USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 665 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 39 HIS : no HD1:sc= 1.12 K(o=2.4,f=-3.4!) USER MOD Set 1.2: A 41 SER OG : rot -114:sc= 1.28 USER MOD Set 2.1: A 33 SER OG : rot 180:sc= 0.00207 USER MOD Set 2.2: A 34 HIS : no HD1:sc= -0.0439 X(o=-0.042,f=-0.09) USER MOD Set 3.1: A 23 CYS SG : rot -176:sc= 2.64 USER MOD Set 3.2: A 26 CYS SG : rot 20:sc= 0.486 USER MOD Set 3.3: A 71 CYS SG : rot -77:sc= -8.13! USER MOD Set 3.4: A 73 LYS NZ :NH3+ 138:sc= -1.13 (180deg=-1.07) USER MOD Set 3.5: A 74 CYS SG : rot -134:sc= -8.61! USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.014) USER MOD Single : A 27 SER OG : rot -25:sc= 0.923 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0.0262 USER MOD Single : A 35 SER OG : rot 104:sc= 0.564 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 99:sc= 1.26 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.0242 USER MOD Single : A 57 LYS NZ :NH3+ -178:sc= 0.8 (180deg=0.797) USER MOD Single : A 58 CYS SG : rot -8:sc= -0.28 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= -0.0642 K(o=-0.064,f=-3.4!) USER MOD Single : A 68 LYS NZ :NH3+ -144:sc= 1.18 (180deg=-0.262) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= 0.23 X(o=0.23,f=-0.15) USER MOD Single : A 80 HIS : no HE2:sc= 0.206 K(o=0.21,f=-0.71) USER MOD Single : A 84 ASN : amide:sc= -0.081 X(o=-0.081,f=-0.0007) USER MOD Single : A 88 LYS NZ :NH3+ -152:sc= -0.35 (180deg=-1.33) USER MOD Single : A 91 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 92 SER OG : rot 166:sc= 1.28 USER MOD Single : A 95 CYS SG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot -42:sc= 0.0907 USER MOD Single : A 100 SER OG : rot -149:sc= -0.472 USER MOD Single : A 102 LYS NZ :NH3+ 171:sc= -0.0102 (180deg=-0.111) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 261 N PRO A 18 56.323 49.462 47.380 1.00 0.00 N ATOM 262 CA PRO A 18 57.719 49.896 47.391 1.00 0.00 C ATOM 263 C PRO A 18 58.570 49.066 48.362 1.00 0.00 C ATOM 264 O PRO A 18 58.179 48.815 49.505 1.00 0.00 O ATOM 265 CB PRO A 18 57.684 51.382 47.763 1.00 0.00 C ATOM 266 CG PRO A 18 56.435 51.494 48.637 1.00 0.00 C ATOM 267 CD PRO A 18 55.482 50.466 48.025 1.00 0.00 C ATOM 0 HA PRO A 18 58.192 49.748 46.420 1.00 0.00 H new ATOM 0 HB2 PRO A 18 58.582 51.683 48.303 1.00 0.00 H new ATOM 0 HB3 PRO A 18 57.616 52.017 46.880 1.00 0.00 H new ATOM 0 HG2 PRO A 18 56.653 51.268 49.681 1.00 0.00 H new ATOM 0 HG3 PRO A 18 56.014 52.499 48.609 1.00 0.00 H new ATOM 0 HD2 PRO A 18 54.854 50.013 48.792 1.00 0.00 H new ATOM 0 HD3 PRO A 18 54.814 50.936 47.303 1.00 0.00 H new ATOM 275 N GLY A 19 59.769 48.668 47.930 1.00 0.00 N ATOM 276 CA GLY A 19 60.661 47.810 48.712 1.00 0.00 C ATOM 277 C GLY A 19 61.929 47.377 47.975 1.00 0.00 C ATOM 278 O GLY A 19 62.155 47.777 46.829 1.00 0.00 O ATOM 0 H GLY A 19 60.150 48.934 47.022 1.00 0.00 H new ATOM 0 HA2 GLY A 19 60.947 48.338 49.622 1.00 0.00 H new ATOM 0 HA3 GLY A 19 60.112 46.920 49.019 1.00 0.00 H new ATOM 282 N VAL A 20 62.768 46.580 48.642 1.00 0.00 N ATOM 283 CA VAL A 20 64.069 46.114 48.133 1.00 0.00 C ATOM 284 C VAL A 20 64.412 44.698 48.554 1.00 0.00 C ATOM 285 O VAL A 20 63.712 44.032 49.302 1.00 0.00 O ATOM 286 CB VAL A 20 65.167 47.092 48.580 1.00 0.00 C ATOM 287 CG1 VAL A 20 65.512 47.042 50.069 1.00 0.00 C ATOM 288 CG2 VAL A 20 66.456 47.139 47.744 1.00 0.00 C ATOM 0 H VAL A 20 62.559 46.229 49.577 1.00 0.00 H new ATOM 0 HA VAL A 20 64.001 46.091 47.045 1.00 0.00 H new ATOM 0 HB VAL A 20 64.653 48.031 48.376 1.00 0.00 H new ATOM 0 HG11 VAL A 20 66.296 47.768 50.285 1.00 0.00 H new ATOM 0 HG12 VAL A 20 64.625 47.280 50.656 1.00 0.00 H new ATOM 0 HG13 VAL A 20 65.861 46.042 50.328 1.00 0.00 H new ATOM 0 HG21 VAL A 20 67.141 47.870 48.173 1.00 0.00 H new ATOM 0 HG22 VAL A 20 66.927 46.156 47.746 1.00 0.00 H new ATOM 0 HG23 VAL A 20 66.215 47.424 46.720 1.00 0.00 H new ATOM 298 N TYR A 21 65.564 44.286 48.066 1.00 0.00 N ATOM 299 CA TYR A 21 66.188 42.980 48.310 1.00 0.00 C ATOM 300 C TYR A 21 67.370 43.074 49.282 1.00 0.00 C ATOM 301 O TYR A 21 68.036 44.106 49.309 1.00 0.00 O ATOM 302 CB TYR A 21 66.622 42.370 46.973 1.00 0.00 C ATOM 303 CG TYR A 21 65.476 41.774 46.178 1.00 0.00 C ATOM 304 CD1 TYR A 21 65.094 40.440 46.413 1.00 0.00 C ATOM 305 CD2 TYR A 21 64.792 42.536 45.213 1.00 0.00 C ATOM 306 CE1 TYR A 21 64.059 39.853 45.663 1.00 0.00 C ATOM 307 CE2 TYR A 21 63.764 41.953 44.447 1.00 0.00 C ATOM 308 CZ TYR A 21 63.399 40.606 44.671 1.00 0.00 C ATOM 309 OH TYR A 21 62.419 40.029 43.929 1.00 0.00 O ATOM 0 H TYR A 21 66.128 44.876 47.455 1.00 0.00 H new ATOM 0 HA TYR A 21 65.451 42.332 48.784 1.00 0.00 H new ATOM 0 HB2 TYR A 21 67.108 43.139 46.373 1.00 0.00 H new ATOM 0 HB3 TYR A 21 67.365 41.595 47.161 1.00 0.00 H new ATOM 0 HD1 TYR A 21 65.599 39.863 47.174 1.00 0.00 H new ATOM 0 HD2 TYR A 21 65.056 43.572 45.059 1.00 0.00 H new ATOM 0 HE1 TYR A 21 63.771 38.828 45.847 1.00 0.00 H new ATOM 0 HE2 TYR A 21 63.256 42.533 43.691 1.00 0.00 H new ATOM 0 HH TYR A 21 62.065 40.682 43.290 1.00 0.00 H new ATOM 319 N VAL A 22 67.651 42.008 50.050 1.00 0.00 N ATOM 320 CA VAL A 22 68.856 41.892 50.902 1.00 0.00 C ATOM 321 C VAL A 22 69.470 40.498 50.857 1.00 0.00 C ATOM 322 O VAL A 22 68.742 39.510 50.747 1.00 0.00 O ATOM 323 CB VAL A 22 68.648 42.293 52.382 1.00 0.00 C ATOM 324 CG1 VAL A 22 67.538 43.328 52.593 1.00 0.00 C ATOM 325 CG2 VAL A 22 68.282 41.158 53.353 1.00 0.00 C ATOM 0 H VAL A 22 67.043 41.190 50.100 1.00 0.00 H new ATOM 0 HA VAL A 22 69.541 42.616 50.461 1.00 0.00 H new ATOM 0 HB VAL A 22 69.642 42.679 52.607 1.00 0.00 H new ATOM 0 HG11 VAL A 22 67.452 43.558 53.655 1.00 0.00 H new ATOM 0 HG12 VAL A 22 67.779 44.238 52.043 1.00 0.00 H new ATOM 0 HG13 VAL A 22 66.592 42.926 52.231 1.00 0.00 H new ATOM 0 HG21 VAL A 22 68.163 41.563 54.358 1.00 0.00 H new ATOM 0 HG22 VAL A 22 67.348 40.694 53.035 1.00 0.00 H new ATOM 0 HG23 VAL A 22 69.076 40.411 53.355 1.00 0.00 H new ATOM 335 N CYS A 23 70.788 40.407 51.055 1.00 0.00 N ATOM 336 CA CYS A 23 71.494 39.123 50.970 1.00 0.00 C ATOM 337 C CYS A 23 71.018 38.138 52.062 1.00 0.00 C ATOM 338 O CYS A 23 70.733 38.518 53.203 1.00 0.00 O ATOM 339 CB CYS A 23 73.028 39.321 50.946 1.00 0.00 C ATOM 340 SG CYS A 23 73.854 37.736 50.685 1.00 0.00 S ATOM 0 H CYS A 23 71.387 41.203 51.274 1.00 0.00 H new ATOM 0 HA CYS A 23 71.236 38.658 50.018 1.00 0.00 H new ATOM 0 HB2 CYS A 23 73.300 40.017 50.153 1.00 0.00 H new ATOM 0 HB3 CYS A 23 73.360 39.763 51.885 1.00 0.00 H new ATOM 0 HG CYS A 23 75.142 37.900 50.758 1.00 0.00 H new ATOM 345 N ALA A 24 71.017 36.847 51.726 1.00 0.00 N ATOM 346 CA ALA A 24 70.826 35.789 52.712 1.00 0.00 C ATOM 347 C ALA A 24 71.973 35.711 53.741 1.00 0.00 C ATOM 348 O ALA A 24 71.791 35.090 54.789 1.00 0.00 O ATOM 349 CB ALA A 24 70.623 34.443 52.016 1.00 0.00 C ATOM 0 H ALA A 24 71.147 36.510 50.772 1.00 0.00 H new ATOM 0 HA ALA A 24 69.927 36.038 53.275 1.00 0.00 H new ATOM 0 HB1 ALA A 24 70.482 33.664 52.765 1.00 0.00 H new ATOM 0 HB2 ALA A 24 69.743 34.494 51.375 1.00 0.00 H new ATOM 0 HB3 ALA A 24 71.499 34.210 51.411 1.00 0.00 H new ATOM 355 N LYS A 25 73.132 36.336 53.475 1.00 0.00 N ATOM 356 CA LYS A 25 74.319 36.307 54.345 1.00 0.00 C ATOM 357 C LYS A 25 75.000 37.643 54.599 1.00 0.00 C ATOM 358 O LYS A 25 75.247 37.977 55.754 1.00 0.00 O ATOM 359 CB LYS A 25 75.326 35.294 53.810 1.00 0.00 C ATOM 360 CG LYS A 25 75.398 34.086 54.753 1.00 0.00 C ATOM 361 CD LYS A 25 76.668 33.298 54.497 1.00 0.00 C ATOM 362 CE LYS A 25 76.977 32.261 55.583 1.00 0.00 C ATOM 363 NZ LYS A 25 75.861 31.314 55.803 1.00 0.00 N ATOM 0 H LYS A 25 73.273 36.888 52.629 1.00 0.00 H new ATOM 0 HA LYS A 25 73.938 36.012 55.323 1.00 0.00 H new ATOM 0 HB2 LYS A 25 75.034 34.970 52.811 1.00 0.00 H new ATOM 0 HB3 LYS A 25 76.309 35.757 53.721 1.00 0.00 H new ATOM 0 HG2 LYS A 25 75.373 34.422 55.790 1.00 0.00 H new ATOM 0 HG3 LYS A 25 74.528 33.446 54.604 1.00 0.00 H new ATOM 0 HD2 LYS A 25 76.583 32.791 53.536 1.00 0.00 H new ATOM 0 HD3 LYS A 25 77.506 33.991 54.419 1.00 0.00 H new ATOM 0 HE2 LYS A 25 77.871 31.704 55.304 1.00 0.00 H new ATOM 0 HE3 LYS A 25 77.201 32.775 56.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 76.154 30.585 56.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 75.038 31.828 56.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 75.606 30.863 54.901 1.00 0.00 H new ATOM 377 N CYS A 26 75.246 38.417 53.549 1.00 0.00 N ATOM 378 CA CYS A 26 75.863 39.731 53.654 1.00 0.00 C ATOM 379 C CYS A 26 74.895 40.693 54.386 1.00 0.00 C ATOM 380 O CYS A 26 75.309 41.663 55.020 1.00 0.00 O ATOM 381 CB CYS A 26 76.267 40.201 52.245 1.00 0.00 C ATOM 382 SG CYS A 26 77.108 38.924 51.263 1.00 0.00 S ATOM 0 H CYS A 26 75.020 38.146 52.592 1.00 0.00 H new ATOM 0 HA CYS A 26 76.775 39.704 54.251 1.00 0.00 H new ATOM 0 HB2 CYS A 26 75.375 40.529 51.711 1.00 0.00 H new ATOM 0 HB3 CYS A 26 76.922 41.068 52.334 1.00 0.00 H new ATOM 0 HG CYS A 26 76.840 37.751 51.755 1.00 0.00 H new ATOM 387 N SER A 27 73.592 40.382 54.290 1.00 0.00 N ATOM 388 CA SER A 27 72.422 41.088 54.826 1.00 0.00 C ATOM 389 C SER A 27 72.215 42.502 54.297 1.00 0.00 C ATOM 390 O SER A 27 71.273 43.171 54.714 1.00 0.00 O ATOM 391 CB SER A 27 72.366 41.018 56.359 1.00 0.00 C ATOM 392 OG SER A 27 73.381 41.810 56.948 1.00 0.00 O ATOM 0 H SER A 27 73.306 39.544 53.783 1.00 0.00 H new ATOM 0 HA SER A 27 71.566 40.538 54.434 1.00 0.00 H new ATOM 0 HB2 SER A 27 71.390 41.358 56.705 1.00 0.00 H new ATOM 0 HB3 SER A 27 72.476 39.983 56.682 1.00 0.00 H new ATOM 0 HG SER A 27 74.124 41.911 56.317 1.00 0.00 H new ATOM 398 N TYR A 28 73.060 42.946 53.366 1.00 0.00 N ATOM 399 CA TYR A 28 73.041 44.312 52.868 1.00 0.00 C ATOM 400 C TYR A 28 71.926 44.508 51.832 1.00 0.00 C ATOM 401 O TYR A 28 71.719 43.644 50.979 1.00 0.00 O ATOM 402 CB TYR A 28 74.423 44.708 52.357 1.00 0.00 C ATOM 403 CG TYR A 28 74.671 46.209 52.405 1.00 0.00 C ATOM 404 CD1 TYR A 28 74.002 47.090 51.528 1.00 0.00 C ATOM 405 CD2 TYR A 28 75.513 46.732 53.406 1.00 0.00 C ATOM 406 CE1 TYR A 28 74.121 48.485 51.697 1.00 0.00 C ATOM 407 CE2 TYR A 28 75.663 48.124 53.552 1.00 0.00 C ATOM 408 CZ TYR A 28 74.949 49.004 52.717 1.00 0.00 C ATOM 409 OH TYR A 28 75.045 50.343 52.921 1.00 0.00 O ATOM 0 H TYR A 28 73.778 42.362 52.938 1.00 0.00 H new ATOM 0 HA TYR A 28 72.805 44.990 53.688 1.00 0.00 H new ATOM 0 HB2 TYR A 28 75.183 44.201 52.952 1.00 0.00 H new ATOM 0 HB3 TYR A 28 74.538 44.360 51.331 1.00 0.00 H new ATOM 0 HD1 TYR A 28 73.397 46.695 50.725 1.00 0.00 H new ATOM 0 HD2 TYR A 28 76.046 46.062 54.064 1.00 0.00 H new ATOM 0 HE1 TYR A 28 73.579 49.156 51.047 1.00 0.00 H new ATOM 0 HE2 TYR A 28 76.328 48.518 54.307 1.00 0.00 H new ATOM 0 HH TYR A 28 75.659 50.517 53.665 1.00 0.00 H new ATOM 419 N GLU A 29 71.202 45.624 51.909 1.00 0.00 N ATOM 420 CA GLU A 29 69.993 45.873 51.122 1.00 0.00 C ATOM 421 C GLU A 29 70.292 46.653 49.834 1.00 0.00 C ATOM 422 O GLU A 29 70.711 47.813 49.899 1.00 0.00 O ATOM 423 CB GLU A 29 68.909 46.598 51.944 1.00 0.00 C ATOM 424 CG GLU A 29 68.940 46.366 53.460 1.00 0.00 C ATOM 425 CD GLU A 29 70.017 47.248 54.098 1.00 0.00 C ATOM 426 OE1 GLU A 29 69.935 48.494 53.993 1.00 0.00 O ATOM 427 OE2 GLU A 29 71.010 46.696 54.620 1.00 0.00 O ATOM 0 H GLU A 29 71.443 46.395 52.531 1.00 0.00 H new ATOM 0 HA GLU A 29 69.608 44.893 50.841 1.00 0.00 H new ATOM 0 HB2 GLU A 29 68.998 47.669 51.759 1.00 0.00 H new ATOM 0 HB3 GLU A 29 67.932 46.290 51.570 1.00 0.00 H new ATOM 0 HG2 GLU A 29 67.966 46.596 53.892 1.00 0.00 H new ATOM 0 HG3 GLU A 29 69.144 45.316 53.672 1.00 0.00 H new ATOM 434 N LEU A 30 70.087 46.026 48.670 1.00 0.00 N ATOM 435 CA LEU A 30 70.362 46.568 47.350 1.00 0.00 C ATOM 436 C LEU A 30 69.658 45.748 46.246 1.00 0.00 C ATOM 437 O LEU A 30 69.467 44.538 46.330 1.00 0.00 O ATOM 438 CB LEU A 30 71.889 46.731 47.147 1.00 0.00 C ATOM 439 CG LEU A 30 72.820 45.590 47.612 1.00 0.00 C ATOM 440 CD1 LEU A 30 72.645 44.291 46.829 1.00 0.00 C ATOM 441 CD2 LEU A 30 74.275 46.036 47.444 1.00 0.00 C ATOM 0 H LEU A 30 69.706 45.081 48.630 1.00 0.00 H new ATOM 0 HA LEU A 30 69.935 47.568 47.271 1.00 0.00 H new ATOM 0 HB2 LEU A 30 72.067 46.891 46.084 1.00 0.00 H new ATOM 0 HB3 LEU A 30 72.197 47.641 47.662 1.00 0.00 H new ATOM 0 HG LEU A 30 72.558 45.388 48.651 1.00 0.00 H new ATOM 0 HD11 LEU A 30 73.333 43.538 47.214 1.00 0.00 H new ATOM 0 HD12 LEU A 30 71.620 43.936 46.938 1.00 0.00 H new ATOM 0 HD13 LEU A 30 72.857 44.470 45.775 1.00 0.00 H new ATOM 0 HD21 LEU A 30 74.941 45.237 47.770 1.00 0.00 H new ATOM 0 HD22 LEU A 30 74.467 46.263 46.395 1.00 0.00 H new ATOM 0 HD23 LEU A 30 74.455 46.926 48.047 1.00 0.00 H new ATOM 453 N PHE A 31 69.233 46.452 45.204 1.00 0.00 N ATOM 454 CA PHE A 31 68.639 45.942 43.954 1.00 0.00 C ATOM 455 C PHE A 31 68.753 46.974 42.818 1.00 0.00 C ATOM 456 O PHE A 31 68.566 48.165 43.055 1.00 0.00 O ATOM 457 CB PHE A 31 67.163 45.590 44.191 1.00 0.00 C ATOM 458 CG PHE A 31 66.544 44.754 43.087 1.00 0.00 C ATOM 459 CD1 PHE A 31 66.928 43.411 42.923 1.00 0.00 C ATOM 460 CD2 PHE A 31 65.570 45.307 42.236 1.00 0.00 C ATOM 461 CE1 PHE A 31 66.335 42.625 41.919 1.00 0.00 C ATOM 462 CE2 PHE A 31 64.988 44.523 41.223 1.00 0.00 C ATOM 463 CZ PHE A 31 65.364 43.177 41.067 1.00 0.00 C ATOM 0 H PHE A 31 69.295 47.470 45.201 1.00 0.00 H new ATOM 0 HA PHE A 31 69.188 45.049 43.655 1.00 0.00 H new ATOM 0 HB2 PHE A 31 67.076 45.050 45.134 1.00 0.00 H new ATOM 0 HB3 PHE A 31 66.592 46.513 44.298 1.00 0.00 H new ATOM 0 HD1 PHE A 31 67.680 42.983 43.569 1.00 0.00 H new ATOM 0 HD2 PHE A 31 65.268 46.336 42.361 1.00 0.00 H new ATOM 0 HE1 PHE A 31 66.627 41.592 41.802 1.00 0.00 H new ATOM 0 HE2 PHE A 31 64.251 44.956 40.563 1.00 0.00 H new ATOM 0 HZ PHE A 31 64.909 42.571 40.297 1.00 0.00 H new ATOM 473 N SER A 32 69.047 46.534 41.587 1.00 0.00 N ATOM 474 CA SER A 32 69.044 47.405 40.395 1.00 0.00 C ATOM 475 C SER A 32 67.642 47.562 39.783 1.00 0.00 C ATOM 476 O SER A 32 66.809 46.657 39.842 1.00 0.00 O ATOM 477 CB SER A 32 70.066 46.899 39.368 1.00 0.00 C ATOM 478 OG SER A 32 69.988 47.567 38.126 1.00 0.00 O ATOM 0 H SER A 32 69.294 45.565 41.385 1.00 0.00 H new ATOM 0 HA SER A 32 69.342 48.404 40.712 1.00 0.00 H new ATOM 0 HB2 SER A 32 71.070 47.020 39.775 1.00 0.00 H new ATOM 0 HB3 SER A 32 69.913 45.832 39.209 1.00 0.00 H new ATOM 0 HG SER A 32 70.663 47.203 37.516 1.00 0.00 H new ATOM 484 N SER A 33 67.388 48.694 39.122 1.00 0.00 N ATOM 485 CA SER A 33 66.159 48.951 38.354 1.00 0.00 C ATOM 486 C SER A 33 65.945 47.981 37.184 1.00 0.00 C ATOM 487 O SER A 33 64.845 47.911 36.645 1.00 0.00 O ATOM 488 CB SER A 33 66.199 50.387 37.812 1.00 0.00 C ATOM 489 OG SER A 33 67.452 50.666 37.210 1.00 0.00 O ATOM 0 H SER A 33 68.042 49.476 39.103 1.00 0.00 H new ATOM 0 HA SER A 33 65.325 48.802 39.040 1.00 0.00 H new ATOM 0 HB2 SER A 33 65.401 50.527 37.082 1.00 0.00 H new ATOM 0 HB3 SER A 33 66.016 51.091 38.623 1.00 0.00 H new ATOM 0 HG SER A 33 67.454 51.585 36.870 1.00 0.00 H new ATOM 495 N HIS A 34 66.987 47.256 36.773 1.00 0.00 N ATOM 496 CA HIS A 34 67.033 46.475 35.531 1.00 0.00 C ATOM 497 C HIS A 34 67.123 44.956 35.745 1.00 0.00 C ATOM 498 O HIS A 34 67.008 44.181 34.797 1.00 0.00 O ATOM 499 CB HIS A 34 68.245 46.983 34.752 1.00 0.00 C ATOM 500 CG HIS A 34 68.217 48.476 34.484 1.00 0.00 C ATOM 501 ND1 HIS A 34 69.307 49.315 34.423 1.00 0.00 N ATOM 502 CD2 HIS A 34 67.106 49.267 34.317 1.00 0.00 C ATOM 503 CE1 HIS A 34 68.877 50.569 34.241 1.00 0.00 C ATOM 504 NE2 HIS A 34 67.534 50.594 34.171 1.00 0.00 N ATOM 0 H HIS A 34 67.851 47.193 37.311 1.00 0.00 H new ATOM 0 HA HIS A 34 66.098 46.616 34.989 1.00 0.00 H new ATOM 0 HB2 HIS A 34 69.151 46.740 35.308 1.00 0.00 H new ATOM 0 HB3 HIS A 34 68.302 46.453 33.801 1.00 0.00 H new ATOM 0 HD2 HIS A 34 66.081 48.926 34.301 1.00 0.00 H new ATOM 0 HE1 HIS A 34 69.516 51.436 34.162 1.00 0.00 H new ATOM 0 HE2 HIS A 34 66.944 51.415 34.038 1.00 0.00 H new ATOM 512 N SER A 35 67.313 44.516 36.992 1.00 0.00 N ATOM 513 CA SER A 35 67.460 43.129 37.407 1.00 0.00 C ATOM 514 C SER A 35 66.173 42.317 37.261 1.00 0.00 C ATOM 515 O SER A 35 66.217 41.093 37.248 1.00 0.00 O ATOM 516 CB SER A 35 68.071 43.001 38.807 1.00 0.00 C ATOM 517 OG SER A 35 68.107 44.191 39.577 1.00 0.00 O ATOM 0 H SER A 35 67.371 45.160 37.780 1.00 0.00 H new ATOM 0 HA SER A 35 68.172 42.686 36.710 1.00 0.00 H new ATOM 0 HB2 SER A 35 67.508 42.250 39.361 1.00 0.00 H new ATOM 0 HB3 SER A 35 69.089 42.626 38.705 1.00 0.00 H new ATOM 0 HG SER A 35 67.400 44.164 40.255 1.00 0.00 H new ATOM 523 N LYS A 36 65.042 43.003 37.082 1.00 0.00 N ATOM 524 CA LYS A 36 63.777 42.402 36.612 1.00 0.00 C ATOM 525 C LYS A 36 63.076 43.256 35.549 1.00 0.00 C ATOM 526 O LYS A 36 63.207 44.477 35.565 1.00 0.00 O ATOM 527 CB LYS A 36 62.844 42.090 37.800 1.00 0.00 C ATOM 528 CG LYS A 36 62.280 43.352 38.482 1.00 0.00 C ATOM 529 CD LYS A 36 61.317 43.016 39.628 1.00 0.00 C ATOM 530 CE LYS A 36 60.797 44.320 40.250 1.00 0.00 C ATOM 531 NZ LYS A 36 59.739 44.084 41.265 1.00 0.00 N ATOM 0 H LYS A 36 64.971 44.005 37.260 1.00 0.00 H new ATOM 0 HA LYS A 36 64.031 41.461 36.124 1.00 0.00 H new ATOM 0 HB2 LYS A 36 62.016 41.474 37.450 1.00 0.00 H new ATOM 0 HB3 LYS A 36 63.390 41.501 38.537 1.00 0.00 H new ATOM 0 HG2 LYS A 36 63.104 43.952 38.868 1.00 0.00 H new ATOM 0 HG3 LYS A 36 61.761 43.961 37.742 1.00 0.00 H new ATOM 0 HD2 LYS A 36 60.484 42.419 39.256 1.00 0.00 H new ATOM 0 HD3 LYS A 36 61.826 42.417 40.383 1.00 0.00 H new ATOM 0 HE2 LYS A 36 61.627 44.854 40.713 1.00 0.00 H new ATOM 0 HE3 LYS A 36 60.403 44.963 39.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 59.422 44.995 41.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 58.934 43.598 40.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 60.119 43.493 42.032 1.00 0.00 H new ATOM 545 N TYR A 37 62.255 42.625 34.707 1.00 0.00 N ATOM 546 CA TYR A 37 61.231 43.280 33.883 1.00 0.00 C ATOM 547 C TYR A 37 59.820 43.000 34.446 1.00 0.00 C ATOM 548 O TYR A 37 59.628 42.161 35.326 1.00 0.00 O ATOM 549 CB TYR A 37 61.344 42.862 32.410 1.00 0.00 C ATOM 550 CG TYR A 37 62.513 43.364 31.569 1.00 0.00 C ATOM 551 CD1 TYR A 37 63.502 44.243 32.065 1.00 0.00 C ATOM 552 CD2 TYR A 37 62.560 42.974 30.215 1.00 0.00 C ATOM 553 CE1 TYR A 37 64.548 44.685 31.227 1.00 0.00 C ATOM 554 CE2 TYR A 37 63.596 43.423 29.377 1.00 0.00 C ATOM 555 CZ TYR A 37 64.603 44.268 29.882 1.00 0.00 C ATOM 556 OH TYR A 37 65.601 44.688 29.065 1.00 0.00 O ATOM 0 H TYR A 37 62.283 41.614 34.574 1.00 0.00 H new ATOM 0 HA TYR A 37 61.401 44.356 33.923 1.00 0.00 H new ATOM 0 HB2 TYR A 37 61.367 41.773 32.382 1.00 0.00 H new ATOM 0 HB3 TYR A 37 60.426 43.175 31.912 1.00 0.00 H new ATOM 0 HD1 TYR A 37 63.457 44.578 33.091 1.00 0.00 H new ATOM 0 HD2 TYR A 37 61.794 42.325 29.818 1.00 0.00 H new ATOM 0 HE1 TYR A 37 65.309 45.345 31.618 1.00 0.00 H new ATOM 0 HE2 TYR A 37 63.620 43.118 28.341 1.00 0.00 H new ATOM 0 HH TYR A 37 65.479 44.300 28.173 1.00 0.00 H new ATOM 566 N ALA A 38 58.820 43.712 33.929 1.00 0.00 N ATOM 567 CA ALA A 38 57.423 43.671 34.376 1.00 0.00 C ATOM 568 C ALA A 38 56.626 42.482 33.781 1.00 0.00 C ATOM 569 O ALA A 38 55.673 42.662 33.021 1.00 0.00 O ATOM 570 CB ALA A 38 56.792 45.039 34.080 1.00 0.00 C ATOM 0 H ALA A 38 58.964 44.361 33.155 1.00 0.00 H new ATOM 0 HA ALA A 38 57.390 43.486 35.450 1.00 0.00 H new ATOM 0 HB1 ALA A 38 55.751 45.037 34.403 1.00 0.00 H new ATOM 0 HB2 ALA A 38 57.337 45.815 34.617 1.00 0.00 H new ATOM 0 HB3 ALA A 38 56.839 45.238 33.009 1.00 0.00 H new ATOM 576 N HIS A 39 57.019 41.253 34.127 1.00 0.00 N ATOM 577 CA HIS A 39 56.368 40.028 33.666 1.00 0.00 C ATOM 578 C HIS A 39 55.268 39.570 34.635 1.00 0.00 C ATOM 579 O HIS A 39 55.541 39.266 35.796 1.00 0.00 O ATOM 580 CB HIS A 39 57.422 38.941 33.448 1.00 0.00 C ATOM 581 CG HIS A 39 56.930 37.818 32.574 1.00 0.00 C ATOM 582 ND1 HIS A 39 56.273 36.680 32.979 1.00 0.00 N ATOM 583 CD2 HIS A 39 57.053 37.752 31.211 1.00 0.00 C ATOM 584 CE1 HIS A 39 56.009 35.943 31.886 1.00 0.00 C ATOM 585 NE2 HIS A 39 56.476 36.552 30.785 1.00 0.00 N ATOM 0 H HIS A 39 57.812 41.081 34.745 1.00 0.00 H new ATOM 0 HA HIS A 39 55.874 40.230 32.716 1.00 0.00 H new ATOM 0 HB2 HIS A 39 58.308 39.386 32.995 1.00 0.00 H new ATOM 0 HB3 HIS A 39 57.726 38.537 34.414 1.00 0.00 H new ATOM 0 HD2 HIS A 39 57.514 38.495 30.578 1.00 0.00 H new ATOM 0 HE1 HIS A 39 55.493 34.994 31.893 1.00 0.00 H new ATOM 0 HE2 HIS A 39 56.421 36.207 29.827 1.00 0.00 H new ATOM 593 N SER A 40 54.024 39.509 34.162 1.00 0.00 N ATOM 594 CA SER A 40 52.840 39.273 35.001 1.00 0.00 C ATOM 595 C SER A 40 52.494 37.781 35.127 1.00 0.00 C ATOM 596 O SER A 40 51.510 37.293 34.570 1.00 0.00 O ATOM 597 CB SER A 40 51.677 40.170 34.562 1.00 0.00 C ATOM 598 OG SER A 40 51.143 40.863 35.674 1.00 0.00 O ATOM 0 H SER A 40 53.803 39.623 33.173 1.00 0.00 H new ATOM 0 HA SER A 40 53.075 39.570 36.023 1.00 0.00 H new ATOM 0 HB2 SER A 40 52.021 40.882 33.812 1.00 0.00 H new ATOM 0 HB3 SER A 40 50.900 39.566 34.094 1.00 0.00 H new ATOM 0 HG SER A 40 50.402 41.433 35.379 1.00 0.00 H new ATOM 604 N SER A 41 53.336 37.038 35.850 1.00 0.00 N ATOM 605 CA SER A 41 53.200 35.591 36.091 1.00 0.00 C ATOM 606 C SER A 41 53.734 35.191 37.476 1.00 0.00 C ATOM 607 O SER A 41 54.574 35.911 38.015 1.00 0.00 O ATOM 608 CB SER A 41 53.968 34.812 35.010 1.00 0.00 C ATOM 609 OG SER A 41 55.373 34.989 35.132 1.00 0.00 O ATOM 0 H SER A 41 54.160 37.436 36.301 1.00 0.00 H new ATOM 0 HA SER A 41 52.138 35.347 36.052 1.00 0.00 H new ATOM 0 HB2 SER A 41 53.727 33.752 35.085 1.00 0.00 H new ATOM 0 HB3 SER A 41 53.644 35.143 34.023 1.00 0.00 H new ATOM 0 HG SER A 41 55.710 35.481 34.354 1.00 0.00 H new ATOM 615 N PRO A 42 53.346 34.027 38.034 1.00 0.00 N ATOM 616 CA PRO A 42 54.084 33.413 39.141 1.00 0.00 C ATOM 617 C PRO A 42 55.523 33.051 38.721 1.00 0.00 C ATOM 618 O PRO A 42 55.790 32.784 37.543 1.00 0.00 O ATOM 619 CB PRO A 42 53.268 32.179 39.541 1.00 0.00 C ATOM 620 CG PRO A 42 52.564 31.787 38.241 1.00 0.00 C ATOM 621 CD PRO A 42 52.277 33.140 37.588 1.00 0.00 C ATOM 0 HA PRO A 42 54.197 34.095 39.984 1.00 0.00 H new ATOM 0 HB2 PRO A 42 53.907 31.377 39.910 1.00 0.00 H new ATOM 0 HB3 PRO A 42 52.554 32.408 40.332 1.00 0.00 H new ATOM 0 HG2 PRO A 42 53.196 31.161 37.612 1.00 0.00 H new ATOM 0 HG3 PRO A 42 51.648 31.227 38.430 1.00 0.00 H new ATOM 0 HD2 PRO A 42 52.266 33.056 36.501 1.00 0.00 H new ATOM 0 HD3 PRO A 42 51.301 33.521 37.889 1.00 0.00 H new ATOM 629 N TRP A 43 56.446 33.060 39.689 1.00 0.00 N ATOM 630 CA TRP A 43 57.895 32.910 39.514 1.00 0.00 C ATOM 631 C TRP A 43 58.470 33.710 38.319 1.00 0.00 C ATOM 632 O TRP A 43 59.073 33.125 37.412 1.00 0.00 O ATOM 633 CB TRP A 43 58.274 31.421 39.530 1.00 0.00 C ATOM 634 CG TRP A 43 57.802 30.600 40.699 1.00 0.00 C ATOM 635 CD1 TRP A 43 57.235 29.374 40.604 1.00 0.00 C ATOM 636 CD2 TRP A 43 57.887 30.881 42.136 1.00 0.00 C ATOM 637 NE1 TRP A 43 56.952 28.885 41.865 1.00 0.00 N ATOM 638 CE2 TRP A 43 57.330 29.773 42.846 1.00 0.00 C ATOM 639 CE3 TRP A 43 58.390 31.946 42.916 1.00 0.00 C ATOM 640 CZ2 TRP A 43 57.268 29.729 44.247 1.00 0.00 C ATOM 641 CZ3 TRP A 43 58.357 31.900 44.326 1.00 0.00 C ATOM 642 CH2 TRP A 43 57.790 30.800 44.991 1.00 0.00 C ATOM 0 H TRP A 43 56.188 33.179 40.669 1.00 0.00 H new ATOM 0 HA TRP A 43 58.387 33.376 40.368 1.00 0.00 H new ATOM 0 HB2 TRP A 43 57.886 30.965 38.619 1.00 0.00 H new ATOM 0 HB3 TRP A 43 59.361 31.349 39.485 1.00 0.00 H new ATOM 0 HD1 TRP A 43 57.034 28.855 39.679 1.00 0.00 H new ATOM 0 HE1 TRP A 43 56.518 27.980 42.046 1.00 0.00 H new ATOM 0 HE3 TRP A 43 58.808 32.812 42.424 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 56.824 28.881 44.748 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 58.771 32.717 44.898 1.00 0.00 H new ATOM 0 HH2 TRP A 43 57.756 30.778 46.070 1.00 0.00 H new ATOM 653 N PRO A 44 58.284 35.045 38.273 1.00 0.00 N ATOM 654 CA PRO A 44 58.749 35.872 37.162 1.00 0.00 C ATOM 655 C PRO A 44 60.284 35.960 37.145 1.00 0.00 C ATOM 656 O PRO A 44 60.923 36.134 38.183 1.00 0.00 O ATOM 657 CB PRO A 44 58.073 37.232 37.358 1.00 0.00 C ATOM 658 CG PRO A 44 57.930 37.333 38.876 1.00 0.00 C ATOM 659 CD PRO A 44 57.689 35.885 39.308 1.00 0.00 C ATOM 0 HA PRO A 44 58.485 35.452 36.191 1.00 0.00 H new ATOM 0 HB2 PRO A 44 58.678 38.044 36.955 1.00 0.00 H new ATOM 0 HB3 PRO A 44 57.105 37.277 36.858 1.00 0.00 H new ATOM 0 HG2 PRO A 44 58.827 37.746 39.337 1.00 0.00 H new ATOM 0 HG3 PRO A 44 57.100 37.980 39.159 1.00 0.00 H new ATOM 0 HD2 PRO A 44 58.144 35.688 40.278 1.00 0.00 H new ATOM 0 HD3 PRO A 44 56.623 35.681 39.409 1.00 0.00 H new ATOM 667 N ALA A 45 60.876 35.834 35.956 1.00 0.00 N ATOM 668 CA ALA A 45 62.325 35.763 35.784 1.00 0.00 C ATOM 669 C ALA A 45 63.046 37.098 36.052 1.00 0.00 C ATOM 670 O ALA A 45 62.493 38.185 35.858 1.00 0.00 O ATOM 671 CB ALA A 45 62.628 35.242 34.375 1.00 0.00 C ATOM 0 H ALA A 45 60.358 35.778 35.079 1.00 0.00 H new ATOM 0 HA ALA A 45 62.715 35.075 36.535 1.00 0.00 H new ATOM 0 HB1 ALA A 45 63.707 35.184 34.233 1.00 0.00 H new ATOM 0 HB2 ALA A 45 62.192 34.251 34.252 1.00 0.00 H new ATOM 0 HB3 ALA A 45 62.201 35.920 33.637 1.00 0.00 H new ATOM 677 N PHE A 46 64.320 37.000 36.429 1.00 0.00 N ATOM 678 CA PHE A 46 65.250 38.128 36.472 1.00 0.00 C ATOM 679 C PHE A 46 65.985 38.258 35.123 1.00 0.00 C ATOM 680 O PHE A 46 66.077 37.307 34.340 1.00 0.00 O ATOM 681 CB PHE A 46 66.239 37.942 37.640 1.00 0.00 C ATOM 682 CG PHE A 46 65.797 38.320 39.047 1.00 0.00 C ATOM 683 CD1 PHE A 46 64.445 38.304 39.452 1.00 0.00 C ATOM 684 CD2 PHE A 46 66.793 38.652 39.987 1.00 0.00 C ATOM 685 CE1 PHE A 46 64.100 38.617 40.780 1.00 0.00 C ATOM 686 CE2 PHE A 46 66.449 38.955 41.316 1.00 0.00 C ATOM 687 CZ PHE A 46 65.102 38.941 41.712 1.00 0.00 C ATOM 0 H PHE A 46 64.743 36.118 36.719 1.00 0.00 H new ATOM 0 HA PHE A 46 64.698 39.053 36.640 1.00 0.00 H new ATOM 0 HB2 PHE A 46 66.534 36.893 37.658 1.00 0.00 H new ATOM 0 HB3 PHE A 46 67.134 38.520 37.409 1.00 0.00 H new ATOM 0 HD1 PHE A 46 63.673 38.051 38.741 1.00 0.00 H new ATOM 0 HD2 PHE A 46 67.829 38.674 39.684 1.00 0.00 H new ATOM 0 HE1 PHE A 46 63.064 38.608 41.084 1.00 0.00 H new ATOM 0 HE2 PHE A 46 67.220 39.198 42.032 1.00 0.00 H new ATOM 0 HZ PHE A 46 64.836 39.179 42.731 1.00 0.00 H new ATOM 697 N THR A 47 66.512 39.450 34.862 1.00 0.00 N ATOM 698 CA THR A 47 67.122 39.865 33.583 1.00 0.00 C ATOM 699 C THR A 47 68.591 40.259 33.726 1.00 0.00 C ATOM 700 O THR A 47 69.420 39.867 32.909 1.00 0.00 O ATOM 701 CB THR A 47 66.344 41.051 32.981 1.00 0.00 C ATOM 702 OG1 THR A 47 65.796 41.889 33.983 1.00 0.00 O ATOM 703 CG2 THR A 47 65.169 40.556 32.141 1.00 0.00 C ATOM 0 H THR A 47 66.531 40.193 35.561 1.00 0.00 H new ATOM 0 HA THR A 47 67.071 38.999 32.923 1.00 0.00 H new ATOM 0 HB THR A 47 67.062 41.605 32.377 1.00 0.00 H new ATOM 0 HG1 THR A 47 66.379 42.665 34.115 1.00 0.00 H new ATOM 0 HG21 THR A 47 64.634 41.410 31.726 1.00 0.00 H new ATOM 0 HG22 THR A 47 65.540 39.930 31.329 1.00 0.00 H new ATOM 0 HG23 THR A 47 64.493 39.974 32.768 1.00 0.00 H new ATOM 711 N GLU A 48 68.919 41.013 34.770 1.00 0.00 N ATOM 712 CA GLU A 48 70.265 41.425 35.162 1.00 0.00 C ATOM 713 C GLU A 48 70.515 41.125 36.651 1.00 0.00 C ATOM 714 O GLU A 48 69.695 40.529 37.351 1.00 0.00 O ATOM 715 CB GLU A 48 70.395 42.936 34.887 1.00 0.00 C ATOM 716 CG GLU A 48 70.755 43.310 33.459 1.00 0.00 C ATOM 717 CD GLU A 48 72.252 43.118 33.162 1.00 0.00 C ATOM 718 OE1 GLU A 48 72.970 42.487 33.978 1.00 0.00 O ATOM 719 OE2 GLU A 48 72.731 43.646 32.127 1.00 0.00 O ATOM 0 H GLU A 48 68.209 41.376 35.406 1.00 0.00 H new ATOM 0 HA GLU A 48 71.008 40.870 34.589 1.00 0.00 H new ATOM 0 HB2 GLU A 48 69.451 43.417 35.144 1.00 0.00 H new ATOM 0 HB3 GLU A 48 71.154 43.346 35.554 1.00 0.00 H new ATOM 0 HG2 GLU A 48 70.170 42.703 32.769 1.00 0.00 H new ATOM 0 HG3 GLU A 48 70.482 44.350 33.279 1.00 0.00 H new ATOM 726 N THR A 49 71.637 41.626 37.152 1.00 0.00 N ATOM 727 CA THR A 49 72.000 41.649 38.579 1.00 0.00 C ATOM 728 C THR A 49 71.992 43.085 39.104 1.00 0.00 C ATOM 729 O THR A 49 71.922 44.039 38.324 1.00 0.00 O ATOM 730 CB THR A 49 73.364 40.984 38.838 1.00 0.00 C ATOM 731 OG1 THR A 49 74.411 41.744 38.286 1.00 0.00 O ATOM 732 CG2 THR A 49 73.465 39.563 38.285 1.00 0.00 C ATOM 0 H THR A 49 72.353 42.046 36.559 1.00 0.00 H new ATOM 0 HA THR A 49 71.251 41.069 39.119 1.00 0.00 H new ATOM 0 HB THR A 49 73.453 40.934 39.923 1.00 0.00 H new ATOM 0 HG1 THR A 49 75.267 41.301 38.466 1.00 0.00 H new ATOM 0 HG21 THR A 49 74.453 39.157 38.504 1.00 0.00 H new ATOM 0 HG22 THR A 49 72.704 38.937 38.750 1.00 0.00 H new ATOM 0 HG23 THR A 49 73.311 39.581 37.206 1.00 0.00 H new ATOM 740 N ILE A 50 72.083 43.267 40.427 1.00 0.00 N ATOM 741 CA ILE A 50 72.378 44.562 41.036 1.00 0.00 C ATOM 742 C ILE A 50 73.714 45.104 40.514 1.00 0.00 C ATOM 743 O ILE A 50 73.753 46.078 39.765 1.00 0.00 O ATOM 744 CB ILE A 50 72.335 44.502 42.576 1.00 0.00 C ATOM 745 CG1 ILE A 50 71.209 43.623 43.170 1.00 0.00 C ATOM 746 CG2 ILE A 50 72.283 45.947 43.098 1.00 0.00 C ATOM 747 CD1 ILE A 50 71.605 42.159 43.413 1.00 0.00 C ATOM 0 H ILE A 50 71.953 42.515 41.104 1.00 0.00 H new ATOM 0 HA ILE A 50 71.595 45.260 40.741 1.00 0.00 H new ATOM 0 HB ILE A 50 73.239 43.996 42.915 1.00 0.00 H new ATOM 0 HG12 ILE A 50 70.884 44.060 44.114 1.00 0.00 H new ATOM 0 HG13 ILE A 50 70.353 43.647 42.496 1.00 0.00 H new ATOM 0 HG21 ILE A 50 72.252 45.939 44.188 1.00 0.00 H new ATOM 0 HG22 ILE A 50 73.169 46.487 42.764 1.00 0.00 H new ATOM 0 HG23 ILE A 50 71.391 46.441 42.713 1.00 0.00 H new ATOM 0 HD11 ILE A 50 70.756 41.617 43.830 1.00 0.00 H new ATOM 0 HD12 ILE A 50 71.900 41.700 42.469 1.00 0.00 H new ATOM 0 HD13 ILE A 50 72.440 42.119 44.112 1.00 0.00 H new ATOM 759 N HIS A 51 74.772 44.406 40.901 1.00 0.00 N ATOM 760 CA HIS A 51 76.159 44.484 40.447 1.00 0.00 C ATOM 761 C HIS A 51 76.960 43.372 41.164 1.00 0.00 C ATOM 762 O HIS A 51 76.675 43.117 42.339 1.00 0.00 O ATOM 763 CB HIS A 51 76.753 45.850 40.831 1.00 0.00 C ATOM 764 CG HIS A 51 77.737 46.372 39.819 1.00 0.00 C ATOM 765 ND1 HIS A 51 77.412 47.007 38.644 1.00 0.00 N ATOM 766 CD2 HIS A 51 79.104 46.325 39.888 1.00 0.00 C ATOM 767 CE1 HIS A 51 78.551 47.341 38.022 1.00 0.00 C ATOM 768 NE2 HIS A 51 79.618 46.936 38.734 1.00 0.00 N ATOM 0 H HIS A 51 74.671 43.691 41.621 1.00 0.00 H new ATOM 0 HA HIS A 51 76.207 44.362 39.365 1.00 0.00 H new ATOM 0 HB2 HIS A 51 75.944 46.571 40.948 1.00 0.00 H new ATOM 0 HB3 HIS A 51 77.247 45.765 41.799 1.00 0.00 H new ATOM 0 HD2 HIS A 51 79.685 45.893 40.690 1.00 0.00 H new ATOM 0 HE1 HIS A 51 78.605 47.864 37.078 1.00 0.00 H new ATOM 0 HE2 HIS A 51 80.601 47.050 38.486 1.00 0.00 H new ATOM 776 N PRO A 52 77.956 42.721 40.539 1.00 0.00 N ATOM 777 CA PRO A 52 78.880 41.813 41.221 1.00 0.00 C ATOM 778 C PRO A 52 80.183 42.504 41.657 1.00 0.00 C ATOM 779 O PRO A 52 80.517 43.590 41.185 1.00 0.00 O ATOM 780 CB PRO A 52 79.193 40.742 40.187 1.00 0.00 C ATOM 781 CG PRO A 52 79.209 41.544 38.881 1.00 0.00 C ATOM 782 CD PRO A 52 78.154 42.636 39.099 1.00 0.00 C ATOM 0 HA PRO A 52 78.432 41.425 42.136 1.00 0.00 H new ATOM 0 HB2 PRO A 52 80.151 40.259 40.379 1.00 0.00 H new ATOM 0 HB3 PRO A 52 78.437 39.957 40.173 1.00 0.00 H new ATOM 0 HG2 PRO A 52 80.192 41.973 38.689 1.00 0.00 H new ATOM 0 HG3 PRO A 52 78.962 40.916 38.025 1.00 0.00 H new ATOM 0 HD2 PRO A 52 78.491 43.590 38.695 1.00 0.00 H new ATOM 0 HD3 PRO A 52 77.223 42.386 38.591 1.00 0.00 H new ATOM 790 N ASP A 53 80.954 41.851 42.531 1.00 0.00 N ATOM 791 CA ASP A 53 82.238 42.323 42.999 1.00 0.00 C ATOM 792 C ASP A 53 83.393 41.316 43.055 1.00 0.00 C ATOM 793 O ASP A 53 84.252 41.254 42.172 1.00 0.00 O ATOM 794 CB ASP A 53 81.968 43.139 44.270 1.00 0.00 C ATOM 795 CG ASP A 53 81.535 42.356 45.514 1.00 0.00 C ATOM 796 OD1 ASP A 53 81.000 41.234 45.353 1.00 0.00 O ATOM 797 OD2 ASP A 53 81.814 42.832 46.639 1.00 0.00 O ATOM 0 H ASP A 53 80.685 40.955 42.937 1.00 0.00 H new ATOM 0 HA ASP A 53 82.678 42.962 42.233 1.00 0.00 H new ATOM 0 HB2 ASP A 53 82.873 43.694 44.516 1.00 0.00 H new ATOM 0 HB3 ASP A 53 81.195 43.873 44.044 1.00 0.00 H new ATOM 802 N SER A 54 83.371 40.514 44.098 1.00 0.00 N ATOM 803 CA SER A 54 84.248 39.389 44.411 1.00 0.00 C ATOM 804 C SER A 54 83.524 38.051 44.233 1.00 0.00 C ATOM 805 O SER A 54 84.094 36.976 44.444 1.00 0.00 O ATOM 806 CB SER A 54 84.683 39.533 45.863 1.00 0.00 C ATOM 807 OG SER A 54 86.029 39.951 45.949 1.00 0.00 O ATOM 0 H SER A 54 82.669 40.641 44.827 1.00 0.00 H new ATOM 0 HA SER A 54 85.103 39.398 43.735 1.00 0.00 H new ATOM 0 HB2 SER A 54 84.041 40.255 46.369 1.00 0.00 H new ATOM 0 HB3 SER A 54 84.560 38.581 46.379 1.00 0.00 H new ATOM 0 HG SER A 54 86.285 40.038 46.891 1.00 0.00 H new ATOM 813 N VAL A 55 82.239 38.131 43.891 1.00 0.00 N ATOM 814 CA VAL A 55 81.342 36.984 43.667 1.00 0.00 C ATOM 815 C VAL A 55 81.697 36.243 42.374 1.00 0.00 C ATOM 816 O VAL A 55 82.511 36.697 41.570 1.00 0.00 O ATOM 817 CB VAL A 55 79.853 37.386 43.720 1.00 0.00 C ATOM 818 CG1 VAL A 55 79.486 37.955 45.095 1.00 0.00 C ATOM 819 CG2 VAL A 55 79.465 38.398 42.641 1.00 0.00 C ATOM 0 H VAL A 55 81.771 39.027 43.756 1.00 0.00 H new ATOM 0 HA VAL A 55 81.498 36.288 44.491 1.00 0.00 H new ATOM 0 HB VAL A 55 79.293 36.469 43.533 1.00 0.00 H new ATOM 0 HG11 VAL A 55 78.431 38.230 45.105 1.00 0.00 H new ATOM 0 HG12 VAL A 55 79.672 37.203 45.862 1.00 0.00 H new ATOM 0 HG13 VAL A 55 80.093 38.837 45.298 1.00 0.00 H new ATOM 0 HG21 VAL A 55 78.406 38.639 42.732 1.00 0.00 H new ATOM 0 HG22 VAL A 55 80.056 39.306 42.764 1.00 0.00 H new ATOM 0 HG23 VAL A 55 79.656 37.971 41.656 1.00 0.00 H new ATOM 829 N THR A 56 81.125 35.056 42.218 1.00 0.00 N ATOM 830 CA THR A 56 81.530 34.030 41.231 1.00 0.00 C ATOM 831 C THR A 56 80.337 33.360 40.547 1.00 0.00 C ATOM 832 O THR A 56 79.228 33.369 41.071 1.00 0.00 O ATOM 833 CB THR A 56 82.433 32.974 41.906 1.00 0.00 C ATOM 834 OG1 THR A 56 82.756 31.913 41.037 1.00 0.00 O ATOM 835 CG2 THR A 56 81.840 32.344 43.167 1.00 0.00 C ATOM 0 H THR A 56 80.335 34.758 42.791 1.00 0.00 H new ATOM 0 HA THR A 56 82.089 34.541 40.448 1.00 0.00 H new ATOM 0 HB THR A 56 83.319 33.548 42.179 1.00 0.00 H new ATOM 0 HG1 THR A 56 83.329 31.270 41.505 1.00 0.00 H new ATOM 0 HG21 THR A 56 82.541 31.615 43.574 1.00 0.00 H new ATOM 0 HG22 THR A 56 81.653 33.121 43.908 1.00 0.00 H new ATOM 0 HG23 THR A 56 80.903 31.846 42.919 1.00 0.00 H new ATOM 843 N LYS A 57 80.535 32.740 39.379 1.00 0.00 N ATOM 844 CA LYS A 57 79.642 31.739 38.823 1.00 0.00 C ATOM 845 C LYS A 57 80.329 30.504 38.251 1.00 0.00 C ATOM 846 O LYS A 57 81.436 30.569 37.706 1.00 0.00 O ATOM 847 CB LYS A 57 78.733 32.367 37.791 1.00 0.00 C ATOM 848 CG LYS A 57 79.186 33.403 36.782 1.00 0.00 C ATOM 849 CD LYS A 57 80.216 32.928 35.753 1.00 0.00 C ATOM 850 CE LYS A 57 81.601 33.473 36.103 1.00 0.00 C ATOM 851 NZ LYS A 57 82.671 32.468 35.924 1.00 0.00 N ATOM 0 H LYS A 57 81.343 32.931 38.786 1.00 0.00 H new ATOM 0 HA LYS A 57 79.061 31.370 39.668 1.00 0.00 H new ATOM 0 HB2 LYS A 57 78.313 31.543 37.214 1.00 0.00 H new ATOM 0 HB3 LYS A 57 77.911 32.820 38.345 1.00 0.00 H new ATOM 0 HG2 LYS A 57 78.309 33.769 36.248 1.00 0.00 H new ATOM 0 HG3 LYS A 57 79.606 34.250 37.324 1.00 0.00 H new ATOM 0 HD2 LYS A 57 80.241 31.839 35.729 1.00 0.00 H new ATOM 0 HD3 LYS A 57 79.927 33.262 34.757 1.00 0.00 H new ATOM 0 HE2 LYS A 57 81.814 34.340 35.478 1.00 0.00 H new ATOM 0 HE3 LYS A 57 81.601 33.817 37.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 83.584 32.878 36.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 82.468 31.636 36.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 82.715 32.182 34.925 1.00 0.00 H new ATOM 865 N CYS A 58 79.581 29.405 38.259 1.00 0.00 N ATOM 866 CA CYS A 58 79.987 28.105 37.713 1.00 0.00 C ATOM 867 C CYS A 58 78.870 27.377 36.932 1.00 0.00 C ATOM 868 O CYS A 58 77.691 27.586 37.190 1.00 0.00 O ATOM 869 CB CYS A 58 80.550 27.244 38.846 1.00 0.00 C ATOM 870 SG CYS A 58 79.435 27.100 40.275 1.00 0.00 S ATOM 0 H CYS A 58 78.643 29.390 38.658 1.00 0.00 H new ATOM 0 HA CYS A 58 80.762 28.286 36.968 1.00 0.00 H new ATOM 0 HB2 CYS A 58 80.764 26.247 38.461 1.00 0.00 H new ATOM 0 HB3 CYS A 58 81.498 27.668 39.177 1.00 0.00 H new ATOM 0 HG CYS A 58 78.433 27.914 40.127 1.00 0.00 H new ATOM 876 N PRO A 59 79.197 26.523 35.948 1.00 0.00 N ATOM 877 CA PRO A 59 78.202 25.780 35.171 1.00 0.00 C ATOM 878 C PRO A 59 77.571 24.614 35.929 1.00 0.00 C ATOM 879 O PRO A 59 78.159 24.045 36.849 1.00 0.00 O ATOM 880 CB PRO A 59 78.920 25.337 33.903 1.00 0.00 C ATOM 881 CG PRO A 59 80.367 25.183 34.375 1.00 0.00 C ATOM 882 CD PRO A 59 80.534 26.268 35.440 1.00 0.00 C ATOM 0 HA PRO A 59 77.346 26.415 34.945 1.00 0.00 H new ATOM 0 HB2 PRO A 59 78.518 24.401 33.516 1.00 0.00 H new ATOM 0 HB3 PRO A 59 78.830 26.076 33.107 1.00 0.00 H new ATOM 0 HG2 PRO A 59 80.548 24.190 34.787 1.00 0.00 H new ATOM 0 HG3 PRO A 59 81.070 25.320 33.554 1.00 0.00 H new ATOM 0 HD2 PRO A 59 81.200 25.936 36.237 1.00 0.00 H new ATOM 0 HD3 PRO A 59 80.971 27.171 35.015 1.00 0.00 H new ATOM 890 N GLU A 60 76.366 24.229 35.505 1.00 0.00 N ATOM 891 CA GLU A 60 75.835 22.908 35.832 1.00 0.00 C ATOM 892 C GLU A 60 76.515 21.743 35.112 1.00 0.00 C ATOM 893 O GLU A 60 77.187 21.879 34.090 1.00 0.00 O ATOM 894 CB GLU A 60 74.316 22.785 35.651 1.00 0.00 C ATOM 895 CG GLU A 60 73.496 23.283 36.841 1.00 0.00 C ATOM 896 CD GLU A 60 73.638 22.370 38.074 1.00 0.00 C ATOM 897 OE1 GLU A 60 74.571 21.535 38.151 1.00 0.00 O ATOM 898 OE2 GLU A 60 72.853 22.512 39.035 1.00 0.00 O ATOM 0 H GLU A 60 75.745 24.808 34.940 1.00 0.00 H new ATOM 0 HA GLU A 60 76.072 22.827 36.893 1.00 0.00 H new ATOM 0 HB2 GLU A 60 74.022 23.344 34.763 1.00 0.00 H new ATOM 0 HB3 GLU A 60 74.068 21.740 35.466 1.00 0.00 H new ATOM 0 HG2 GLU A 60 73.814 24.293 37.101 1.00 0.00 H new ATOM 0 HG3 GLU A 60 72.446 23.343 36.556 1.00 0.00 H new ATOM 905 N LYS A 61 76.276 20.559 35.678 1.00 0.00 N ATOM 906 CA LYS A 61 76.826 19.275 35.275 1.00 0.00 C ATOM 907 C LYS A 61 75.877 18.396 34.488 1.00 0.00 C ATOM 908 O LYS A 61 76.259 17.755 33.517 1.00 0.00 O ATOM 909 CB LYS A 61 77.326 18.585 36.535 1.00 0.00 C ATOM 910 CG LYS A 61 78.189 17.349 36.287 1.00 0.00 C ATOM 911 CD LYS A 61 79.493 17.835 35.643 1.00 0.00 C ATOM 912 CE LYS A 61 80.549 16.745 35.428 1.00 0.00 C ATOM 913 NZ LYS A 61 80.299 15.916 34.226 1.00 0.00 N ATOM 0 H LYS A 61 75.653 20.472 36.481 1.00 0.00 H new ATOM 0 HA LYS A 61 77.638 19.456 34.571 1.00 0.00 H new ATOM 0 HB2 LYS A 61 77.902 19.301 37.121 1.00 0.00 H new ATOM 0 HB3 LYS A 61 76.467 18.296 37.140 1.00 0.00 H new ATOM 0 HG2 LYS A 61 78.392 16.826 37.222 1.00 0.00 H new ATOM 0 HG3 LYS A 61 77.675 16.645 35.633 1.00 0.00 H new ATOM 0 HD2 LYS A 61 79.259 18.289 34.680 1.00 0.00 H new ATOM 0 HD3 LYS A 61 79.921 18.618 36.269 1.00 0.00 H new ATOM 0 HE2 LYS A 61 81.530 17.212 35.341 1.00 0.00 H new ATOM 0 HE3 LYS A 61 80.579 16.100 36.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 81.047 15.199 34.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 79.376 15.445 34.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 80.298 16.522 33.381 1.00 0.00 H new ATOM 927 N ASN A 62 74.633 18.409 34.930 1.00 0.00 N ATOM 928 CA ASN A 62 73.482 17.748 34.337 1.00 0.00 C ATOM 929 C ASN A 62 72.629 18.716 33.509 1.00 0.00 C ATOM 930 O ASN A 62 71.633 18.292 32.919 1.00 0.00 O ATOM 931 CB ASN A 62 72.712 17.035 35.471 1.00 0.00 C ATOM 932 CG ASN A 62 72.653 17.878 36.734 1.00 0.00 C ATOM 933 OD1 ASN A 62 72.528 19.093 36.700 1.00 0.00 O ATOM 934 ND2 ASN A 62 72.920 17.278 37.859 1.00 0.00 N ATOM 0 H ASN A 62 74.381 18.920 35.776 1.00 0.00 H new ATOM 0 HA ASN A 62 73.798 16.997 33.613 1.00 0.00 H new ATOM 0 HB2 ASN A 62 71.699 16.811 35.137 1.00 0.00 H new ATOM 0 HB3 ASN A 62 73.193 16.082 35.693 1.00 0.00 H new ATOM 0 HD21 ASN A 62 73.025 17.823 38.715 1.00 0.00 H new ATOM 0 HD22 ASN A 62 73.024 16.264 37.884 1.00 0.00 H new ATOM 941 N ARG A 63 73.045 19.992 33.427 1.00 0.00 N ATOM 942 CA ARG A 63 72.402 21.016 32.611 1.00 0.00 C ATOM 943 C ARG A 63 73.417 21.867 31.815 1.00 0.00 C ATOM 944 O ARG A 63 73.629 23.022 32.164 1.00 0.00 O ATOM 945 CB ARG A 63 71.430 21.871 33.458 1.00 0.00 C ATOM 946 CG ARG A 63 70.633 21.160 34.568 1.00 0.00 C ATOM 947 CD ARG A 63 69.518 22.075 35.100 1.00 0.00 C ATOM 948 NE ARG A 63 69.078 21.721 36.467 1.00 0.00 N ATOM 949 CZ ARG A 63 67.851 21.801 36.957 1.00 0.00 C ATOM 950 NH1 ARG A 63 66.775 21.887 36.236 1.00 0.00 N ATOM 951 NH2 ARG A 63 67.664 21.815 38.237 1.00 0.00 N ATOM 0 H ARG A 63 73.855 20.339 33.940 1.00 0.00 H new ATOM 0 HA ARG A 63 71.804 20.504 31.857 1.00 0.00 H new ATOM 0 HB2 ARG A 63 72.005 22.674 33.919 1.00 0.00 H new ATOM 0 HB3 ARG A 63 70.716 22.339 32.780 1.00 0.00 H new ATOM 0 HG2 ARG A 63 70.201 20.238 34.180 1.00 0.00 H new ATOM 0 HG3 ARG A 63 71.302 20.881 35.382 1.00 0.00 H new ATOM 0 HD2 ARG A 63 69.869 23.107 35.094 1.00 0.00 H new ATOM 0 HD3 ARG A 63 68.663 22.025 34.426 1.00 0.00 H new ATOM 0 HE ARG A 63 69.799 21.378 37.102 1.00 0.00 H new ATOM 0 HH11 ARG A 63 66.842 21.896 35.218 1.00 0.00 H new ATOM 0 HH12 ARG A 63 65.862 21.945 36.687 1.00 0.00 H new ATOM 0 HH21 ARG A 63 68.462 21.764 38.870 1.00 0.00 H new ATOM 0 HH22 ARG A 63 66.718 21.877 38.614 1.00 0.00 H new ATOM 965 N PRO A 64 74.038 21.362 30.728 1.00 0.00 N ATOM 966 CA PRO A 64 75.134 22.039 30.001 1.00 0.00 C ATOM 967 C PRO A 64 74.716 23.246 29.129 1.00 0.00 C ATOM 968 O PRO A 64 75.378 23.634 28.165 1.00 0.00 O ATOM 969 CB PRO A 64 75.840 20.919 29.226 1.00 0.00 C ATOM 970 CG PRO A 64 74.698 19.949 28.925 1.00 0.00 C ATOM 971 CD PRO A 64 73.824 20.032 30.178 1.00 0.00 C ATOM 0 HA PRO A 64 75.804 22.534 30.703 1.00 0.00 H new ATOM 0 HB2 PRO A 64 76.308 21.290 28.314 1.00 0.00 H new ATOM 0 HB3 PRO A 64 76.625 20.449 29.818 1.00 0.00 H new ATOM 0 HG2 PRO A 64 74.147 20.241 28.031 1.00 0.00 H new ATOM 0 HG3 PRO A 64 75.064 18.936 28.757 1.00 0.00 H new ATOM 0 HD2 PRO A 64 72.774 19.876 29.932 1.00 0.00 H new ATOM 0 HD3 PRO A 64 74.101 19.262 30.899 1.00 0.00 H new ATOM 979 N GLU A 65 73.600 23.855 29.509 1.00 0.00 N ATOM 980 CA GLU A 65 72.891 24.975 28.895 1.00 0.00 C ATOM 981 C GLU A 65 72.530 26.079 29.902 1.00 0.00 C ATOM 982 O GLU A 65 72.070 27.162 29.555 1.00 0.00 O ATOM 983 CB GLU A 65 71.626 24.467 28.166 1.00 0.00 C ATOM 984 CG GLU A 65 71.745 23.072 27.582 1.00 0.00 C ATOM 985 CD GLU A 65 70.590 22.671 26.661 1.00 0.00 C ATOM 986 OE1 GLU A 65 70.259 23.419 25.712 1.00 0.00 O ATOM 987 OE2 GLU A 65 70.023 21.568 26.850 1.00 0.00 O ATOM 0 H GLU A 65 73.114 23.542 30.349 1.00 0.00 H new ATOM 0 HA GLU A 65 73.571 25.426 28.172 1.00 0.00 H new ATOM 0 HB2 GLU A 65 70.790 24.483 28.865 1.00 0.00 H new ATOM 0 HB3 GLU A 65 71.383 25.162 27.363 1.00 0.00 H new ATOM 0 HG2 GLU A 65 72.679 23.003 27.024 1.00 0.00 H new ATOM 0 HG3 GLU A 65 71.808 22.353 28.399 1.00 0.00 H new ATOM 994 N ALA A 66 72.777 25.797 31.175 1.00 0.00 N ATOM 995 CA ALA A 66 72.406 26.605 32.319 1.00 0.00 C ATOM 996 C ALA A 66 73.536 26.593 33.348 1.00 0.00 C ATOM 997 O ALA A 66 74.154 25.563 33.619 1.00 0.00 O ATOM 998 CB ALA A 66 71.099 26.066 32.912 1.00 0.00 C ATOM 0 H ALA A 66 73.271 24.947 31.447 1.00 0.00 H new ATOM 0 HA ALA A 66 72.245 27.639 32.014 1.00 0.00 H new ATOM 0 HB1 ALA A 66 70.814 26.670 33.774 1.00 0.00 H new ATOM 0 HB2 ALA A 66 70.312 26.113 32.160 1.00 0.00 H new ATOM 0 HB3 ALA A 66 71.241 25.032 33.225 1.00 0.00 H new ATOM 1004 N LEU A 67 73.805 27.751 33.931 1.00 0.00 N ATOM 1005 CA LEU A 67 74.830 27.898 34.955 1.00 0.00 C ATOM 1006 C LEU A 67 74.283 28.429 36.285 1.00 0.00 C ATOM 1007 O LEU A 67 73.193 28.992 36.357 1.00 0.00 O ATOM 1008 CB LEU A 67 76.039 28.595 34.314 1.00 0.00 C ATOM 1009 CG LEU A 67 76.098 30.112 34.120 1.00 0.00 C ATOM 1010 CD1 LEU A 67 76.270 30.807 35.464 1.00 0.00 C ATOM 1011 CD2 LEU A 67 77.346 30.391 33.279 1.00 0.00 C ATOM 0 H LEU A 67 73.318 28.619 33.707 1.00 0.00 H new ATOM 0 HA LEU A 67 75.206 26.936 35.303 1.00 0.00 H new ATOM 0 HB2 LEU A 67 76.910 28.321 34.909 1.00 0.00 H new ATOM 0 HB3 LEU A 67 76.172 28.148 33.329 1.00 0.00 H new ATOM 0 HG LEU A 67 75.185 30.474 33.648 1.00 0.00 H new ATOM 0 HD11 LEU A 67 76.311 31.886 35.313 1.00 0.00 H new ATOM 0 HD12 LEU A 67 75.427 30.562 36.111 1.00 0.00 H new ATOM 0 HD13 LEU A 67 77.195 30.471 35.932 1.00 0.00 H new ATOM 0 HD21 LEU A 67 77.438 31.464 33.109 1.00 0.00 H new ATOM 0 HD22 LEU A 67 78.229 30.030 33.807 1.00 0.00 H new ATOM 0 HD23 LEU A 67 77.261 29.878 32.321 1.00 0.00 H new ATOM 1023 N LYS A 68 75.021 28.178 37.363 1.00 0.00 N ATOM 1024 CA LYS A 68 74.696 28.505 38.749 1.00 0.00 C ATOM 1025 C LYS A 68 75.659 29.567 39.288 1.00 0.00 C ATOM 1026 O LYS A 68 76.877 29.412 39.269 1.00 0.00 O ATOM 1027 CB LYS A 68 74.649 27.197 39.559 1.00 0.00 C ATOM 1028 CG LYS A 68 75.802 26.214 39.301 1.00 0.00 C ATOM 1029 CD LYS A 68 75.501 24.948 40.075 1.00 0.00 C ATOM 1030 CE LYS A 68 76.574 23.874 39.868 1.00 0.00 C ATOM 1031 NZ LYS A 68 76.079 22.536 40.269 1.00 0.00 N ATOM 0 H LYS A 68 75.923 27.709 37.286 1.00 0.00 H new ATOM 0 HA LYS A 68 73.710 28.962 38.834 1.00 0.00 H new ATOM 0 HB2 LYS A 68 74.640 27.448 40.620 1.00 0.00 H new ATOM 0 HB3 LYS A 68 73.708 26.690 39.343 1.00 0.00 H new ATOM 0 HG2 LYS A 68 75.893 26.000 38.236 1.00 0.00 H new ATOM 0 HG3 LYS A 68 76.751 26.643 39.622 1.00 0.00 H new ATOM 0 HD2 LYS A 68 75.424 25.183 41.137 1.00 0.00 H new ATOM 0 HD3 LYS A 68 74.532 24.556 39.765 1.00 0.00 H new ATOM 0 HE2 LYS A 68 76.875 23.854 38.821 1.00 0.00 H new ATOM 0 HE3 LYS A 68 77.461 24.126 40.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 76.855 21.994 40.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 75.307 22.643 40.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 75.727 22.030 39.431 1.00 0.00 H new ATOM 1045 N VAL A 69 75.107 30.690 39.734 1.00 0.00 N ATOM 1046 CA VAL A 69 75.862 31.875 40.160 1.00 0.00 C ATOM 1047 C VAL A 69 75.855 31.983 41.687 1.00 0.00 C ATOM 1048 O VAL A 69 74.802 31.835 42.314 1.00 0.00 O ATOM 1049 CB VAL A 69 75.290 33.150 39.508 1.00 0.00 C ATOM 1050 CG1 VAL A 69 76.189 34.345 39.821 1.00 0.00 C ATOM 1051 CG2 VAL A 69 75.084 33.014 37.994 1.00 0.00 C ATOM 0 H VAL A 69 74.097 30.810 39.813 1.00 0.00 H new ATOM 0 HA VAL A 69 76.895 31.770 39.830 1.00 0.00 H new ATOM 0 HB VAL A 69 74.301 33.310 39.938 1.00 0.00 H new ATOM 0 HG11 VAL A 69 75.778 35.241 39.357 1.00 0.00 H new ATOM 0 HG12 VAL A 69 76.242 34.487 40.900 1.00 0.00 H new ATOM 0 HG13 VAL A 69 77.189 34.160 39.430 1.00 0.00 H new ATOM 0 HG21 VAL A 69 74.680 33.945 37.597 1.00 0.00 H new ATOM 0 HG22 VAL A 69 76.039 32.800 37.515 1.00 0.00 H new ATOM 0 HG23 VAL A 69 74.387 32.201 37.793 1.00 0.00 H new ATOM 1061 N SER A 70 77.011 32.237 42.300 1.00 0.00 N ATOM 1062 CA SER A 70 77.193 32.122 43.756 1.00 0.00 C ATOM 1063 C SER A 70 77.996 33.239 44.447 1.00 0.00 C ATOM 1064 O SER A 70 78.909 33.867 43.907 1.00 0.00 O ATOM 1065 CB SER A 70 77.723 30.728 44.102 1.00 0.00 C ATOM 1066 OG SER A 70 78.809 30.346 43.281 1.00 0.00 O ATOM 0 H SER A 70 77.853 32.529 41.804 1.00 0.00 H new ATOM 0 HA SER A 70 76.198 32.265 44.177 1.00 0.00 H new ATOM 0 HB2 SER A 70 78.036 30.710 45.146 1.00 0.00 H new ATOM 0 HB3 SER A 70 76.918 30.000 43.998 1.00 0.00 H new ATOM 0 HG SER A 70 79.115 29.451 43.539 1.00 0.00 H new ATOM 1072 N CYS A 71 77.628 33.482 45.707 1.00 0.00 N ATOM 1073 CA CYS A 71 78.185 34.527 46.551 1.00 0.00 C ATOM 1074 C CYS A 71 79.357 33.926 47.342 1.00 0.00 C ATOM 1075 O CYS A 71 79.228 33.588 48.516 1.00 0.00 O ATOM 1076 CB CYS A 71 77.042 35.079 47.421 1.00 0.00 C ATOM 1077 SG CYS A 71 77.569 36.472 48.483 1.00 0.00 S ATOM 0 H CYS A 71 76.908 32.934 46.179 1.00 0.00 H new ATOM 0 HA CYS A 71 78.592 35.369 45.991 1.00 0.00 H new ATOM 0 HB2 CYS A 71 76.227 35.408 46.776 1.00 0.00 H new ATOM 0 HB3 CYS A 71 76.649 34.278 48.048 1.00 0.00 H new ATOM 0 HG CYS A 71 78.238 36.014 49.499 1.00 0.00 H new ATOM 1082 N GLY A 72 80.501 33.717 46.689 1.00 0.00 N ATOM 1083 CA GLY A 72 81.654 33.107 47.371 1.00 0.00 C ATOM 1084 C GLY A 72 82.348 34.036 48.380 1.00 0.00 C ATOM 1085 O GLY A 72 83.264 33.608 49.083 1.00 0.00 O ATOM 0 H GLY A 72 80.658 33.954 45.709 1.00 0.00 H new ATOM 0 HA2 GLY A 72 81.322 32.208 47.890 1.00 0.00 H new ATOM 0 HA3 GLY A 72 82.381 32.793 46.622 1.00 0.00 H new ATOM 1089 N LYS A 73 81.880 35.288 48.489 1.00 0.00 N ATOM 1090 CA LYS A 73 82.232 36.267 49.508 1.00 0.00 C ATOM 1091 C LYS A 73 81.901 35.802 50.921 1.00 0.00 C ATOM 1092 O LYS A 73 82.759 35.815 51.804 1.00 0.00 O ATOM 1093 CB LYS A 73 81.433 37.516 49.219 1.00 0.00 C ATOM 1094 CG LYS A 73 81.998 38.370 48.086 1.00 0.00 C ATOM 1095 CD LYS A 73 81.599 39.833 48.258 1.00 0.00 C ATOM 1096 CE LYS A 73 80.095 40.151 48.181 1.00 0.00 C ATOM 1097 NZ LYS A 73 79.376 39.836 49.444 1.00 0.00 N ATOM 0 H LYS A 73 81.204 35.660 47.822 1.00 0.00 H new ATOM 0 HA LYS A 73 83.309 36.431 49.469 1.00 0.00 H new ATOM 0 HB2 LYS A 73 80.411 37.231 48.970 1.00 0.00 H new ATOM 0 HB3 LYS A 73 81.383 38.120 50.125 1.00 0.00 H new ATOM 0 HG2 LYS A 73 83.084 38.285 48.068 1.00 0.00 H new ATOM 0 HG3 LYS A 73 81.633 37.999 47.128 1.00 0.00 H new ATOM 0 HD2 LYS A 73 81.971 40.176 49.223 1.00 0.00 H new ATOM 0 HD3 LYS A 73 82.110 40.418 47.493 1.00 0.00 H new ATOM 0 HE2 LYS A 73 79.963 41.207 47.946 1.00 0.00 H new ATOM 0 HE3 LYS A 73 79.650 39.585 47.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 78.701 40.598 49.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 78.862 38.938 49.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 80.061 39.751 50.222 1.00 0.00 H new ATOM 1111 N CYS A 74 80.640 35.433 51.093 1.00 0.00 N ATOM 1112 CA CYS A 74 79.966 35.100 52.324 1.00 0.00 C ATOM 1113 C CYS A 74 79.657 33.578 52.396 1.00 0.00 C ATOM 1114 O CYS A 74 79.703 32.954 53.461 1.00 0.00 O ATOM 1115 CB CYS A 74 78.755 36.045 52.283 1.00 0.00 C ATOM 1116 SG CYS A 74 77.690 35.768 50.836 1.00 0.00 S ATOM 0 H CYS A 74 80.010 35.354 50.294 1.00 0.00 H new ATOM 0 HA CYS A 74 80.537 35.246 53.241 1.00 0.00 H new ATOM 0 HB2 CYS A 74 78.167 35.913 53.191 1.00 0.00 H new ATOM 0 HB3 CYS A 74 79.106 37.077 52.277 1.00 0.00 H new ATOM 0 HG CYS A 74 77.393 36.910 50.291 1.00 0.00 H new ATOM 1121 N GLY A 75 79.438 32.974 51.227 1.00 0.00 N ATOM 1122 CA GLY A 75 79.244 31.547 50.988 1.00 0.00 C ATOM 1123 C GLY A 75 77.796 31.200 50.641 1.00 0.00 C ATOM 1124 O GLY A 75 77.196 30.345 51.293 1.00 0.00 O ATOM 0 H GLY A 75 79.388 33.510 50.361 1.00 0.00 H new ATOM 0 HA2 GLY A 75 79.895 31.227 50.175 1.00 0.00 H new ATOM 0 HA3 GLY A 75 79.545 30.990 51.875 1.00 0.00 H new ATOM 1128 N ASN A 76 77.205 31.884 49.654 1.00 0.00 N ATOM 1129 CA ASN A 76 75.843 31.671 49.199 1.00 0.00 C ATOM 1130 C ASN A 76 75.772 31.394 47.687 1.00 0.00 C ATOM 1131 O ASN A 76 76.743 30.962 47.077 1.00 0.00 O ATOM 1132 CB ASN A 76 74.989 32.806 49.754 1.00 0.00 C ATOM 1133 CG ASN A 76 73.642 32.278 50.223 1.00 0.00 C ATOM 1134 OD1 ASN A 76 73.579 31.472 51.137 1.00 0.00 O ATOM 1135 ND2 ASN A 76 72.549 32.627 49.590 1.00 0.00 N ATOM 0 H ASN A 76 77.685 32.623 49.139 1.00 0.00 H new ATOM 0 HA ASN A 76 75.413 30.751 49.594 1.00 0.00 H new ATOM 0 HB2 ASN A 76 75.507 33.287 50.584 1.00 0.00 H new ATOM 0 HB3 ASN A 76 74.841 33.567 48.987 1.00 0.00 H new ATOM 0 HD21 ASN A 76 71.652 32.225 49.862 1.00 0.00 H new ATOM 0 HD22 ASN A 76 72.595 33.300 48.825 1.00 0.00 H new ATOM 1142 N GLY A 77 74.620 31.608 47.065 1.00 0.00 N ATOM 1143 CA GLY A 77 74.208 31.068 45.787 1.00 0.00 C ATOM 1144 C GLY A 77 73.084 31.914 45.196 1.00 0.00 C ATOM 1145 O GLY A 77 71.907 31.568 45.223 1.00 0.00 O ATOM 0 H GLY A 77 73.902 32.206 47.474 1.00 0.00 H new ATOM 0 HA2 GLY A 77 75.056 31.047 45.102 1.00 0.00 H new ATOM 0 HA3 GLY A 77 73.872 30.038 45.910 1.00 0.00 H new ATOM 1149 N LEU A 78 73.539 33.071 44.727 1.00 0.00 N ATOM 1150 CA LEU A 78 72.846 34.225 44.131 1.00 0.00 C ATOM 1151 C LEU A 78 71.726 33.821 43.174 1.00 0.00 C ATOM 1152 O LEU A 78 70.681 34.465 43.134 1.00 0.00 O ATOM 1153 CB LEU A 78 73.865 35.080 43.350 1.00 0.00 C ATOM 1154 CG LEU A 78 74.976 35.659 44.234 1.00 0.00 C ATOM 1155 CD1 LEU A 78 76.083 36.292 43.396 1.00 0.00 C ATOM 1156 CD2 LEU A 78 74.440 36.721 45.201 1.00 0.00 C ATOM 0 H LEU A 78 74.542 33.252 44.758 1.00 0.00 H new ATOM 0 HA LEU A 78 72.397 34.783 44.953 1.00 0.00 H new ATOM 0 HB2 LEU A 78 74.315 34.471 42.566 1.00 0.00 H new ATOM 0 HB3 LEU A 78 73.340 35.898 42.856 1.00 0.00 H new ATOM 0 HG LEU A 78 75.377 34.820 44.803 1.00 0.00 H new ATOM 0 HD11 LEU A 78 76.854 36.692 44.054 1.00 0.00 H new ATOM 0 HD12 LEU A 78 76.520 35.538 42.742 1.00 0.00 H new ATOM 0 HD13 LEU A 78 75.667 37.099 42.793 1.00 0.00 H new ATOM 0 HD21 LEU A 78 75.259 37.106 45.809 1.00 0.00 H new ATOM 0 HD22 LEU A 78 73.994 37.538 44.634 1.00 0.00 H new ATOM 0 HD23 LEU A 78 73.685 36.275 45.849 1.00 0.00 H new ATOM 1168 N GLY A 79 71.937 32.734 42.449 1.00 0.00 N ATOM 1169 CA GLY A 79 70.889 32.095 41.641 1.00 0.00 C ATOM 1170 C GLY A 79 71.426 31.223 40.508 1.00 0.00 C ATOM 1171 O GLY A 79 72.414 30.503 40.656 1.00 0.00 O ATOM 0 H GLY A 79 72.840 32.262 42.399 1.00 0.00 H new ATOM 0 HA2 GLY A 79 70.264 31.483 42.292 1.00 0.00 H new ATOM 0 HA3 GLY A 79 70.248 32.868 41.218 1.00 0.00 H new ATOM 1175 N HIS A 80 70.747 31.284 39.369 1.00 0.00 N ATOM 1176 CA HIS A 80 71.064 30.617 38.123 1.00 0.00 C ATOM 1177 C HIS A 80 70.989 31.595 36.945 1.00 0.00 C ATOM 1178 O HIS A 80 70.238 32.564 36.990 1.00 0.00 O ATOM 1179 CB HIS A 80 70.054 29.503 37.919 1.00 0.00 C ATOM 1180 CG HIS A 80 69.942 28.523 39.055 1.00 0.00 C ATOM 1181 ND1 HIS A 80 69.057 28.621 40.104 1.00 0.00 N ATOM 1182 CD2 HIS A 80 70.696 27.402 39.255 1.00 0.00 C ATOM 1183 CE1 HIS A 80 69.268 27.580 40.925 1.00 0.00 C ATOM 1184 NE2 HIS A 80 70.277 26.818 40.460 1.00 0.00 N ATOM 0 H HIS A 80 69.898 31.844 39.292 1.00 0.00 H new ATOM 0 HA HIS A 80 72.078 30.221 38.169 1.00 0.00 H new ATOM 0 HB2 HIS A 80 69.074 29.949 37.748 1.00 0.00 H new ATOM 0 HB3 HIS A 80 70.318 28.956 37.014 1.00 0.00 H new ATOM 0 HD1 HIS A 80 68.362 29.356 40.235 1.00 0.00 H new ATOM 0 HD2 HIS A 80 71.474 27.032 38.604 1.00 0.00 H new ATOM 0 HE1 HIS A 80 68.709 27.382 41.828 1.00 0.00 H new ATOM 1192 N GLU A 81 71.696 31.306 35.863 1.00 0.00 N ATOM 1193 CA GLU A 81 71.850 32.123 34.669 1.00 0.00 C ATOM 1194 C GLU A 81 71.904 31.175 33.459 1.00 0.00 C ATOM 1195 O GLU A 81 72.779 30.316 33.362 1.00 0.00 O ATOM 1196 CB GLU A 81 73.145 32.925 34.857 1.00 0.00 C ATOM 1197 CG GLU A 81 73.490 33.938 33.764 1.00 0.00 C ATOM 1198 CD GLU A 81 74.856 34.580 34.065 1.00 0.00 C ATOM 1199 OE1 GLU A 81 74.996 35.249 35.115 1.00 0.00 O ATOM 1200 OE2 GLU A 81 75.807 34.404 33.268 1.00 0.00 O ATOM 0 H GLU A 81 72.215 30.431 35.791 1.00 0.00 H new ATOM 0 HA GLU A 81 71.028 32.820 34.503 1.00 0.00 H new ATOM 0 HB2 GLU A 81 73.081 33.457 35.806 1.00 0.00 H new ATOM 0 HB3 GLU A 81 73.972 32.220 34.942 1.00 0.00 H new ATOM 0 HG2 GLU A 81 73.515 33.445 32.792 1.00 0.00 H new ATOM 0 HG3 GLU A 81 72.719 34.707 33.711 1.00 0.00 H new ATOM 1207 N PHE A 82 70.922 31.250 32.568 1.00 0.00 N ATOM 1208 CA PHE A 82 70.841 30.393 31.377 1.00 0.00 C ATOM 1209 C PHE A 82 71.650 30.983 30.207 1.00 0.00 C ATOM 1210 O PHE A 82 71.709 32.202 30.037 1.00 0.00 O ATOM 1211 CB PHE A 82 69.364 30.165 31.006 1.00 0.00 C ATOM 1212 CG PHE A 82 69.104 29.013 30.047 1.00 0.00 C ATOM 1213 CD1 PHE A 82 69.255 29.185 28.657 1.00 0.00 C ATOM 1214 CD2 PHE A 82 68.701 27.759 30.547 1.00 0.00 C ATOM 1215 CE1 PHE A 82 69.040 28.106 27.780 1.00 0.00 C ATOM 1216 CE2 PHE A 82 68.479 26.681 29.669 1.00 0.00 C ATOM 1217 CZ PHE A 82 68.659 26.851 28.286 1.00 0.00 C ATOM 0 H PHE A 82 70.150 31.911 32.647 1.00 0.00 H new ATOM 0 HA PHE A 82 71.289 29.425 31.602 1.00 0.00 H new ATOM 0 HB2 PHE A 82 68.800 29.988 31.922 1.00 0.00 H new ATOM 0 HB3 PHE A 82 68.973 31.081 30.562 1.00 0.00 H new ATOM 0 HD1 PHE A 82 69.537 30.150 28.263 1.00 0.00 H new ATOM 0 HD2 PHE A 82 68.562 27.624 31.609 1.00 0.00 H new ATOM 0 HE1 PHE A 82 69.168 28.242 26.716 1.00 0.00 H new ATOM 0 HE2 PHE A 82 68.170 25.722 30.059 1.00 0.00 H new ATOM 0 HZ PHE A 82 68.505 26.020 27.614 1.00 0.00 H new ATOM 1227 N LEU A 83 72.266 30.126 29.388 1.00 0.00 N ATOM 1228 CA LEU A 83 73.272 30.500 28.391 1.00 0.00 C ATOM 1229 C LEU A 83 73.076 29.750 27.057 1.00 0.00 C ATOM 1230 O LEU A 83 72.214 28.893 26.913 1.00 0.00 O ATOM 1231 CB LEU A 83 74.658 30.259 29.041 1.00 0.00 C ATOM 1232 CG LEU A 83 75.882 30.907 28.362 1.00 0.00 C ATOM 1233 CD1 LEU A 83 75.726 32.415 28.147 1.00 0.00 C ATOM 1234 CD2 LEU A 83 77.125 30.681 29.222 1.00 0.00 C ATOM 0 H LEU A 83 72.073 29.125 29.401 1.00 0.00 H new ATOM 0 HA LEU A 83 73.178 31.550 28.115 1.00 0.00 H new ATOM 0 HB2 LEU A 83 74.615 30.617 30.070 1.00 0.00 H new ATOM 0 HB3 LEU A 83 74.827 29.183 29.085 1.00 0.00 H new ATOM 0 HG LEU A 83 75.975 30.434 27.384 1.00 0.00 H new ATOM 0 HD11 LEU A 83 76.621 32.808 27.666 1.00 0.00 H new ATOM 0 HD12 LEU A 83 74.860 32.604 27.513 1.00 0.00 H new ATOM 0 HD13 LEU A 83 75.585 32.907 29.109 1.00 0.00 H new ATOM 0 HD21 LEU A 83 77.989 31.140 28.741 1.00 0.00 H new ATOM 0 HD22 LEU A 83 76.975 31.131 30.203 1.00 0.00 H new ATOM 0 HD23 LEU A 83 77.299 29.611 29.336 1.00 0.00 H new ATOM 1246 N ASN A 84 73.882 30.097 26.052 1.00 0.00 N ATOM 1247 CA ASN A 84 73.960 29.442 24.736 1.00 0.00 C ATOM 1248 C ASN A 84 72.665 29.517 23.896 1.00 0.00 C ATOM 1249 O ASN A 84 72.470 28.760 22.947 1.00 0.00 O ATOM 1250 CB ASN A 84 74.539 28.027 24.860 1.00 0.00 C ATOM 1251 CG ASN A 84 75.731 27.873 25.756 1.00 0.00 C ATOM 1252 OD1 ASN A 84 76.765 28.519 25.655 1.00 0.00 O ATOM 1253 ND2 ASN A 84 75.610 26.918 26.632 1.00 0.00 N ATOM 0 H ASN A 84 74.531 30.880 26.133 1.00 0.00 H new ATOM 0 HA ASN A 84 74.663 30.029 24.145 1.00 0.00 H new ATOM 0 HB2 ASN A 84 73.752 27.366 25.222 1.00 0.00 H new ATOM 0 HB3 ASN A 84 74.813 27.681 23.863 1.00 0.00 H new ATOM 0 HD21 ASN A 84 76.387 26.694 27.253 1.00 0.00 H new ATOM 0 HD22 ASN A 84 74.738 26.393 26.697 1.00 0.00 H new ATOM 1260 N ASP A 85 71.769 30.449 24.237 1.00 0.00 N ATOM 1261 CA ASP A 85 70.499 30.673 23.533 1.00 0.00 C ATOM 1262 C ASP A 85 70.514 31.864 22.558 1.00 0.00 C ATOM 1263 O ASP A 85 69.712 31.922 21.627 1.00 0.00 O ATOM 1264 CB ASP A 85 69.364 30.777 24.562 1.00 0.00 C ATOM 1265 CG ASP A 85 68.100 30.070 24.062 1.00 0.00 C ATOM 1266 OD1 ASP A 85 68.224 28.901 23.628 1.00 0.00 O ATOM 1267 OD2 ASP A 85 67.013 30.690 24.045 1.00 0.00 O ATOM 0 H ASP A 85 71.908 31.082 25.025 1.00 0.00 H new ATOM 0 HA ASP A 85 70.330 29.811 22.888 1.00 0.00 H new ATOM 0 HB2 ASP A 85 69.683 30.334 25.506 1.00 0.00 H new ATOM 0 HB3 ASP A 85 69.144 31.826 24.760 1.00 0.00 H new ATOM 1272 N GLY A 86 71.479 32.770 22.736 1.00 0.00 N ATOM 1273 CA GLY A 86 71.825 33.870 21.848 1.00 0.00 C ATOM 1274 C GLY A 86 72.151 35.195 22.562 1.00 0.00 C ATOM 1275 O GLY A 86 71.561 36.223 22.216 1.00 0.00 O ATOM 0 H GLY A 86 72.077 32.748 23.562 1.00 0.00 H new ATOM 0 HA2 GLY A 86 72.685 33.576 21.246 1.00 0.00 H new ATOM 0 HA3 GLY A 86 70.996 34.038 21.160 1.00 0.00 H new ATOM 1279 N PRO A 87 73.093 35.211 23.533 1.00 0.00 N ATOM 1280 CA PRO A 87 73.253 36.270 24.552 1.00 0.00 C ATOM 1281 C PRO A 87 73.676 37.656 24.037 1.00 0.00 C ATOM 1282 O PRO A 87 73.662 38.634 24.778 1.00 0.00 O ATOM 1283 CB PRO A 87 74.306 35.709 25.511 1.00 0.00 C ATOM 1284 CG PRO A 87 75.164 34.806 24.630 1.00 0.00 C ATOM 1285 CD PRO A 87 74.107 34.178 23.728 1.00 0.00 C ATOM 0 HA PRO A 87 72.283 36.476 25.004 1.00 0.00 H new ATOM 0 HB2 PRO A 87 74.898 36.505 25.963 1.00 0.00 H new ATOM 0 HB3 PRO A 87 73.846 35.151 26.327 1.00 0.00 H new ATOM 0 HG2 PRO A 87 75.906 35.369 24.064 1.00 0.00 H new ATOM 0 HG3 PRO A 87 75.705 34.059 25.211 1.00 0.00 H new ATOM 0 HD2 PRO A 87 74.538 33.867 22.776 1.00 0.00 H new ATOM 0 HD3 PRO A 87 73.677 33.289 24.189 1.00 0.00 H new ATOM 1293 N LYS A 88 74.043 37.741 22.758 1.00 0.00 N ATOM 1294 CA LYS A 88 74.362 38.970 22.002 1.00 0.00 C ATOM 1295 C LYS A 88 73.233 40.017 22.003 1.00 0.00 C ATOM 1296 O LYS A 88 73.487 41.211 21.840 1.00 0.00 O ATOM 1297 CB LYS A 88 74.617 38.557 20.549 1.00 0.00 C ATOM 1298 CG LYS A 88 75.801 37.617 20.311 1.00 0.00 C ATOM 1299 CD LYS A 88 75.560 36.688 19.115 1.00 0.00 C ATOM 1300 CE LYS A 88 75.279 37.366 17.767 1.00 0.00 C ATOM 1301 NZ LYS A 88 73.882 37.838 17.606 1.00 0.00 N ATOM 0 H LYS A 88 74.133 36.906 22.179 1.00 0.00 H new ATOM 0 HA LYS A 88 75.224 39.434 22.482 1.00 0.00 H new ATOM 0 HB2 LYS A 88 73.716 38.077 20.166 1.00 0.00 H new ATOM 0 HB3 LYS A 88 74.772 39.460 19.959 1.00 0.00 H new ATOM 0 HG2 LYS A 88 76.703 38.205 20.139 1.00 0.00 H new ATOM 0 HG3 LYS A 88 75.976 37.020 21.206 1.00 0.00 H new ATOM 0 HD2 LYS A 88 76.434 36.047 18.999 1.00 0.00 H new ATOM 0 HD3 LYS A 88 74.718 36.038 19.352 1.00 0.00 H new ATOM 0 HE2 LYS A 88 75.953 38.215 17.652 1.00 0.00 H new ATOM 0 HE3 LYS A 88 75.509 36.665 16.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 73.629 37.837 16.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 73.240 37.205 18.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 73.796 38.803 17.983 1.00 0.00 H new ATOM 1315 N ARG A 89 71.986 39.563 22.160 1.00 0.00 N ATOM 1316 CA ARG A 89 70.753 40.346 22.274 1.00 0.00 C ATOM 1317 C ARG A 89 70.679 41.176 23.570 1.00 0.00 C ATOM 1318 O ARG A 89 71.606 41.190 24.373 1.00 0.00 O ATOM 1319 CB ARG A 89 69.568 39.388 22.081 1.00 0.00 C ATOM 1320 CG ARG A 89 68.834 39.640 20.778 1.00 0.00 C ATOM 1321 CD ARG A 89 67.791 40.753 20.902 1.00 0.00 C ATOM 1322 NE ARG A 89 67.017 40.954 19.666 1.00 0.00 N ATOM 1323 CZ ARG A 89 66.143 41.925 19.473 1.00 0.00 C ATOM 1324 NH1 ARG A 89 65.888 42.807 20.395 1.00 0.00 N ATOM 1325 NH2 ARG A 89 65.499 42.048 18.353 1.00 0.00 N ATOM 0 H ARG A 89 71.799 38.562 22.215 1.00 0.00 H new ATOM 0 HA ARG A 89 70.726 41.105 21.492 1.00 0.00 H new ATOM 0 HB2 ARG A 89 69.928 38.359 22.100 1.00 0.00 H new ATOM 0 HB3 ARG A 89 68.874 39.499 22.914 1.00 0.00 H new ATOM 0 HG2 ARG A 89 69.554 39.905 20.004 1.00 0.00 H new ATOM 0 HG3 ARG A 89 68.344 38.721 20.456 1.00 0.00 H new ATOM 0 HD2 ARG A 89 67.108 40.515 21.717 1.00 0.00 H new ATOM 0 HD3 ARG A 89 68.291 41.685 21.167 1.00 0.00 H new ATOM 0 HE ARG A 89 67.167 40.295 18.902 1.00 0.00 H new ATOM 0 HH11 ARG A 89 66.368 42.759 21.294 1.00 0.00 H new ATOM 0 HH12 ARG A 89 65.208 43.547 20.219 1.00 0.00 H new ATOM 0 HH21 ARG A 89 65.663 41.385 17.595 1.00 0.00 H new ATOM 0 HH22 ARG A 89 64.829 42.807 18.231 1.00 0.00 H new ATOM 1339 N GLY A 90 69.554 41.860 23.792 1.00 0.00 N ATOM 1340 CA GLY A 90 69.150 42.374 25.098 1.00 0.00 C ATOM 1341 C GLY A 90 68.473 41.350 26.015 1.00 0.00 C ATOM 1342 O GLY A 90 67.966 41.693 27.078 1.00 0.00 O ATOM 0 H GLY A 90 68.886 42.075 23.052 1.00 0.00 H new ATOM 0 HA2 GLY A 90 70.031 42.767 25.605 1.00 0.00 H new ATOM 0 HA3 GLY A 90 68.468 43.211 24.947 1.00 0.00 H new ATOM 1346 N GLN A 91 68.382 40.106 25.555 1.00 0.00 N ATOM 1347 CA GLN A 91 67.692 38.995 26.161 1.00 0.00 C ATOM 1348 C GLN A 91 68.639 38.147 27.017 1.00 0.00 C ATOM 1349 O GLN A 91 69.805 37.942 26.687 1.00 0.00 O ATOM 1350 CB GLN A 91 67.033 38.161 25.056 1.00 0.00 C ATOM 1351 CG GLN A 91 66.022 38.948 24.216 1.00 0.00 C ATOM 1352 CD GLN A 91 65.484 38.159 23.026 1.00 0.00 C ATOM 1353 OE1 GLN A 91 66.145 37.986 22.011 1.00 0.00 O ATOM 1354 NE2 GLN A 91 64.265 37.679 23.095 1.00 0.00 N ATOM 0 H GLN A 91 68.828 39.838 24.678 1.00 0.00 H new ATOM 0 HA GLN A 91 66.922 39.372 26.834 1.00 0.00 H new ATOM 0 HB2 GLN A 91 67.808 37.765 24.400 1.00 0.00 H new ATOM 0 HB3 GLN A 91 66.530 37.306 25.508 1.00 0.00 H new ATOM 0 HG2 GLN A 91 65.188 39.249 24.851 1.00 0.00 H new ATOM 0 HG3 GLN A 91 66.493 39.862 23.854 1.00 0.00 H new ATOM 0 HE21 GLN A 91 63.709 37.820 23.938 1.00 0.00 H new ATOM 0 HE22 GLN A 91 63.874 37.165 22.305 1.00 0.00 H new ATOM 1363 N SER A 92 68.100 37.617 28.105 1.00 0.00 N ATOM 1364 CA SER A 92 68.761 36.957 29.201 1.00 0.00 C ATOM 1365 C SER A 92 67.645 36.325 30.031 1.00 0.00 C ATOM 1366 O SER A 92 66.474 36.712 29.977 1.00 0.00 O ATOM 1367 CB SER A 92 69.525 37.972 30.064 1.00 0.00 C ATOM 1368 OG SER A 92 68.670 39.002 30.514 1.00 0.00 O ATOM 0 H SER A 92 67.090 37.646 28.248 1.00 0.00 H new ATOM 0 HA SER A 92 69.482 36.222 28.843 1.00 0.00 H new ATOM 0 HB2 SER A 92 69.970 37.464 30.920 1.00 0.00 H new ATOM 0 HB3 SER A 92 70.344 38.401 29.487 1.00 0.00 H new ATOM 0 HG SER A 92 69.114 39.507 31.227 1.00 0.00 H new ATOM 1374 N ARG A 93 68.027 35.309 30.784 1.00 0.00 N ATOM 1375 CA ARG A 93 67.229 34.683 31.849 1.00 0.00 C ATOM 1376 C ARG A 93 68.100 34.360 33.061 1.00 0.00 C ATOM 1377 O ARG A 93 68.974 33.495 32.991 1.00 0.00 O ATOM 1378 CB ARG A 93 66.541 33.397 31.346 1.00 0.00 C ATOM 1379 CG ARG A 93 65.568 33.581 30.171 1.00 0.00 C ATOM 1380 CD ARG A 93 64.275 34.321 30.558 1.00 0.00 C ATOM 1381 NE ARG A 93 63.159 33.388 30.816 1.00 0.00 N ATOM 1382 CZ ARG A 93 62.454 32.740 29.907 1.00 0.00 C ATOM 1383 NH1 ARG A 93 62.709 32.829 28.633 1.00 0.00 N ATOM 1384 NH2 ARG A 93 61.477 31.976 30.277 1.00 0.00 N ATOM 0 H ARG A 93 68.941 34.871 30.673 1.00 0.00 H new ATOM 0 HA ARG A 93 66.460 35.397 32.145 1.00 0.00 H new ATOM 0 HB2 ARG A 93 67.312 32.686 31.048 1.00 0.00 H new ATOM 0 HB3 ARG A 93 65.998 32.948 32.177 1.00 0.00 H new ATOM 0 HG2 ARG A 93 66.070 34.133 29.376 1.00 0.00 H new ATOM 0 HG3 ARG A 93 65.310 32.603 29.766 1.00 0.00 H new ATOM 0 HD2 ARG A 93 64.455 34.925 31.447 1.00 0.00 H new ATOM 0 HD3 ARG A 93 63.997 35.007 29.758 1.00 0.00 H new ATOM 0 HE ARG A 93 62.909 33.229 31.792 1.00 0.00 H new ATOM 0 HH11 ARG A 93 63.477 33.415 28.306 1.00 0.00 H new ATOM 0 HH12 ARG A 93 62.141 32.312 27.962 1.00 0.00 H new ATOM 0 HH21 ARG A 93 61.254 31.876 31.267 1.00 0.00 H new ATOM 0 HH22 ARG A 93 60.930 31.474 29.578 1.00 0.00 H new ATOM 1398 N PHE A 94 67.805 35.015 34.177 1.00 0.00 N ATOM 1399 CA PHE A 94 68.349 34.702 35.495 1.00 0.00 C ATOM 1400 C PHE A 94 67.222 34.140 36.378 1.00 0.00 C ATOM 1401 O PHE A 94 66.111 34.674 36.407 1.00 0.00 O ATOM 1402 CB PHE A 94 69.051 35.944 36.065 1.00 0.00 C ATOM 1403 CG PHE A 94 69.903 35.704 37.302 1.00 0.00 C ATOM 1404 CD1 PHE A 94 69.310 35.558 38.574 1.00 0.00 C ATOM 1405 CD2 PHE A 94 71.305 35.648 37.183 1.00 0.00 C ATOM 1406 CE1 PHE A 94 70.115 35.344 39.709 1.00 0.00 C ATOM 1407 CE2 PHE A 94 72.107 35.446 38.320 1.00 0.00 C ATOM 1408 CZ PHE A 94 71.513 35.288 39.583 1.00 0.00 C ATOM 0 H PHE A 94 67.160 35.805 34.191 1.00 0.00 H new ATOM 0 HA PHE A 94 69.114 33.927 35.445 1.00 0.00 H new ATOM 0 HB2 PHE A 94 69.683 36.372 35.287 1.00 0.00 H new ATOM 0 HB3 PHE A 94 68.293 36.690 36.306 1.00 0.00 H new ATOM 0 HD1 PHE A 94 68.236 35.611 38.677 1.00 0.00 H new ATOM 0 HD2 PHE A 94 71.767 35.761 36.213 1.00 0.00 H new ATOM 0 HE1 PHE A 94 69.656 35.223 40.679 1.00 0.00 H new ATOM 0 HE2 PHE A 94 73.182 35.412 38.222 1.00 0.00 H new ATOM 0 HZ PHE A 94 72.129 35.124 40.455 1.00 0.00 H new ATOM 1418 N CYS A 95 67.484 33.033 37.073 1.00 0.00 N ATOM 1419 CA CYS A 95 66.509 32.300 37.877 1.00 0.00 C ATOM 1420 C CYS A 95 66.998 32.121 39.324 1.00 0.00 C ATOM 1421 O CYS A 95 67.932 31.369 39.610 1.00 0.00 O ATOM 1422 CB CYS A 95 66.167 30.982 37.172 1.00 0.00 C ATOM 1423 SG CYS A 95 64.848 30.134 38.082 1.00 0.00 S ATOM 0 H CYS A 95 68.411 32.609 37.092 1.00 0.00 H new ATOM 0 HA CYS A 95 65.586 32.874 37.961 1.00 0.00 H new ATOM 0 HB2 CYS A 95 65.849 31.177 36.148 1.00 0.00 H new ATOM 0 HB3 CYS A 95 67.051 30.347 37.116 1.00 0.00 H new ATOM 0 HG CYS A 95 64.556 29.017 37.483 1.00 0.00 H new ATOM 1429 N ILE A 96 66.377 32.849 40.249 1.00 0.00 N ATOM 1430 CA ILE A 96 66.817 33.008 41.640 1.00 0.00 C ATOM 1431 C ILE A 96 65.965 32.169 42.606 1.00 0.00 C ATOM 1432 O ILE A 96 64.820 31.834 42.317 1.00 0.00 O ATOM 1433 CB ILE A 96 66.799 34.514 41.975 1.00 0.00 C ATOM 1434 CG1 ILE A 96 67.458 34.821 43.329 1.00 0.00 C ATOM 1435 CG2 ILE A 96 65.388 35.132 41.907 1.00 0.00 C ATOM 1436 CD1 ILE A 96 68.036 36.240 43.363 1.00 0.00 C ATOM 0 H ILE A 96 65.521 33.365 40.046 1.00 0.00 H new ATOM 0 HA ILE A 96 67.832 32.630 41.760 1.00 0.00 H new ATOM 0 HB ILE A 96 67.396 34.986 41.195 1.00 0.00 H new ATOM 0 HG12 ILE A 96 66.724 34.707 44.126 1.00 0.00 H new ATOM 0 HG13 ILE A 96 68.252 34.099 43.521 1.00 0.00 H new ATOM 0 HG21 ILE A 96 65.443 36.192 42.153 1.00 0.00 H new ATOM 0 HG22 ILE A 96 64.987 35.013 40.900 1.00 0.00 H new ATOM 0 HG23 ILE A 96 64.735 34.628 42.620 1.00 0.00 H new ATOM 0 HD11 ILE A 96 68.494 36.423 44.335 1.00 0.00 H new ATOM 0 HD12 ILE A 96 68.789 36.345 42.581 1.00 0.00 H new ATOM 0 HD13 ILE A 96 67.237 36.962 43.197 1.00 0.00 H new ATOM 1448 N PHE A 97 66.527 31.827 43.766 1.00 0.00 N ATOM 1449 CA PHE A 97 65.899 31.000 44.807 1.00 0.00 C ATOM 1450 C PHE A 97 65.624 31.810 46.085 1.00 0.00 C ATOM 1451 O PHE A 97 66.371 32.726 46.409 1.00 0.00 O ATOM 1452 CB PHE A 97 66.819 29.807 45.111 1.00 0.00 C ATOM 1453 CG PHE A 97 66.659 28.545 44.263 1.00 0.00 C ATOM 1454 CD1 PHE A 97 66.112 28.567 42.961 1.00 0.00 C ATOM 1455 CD2 PHE A 97 67.088 27.314 44.798 1.00 0.00 C ATOM 1456 CE1 PHE A 97 65.978 27.379 42.220 1.00 0.00 C ATOM 1457 CE2 PHE A 97 66.959 26.124 44.056 1.00 0.00 C ATOM 1458 CZ PHE A 97 66.401 26.155 42.766 1.00 0.00 C ATOM 0 H PHE A 97 67.468 32.128 44.020 1.00 0.00 H new ATOM 0 HA PHE A 97 64.936 30.644 44.442 1.00 0.00 H new ATOM 0 HB2 PHE A 97 67.850 30.147 45.013 1.00 0.00 H new ATOM 0 HB3 PHE A 97 66.672 29.529 46.155 1.00 0.00 H new ATOM 0 HD1 PHE A 97 65.794 29.505 42.530 1.00 0.00 H new ATOM 0 HD2 PHE A 97 67.520 27.283 45.787 1.00 0.00 H new ATOM 0 HE1 PHE A 97 65.549 27.407 41.229 1.00 0.00 H new ATOM 0 HE2 PHE A 97 67.289 25.186 44.478 1.00 0.00 H new ATOM 0 HZ PHE A 97 66.298 25.243 42.197 1.00 0.00 H new ATOM 1468 N SER A 98 64.634 31.420 46.894 1.00 0.00 N ATOM 1469 CA SER A 98 64.386 32.018 48.222 1.00 0.00 C ATOM 1470 C SER A 98 65.499 31.765 49.250 1.00 0.00 C ATOM 1471 O SER A 98 65.659 32.520 50.203 1.00 0.00 O ATOM 1472 CB SER A 98 63.061 31.510 48.762 1.00 0.00 C ATOM 1473 OG SER A 98 63.019 30.099 48.757 1.00 0.00 O ATOM 0 H SER A 98 63.977 30.679 46.651 1.00 0.00 H new ATOM 0 HA SER A 98 64.362 33.097 48.072 1.00 0.00 H new ATOM 0 HB2 SER A 98 62.913 31.878 49.777 1.00 0.00 H new ATOM 0 HB3 SER A 98 62.243 31.904 48.158 1.00 0.00 H new ATOM 0 HG SER A 98 62.157 29.796 49.111 1.00 0.00 H new ATOM 1479 N SER A 99 66.306 30.726 49.031 1.00 0.00 N ATOM 1480 CA SER A 99 67.555 30.475 49.772 1.00 0.00 C ATOM 1481 C SER A 99 68.747 31.337 49.303 1.00 0.00 C ATOM 1482 O SER A 99 69.822 31.274 49.901 1.00 0.00 O ATOM 1483 CB SER A 99 67.895 28.989 49.740 1.00 0.00 C ATOM 1484 OG SER A 99 68.756 28.631 50.804 1.00 0.00 O ATOM 0 H SER A 99 66.111 30.019 48.322 1.00 0.00 H new ATOM 0 HA SER A 99 67.371 30.781 50.802 1.00 0.00 H new ATOM 0 HB2 SER A 99 66.978 28.403 49.800 1.00 0.00 H new ATOM 0 HB3 SER A 99 68.368 28.743 48.789 1.00 0.00 H new ATOM 0 HG SER A 99 69.449 29.316 50.908 1.00 0.00 H new ATOM 1490 N SER A 100 68.587 32.131 48.233 1.00 0.00 N ATOM 1491 CA SER A 100 69.611 33.063 47.736 1.00 0.00 C ATOM 1492 C SER A 100 69.653 34.366 48.536 1.00 0.00 C ATOM 1493 O SER A 100 70.726 34.830 48.927 1.00 0.00 O ATOM 1494 CB SER A 100 69.361 33.391 46.263 1.00 0.00 C ATOM 1495 OG SER A 100 70.290 34.346 45.826 1.00 0.00 O ATOM 0 H SER A 100 67.730 32.144 47.680 1.00 0.00 H new ATOM 0 HA SER A 100 70.572 32.563 47.854 1.00 0.00 H new ATOM 0 HB2 SER A 100 69.444 32.487 45.660 1.00 0.00 H new ATOM 0 HB3 SER A 100 68.347 33.769 46.132 1.00 0.00 H new ATOM 0 HG SER A 100 69.884 34.903 45.129 1.00 0.00 H new ATOM 1501 N LEU A 101 68.474 34.952 48.764 1.00 0.00 N ATOM 1502 CA LEU A 101 68.270 36.265 49.372 1.00 0.00 C ATOM 1503 C LEU A 101 66.808 36.487 49.802 1.00 0.00 C ATOM 1504 O LEU A 101 65.928 35.682 49.497 1.00 0.00 O ATOM 1505 CB LEU A 101 68.749 37.360 48.400 1.00 0.00 C ATOM 1506 CG LEU A 101 68.334 37.285 46.920 1.00 0.00 C ATOM 1507 CD1 LEU A 101 66.831 37.093 46.704 1.00 0.00 C ATOM 1508 CD2 LEU A 101 68.758 38.585 46.231 1.00 0.00 C ATOM 0 H LEU A 101 67.594 34.499 48.516 1.00 0.00 H new ATOM 0 HA LEU A 101 68.863 36.317 50.285 1.00 0.00 H new ATOM 0 HB2 LEU A 101 68.404 38.318 48.789 1.00 0.00 H new ATOM 0 HB3 LEU A 101 69.838 37.376 48.435 1.00 0.00 H new ATOM 0 HG LEU A 101 68.828 36.409 46.500 1.00 0.00 H new ATOM 0 HD11 LEU A 101 66.620 37.050 45.636 1.00 0.00 H new ATOM 0 HD12 LEU A 101 66.512 36.163 47.175 1.00 0.00 H new ATOM 0 HD13 LEU A 101 66.290 37.929 47.148 1.00 0.00 H new ATOM 0 HD21 LEU A 101 68.472 38.550 45.180 1.00 0.00 H new ATOM 0 HD22 LEU A 101 68.266 39.430 46.713 1.00 0.00 H new ATOM 0 HD23 LEU A 101 69.839 38.702 46.309 1.00 0.00 H new ATOM 1520 N LYS A 102 66.556 37.596 50.504 1.00 0.00 N ATOM 1521 CA LYS A 102 65.254 38.019 51.015 1.00 0.00 C ATOM 1522 C LYS A 102 64.815 39.367 50.438 1.00 0.00 C ATOM 1523 O LYS A 102 65.580 40.035 49.744 1.00 0.00 O ATOM 1524 CB LYS A 102 65.295 38.076 52.535 1.00 0.00 C ATOM 1525 CG LYS A 102 65.947 36.878 53.255 1.00 0.00 C ATOM 1526 CD LYS A 102 67.416 37.088 53.658 1.00 0.00 C ATOM 1527 CE LYS A 102 67.647 38.070 54.821 1.00 0.00 C ATOM 1528 NZ LYS A 102 66.975 37.627 56.069 1.00 0.00 N ATOM 0 H LYS A 102 67.296 38.256 50.742 1.00 0.00 H new ATOM 0 HA LYS A 102 64.515 37.283 50.696 1.00 0.00 H new ATOM 0 HB2 LYS A 102 65.829 38.980 52.827 1.00 0.00 H new ATOM 0 HB3 LYS A 102 64.273 38.177 52.900 1.00 0.00 H new ATOM 0 HG2 LYS A 102 65.368 36.652 54.151 1.00 0.00 H new ATOM 0 HG3 LYS A 102 65.884 36.004 52.606 1.00 0.00 H new ATOM 0 HD2 LYS A 102 67.842 36.122 53.930 1.00 0.00 H new ATOM 0 HD3 LYS A 102 67.966 37.446 52.788 1.00 0.00 H new ATOM 0 HE2 LYS A 102 68.717 38.171 55.002 1.00 0.00 H new ATOM 0 HE3 LYS A 102 67.277 39.056 54.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 67.279 38.230 56.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 65.944 37.701 55.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 67.231 36.639 56.269 1.00 0.00 H new ATOM 1542 N PHE A 103 63.603 39.788 50.778 1.00 0.00 N ATOM 1543 CA PHE A 103 62.987 41.047 50.409 1.00 0.00 C ATOM 1544 C PHE A 103 62.493 41.777 51.662 1.00 0.00 C ATOM 1545 O PHE A 103 61.843 41.196 52.529 1.00 0.00 O ATOM 1546 CB PHE A 103 61.857 40.742 49.429 1.00 0.00 C ATOM 1547 CG PHE A 103 61.235 41.964 48.777 1.00 0.00 C ATOM 1548 CD1 PHE A 103 61.756 42.464 47.569 1.00 0.00 C ATOM 1549 CD2 PHE A 103 60.145 42.615 49.386 1.00 0.00 C ATOM 1550 CE1 PHE A 103 61.193 43.608 46.973 1.00 0.00 C ATOM 1551 CE2 PHE A 103 59.576 43.754 48.787 1.00 0.00 C ATOM 1552 CZ PHE A 103 60.098 44.249 47.579 1.00 0.00 C ATOM 0 H PHE A 103 62.987 39.217 51.357 1.00 0.00 H new ATOM 0 HA PHE A 103 63.703 41.712 49.926 1.00 0.00 H new ATOM 0 HB2 PHE A 103 62.240 40.085 48.648 1.00 0.00 H new ATOM 0 HB3 PHE A 103 61.077 40.191 49.955 1.00 0.00 H new ATOM 0 HD1 PHE A 103 62.591 41.968 47.097 1.00 0.00 H new ATOM 0 HD2 PHE A 103 59.744 42.239 50.316 1.00 0.00 H new ATOM 0 HE1 PHE A 103 61.602 43.993 46.051 1.00 0.00 H new ATOM 0 HE2 PHE A 103 58.738 44.248 49.255 1.00 0.00 H new ATOM 0 HZ PHE A 103 59.658 45.121 47.117 1.00 0.00 H new ATOM 1562 N VAL A 104 62.799 43.064 51.745 1.00 0.00 N ATOM 1563 CA VAL A 104 62.353 43.991 52.784 1.00 0.00 C ATOM 1564 C VAL A 104 61.571 45.162 52.160 1.00 0.00 C ATOM 1565 O VAL A 104 62.132 45.949 51.389 1.00 0.00 O ATOM 1566 CB VAL A 104 63.530 44.412 53.684 1.00 0.00 C ATOM 1567 CG1 VAL A 104 64.608 45.269 53.012 1.00 0.00 C ATOM 1568 CG2 VAL A 104 63.029 45.138 54.935 1.00 0.00 C ATOM 0 H VAL A 104 63.397 43.517 51.054 1.00 0.00 H new ATOM 0 HA VAL A 104 61.650 43.490 53.450 1.00 0.00 H new ATOM 0 HB VAL A 104 64.012 43.468 53.939 1.00 0.00 H new ATOM 0 HG11 VAL A 104 65.387 45.507 53.736 1.00 0.00 H new ATOM 0 HG12 VAL A 104 65.044 44.718 52.178 1.00 0.00 H new ATOM 0 HG13 VAL A 104 64.161 46.192 52.643 1.00 0.00 H new ATOM 0 HG21 VAL A 104 63.879 45.425 55.554 1.00 0.00 H new ATOM 0 HG22 VAL A 104 62.477 46.030 54.641 1.00 0.00 H new ATOM 0 HG23 VAL A 104 62.374 44.476 55.502 1.00 0.00 H new ATOM 1578 N PRO A 105 60.258 45.284 52.426 1.00 0.00 N ATOM 1579 CA PRO A 105 59.454 46.388 51.917 1.00 0.00 C ATOM 1580 C PRO A 105 59.729 47.689 52.679 1.00 0.00 C ATOM 1581 O PRO A 105 60.233 47.670 53.802 1.00 0.00 O ATOM 1582 CB PRO A 105 57.999 45.927 52.049 1.00 0.00 C ATOM 1583 CG PRO A 105 58.045 45.019 53.278 1.00 0.00 C ATOM 1584 CD PRO A 105 59.420 44.361 53.175 1.00 0.00 C ATOM 0 HA PRO A 105 59.697 46.621 50.880 1.00 0.00 H new ATOM 0 HB2 PRO A 105 57.319 46.767 52.191 1.00 0.00 H new ATOM 0 HB3 PRO A 105 57.662 45.391 51.162 1.00 0.00 H new ATOM 0 HG2 PRO A 105 57.939 45.587 54.202 1.00 0.00 H new ATOM 0 HG3 PRO A 105 57.243 44.281 53.263 1.00 0.00 H new ATOM 0 HD2 PRO A 105 59.836 44.173 54.165 1.00 0.00 H new ATOM 0 HD3 PRO A 105 59.353 43.398 52.669 1.00 0.00 H new ATOM 1592 N LYS A 106 59.332 48.827 52.090 1.00 0.00 N ATOM 1593 CA LYS A 106 59.353 50.152 52.716 1.00 0.00 C ATOM 1594 C LYS A 106 60.719 50.420 53.356 1.00 0.00 C ATOM 1595 O LYS A 106 61.763 50.215 52.735 1.00 0.00 O ATOM 1596 CB LYS A 106 58.078 50.193 53.567 1.00 0.00 C ATOM 1597 CG LYS A 106 57.640 51.581 54.072 1.00 0.00 C ATOM 1598 CD LYS A 106 56.522 52.200 53.211 1.00 0.00 C ATOM 1599 CE LYS A 106 55.127 51.629 53.518 1.00 0.00 C ATOM 1600 NZ LYS A 106 54.554 52.188 54.768 1.00 0.00 N ATOM 0 H LYS A 106 58.977 48.848 51.134 1.00 0.00 H new ATOM 0 HA LYS A 106 59.297 51.012 52.048 1.00 0.00 H new ATOM 0 HB2 LYS A 106 57.262 49.768 52.982 1.00 0.00 H new ATOM 0 HB3 LYS A 106 58.222 49.544 54.431 1.00 0.00 H new ATOM 0 HG2 LYS A 106 57.295 51.496 55.102 1.00 0.00 H new ATOM 0 HG3 LYS A 106 58.501 52.249 54.078 1.00 0.00 H new ATOM 0 HD2 LYS A 106 56.508 53.279 53.368 1.00 0.00 H new ATOM 0 HD3 LYS A 106 56.751 52.034 52.158 1.00 0.00 H new ATOM 0 HE2 LYS A 106 54.457 51.844 52.685 1.00 0.00 H new ATOM 0 HE3 LYS A 106 55.191 50.544 53.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 53.614 51.775 54.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 55.179 51.961 55.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 54.467 53.221 54.679 1.00 0.00 H new