM 983 CD1 LEU A 69 -10.483 -2.268 1.456 1.00 0.00 C ATOM 984 CD2 LEU A 69 -11.183 -4.299 0.176 1.00 0.00 C ATOM 0 H LEU A 69 -8.624 -3.330 4.200 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.326 -4.495 4.069 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.997 -4.170 2.210 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -10.029 -5.569 1.986 1.00 0.00 H new ATOM 0 HG LEU A 69 -11.942 -3.694 2.074 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.190 -1.678 0.873 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -10.392 -1.841 2.455 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -9.510 -2.256 0.966 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.880 -3.681 -0.389 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.227 -4.338 -0.346 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.586 -5.307 0.271 1.00 0.00 H new ATOM 996 N GLY A 70 -8.506 -6.085 4.671 1.00 0.00 N ATOM 997 CA GLY A 70 -7.970 -7.326 5.201 1.00 0.00 C ATOM 998 C GLY A 70 -6.778 -7.827 4.411 1.00 0.00 C ATOM 999 O GLY A 70 -6.618 -7.493 3.238 1.00 0.00 O ATOM 0 H GLY A 70 -7.813 -5.356 4.503 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -7.677 -7.177 6.240 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.751 -8.087 5.196 1.00 0.00 H new ATOM 1003 N MET A 71 -5.937 -8.629 5.056 1.00 0.00 N ATOM 1004 CA MET A 71 -4.752 -9.176 4.406 1.00 0.00 C ATOM 1005 C MET A 71 -5.123 -10.335 3.486 1.00 0.00 C ATOM 1006 O MET A 71 -6.079 -11.068 3.749 1.00 0.00 O ATOM 1007 CB MET A 71 -3.740 -9.644 5.453 1.00 0.00 C ATOM 1008 CG MET A 71 -2.434 -10.143 4.855 1.00 0.00 C ATOM 1009 SD MET A 71 -1.595 -11.335 5.916 1.00 0.00 S ATOM 1010 CE MET A 71 -2.412 -12.854 5.431 1.00 0.00 C ATOM 0 H MET A 71 -6.054 -8.914 6.028 1.00 0.00 H new ATOM 0 HA MET A 71 -4.302 -8.387 3.804 1.00 0.00 H new ATOM 0 HB2 MET A 71 -3.527 -8.820 6.134 1.00 0.00 H new ATOM 0 HB3 MET A 71 -4.186 -10.442 6.047 1.00 0.00 H new ATOM 0 HG2 MET A 71 -2.634 -10.602 3.887 1.00 0.00 H new ATOM 0 HG3 MET A 71 -1.774 -9.295 4.675 1.00 0.00 H new ATOM 0 HE1 MET A 71 -2.001 -13.687 6.002 1.00 0.00 H new ATOM 0 HE2 MET A 71 -3.481 -12.771 5.628 1.00 0.00 H new ATOM 0 HE3 MET A 71 -2.252 -13.029 4.367 1.00 0.00 H new ATOM 1020 N LEU A 72 -4.364 -10.496 2.409 1.00 0.00 N ATOM 1021 CA LEU A 72 -4.613 -11.567 1.450 1.00 0.00 C ATOM 1022 C LEU A 72 -3.304 -12.198 0.986 1.00 0.00 C ATOM 1023 O LEU A 72 -2.389 -11.519 0.522 1.00 0.00 O ATOM 1024 CB LEU A 72 -5.388 -11.029 0.245 1.00 0.00 C ATOM 1025 CG LEU A 72 -6.339 -12.015 -0.435 1.00 0.00 C ATOM 1026 CD1 LEU A 72 -5.555 -13.102 -1.155 1.00 0.00 C ATOM 1027 CD2 LEU A 72 -7.292 -12.626 0.582 1.00 0.00 C ATOM 0 H LEU A 72 -3.570 -9.899 2.177 1.00 0.00 H new ATOM 0 HA LEU A 72 -5.209 -12.334 1.945 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -5.965 -10.162 0.567 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -4.670 -10.677 -0.496 1.00 0.00 H new ATOM 0 HG LEU A 72 -6.929 -11.471 -1.173 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -6.248 -13.794 -1.633 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -4.915 -12.648 -1.912 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -4.939 -13.643 -0.437 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -7.961 -13.325 0.080 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -6.720 -13.155 1.344 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -7.878 -11.836 1.051 1.00 0.00 H new ATOM 1039 N PRO A 73 -3.213 -13.531 1.111 1.00 0.00 N ATOM 1040 CA PRO A 73 -2.022 -14.284 0.708 1.00 0.00 C ATOM 1041 C PRO A 73 -1.841 -14.315 -0.806 1.00 0.00 C ATOM 1042 O PRO A 73 -2.744 -14.715 -1.541 1.00 0.00 O ATOM 1043 CB PRO A 73 -2.294 -15.692 1.243 1.00 0.00 C ATOM 1044 CG PRO A 73 -3.779 -15.787 1.320 1.00 0.00 C ATOM 1045 CD PRO A 73 -4.266 -14.405 1.655 1.00 0.00 C ATOM 0 HA PRO A 73 -1.107 -13.836 1.095 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -1.882 -16.454 0.581 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -1.837 -15.839 2.221 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -4.198 -16.129 0.374 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -4.085 -16.504 2.082 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -5.234 -14.199 1.199 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -4.384 -14.270 2.730 1.00 0.00 H new ATOM 1053 N VAL A 74 -0.668 -13.892 -1.266 1.00 0.00 N ATOM 1054 CA VAL A 74 -0.368 -13.873 -2.693 1.00 0.00 C ATOM 1055 C VAL A 74 0.759 -14.842 -3.030 1.00 0.00 C ATOM 1056 O VAL A 74 1.397 -15.403 -2.139 1.00 0.00 O ATOM 1057 CB VAL A 74 0.025 -12.460 -3.165 1.00 0.00 C ATOM 1058 CG1 VAL A 74 -1.214 -11.611 -3.401 1.00 0.00 C ATOM 1059 CG2 VAL A 74 0.950 -11.799 -2.154 1.00 0.00 C ATOM 0 H VAL A 74 0.090 -13.558 -0.671 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.276 -14.182 -3.212 1.00 0.00 H new ATOM 0 HB VAL A 74 0.560 -12.548 -4.110 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.916 -10.617 -3.734 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.835 -12.078 -4.165 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.781 -11.528 -2.473 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.218 -10.802 -2.503 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.443 -11.723 -1.192 1.00 0.00 H new ATOM 0 HG23 VAL A 74 1.853 -12.398 -2.041 1.00 0.00 H new ATOM 1069 N ASP A 75 1.000 -15.034 -4.323 1.00 0.00 N ATOM 1070 CA ASP A 75 2.053 -15.934 -4.779 1.00 0.00 C ATOM 1071 C ASP A 75 3.261 -15.149 -5.280 1.00 0.00 C ATOM 1072 O ASP A 75 4.388 -15.645 -5.260 1.00 0.00 O ATOM 1073 CB ASP A 75 1.527 -16.847 -5.888 1.00 0.00 C ATOM 1074 CG ASP A 75 0.091 -17.274 -5.654 1.00 0.00 C ATOM 1075 OD1 ASP A 75 -0.269 -17.531 -4.487 1.00 0.00 O ATOM 1076 OD2 ASP A 75 -0.673 -17.349 -6.639 1.00 0.00 O ATOM 0 H ASP A 75 0.480 -14.578 -5.073 1.00 0.00 H new ATOM 0 HA ASP A 75 2.366 -16.545 -3.933 1.00 0.00 H new ATOM 0 HB2 ASP A 75 1.598 -16.330 -6.845 1.00 0.00 H new ATOM 0 HB3 ASP A 75 2.160 -17.732 -5.957 1.00 0.00 H new ATOM 1081 N ARG A 76 3.018 -13.922 -5.729 1.00 0.00 N ATOM 1082 CA ARG A 76 4.085 -13.069 -6.237 1.00 0.00 C ATOM 1083 C ARG A 76 4.077 -11.713 -5.538 1.00 0.00 C ATOM 1084 O ARG A 76 3.026 -11.156 -5.222 1.00 0.00 O ATOM 1085 CB ARG A 76 3.938 -12.877 -7.747 1.00 0.00 C ATOM 1086 CG ARG A 76 4.206 -14.139 -8.551 1.00 0.00 C ATOM 1087 CD ARG A 76 4.624 -13.813 -9.976 1.00 0.00 C ATOM 1088 NE ARG A 76 4.876 -15.019 -10.762 1.00 0.00 N ATOM 1089 CZ ARG A 76 3.913 -15.778 -11.272 1.00 0.00 C ATOM 1090 NH1 ARG A 76 2.640 -15.458 -11.081 1.00 0.00 N ATOM 1091 NH2 ARG A 76 4.222 -16.860 -11.976 1.00 0.00 N ATOM 0 H ARG A 76 2.091 -13.497 -5.751 1.00 0.00 H new ATOM 0 HA ARG A 76 5.037 -13.559 -6.031 1.00 0.00 H new ATOM 0 HB2 ARG A 76 2.929 -12.526 -7.963 1.00 0.00 H new ATOM 0 HB3 ARG A 76 4.624 -12.096 -8.074 1.00 0.00 H new ATOM 0 HG2 ARG A 76 4.989 -14.722 -8.065 1.00 0.00 H new ATOM 0 HG3 ARG A 76 3.310 -14.759 -8.566 1.00 0.00 H new ATOM 0 HD2 ARG A 76 3.843 -13.223 -10.457 1.00 0.00 H new ATOM 0 HD3 ARG A 76 5.523 -13.197 -9.958 1.00 0.00 H new ATOM 0 HE ARG A 76 5.844 -15.293 -10.928 1.00 0.00 H new ATOM 0 HH11 ARG A 76 2.399 -14.627 -10.541 1.00 0.00 H new ATOM 0 HH12 ARG A 76 1.903 -16.043 -11.474 1.00 0.00 H new ATOM 0 HH21 ARG A 76 5.200 -17.109 -12.126 1.00 0.00 H new ATOM 0 HH22 ARG A 76 3.482 -17.442 -12.367 1.00 0.00 H new ATOM 1105 N PRO A 77 5.277 -11.168 -5.289 1.00 0.00 N ATOM 1106 CA PRO A 77 5.435 -9.871 -4.624 1.00 0.00 C ATOM 1107 C PRO A 77 4.981 -8.710 -5.503 1.00 0.00 C ATOM 1108 O PRO A 77 4.667 -7.628 -5.006 1.00 0.00 O ATOM 1109 CB PRO A 77 6.941 -9.787 -4.363 1.00 0.00 C ATOM 1110 CG PRO A 77 7.555 -10.662 -5.401 1.00 0.00 C ATOM 1111 CD PRO A 77 6.572 -11.775 -5.637 1.00 0.00 C ATOM 0 HA PRO A 77 4.828 -9.799 -3.722 1.00 0.00 H new ATOM 0 HB2 PRO A 77 7.301 -8.761 -4.447 1.00 0.00 H new ATOM 0 HB3 PRO A 77 7.188 -10.131 -3.359 1.00 0.00 H new ATOM 0 HG2 PRO A 77 7.743 -10.106 -6.319 1.00 0.00 H new ATOM 0 HG3 PRO A 77 8.515 -11.054 -5.064 1.00 0.00 H new ATOM 0 HD2 PRO A 77 6.591 -12.115 -6.673 1.00 0.00 H new ATOM 0 HD3 PRO A 77 6.790 -12.642 -5.013 1.00 0.00 H new ATOM 1119 N VAL A 78 4.948 -8.942 -6.811 1.00 0.00 N ATOM 1120 CA VAL A 78 4.531 -7.916 -7.759 1.00 0.00 C ATOM 1121 C VAL A 78 3.622 -8.499 -8.835 1.00 0.00 C ATOM 1122 O VAL A 78 3.452 -9.714 -8.928 1.00 0.00 O ATOM 1123 CB VAL A 78 5.744 -7.249 -8.434 1.00 0.00 C ATOM 1124 CG1 VAL A 78 6.714 -6.720 -7.388 1.00 0.00 C ATOM 1125 CG2 VAL A 78 6.438 -8.227 -9.370 1.00 0.00 C ATOM 0 H VAL A 78 5.205 -9.832 -7.239 1.00 0.00 H new ATOM 0 HA VAL A 78 3.982 -7.165 -7.191 1.00 0.00 H new ATOM 0 HB VAL A 78 5.389 -6.405 -9.026 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.564 -6.252 -7.884 1.00 0.00 H new ATOM 0 HG12 VAL A 78 6.209 -5.984 -6.763 1.00 0.00 H new ATOM 0 HG13 VAL A 78 7.065 -7.544 -6.767 1.00 0.00 H new ATOM 0 HG21 VAL A 78 7.293 -7.739 -9.838 1.00 0.00 H new ATOM 0 HG22 VAL A 78 6.781 -9.093 -8.803 1.00 0.00 H new ATOM 0 HG23 VAL A 78 5.739 -8.552 -10.141 1.00 0.00 H new ATOM 1135 N GLY A 79 3.039 -7.623 -9.648 1.00 0.00 N ATOM 1136 CA GLY A 79 2.154 -8.070 -10.708 1.00 0.00 C ATOM 1137 C GLY A 79 0.725 -7.604 -10.506 1.00 0.00 C ATOM 1138 O GLY A 79 0.093 -7.937 -9.504 1.00 0.00 O ATOM 0 H GLY A 79 3.164 -6.612 -9.591 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.522 -7.699 -11.665 1.00 0.00 H new ATOM 0 HA3 GLY A 79 2.174 -9.159 -10.759 1.00 0.00 H new ATOM 1142 N MET A 80 0.217 -6.829 -11.458 1.00 0.00 N ATOM 1143 CA MET A 80 -1.146 -6.316 -11.379 1.00 0.00 C ATOM 1144 C MET A 80 -2.138 -7.446 -11.121 1.00 0.00 C ATOM 1145 O MET A 80 -2.916 -7.395 -10.168 1.00 0.00 O ATOM 1146 CB MET A 80 -1.514 -5.584 -12.671 1.00 0.00 C ATOM 1147 CG MET A 80 -1.161 -4.106 -12.654 1.00 0.00 C ATOM 1148 SD MET A 80 -2.432 -3.097 -11.867 1.00 0.00 S ATOM 1149 CE MET A 80 -1.785 -2.973 -10.202 1.00 0.00 C ATOM 0 H MET A 80 0.728 -6.542 -12.293 1.00 0.00 H new ATOM 0 HA MET A 80 -1.196 -5.615 -10.546 1.00 0.00 H new ATOM 0 HB2 MET A 80 -1.003 -6.061 -13.507 1.00 0.00 H new ATOM 0 HB3 MET A 80 -2.584 -5.691 -12.848 1.00 0.00 H new ATOM 0 HG2 MET A 80 -0.216 -3.968 -12.128 1.00 0.00 H new ATOM 0 HG3 MET A 80 -1.010 -3.761 -13.677 1.00 0.00 H new ATOM 0 HE1 MET A 80 -2.278 -2.152 -9.680 1.00 0.00 H new ATOM 0 HE2 MET A 80 -1.971 -3.905 -9.669 1.00 0.00 H new ATOM 0 HE3 MET A 80 -0.712 -2.786 -10.242 1.00 0.00 H new ATOM 1159 N ASP A 81 -2.105 -8.463 -11.975 1.00 0.00 N ATOM 1160 CA ASP A 81 -3.001 -9.605 -11.838 1.00 0.00 C ATOM 1161 C ASP A 81 -3.063 -10.077 -10.389 1.00 0.00 C ATOM 1162 O ASP A 81 -4.109 -10.519 -9.912 1.00 0.00 O ATOM 1163 CB ASP A 81 -2.541 -10.752 -12.741 1.00 0.00 C ATOM 1164 CG ASP A 81 -3.649 -11.749 -13.019 1.00 0.00 C ATOM 1165 OD1 ASP A 81 -4.750 -11.317 -13.420 1.00 0.00 O ATOM 1166 OD2 ASP A 81 -3.414 -12.962 -12.837 1.00 0.00 O ATOM 0 H ASP A 81 -1.468 -8.520 -12.769 1.00 0.00 H new ATOM 0 HA ASP A 81 -3.999 -9.290 -12.142 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -2.177 -10.345 -13.684 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -1.702 -11.266 -12.272 1.00 0.00 H new ATOM 1171 N THR A 82 -1.936 -9.980 -9.691 1.00 0.00 N ATOM 1172 CA THR A 82 -1.861 -10.398 -8.297 1.00 0.00 C ATOM 1173 C THR A 82 -2.501 -9.364 -7.378 1.00 0.00 C ATOM 1174 O THR A 82 -3.079 -9.708 -6.346 1.00 0.00 O ATOM 1175 CB THR A 82 -0.403 -10.628 -7.856 1.00 0.00 C ATOM 1176 OG1 THR A 82 0.241 -11.541 -8.751 1.00 0.00 O ATOM 1177 CG2 THR A 82 -0.346 -11.175 -6.438 1.00 0.00 C ATOM 0 H THR A 82 -1.062 -9.615 -10.069 1.00 0.00 H new ATOM 0 HA THR A 82 -2.408 -11.338 -8.219 1.00 0.00 H new ATOM 0 HB THR A 82 0.116 -9.670 -7.880 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.198 -11.336 -8.795 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.694 -11.329 -6.149 1.00 0.00 H new ATOM 0 HG22 THR A 82 -0.811 -10.464 -5.755 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.880 -12.124 -6.392 1.00 0.00 H new ATOM 1185 N LEU A 83 -2.395 -8.096 -7.758 1.00 0.00 N ATOM 1186 CA LEU A 83 -2.965 -7.010 -6.968 1.00 0.00 C ATOM 1187 C LEU A 83 -4.489 -7.060 -6.993 1.00 0.00 C ATOM 1188 O LEU A 83 -5.131 -7.225 -5.957 1.00 0.00 O ATOM 1189 CB LEU A 83 -2.478 -5.659 -7.495 1.00 0.00 C ATOM 1190 CG LEU A 83 -2.412 -4.523 -6.473 1.00 0.00 C ATOM 1191 CD1 LEU A 83 -1.070 -4.526 -5.758 1.00 0.00 C ATOM 1192 CD2 LEU A 83 -2.655 -3.182 -7.150 1.00 0.00 C ATOM 0 H LEU A 83 -1.920 -7.794 -8.608 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.633 -7.131 -5.937 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -1.484 -5.795 -7.922 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -3.135 -5.351 -8.309 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.196 -4.680 -5.732 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -1.041 -3.711 -5.035 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -0.936 -5.476 -5.240 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -0.270 -4.393 -6.486 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -2.604 -2.385 -6.408 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -1.894 -3.016 -7.913 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -3.641 -3.183 -7.615 1.00 0.00 H new ATOM 1204 N ASN A 84 -5.061 -6.917 -8.184 1.00 0.00 N ATOM 1205 CA ASN A 84 -6.510 -6.947 -8.344 1.00 0.00 C ATOM 1206 C ASN A 84 -7.100 -8.209 -7.721 1.00 0.00 C ATOM 1207 O ASN A 84 -8.296 -8.272 -7.435 1.00 0.00 O ATOM 1208 CB ASN A 84 -6.882 -6.876 -9.826 1.00 0.00 C ATOM 1209 CG ASN A 84 -6.824 -5.461 -10.370 1.00 0.00 C ATOM 1210 OD1 ASN A 84 -7.855 -4.838 -10.620 1.00 0.00 O ATOM 1211 ND2 ASN A 84 -5.613 -4.948 -10.554 1.00 0.00 N ATOM 0 H ASN A 84 -4.543 -6.779 -9.052 1.00 0.00 H new ATOM 0 HA ASN A 84 -6.925 -6.080 -7.830 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -6.205 -7.510 -10.398 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -7.887 -7.275 -9.965 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -5.510 -4.000 -10.917 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -4.786 -5.502 -10.333 1.00 0.00 H new ATOM 1218 N SER A 85 -6.252 -9.211 -7.511 1.00 0.00 N ATOM 1219 CA SER A 85 -6.690 -10.472 -6.925 1.00 0.00 C ATOM 1220 C SER A 85 -7.058 -10.289 -5.455 1.00 0.00 C ATOM 1221 O SER A 85 -8.093 -10.774 -4.999 1.00 0.00 O ATOM 1222 CB SER A 85 -5.592 -11.529 -7.059 1.00 0.00 C ATOM 1223 OG SER A 85 -6.071 -12.811 -6.689 1.00 0.00 O ATOM 0 H SER A 85 -5.258 -9.174 -7.738 1.00 0.00 H new ATOM 0 HA SER A 85 -7.576 -10.807 -7.465 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.231 -11.555 -8.087 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.744 -11.259 -6.430 1.00 0.00 H new ATOM 0 HG SER A 85 -5.351 -13.469 -6.784 1.00 0.00 H new ATOM 1229 N ALA A 86 -6.203 -9.586 -4.721 1.00 0.00 N ATOM 1230 CA ALA A 86 -6.438 -9.336 -3.304 1.00 0.00 C ATOM 1231 C ALA A 86 -7.655 -8.440 -3.099 1.00 0.00 C ATOM 1232 O ALA A 86 -8.556 -8.769 -2.327 1.00 0.00 O ATOM 1233 CB ALA A 86 -5.207 -8.710 -2.667 1.00 0.00 C ATOM 0 H ALA A 86 -5.341 -9.179 -5.084 1.00 0.00 H new ATOM 0 HA ALA A 86 -6.637 -10.292 -2.820 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -5.397 -8.529 -1.609 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -4.359 -9.386 -2.773 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -4.982 -7.765 -3.162 1.00 0.00 H new ATOM 1239 N ILE A 87 -7.675 -7.308 -3.795 1.00 0.00 N ATOM 1240 CA ILE A 87 -8.782 -6.366 -3.689 1.00 0.00 C ATOM 1241 C ILE A 87 -10.120 -7.063 -3.908 1.00 0.00 C ATOM 1242 O ILE A 87 -11.037 -6.935 -3.097 1.00 0.00 O ATOM 1243 CB ILE A 87 -8.642 -5.217 -4.704 1.00 0.00 C ATOM 1244 CG1 ILE A 87 -7.310 -4.490 -4.505 1.00 0.00 C ATOM 1245 CG2 ILE A 87 -9.806 -4.247 -4.570 1.00 0.00 C ATOM 1246 CD1 ILE A 87 -6.908 -3.631 -5.683 1.00 0.00 C ATOM 0 H ILE A 87 -6.937 -7.021 -4.438 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.751 -5.954 -2.680 1.00 0.00 H new ATOM 0 HB ILE A 87 -8.658 -5.637 -5.710 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.377 -3.864 -3.615 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.528 -5.226 -4.319 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -9.693 -3.440 -5.294 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -10.742 -4.774 -4.757 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -9.819 -3.831 -3.563 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -5.955 -3.146 -5.471 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -6.809 -4.255 -6.571 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.670 -2.872 -5.857 1.00 0.00 H new ATOM 1258 N GLU A 88 -10.223 -7.802 -5.008 1.00 0.00 N ATOM 1259 CA GLU A 88 -11.450 -8.520 -5.333 1.00 0.00 C ATOM 1260 C GLU A 88 -11.733 -9.607 -4.300 1.00 0.00 C ATOM 1261 O GLU A 88 -12.887 -9.877 -3.968 1.00 0.00 O ATOM 1262 CB GLU A 88 -11.350 -9.141 -6.728 1.00 0.00 C ATOM 1263 CG GLU A 88 -11.300 -8.115 -7.848 1.00 0.00 C ATOM 1264 CD GLU A 88 -11.434 -8.744 -9.221 1.00 0.00 C ATOM 1265 OE1 GLU A 88 -10.571 -9.572 -9.582 1.00 0.00 O ATOM 1266 OE2 GLU A 88 -12.402 -8.409 -9.935 1.00 0.00 O ATOM 0 H GLU A 88 -9.472 -7.919 -5.689 1.00 0.00 H new ATOM 0 HA GLU A 88 -12.273 -7.806 -5.319 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -10.456 -9.763 -6.776 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -12.205 -9.798 -6.886 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -12.100 -7.388 -7.706 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -10.359 -7.568 -7.793 1.00 0.00 H new ATOM 1273 N ASN A 89 -10.671 -10.228 -3.796 1.00 0.00 N ATOM 1274 CA ASN A 89 -10.805 -11.286 -2.802 1.00 0.00 C ATOM 1275 C ASN A 89 -11.497 -10.768 -1.545 1.00 0.00 C ATOM 1276 O ASN A 89 -12.509 -11.318 -1.108 1.00 0.00 O ATOM 1277 CB ASN A 89 -9.431 -11.855 -2.443 1.00 0.00 C ATOM 1278 CG ASN A 89 -9.035 -13.016 -3.335 1.00 0.00 C ATOM 1279 OD1 ASN A 89 -9.809 -13.952 -3.535 1.00 0.00 O ATOM 1280 ND2 ASN A 89 -7.823 -12.960 -3.876 1.00 0.00 N ATOM 0 H ASN A 89 -9.709 -10.017 -4.060 1.00 0.00 H new ATOM 0 HA ASN A 89 -11.418 -12.078 -3.232 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -8.682 -11.067 -2.523 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -9.437 -12.184 -1.404 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -7.501 -13.712 -4.485 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -7.214 -12.165 -3.683 1.00 0.00 H new ATOM 1287 N LEU A 90 -10.945 -9.706 -0.968 1.00 0.00 N ATOM 1288 CA LEU A 90 -11.509 -9.111 0.239 1.00 0.00 C ATOM 1289 C LEU A 90 -12.843 -8.434 -0.060 1.00 0.00 C ATOM 1290 O LEU A 90 -13.785 -8.523 0.727 1.00 0.00 O ATOM 1291 CB LEU A 90 -10.532 -8.098 0.836 1.00 0.00 C ATOM 1292 CG LEU A 90 -9.462 -8.666 1.769 1.00 0.00 C ATOM 1293 CD1 LEU A 90 -10.086 -9.614 2.782 1.00 0.00 C ATOM 1294 CD2 LEU A 90 -8.379 -9.375 0.970 1.00 0.00 C ATOM 0 H LEU A 90 -10.108 -9.239 -1.316 1.00 0.00 H new ATOM 0 HA LEU A 90 -11.682 -9.909 0.961 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -10.033 -7.579 0.018 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -11.105 -7.351 1.385 1.00 0.00 H new ATOM 0 HG LEU A 90 -9.003 -7.839 2.310 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -9.310 -10.009 3.437 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -10.824 -9.076 3.377 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -10.572 -10.437 2.259 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.626 -9.773 1.651 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -8.822 -10.193 0.402 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -7.911 -8.668 0.284 1.00 0.00 H new ATOM 1306 N MET A 91 -12.915 -7.759 -1.202 1.00 0.00 N ATOM 1307 CA MET A 91 -14.135 -7.069 -1.606 1.00 0.00 C ATOM 1308 C MET A 91 -15.333 -8.012 -1.561 1.00 0.00 C ATOM 1309 O MET A 91 -16.400 -7.655 -1.060 1.00 0.00 O ATOM 1310 CB MET A 91 -13.978 -6.493 -3.014 1.00 0.00 C ATOM 1311 CG MET A 91 -13.397 -5.088 -3.035 1.00 0.00 C ATOM 1312 SD MET A 91 -13.519 -4.309 -4.656 1.00 0.00 S ATOM 1313 CE MET A 91 -15.146 -3.567 -4.555 1.00 0.00 C ATOM 0 H MET A 91 -12.144 -7.675 -1.864 1.00 0.00 H new ATOM 0 HA MET A 91 -14.310 -6.253 -0.905 1.00 0.00 H new ATOM 0 HB2 MET A 91 -13.335 -7.152 -3.598 1.00 0.00 H new ATOM 0 HB3 MET A 91 -14.952 -6.482 -3.504 1.00 0.00 H new ATOM 0 HG2 MET A 91 -13.917 -4.473 -2.301 1.00 0.00 H new ATOM 0 HG3 MET A 91 -12.350 -5.127 -2.733 1.00 0.00 H new ATOM 0 HE1 MET A 91 -15.367 -3.046 -5.487 1.00 0.00 H new ATOM 0 HE2 MET A 91 -15.891 -4.345 -4.389 1.00 0.00 H new ATOM 0 HE3 MET A 91 -15.172 -2.857 -3.728 1.00 0.00 H new ATOM 1323 N THR A 92 -15.150 -9.220 -2.087 1.00 0.00 N ATOM 1324 CA THR A 92 -16.216 -10.213 -2.108 1.00 0.00 C ATOM 1325 C THR A 92 -16.340 -10.915 -0.761 1.00 0.00 C ATOM 1326 O THR A 92 -17.366 -11.526 -0.460 1.00 0.00 O ATOM 1327 CB THR A 92 -15.979 -11.269 -3.204 1.00 0.00 C ATOM 1328 OG1 THR A 92 -17.217 -11.897 -3.556 1.00 0.00 O ATOM 1329 CG2 THR A 92 -14.985 -12.321 -2.736 1.00 0.00 C ATOM 0 H THR A 92 -14.273 -9.533 -2.504 1.00 0.00 H new ATOM 0 HA THR A 92 -17.141 -9.678 -2.323 1.00 0.00 H new ATOM 0 HB THR A 92 -15.566 -10.766 -4.079 1.00 0.00 H new ATOM 0 HG1 THR A 92 -17.058 -12.566 -4.254 1.00 0.00 H new ATOM 0 HG21 THR A 92 -14.834 -13.056 -3.527 1.00 0.00 H new ATOM 0 HG22 THR A 92 -14.035 -11.843 -2.498 1.00 0.00 H new ATOM 0 HG23 THR A 92 -15.373 -12.819 -1.848 1.00 0.00 H new ATOM 1337 N SER A 93 -15.289 -10.824 0.048 1.00 0.00 N ATOM 1338 CA SER A 93 -15.279 -11.453 1.363 1.00 0.00 C ATOM 1339 C SER A 93 -16.125 -10.657 2.353 1.00 0.00 C ATOM 1340 O SER A 93 -16.941 -11.220 3.082 1.00 0.00 O ATOM 1341 CB SER A 93 -13.846 -11.575 1.883 1.00 0.00 C ATOM 1342 OG SER A 93 -13.826 -12.058 3.215 1.00 0.00 O ATOM 0 H SER A 93 -14.433 -10.320 -0.185 1.00 0.00 H new ATOM 0 HA SER A 93 -15.708 -12.450 1.264 1.00 0.00 H new ATOM 0 HB2 SER A 93 -13.279 -12.248 1.240 1.00 0.00 H new ATOM 0 HB3 SER A 93 -13.356 -10.603 1.838 1.00 0.00 H new ATOM 0 HG SER A 93 -12.899 -12.128 3.524 1.00 0.00 H new ATOM 1348 N SER A 94 -15.923 -9.344 2.371 1.00 0.00 N ATOM 1349 CA SER A 94 -16.664 -8.469 3.273 1.00 0.00 C ATOM 1350 C SER A 94 -17.392 -7.377 2.495 1.00 0.00 C ATOM 1351 O SER A 94 -17.306 -7.311 1.269 1.00 0.00 O ATOM 1352 CB SER A 94 -15.718 -7.838 4.296 1.00 0.00 C ATOM 1353 OG SER A 94 -15.555 -8.678 5.426 1.00 0.00 O ATOM 0 H SER A 94 -15.253 -8.862 1.772 1.00 0.00 H new ATOM 0 HA SER A 94 -17.405 -9.072 3.797 1.00 0.00 H new ATOM 0 HB2 SER A 94 -14.748 -7.653 3.834 1.00 0.00 H new ATOM 0 HB3 SER A 94 -16.111 -6.871 4.611 1.00 0.00 H new ATOM 0 HG SER A 94 -14.945 -8.253 6.064 1.00 0.00 H new ATOM 1359 N SER A 95 -18.108 -6.521 3.218 1.00 0.00 N ATOM 1360 CA SER A 95 -18.854 -5.434 2.596 1.00 0.00 C ATOM 1361 C SER A 95 -18.113 -4.109 2.750 1.00 0.00 C ATOM 1362 O SER A 95 -17.195 -3.988 3.562 1.00 0.00 O ATOM 1363 CB SER A 95 -20.249 -5.325 3.215 1.00 0.00 C ATOM 1364 OG SER A 95 -20.225 -5.672 4.589 1.00 0.00 O ATOM 0 H SER A 95 -18.187 -6.560 4.234 1.00 0.00 H new ATOM 0 HA SER A 95 -18.952 -5.655 1.533 1.00 0.00 H new ATOM 0 HB2 SER A 95 -20.623 -4.308 3.100 1.00 0.00 H new ATOM 0 HB3 SER A 95 -20.939 -5.980 2.683 1.00 0.00 H new ATOM 0 HG SER A 95 -21.128 -5.593 4.962 1.00 0.00 H new ATOM 1370 N LYS A 96 -18.517 -3.118 1.963 1.00 0.00 N ATOM 1371 CA LYS A 96 -17.895 -1.800 2.010 1.00 0.00 C ATOM 1372 C LYS A 96 -18.064 -1.167 3.388 1.00 0.00 C ATOM 1373 O LYS A 96 -17.202 -0.418 3.846 1.00 0.00 O ATOM 1374 CB LYS A 96 -18.500 -0.888 0.941 1.00 0.00 C ATOM 1375 CG LYS A 96 -17.900 0.507 0.920 1.00 0.00 C ATOM 1376 CD LYS A 96 -18.223 1.233 -0.375 1.00 0.00 C ATOM 1377 CE LYS A 96 -17.399 2.504 -0.521 1.00 0.00 C ATOM 1378 NZ LYS A 96 -18.045 3.664 0.152 1.00 0.00 N ATOM 0 H LYS A 96 -19.273 -3.203 1.284 1.00 0.00 H new ATOM 0 HA LYS A 96 -16.830 -1.922 1.813 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -18.362 -1.348 -0.037 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -19.574 -0.810 1.108 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -18.281 1.081 1.765 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -16.819 0.441 1.041 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -18.030 0.574 -1.221 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -19.284 1.481 -0.400 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -16.407 2.345 -0.098 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -17.262 2.728 -1.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -17.453 4.510 0.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -18.981 3.833 -0.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -18.153 3.461 1.166 1.00 0.00 H new ATOM 1392 N GLU A 97 -19.179 -1.475 4.043 1.00 0.00 N ATOM 1393 CA GLU A 97 -19.459 -0.936 5.368 1.00 0.00 C ATOM 1394 C GLU A 97 -18.744 -1.745 6.447 1.00 0.00 C ATOM 1395 O GLU A 97 -18.230 -1.187 7.417 1.00 0.00 O ATOM 1396 CB GLU A 97 -20.966 -0.933 5.634 1.00 0.00 C ATOM 1397 CG GLU A 97 -21.592 -2.317 5.608 1.00 0.00 C ATOM 1398 CD GLU A 97 -23.083 -2.288 5.879 1.00 0.00 C ATOM 1399 OE1 GLU A 97 -23.488 -1.696 6.903 1.00 0.00 O ATOM 1400 OE2 GLU A 97 -23.846 -2.856 5.070 1.00 0.00 O ATOM 0 H GLU A 97 -19.902 -2.094 3.678 1.00 0.00 H new ATOM 0 HA GLU A 97 -19.089 0.089 5.400 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -21.154 -0.477 6.606 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -21.457 -0.308 4.888 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -21.412 -2.775 4.635 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -21.104 -2.947 6.352 1.00 0.00 H new ATOM 1407 N ASP A 98 -18.715 -3.061 6.270 1.00 0.00 N ATOM 1408 CA ASP A 98 -18.062 -3.947 7.227 1.00 0.00 C ATOM 1409 C ASP A 98 -16.603 -3.549 7.428 1.00 0.00 C ATOM 1410 O ASP A 98 -15.973 -3.941 8.411 1.00 0.00 O ATOM 1411 CB ASP A 98 -18.147 -5.398 6.750 1.00 0.00 C ATOM 1412 CG ASP A 98 -19.490 -6.031 7.058 1.00 0.00 C ATOM 1413 OD1 ASP A 98 -20.432 -5.286 7.400 1.00 0.00 O ATOM 1414 OD2 ASP A 98 -19.598 -7.270 6.956 1.00 0.00 O ATOM 0 H ASP A 98 -19.136 -3.538 5.473 1.00 0.00 H new ATOM 0 HA ASP A 98 -18.579 -3.855 8.182 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -17.969 -5.435 5.675 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -17.357 -5.980 7.224 1.00 0.00 H new ATOM 1419 N TRP A 99 -16.073 -2.770 6.492 1.00 0.00 N ATOM 1420 CA TRP A 99 -14.688 -2.321 6.567 1.00 0.00 C ATOM 1421 C TRP A 99 -14.525 -1.232 7.622 1.00 0.00 C ATOM 1422 O TRP A 99 -15.092 -0.144 7.517 1.00 0.00 O ATOM 1423 CB TRP A 99 -14.224 -1.802 5.205 1.00 0.00 C ATOM 1424 CG TRP A 99 -14.459 -2.774 4.088 1.00 0.00 C ATOM 1425 CD1 TRP A 99 -14.591 -4.129 4.195 1.00 0.00 C ATOM 1426 CD2 TRP A 99 -14.587 -2.464 2.696 1.00 0.00 C ATOM 1427 NE1 TRP A 99 -14.794 -4.680 2.953 1.00 0.00 N ATOM 1428 CE2 TRP A 99 -14.796 -3.681 2.017 1.00 0.00 C ATOM 1429 CE3 TRP A 99 -14.547 -1.279 1.958 1.00 0.00 C ATOM 1430 CZ2 TRP A 99 -14.964 -3.742 0.636 1.00 0.00 C ATOM 1431 CZ3 TRP A 99 -14.713 -1.342 0.587 1.00 0.00 C ATOM 1432 CH2 TRP A 99 -14.920 -2.566 -0.062 1.00 0.00 C ATOM 0 H TRP A 99 -16.581 -2.436 5.673 1.00 0.00 H new ATOM 0 HA TRP A 99 -14.071 -3.173 6.853 1.00 0.00 H new ATOM 0 HB2 TRP A 99 -14.745 -0.871 4.982 1.00 0.00 H new ATOM 0 HB3 TRP A 99 -13.161 -1.568 5.256 1.00 0.00 H new ATOM 0 HD1 TRP A 99 -14.543 -4.685 5.119 1.00 0.00 H new ATOM 0 HE1 TRP A 99 -14.922 -5.673 2.759 1.00 0.00 H new ATOM 0 HE3 TRP A 99 -14.389 -0.330 2.450 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 -15.123 -4.685 0.133 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 -14.683 -0.432 0.006 1.00 0.00 H new ATOM 0 HH2 TRP A 99 -15.047 -2.582 -1.134 1.00 0.00 H new ATOM 1443 N PRO A 100 -13.733 -1.528 8.663 1.00 0.00 N ATOM 1444 CA PRO A 100 -13.477 -0.585 9.756 1.00 0.00 C ATOM 1445 C PRO A 100 -12.620 0.596 9.315 1.00 0.00 C ATOM 1446 O PRO A 100 -11.713 0.446 8.497 1.00 0.00 O ATOM 1447 CB PRO A 100 -12.728 -1.433 10.787 1.00 0.00 C ATOM 1448 CG PRO A 100 -12.087 -2.518 9.992 1.00 0.00 C ATOM 1449 CD PRO A 100 -13.025 -2.805 8.852 1.00 0.00 C ATOM 0 HA PRO A 100 -14.398 -0.141 10.135 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -11.984 -0.841 11.321 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -13.409 -1.840 11.535 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -11.109 -2.207 9.624 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -11.930 -3.408 10.602 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -12.485 -3.102 7.953 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -13.714 -3.615 9.093 1.00 0.00 H new ATOM 1457 N SER A 101 -12.914 1.772 9.862 1.00 0.00 N ATOM 1458 CA SER A 101 -12.173 2.980 9.521 1.00 0.00 C ATOM 1459 C SER A 101 -10.816 3.000 10.219 1.00 0.00 C ATOM 1460 O SER A 101 -10.707 2.664 11.398 1.00 0.00 O ATOM 1461 CB SER A 101 -12.976 4.223 9.909 1.00 0.00 C ATOM 1462 OG SER A 101 -14.310 4.135 9.439 1.00 0.00 O ATOM 0 H SER A 101 -13.660 1.913 10.543 1.00 0.00 H new ATOM 0 HA SER A 101 -12.009 2.984 8.443 1.00 0.00 H new ATOM 0 HB2 SER A 101 -12.976 4.336 10.993 1.00 0.00 H new ATOM 0 HB3 SER A 101 -12.499 5.112 9.495 1.00 0.00 H new ATOM 0 HG SER A 101 -14.803 4.940 9.701 1.00 0.00 H new ATOM 1468 N VAL A 102 -9.784 3.396 9.481 1.00 0.00 N ATOM 1469 CA VAL A 102 -8.434 3.461 10.027 1.00 0.00 C ATOM 1470 C VAL A 102 -7.674 4.661 9.473 1.00 0.00 C ATOM 1471 O VAL A 102 -7.919 5.099 8.350 1.00 0.00 O ATOM 1472 CB VAL A 102 -7.641 2.177 9.718 1.00 0.00 C ATOM 1473 CG1 VAL A 102 -8.348 0.961 10.295 1.00 0.00 C ATOM 1474 CG2 VAL A 102 -7.438 2.025 8.218 1.00 0.00 C ATOM 0 H VAL A 102 -9.857 3.677 8.503 1.00 0.00 H new ATOM 0 HA VAL A 102 -8.534 3.566 11.107 1.00 0.00 H new ATOM 0 HB VAL A 102 -6.661 2.254 10.188 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -7.773 0.064 10.067 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -8.436 1.070 11.376 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -9.342 0.876 9.857 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -6.876 1.113 8.017 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -8.408 1.970 7.723 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -6.885 2.883 7.837 1.00 0.00 H new ATOM 1484 N ASN A 103 -6.749 5.188 10.269 1.00 0.00 N ATOM 1485 CA ASN A 103 -5.952 6.338 9.857 1.00 0.00 C ATOM 1486 C ASN A 103 -4.600 5.894 9.307 1.00 0.00 C ATOM 1487 O ASN A 103 -3.802 5.280 10.015 1.00 0.00 O ATOM 1488 CB ASN A 103 -5.747 7.291 11.037 1.00 0.00 C ATOM 1489 CG ASN A 103 -6.888 8.279 11.186 1.00 0.00 C ATOM 1490 OD1 ASN A 103 -7.094 9.140 10.330 1.00 0.00 O ATOM 1491 ND2 ASN A 103 -7.635 8.160 12.277 1.00 0.00 N ATOM 0 H ASN A 103 -6.533 4.837 11.202 1.00 0.00 H new ATOM 0 HA ASN A 103 -6.492 6.859 9.067 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -5.649 6.712 11.955 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -4.813 7.836 10.902 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -8.416 8.797 12.432 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -7.428 7.431 12.960 1.00 0.00 H new ATOM 1498 N MET A 104 -4.350 6.210 8.041 1.00 0.00 N ATOM 1499 CA MET A 104 -3.093 5.846 7.397 1.00 0.00 C ATOM 1500 C MET A 104 -2.046 6.937 7.591 1.00 0.00 C ATOM 1501 O MET A 104 -2.320 8.118 7.382 1.00 0.00 O ATOM 1502 CB MET A 104 -3.315 5.596 5.904 1.00 0.00 C ATOM 1503 CG MET A 104 -2.065 5.133 5.173 1.00 0.00 C ATOM 1504 SD MET A 104 -2.347 4.874 3.411 1.00 0.00 S ATOM 1505 CE MET A 104 -3.402 3.428 3.445 1.00 0.00 C ATOM 0 H MET A 104 -5.000 6.717 7.441 1.00 0.00 H new ATOM 0 HA MET A 104 -2.727 4.930 7.862 1.00 0.00 H new ATOM 0 HB2 MET A 104 -4.096 4.846 5.782 1.00 0.00 H new ATOM 0 HB3 MET A 104 -3.678 6.513 5.440 1.00 0.00 H new ATOM 0 HG2 MET A 104 -1.276 5.873 5.306 1.00 0.00 H new ATOM 0 HG3 MET A 104 -1.710 4.205 5.621 1.00 0.00 H new ATOM 0 HE1 MET A 104 -2.885 2.589 2.979 1.00 0.00 H new ATOM 0 HE2 MET A 104 -3.642 3.177 4.478 1.00 0.00 H new ATOM 0 HE3 MET A 104 -4.322 3.636 2.899 1.00 0.00 H new ATOM 1515 N ASN A 105 -0.845 6.534 7.993 1.00 0.00 N ATOM 1516 CA ASN A 105 0.244 7.478 8.217 1.00 0.00 C ATOM 1517 C ASN A 105 1.314 7.340 7.138 1.00 0.00 C ATOM 1518 O ASN A 105 1.626 6.235 6.696 1.00 0.00 O ATOM 1519 CB ASN A 105 0.864 7.256 9.598 1.00 0.00 C ATOM 1520 CG ASN A 105 -0.069 7.662 10.723 1.00 0.00 C ATOM 1521 OD1 ASN A 105 -1.245 7.949 10.496 1.00 0.00 O ATOM 1522 ND2 ASN A 105 0.453 7.688 11.943 1.00 0.00 N ATOM 0 H ASN A 105 -0.601 5.560 8.170 1.00 0.00 H new ATOM 0 HA ASN A 105 -0.167 8.486 8.169 1.00 0.00 H new ATOM 0 HB2 ASN A 105 1.128 6.204 9.710 1.00 0.00 H new ATOM 0 HB3 ASN A 105 1.790 7.827 9.674 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -0.126 7.954 12.740 1.00 0.00 H new ATOM 0 HD22 ASN A 105 1.433 7.442 12.084 1.00 0.00 H new ATOM 1529 N VAL A 106 1.873 8.471 6.719 1.00 0.00 N ATOM 1530 CA VAL A 106 2.910 8.477 5.694 1.00 0.00 C ATOM 1531 C VAL A 106 4.129 9.271 6.150 1.00 0.00 C ATOM 1532 O VAL A 106 4.717 10.024 5.374 1.00 0.00 O ATOM 1533 CB VAL A 106 2.388 9.071 4.372 1.00 0.00 C ATOM 1534 CG1 VAL A 106 3.462 9.007 3.297 1.00 0.00 C ATOM 1535 CG2 VAL A 106 1.128 8.347 3.923 1.00 0.00 C ATOM 0 H VAL A 106 1.625 9.395 7.074 1.00 0.00 H new ATOM 0 HA VAL A 106 3.198 7.439 5.528 1.00 0.00 H new ATOM 0 HB VAL A 106 2.137 10.119 4.539 1.00 0.00 H new ATOM 0 HG11 VAL A 106 3.075 9.431 2.370 1.00 0.00 H new ATOM 0 HG12 VAL A 106 4.334 9.575 3.620 1.00 0.00 H new ATOM 0 HG13 VAL A 106 3.748 7.969 3.129 1.00 0.00 H new ATOM 0 HG21 VAL A 106 0.773 8.780 2.988 1.00 0.00 H new ATOM 0 HG22 VAL A 106 1.349 7.290 3.773 1.00 0.00 H new ATOM 0 HG23 VAL A 106 0.357 8.451 4.686 1.00 0.00 H new ATOM 1545 N ALA A 107 4.503 9.098 7.413 1.00 0.00 N ATOM 1546 CA ALA A 107 5.653 9.796 7.972 1.00 0.00 C ATOM 1547 C ALA A 107 6.942 9.020 7.721 1.00 0.00 C ATOM 1548 O ALA A 107 6.926 7.795 7.599 1.00 0.00 O ATOM 1549 CB ALA A 107 5.457 10.029 9.463 1.00 0.00 C ATOM 0 H ALA A 107 4.026 8.480 8.069 1.00 0.00 H new ATOM 0 HA ALA A 107 5.738 10.761 7.473 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.324 10.551 9.867 1.00 0.00 H new ATOM 0 HB2 ALA A 107 4.563 10.632 9.623 1.00 0.00 H new ATOM 0 HB3 ALA A 107 5.343 9.070 9.969 1.00 0.00 H new ATOM 1555 N ASP A 108 8.055 9.740 7.645 1.00 0.00 N ATOM 1556 CA ASP A 108 9.353 9.118 7.409 1.00 0.00 C ATOM 1557 C ASP A 108 9.275 8.117 6.261 1.00 0.00 C ATOM 1558 O ASP A 108 9.837 7.025 6.338 1.00 0.00 O ATOM 1559 CB ASP A 108 9.847 8.422 8.677 1.00 0.00 C ATOM 1560 CG ASP A 108 11.360 8.397 8.773 1.00 0.00 C ATOM 1561 OD1 ASP A 108 12.002 7.817 7.872 1.00 0.00 O ATOM 1562 OD2 ASP A 108 11.903 8.957 9.748 1.00 0.00 O ATOM 0 H ASP A 108 8.085 10.755 7.743 1.00 0.00 H new ATOM 0 HA ASP A 108 10.060 9.902 7.136 1.00 0.00 H new ATOM 0 HB2 ASP A 108 9.439 8.932 9.550 1.00 0.00 H new ATOM 0 HB3 ASP A 108 9.468 7.400 8.698 1.00 0.00 H new ATOM 1567 N ALA A 109 8.574 8.496 5.198 1.00 0.00 N ATOM 1568 CA ALA A 109 8.423 7.632 4.034 1.00 0.00 C ATOM 1569 C ALA A 109 7.992 6.228 4.445 1.00 0.00 C ATOM 1570 O ALA A 109 8.342 5.243 3.793 1.00 0.00 O ATOM 1571 CB ALA A 109 9.723 7.577 3.245 1.00 0.00 C ATOM 0 H ALA A 109 8.101 9.396 5.119 1.00 0.00 H new ATOM 0 HA ALA A 109 7.643 8.052 3.399 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.596 6.928 2.379 1.00 0.00 H new ATOM 0 HB2 ALA A 109 9.989 8.580 2.911 1.00 0.00 H new ATOM 0 HB3 ALA A 109 10.517 7.183 3.879 1.00 0.00 H new ATOM 1577 N THR A 110 7.231 6.142 5.531 1.00 0.00 N ATOM 1578 CA THR A 110 6.754 4.858 6.030 1.00 0.00 C ATOM 1579 C THR A 110 5.231 4.826 6.098 1.00 0.00 C ATOM 1580 O THR A 110 4.595 5.812 6.473 1.00 0.00 O ATOM 1581 CB THR A 110 7.325 4.551 7.427 1.00 0.00 C ATOM 1582 OG1 THR A 110 8.756 4.540 7.380 1.00 0.00 O ATOM 1583 CG2 THR A 110 6.819 3.210 7.936 1.00 0.00 C ATOM 0 H THR A 110 6.932 6.946 6.082 1.00 0.00 H new ATOM 0 HA THR A 110 7.100 4.098 5.329 1.00 0.00 H new ATOM 0 HB THR A 110 6.990 5.331 8.111 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.080 5.416 7.083 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.236 3.015 8.924 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.731 3.232 7.999 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.127 2.421 7.250 1.00 0.00 H new ATOM 1591 N VAL A 111 4.651 3.687 5.735 1.00 0.00 N ATOM 1592 CA VAL A 111 3.202 3.526 5.756 1.00 0.00 C ATOM 1593 C VAL A 111 2.755 2.736 6.981 1.00 0.00 C ATOM 1594 O VAL A 111 3.037 1.544 7.103 1.00 0.00 O ATOM 1595 CB VAL A 111 2.698 2.812 4.487 1.00 0.00 C ATOM 1596 CG1 VAL A 111 1.191 2.612 4.550 1.00 0.00 C ATOM 1597 CG2 VAL A 111 3.088 3.598 3.244 1.00 0.00 C ATOM 0 H VAL A 111 5.162 2.862 5.423 1.00 0.00 H new ATOM 0 HA VAL A 111 2.773 4.527 5.796 1.00 0.00 H new ATOM 0 HB VAL A 111 3.169 1.830 4.431 1.00 0.00 H new ATOM 0 HG11 VAL A 111 0.853 2.106 3.645 1.00 0.00 H new ATOM 0 HG12 VAL A 111 0.941 2.005 5.420 1.00 0.00 H new ATOM 0 HG13 VAL A 111 0.698 3.581 4.630 1.00 0.00 H new ATOM 0 HG21 VAL A 111 2.724 3.080 2.357 1.00 0.00 H new ATOM 0 HG22 VAL A 111 2.646 4.593 3.289 1.00 0.00 H new ATOM 0 HG23 VAL A 111 4.173 3.685 3.194 1.00 0.00 H new ATOM 1607 N THR A 112 2.055 3.410 7.889 1.00 0.00 N ATOM 1608 CA THR A 112 1.569 2.772 9.106 1.00 0.00 C ATOM 1609 C THR A 112 0.059 2.931 9.245 1.00 0.00 C ATOM 1610 O THR A 112 -0.448 4.045 9.379 1.00 0.00 O ATOM 1611 CB THR A 112 2.252 3.355 10.358 1.00 0.00 C ATOM 1612 OG1 THR A 112 3.675 3.282 10.218 1.00 0.00 O ATOM 1613 CG2 THR A 112 1.821 2.605 11.609 1.00 0.00 C ATOM 0 H THR A 112 1.812 4.397 7.804 1.00 0.00 H new ATOM 0 HA THR A 112 1.815 1.713 9.027 1.00 0.00 H new ATOM 0 HB THR A 112 1.950 4.398 10.457 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.102 3.656 11.017 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.316 3.035 12.480 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.741 2.687 11.729 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.097 1.554 11.517 1.00 0.00 H new ATOM 1621 N VAL A 113 -0.655 1.810 9.212 1.00 0.00 N ATOM 1622 CA VAL A 113 -2.108 1.826 9.336 1.00 0.00 C ATOM 1623 C VAL A 113 -2.534 1.924 10.796 1.00 0.00 C ATOM 1624 O VAL A 113 -2.570 0.922 11.512 1.00 0.00 O ATOM 1625 CB VAL A 113 -2.737 0.566 8.713 1.00 0.00 C ATOM 1626 CG1 VAL A 113 -4.242 0.553 8.938 1.00 0.00 C ATOM 1627 CG2 VAL A 113 -2.412 0.487 7.229 1.00 0.00 C ATOM 0 H VAL A 113 -0.251 0.880 9.101 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.462 2.705 8.798 1.00 0.00 H new ATOM 0 HB VAL A 113 -2.313 -0.311 9.202 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -4.669 -0.345 8.491 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -4.450 0.560 10.008 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -4.687 1.435 8.477 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -2.864 -0.409 6.805 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -2.807 1.367 6.723 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.331 0.446 7.095 1.00 0.00 H new ATOM 1637 N ILE A 114 -2.856 3.137 11.233 1.00 0.00 N ATOM 1638 CA ILE A 114 -3.281 3.365 12.608 1.00 0.00 C ATOM 1639 C ILE A 114 -4.785 3.168 12.758 1.00 0.00 C ATOM 1640 O ILE A 114 -5.555 3.467 11.846 1.00 0.00 O ATOM 1641 CB ILE A 114 -2.910 4.783 13.084 1.00 0.00 C ATOM 1642 CG1 ILE A 114 -1.465 5.110 12.704 1.00 0.00 C ATOM 1643 CG2 ILE A 114 -3.110 4.906 14.587 1.00 0.00 C ATOM 1644 CD1 ILE A 114 -0.440 4.451 13.601 1.00 0.00 C ATOM 0 H ILE A 114 -2.831 3.977 10.654 1.00 0.00 H new ATOM 0 HA ILE A 114 -2.758 2.635 13.225 1.00 0.00 H new ATOM 0 HB ILE A 114 -3.566 5.500 12.590 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -1.289 4.798 11.675 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -1.325 6.190 12.738 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -2.844 5.913 14.908 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -4.154 4.711 14.832 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -2.476 4.182 15.099 1.00 0.00 H new ATOM 0 HD11 ILE A 114 0.562 4.727 13.273 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -0.589 4.782 14.629 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -0.553 3.368 13.549 1.00 0.00 H new ATOM 1656 N SER A 115 -5.198 2.664 13.917 1.00 0.00 N ATOM 1657 CA SER A 115 -6.611 2.425 14.187 1.00 0.00 C ATOM 1658 C SER A 115 -7.316 3.720 14.578 1.00 0.00 C ATOM 1659 O SER A 115 -6.934 4.380 15.543 1.00 0.00 O ATOM 1660 CB SER A 115 -6.771 1.388 15.300 1.00 0.00 C ATOM 1661 OG SER A 115 -8.041 0.764 15.237 1.00 0.00 O ATOM 0 H SER A 115 -4.574 2.413 14.684 1.00 0.00 H new ATOM 0 HA SER A 115 -7.070 2.043 13.275 1.00 0.00 H new ATOM 0 HB2 SER A 115 -5.988 0.635 15.215 1.00 0.00 H new ATOM 0 HB3 SER A 115 -6.646 1.869 16.270 1.00 0.00 H new ATOM 0 HG SER A 115 -8.118 0.104 15.958 1.00 0.00 H new ATOM 1667 N GLU A 116 -8.348 4.077 13.819 1.00 0.00 N ATOM 1668 CA GLU A 116 -9.106 5.293 14.085 1.00 0.00 C ATOM 1669 C GLU A 116 -9.486 5.386 15.560 1.00 0.00 C ATOM 1670 O GLU A 116 -9.772 6.468 16.073 1.00 0.00 O ATOM 1671 CB GLU A 116 -10.367 5.335 13.219 1.00 0.00 C ATOM 1672 CG GLU A 116 -10.854 6.742 12.920 1.00 0.00 C ATOM 1673 CD GLU A 116 -12.351 6.804 12.683 1.00 0.00 C ATOM 1674 OE1 GLU A 116 -13.110 6.375 13.577 1.00 0.00 O ATOM 1675 OE2 GLU A 116 -12.762 7.280 11.605 1.00 0.00 O ATOM 0 H GLU A 116 -8.677 3.541 13.016 1.00 0.00 H new ATOM 0 HA GLU A 116 -8.474 6.145 13.836 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -10.169 4.821 12.279 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.162 4.784 13.722 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -10.594 7.397 13.752 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -10.335 7.123 12.041 1.00 0.00 H new ATOM 1682 N LYS A 117 -9.488 4.243 16.237 1.00 0.00 N ATOM 1683 CA LYS A 117 -9.832 4.192 17.653 1.00 0.00 C ATOM 1684 C LYS A 117 -8.881 5.056 18.475 1.00 0.00 C ATOM 1685 O LYS A 117 -9.312 5.830 19.329 1.00 0.00 O ATOM 1686 CB LYS A 117 -9.791 2.748 18.158 1.00 0.00 C ATOM 1687 CG LYS A 117 -11.075 1.978 17.904 1.00 0.00 C ATOM 1688 CD LYS A 117 -10.985 0.554 18.428 1.00 0.00 C ATOM 1689 CE LYS A 117 -12.347 -0.124 18.437 1.00 0.00 C ATOM 1690 NZ LYS A 117 -13.127 0.215 19.659 1.00 0.00 N ATOM 0 H LYS A 117 -9.255 3.338 15.827 1.00 0.00 H new ATOM 0 HA LYS A 117 -10.843 4.582 17.770 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -8.964 2.227 17.676 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -9.585 2.752 19.228 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -11.909 2.491 18.383 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -11.284 1.960 16.834 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -10.296 -0.020 17.808 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -10.575 0.562 19.438 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -12.908 0.177 17.553 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -12.215 -1.204 18.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -14.048 -0.266 19.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -12.603 -0.095 20.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -13.275 1.244 19.702 1.00 0.00 H new ATOM 1704 N ASN A 118 -7.586 4.920 18.210 1.00 0.00 N ATOM 1705 CA ASN A 118 -6.575 5.690 18.925 1.00 0.00 C ATOM 1706 C ASN A 118 -5.472 6.152 17.977 1.00 0.00 C ATOM 1707 O ASN A 118 -5.541 5.922 16.770 1.00 0.00 O ATOM 1708 CB ASN A 118 -5.973 4.853 20.056 1.00 0.00 C ATOM 1709 CG ASN A 118 -6.830 4.870 21.307 1.00 0.00 C ATOM 1710 OD1 ASN A 118 -8.039 4.645 21.247 1.00 0.00 O ATOM 1711 ND2 ASN A 118 -6.206 5.138 22.448 1.00 0.00 N ATOM 0 H ASN A 118 -7.212 4.284 17.506 1.00 0.00 H new ATOM 0 HA ASN A 118 -7.057 6.570 19.350 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -5.850 3.824 19.717 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -4.979 5.231 20.295 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -6.731 5.164 23.322 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -5.202 5.318 22.450 1.00 0.00 H new ATOM 1718 N GLU A 119 -4.456 6.804 18.533 1.00 0.00 N ATOM 1719 CA GLU A 119 -3.339 7.298 17.737 1.00 0.00 C ATOM 1720 C GLU A 119 -2.073 6.493 18.016 1.00 0.00 C ATOM 1721 O GLU A 119 -1.102 6.563 17.263 1.00 0.00 O ATOM 1722 CB GLU A 119 -3.090 8.779 18.030 1.00 0.00 C ATOM 1723 CG GLU A 119 -2.294 9.489 16.948 1.00 0.00 C ATOM 1724 CD GLU A 119 -1.575 10.720 17.465 1.00 0.00 C ATOM 1725 OE1 GLU A 119 -0.731 10.577 18.374 1.00 0.00 O ATOM 1726 OE2 GLU A 119 -1.857 11.827 16.960 1.00 0.00 O ATOM 0 H GLU A 119 -4.383 7.002 19.531 1.00 0.00 H new ATOM 0 HA GLU A 119 -3.598 7.182 16.685 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -4.049 9.282 18.153 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -2.559 8.869 18.978 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -1.565 8.798 16.526 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -2.965 9.778 16.139 1.00 0.00 H new ATOM 1733 N GLU A 120 -2.092 5.731 19.105 1.00 0.00 N ATOM 1734 CA GLU A 120 -0.945 4.914 19.485 1.00 0.00 C ATOM 1735 C GLU A 120 -1.221 3.435 19.225 1.00 0.00 C ATOM 1736 O GLU A 120 -0.566 2.563 19.795 1.00 0.00 O ATOM 1737 CB GLU A 120 -0.604 5.129 20.961 1.00 0.00 C ATOM 1738 CG GLU A 120 -1.756 4.822 21.903 1.00 0.00 C ATOM 1739 CD GLU A 120 -1.956 3.334 22.115 1.00 0.00 C ATOM 1740 OE1 GLU A 120 -1.000 2.663 22.556 1.00 0.00 O ATOM 1741 OE2 GLU A 120 -3.070 2.841 21.838 1.00 0.00 O ATOM 0 H GLU A 120 -2.888 5.662 19.739 1.00 0.00 H new ATOM 0 HA GLU A 120 -0.095 5.220 18.875 1.00 0.00 H new ATOM 0 HB2 GLU A 120 0.247 4.500 21.224 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -0.293 6.163 21.106 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -1.571 5.301 22.865 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -2.673 5.255 21.503 1.00 0.00 H new ATOM 1748 N GLU A 121 -2.194 3.163 18.362 1.00 0.00 N ATOM 1749 CA GLU A 121 -2.557 1.791 18.029 1.00 0.00 C ATOM 1750 C GLU A 121 -2.051 1.417 16.639 1.00 0.00 C ATOM 1751 O GLU A 121 -2.805 1.434 15.666 1.00 0.00 O ATOM 1752 CB GLU A 121 -4.075 1.610 18.096 1.00 0.00 C ATOM 1753 CG GLU A 121 -4.522 0.163 17.978 1.00 0.00 C ATOM 1754 CD GLU A 121 -5.830 -0.104 18.697 1.00 0.00 C ATOM 1755 OE1 GLU A 121 -6.724 0.765 18.647 1.00 0.00 O ATOM 1756 OE2 GLU A 121 -5.959 -1.185 19.311 1.00 0.00 O ATOM 0 H GLU A 121 -2.745 3.874 17.881 1.00 0.00 H new ATOM 0 HA GLU A 121 -2.087 1.131 18.758 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -4.440 2.018 19.039 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -4.537 2.190 17.297 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -4.632 -0.095 16.925 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -3.748 -0.487 18.386 1.00 0.00 H new ATOM 1763 N VAL A 122 -0.768 1.079 16.554 1.00 0.00 N ATOM 1764 CA VAL A 122 -0.160 0.700 15.284 1.00 0.00 C ATOM 1765 C VAL A 122 -0.576 -0.708 14.874 1.00 0.00 C ATOM 1766 O VAL A 122 -0.047 -1.697 15.383 1.00 0.00 O ATOM 1767 CB VAL A 122 1.377 0.768 15.356 1.00 0.00 C ATOM 1768 CG1 VAL A 122 1.872 0.274 16.706 1.00 0.00 C ATOM 1769 CG2 VAL A 122 1.999 -0.036 14.224 1.00 0.00 C ATOM 0 H VAL A 122 -0.130 1.060 17.349 1.00 0.00 H new ATOM 0 HA VAL A 122 -0.514 1.412 14.538 1.00 0.00 H new ATOM 0 HB VAL A 122 1.682 1.808 15.243 1.00 0.00 H new ATOM 0 HG11 VAL A 122 2.960 0.330 16.737 1.00 0.00 H new ATOM 0 HG12 VAL A 122 1.454 0.897 17.497 1.00 0.00 H new ATOM 0 HG13 VAL A 122 1.557 -0.759 16.853 1.00 0.00 H new ATOM 0 HG21 VAL A 122 3.085 0.023 14.290 1.00 0.00 H new ATOM 0 HG22 VAL A 122 1.687 -1.077 14.303 1.00 0.00 H new ATOM 0 HG23 VAL A 122 1.671 0.370 13.267 1.00 0.00 H new ATOM 1779 N LEU A 123 -1.527 -0.793 13.950 1.00 0.00 N ATOM 1780 CA LEU A 123 -2.015 -2.081 13.470 1.00 0.00 C ATOM 1781 C LEU A 123 -1.017 -2.716 12.506 1.00 0.00 C ATOM 1782 O LEU A 123 -0.521 -3.817 12.747 1.00 0.00 O ATOM 1783 CB LEU A 123 -3.369 -1.910 12.781 1.00 0.00 C ATOM 1784 CG LEU A 123 -4.447 -1.186 13.588 1.00 0.00 C ATOM 1785 CD1 LEU A 123 -5.427 -0.484 12.661 1.00 0.00 C ATOM 1786 CD2 LEU A 123 -5.177 -2.161 14.499 1.00 0.00 C ATOM 0 H LEU A 123 -1.975 0.015 13.518 1.00 0.00 H new ATOM 0 HA LEU A 123 -2.132 -2.741 14.329 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -3.214 -1.365 11.850 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -3.745 -2.897 12.514 1.00 0.00 H new ATOM 0 HG LEU A 123 -3.963 -0.432 14.209 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -6.187 0.026 13.253 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -4.893 0.245 12.051 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -5.905 -1.219 12.013 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -5.940 -1.628 15.065 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -5.648 -2.938 13.897 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -4.466 -2.617 15.188 1.00 0.00 H new ATOM 1798 N VAL A 124 -0.727 -2.014 11.416 1.00 0.00 N ATOM 1799 CA VAL A 124 0.214 -2.508 10.417 1.00 0.00 C ATOM 1800 C VAL A 124 1.315 -1.488 10.148 1.00 0.00 C ATOM 1801 O VAL A 124 1.042 -0.358 9.745 1.00 0.00 O ATOM 1802 CB VAL A 124 -0.497 -2.841 9.092 1.00 0.00 C ATOM 1803 CG1 VAL A 124 0.518 -3.056 7.980 1.00 0.00 C ATOM 1804 CG2 VAL A 124 -1.386 -4.065 9.258 1.00 0.00 C ATOM 0 H VAL A 124 -1.130 -1.102 11.202 1.00 0.00 H new ATOM 0 HA VAL A 124 0.656 -3.418 10.822 1.00 0.00 H new ATOM 0 HB VAL A 124 -1.128 -1.996 8.816 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -0.003 -3.290 7.052 1.00 0.00 H new ATOM 0 HG12 VAL A 124 1.108 -2.150 7.846 1.00 0.00 H new ATOM 0 HG13 VAL A 124 1.178 -3.883 8.244 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -1.881 -4.286 8.312 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -0.778 -4.918 9.558 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -2.137 -3.868 10.023 1.00 0.00 H new ATOM 1814 N GLU A 125 2.560 -1.896 10.373 1.00 0.00 N ATOM 1815 CA GLU A 125 3.702 -1.016 10.154 1.00 0.00 C ATOM 1816 C GLU A 125 4.455 -1.408 8.886 1.00 0.00 C ATOM 1817 O GLU A 125 5.316 -2.289 8.909 1.00 0.00 O ATOM 1818 CB GLU A 125 4.647 -1.063 11.357 1.00 0.00 C ATOM 1819 CG GLU A 125 5.659 0.070 11.380 1.00 0.00 C ATOM 1820 CD GLU A 125 6.467 0.105 12.663 1.00 0.00 C ATOM 1821 OE1 GLU A 125 7.343 -0.769 12.835 1.00 0.00 O ATOM 1822 OE2 GLU A 125 6.224 1.004 13.494 1.00 0.00 O ATOM 0 H GLU A 125 2.803 -2.829 10.706 1.00 0.00 H new ATOM 0 HA GLU A 125 3.328 0.001 10.034 1.00 0.00 H new ATOM 0 HB2 GLU A 125 4.057 -1.031 12.273 1.00 0.00 H new ATOM 0 HB3 GLU A 125 5.179 -2.014 11.354 1.00 0.00 H new ATOM 0 HG2 GLU A 125 6.336 -0.035 10.532 1.00 0.00 H new ATOM 0 HG3 GLU A 125 5.138 1.020 11.257 1.00 0.00 H new ATOM 1829 N CYS A 126 4.125 -0.747 7.782 1.00 0.00 N ATOM 1830 CA CYS A 126 4.769 -1.027 6.503 1.00 0.00 C ATOM 1831 C CYS A 126 5.635 0.149 6.062 1.00 0.00 C ATOM 1832 O CYS A 126 5.268 1.309 6.253 1.00 0.00 O ATOM 1833 CB CYS A 126 3.718 -1.330 5.435 1.00 0.00 C ATOM 1834 SG CYS A 126 4.402 -1.947 3.879 1.00 0.00 S ATOM 0 H CYS A 126 3.416 -0.014 7.746 1.00 0.00 H new ATOM 0 HA CYS A 126 5.410 -1.900 6.630 1.00 0.00 H new ATOM 0 HB2 CYS A 126 3.017 -2.066 5.829 1.00 0.00 H new ATOM 0 HB3 CYS A 126 3.148 -0.423 5.234 1.00 0.00 H new ATOM 0 HG CYS A 126 3.439 -2.132 3.025 1.00 0.00 H new ATOM 1840 N ARG A 127 6.785 -0.158 5.472 1.00 0.00 N ATOM 1841 CA ARG A 127 7.705 0.873 5.007 1.00 0.00 C ATOM 1842 C ARG A 127 7.850 0.827 3.488 1.00 0.00 C ATOM 1843 O ARG A 127 7.318 -0.067 2.830 1.00 0.00 O ATOM 1844 CB ARG A 127 9.074 0.700 5.666 1.00 0.00 C ATOM 1845 CG ARG A 127 9.002 0.450 7.163 1.00 0.00 C ATOM 1846 CD ARG A 127 10.241 -0.273 7.668 1.00 0.00 C ATOM 1847 NE ARG A 127 10.522 0.033 9.068 1.00 0.00 N ATOM 1848 CZ ARG A 127 11.210 -0.769 9.872 1.00 0.00 C ATOM 1849 NH1 ARG A 127 11.686 -1.920 9.417 1.00 0.00 N ATOM 1850 NH2 ARG A 127 11.424 -0.421 11.134 1.00 0.00 N ATOM 0 H ARG A 127 7.102 -1.113 5.304 1.00 0.00 H new ATOM 0 HA ARG A 127 7.295 1.843 5.287 1.00 0.00 H new ATOM 0 HB2 ARG A 127 9.593 -0.133 5.192 1.00 0.00 H new ATOM 0 HB3 ARG A 127 9.671 1.594 5.484 1.00 0.00 H new ATOM 0 HG2 ARG A 127 8.895 1.400 7.687 1.00 0.00 H new ATOM 0 HG3 ARG A 127 8.116 -0.142 7.392 1.00 0.00 H new ATOM 0 HD2 ARG A 127 10.105 -1.348 7.552 1.00 0.00 H new ATOM 0 HD3 ARG A 127 11.099 0.008 7.057 1.00 0.00 H new ATOM 0 HE ARG A 127 10.170 0.911 9.449 1.00 0.00 H new ATOM 0 HH11 ARG A 127 11.524 -2.191 8.447 1.00 0.00 H new ATOM 0 HH12 ARG A 127 12.214 -2.534 10.037 1.00 0.00 H new ATOM 0 HH21 ARG A 127 11.060 0.464 11.488 1.00 0.00 H new ATOM 0 HH22 ARG A 127 11.953 -1.038 11.751 1.00 0.00 H new ATOM 1864 N VAL A 128 8.573 1.797 2.938 1.00 0.00 N ATOM 1865 CA VAL A 128 8.789 1.867 1.498 1.00 0.00 C ATOM 1866 C VAL A 128 9.946 0.971 1.071 1.00 0.00 C ATOM 1867 O VAL A 128 9.828 0.199 0.120 1.00 0.00 O ATOM 1868 CB VAL A 128 9.077 3.311 1.044 1.00 0.00 C ATOM 1869 CG1 VAL A 128 7.879 4.206 1.316 1.00 0.00 C ATOM 1870 CG2 VAL A 128 10.322 3.847 1.734 1.00 0.00 C ATOM 0 H VAL A 128 9.019 2.545 3.468 1.00 0.00 H new ATOM 0 HA VAL A 128 7.871 1.520 1.023 1.00 0.00 H new ATOM 0 HB VAL A 128 9.258 3.306 -0.031 1.00 0.00 H new ATOM 0 HG11 VAL A 128 8.102 5.222 0.989 1.00 0.00 H new ATOM 0 HG12 VAL A 128 7.013 3.831 0.771 1.00 0.00 H new ATOM 0 HG13 VAL A 128 7.662 4.209 2.384 1.00 0.00 H new ATOM 0 HG21 VAL A 128 10.511 4.868 1.402 1.00 0.00 H new ATOM 0 HG22 VAL A 128 10.172 3.838 2.814 1.00 0.00 H new ATOM 0 HG23 VAL A 128 11.177 3.219 1.482 1.00 0.00 H new ATOM 1880 N ARG A 129 11.064 1.079 1.782 1.00 0.00 N ATOM 1881 CA ARG A 129 12.243 0.278 1.476 1.00 0.00 C ATOM 1882 C ARG A 129 11.918 -1.212 1.530 1.00 0.00 C ATOM 1883 O ARG A 129 12.653 -2.039 0.990 1.00 0.00 O ATOM 1884 CB ARG A 129 13.373 0.600 2.456 1.00 0.00 C ATOM 1885 CG ARG A 129 13.004 0.357 3.911 1.00 0.00 C ATOM 1886 CD ARG A 129 12.406 1.601 4.549 1.00 0.00 C ATOM 1887 NE ARG A 129 12.693 1.674 5.980 1.00 0.00 N ATOM 1888 CZ ARG A 129 13.921 1.753 6.480 1.00 0.00 C ATOM 1889 NH1 ARG A 129 14.970 1.770 5.669 1.00 0.00 N ATOM 1890 NH2 ARG A 129 14.101 1.816 7.793 1.00 0.00 N ATOM 0 H ARG A 129 11.178 1.713 2.573 1.00 0.00 H new ATOM 0 HA ARG A 129 12.566 0.525 0.465 1.00 0.00 H new ATOM 0 HB2 ARG A 129 14.244 -0.005 2.205 1.00 0.00 H new ATOM 0 HB3 ARG A 129 13.663 1.643 2.333 1.00 0.00 H new ATOM 0 HG2 ARG A 129 12.290 -0.465 3.974 1.00 0.00 H new ATOM 0 HG3 ARG A 129 13.891 0.052 4.467 1.00 0.00 H new ATOM 0 HD2 ARG A 129 12.801 2.488 4.054 1.00 0.00 H new ATOM 0 HD3 ARG A 129 11.327 1.604 4.395 1.00 0.00 H new ATOM 0 HE ARG A 129 11.907 1.664 6.630 1.00 0.00 H new ATOM 0 HH11 ARG A 129 14.835 1.722 4.659 1.00 0.00 H new ATOM 0 HH12 ARG A 129 15.912 1.831 6.055 1.00 0.00 H new ATOM 0 HH21 ARG A 129 13.296 1.804 8.419 1.00 0.00 H new ATOM 0 HH22 ARG A 129 15.044 1.877 8.176 1.00 0.00 H new ATOM 1904 N PHE A 130 10.811 -1.547 2.185 1.00 0.00 N ATOM 1905 CA PHE A 130 10.389 -2.937 2.311 1.00 0.00 C ATOM 1906 C PHE A 130 9.285 -3.263 1.309 1.00 0.00 C ATOM 1907 O PHE A 130 9.104 -4.418 0.921 1.00 0.00 O ATOM 1908 CB PHE A 130 9.901 -3.217 3.734 1.00 0.00 C ATOM 1909 CG PHE A 130 10.989 -3.678 4.661 1.00 0.00 C ATOM 1910 CD1 PHE A 130 11.452 -4.984 4.613 1.00 0.00 C ATOM 1911 CD2 PHE A 130 11.550 -2.807 5.581 1.00 0.00 C ATOM 1912 CE1 PHE A 130 12.453 -5.411 5.464 1.00 0.00 C ATOM 1913 CE2 PHE A 130 12.552 -3.228 6.434 1.00 0.00 C ATOM 1914 CZ PHE A 130 13.003 -4.532 6.377 1.00 0.00 C ATOM 0 H PHE A 130 10.190 -0.875 2.636 1.00 0.00 H new ATOM 0 HA PHE A 130 11.248 -3.573 2.098 1.00 0.00 H new ATOM 0 HB2 PHE A 130 9.449 -2.312 4.139 1.00 0.00 H new ATOM 0 HB3 PHE A 130 9.119 -3.976 3.699 1.00 0.00 H new ATOM 0 HD1 PHE A 130 11.025 -5.676 3.902 1.00 0.00 H new ATOM 0 HD2 PHE A 130 11.200 -1.787 5.632 1.00 0.00 H new ATOM 0 HE1 PHE A 130 12.805 -6.431 5.416 1.00 0.00 H new ATOM 0 HE2 PHE A 130 12.982 -2.538 7.145 1.00 0.00 H new ATOM 0 HZ PHE A 130 13.784 -4.864 7.045 1.00 0.00 H new ATOM 1924 N LEU A 131 8.550 -2.238 0.895 1.00 0.00 N ATOM 1925 CA LEU A 131 7.462 -2.414 -0.062 1.00 0.00 C ATOM 1926 C LEU A 131 7.967 -3.062 -1.347 1.00 0.00 C ATOM 1927 O LEU A 131 9.055 -2.746 -1.827 1.00 0.00 O ATOM 1928 CB LEU A 131 6.812 -1.066 -0.378 1.00 0.00 C ATOM 1929 CG LEU A 131 5.363 -1.117 -0.865 1.00 0.00 C ATOM 1930 CD1 LEU A 131 4.774 0.283 -0.935 1.00 0.00 C ATOM 1931 CD2 LEU A 131 5.280 -1.801 -2.221 1.00 0.00 C ATOM 0 H LEU A 131 8.687 -1.276 1.206 1.00 0.00 H new ATOM 0 HA LEU A 131 6.718 -3.073 0.387 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.851 -0.447 0.519 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.412 -0.565 -1.138 1.00 0.00 H new ATOM 0 HG LEU A 131 4.780 -1.699 -0.151 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.743 0.227 -1.283 1.00 0.00 H new ATOM 0 HD12 LEU A 131 4.798 0.738 0.055 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.358 0.889 -1.627 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.242 -1.828 -2.552 1.00 0.00 H new ATOM 0 HD22 LEU A 131 5.877 -1.247 -2.945 1.00 0.00 H new ATOM 0 HD23 LEU A 131 5.662 -2.819 -2.139 1.00 0.00 H new ATOM 1943 N SER A 132 7.167 -3.968 -1.900 1.00 0.00 N ATOM 1944 CA SER A 132 7.533 -4.662 -3.129 1.00 0.00 C ATOM 1945 C SER A 132 6.787 -4.079 -4.325 1.00 0.00 C ATOM 1946 O SER A 132 7.399 -3.591 -5.276 1.00 0.00 O ATOM 1947 CB SER A 132 7.232 -6.157 -3.005 1.00 0.00 C ATOM 1948 OG SER A 132 7.792 -6.693 -1.819 1.00 0.00 O ATOM 0 H SER A 132 6.261 -4.239 -1.516 1.00 0.00 H new ATOM 0 HA SER A 132 8.603 -4.526 -3.289 1.00 0.00 H new ATOM 0 HB2 SER A 132 6.154 -6.315 -3.006 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.632 -6.685 -3.871 1.00 0.00 H new ATOM 0 HG SER A 132 7.584 -7.649 -1.762 1.00 0.00 H new ATOM 1954 N PHE A 133 5.460 -4.134 -4.271 1.00 0.00 N ATOM 1955 CA PHE A 133 4.629 -3.612 -5.349 1.00 0.00 C ATOM 1956 C PHE A 133 3.481 -2.774 -4.794 1.00 0.00 C ATOM 1957 O PHE A 133 3.108 -2.907 -3.629 1.00 0.00 O ATOM 1958 CB PHE A 133 4.074 -4.760 -6.195 1.00 0.00 C ATOM 1959 CG PHE A 133 3.364 -4.302 -7.436 1.00 0.00 C ATOM 1960 CD1 PHE A 133 3.926 -3.337 -8.256 1.00 0.00 C ATOM 1961 CD2 PHE A 133 2.133 -4.836 -7.783 1.00 0.00 C ATOM 1962 CE1 PHE A 133 3.275 -2.913 -9.399 1.00 0.00 C ATOM 1963 CE2 PHE A 133 1.477 -4.416 -8.925 1.00 0.00 C ATOM 1964 CZ PHE A 133 2.049 -3.452 -9.733 1.00 0.00 C ATOM 0 H PHE A 133 4.938 -4.535 -3.492 1.00 0.00 H new ATOM 0 HA PHE A 133 5.251 -2.974 -5.977 1.00 0.00 H new ATOM 0 HB2 PHE A 133 4.893 -5.421 -6.478 1.00 0.00 H new ATOM 0 HB3 PHE A 133 3.385 -5.348 -5.588 1.00 0.00 H new ATOM 0 HD1 PHE A 133 4.885 -2.911 -7.999 1.00 0.00 H new ATOM 0 HD2 PHE A 133 1.681 -5.589 -7.154 1.00 0.00 H new ATOM 0 HE1 PHE A 133 3.725 -2.161 -10.030 1.00 0.00 H new ATOM 0 HE2 PHE A 133 0.519 -4.841 -9.185 1.00 0.00 H new ATOM 0 HZ PHE A 133 1.537 -3.121 -10.625 1.00 0.00 H new ATOM 1974 N MET A 134 2.926 -1.910 -5.638 1.00 0.00 N ATOM 1975 CA MET A 134 1.820 -1.050 -5.232 1.00 0.00 C ATOM 1976 C MET A 134 1.083 -0.502 -6.450 1.00 0.00 C ATOM 1977 O MET A 134 1.686 0.114 -7.327 1.00 0.00 O ATOM 1978 CB MET A 134 2.333 0.105 -4.370 1.00 0.00 C ATOM 1979 CG MET A 134 3.442 0.909 -5.029 1.00 0.00 C ATOM 1980 SD MET A 134 4.239 2.057 -3.890 1.00 0.00 S ATOM 1981 CE MET A 134 5.941 1.510 -3.994 1.00 0.00 C ATOM 0 H MET A 134 3.223 -1.787 -6.606 1.00 0.00 H new ATOM 0 HA MET A 134 1.123 -1.649 -4.646 1.00 0.00 H new ATOM 0 HB2 MET A 134 1.502 0.771 -4.137 1.00 0.00 H new ATOM 0 HB3 MET A 134 2.698 -0.293 -3.423 1.00 0.00 H new ATOM 0 HG2 MET A 134 4.190 0.226 -5.433 1.00 0.00 H new ATOM 0 HG3 MET A 134 3.031 1.466 -5.871 1.00 0.00 H new ATOM 0 HE1 MET A 134 6.403 1.568 -3.008 1.00 0.00 H new ATOM 0 HE2 MET A 134 5.971 0.480 -4.349 1.00 0.00 H new ATOM 0 HE3 MET A 134 6.487 2.149 -4.688 1.00 0.00 H new ATOM 1991 N GLY A 135 -0.226 -0.731 -6.497 1.00 0.00 N ATOM 1992 CA GLY A 135 -1.024 -0.254 -7.611 1.00 0.00 C ATOM 1993 C GLY A 135 -2.478 -0.049 -7.238 1.00 0.00 C ATOM 1994 O GLY A 135 -2.858 -0.211 -6.078 1.00 0.00 O ATOM 0 H GLY A 135 -0.748 -1.239 -5.783 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -0.609 0.686 -7.974 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -0.960 -0.969 -8.432 1.00 0.00 H new ATOM 1998 N VAL A 136 -3.296 0.311 -8.223 1.00 0.00 N ATOM 1999 CA VAL A 136 -4.717 0.539 -7.992 1.00 0.00 C ATOM 2000 C VAL A 136 -5.566 -0.486 -8.736 1.00 0.00 C ATOM 2001 O VAL A 136 -5.314 -0.788 -9.901 1.00 0.00 O ATOM 2002 CB VAL A 136 -5.137 1.954 -8.432 1.00 0.00 C ATOM 2003 CG1 VAL A 136 -6.647 2.116 -8.339 1.00 0.00 C ATOM 2004 CG2 VAL A 136 -4.427 3.005 -7.593 1.00 0.00 C ATOM 0 H VAL A 136 -2.998 0.451 -9.188 1.00 0.00 H new ATOM 0 HA VAL A 136 -4.884 0.435 -6.920 1.00 0.00 H new ATOM 0 HB VAL A 136 -4.844 2.094 -9.473 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.925 3.122 -8.654 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -7.132 1.386 -8.987 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -6.967 1.956 -7.309 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -4.735 3.999 -7.917 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -4.687 2.869 -6.543 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -3.349 2.901 -7.716 1.00 0.00 H new ATOM 2014 N GLY A 137 -6.576 -1.018 -8.053 1.00 0.00 N ATOM 2015 CA GLY A 137 -7.448 -2.003 -8.665 1.00 0.00 C ATOM 2016 C GLY A 137 -8.216 -1.444 -9.845 1.00 0.00 C ATOM 2017 O GLY A 137 -7.865 -0.393 -10.383 1.00 0.00 O ATOM 0 H GLY A 137 -6.805 -0.784 -7.087 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -6.854 -2.856 -8.993 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -8.152 -2.373 -7.920 1.00 0.00 H new ATOM 2021 N LYS A 138 -9.267 -2.147 -10.253 1.00 0.00 N ATOM 2022 CA LYS A 138 -10.088 -1.716 -11.378 1.00 0.00 C ATOM 2023 C LYS A 138 -10.703 -0.347 -11.109 1.00 0.00 C ATOM 2024 O LYS A 138 -10.854 0.467 -12.021 1.00 0.00 O ATOM 2025 CB LYS A 138 -11.193 -2.739 -11.651 1.00 0.00 C ATOM 2026 CG LYS A 138 -12.077 -3.015 -10.447 1.00 0.00 C ATOM 2027 CD LYS A 138 -12.850 -4.314 -10.609 1.00 0.00 C ATOM 2028 CE LYS A 138 -13.970 -4.172 -11.629 1.00 0.00 C ATOM 2029 NZ LYS A 138 -15.109 -3.376 -11.094 1.00 0.00 N ATOM 0 H LYS A 138 -9.571 -3.019 -9.820 1.00 0.00 H new ATOM 0 HA LYS A 138 -9.447 -1.640 -12.256 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -11.814 -2.381 -12.472 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -10.738 -3.674 -11.979 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -11.463 -3.065 -9.548 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -12.775 -2.189 -10.310 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -12.170 -5.107 -10.921 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -13.268 -4.613 -9.647 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -13.583 -3.693 -12.529 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -14.323 -5.161 -11.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -15.910 -3.429 -11.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -15.396 -3.758 -10.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -14.817 -2.384 -10.983 1.00 0.00 H new ATOM 2043 N ASP A 139 -11.056 -0.098 -9.852 1.00 0.00 N ATOM 2044 CA ASP A 139 -11.652 1.175 -9.463 1.00 0.00 C ATOM 2045 C ASP A 139 -10.602 2.109 -8.872 1.00 0.00 C ATOM 2046 O ASP A 139 -9.479 1.695 -8.582 1.00 0.00 O ATOM 2047 CB ASP A 139 -12.777 0.947 -8.452 1.00 0.00 C ATOM 2048 CG ASP A 139 -13.982 0.265 -9.070 1.00 0.00 C ATOM 2049 OD1 ASP A 139 -14.313 0.583 -10.231 1.00 0.00 O ATOM 2050 OD2 ASP A 139 -14.595 -0.587 -8.392 1.00 0.00 O ATOM 0 H ASP A 139 -10.940 -0.761 -9.086 1.00 0.00 H new ATOM 0 HA ASP A 139 -12.066 1.643 -10.356 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -12.403 0.340 -7.627 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -13.082 1.905 -8.030 1.00 0.00 H new ATOM 2055 N VAL A 140 -10.973 3.374 -8.697 1.00 0.00 N ATOM 2056 CA VAL A 140 -10.063 4.368 -8.141 1.00 0.00 C ATOM 2057 C VAL A 140 -10.190 4.441 -6.623 1.00 0.00 C ATOM 2058 O VAL A 140 -9.512 5.234 -5.970 1.00 0.00 O ATOM 2059 CB VAL A 140 -10.326 5.764 -8.735 1.00 0.00 C ATOM 2060 CG1 VAL A 140 -10.087 5.759 -10.237 1.00 0.00 C ATOM 2061 CG2 VAL A 140 -11.740 6.222 -8.413 1.00 0.00 C ATOM 0 H VAL A 140 -11.898 3.734 -8.932 1.00 0.00 H new ATOM 0 HA VAL A 140 -9.053 4.054 -8.404 1.00 0.00 H new ATOM 0 HB VAL A 140 -9.629 6.469 -8.283 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -10.278 6.754 -10.639 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -9.054 5.478 -10.440 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -10.758 5.042 -10.710 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -11.909 7.210 -8.840 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -12.456 5.517 -8.836 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -11.870 6.267 -7.332 1.00 0.00 H new ATOM 2071 N HIS A 141 -11.065 3.608 -6.067 1.00 0.00 N ATOM 2072 CA HIS A 141 -11.281 3.577 -4.625 1.00 0.00 C ATOM 2073 C HIS A 141 -10.682 2.315 -4.013 1.00 0.00 C ATOM 2074 O HIS A 141 -10.968 1.972 -2.865 1.00 0.00 O ATOM 2075 CB HIS A 141 -12.775 3.651 -4.310 1.00 0.00 C ATOM 2076 CG HIS A 141 -13.504 4.689 -5.107 1.00 0.00 C ATOM 2077 ND1 HIS A 141 -14.271 4.388 -6.212 1.00 0.00 N ATOM 2078 CD2 HIS A 141 -13.581 6.032 -4.951 1.00 0.00 C ATOM 2079 CE1 HIS A 141 -14.788 5.501 -6.703 1.00 0.00 C ATOM 2080 NE2 HIS A 141 -14.384 6.512 -5.956 1.00 0.00 N ATOM 0 H HIS A 141 -11.635 2.946 -6.593 1.00 0.00 H new ATOM 0 HA HIS A 141 -10.782 4.443 -4.189 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -13.226 2.677 -4.498 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -12.904 3.863 -3.249 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -13.101 6.616 -4.180 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -15.431 5.571 -7.568 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -14.629 7.491 -6.102 1.00 0.00 H new ATOM 2088 N THR A 142 -9.849 1.625 -4.786 1.00 0.00 N ATOM 2089 CA THR A 142 -9.211 0.400 -4.321 1.00 0.00 C ATOM 2090 C THR A 142 -7.696 0.481 -4.463 1.00 0.00 C ATOM 2091 O THR A 142 -7.168 0.534 -5.574 1.00 0.00 O ATOM 2092 CB THR A 142 -9.723 -0.829 -5.097 1.00 0.00 C ATOM 2093 OG1 THR A 142 -9.622 -0.596 -6.506 1.00 0.00 O ATOM 2094 CG2 THR A 142 -11.167 -1.137 -4.731 1.00 0.00 C ATOM 0 H THR A 142 -9.600 1.894 -5.738 1.00 0.00 H new ATOM 0 HA THR A 142 -9.469 0.289 -3.268 1.00 0.00 H new ATOM 0 HB THR A 142 -9.105 -1.685 -4.826 1.00 0.00 H new ATOM 0 HG1 THR A 142 -8.718 -0.287 -6.722 1.00 0.00 H new ATOM 0 HG21 THR A 142 -11.506 -2.008 -5.291 1.00 0.00 H new ATOM 0 HG22 THR A 142 -11.236 -1.343 -3.663 1.00 0.00 H new ATOM 0 HG23 THR A 142 -11.795 -0.281 -4.976 1.00 0.00 H new ATOM 2102 N PHE A 143 -7.000 0.489 -3.331 1.00 0.00 N ATOM 2103 CA PHE A 143 -5.544 0.564 -3.329 1.00 0.00 C ATOM 2104 C PHE A 143 -4.946 -0.490 -2.401 1.00 0.00 C ATOM 2105 O PHE A 143 -5.401 -0.667 -1.271 1.00 0.00 O ATOM 2106 CB PHE A 143 -5.084 1.958 -2.898 1.00 0.00 C ATOM 2107 CG PHE A 143 -3.629 2.022 -2.530 1.00 0.00 C ATOM 2108 CD1 PHE A 143 -2.662 2.215 -3.504 1.00 0.00 C ATOM 2109 CD2 PHE A 143 -3.228 1.892 -1.210 1.00 0.00 C ATOM 2110 CE1 PHE A 143 -1.323 2.273 -3.168 1.00 0.00 C ATOM 2111 CE2 PHE A 143 -1.890 1.950 -0.868 1.00 0.00 C ATOM 2112 CZ PHE A 143 -0.937 2.142 -1.848 1.00 0.00 C ATOM 0 H PHE A 143 -7.421 0.444 -2.403 1.00 0.00 H new ATOM 0 HA PHE A 143 -5.194 0.371 -4.343 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -5.277 2.662 -3.707 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -5.681 2.281 -2.045 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -2.958 2.321 -4.537 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -3.970 1.744 -0.439 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -0.579 2.421 -3.937 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -1.591 1.845 0.164 1.00 0.00 H new ATOM 0 HZ PHE A 143 0.109 2.190 -1.583 1.00 0.00 H new ATOM 2122 N ALA A 144 -3.925 -1.188 -2.888 1.00 0.00 N ATOM 2123 CA ALA A 144 -3.264 -2.223 -2.103 1.00 0.00 C ATOM 2124 C ALA A 144 -1.759 -2.223 -2.352 1.00 0.00 C ATOM 2125 O ALA A 144 -1.283 -1.662 -3.338 1.00 0.00 O ATOM 2126 CB ALA A 144 -3.854 -3.588 -2.426 1.00 0.00 C ATOM 0 H ALA A 144 -3.538 -1.055 -3.822 1.00 0.00 H new ATOM 0 HA ALA A 144 -3.432 -2.007 -1.048 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -3.351 -4.351 -1.833 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -4.918 -3.589 -2.191 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -3.716 -3.803 -3.486 1.00 0.00 H new ATOM 2132 N PHE A 145 -1.016 -2.857 -1.451 1.00 0.00 N ATOM 2133 CA PHE A 145 0.436 -2.929 -1.572 1.00 0.00 C ATOM 2134 C PHE A 145 0.976 -4.189 -0.902 1.00 0.00 C ATOM 2135 O PHE A 145 0.441 -4.645 0.109 1.00 0.00 O ATOM 2136 CB PHE A 145 1.083 -1.690 -0.949 1.00 0.00 C ATOM 2137 CG PHE A 145 0.812 -1.548 0.522 1.00 0.00 C ATOM 2138 CD1 PHE A 145 1.489 -2.331 1.443 1.00 0.00 C ATOM 2139 CD2 PHE A 145 -0.119 -0.632 0.983 1.00 0.00 C ATOM 2140 CE1 PHE A 145 1.243 -2.203 2.797 1.00 0.00 C ATOM 2141 CE2 PHE A 145 -0.370 -0.499 2.336 1.00 0.00 C ATOM 2142 CZ PHE A 145 0.312 -1.286 3.244 1.00 0.00 C ATOM 0 H PHE A 145 -1.395 -3.328 -0.629 1.00 0.00 H new ATOM 0 HA PHE A 145 0.686 -2.967 -2.632 1.00 0.00 H new ATOM 0 HB2 PHE A 145 2.160 -1.733 -1.109 1.00 0.00 H new ATOM 0 HB3 PHE A 145 0.719 -0.801 -1.465 1.00 0.00 H new ATOM 0 HD1 PHE A 145 2.218 -3.050 1.099 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -0.655 -0.015 0.277 1.00 0.00 H new ATOM 0 HE1 PHE A 145 1.778 -2.819 3.504 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -1.098 0.219 2.683 1.00 0.00 H new ATOM 0 HZ PHE A 145 0.117 -1.184 4.301 1.00 0.00 H new ATOM 2152 N ILE A 146 2.037 -4.748 -1.475 1.00 0.00 N ATOM 2153 CA ILE A 146 2.649 -5.955 -0.934 1.00 0.00 C ATOM 2154 C ILE A 146 3.928 -5.628 -0.171 1.00 0.00 C ATOM 2155 O ILE A 146 4.709 -4.771 -0.585 1.00 0.00 O ATOM 2156 CB ILE A 146 2.974 -6.968 -2.047 1.00 0.00 C ATOM 2157 CG1 ILE A 146 1.690 -7.623 -2.562 1.00 0.00 C ATOM 2158 CG2 ILE A 146 3.944 -8.023 -1.537 1.00 0.00 C ATOM 2159 CD1 ILE A 146 1.093 -6.921 -3.761 1.00 0.00 C ATOM 0 H ILE A 146 2.490 -4.384 -2.313 1.00 0.00 H new ATOM 0 HA ILE A 146 1.924 -6.398 -0.251 1.00 0.00 H new ATOM 0 HB ILE A 146 3.446 -6.437 -2.874 1.00 0.00 H new ATOM 0 HG12 ILE A 146 1.901 -8.659 -2.826 1.00 0.00 H new ATOM 0 HG13 ILE A 146 0.954 -7.642 -1.758 1.00 0.00 H new ATOM 0 HG21 ILE A 146 4.164 -8.732 -2.336 1.00 0.00 H new ATOM 0 HG22 ILE A 146 4.867 -7.542 -1.214 1.00 0.00 H new ATOM 0 HG23 ILE A 146 3.497 -8.552 -0.695 1.00 0.00 H new ATOM 0 HD11 ILE A 146 0.186 -7.439 -4.072 1.00 0.00 H new ATOM 0 HD12 ILE A 146 0.850 -5.892 -3.496 1.00 0.00 H new ATOM 0 HD13 ILE A 146 1.812 -6.925 -4.580 1.00 0.00 H new ATOM 2171 N MET A 147 4.137 -6.317 0.946 1.00 0.00 N ATOM 2172 CA MET A 147 5.324 -6.102 1.766 1.00 0.00 C ATOM 2173 C MET A 147 6.010 -7.426 2.087 1.00 0.00 C ATOM 2174 O MET A 147 5.354 -8.458 2.227 1.00 0.00 O ATOM 2175 CB MET A 147 4.950 -5.381 3.062 1.00 0.00 C ATOM 2176 CG MET A 147 4.238 -6.270 4.069 1.00 0.00 C ATOM 2177 SD MET A 147 3.380 -5.327 5.344 1.00 0.00 S ATOM 2178 CE MET A 147 4.742 -4.903 6.426 1.00 0.00 C ATOM 0 H MET A 147 3.500 -7.029 1.304 1.00 0.00 H new ATOM 0 HA MET A 147 6.019 -5.481 1.200 1.00 0.00 H new ATOM 0 HB2 MET A 147 5.855 -4.980 3.519 1.00 0.00 H new ATOM 0 HB3 MET A 147 4.310 -4.531 2.824 1.00 0.00 H new ATOM 0 HG2 MET A 147 3.521 -6.903 3.546 1.00 0.00 H new ATOM 0 HG3 MET A 147 4.964 -6.933 4.540 1.00 0.00 H new ATOM 0 HE1 MET A 147 4.370 -4.316 7.266 1.00 0.00 H new ATOM 0 HE2 MET A 147 5.208 -5.815 6.798 1.00 0.00 H new ATOM 0 HE3 MET A 147 5.478 -4.319 5.873 1.00 0.00 H new ATOM 2188 N ASP A 148 7.333 -7.389 2.201 1.00 0.00 N ATOM 2189 CA ASP A 148 8.108 -8.586 2.506 1.00 0.00 C ATOM 2190 C ASP A 148 8.349 -8.710 4.007 1.00 0.00 C ATOM 2191 O ASP A 148 9.197 -8.017 4.570 1.00 0.00 O ATOM 2192 CB ASP A 148 9.445 -8.557 1.763 1.00 0.00 C ATOM 2193 CG ASP A 148 10.231 -9.842 1.935 1.00 0.00 C ATOM 2194 OD1 ASP A 148 9.603 -10.921 1.979 1.00 0.00 O ATOM 2195 OD2 ASP A 148 11.474 -9.768 2.025 1.00 0.00 O ATOM 0 H ASP A 148 7.891 -6.543 2.087 1.00 0.00 H new ATOM 0 HA ASP A 148 7.536 -9.453 2.175 1.00 0.00 H new ATOM 0 HB2 ASP A 148 9.264 -8.384 0.702 1.00 0.00 H new ATOM 0 HB3 ASP A 148 10.041 -7.719 2.125 1.00 0.00 H new ATOM 2200 N THR A 149 7.597 -9.597 4.651 1.00 0.00 N ATOM 2201 CA THR A 149 7.726 -9.810 6.087 1.00 0.00 C ATOM 2202 C THR A 149 8.778 -10.871 6.392 1.00 0.00 C ATOM 2203 O THR A 149 8.726 -11.528 7.431 1.00 0.00 O ATOM 2204 CB THR A 149 6.386 -10.236 6.715 1.00 0.00 C ATOM 2205 OG1 THR A 149 5.955 -11.481 6.153 1.00 0.00 O ATOM 2206 CG2 THR A 149 5.320 -9.175 6.486 1.00 0.00 C ATOM 0 H THR A 149 6.892 -10.180 4.200 1.00 0.00 H new ATOM 0 HA THR A 149 8.035 -8.859 6.521 1.00 0.00 H new ATOM 0 HB THR A 149 6.534 -10.354 7.788 1.00 0.00 H new ATOM 0 HG1 THR A 149 5.351 -11.309 5.401 1.00 0.00 H new ATOM 0 HG21 THR A 149 4.382 -9.498 6.938 1.00 0.00 H new ATOM 0 HG22 THR A 149 5.638 -8.236 6.940 1.00 0.00 H new ATOM 0 HG23 THR A 149 5.175 -9.030 5.415 1.00 0.00 H new ATOM 2214 N GLY A 150 9.732 -11.032 5.480 1.00 0.00 N ATOM 2215 CA GLY A 150 10.782 -12.015 5.672 1.00 0.00 C ATOM 2216 C GLY A 150 10.304 -13.431 5.420 1.00 0.00 C ATOM 2217 O GLY A 150 9.102 -13.692 5.393 1.00 0.00 O ATOM 0 H GLY A 150 9.796 -10.500 4.612 1.00 0.00 H new ATOM 0 HA2 GLY A 150 11.612 -11.791 5.002 1.00 0.00 H new ATOM 0 HA3 GLY A 150 11.164 -11.940 6.690 1.00 0.00 H new ATOM 2221 N ASN A 151 11.248 -14.348 5.233 1.00 0.00 N ATOM 2222 CA ASN A 151 10.917 -15.746 4.980 1.00 0.00 C ATOM 2223 C ASN A 151 10.133 -15.891 3.679 1.00 0.00 C ATOM 2224 O ASN A 151 9.159 -16.641 3.610 1.00 0.00 O ATOM 2225 CB ASN A 151 10.105 -16.318 6.143 1.00 0.00 C ATOM 2226 CG ASN A 151 10.987 -16.882 7.241 1.00 0.00 C ATOM 2227 OD1 ASN A 151 12.198 -17.024 7.068 1.00 0.00 O ATOM 2228 ND2 ASN A 151 10.382 -17.207 8.377 1.00 0.00 N ATOM 0 H ASN A 151 12.248 -14.148 5.252 1.00 0.00 H new ATOM 0 HA ASN A 151 11.849 -16.304 4.887 1.00 0.00 H new ATOM 0 HB2 ASN A 151 9.468 -15.536 6.557 1.00 0.00 H new ATOM 0 HB3 ASN A 151 9.446 -17.102 5.771 1.00 0.00 H new ATOM 0 HD21 ASN A 151 10.923 -17.592 9.151 1.00 0.00 H new ATOM 0 HD22 ASN A 151 9.376 -17.072 8.476 1.00 0.00 H new ATOM 2235 N GLN A 152 10.566 -15.170 2.650 1.00 0.00 N ATOM 2236 CA GLN A 152 9.905 -15.219 1.351 1.00 0.00 C ATOM 2237 C GLN A 152 8.391 -15.120 1.507 1.00 0.00 C ATOM 2238 O GLN A 152 7.637 -15.710 0.732 1.00 0.00 O ATOM 2239 CB GLN A 152 10.270 -16.511 0.617 1.00 0.00 C ATOM 2240 CG GLN A 152 11.698 -16.531 0.095 1.00 0.00 C ATOM 2241 CD GLN A 152 12.199 -17.934 -0.182 1.00 0.00 C ATOM 2242 OE1 GLN A 152 12.438 -18.305 -1.331 1.00 0.00 O ATOM 2243 NE2 GLN A 152 12.360 -18.724 0.874 1.00 0.00 N ATOM 0 H GLN A 152 11.371 -14.545 2.690 1.00 0.00 H new ATOM 0 HA GLN A 152 10.249 -14.367 0.765 1.00 0.00 H new ATOM 0 HB2 GLN A 152 10.127 -17.355 1.291 1.00 0.00 H new ATOM 0 HB3 GLN A 152 9.584 -16.651 -0.219 1.00 0.00 H new ATOM 0 HG2 GLN A 152 11.754 -15.942 -0.820 1.00 0.00 H new ATOM 0 HG3 GLN A 152 12.353 -16.052 0.823 1.00 0.00 H new ATOM 0 HE21 GLN A 152 12.150 -18.375 1.809 1.00 0.00 H new ATOM 0 HE22 GLN A 152 12.694 -19.680 0.750 1.00 0.00 H new ATOM 2252 N ARG A 153 7.952 -14.371 2.513 1.00 0.00 N ATOM 2253 CA ARG A 153 6.528 -14.196 2.771 1.00 0.00 C ATOM 2254 C ARG A 153 6.053 -12.826 2.296 1.00 0.00 C ATOM 2255 O ARG A 153 6.672 -11.805 2.596 1.00 0.00 O ATOM 2256 CB ARG A 153 6.235 -14.360 4.264 1.00 0.00 C ATOM 2257 CG ARG A 153 6.246 -15.806 4.732 1.00 0.00 C ATOM 2258 CD ARG A 153 4.964 -16.526 4.346 1.00 0.00 C ATOM 2259 NE ARG A 153 5.028 -17.955 4.642 1.00 0.00 N ATOM 2260 CZ ARG A 153 4.042 -18.805 4.380 1.00 0.00 C ATOM 2261 NH1 ARG A 153 2.921 -18.372 3.819 1.00 0.00 N ATOM 2262 NH2 ARG A 153 4.176 -20.091 4.678 1.00 0.00 N ATOM 0 H ARG A 153 8.562 -13.875 3.163 1.00 0.00 H new ATOM 0 HA ARG A 153 5.987 -14.961 2.215 1.00 0.00 H new ATOM 0 HB2 ARG A 153 6.974 -13.797 4.834 1.00 0.00 H new ATOM 0 HB3 ARG A 153 5.261 -13.923 4.485 1.00 0.00 H new ATOM 0 HG2 ARG A 153 7.101 -16.324 4.297 1.00 0.00 H new ATOM 0 HG3 ARG A 153 6.371 -15.838 5.814 1.00 0.00 H new ATOM 0 HD2 ARG A 153 4.124 -16.082 4.881 1.00 0.00 H new ATOM 0 HD3 ARG A 153 4.775 -16.384 3.282 1.00 0.00 H new ATOM 0 HE ARG A 153 5.877 -18.320 5.074 1.00 0.00 H new ATOM 0 HH11 ARG A 153 2.815 -17.384 3.588 1.00 0.00 H new ATOM 0 HH12 ARG A 153 2.165 -19.027 3.619 1.00 0.00 H new ATOM 0 HH21 ARG A 153 5.037 -20.428 5.109 1.00 0.00 H new ATOM 0 HH22 ARG A 153 3.418 -20.743 4.476 1.00 0.00 H new ATOM 2276 N PHE A 154 4.952 -12.813 1.552 1.00 0.00 N ATOM 2277 CA PHE A 154 4.395 -11.569 1.033 1.00 0.00 C ATOM 2278 C PHE A 154 2.947 -11.394 1.479 1.00 0.00 C ATOM 2279 O PHE A 154 2.097 -12.242 1.210 1.00 0.00 O ATOM 2280 CB PHE A 154 4.477 -11.547 -0.494 1.00 0.00 C ATOM 2281 CG PHE A 154 5.757 -12.116 -1.035 1.00 0.00 C ATOM 2282 CD1 PHE A 154 6.978 -11.560 -0.690 1.00 0.00 C ATOM 2283 CD2 PHE A 154 5.739 -13.208 -1.888 1.00 0.00 C ATOM 2284 CE1 PHE A 154 8.158 -12.082 -1.186 1.00 0.00 C ATOM 2285 CE2 PHE A 154 6.916 -13.735 -2.387 1.00 0.00 C ATOM 2286 CZ PHE A 154 8.127 -13.171 -2.035 1.00 0.00 C ATOM 0 H PHE A 154 4.428 -13.649 1.295 1.00 0.00 H new ATOM 0 HA PHE A 154 4.982 -10.742 1.433 1.00 0.00 H new ATOM 0 HB2 PHE A 154 3.638 -12.109 -0.903 1.00 0.00 H new ATOM 0 HB3 PHE A 154 4.371 -10.519 -0.841 1.00 0.00 H new ATOM 0 HD1 PHE A 154 7.008 -10.709 -0.026 1.00 0.00 H new ATOM 0 HD2 PHE A 154 4.795 -13.653 -2.166 1.00 0.00 H new ATOM 0 HE1 PHE A 154 9.103 -11.639 -0.910 1.00 0.00 H new ATOM 0 HE2 PHE A 154 6.889 -14.586 -3.051 1.00 0.00 H new ATOM 0 HZ PHE A 154 9.048 -13.581 -2.423 1.00 0.00 H new ATOM 2296 N GLU A 155 2.674 -10.287 2.164 1.00 0.00 N ATOM 2297 CA GLU A 155 1.328 -10.002 2.649 1.00 0.00 C ATOM 2298 C GLU A 155 0.675 -8.898 1.821 1.00 0.00 C ATOM 2299 O GLU A 155 1.215 -7.798 1.697 1.00 0.00 O ATOM 2300 CB GLU A 155 1.369 -9.593 4.122 1.00 0.00 C ATOM 2301 CG GLU A 155 1.841 -10.701 5.049 1.00 0.00 C ATOM 2302 CD GLU A 155 2.995 -11.496 4.467 1.00 0.00 C ATOM 2303 OE1 GLU A 155 4.027 -10.881 4.126 1.00 0.00 O ATOM 2304 OE2 GLU A 155 2.865 -12.733 4.355 1.00 0.00 O ATOM 0 H GLU A 155 3.366 -9.574 2.395 1.00 0.00 H new ATOM 0 HA GLU A 155 0.733 -10.909 2.548 1.00 0.00 H new ATOM 0 HB2 GLU A 155 2.029 -8.732 4.233 1.00 0.00 H new ATOM 0 HB3 GLU A 155 0.373 -9.273 4.429 1.00 0.00 H new ATOM 0 HG2 GLU A 155 2.147 -10.268 6.001 1.00 0.00 H new ATOM 0 HG3 GLU A 155 1.009 -11.374 5.258 1.00 0.00 H new ATOM 2311 N CYS A 156 -0.489 -9.201 1.258 1.00 0.00 N ATOM 2312 CA CYS A 156 -1.217 -8.236 0.441 1.00 0.00 C ATOM 2313 C CYS A 156 -2.282 -7.520 1.265 1.00 0.00 C ATOM 2314 O CYS A 156 -3.306 -8.106 1.618 1.00 0.00 O ATOM 2315 CB CYS A 156 -1.864 -8.934 -0.756 1.00 0.00 C ATOM 2316 SG CYS A 156 -2.070 -7.875 -2.207 1.00 0.00 S ATOM 0 H CYS A 156 -0.949 -10.107 1.352 1.00 0.00 H new ATOM 0 HA CYS A 156 -0.505 -7.495 0.078 1.00 0.00 H new ATOM 0 HB2 CYS A 156 -1.256 -9.796 -1.032 1.00 0.00 H new ATOM 0 HB3 CYS A 156 -2.840 -9.315 -0.456 1.00 0.00 H new ATOM 0 HG CYS A 156 -2.213 -8.614 -3.267 1.00 0.00 H new ATOM 2322 N HIS A 157 -2.034 -6.250 1.568 1.00 0.00 N ATOM 2323 CA HIS A 157 -2.972 -5.454 2.352 1.00 0.00 C ATOM 2324 C HIS A 157 -3.733 -4.477 1.461 1.00 0.00 C ATOM 2325 O HIS A 157 -3.133 -3.736 0.682 1.00 0.00 O ATOM 2326 CB HIS A 157 -2.232 -4.690 3.451 1.00 0.00 C ATOM 2327 CG HIS A 157 -1.414 -5.570 4.345 1.00 0.00 C ATOM 2328 ND1 HIS A 157 -1.953 -6.290 5.390 1.00 0.00 N ATOM 2329 CD2 HIS A 157 -0.089 -5.845 4.344 1.00 0.00 C ATOM 2330 CE1 HIS A 157 -0.994 -6.969 5.995 1.00 0.00 C ATOM 2331 NE2 HIS A 157 0.147 -6.717 5.379 1.00 0.00 N ATOM 0 H HIS A 157 -1.192 -5.750 1.283 1.00 0.00 H new ATOM 0 HA HIS A 157 -3.690 -6.133 2.812 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -1.580 -3.948 2.990 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -2.958 -4.146 4.056 1.00 0.00 H new ATOM 0 HD2 HIS A 157 0.646 -5.452 3.657 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -1.122 -7.619 6.848 1.00 0.00 H new ATOM 0 HE2 HIS A 157 1.055 -7.106 5.631 1.00 0.00 H new ATOM 2339 N VAL A 158 -5.056 -4.482 1.580 1.00 0.00 N ATOM 2340 CA VAL A 158 -5.899 -3.596 0.785 1.00 0.00 C ATOM 2341 C VAL A 158 -6.559 -2.536 1.659 1.00 0.00 C ATOM 2342 O VAL A 158 -6.889 -2.788 2.818 1.00 0.00 O ATOM 2343 CB VAL A 158 -6.992 -4.382 0.037 1.00 0.00 C ATOM 2344 CG1 VAL A 158 -7.804 -3.454 -0.853 1.00 0.00 C ATOM 2345 CG2 VAL A 158 -6.374 -5.509 -0.777 1.00 0.00 C ATOM 0 H VAL A 158 -5.568 -5.090 2.219 1.00 0.00 H new ATOM 0 HA VAL A 158 -5.249 -3.110 0.057 1.00 0.00 H new ATOM 0 HB VAL A 158 -7.666 -4.822 0.772 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -8.571 -4.028 -1.373 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -8.277 -2.686 -0.242 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -7.146 -2.982 -1.583 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -7.160 -6.054 -1.299 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -5.677 -5.093 -1.504 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -5.842 -6.189 -0.112 1.00 0.00 H new ATOM 2355 N PHE A 159 -6.751 -1.348 1.095 1.00 0.00 N ATOM 2356 CA PHE A 159 -7.372 -0.247 1.823 1.00 0.00 C ATOM 2357 C PHE A 159 -8.209 0.620 0.888 1.00 0.00 C ATOM 2358 O PHE A 159 -7.750 1.018 -0.183 1.00 0.00 O ATOM 2359 CB PHE A 159 -6.303 0.607 2.509 1.00 0.00 C ATOM 2360 CG PHE A 159 -5.331 -0.193 3.328 1.00 0.00 C ATOM 2361 CD1 PHE A 159 -4.269 -0.846 2.724 1.00 0.00 C ATOM 2362 CD2 PHE A 159 -5.480 -0.293 4.702 1.00 0.00 C ATOM 2363 CE1 PHE A 159 -3.372 -1.583 3.474 1.00 0.00 C ATOM 2364 CE2 PHE A 159 -4.586 -1.028 5.457 1.00 0.00 C ATOM 2365 CZ PHE A 159 -3.532 -1.675 4.843 1.00 0.00 C ATOM 0 H PHE A 159 -6.486 -1.123 0.136 1.00 0.00 H new ATOM 0 HA PHE A 159 -8.030 -0.672 2.582 1.00 0.00 H new ATOM 0 HB2 PHE A 159 -5.754 1.165 1.751 1.00 0.00 H new ATOM 0 HB3 PHE A 159 -6.792 1.339 3.152 1.00 0.00 H new ATOM 0 HD1 PHE A 159 -4.140 -0.778 1.654 1.00 0.00 H new ATOM 0 HD2 PHE A 159 -6.304 0.209 5.188 1.00 0.00 H new ATOM 0 HE1 PHE A 159 -2.548 -2.086 2.991 1.00 0.00 H new ATOM 0 HE2 PHE A 159 -4.712 -1.096 6.527 1.00 0.00 H new ATOM 0 HZ PHE A 159 -2.834 -2.252 5.432 1.00 0.00 H new ATOM 2375 N TRP A 160 -9.438 0.908 1.300 1.00 0.00 N ATOM 2376 CA TRP A 160 -10.340 1.727 0.499 1.00 0.00 C ATOM 2377 C TRP A 160 -10.072 3.211 0.723 1.00 0.00 C ATOM 2378 O TRP A 160 -10.003 3.674 1.863 1.00 0.00 O ATOM 2379 CB TRP A 160 -11.796 1.403 0.839 1.00 0.00 C ATOM 2380 CG TRP A 160 -12.782 2.074 -0.067 1.00 0.00 C ATOM 2381 CD1 TRP A 160 -13.259 3.349 0.042 1.00 0.00 C ATOM 2382 CD2 TRP A 160 -13.413 1.505 -1.219 1.00 0.00 C ATOM 2383 NE1 TRP A 160 -14.149 3.607 -0.973 1.00 0.00 N ATOM 2384 CE2 TRP A 160 -14.260 2.492 -1.761 1.00 0.00 C ATOM 2385 CE3 TRP A 160 -13.344 0.258 -1.847 1.00 0.00 C ATOM 2386 CZ2 TRP A 160 -15.031 2.268 -2.899 1.00 0.00 C ATOM 2387 CZ3 TRP A 160 -14.110 0.038 -2.976 1.00 0.00 C ATOM 2388 CH2 TRP A 160 -14.944 1.038 -3.493 1.00 0.00 C ATOM 0 H TRP A 160 -9.833 0.587 2.184 1.00 0.00 H new ATOM 0 HA TRP A 160 -10.160 1.498 -0.551 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -11.942 0.324 0.787 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -11.996 1.703 1.868 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -12.978 4.051 0.813 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -14.646 4.486 -1.116 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -12.704 -0.519 -1.457 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -15.675 3.038 -3.299 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -14.065 -0.922 -3.469 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -15.530 0.834 -4.377 1.00 0.00 H new ATOM 2399 N CYS A 161 -9.921 3.953 -0.369 1.00 0.00 N ATOM 2400 CA CYS A 161 -9.659 5.385 -0.290 1.00 0.00 C ATOM 2401 C CYS A 161 -10.735 6.176 -1.027 1.00 0.00 C ATOM 2402 O CYS A 161 -11.291 5.708 -2.020 1.00 0.00 O ATOM 2403 CB CYS A 161 -8.283 5.706 -0.875 1.00 0.00 C ATOM 2404 SG CYS A 161 -6.955 4.643 -0.263 1.00 0.00 S ATOM 0 H CYS A 161 -9.976 3.586 -1.319 1.00 0.00 H new ATOM 0 HA CYS A 161 -9.676 5.675 0.761 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -8.332 5.619 -1.960 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -8.037 6.743 -0.649 1.00 0.00 H new ATOM 0 HG CYS A 161 -5.880 4.844 -0.965 1.00 0.00 H new ATOM 2410 N GLU A 162 -11.024 7.376 -0.533 1.00 0.00 N ATOM 2411 CA GLU A 162 -12.036 8.230 -1.144 1.00 0.00 C ATOM 2412 C GLU A 162 -11.654 9.702 -1.017 1.00 0.00 C ATOM 2413 O GLU A 162 -10.888 10.097 -0.138 1.00 0.00 O ATOM 2414 CB GLU A 162 -13.400 7.987 -0.494 1.00 0.00 C ATOM 2415 CG GLU A 162 -13.318 7.655 0.987 1.00 0.00 C ATOM 2416 CD GLU A 162 -12.956 8.859 1.835 1.00 0.00 C ATOM 2417 OE1 GLU A 162 -13.516 9.948 1.591 1.00 0.00 O ATOM 2418 OE2 GLU A 162 -12.112 8.711 2.744 1.00 0.00 O ATOM 0 H GLU A 162 -10.572 7.778 0.288 1.00 0.00 H new ATOM 0 HA GLU A 162 -12.097 7.978 -2.203 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -14.019 8.875 -0.625 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -13.900 7.170 -1.014 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -14.276 7.256 1.320 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -12.576 6.871 1.139 1.00 0.00 H new ATOM 2425 N PRO A 163 -12.201 10.534 -1.916 1.00 0.00 N ATOM 2426 CA PRO A 163 -13.114 10.075 -2.967 1.00 0.00 C ATOM 2427 C PRO A 163 -12.404 9.238 -4.026 1.00 0.00 C ATOM 2428 O PRO A 163 -13.029 8.753 -4.968 1.00 0.00 O ATOM 2429 CB PRO A 163 -13.637 11.378 -3.576 1.00 0.00 C ATOM 2430 CG PRO A 163 -12.572 12.381 -3.295 1.00 0.00 C ATOM 2431 CD PRO A 163 -11.969 11.986 -1.976 1.00 0.00 C ATOM 0 HA PRO A 163 -13.898 9.428 -2.573 1.00 0.00 H new ATOM 0 HB2 PRO A 163 -13.810 11.273 -4.647 1.00 0.00 H new ATOM 0 HB3 PRO A 163 -14.586 11.672 -3.127 1.00 0.00 H new ATOM 0 HG2 PRO A 163 -11.819 12.382 -4.083 1.00 0.00 H new ATOM 0 HG3 PRO A 163 -12.987 13.388 -3.249 1.00 0.00 H new ATOM 0 HD2 PRO A 163 -10.906 12.225 -1.932 1.00 0.00 H new ATOM 0 HD3 PRO A 163 -12.447 12.504 -1.144 1.00 0.00 H new ATOM 2439 N ASN A 164 -11.095 9.073 -3.865 1.00 0.00 N ATOM 2440 CA ASN A 164 -10.301 8.295 -4.808 1.00 0.00 C ATOM 2441 C ASN A 164 -8.985 7.853 -4.176 1.00 0.00 C ATOM 2442 O ASN A 164 -8.657 8.250 -3.058 1.00 0.00 O ATOM 2443 CB ASN A 164 -10.024 9.114 -6.071 1.00 0.00 C ATOM 2444 CG ASN A 164 -9.530 10.513 -5.756 1.00 0.00 C ATOM 2445 OD1 ASN A 164 -9.470 10.914 -4.593 1.00 0.00 O ATOM 2446 ND2 ASN A 164 -9.175 11.262 -6.793 1.00 0.00 N ATOM 0 H ASN A 164 -10.562 9.468 -3.090 1.00 0.00 H new ATOM 0 HA ASN A 164 -10.871 7.406 -5.077 1.00 0.00 H new ATOM 0 HB2 ASN A 164 -9.282 8.598 -6.680 1.00 0.00 H new ATOM 0 HB3 ASN A 164 -10.935 9.179 -6.666 1.00 0.00 H new ATOM 0 HD21 ASN A 164 -8.836 12.212 -6.643 1.00 0.00 H new ATOM 0 HD22 ASN A 164 -9.242 10.887 -7.739 1.00 0.00 H new ATOM 2453 N ALA A 165 -8.235 7.028 -4.900 1.00 0.00 N ATOM 2454 CA ALA A 165 -6.953 6.534 -4.412 1.00 0.00 C ATOM 2455 C ALA A 165 -5.793 7.282 -5.060 1.00 0.00 C ATOM 2456 O ALA A 165 -4.706 6.732 -5.232 1.00 0.00 O ATOM 2457 CB ALA A 165 -6.831 5.040 -4.670 1.00 0.00 C ATOM 0 H ALA A 165 -8.493 6.688 -5.826 1.00 0.00 H new ATOM 0 HA ALA A 165 -6.909 6.711 -3.337 1.00 0.00 H new ATOM 0 HB1 ALA A 165 -5.869 4.684 -4.301 1.00 0.00 H new ATOM 0 HB2 ALA A 165 -7.635 4.515 -4.154 1.00 0.00 H new ATOM 0 HB3 ALA A 165 -6.902 4.849 -5.741 1.00 0.00 H new ATOM 2463 N ALA A 166 -6.032 8.539 -5.418 1.00 0.00 N ATOM 2464 CA ALA A 166 -5.007 9.363 -6.046 1.00 0.00 C ATOM 2465 C ALA A 166 -4.063 9.954 -5.004 1.00 0.00 C ATOM 2466 O ALA A 166 -2.844 9.918 -5.166 1.00 0.00 O ATOM 2467 CB ALA A 166 -5.649 10.470 -6.868 1.00 0.00 C ATOM 0 H ALA A 166 -6.927 9.009 -5.284 1.00 0.00 H new ATOM 0 HA ALA A 166 -4.421 8.727 -6.710 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -4.871 11.077 -7.331 1.00 0.00 H new ATOM 0 HB2 ALA A 166 -6.276 10.030 -7.644 1.00 0.00 H new ATOM 0 HB3 ALA A 166 -6.261 11.097 -6.219 1.00 0.00 H new ATOM 2473 N ASN A 167 -4.635 10.499 -3.936 1.00 0.00 N ATOM 2474 CA ASN A 167 -3.845 11.100 -2.868 1.00 0.00 C ATOM 2475 C ASN A 167 -2.968 10.053 -2.186 1.00 0.00 C ATOM 2476 O ASN A 167 -1.743 10.169 -2.170 1.00 0.00 O ATOM 2477 CB ASN A 167 -4.761 11.763 -1.838 1.00 0.00 C ATOM 2478 CG ASN A 167 -5.917 12.503 -2.484 1.00 0.00 C ATOM 2479 OD1 ASN A 167 -6.934 11.903 -2.832 1.00 0.00 O ATOM 2480 ND2 ASN A 167 -5.764 13.812 -2.647 1.00 0.00 N ATOM 0 H ASN A 167 -5.643 10.537 -3.787 1.00 0.00 H new ATOM 0 HA ASN A 167 -3.199 11.858 -3.310 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -5.152 11.003 -1.161 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -4.180 12.459 -1.234 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -6.507 14.363 -3.076 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -4.903 14.267 -2.343 1.00 0.00 H new ATOM 2487 N VAL A 168 -3.605 9.032 -1.623 1.00 0.00 N ATOM 2488 CA VAL A 168 -2.884 7.964 -0.940 1.00 0.00 C ATOM 2489 C VAL A 168 -1.735 7.443 -1.796 1.00 0.00 C ATOM 2490 O VAL A 168 -0.566 7.699 -1.506 1.00 0.00 O ATOM 2491 CB VAL A 168 -3.819 6.792 -0.588 1.00 0.00 C ATOM 2492 CG1 VAL A 168 -3.015 5.588 -0.121 1.00 0.00 C ATOM 2493 CG2 VAL A 168 -4.826 7.214 0.472 1.00 0.00 C ATOM 0 H VAL A 168 -4.619 8.921 -1.626 1.00 0.00 H new ATOM 0 HA VAL A 168 -2.484 8.390 -0.020 1.00 0.00 H new ATOM 0 HB VAL A 168 -4.368 6.506 -1.485 1.00 0.00 H new ATOM 0 HG11 VAL A 168 -3.693 4.770 0.123 1.00 0.00 H new ATOM 0 HG12 VAL A 168 -2.337 5.273 -0.915 1.00 0.00 H new ATOM 0 HG13 VAL A 168 -2.438 5.857 0.764 1.00 0.00 H new ATOM 0 HG21 VAL A 168 -5.479 6.374 0.709 1.00 0.00 H new ATOM 0 HG22 VAL A 168 -4.297 7.527 1.372 1.00 0.00 H new ATOM 0 HG23 VAL A 168 -5.425 8.044 0.095 1.00 0.00 H new ATOM 2503 N SER A 169 -2.075 6.711 -2.852 1.00 0.00 N ATOM 2504 CA SER A 169 -1.071 6.150 -3.749 1.00 0.00 C ATOM 2505 C SER A 169 0.057 7.149 -3.993 1.00 0.00 C ATOM 2506 O SER A 169 1.233 6.822 -3.837 1.00 0.00 O ATOM 2507 CB SER A 169 -1.711 5.751 -5.080 1.00 0.00 C ATOM 2508 OG SER A 169 -2.286 4.458 -5.001 1.00 0.00 O ATOM 0 H SER A 169 -3.038 6.492 -3.108 1.00 0.00 H new ATOM 0 HA SER A 169 -0.652 5.262 -3.276 1.00 0.00 H new ATOM 0 HB2 SER A 169 -2.477 6.477 -5.351 1.00 0.00 H new ATOM 0 HB3 SER A 169 -0.959 5.771 -5.869 1.00 0.00 H new ATOM 0 HG SER A 169 -2.049 4.046 -4.144 1.00 0.00 H new ATOM 2514 N GLU A 170 -0.312 8.366 -4.378 1.00 0.00 N ATOM 2515 CA GLU A 170 0.668 9.412 -4.646 1.00 0.00 C ATOM 2516 C GLU A 170 1.663 9.532 -3.495 1.00 0.00 C ATOM 2517 O GLU A 170 2.874 9.452 -3.696 1.00 0.00 O ATOM 2518 CB GLU A 170 -0.033 10.754 -4.870 1.00 0.00 C ATOM 2519 CG GLU A 170 0.914 11.942 -4.875 1.00 0.00 C ATOM 2520 CD GLU A 170 1.676 12.076 -6.178 1.00 0.00 C ATOM 2521 OE1 GLU A 170 1.087 12.572 -7.161 1.00 0.00 O ATOM 2522 OE2 GLU A 170 2.861 11.684 -6.216 1.00 0.00 O ATOM 0 H GLU A 170 -1.282 8.652 -4.511 1.00 0.00 H new ATOM 0 HA GLU A 170 1.214 9.140 -5.550 1.00 0.00 H new ATOM 0 HB2 GLU A 170 -0.567 10.721 -5.820 1.00 0.00 H new ATOM 0 HB3 GLU A 170 -0.780 10.899 -4.090 1.00 0.00 H new ATOM 0 HG2 GLU A 170 0.346 12.855 -4.695 1.00 0.00 H new ATOM 0 HG3 GLU A 170 1.623 11.840 -4.053 1.00 0.00 H new ATOM 2529 N ALA A 171 1.141 9.726 -2.288 1.00 0.00 N ATOM 2530 CA ALA A 171 1.983 9.856 -1.104 1.00 0.00 C ATOM 2531 C ALA A 171 2.930 8.669 -0.971 1.00 0.00 C ATOM 2532 O ALA A 171 4.106 8.833 -0.647 1.00 0.00 O ATOM 2533 CB ALA A 171 1.122 9.990 0.143 1.00 0.00 C ATOM 0 H ALA A 171 0.140 9.797 -2.104 1.00 0.00 H new ATOM 0 HA ALA A 171 2.586 10.757 -1.214 1.00 0.00 H new ATOM 0 HB1 ALA A 171 1.763 10.086 1.019 1.00 0.00 H new ATOM 0 HB2 ALA A 171 0.491 10.875 0.056 1.00 0.00 H new ATOM 0 HB3 ALA A 171 0.494 9.105 0.248 1.00 0.00 H new ATOM 2539 N VAL A 172 2.409 7.471 -1.221 1.00 0.00 N ATOM 2540 CA VAL A 172 3.209 6.256 -1.129 1.00 0.00 C ATOM 2541 C VAL A 172 4.306 6.238 -2.188 1.00 0.00 C ATOM 2542 O VAL A 172 5.415 5.769 -1.937 1.00 0.00 O ATOM 2543 CB VAL A 172 2.336 4.996 -1.289 1.00 0.00 C ATOM 2544 CG1 VAL A 172 3.182 3.740 -1.154 1.00 0.00 C ATOM 2545 CG2 VAL A 172 1.205 5.000 -0.271 1.00 0.00 C ATOM 0 H VAL A 172 1.437 7.317 -1.489 1.00 0.00 H new ATOM 0 HA VAL A 172 3.664 6.251 -0.139 1.00 0.00 H new ATOM 0 HB VAL A 172 1.897 5.003 -2.286 1.00 0.00 H new ATOM 0 HG11 VAL A 172 2.549 2.861 -1.270 1.00 0.00 H new ATOM 0 HG12 VAL A 172 3.953 3.736 -1.925 1.00 0.00 H new ATOM 0 HG13 VAL A 172 3.652 3.722 -0.171 1.00 0.00 H new ATOM 0 HG21 VAL A 172 0.598 4.103 -0.398 1.00 0.00 H new ATOM 0 HG22 VAL A 172 1.622 5.017 0.736 1.00 0.00 H new ATOM 0 HG23 VAL A 172 0.584 5.883 -0.421 1.00 0.00 H new ATOM 2555 N GLN A 173 3.987 6.753 -3.371 1.00 0.00 N ATOM 2556 CA GLN A 173 4.946 6.796 -4.468 1.00 0.00 C ATOM 2557 C GLN A 173 6.116 7.715 -4.133 1.00 0.00 C ATOM 2558 O GLN A 173 7.265 7.279 -4.078 1.00 0.00 O ATOM 2559 CB GLN A 173 4.263 7.268 -5.753 1.00 0.00 C ATOM 2560 CG GLN A 173 5.182 7.275 -6.964 1.00 0.00 C ATOM 2561 CD GLN A 173 4.684 8.185 -8.069 1.00 0.00 C ATOM 2562 OE1 GLN A 173 5.129 9.326 -8.197 1.00 0.00 O ATOM 2563 NE2 GLN A 173 3.756 7.683 -8.876 1.00 0.00 N ATOM 0 H GLN A 173 3.073 7.146 -3.594 1.00 0.00 H new ATOM 0 HA GLN A 173 5.332 5.788 -4.619 1.00 0.00 H new ATOM 0 HB2 GLN A 173 3.409 6.622 -5.959 1.00 0.00 H new ATOM 0 HB3 GLN A 173 3.872 8.274 -5.598 1.00 0.00 H new ATOM 0 HG2 GLN A 173 6.178 7.594 -6.657 1.00 0.00 H new ATOM 0 HG3 GLN A 173 5.277 6.260 -7.349 1.00 0.00 H new ATOM 0 HE21 GLN A 173 3.416 6.732 -8.733 1.00 0.00 H new ATOM 0 HE22 GLN A 173 3.383 8.248 -9.639 1.00 0.00 H new ATOM 2572 N ALA A 174 5.815 8.990 -3.910 1.00 0.00 N ATOM 2573 CA ALA A 174 6.841 9.971 -3.579 1.00 0.00 C ATOM 2574 C ALA A 174 7.663 9.520 -2.376 1.00 0.00 C ATOM 2575 O ALA A 174 8.884 9.672 -2.355 1.00 0.00 O ATOM 2576 CB ALA A 174 6.207 11.327 -3.308 1.00 0.00 C ATOM 0 H ALA A 174 4.869 9.368 -3.953 1.00 0.00 H new ATOM 0 HA ALA A 174 7.512 10.060 -4.433 1.00 0.00 H new ATOM 0 HB1 ALA A 174 6.985 12.050 -3.062 1.00 0.00 H new ATOM 0 HB2 ALA A 174 5.669 11.661 -4.195 1.00 0.00 H new ATOM 0 HB3 ALA A 174 5.512 11.243 -2.472 1.00 0.00 H new ATOM 2582 N ALA A 175 6.986 8.965 -1.377 1.00 0.00 N ATOM 2583 CA ALA A 175 7.655 8.490 -0.171 1.00 0.00 C ATOM 2584 C ALA A 175 8.883 7.655 -0.517 1.00 0.00 C ATOM 2585 O ALA A 175 9.927 7.775 0.124 1.00 0.00 O ATOM 2586 CB ALA A 175 6.690 7.684 0.685 1.00 0.00 C ATOM 0 H ALA A 175 5.975 8.833 -1.378 1.00 0.00 H new ATOM 0 HA ALA A 175 7.988 9.359 0.397 1.00 0.00 H new ATOM 0 HB1 ALA A 175 7.203 7.336 1.582 1.00 0.00 H new ATOM 0 HB2 ALA A 175 5.846 8.311 0.970 1.00 0.00 H new ATOM 0 HB3 ALA A 175 6.329 6.826 0.117 1.00 0.00 H new ATOM 2592 N CYS A 176 8.750 6.810 -1.533 1.00 0.00 N ATOM 2593 CA CYS A 176 9.850 5.953 -1.963 1.00 0.00 C ATOM 2594 C CYS A 176 11.119 6.769 -2.187 1.00 0.00 C ATOM 2595 O CYS A 176 12.211 6.215 -2.305 1.00 0.00 O ATOM 2596 CB CYS A 176 9.473 5.210 -3.246 1.00 0.00 C ATOM 2597 SG CYS A 176 8.050 4.108 -3.070 1.00 0.00 S ATOM 0 H CYS A 176 7.893 6.700 -2.074 1.00 0.00 H new ATOM 0 HA CYS A 176 10.042 5.226 -1.174 1.00 0.00 H new ATOM 0 HB2 CYS A 176 9.259 5.940 -4.026 1.00 0.00 H new ATOM 0 HB3 CYS A 176 10.331 4.627 -3.581 1.00 0.00 H new ATOM 0 HG CYS A 176 7.038 4.777 -2.603 1.00 0.00 H new