USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=30 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 76 ASN : amide:sc= -1.85 K(o=-0.62,f=-1.5) USER MOD Set 1.2: A 100 SER OG : rot -163:sc= 1.23 USER MOD Set 2.1: A 39 HIS : no HE2:sc= 1.08 K(o=2.4,f=-1.9) USER MOD Set 2.2: A 41 SER OG : rot 137:sc= 1.29 USER MOD Set 3.1: A 23 CYS SG : rot -169:sc= 2.85 USER MOD Set 3.2: A 26 CYS SG : rot 180:sc= 0.522 USER MOD Set 3.3: A 71 CYS SG : rot -142:sc= -5.38! USER MOD Set 3.4: A 74 CYS SG : rot -49:sc= -6.73! USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 149:sc= 1.06 (180deg=0.724) USER MOD Single : A 27 SER OG : rot -33:sc= 0.934 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0.136 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 35 SER OG : rot 49:sc= 1.16 USER MOD Single : A 36 LYS NZ :NH3+ 172:sc= 1.5 (180deg=1.19) 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 132:sc= 1.04 USER MOD Single : A 49 THR OG1 : rot 35:sc= 0.0319 USER MOD Single : A 51 HIS : no HD1:sc= -0.181 K(o=-0.18,f=-3!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 CYS SG : rot 180:sc= -0.236 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= -0.489 K(o=-0.49,f=-3.5!) USER MOD Single : A 68 LYS NZ :NH3+ -172:sc= 1.27 (180deg=1.2) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : no HE2:sc= 0.0354 X(o=0.035,f=-0.34) USER MOD Single : A 84 ASN : amide:sc= 0.194 X(o=0.19,f=-0.005) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 2.03 K(o=2,f=-6.9!) USER MOD Single : A 92 SER OG : rot 103:sc= 1.23 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 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00132) USER MOD ----------------------------------------------------------------- ATOM 261 N PRO A 18 57.261 49.750 47.229 1.00 0.00 N ATOM 262 CA PRO A 18 58.670 50.140 47.121 1.00 0.00 C ATOM 263 C PRO A 18 59.549 49.619 48.271 1.00 0.00 C ATOM 264 O PRO A 18 59.150 49.558 49.436 1.00 0.00 O ATOM 265 CB PRO A 18 58.679 51.672 47.039 1.00 0.00 C ATOM 266 CG PRO A 18 57.416 52.064 47.802 1.00 0.00 C ATOM 267 CD PRO A 18 56.443 50.941 47.442 1.00 0.00 C ATOM 0 HA PRO A 18 59.113 49.685 46.235 1.00 0.00 H new ATOM 0 HB2 PRO A 18 59.574 52.095 47.495 1.00 0.00 H new ATOM 0 HB3 PRO A 18 58.652 52.021 46.007 1.00 0.00 H new ATOM 0 HG2 PRO A 18 57.592 52.118 48.876 1.00 0.00 H new ATOM 0 HG3 PRO A 18 57.042 53.039 47.491 1.00 0.00 H new ATOM 0 HD2 PRO A 18 55.721 50.780 48.242 1.00 0.00 H new ATOM 0 HD3 PRO A 18 55.875 51.190 46.545 1.00 0.00 H new ATOM 275 N GLY A 19 60.791 49.275 47.934 1.00 0.00 N ATOM 276 CA GLY A 19 61.729 48.631 48.844 1.00 0.00 C ATOM 277 C GLY A 19 63.049 48.254 48.187 1.00 0.00 C ATOM 278 O GLY A 19 63.359 48.705 47.078 1.00 0.00 O ATOM 0 H GLY A 19 61.177 49.440 47.005 1.00 0.00 H new ATOM 0 HA2 GLY A 19 61.927 49.299 49.682 1.00 0.00 H new ATOM 0 HA3 GLY A 19 61.267 47.733 49.254 1.00 0.00 H new ATOM 282 N VAL A 20 63.814 47.417 48.888 1.00 0.00 N ATOM 283 CA VAL A 20 65.185 47.011 48.528 1.00 0.00 C ATOM 284 C VAL A 20 65.375 45.497 48.691 1.00 0.00 C ATOM 285 O VAL A 20 64.650 44.853 49.443 1.00 0.00 O ATOM 286 CB VAL A 20 66.224 47.753 49.381 1.00 0.00 C ATOM 287 CG1 VAL A 20 67.565 47.902 48.650 1.00 0.00 C ATOM 288 CG2 VAL A 20 65.807 49.157 49.845 1.00 0.00 C ATOM 0 H VAL A 20 63.491 46.984 49.753 1.00 0.00 H new ATOM 0 HA VAL A 20 65.334 47.275 47.481 1.00 0.00 H new ATOM 0 HB VAL A 20 66.314 47.117 50.261 1.00 0.00 H new ATOM 0 HG11 VAL A 20 68.271 48.432 49.289 1.00 0.00 H new ATOM 0 HG12 VAL A 20 67.962 46.915 48.412 1.00 0.00 H new ATOM 0 HG13 VAL A 20 67.416 48.465 47.728 1.00 0.00 H new ATOM 0 HG21 VAL A 20 66.608 49.596 50.440 1.00 0.00 H new ATOM 0 HG22 VAL A 20 65.614 49.785 48.975 1.00 0.00 H new ATOM 0 HG23 VAL A 20 64.903 49.087 50.450 1.00 0.00 H new ATOM 298 N TYR A 21 66.385 44.928 48.036 1.00 0.00 N ATOM 299 CA TYR A 21 66.776 43.515 48.171 1.00 0.00 C ATOM 300 C TYR A 21 68.141 43.381 48.865 1.00 0.00 C ATOM 301 O TYR A 21 69.000 44.250 48.702 1.00 0.00 O ATOM 302 CB TYR A 21 66.751 42.809 46.808 1.00 0.00 C ATOM 303 CG TYR A 21 65.368 42.376 46.353 1.00 0.00 C ATOM 304 CD1 TYR A 21 64.503 43.292 45.722 1.00 0.00 C ATOM 305 CD2 TYR A 21 64.936 41.053 46.584 1.00 0.00 C ATOM 306 CE1 TYR A 21 63.194 42.904 45.369 1.00 0.00 C ATOM 307 CE2 TYR A 21 63.635 40.657 46.218 1.00 0.00 C ATOM 308 CZ TYR A 21 62.750 41.590 45.638 1.00 0.00 C ATOM 309 OH TYR A 21 61.460 41.235 45.395 1.00 0.00 O ATOM 0 H TYR A 21 66.972 45.444 47.380 1.00 0.00 H new ATOM 0 HA TYR A 21 66.045 43.017 48.808 1.00 0.00 H new ATOM 0 HB2 TYR A 21 67.175 43.477 46.058 1.00 0.00 H new ATOM 0 HB3 TYR A 21 67.396 41.932 46.854 1.00 0.00 H new ATOM 0 HD1 TYR A 21 64.844 44.294 45.508 1.00 0.00 H new ATOM 0 HD2 TYR A 21 65.606 40.341 47.043 1.00 0.00 H new ATOM 0 HE1 TYR A 21 62.531 43.611 44.893 1.00 0.00 H new ATOM 0 HE2 TYR A 21 63.315 39.639 46.381 1.00 0.00 H new ATOM 0 HH TYR A 21 61.328 40.294 45.637 1.00 0.00 H new ATOM 319 N VAL A 22 68.330 42.317 49.655 1.00 0.00 N ATOM 320 CA VAL A 22 69.512 42.109 50.513 1.00 0.00 C ATOM 321 C VAL A 22 69.956 40.649 50.550 1.00 0.00 C ATOM 322 O VAL A 22 69.125 39.750 50.406 1.00 0.00 O ATOM 323 CB VAL A 22 69.304 42.615 51.963 1.00 0.00 C ATOM 324 CG1 VAL A 22 68.413 43.864 52.049 1.00 0.00 C ATOM 325 CG2 VAL A 22 68.648 41.615 52.930 1.00 0.00 C ATOM 0 H VAL A 22 67.652 41.557 49.720 1.00 0.00 H new ATOM 0 HA VAL A 22 70.299 42.706 50.051 1.00 0.00 H new ATOM 0 HB VAL A 22 70.335 42.809 52.260 1.00 0.00 H new ATOM 0 HG11 VAL A 22 68.308 44.165 53.091 1.00 0.00 H new ATOM 0 HG12 VAL A 22 68.868 44.675 51.481 1.00 0.00 H new ATOM 0 HG13 VAL A 22 67.430 43.639 51.636 1.00 0.00 H new ATOM 0 HG21 VAL A 22 68.550 42.072 53.915 1.00 0.00 H new ATOM 0 HG22 VAL A 22 67.661 41.342 52.557 1.00 0.00 H new ATOM 0 HG23 VAL A 22 69.267 40.721 53.004 1.00 0.00 H new ATOM 335 N CYS A 23 71.241 40.415 50.829 1.00 0.00 N ATOM 336 CA CYS A 23 71.812 39.067 50.906 1.00 0.00 C ATOM 337 C CYS A 23 71.200 38.259 52.071 1.00 0.00 C ATOM 338 O CYS A 23 71.023 38.785 53.174 1.00 0.00 O ATOM 339 CB CYS A 23 73.348 39.163 50.996 1.00 0.00 C ATOM 340 SG CYS A 23 74.085 37.504 50.958 1.00 0.00 S ATOM 0 H CYS A 23 71.917 41.157 51.008 1.00 0.00 H new ATOM 0 HA CYS A 23 71.561 38.519 49.998 1.00 0.00 H new ATOM 0 HB2 CYS A 23 73.731 39.758 50.167 1.00 0.00 H new ATOM 0 HB3 CYS A 23 73.634 39.675 51.915 1.00 0.00 H new ATOM 0 HG CYS A 23 75.345 37.582 51.270 1.00 0.00 H new ATOM 345 N ALA A 24 70.966 36.961 51.852 1.00 0.00 N ATOM 346 CA ALA A 24 70.511 36.055 52.907 1.00 0.00 C ATOM 347 C ALA A 24 71.587 35.739 53.980 1.00 0.00 C ATOM 348 O ALA A 24 71.310 35.003 54.935 1.00 0.00 O ATOM 349 CB ALA A 24 69.955 34.763 52.304 1.00 0.00 C ATOM 0 H ALA A 24 71.086 36.513 50.944 1.00 0.00 H new ATOM 0 HA ALA A 24 69.717 36.586 53.432 1.00 0.00 H new ATOM 0 HB1 ALA A 24 69.622 34.102 53.104 1.00 0.00 H new ATOM 0 HB2 ALA A 24 69.113 34.998 51.653 1.00 0.00 H new ATOM 0 HB3 ALA A 24 70.734 34.267 51.725 1.00 0.00 H new ATOM 355 N LYS A 25 72.824 36.233 53.806 1.00 0.00 N ATOM 356 CA LYS A 25 73.961 36.033 54.706 1.00 0.00 C ATOM 357 C LYS A 25 74.733 37.307 55.037 1.00 0.00 C ATOM 358 O LYS A 25 75.066 37.540 56.199 1.00 0.00 O ATOM 359 CB LYS A 25 74.885 34.998 54.080 1.00 0.00 C ATOM 360 CG LYS A 25 74.506 33.574 54.510 1.00 0.00 C ATOM 361 CD LYS A 25 75.649 32.619 54.222 1.00 0.00 C ATOM 362 CE LYS A 25 75.279 31.192 54.636 1.00 0.00 C ATOM 363 NZ LYS A 25 76.331 30.217 54.273 1.00 0.00 N ATOM 0 H LYS A 25 73.064 36.807 52.998 1.00 0.00 H new ATOM 0 HA LYS A 25 73.564 35.689 55.661 1.00 0.00 H new ATOM 0 HB2 LYS A 25 74.838 35.076 52.994 1.00 0.00 H new ATOM 0 HB3 LYS A 25 75.915 35.205 54.370 1.00 0.00 H new ATOM 0 HG2 LYS A 25 74.268 33.558 55.574 1.00 0.00 H new ATOM 0 HG3 LYS A 25 73.610 33.252 53.979 1.00 0.00 H new ATOM 0 HD2 LYS A 25 75.891 32.644 53.160 1.00 0.00 H new ATOM 0 HD3 LYS A 25 76.541 32.939 54.760 1.00 0.00 H new ATOM 0 HE2 LYS A 25 75.111 31.159 55.712 1.00 0.00 H new ATOM 0 HE3 LYS A 25 74.341 30.908 54.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 76.338 29.440 54.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 76.138 29.835 53.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 77.257 30.690 54.274 1.00 0.00 H new ATOM 377 N CYS A 26 75.016 38.123 54.031 1.00 0.00 N ATOM 378 CA CYS A 26 75.777 39.352 54.171 1.00 0.00 C ATOM 379 C CYS A 26 74.893 40.477 54.766 1.00 0.00 C ATOM 380 O CYS A 26 75.374 41.313 55.535 1.00 0.00 O ATOM 381 CB CYS A 26 76.397 39.681 52.801 1.00 0.00 C ATOM 382 SG CYS A 26 77.261 38.262 52.068 1.00 0.00 S ATOM 0 H CYS A 26 74.715 37.943 53.073 1.00 0.00 H new ATOM 0 HA CYS A 26 76.595 39.241 54.883 1.00 0.00 H new ATOM 0 HB2 CYS A 26 75.612 40.015 52.122 1.00 0.00 H new ATOM 0 HB3 CYS A 26 77.096 40.510 52.912 1.00 0.00 H new ATOM 0 HG CYS A 26 77.758 38.604 50.916 1.00 0.00 H new ATOM 387 N SER A 27 73.601 40.474 54.408 1.00 0.00 N ATOM 388 CA SER A 27 72.593 41.508 54.724 1.00 0.00 C ATOM 389 C SER A 27 72.914 42.906 54.168 1.00 0.00 C ATOM 390 O SER A 27 72.290 43.901 54.541 1.00 0.00 O ATOM 391 CB SER A 27 72.192 41.503 56.210 1.00 0.00 C ATOM 392 OG SER A 27 73.155 42.137 57.033 1.00 0.00 O ATOM 0 H SER A 27 73.205 39.710 53.860 1.00 0.00 H new ATOM 0 HA SER A 27 71.700 41.216 54.171 1.00 0.00 H new ATOM 0 HB2 SER A 27 71.232 42.006 56.326 1.00 0.00 H new ATOM 0 HB3 SER A 27 72.055 40.474 56.543 1.00 0.00 H new ATOM 0 HG SER A 27 74.051 41.983 56.667 1.00 0.00 H new ATOM 398 N TYR A 28 73.871 42.980 53.238 1.00 0.00 N ATOM 399 CA TYR A 28 74.144 44.167 52.438 1.00 0.00 C ATOM 400 C TYR A 28 72.992 44.405 51.450 1.00 0.00 C ATOM 401 O TYR A 28 72.583 43.473 50.754 1.00 0.00 O ATOM 402 CB TYR A 28 75.492 44.013 51.734 1.00 0.00 C ATOM 403 CG TYR A 28 76.145 45.301 51.255 1.00 0.00 C ATOM 404 CD1 TYR A 28 75.563 46.070 50.226 1.00 0.00 C ATOM 405 CD2 TYR A 28 77.372 45.710 51.815 1.00 0.00 C ATOM 406 CE1 TYR A 28 76.202 47.232 49.754 1.00 0.00 C ATOM 407 CE2 TYR A 28 78.019 46.867 51.340 1.00 0.00 C ATOM 408 CZ TYR A 28 77.439 47.626 50.303 1.00 0.00 C ATOM 409 OH TYR A 28 78.081 48.716 49.806 1.00 0.00 O ATOM 0 H TYR A 28 74.488 42.197 53.020 1.00 0.00 H new ATOM 0 HA TYR A 28 74.208 45.046 53.079 1.00 0.00 H new ATOM 0 HB2 TYR A 28 76.180 43.512 52.415 1.00 0.00 H new ATOM 0 HB3 TYR A 28 75.358 43.356 50.875 1.00 0.00 H new ATOM 0 HD1 TYR A 28 74.620 45.765 49.797 1.00 0.00 H new ATOM 0 HD2 TYR A 28 77.818 45.133 52.612 1.00 0.00 H new ATOM 0 HE1 TYR A 28 75.745 47.821 48.972 1.00 0.00 H new ATOM 0 HE2 TYR A 28 78.961 47.173 51.771 1.00 0.00 H new ATOM 0 HH TYR A 28 78.919 48.853 50.295 1.00 0.00 H new ATOM 419 N GLU A 29 72.458 45.626 51.379 1.00 0.00 N ATOM 420 CA GLU A 29 71.295 45.938 50.544 1.00 0.00 C ATOM 421 C GLU A 29 71.702 46.431 49.142 1.00 0.00 C ATOM 422 O GLU A 29 72.222 47.542 49.004 1.00 0.00 O ATOM 423 CB GLU A 29 70.389 46.960 51.257 1.00 0.00 C ATOM 424 CG GLU A 29 70.083 46.640 52.732 1.00 0.00 C ATOM 425 CD GLU A 29 70.854 47.539 53.701 1.00 0.00 C ATOM 426 OE1 GLU A 29 72.108 47.541 53.676 1.00 0.00 O ATOM 427 OE2 GLU A 29 70.212 48.233 54.525 1.00 0.00 O ATOM 0 H GLU A 29 72.819 46.426 51.898 1.00 0.00 H new ATOM 0 HA GLU A 29 70.733 45.016 50.397 1.00 0.00 H new ATOM 0 HB2 GLU A 29 70.861 47.941 51.204 1.00 0.00 H new ATOM 0 HB3 GLU A 29 69.447 47.030 50.713 1.00 0.00 H new ATOM 0 HG2 GLU A 29 69.014 46.753 52.910 1.00 0.00 H new ATOM 0 HG3 GLU A 29 70.331 45.598 52.933 1.00 0.00 H new ATOM 434 N LEU A 30 71.468 45.628 48.094 1.00 0.00 N ATOM 435 CA LEU A 30 71.749 45.988 46.703 1.00 0.00 C ATOM 436 C LEU A 30 70.951 45.163 45.668 1.00 0.00 C ATOM 437 O LEU A 30 70.838 43.941 45.718 1.00 0.00 O ATOM 438 CB LEU A 30 73.268 45.989 46.415 1.00 0.00 C ATOM 439 CG LEU A 30 74.107 44.803 46.925 1.00 0.00 C ATOM 440 CD1 LEU A 30 73.774 43.487 46.226 1.00 0.00 C ATOM 441 CD2 LEU A 30 75.585 45.103 46.676 1.00 0.00 C ATOM 0 H LEU A 30 71.071 44.694 48.195 1.00 0.00 H new ATOM 0 HA LEU A 30 71.389 47.010 46.580 1.00 0.00 H new ATOM 0 HB2 LEU A 30 73.402 46.051 45.335 1.00 0.00 H new ATOM 0 HB3 LEU A 30 73.687 46.901 46.841 1.00 0.00 H new ATOM 0 HG LEU A 30 73.880 44.686 47.985 1.00 0.00 H new ATOM 0 HD11 LEU A 30 74.400 42.691 46.631 1.00 0.00 H new ATOM 0 HD12 LEU A 30 72.725 43.243 46.391 1.00 0.00 H new ATOM 0 HD13 LEU A 30 73.960 43.586 45.157 1.00 0.00 H new ATOM 0 HD21 LEU A 30 76.191 44.270 47.033 1.00 0.00 H new ATOM 0 HD22 LEU A 30 75.753 45.242 45.608 1.00 0.00 H new ATOM 0 HD23 LEU A 30 75.867 46.011 47.209 1.00 0.00 H new ATOM 453 N PHE A 31 70.411 45.894 44.699 1.00 0.00 N ATOM 454 CA PHE A 31 69.778 45.457 43.442 1.00 0.00 C ATOM 455 C PHE A 31 69.509 46.668 42.516 1.00 0.00 C ATOM 456 O PHE A 31 69.849 47.800 42.857 1.00 0.00 O ATOM 457 CB PHE A 31 68.454 44.704 43.717 1.00 0.00 C ATOM 458 CG PHE A 31 67.207 45.559 43.928 1.00 0.00 C ATOM 459 CD1 PHE A 31 67.199 46.623 44.851 1.00 0.00 C ATOM 460 CD2 PHE A 31 66.059 45.314 43.148 1.00 0.00 C ATOM 461 CE1 PHE A 31 66.066 47.449 44.966 1.00 0.00 C ATOM 462 CE2 PHE A 31 64.919 46.126 43.285 1.00 0.00 C ATOM 463 CZ PHE A 31 64.921 47.193 44.196 1.00 0.00 C ATOM 0 H PHE A 31 70.400 46.911 44.774 1.00 0.00 H new ATOM 0 HA PHE A 31 70.468 44.775 42.944 1.00 0.00 H new ATOM 0 HB2 PHE A 31 68.266 44.030 42.881 1.00 0.00 H new ATOM 0 HB3 PHE A 31 68.594 44.083 44.602 1.00 0.00 H new ATOM 0 HD1 PHE A 31 68.064 46.805 45.471 1.00 0.00 H new ATOM 0 HD2 PHE A 31 66.055 44.498 42.441 1.00 0.00 H new ATOM 0 HE1 PHE A 31 66.077 48.284 45.650 1.00 0.00 H new ATOM 0 HE2 PHE A 31 64.041 45.928 42.688 1.00 0.00 H new ATOM 0 HZ PHE A 31 64.045 47.815 44.304 1.00 0.00 H new ATOM 473 N SER A 32 68.908 46.436 41.347 1.00 0.00 N ATOM 474 CA SER A 32 68.464 47.459 40.394 1.00 0.00 C ATOM 475 C SER A 32 67.035 47.194 39.903 1.00 0.00 C ATOM 476 O SER A 32 66.592 46.043 39.807 1.00 0.00 O ATOM 477 CB SER A 32 69.444 47.505 39.214 1.00 0.00 C ATOM 478 OG SER A 32 68.994 48.353 38.174 1.00 0.00 O ATOM 0 H SER A 32 68.708 45.490 41.023 1.00 0.00 H new ATOM 0 HA SER A 32 68.453 48.425 40.899 1.00 0.00 H new ATOM 0 HB2 SER A 32 70.416 47.850 39.566 1.00 0.00 H new ATOM 0 HB3 SER A 32 69.585 46.498 38.823 1.00 0.00 H new ATOM 0 HG SER A 32 69.649 48.353 37.445 1.00 0.00 H new ATOM 484 N SER A 33 66.333 48.256 39.509 1.00 0.00 N ATOM 485 CA SER A 33 65.054 48.163 38.798 1.00 0.00 C ATOM 486 C SER A 33 65.197 47.424 37.464 1.00 0.00 C ATOM 487 O SER A 33 64.339 46.619 37.109 1.00 0.00 O ATOM 488 CB SER A 33 64.503 49.568 38.524 1.00 0.00 C ATOM 489 OG SER A 33 64.358 50.291 39.732 1.00 0.00 O ATOM 0 H SER A 33 66.637 49.215 39.675 1.00 0.00 H new ATOM 0 HA SER A 33 64.370 47.602 39.435 1.00 0.00 H new ATOM 0 HB2 SER A 33 65.174 50.103 37.852 1.00 0.00 H new ATOM 0 HB3 SER A 33 63.539 49.495 38.020 1.00 0.00 H new ATOM 0 HG SER A 33 64.007 51.185 39.538 1.00 0.00 H new ATOM 495 N HIS A 34 66.300 47.637 36.735 1.00 0.00 N ATOM 496 CA HIS A 34 66.458 47.121 35.369 1.00 0.00 C ATOM 497 C HIS A 34 66.652 45.598 35.299 1.00 0.00 C ATOM 498 O HIS A 34 66.351 44.981 34.277 1.00 0.00 O ATOM 499 CB HIS A 34 67.590 47.869 34.654 1.00 0.00 C ATOM 500 CG HIS A 34 67.412 49.369 34.640 1.00 0.00 C ATOM 501 ND1 HIS A 34 66.335 50.057 34.126 1.00 0.00 N ATOM 502 CD2 HIS A 34 68.285 50.300 35.135 1.00 0.00 C ATOM 503 CE1 HIS A 34 66.559 51.371 34.299 1.00 0.00 C ATOM 504 NE2 HIS A 34 67.733 51.571 34.921 1.00 0.00 N ATOM 0 H HIS A 34 67.103 48.168 37.072 1.00 0.00 H new ATOM 0 HA HIS A 34 65.518 47.310 34.850 1.00 0.00 H new ATOM 0 HB2 HIS A 34 68.536 47.629 35.139 1.00 0.00 H new ATOM 0 HB3 HIS A 34 67.659 47.510 33.627 1.00 0.00 H new ATOM 0 HD2 HIS A 34 69.233 50.092 35.608 1.00 0.00 H new ATOM 0 HE1 HIS A 34 65.889 52.156 33.982 1.00 0.00 H new ATOM 0 HE2 HIS A 34 68.141 52.468 35.185 1.00 0.00 H new ATOM 512 N SER A 35 67.071 44.986 36.406 1.00 0.00 N ATOM 513 CA SER A 35 67.207 43.560 36.625 1.00 0.00 C ATOM 514 C SER A 35 65.882 42.849 36.890 1.00 0.00 C ATOM 515 O SER A 35 65.798 41.639 36.691 1.00 0.00 O ATOM 516 CB SER A 35 68.181 43.284 37.778 1.00 0.00 C ATOM 517 OG SER A 35 68.319 44.356 38.693 1.00 0.00 O ATOM 0 H SER A 35 67.343 45.521 37.231 1.00 0.00 H new ATOM 0 HA SER A 35 67.600 43.153 35.694 1.00 0.00 H new ATOM 0 HB2 SER A 35 67.843 42.400 38.320 1.00 0.00 H new ATOM 0 HB3 SER A 35 69.161 43.048 37.362 1.00 0.00 H new ATOM 0 HG SER A 35 67.432 44.677 38.957 1.00 0.00 H new ATOM 523 N LYS A 36 64.852 43.582 37.335 1.00 0.00 N ATOM 524 CA LYS A 36 63.550 43.017 37.722 1.00 0.00 C ATOM 525 C LYS A 36 62.428 43.625 36.877 1.00 0.00 C ATOM 526 O LYS A 36 61.689 44.505 37.318 1.00 0.00 O ATOM 527 CB LYS A 36 63.361 43.136 39.250 1.00 0.00 C ATOM 528 CG LYS A 36 62.595 41.947 39.854 1.00 0.00 C ATOM 529 CD LYS A 36 61.128 41.766 39.437 1.00 0.00 C ATOM 530 CE LYS A 36 60.213 42.863 40.000 1.00 0.00 C ATOM 531 NZ LYS A 36 59.613 43.702 38.936 1.00 0.00 N ATOM 0 H LYS A 36 64.899 44.596 37.438 1.00 0.00 H new ATOM 0 HA LYS A 36 63.513 41.949 37.505 1.00 0.00 H new ATOM 0 HB2 LYS A 36 64.338 43.212 39.727 1.00 0.00 H new ATOM 0 HB3 LYS A 36 62.825 44.058 39.474 1.00 0.00 H new ATOM 0 HG2 LYS A 36 63.133 41.034 39.598 1.00 0.00 H new ATOM 0 HG3 LYS A 36 62.627 42.042 40.939 1.00 0.00 H new ATOM 0 HD2 LYS A 36 61.061 41.766 38.349 1.00 0.00 H new ATOM 0 HD3 LYS A 36 60.775 40.793 39.779 1.00 0.00 H new ATOM 0 HE2 LYS A 36 59.418 42.403 40.587 1.00 0.00 H new ATOM 0 HE3 LYS A 36 60.785 43.496 40.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 58.903 44.337 39.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 60.357 44.268 38.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 59.158 43.091 38.228 1.00 0.00 H new ATOM 545 N TYR A 37 62.276 43.094 35.667 1.00 0.00 N ATOM 546 CA TYR A 37 61.239 43.444 34.704 1.00 0.00 C ATOM 547 C TYR A 37 59.843 42.959 35.134 1.00 0.00 C ATOM 548 O TYR A 37 59.616 42.488 36.256 1.00 0.00 O ATOM 549 CB TYR A 37 61.673 42.937 33.310 1.00 0.00 C ATOM 550 CG TYR A 37 61.661 41.431 33.094 1.00 0.00 C ATOM 551 CD1 TYR A 37 62.641 40.607 33.688 1.00 0.00 C ATOM 552 CD2 TYR A 37 60.694 40.855 32.243 1.00 0.00 C ATOM 553 CE1 TYR A 37 62.628 39.218 33.462 1.00 0.00 C ATOM 554 CE2 TYR A 37 60.697 39.468 31.996 1.00 0.00 C ATOM 555 CZ TYR A 37 61.658 38.644 32.619 1.00 0.00 C ATOM 556 OH TYR A 37 61.678 37.306 32.384 1.00 0.00 O ATOM 0 H TYR A 37 62.905 42.372 35.315 1.00 0.00 H new ATOM 0 HA TYR A 37 61.135 44.528 34.657 1.00 0.00 H new ATOM 0 HB2 TYR A 37 61.021 43.392 32.565 1.00 0.00 H new ATOM 0 HB3 TYR A 37 62.682 43.300 33.115 1.00 0.00 H new ATOM 0 HD1 TYR A 37 63.403 41.043 34.317 1.00 0.00 H new ATOM 0 HD2 TYR A 37 59.947 41.481 31.778 1.00 0.00 H new ATOM 0 HE1 TYR A 37 63.366 38.589 33.938 1.00 0.00 H new ATOM 0 HE2 TYR A 37 59.964 39.036 31.330 1.00 0.00 H new ATOM 0 HH TYR A 37 60.942 37.068 31.783 1.00 0.00 H new ATOM 566 N ALA A 38 58.882 43.161 34.242 1.00 0.00 N ATOM 567 CA ALA A 38 57.494 42.726 34.392 1.00 0.00 C ATOM 568 C ALA A 38 57.236 41.385 33.676 1.00 0.00 C ATOM 569 O ALA A 38 57.341 41.298 32.455 1.00 0.00 O ATOM 570 CB ALA A 38 56.576 43.843 33.879 1.00 0.00 C ATOM 0 H ALA A 38 59.051 43.649 33.362 1.00 0.00 H new ATOM 0 HA ALA A 38 57.280 42.544 35.445 1.00 0.00 H new ATOM 0 HB1 ALA A 38 55.535 43.535 33.983 1.00 0.00 H new ATOM 0 HB2 ALA A 38 56.746 44.750 34.460 1.00 0.00 H new ATOM 0 HB3 ALA A 38 56.793 44.039 32.829 1.00 0.00 H new ATOM 576 N HIS A 39 56.867 40.344 34.425 1.00 0.00 N ATOM 577 CA HIS A 39 56.336 39.076 33.923 1.00 0.00 C ATOM 578 C HIS A 39 55.460 38.429 35.003 1.00 0.00 C ATOM 579 O HIS A 39 55.910 38.238 36.133 1.00 0.00 O ATOM 580 CB HIS A 39 57.503 38.167 33.530 1.00 0.00 C ATOM 581 CG HIS A 39 57.116 36.761 33.141 1.00 0.00 C ATOM 582 ND1 HIS A 39 56.724 36.308 31.897 1.00 0.00 N ATOM 583 CD2 HIS A 39 57.155 35.670 33.968 1.00 0.00 C ATOM 584 CE1 HIS A 39 56.549 34.979 31.975 1.00 0.00 C ATOM 585 NE2 HIS A 39 56.790 34.545 33.223 1.00 0.00 N ATOM 0 H HIS A 39 56.933 40.363 35.443 1.00 0.00 H new ATOM 0 HA HIS A 39 55.718 39.243 33.041 1.00 0.00 H new ATOM 0 HB2 HIS A 39 58.035 38.625 32.696 1.00 0.00 H new ATOM 0 HB3 HIS A 39 58.202 38.117 34.365 1.00 0.00 H new ATOM 0 HD1 HIS A 39 56.591 36.882 31.065 1.00 0.00 H new ATOM 0 HD2 HIS A 39 57.422 35.678 35.015 1.00 0.00 H new ATOM 0 HE1 HIS A 39 56.255 34.347 31.150 1.00 0.00 H new ATOM 593 N SER A 40 54.208 38.113 34.666 1.00 0.00 N ATOM 594 CA SER A 40 53.180 37.706 35.614 1.00 0.00 C ATOM 595 C SER A 40 52.992 36.187 35.621 1.00 0.00 C ATOM 596 O SER A 40 52.237 35.630 34.819 1.00 0.00 O ATOM 597 CB SER A 40 51.891 38.453 35.296 1.00 0.00 C ATOM 598 OG SER A 40 51.667 39.481 36.237 1.00 0.00 O ATOM 0 H SER A 40 53.877 38.135 33.701 1.00 0.00 H new ATOM 0 HA SER A 40 53.491 37.969 36.625 1.00 0.00 H new ATOM 0 HB2 SER A 40 51.948 38.877 34.293 1.00 0.00 H new ATOM 0 HB3 SER A 40 51.051 37.758 35.301 1.00 0.00 H new ATOM 0 HG SER A 40 50.836 39.951 36.016 1.00 0.00 H new ATOM 604 N SER A 41 53.713 35.528 36.525 1.00 0.00 N ATOM 605 CA SER A 41 53.770 34.069 36.705 1.00 0.00 C ATOM 606 C SER A 41 54.214 33.732 38.139 1.00 0.00 C ATOM 607 O SER A 41 54.770 34.606 38.817 1.00 0.00 O ATOM 608 CB SER A 41 54.805 33.471 35.739 1.00 0.00 C ATOM 609 OG SER A 41 54.402 33.641 34.394 1.00 0.00 O ATOM 0 H SER A 41 54.308 36.020 37.191 1.00 0.00 H new ATOM 0 HA SER A 41 52.780 33.658 36.511 1.00 0.00 H new ATOM 0 HB2 SER A 41 55.772 33.949 35.896 1.00 0.00 H new ATOM 0 HB3 SER A 41 54.936 32.410 35.952 1.00 0.00 H new ATOM 0 HG SER A 41 55.172 33.917 33.854 1.00 0.00 H new ATOM 615 N PRO A 42 54.052 32.482 38.616 1.00 0.00 N ATOM 616 CA PRO A 42 54.879 31.975 39.713 1.00 0.00 C ATOM 617 C PRO A 42 56.373 32.081 39.359 1.00 0.00 C ATOM 618 O PRO A 42 56.749 31.976 38.193 1.00 0.00 O ATOM 619 CB PRO A 42 54.448 30.516 39.911 1.00 0.00 C ATOM 620 CG PRO A 42 53.946 30.106 38.525 1.00 0.00 C ATOM 621 CD PRO A 42 53.291 31.389 38.017 1.00 0.00 C ATOM 0 HA PRO A 42 54.744 32.552 40.628 1.00 0.00 H new ATOM 0 HB2 PRO A 42 55.279 29.892 40.239 1.00 0.00 H new ATOM 0 HB3 PRO A 42 53.666 30.426 40.665 1.00 0.00 H new ATOM 0 HG2 PRO A 42 54.761 29.783 37.878 1.00 0.00 H new ATOM 0 HG3 PRO A 42 53.235 29.281 38.579 1.00 0.00 H new ATOM 0 HD2 PRO A 42 53.322 31.440 36.929 1.00 0.00 H new ATOM 0 HD3 PRO A 42 52.242 31.436 38.309 1.00 0.00 H new ATOM 629 N TRP A 43 57.221 32.286 40.373 1.00 0.00 N ATOM 630 CA TRP A 43 58.687 32.350 40.259 1.00 0.00 C ATOM 631 C TRP A 43 59.203 33.255 39.106 1.00 0.00 C ATOM 632 O TRP A 43 59.853 32.765 38.177 1.00 0.00 O ATOM 633 CB TRP A 43 59.237 30.917 40.182 1.00 0.00 C ATOM 634 CG TRP A 43 58.680 29.893 41.134 1.00 0.00 C ATOM 635 CD1 TRP A 43 58.380 28.626 40.777 1.00 0.00 C ATOM 636 CD2 TRP A 43 58.360 29.984 42.561 1.00 0.00 C ATOM 637 NE1 TRP A 43 57.903 27.928 41.868 1.00 0.00 N ATOM 638 CE2 TRP A 43 57.860 28.717 42.992 1.00 0.00 C ATOM 639 CE3 TRP A 43 58.430 31.001 43.548 1.00 0.00 C ATOM 640 CZ2 TRP A 43 57.455 28.468 44.312 1.00 0.00 C ATOM 641 CZ3 TRP A 43 58.026 30.763 44.874 1.00 0.00 C ATOM 642 CH2 TRP A 43 57.541 29.499 45.261 1.00 0.00 C ATOM 0 H TRP A 43 56.896 32.417 41.331 1.00 0.00 H new ATOM 0 HA TRP A 43 59.070 32.842 41.153 1.00 0.00 H new ATOM 0 HB2 TRP A 43 59.076 30.552 39.168 1.00 0.00 H new ATOM 0 HB3 TRP A 43 60.315 30.965 40.336 1.00 0.00 H new ATOM 0 HD1 TRP A 43 58.496 28.218 39.784 1.00 0.00 H new ATOM 0 HE1 TRP A 43 57.618 26.949 41.843 1.00 0.00 H new ATOM 0 HE3 TRP A 43 58.801 31.978 43.275 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 57.082 27.495 44.595 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 58.088 31.558 45.603 1.00 0.00 H new ATOM 0 HH2 TRP A 43 57.237 29.324 46.282 1.00 0.00 H new ATOM 653 N PRO A 44 58.913 34.572 39.116 1.00 0.00 N ATOM 654 CA PRO A 44 59.326 35.486 38.050 1.00 0.00 C ATOM 655 C PRO A 44 60.858 35.623 37.961 1.00 0.00 C ATOM 656 O PRO A 44 61.555 35.703 38.972 1.00 0.00 O ATOM 657 CB PRO A 44 58.636 36.819 38.358 1.00 0.00 C ATOM 658 CG PRO A 44 58.465 36.780 39.876 1.00 0.00 C ATOM 659 CD PRO A 44 58.196 35.300 40.150 1.00 0.00 C ATOM 0 HA PRO A 44 59.032 35.110 37.070 1.00 0.00 H new ATOM 0 HB2 PRO A 44 59.242 37.668 38.043 1.00 0.00 H new ATOM 0 HB3 PRO A 44 57.677 36.904 37.847 1.00 0.00 H new ATOM 0 HG2 PRO A 44 59.358 37.131 40.393 1.00 0.00 H new ATOM 0 HG3 PRO A 44 57.638 37.409 40.206 1.00 0.00 H new ATOM 0 HD2 PRO A 44 58.545 35.016 41.143 1.00 0.00 H new ATOM 0 HD3 PRO A 44 57.129 35.083 40.113 1.00 0.00 H new ATOM 667 N ALA A 45 61.374 35.653 36.729 1.00 0.00 N ATOM 668 CA ALA A 45 62.808 35.675 36.434 1.00 0.00 C ATOM 669 C ALA A 45 63.423 37.094 36.462 1.00 0.00 C ATOM 670 O ALA A 45 62.722 38.103 36.583 1.00 0.00 O ATOM 671 CB ALA A 45 63.021 34.971 35.088 1.00 0.00 C ATOM 0 H ALA A 45 60.793 35.663 35.891 1.00 0.00 H new ATOM 0 HA ALA A 45 63.339 35.143 37.223 1.00 0.00 H new ATOM 0 HB1 ALA A 45 64.083 34.972 34.841 1.00 0.00 H new ATOM 0 HB2 ALA A 45 62.665 33.943 35.155 1.00 0.00 H new ATOM 0 HB3 ALA A 45 62.467 35.497 34.311 1.00 0.00 H new ATOM 677 N PHE A 46 64.753 37.167 36.342 1.00 0.00 N ATOM 678 CA PHE A 46 65.546 38.400 36.271 1.00 0.00 C ATOM 679 C PHE A 46 66.169 38.574 34.872 1.00 0.00 C ATOM 680 O PHE A 46 66.463 37.608 34.165 1.00 0.00 O ATOM 681 CB PHE A 46 66.639 38.386 37.359 1.00 0.00 C ATOM 682 CG PHE A 46 66.282 38.974 38.719 1.00 0.00 C ATOM 683 CD1 PHE A 46 65.055 38.691 39.353 1.00 0.00 C ATOM 684 CD2 PHE A 46 67.232 39.776 39.384 1.00 0.00 C ATOM 685 CE1 PHE A 46 64.784 39.206 40.634 1.00 0.00 C ATOM 686 CE2 PHE A 46 66.958 40.298 40.660 1.00 0.00 C ATOM 687 CZ PHE A 46 65.732 40.014 41.285 1.00 0.00 C ATOM 0 H PHE A 46 65.333 36.330 36.289 1.00 0.00 H new ATOM 0 HA PHE A 46 64.886 39.249 36.448 1.00 0.00 H new ATOM 0 HB2 PHE A 46 66.951 37.352 37.510 1.00 0.00 H new ATOM 0 HB3 PHE A 46 67.504 38.927 36.975 1.00 0.00 H new ATOM 0 HD1 PHE A 46 64.320 38.077 38.854 1.00 0.00 H new ATOM 0 HD2 PHE A 46 68.178 39.991 38.909 1.00 0.00 H new ATOM 0 HE1 PHE A 46 63.845 38.980 41.118 1.00 0.00 H new ATOM 0 HE2 PHE A 46 67.689 40.917 41.159 1.00 0.00 H new ATOM 0 HZ PHE A 46 65.518 40.416 42.264 1.00 0.00 H new ATOM 697 N THR A 47 66.406 39.825 34.479 1.00 0.00 N ATOM 698 CA THR A 47 67.131 40.200 33.249 1.00 0.00 C ATOM 699 C THR A 47 68.632 40.340 33.485 1.00 0.00 C ATOM 700 O THR A 47 69.423 39.905 32.652 1.00 0.00 O ATOM 701 CB THR A 47 66.608 41.525 32.670 1.00 0.00 C ATOM 702 OG1 THR A 47 66.019 42.325 33.679 1.00 0.00 O ATOM 703 CG2 THR A 47 65.557 41.288 31.591 1.00 0.00 C ATOM 0 H THR A 47 66.094 40.633 35.017 1.00 0.00 H new ATOM 0 HA THR A 47 66.954 39.390 32.541 1.00 0.00 H new ATOM 0 HB THR A 47 67.470 42.035 32.240 1.00 0.00 H new ATOM 0 HG1 THR A 47 66.362 43.240 33.613 1.00 0.00 H new ATOM 0 HG21 THR A 47 65.210 42.246 31.204 1.00 0.00 H new ATOM 0 HG22 THR A 47 65.994 40.706 30.779 1.00 0.00 H new ATOM 0 HG23 THR A 47 64.715 40.742 32.017 1.00 0.00 H new ATOM 711 N GLU A 48 69.041 40.974 34.588 1.00 0.00 N ATOM 712 CA GLU A 48 70.408 41.397 34.863 1.00 0.00 C ATOM 713 C GLU A 48 70.853 41.067 36.300 1.00 0.00 C ATOM 714 O GLU A 48 70.118 40.504 37.112 1.00 0.00 O ATOM 715 CB GLU A 48 70.501 42.912 34.637 1.00 0.00 C ATOM 716 CG GLU A 48 70.392 43.371 33.195 1.00 0.00 C ATOM 717 CD GLU A 48 71.755 43.800 32.643 1.00 0.00 C ATOM 718 OE1 GLU A 48 72.700 42.969 32.647 1.00 0.00 O ATOM 719 OE2 GLU A 48 71.873 44.977 32.227 1.00 0.00 O ATOM 0 H GLU A 48 68.398 41.214 35.342 1.00 0.00 H new ATOM 0 HA GLU A 48 71.071 40.853 34.190 1.00 0.00 H new ATOM 0 HB2 GLU A 48 69.712 43.396 35.213 1.00 0.00 H new ATOM 0 HB3 GLU A 48 71.451 43.263 35.040 1.00 0.00 H new ATOM 0 HG2 GLU A 48 69.987 42.564 32.584 1.00 0.00 H new ATOM 0 HG3 GLU A 48 69.692 44.204 33.128 1.00 0.00 H new ATOM 726 N THR A 49 72.085 41.469 36.587 1.00 0.00 N ATOM 727 CA THR A 49 72.898 41.138 37.760 1.00 0.00 C ATOM 728 C THR A 49 73.508 42.395 38.373 1.00 0.00 C ATOM 729 O THR A 49 73.990 43.259 37.646 1.00 0.00 O ATOM 730 CB THR A 49 74.042 40.191 37.362 1.00 0.00 C ATOM 731 OG1 THR A 49 74.715 40.670 36.224 1.00 0.00 O ATOM 732 CG2 THR A 49 73.540 38.787 37.043 1.00 0.00 C ATOM 0 H THR A 49 72.588 42.089 35.952 1.00 0.00 H new ATOM 0 HA THR A 49 72.245 40.657 38.489 1.00 0.00 H new ATOM 0 HB THR A 49 74.713 40.151 38.220 1.00 0.00 H new ATOM 0 HG1 THR A 49 74.737 41.650 36.245 1.00 0.00 H new ATOM 0 HG21 THR A 49 74.383 38.153 36.767 1.00 0.00 H new ATOM 0 HG22 THR A 49 73.044 38.370 37.920 1.00 0.00 H new ATOM 0 HG23 THR A 49 72.834 38.833 36.214 1.00 0.00 H new ATOM 740 N ILE A 50 73.481 42.533 39.707 1.00 0.00 N ATOM 741 CA ILE A 50 73.839 43.790 40.382 1.00 0.00 C ATOM 742 C ILE A 50 74.876 43.621 41.501 1.00 0.00 C ATOM 743 O ILE A 50 75.502 44.586 41.935 1.00 0.00 O ATOM 744 CB ILE A 50 72.558 44.443 40.940 1.00 0.00 C ATOM 745 CG1 ILE A 50 71.232 44.066 40.224 1.00 0.00 C ATOM 746 CG2 ILE A 50 72.738 45.973 40.900 1.00 0.00 C ATOM 747 CD1 ILE A 50 70.568 42.777 40.750 1.00 0.00 C ATOM 0 H ILE A 50 73.213 41.783 40.344 1.00 0.00 H new ATOM 0 HA ILE A 50 74.310 44.430 39.635 1.00 0.00 H new ATOM 0 HB ILE A 50 72.446 44.053 41.952 1.00 0.00 H new ATOM 0 HG12 ILE A 50 70.529 44.892 40.330 1.00 0.00 H new ATOM 0 HG13 ILE A 50 71.429 43.950 39.158 1.00 0.00 H new ATOM 0 HG21 ILE A 50 71.842 46.455 41.291 1.00 0.00 H new ATOM 0 HG22 ILE A 50 73.597 46.254 41.510 1.00 0.00 H new ATOM 0 HG23 ILE A 50 72.903 46.293 39.871 1.00 0.00 H new ATOM 0 HD11 ILE A 50 69.649 42.589 40.195 1.00 0.00 H new ATOM 0 HD12 ILE A 50 71.250 41.937 40.619 1.00 0.00 H new ATOM 0 HD13 ILE A 50 70.335 42.893 41.808 1.00 0.00 H new ATOM 759 N HIS A 51 75.043 42.396 41.981 1.00 0.00 N ATOM 760 CA HIS A 51 75.898 42.027 43.098 1.00 0.00 C ATOM 761 C HIS A 51 77.395 42.218 42.765 1.00 0.00 C ATOM 762 O HIS A 51 77.777 42.055 41.604 1.00 0.00 O ATOM 763 CB HIS A 51 75.564 40.569 43.447 1.00 0.00 C ATOM 764 CG HIS A 51 74.081 40.288 43.551 1.00 0.00 C ATOM 765 ND1 HIS A 51 73.163 40.964 44.325 1.00 0.00 N ATOM 766 CD2 HIS A 51 73.376 39.395 42.787 1.00 0.00 C ATOM 767 CE1 HIS A 51 71.939 40.496 44.033 1.00 0.00 C ATOM 768 NE2 HIS A 51 72.020 39.542 43.090 1.00 0.00 N ATOM 0 H HIS A 51 74.560 41.592 41.580 1.00 0.00 H new ATOM 0 HA HIS A 51 75.713 42.675 43.955 1.00 0.00 H new ATOM 0 HB2 HIS A 51 75.995 39.916 42.688 1.00 0.00 H new ATOM 0 HB3 HIS A 51 76.039 40.314 44.394 1.00 0.00 H new ATOM 0 HD2 HIS A 51 73.795 38.699 42.075 1.00 0.00 H new ATOM 0 HE1 HIS A 51 71.022 40.837 44.490 1.00 0.00 H new ATOM 0 HE2 HIS A 51 71.243 39.026 42.676 1.00 0.00 H new ATOM 776 N PRO A 52 78.250 42.554 43.751 1.00 0.00 N ATOM 777 CA PRO A 52 79.674 42.784 43.524 1.00 0.00 C ATOM 778 C PRO A 52 80.399 41.502 43.103 1.00 0.00 C ATOM 779 O PRO A 52 79.979 40.392 43.412 1.00 0.00 O ATOM 780 CB PRO A 52 80.219 43.344 44.844 1.00 0.00 C ATOM 781 CG PRO A 52 79.282 42.739 45.888 1.00 0.00 C ATOM 782 CD PRO A 52 77.939 42.733 45.160 1.00 0.00 C ATOM 0 HA PRO A 52 79.837 43.482 42.702 1.00 0.00 H new ATOM 0 HB2 PRO A 52 81.254 43.047 45.011 1.00 0.00 H new ATOM 0 HB3 PRO A 52 80.193 44.434 44.861 1.00 0.00 H new ATOM 0 HG2 PRO A 52 79.591 41.735 46.178 1.00 0.00 H new ATOM 0 HG3 PRO A 52 79.248 43.337 46.798 1.00 0.00 H new ATOM 0 HD2 PRO A 52 77.301 41.928 45.524 1.00 0.00 H new ATOM 0 HD3 PRO A 52 77.401 43.666 45.326 1.00 0.00 H new ATOM 790 N ASP A 53 81.568 41.668 42.487 1.00 0.00 N ATOM 791 CA ASP A 53 82.454 40.628 41.940 1.00 0.00 C ATOM 792 C ASP A 53 83.023 39.670 43.000 1.00 0.00 C ATOM 793 O ASP A 53 83.684 38.690 42.673 1.00 0.00 O ATOM 794 CB ASP A 53 83.575 41.327 41.161 1.00 0.00 C ATOM 795 CG ASP A 53 84.298 42.343 42.043 1.00 0.00 C ATOM 796 OD1 ASP A 53 85.035 41.942 42.967 1.00 0.00 O ATOM 797 OD2 ASP A 53 84.065 43.563 41.877 1.00 0.00 O ATOM 0 H ASP A 53 81.954 42.601 42.344 1.00 0.00 H new ATOM 0 HA ASP A 53 81.863 39.989 41.285 1.00 0.00 H new ATOM 0 HB2 ASP A 53 84.286 40.586 40.795 1.00 0.00 H new ATOM 0 HB3 ASP A 53 83.159 41.829 40.287 1.00 0.00 H new ATOM 802 N SER A 54 82.692 39.911 44.266 1.00 0.00 N ATOM 803 CA SER A 54 82.816 38.963 45.379 1.00 0.00 C ATOM 804 C SER A 54 81.986 37.683 45.238 1.00 0.00 C ATOM 805 O SER A 54 82.253 36.678 45.904 1.00 0.00 O ATOM 806 CB SER A 54 82.355 39.658 46.653 1.00 0.00 C ATOM 807 OG SER A 54 83.362 40.517 47.140 1.00 0.00 O ATOM 0 H SER A 54 82.313 40.811 44.561 1.00 0.00 H new ATOM 0 HA SER A 54 83.863 38.662 45.395 1.00 0.00 H new ATOM 0 HB2 SER A 54 81.447 40.228 46.455 1.00 0.00 H new ATOM 0 HB3 SER A 54 82.106 38.914 47.410 1.00 0.00 H new ATOM 0 HG SER A 54 83.049 40.957 47.958 1.00 0.00 H new ATOM 813 N VAL A 55 80.983 37.743 44.373 1.00 0.00 N ATOM 814 CA VAL A 55 80.207 36.597 43.876 1.00 0.00 C ATOM 815 C VAL A 55 80.867 36.009 42.625 1.00 0.00 C ATOM 816 O VAL A 55 81.645 36.654 41.922 1.00 0.00 O ATOM 817 CB VAL A 55 78.705 36.903 43.653 1.00 0.00 C ATOM 818 CG1 VAL A 55 78.090 37.686 44.820 1.00 0.00 C ATOM 819 CG2 VAL A 55 78.380 37.607 42.329 1.00 0.00 C ATOM 0 H VAL A 55 80.668 38.628 43.976 1.00 0.00 H new ATOM 0 HA VAL A 55 80.221 35.845 44.665 1.00 0.00 H new ATOM 0 HB VAL A 55 78.248 35.915 43.599 1.00 0.00 H new ATOM 0 HG11 VAL A 55 77.036 37.876 44.616 1.00 0.00 H new ATOM 0 HG12 VAL A 55 78.183 37.105 45.737 1.00 0.00 H new ATOM 0 HG13 VAL A 55 78.613 38.635 44.937 1.00 0.00 H new ATOM 0 HG21 VAL A 55 77.306 37.779 42.263 1.00 0.00 H new ATOM 0 HG22 VAL A 55 78.904 38.562 42.286 1.00 0.00 H new ATOM 0 HG23 VAL A 55 78.699 36.981 41.496 1.00 0.00 H new ATOM 829 N THR A 56 80.551 34.756 42.347 1.00 0.00 N ATOM 830 CA THR A 56 81.166 33.904 41.319 1.00 0.00 C ATOM 831 C THR A 56 80.118 33.046 40.635 1.00 0.00 C ATOM 832 O THR A 56 79.046 32.827 41.185 1.00 0.00 O ATOM 833 CB THR A 56 82.245 33.023 41.957 1.00 0.00 C ATOM 834 OG1 THR A 56 82.833 32.123 41.048 1.00 0.00 O ATOM 835 CG2 THR A 56 81.794 32.200 43.168 1.00 0.00 C ATOM 0 H THR A 56 79.815 34.268 42.858 1.00 0.00 H new ATOM 0 HA THR A 56 81.626 34.541 40.564 1.00 0.00 H new ATOM 0 HB THR A 56 82.965 33.769 42.294 1.00 0.00 H new ATOM 0 HG1 THR A 56 83.513 31.590 41.510 1.00 0.00 H new ATOM 0 HG21 THR A 56 82.633 31.613 43.542 1.00 0.00 H new ATOM 0 HG22 THR A 56 81.441 32.870 43.952 1.00 0.00 H new ATOM 0 HG23 THR A 56 80.986 31.530 42.872 1.00 0.00 H new ATOM 843 N LYS A 57 80.393 32.536 39.436 1.00 0.00 N ATOM 844 CA LYS A 57 79.535 31.567 38.787 1.00 0.00 C ATOM 845 C LYS A 57 80.265 30.382 38.188 1.00 0.00 C ATOM 846 O LYS A 57 81.413 30.462 37.753 1.00 0.00 O ATOM 847 CB LYS A 57 78.655 32.249 37.762 1.00 0.00 C ATOM 848 CG LYS A 57 79.193 33.290 36.800 1.00 0.00 C ATOM 849 CD LYS A 57 80.217 32.793 35.771 1.00 0.00 C ATOM 850 CE LYS A 57 80.271 33.695 34.527 1.00 0.00 C ATOM 851 NZ LYS A 57 80.686 35.083 34.834 1.00 0.00 N ATOM 0 H LYS A 57 81.219 32.788 38.893 1.00 0.00 H new ATOM 0 HA LYS A 57 78.913 31.141 39.574 1.00 0.00 H new ATOM 0 HB2 LYS A 57 78.212 31.460 37.154 1.00 0.00 H new ATOM 0 HB3 LYS A 57 77.841 32.722 38.312 1.00 0.00 H new ATOM 0 HG2 LYS A 57 78.352 33.728 36.263 1.00 0.00 H new ATOM 0 HG3 LYS A 57 79.651 34.090 37.381 1.00 0.00 H new ATOM 0 HD2 LYS A 57 81.204 32.753 36.232 1.00 0.00 H new ATOM 0 HD3 LYS A 57 79.964 31.776 35.470 1.00 0.00 H new ATOM 0 HE2 LYS A 57 80.965 33.266 33.804 1.00 0.00 H new ATOM 0 HE3 LYS A 57 79.289 33.712 34.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 80.704 35.642 33.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 80.011 35.507 35.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 81.635 35.076 35.259 1.00 0.00 H new ATOM 865 N CYS A 58 79.520 29.295 38.107 1.00 0.00 N ATOM 866 CA CYS A 58 79.969 28.017 37.553 1.00 0.00 C ATOM 867 C CYS A 58 78.886 27.258 36.761 1.00 0.00 C ATOM 868 O CYS A 58 77.697 27.447 36.992 1.00 0.00 O ATOM 869 CB CYS A 58 80.559 27.190 38.695 1.00 0.00 C ATOM 870 SG CYS A 58 79.450 27.008 40.123 1.00 0.00 S ATOM 0 H CYS A 58 78.554 29.270 38.434 1.00 0.00 H new ATOM 0 HA CYS A 58 80.734 28.214 36.802 1.00 0.00 H new ATOM 0 HB2 CYS A 58 80.816 26.200 38.318 1.00 0.00 H new ATOM 0 HB3 CYS A 58 81.487 27.656 39.026 1.00 0.00 H new ATOM 0 HG CYS A 58 80.034 26.292 41.037 1.00 0.00 H new ATOM 876 N PRO A 59 79.257 26.398 35.797 1.00 0.00 N ATOM 877 CA PRO A 59 78.286 25.612 35.042 1.00 0.00 C ATOM 878 C PRO A 59 77.610 24.548 35.903 1.00 0.00 C ATOM 879 O PRO A 59 78.203 24.029 36.853 1.00 0.00 O ATOM 880 CB PRO A 59 79.057 24.994 33.877 1.00 0.00 C ATOM 881 CG PRO A 59 80.508 24.962 34.364 1.00 0.00 C ATOM 882 CD PRO A 59 80.611 26.132 35.345 1.00 0.00 C ATOM 0 HA PRO A 59 77.472 26.243 34.685 1.00 0.00 H new ATOM 0 HB2 PRO A 59 78.693 23.993 33.644 1.00 0.00 H new ATOM 0 HB3 PRO A 59 78.954 25.590 32.970 1.00 0.00 H new ATOM 0 HG2 PRO A 59 80.742 24.015 34.850 1.00 0.00 H new ATOM 0 HG3 PRO A 59 81.207 25.076 33.536 1.00 0.00 H new ATOM 0 HD2 PRO A 59 81.260 25.881 36.184 1.00 0.00 H new ATOM 0 HD3 PRO A 59 81.040 27.010 34.861 1.00 0.00 H new ATOM 890 N GLU A 60 76.397 24.150 35.522 1.00 0.00 N ATOM 891 CA GLU A 60 75.924 22.821 35.854 1.00 0.00 C ATOM 892 C GLU A 60 76.547 21.753 34.958 1.00 0.00 C ATOM 893 O GLU A 60 76.956 21.976 33.821 1.00 0.00 O ATOM 894 CB GLU A 60 74.407 22.685 35.848 1.00 0.00 C ATOM 895 CG GLU A 60 73.646 23.549 36.856 1.00 0.00 C ATOM 896 CD GLU A 60 73.803 23.082 38.315 1.00 0.00 C ATOM 897 OE1 GLU A 60 74.805 22.417 38.674 1.00 0.00 O ATOM 898 OE2 GLU A 60 72.938 23.446 39.145 1.00 0.00 O ATOM 0 H GLU A 60 75.739 24.722 34.993 1.00 0.00 H new ATOM 0 HA GLU A 60 76.252 22.660 36.881 1.00 0.00 H new ATOM 0 HB2 GLU A 60 74.046 22.927 34.848 1.00 0.00 H new ATOM 0 HB3 GLU A 60 74.156 21.641 36.034 1.00 0.00 H new ATOM 0 HG2 GLU A 60 73.994 24.579 36.774 1.00 0.00 H new ATOM 0 HG3 GLU A 60 72.588 23.548 36.596 1.00 0.00 H new ATOM 905 N LYS A 61 76.626 20.556 35.526 1.00 0.00 N ATOM 906 CA LYS A 61 77.411 19.430 35.035 1.00 0.00 C ATOM 907 C LYS A 61 76.532 18.347 34.426 1.00 0.00 C ATOM 908 O LYS A 61 76.845 17.769 33.391 1.00 0.00 O ATOM 909 CB LYS A 61 78.269 18.892 36.179 1.00 0.00 C ATOM 910 CG LYS A 61 78.624 19.826 37.356 1.00 0.00 C ATOM 911 CD LYS A 61 79.629 20.916 36.950 1.00 0.00 C ATOM 912 CE LYS A 61 79.855 21.957 38.057 1.00 0.00 C ATOM 913 NZ LYS A 61 80.701 21.452 39.160 1.00 0.00 N ATOM 0 H LYS A 61 76.120 20.333 36.383 1.00 0.00 H new ATOM 0 HA LYS A 61 78.062 19.772 34.230 1.00 0.00 H new ATOM 0 HB2 LYS A 61 77.758 18.023 36.592 1.00 0.00 H new ATOM 0 HB3 LYS A 61 79.205 18.536 35.748 1.00 0.00 H new ATOM 0 HG2 LYS A 61 77.715 20.295 37.733 1.00 0.00 H new ATOM 0 HG3 LYS A 61 79.040 19.236 38.173 1.00 0.00 H new ATOM 0 HD2 LYS A 61 80.581 20.450 36.696 1.00 0.00 H new ATOM 0 HD3 LYS A 61 79.270 21.419 36.052 1.00 0.00 H new ATOM 0 HE2 LYS A 61 80.321 22.843 37.626 1.00 0.00 H new ATOM 0 HE3 LYS A 61 78.891 22.267 38.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 80.819 22.197 39.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 80.247 20.623 39.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 81.633 21.181 38.786 1.00 0.00 H new ATOM 927 N ASN A 62 75.392 18.174 35.084 1.00 0.00 N ATOM 928 CA ASN A 62 74.229 17.392 34.694 1.00 0.00 C ATOM 929 C ASN A 62 73.278 18.136 33.745 1.00 0.00 C ATOM 930 O ASN A 62 72.375 17.521 33.179 1.00 0.00 O ATOM 931 CB ASN A 62 73.564 16.945 36.013 1.00 0.00 C ATOM 932 CG ASN A 62 73.307 18.116 36.947 1.00 0.00 C ATOM 933 OD1 ASN A 62 72.965 19.213 36.544 1.00 0.00 O ATOM 934 ND2 ASN A 62 73.600 17.960 38.208 1.00 0.00 N ATOM 0 H ASN A 62 75.247 18.621 35.989 1.00 0.00 H new ATOM 0 HA ASN A 62 74.525 16.528 34.099 1.00 0.00 H new ATOM 0 HB2 ASN A 62 72.622 16.444 35.792 1.00 0.00 H new ATOM 0 HB3 ASN A 62 74.203 16.217 36.512 1.00 0.00 H new ATOM 0 HD21 ASN A 62 73.542 18.753 38.847 1.00 0.00 H new ATOM 0 HD22 ASN A 62 73.887 17.045 38.555 1.00 0.00 H new ATOM 941 N ARG A 63 73.510 19.445 33.574 1.00 0.00 N ATOM 942 CA ARG A 63 72.888 20.370 32.628 1.00 0.00 C ATOM 943 C ARG A 63 73.913 21.333 32.016 1.00 0.00 C ATOM 944 O ARG A 63 73.992 22.482 32.440 1.00 0.00 O ATOM 945 CB ARG A 63 71.708 21.114 33.273 1.00 0.00 C ATOM 946 CG ARG A 63 70.694 20.088 33.763 1.00 0.00 C ATOM 947 CD ARG A 63 69.267 20.607 33.888 1.00 0.00 C ATOM 948 NE ARG A 63 68.350 19.475 34.108 1.00 0.00 N ATOM 949 CZ ARG A 63 67.077 19.553 34.438 1.00 0.00 C ATOM 950 NH1 ARG A 63 66.455 20.686 34.545 1.00 0.00 N ATOM 951 NH2 ARG A 63 66.396 18.470 34.668 1.00 0.00 N ATOM 0 H ARG A 63 74.203 19.923 34.150 1.00 0.00 H new ATOM 0 HA ARG A 63 72.486 19.779 31.805 1.00 0.00 H new ATOM 0 HB2 ARG A 63 72.057 21.728 34.104 1.00 0.00 H new ATOM 0 HB3 ARG A 63 71.246 21.788 32.551 1.00 0.00 H new ATOM 0 HG2 ARG A 63 70.698 19.239 33.079 1.00 0.00 H new ATOM 0 HG3 ARG A 63 71.016 19.716 34.735 1.00 0.00 H new ATOM 0 HD2 ARG A 63 69.196 21.312 34.716 1.00 0.00 H new ATOM 0 HD3 ARG A 63 68.985 21.147 32.984 1.00 0.00 H new ATOM 0 HE ARG A 63 68.739 18.539 33.994 1.00 0.00 H new ATOM 0 HH11 ARG A 63 66.953 21.559 34.371 1.00 0.00 H new ATOM 0 HH12 ARG A 63 65.468 20.704 34.803 1.00 0.00 H new ATOM 0 HH21 ARG A 63 66.847 17.558 34.593 1.00 0.00 H new ATOM 0 HH22 ARG A 63 65.410 18.532 34.923 1.00 0.00 H new ATOM 965 N PRO A 64 74.690 20.893 31.011 1.00 0.00 N ATOM 966 CA PRO A 64 75.740 21.684 30.362 1.00 0.00 C ATOM 967 C PRO A 64 75.171 22.749 29.394 1.00 0.00 C ATOM 968 O PRO A 64 75.549 22.827 28.224 1.00 0.00 O ATOM 969 CB PRO A 64 76.631 20.629 29.702 1.00 0.00 C ATOM 970 CG PRO A 64 75.651 19.531 29.301 1.00 0.00 C ATOM 971 CD PRO A 64 74.647 19.549 30.447 1.00 0.00 C ATOM 0 HA PRO A 64 76.310 22.298 31.059 1.00 0.00 H new ATOM 0 HB2 PRO A 64 77.157 21.033 28.837 1.00 0.00 H new ATOM 0 HB3 PRO A 64 77.390 20.257 30.391 1.00 0.00 H new ATOM 0 HG2 PRO A 64 75.176 19.741 28.343 1.00 0.00 H new ATOM 0 HG3 PRO A 64 76.143 18.563 29.208 1.00 0.00 H new ATOM 0 HD2 PRO A 64 73.645 19.310 30.090 1.00 0.00 H new ATOM 0 HD3 PRO A 64 74.903 18.804 31.200 1.00 0.00 H new ATOM 979 N GLU A 65 74.197 23.525 29.879 1.00 0.00 N ATOM 980 CA GLU A 65 73.278 24.371 29.118 1.00 0.00 C ATOM 981 C GLU A 65 73.036 25.771 29.712 1.00 0.00 C ATOM 982 O GLU A 65 72.361 26.604 29.116 1.00 0.00 O ATOM 983 CB GLU A 65 71.927 23.641 28.925 1.00 0.00 C ATOM 984 CG GLU A 65 72.008 22.138 28.748 1.00 0.00 C ATOM 985 CD GLU A 65 70.670 21.492 28.384 1.00 0.00 C ATOM 986 OE1 GLU A 65 69.901 21.134 29.307 1.00 0.00 O ATOM 987 OE2 GLU A 65 70.405 21.254 27.181 1.00 0.00 O ATOM 0 H GLU A 65 74.019 23.581 30.882 1.00 0.00 H new ATOM 0 HA GLU A 65 73.770 24.544 28.161 1.00 0.00 H new ATOM 0 HB2 GLU A 65 71.295 23.853 29.787 1.00 0.00 H new ATOM 0 HB3 GLU A 65 71.428 24.064 28.053 1.00 0.00 H new ATOM 0 HG2 GLU A 65 72.736 21.911 27.969 1.00 0.00 H new ATOM 0 HG3 GLU A 65 72.379 21.691 29.670 1.00 0.00 H new ATOM 994 N ALA A 66 73.579 26.013 30.900 1.00 0.00 N ATOM 995 CA ALA A 66 73.436 27.216 31.711 1.00 0.00 C ATOM 996 C ALA A 66 74.533 27.258 32.790 1.00 0.00 C ATOM 997 O ALA A 66 75.210 26.259 33.061 1.00 0.00 O ATOM 998 CB ALA A 66 72.047 27.209 32.365 1.00 0.00 C ATOM 0 H ALA A 66 74.175 25.321 31.355 1.00 0.00 H new ATOM 0 HA ALA A 66 73.540 28.100 31.082 1.00 0.00 H new ATOM 0 HB1 ALA A 66 71.927 28.104 32.975 1.00 0.00 H new ATOM 0 HB2 ALA A 66 71.280 27.192 31.590 1.00 0.00 H new ATOM 0 HB3 ALA A 66 71.946 26.325 32.995 1.00 0.00 H new ATOM 1004 N LEU A 67 74.668 28.410 33.442 1.00 0.00 N ATOM 1005 CA LEU A 67 75.472 28.572 34.658 1.00 0.00 C ATOM 1006 C LEU A 67 74.564 28.677 35.893 1.00 0.00 C ATOM 1007 O LEU A 67 73.516 29.322 35.849 1.00 0.00 O ATOM 1008 CB LEU A 67 76.398 29.811 34.588 1.00 0.00 C ATOM 1009 CG LEU A 67 77.423 29.967 33.445 1.00 0.00 C ATOM 1010 CD1 LEU A 67 78.287 28.726 33.241 1.00 0.00 C ATOM 1011 CD2 LEU A 67 76.818 30.357 32.096 1.00 0.00 C ATOM 0 H LEU A 67 74.216 29.273 33.138 1.00 0.00 H new ATOM 0 HA LEU A 67 76.103 27.687 34.740 1.00 0.00 H new ATOM 0 HB2 LEU A 67 75.755 30.691 34.564 1.00 0.00 H new ATOM 0 HB3 LEU A 67 76.954 29.849 35.525 1.00 0.00 H new ATOM 0 HG LEU A 67 78.043 30.795 33.791 1.00 0.00 H new ATOM 0 HD11 LEU A 67 78.987 28.900 32.423 1.00 0.00 H new ATOM 0 HD12 LEU A 67 78.842 28.515 34.155 1.00 0.00 H new ATOM 0 HD13 LEU A 67 77.650 27.875 32.999 1.00 0.00 H new ATOM 0 HD21 LEU A 67 77.611 30.444 31.353 1.00 0.00 H new ATOM 0 HD22 LEU A 67 76.108 29.592 31.781 1.00 0.00 H new ATOM 0 HD23 LEU A 67 76.303 31.313 32.191 1.00 0.00 H new ATOM 1023 N LYS A 68 75.003 28.129 37.026 1.00 0.00 N ATOM 1024 CA LYS A 68 74.608 28.578 38.364 1.00 0.00 C ATOM 1025 C LYS A 68 75.557 29.677 38.847 1.00 0.00 C ATOM 1026 O LYS A 68 76.754 29.652 38.574 1.00 0.00 O ATOM 1027 CB LYS A 68 74.552 27.399 39.335 1.00 0.00 C ATOM 1028 CG LYS A 68 75.803 26.512 39.307 1.00 0.00 C ATOM 1029 CD LYS A 68 75.591 25.437 40.346 1.00 0.00 C ATOM 1030 CE LYS A 68 76.706 24.390 40.375 1.00 0.00 C ATOM 1031 NZ LYS A 68 76.173 23.122 40.923 1.00 0.00 N ATOM 0 H LYS A 68 75.656 27.345 37.041 1.00 0.00 H new ATOM 0 HA LYS A 68 73.604 29.001 38.319 1.00 0.00 H new ATOM 0 HB2 LYS A 68 74.411 27.780 40.346 1.00 0.00 H new ATOM 0 HB3 LYS A 68 73.680 26.788 39.100 1.00 0.00 H new ATOM 0 HG2 LYS A 68 75.946 26.074 38.319 1.00 0.00 H new ATOM 0 HG3 LYS A 68 76.697 27.095 39.529 1.00 0.00 H new ATOM 0 HD2 LYS A 68 75.514 25.902 41.329 1.00 0.00 H new ATOM 0 HD3 LYS A 68 74.641 24.939 40.154 1.00 0.00 H new ATOM 0 HE2 LYS A 68 77.096 24.230 39.370 1.00 0.00 H new ATOM 0 HE3 LYS A 68 77.536 24.743 40.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 76.955 22.452 41.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 75.700 23.308 41.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 75.490 22.714 40.253 1.00 0.00 H new ATOM 1045 N VAL A 69 75.043 30.652 39.582 1.00 0.00 N ATOM 1046 CA VAL A 69 75.814 31.764 40.140 1.00 0.00 C ATOM 1047 C VAL A 69 75.693 31.773 41.664 1.00 0.00 C ATOM 1048 O VAL A 69 74.587 31.837 42.214 1.00 0.00 O ATOM 1049 CB VAL A 69 75.320 33.099 39.569 1.00 0.00 C ATOM 1050 CG1 VAL A 69 76.257 34.218 40.029 1.00 0.00 C ATOM 1051 CG2 VAL A 69 75.191 33.074 38.040 1.00 0.00 C ATOM 0 H VAL A 69 74.051 30.697 39.816 1.00 0.00 H new ATOM 0 HA VAL A 69 76.861 31.633 39.866 1.00 0.00 H new ATOM 0 HB VAL A 69 74.316 33.283 39.951 1.00 0.00 H new ATOM 0 HG11 VAL A 69 75.912 35.170 39.627 1.00 0.00 H new ATOM 0 HG12 VAL A 69 76.261 34.264 41.118 1.00 0.00 H new ATOM 0 HG13 VAL A 69 77.267 34.017 39.671 1.00 0.00 H new ATOM 0 HG21 VAL A 69 74.838 34.044 37.689 1.00 0.00 H new ATOM 0 HG22 VAL A 69 76.163 32.859 37.596 1.00 0.00 H new ATOM 0 HG23 VAL A 69 74.480 32.301 37.747 1.00 0.00 H new ATOM 1061 N SER A 70 76.832 31.744 42.351 1.00 0.00 N ATOM 1062 CA SER A 70 76.905 31.674 43.823 1.00 0.00 C ATOM 1063 C SER A 70 77.663 32.818 44.523 1.00 0.00 C ATOM 1064 O SER A 70 78.585 33.436 43.995 1.00 0.00 O ATOM 1065 CB SER A 70 77.480 30.326 44.274 1.00 0.00 C ATOM 1066 OG SER A 70 78.640 29.972 43.545 1.00 0.00 O ATOM 0 H SER A 70 77.748 31.768 41.902 1.00 0.00 H new ATOM 0 HA SER A 70 75.868 31.787 44.139 1.00 0.00 H new ATOM 0 HB2 SER A 70 77.720 30.372 45.336 1.00 0.00 H new ATOM 0 HB3 SER A 70 76.724 29.550 44.151 1.00 0.00 H new ATOM 0 HG SER A 70 78.976 29.108 43.864 1.00 0.00 H new ATOM 1072 N CYS A 71 77.298 33.060 45.786 1.00 0.00 N ATOM 1073 CA CYS A 71 77.985 33.976 46.684 1.00 0.00 C ATOM 1074 C CYS A 71 79.046 33.149 47.425 1.00 0.00 C ATOM 1075 O CYS A 71 78.803 32.608 48.500 1.00 0.00 O ATOM 1076 CB CYS A 71 76.941 34.650 47.593 1.00 0.00 C ATOM 1077 SG CYS A 71 77.692 35.847 48.731 1.00 0.00 S ATOM 0 H CYS A 71 76.492 32.608 46.218 1.00 0.00 H new ATOM 0 HA CYS A 71 78.498 34.792 46.175 1.00 0.00 H new ATOM 0 HB2 CYS A 71 76.197 35.155 46.977 1.00 0.00 H new ATOM 0 HB3 CYS A 71 76.415 33.887 48.167 1.00 0.00 H new ATOM 0 HG CYS A 71 77.088 35.791 49.881 1.00 0.00 H new ATOM 1082 N GLY A 72 80.210 32.971 46.804 1.00 0.00 N ATOM 1083 CA GLY A 72 81.347 32.307 47.461 1.00 0.00 C ATOM 1084 C GLY A 72 81.990 33.157 48.573 1.00 0.00 C ATOM 1085 O GLY A 72 82.801 32.651 49.351 1.00 0.00 O ATOM 0 H GLY A 72 80.396 33.275 45.848 1.00 0.00 H new ATOM 0 HA2 GLY A 72 81.011 31.361 47.885 1.00 0.00 H new ATOM 0 HA3 GLY A 72 82.102 32.070 46.712 1.00 0.00 H new ATOM 1089 N LYS A 73 81.569 34.422 48.701 1.00 0.00 N ATOM 1090 CA LYS A 73 81.796 35.311 49.845 1.00 0.00 C ATOM 1091 C LYS A 73 81.359 34.676 51.163 1.00 0.00 C ATOM 1092 O LYS A 73 82.179 34.443 52.052 1.00 0.00 O ATOM 1093 CB LYS A 73 81.019 36.608 49.594 1.00 0.00 C ATOM 1094 CG LYS A 73 81.842 37.873 49.818 1.00 0.00 C ATOM 1095 CD LYS A 73 82.118 38.091 51.308 1.00 0.00 C ATOM 1096 CE LYS A 73 82.664 39.502 51.495 1.00 0.00 C ATOM 1097 NZ LYS A 73 82.563 39.931 52.903 1.00 0.00 N ATOM 0 H LYS A 73 81.029 34.878 47.965 1.00 0.00 H new ATOM 0 HA LYS A 73 82.864 35.509 49.936 1.00 0.00 H new ATOM 0 HB2 LYS A 73 80.647 36.605 48.570 1.00 0.00 H new ATOM 0 HB3 LYS A 73 80.148 36.631 50.249 1.00 0.00 H new ATOM 0 HG2 LYS A 73 82.785 37.798 49.277 1.00 0.00 H new ATOM 0 HG3 LYS A 73 81.310 38.734 49.413 1.00 0.00 H new ATOM 0 HD2 LYS A 73 81.204 37.958 51.886 1.00 0.00 H new ATOM 0 HD3 LYS A 73 82.835 37.355 51.672 1.00 0.00 H new ATOM 0 HE2 LYS A 73 83.705 39.537 51.175 1.00 0.00 H new ATOM 0 HE3 LYS A 73 82.112 40.195 50.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 82.942 40.895 53.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 81.566 39.919 53.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 83.110 39.282 53.504 1.00 0.00 H new ATOM 1111 N CYS A 74 80.069 34.377 51.247 1.00 0.00 N ATOM 1112 CA CYS A 74 79.352 33.935 52.426 1.00 0.00 C ATOM 1113 C CYS A 74 78.997 32.430 52.353 1.00 0.00 C ATOM 1114 O CYS A 74 78.697 31.779 53.359 1.00 0.00 O ATOM 1115 CB CYS A 74 78.171 34.901 52.533 1.00 0.00 C ATOM 1116 SG CYS A 74 77.106 34.923 51.052 1.00 0.00 S ATOM 0 H CYS A 74 79.458 34.443 50.433 1.00 0.00 H new ATOM 0 HA CYS A 74 79.940 33.976 53.343 1.00 0.00 H new ATOM 0 HB2 CYS A 74 77.568 34.629 53.399 1.00 0.00 H new ATOM 0 HB3 CYS A 74 78.551 35.907 52.712 1.00 0.00 H new ATOM 0 HG CYS A 74 77.844 35.042 49.989 1.00 0.00 H new ATOM 1121 N GLY A 75 79.099 31.864 51.153 1.00 0.00 N ATOM 1122 CA GLY A 75 78.850 30.471 50.843 1.00 0.00 C ATOM 1123 C GLY A 75 77.356 30.222 50.646 1.00 0.00 C ATOM 1124 O GLY A 75 76.709 29.545 51.452 1.00 0.00 O ATOM 0 H GLY A 75 79.373 32.400 50.330 1.00 0.00 H new ATOM 0 HA2 GLY A 75 79.393 30.191 49.940 1.00 0.00 H new ATOM 0 HA3 GLY A 75 79.226 29.841 51.649 1.00 0.00 H new ATOM 1128 N ASN A 76 76.800 30.831 49.600 1.00 0.00 N ATOM 1129 CA ASN A 76 75.422 30.700 49.149 1.00 0.00 C ATOM 1130 C ASN A 76 75.364 30.310 47.654 1.00 0.00 C ATOM 1131 O ASN A 76 76.245 29.624 47.138 1.00 0.00 O ATOM 1132 CB ASN A 76 74.693 31.981 49.564 1.00 0.00 C ATOM 1133 CG ASN A 76 73.175 31.897 49.531 1.00 0.00 C ATOM 1134 OD1 ASN A 76 72.590 30.848 49.345 1.00 0.00 O ATOM 1135 ND2 ASN A 76 72.497 33.011 49.619 1.00 0.00 N ATOM 0 H ASN A 76 77.336 31.468 49.011 1.00 0.00 H new ATOM 0 HA ASN A 76 74.891 29.874 49.622 1.00 0.00 H new ATOM 0 HB2 ASN A 76 75.005 32.248 50.574 1.00 0.00 H new ATOM 0 HB3 ASN A 76 75.011 32.791 48.908 1.00 0.00 H new ATOM 0 HD21 ASN A 76 71.481 32.998 49.532 1.00 0.00 H new ATOM 0 HD22 ASN A 76 72.984 33.893 49.775 1.00 0.00 H new ATOM 1142 N GLY A 77 74.310 30.719 46.955 1.00 0.00 N ATOM 1143 CA GLY A 77 73.914 30.309 45.628 1.00 0.00 C ATOM 1144 C GLY A 77 72.666 31.083 45.240 1.00 0.00 C ATOM 1145 O GLY A 77 71.550 30.580 45.334 1.00 0.00 O ATOM 0 H GLY A 77 73.661 31.404 47.343 1.00 0.00 H new ATOM 0 HA2 GLY A 77 74.717 30.502 44.916 1.00 0.00 H new ATOM 0 HA3 GLY A 77 73.718 29.237 45.605 1.00 0.00 H new ATOM 1149 N LEU A 78 72.886 32.355 44.905 1.00 0.00 N ATOM 1150 CA LEU A 78 71.880 33.339 44.484 1.00 0.00 C ATOM 1151 C LEU A 78 70.907 32.710 43.497 1.00 0.00 C ATOM 1152 O LEU A 78 69.694 32.805 43.650 1.00 0.00 O ATOM 1153 CB LEU A 78 72.518 34.498 43.683 1.00 0.00 C ATOM 1154 CG LEU A 78 73.530 35.446 44.305 1.00 0.00 C ATOM 1155 CD1 LEU A 78 72.958 36.238 45.478 1.00 0.00 C ATOM 1156 CD2 LEU A 78 74.828 34.763 44.709 1.00 0.00 C ATOM 0 H LEU A 78 73.825 32.752 44.920 1.00 0.00 H new ATOM 0 HA LEU A 78 71.403 33.687 45.400 1.00 0.00 H new ATOM 0 HB2 LEU A 78 72.999 34.051 42.813 1.00 0.00 H new ATOM 0 HB3 LEU A 78 71.698 35.113 43.313 1.00 0.00 H new ATOM 0 HG LEU A 78 73.769 36.152 43.509 1.00 0.00 H new ATOM 0 HD11 LEU A 78 73.727 36.898 45.881 1.00 0.00 H new ATOM 0 HD12 LEU A 78 72.111 36.834 45.137 1.00 0.00 H new ATOM 0 HD13 LEU A 78 72.627 35.549 46.255 1.00 0.00 H new ATOM 0 HD21 LEU A 78 75.505 35.497 45.146 1.00 0.00 H new ATOM 0 HD22 LEU A 78 74.617 33.984 45.441 1.00 0.00 H new ATOM 0 HD23 LEU A 78 75.294 34.318 43.830 1.00 0.00 H new ATOM 1168 N GLY A 79 71.485 32.129 42.450 1.00 0.00 N ATOM 1169 CA GLY A 79 70.700 31.772 41.268 1.00 0.00 C ATOM 1170 C GLY A 79 71.471 31.170 40.103 1.00 0.00 C ATOM 1171 O GLY A 79 72.394 30.385 40.286 1.00 0.00 O ATOM 0 H GLY A 79 72.477 31.898 42.393 1.00 0.00 H new ATOM 0 HA2 GLY A 79 69.929 31.063 41.571 1.00 0.00 H new ATOM 0 HA3 GLY A 79 70.189 32.667 40.914 1.00 0.00 H new ATOM 1175 N HIS A 80 71.059 31.540 38.893 1.00 0.00 N ATOM 1176 CA HIS A 80 71.533 31.035 37.621 1.00 0.00 C ATOM 1177 C HIS A 80 71.633 32.146 36.579 1.00 0.00 C ATOM 1178 O HIS A 80 70.832 33.074 36.590 1.00 0.00 O ATOM 1179 CB HIS A 80 70.530 30.019 37.117 1.00 0.00 C ATOM 1180 CG HIS A 80 70.257 28.864 38.037 1.00 0.00 C ATOM 1181 ND1 HIS A 80 69.270 28.825 38.993 1.00 0.00 N ATOM 1182 CD2 HIS A 80 70.926 27.673 38.081 1.00 0.00 C ATOM 1183 CE1 HIS A 80 69.340 27.632 39.603 1.00 0.00 C ATOM 1184 NE2 HIS A 80 70.336 26.892 39.083 1.00 0.00 N ATOM 0 H HIS A 80 70.336 32.249 38.775 1.00 0.00 H new ATOM 0 HA HIS A 80 72.522 30.601 37.768 1.00 0.00 H new ATOM 0 HB2 HIS A 80 69.589 30.532 36.918 1.00 0.00 H new ATOM 0 HB3 HIS A 80 70.886 29.625 36.165 1.00 0.00 H new ATOM 0 HD1 HIS A 80 68.604 29.569 39.201 1.00 0.00 H new ATOM 0 HD2 HIS A 80 71.759 27.386 37.456 1.00 0.00 H new ATOM 0 HE1 HIS A 80 68.687 27.310 40.401 1.00 0.00 H new ATOM 1192 N GLU A 81 72.528 31.988 35.614 1.00 0.00 N ATOM 1193 CA GLU A 81 72.779 32.896 34.512 1.00 0.00 C ATOM 1194 C GLU A 81 72.867 32.041 33.245 1.00 0.00 C ATOM 1195 O GLU A 81 73.705 31.149 33.120 1.00 0.00 O ATOM 1196 CB GLU A 81 74.085 33.643 34.806 1.00 0.00 C ATOM 1197 CG GLU A 81 74.498 34.701 33.774 1.00 0.00 C ATOM 1198 CD GLU A 81 75.749 35.479 34.233 1.00 0.00 C ATOM 1199 OE1 GLU A 81 76.831 34.870 34.410 1.00 0.00 O ATOM 1200 OE2 GLU A 81 75.667 36.714 34.432 1.00 0.00 O ATOM 0 H GLU A 81 73.135 31.169 35.581 1.00 0.00 H new ATOM 0 HA GLU A 81 71.994 33.640 34.379 1.00 0.00 H new ATOM 0 HB2 GLU A 81 73.993 34.128 35.778 1.00 0.00 H new ATOM 0 HB3 GLU A 81 74.889 32.911 34.889 1.00 0.00 H new ATOM 0 HG2 GLU A 81 74.699 34.219 32.817 1.00 0.00 H new ATOM 0 HG3 GLU A 81 73.674 35.396 33.614 1.00 0.00 H new ATOM 1207 N PHE A 82 71.937 32.245 32.326 1.00 0.00 N ATOM 1208 CA PHE A 82 71.817 31.458 31.110 1.00 0.00 C ATOM 1209 C PHE A 82 72.605 32.138 29.982 1.00 0.00 C ATOM 1210 O PHE A 82 72.321 33.273 29.595 1.00 0.00 O ATOM 1211 CB PHE A 82 70.327 31.299 30.794 1.00 0.00 C ATOM 1212 CG PHE A 82 69.653 30.112 31.454 1.00 0.00 C ATOM 1213 CD1 PHE A 82 69.482 30.077 32.853 1.00 0.00 C ATOM 1214 CD2 PHE A 82 69.179 29.045 30.668 1.00 0.00 C ATOM 1215 CE1 PHE A 82 68.847 28.978 33.461 1.00 0.00 C ATOM 1216 CE2 PHE A 82 68.540 27.949 31.275 1.00 0.00 C ATOM 1217 CZ PHE A 82 68.373 27.914 32.671 1.00 0.00 C ATOM 0 H PHE A 82 71.231 32.977 32.406 1.00 0.00 H new ATOM 0 HA PHE A 82 72.243 30.462 31.228 1.00 0.00 H new ATOM 0 HB2 PHE A 82 69.808 32.208 31.099 1.00 0.00 H new ATOM 0 HB3 PHE A 82 70.208 31.211 29.714 1.00 0.00 H new ATOM 0 HD1 PHE A 82 69.839 30.896 33.460 1.00 0.00 H new ATOM 0 HD2 PHE A 82 69.306 29.068 29.596 1.00 0.00 H new ATOM 0 HE1 PHE A 82 68.723 28.951 34.534 1.00 0.00 H new ATOM 0 HE2 PHE A 82 68.177 27.133 30.668 1.00 0.00 H new ATOM 0 HZ PHE A 82 67.882 27.072 33.136 1.00 0.00 H new ATOM 1227 N LEU A 83 73.609 31.431 29.459 1.00 0.00 N ATOM 1228 CA LEU A 83 74.576 31.919 28.477 1.00 0.00 C ATOM 1229 C LEU A 83 74.740 30.888 27.358 1.00 0.00 C ATOM 1230 O LEU A 83 74.370 29.725 27.508 1.00 0.00 O ATOM 1231 CB LEU A 83 75.909 32.200 29.196 1.00 0.00 C ATOM 1232 CG LEU A 83 76.899 33.144 28.489 1.00 0.00 C ATOM 1233 CD1 LEU A 83 76.335 34.559 28.330 1.00 0.00 C ATOM 1234 CD2 LEU A 83 78.183 33.226 29.317 1.00 0.00 C ATOM 0 H LEU A 83 73.776 30.460 29.721 1.00 0.00 H new ATOM 0 HA LEU A 83 74.227 32.845 28.020 1.00 0.00 H new ATOM 0 HB2 LEU A 83 75.683 32.619 30.177 1.00 0.00 H new ATOM 0 HB3 LEU A 83 76.411 31.247 29.364 1.00 0.00 H new ATOM 0 HG LEU A 83 77.090 32.740 27.495 1.00 0.00 H new ATOM 0 HD11 LEU A 83 77.069 35.189 27.826 1.00 0.00 H new ATOM 0 HD12 LEU A 83 75.421 34.522 27.738 1.00 0.00 H new ATOM 0 HD13 LEU A 83 76.114 34.975 29.313 1.00 0.00 H new ATOM 0 HD21 LEU A 83 78.891 33.892 28.825 1.00 0.00 H new ATOM 0 HD22 LEU A 83 77.952 33.612 30.310 1.00 0.00 H new ATOM 0 HD23 LEU A 83 78.622 32.232 29.407 1.00 0.00 H new ATOM 1246 N ASN A 84 75.290 31.316 26.223 1.00 0.00 N ATOM 1247 CA ASN A 84 75.310 30.585 24.942 1.00 0.00 C ATOM 1248 C ASN A 84 73.903 30.293 24.354 1.00 0.00 C ATOM 1249 O ASN A 84 73.788 29.667 23.302 1.00 0.00 O ATOM 1250 CB ASN A 84 76.179 29.315 25.010 1.00 0.00 C ATOM 1251 CG ASN A 84 77.348 29.306 25.949 1.00 0.00 C ATOM 1252 OD1 ASN A 84 78.497 29.544 25.616 1.00 0.00 O ATOM 1253 ND2 ASN A 84 77.082 28.848 27.141 1.00 0.00 N ATOM 0 H ASN A 84 75.756 32.221 26.161 1.00 0.00 H new ATOM 0 HA ASN A 84 75.780 31.269 24.236 1.00 0.00 H new ATOM 0 HB2 ASN A 84 75.530 28.481 25.278 1.00 0.00 H new ATOM 0 HB3 ASN A 84 76.556 29.115 24.007 1.00 0.00 H new ATOM 0 HD21 ASN A 84 77.839 28.685 27.805 1.00 0.00 H new ATOM 0 HD22 ASN A 84 76.117 28.653 27.409 1.00 0.00 H new ATOM 1260 N ASP A 85 72.844 30.754 25.026 1.00 0.00 N ATOM 1261 CA ASP A 85 71.433 30.417 24.799 1.00 0.00 C ATOM 1262 C ASP A 85 70.625 31.555 24.146 1.00 0.00 C ATOM 1263 O ASP A 85 69.694 31.307 23.380 1.00 0.00 O ATOM 1264 CB ASP A 85 70.868 29.980 26.168 1.00 0.00 C ATOM 1265 CG ASP A 85 69.352 30.133 26.317 1.00 0.00 C ATOM 1266 OD1 ASP A 85 68.586 29.416 25.636 1.00 0.00 O ATOM 1267 OD2 ASP A 85 68.934 31.002 27.113 1.00 0.00 O ATOM 0 H ASP A 85 72.955 31.416 25.794 1.00 0.00 H new ATOM 0 HA ASP A 85 71.350 29.610 24.071 1.00 0.00 H new ATOM 0 HB2 ASP A 85 71.132 28.936 26.337 1.00 0.00 H new ATOM 0 HB3 ASP A 85 71.356 30.563 26.949 1.00 0.00 H new ATOM 1272 N GLY A 86 71.017 32.804 24.404 1.00 0.00 N ATOM 1273 CA GLY A 86 70.276 34.010 24.039 1.00 0.00 C ATOM 1274 C GLY A 86 70.949 34.942 23.014 1.00 0.00 C ATOM 1275 O GLY A 86 71.161 36.107 23.349 1.00 0.00 O ATOM 0 H GLY A 86 71.890 33.009 24.890 1.00 0.00 H new ATOM 0 HA2 GLY A 86 69.307 33.709 23.642 1.00 0.00 H new ATOM 0 HA3 GLY A 86 70.085 34.582 24.947 1.00 0.00 H new ATOM 1279 N PRO A 87 71.282 34.502 21.782 1.00 0.00 N ATOM 1280 CA PRO A 87 72.014 35.326 20.809 1.00 0.00 C ATOM 1281 C PRO A 87 71.196 36.500 20.247 1.00 0.00 C ATOM 1282 O PRO A 87 71.739 37.563 19.951 1.00 0.00 O ATOM 1283 CB PRO A 87 72.450 34.351 19.708 1.00 0.00 C ATOM 1284 CG PRO A 87 71.382 33.256 19.753 1.00 0.00 C ATOM 1285 CD PRO A 87 71.030 33.177 21.236 1.00 0.00 C ATOM 0 HA PRO A 87 72.861 35.817 21.288 1.00 0.00 H new ATOM 0 HB2 PRO A 87 72.485 34.837 18.733 1.00 0.00 H new ATOM 0 HB3 PRO A 87 73.445 33.949 19.900 1.00 0.00 H new ATOM 0 HG2 PRO A 87 70.514 33.514 19.146 1.00 0.00 H new ATOM 0 HG3 PRO A 87 71.763 32.306 19.378 1.00 0.00 H new ATOM 0 HD2 PRO A 87 69.987 32.890 21.374 1.00 0.00 H new ATOM 0 HD3 PRO A 87 71.637 32.426 21.741 1.00 0.00 H new ATOM 1293 N LYS A 88 69.873 36.338 20.144 1.00 0.00 N ATOM 1294 CA LYS A 88 68.918 37.380 19.783 1.00 0.00 C ATOM 1295 C LYS A 88 68.726 38.333 20.962 1.00 0.00 C ATOM 1296 O LYS A 88 67.826 38.148 21.783 1.00 0.00 O ATOM 1297 CB LYS A 88 67.599 36.762 19.288 1.00 0.00 C ATOM 1298 CG LYS A 88 67.786 35.948 18.004 1.00 0.00 C ATOM 1299 CD LYS A 88 66.460 35.497 17.375 1.00 0.00 C ATOM 1300 CE LYS A 88 65.690 36.673 16.763 1.00 0.00 C ATOM 1301 NZ LYS A 88 64.562 36.221 15.908 1.00 0.00 N ATOM 0 H LYS A 88 69.424 35.439 20.318 1.00 0.00 H new ATOM 0 HA LYS A 88 69.309 37.967 18.952 1.00 0.00 H new ATOM 0 HB2 LYS A 88 67.186 36.120 20.066 1.00 0.00 H new ATOM 0 HB3 LYS A 88 66.872 37.555 19.111 1.00 0.00 H new ATOM 0 HG2 LYS A 88 68.339 36.546 17.280 1.00 0.00 H new ATOM 0 HG3 LYS A 88 68.394 35.070 18.223 1.00 0.00 H new ATOM 0 HD2 LYS A 88 66.658 34.752 16.604 1.00 0.00 H new ATOM 0 HD3 LYS A 88 65.844 35.015 18.134 1.00 0.00 H new ATOM 0 HE2 LYS A 88 65.307 37.309 17.561 1.00 0.00 H new ATOM 0 HE3 LYS A 88 66.372 37.282 16.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 64.070 37.049 15.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 64.929 35.636 15.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 63.896 35.661 16.479 1.00 0.00 H new ATOM 1315 N ARG A 89 69.625 39.313 21.049 1.00 0.00 N ATOM 1316 CA ARG A 89 69.633 40.416 22.018 1.00 0.00 C ATOM 1317 C ARG A 89 68.356 41.258 22.027 1.00 0.00 C ATOM 1318 O ARG A 89 67.409 41.063 21.268 1.00 0.00 O ATOM 1319 CB ARG A 89 70.822 41.326 21.780 1.00 0.00 C ATOM 1320 CG ARG A 89 72.121 40.648 22.122 1.00 0.00 C ATOM 1321 CD ARG A 89 72.984 41.453 23.089 1.00 0.00 C ATOM 1322 NE ARG A 89 73.416 42.743 22.503 1.00 0.00 N ATOM 1323 CZ ARG A 89 73.697 43.879 23.122 1.00 0.00 C ATOM 1324 NH1 ARG A 89 73.562 44.062 24.400 1.00 0.00 N ATOM 1325 NH2 ARG A 89 74.141 44.916 22.474 1.00 0.00 N ATOM 0 H ARG A 89 70.416 39.364 20.407 1.00 0.00 H new ATOM 0 HA ARG A 89 69.700 39.935 22.994 1.00 0.00 H new ATOM 0 HB2 ARG A 89 70.838 41.637 20.736 1.00 0.00 H new ATOM 0 HB3 ARG A 89 70.714 42.229 22.380 1.00 0.00 H new ATOM 0 HG2 ARG A 89 71.910 39.672 22.560 1.00 0.00 H new ATOM 0 HG3 ARG A 89 72.683 40.471 21.205 1.00 0.00 H new ATOM 0 HD2 ARG A 89 72.424 41.640 24.005 1.00 0.00 H new ATOM 0 HD3 ARG A 89 73.861 40.868 23.365 1.00 0.00 H new ATOM 0 HE ARG A 89 73.509 42.758 21.487 1.00 0.00 H new ATOM 0 HH11 ARG A 89 73.221 43.304 24.991 1.00 0.00 H new ATOM 0 HH12 ARG A 89 73.797 44.964 24.814 1.00 0.00 H new ATOM 0 HH21 ARG A 89 74.280 44.866 21.465 1.00 0.00 H new ATOM 0 HH22 ARG A 89 74.350 45.780 22.975 1.00 0.00 H new ATOM 1339 N GLY A 90 68.397 42.190 22.959 1.00 0.00 N ATOM 1340 CA GLY A 90 67.293 42.618 23.788 1.00 0.00 C ATOM 1341 C GLY A 90 67.078 41.669 24.970 1.00 0.00 C ATOM 1342 O GLY A 90 66.114 41.792 25.725 1.00 0.00 O ATOM 0 H GLY A 90 69.256 42.698 23.168 1.00 0.00 H new ATOM 0 HA2 GLY A 90 67.484 43.625 24.159 1.00 0.00 H new ATOM 0 HA3 GLY A 90 66.384 42.666 23.189 1.00 0.00 H new ATOM 1346 N GLN A 91 67.988 40.700 25.109 1.00 0.00 N ATOM 1347 CA GLN A 91 68.001 39.654 26.090 1.00 0.00 C ATOM 1348 C GLN A 91 69.303 39.561 26.895 1.00 0.00 C ATOM 1349 O GLN A 91 70.399 39.842 26.411 1.00 0.00 O ATOM 1350 CB GLN A 91 67.744 38.327 25.392 1.00 0.00 C ATOM 1351 CG GLN A 91 66.282 38.085 25.022 1.00 0.00 C ATOM 1352 CD GLN A 91 66.044 36.645 24.573 1.00 0.00 C ATOM 1353 OE1 GLN A 91 65.563 35.799 25.320 1.00 0.00 O ATOM 1354 NE2 GLN A 91 66.404 36.292 23.363 1.00 0.00 N ATOM 0 H GLN A 91 68.789 40.638 24.481 1.00 0.00 H new ATOM 0 HA GLN A 91 67.218 39.891 26.811 1.00 0.00 H new ATOM 0 HB2 GLN A 91 68.348 38.283 24.486 1.00 0.00 H new ATOM 0 HB3 GLN A 91 68.082 37.518 26.039 1.00 0.00 H new ATOM 0 HG2 GLN A 91 65.648 38.308 25.880 1.00 0.00 H new ATOM 0 HG3 GLN A 91 65.991 38.768 24.224 1.00 0.00 H new ATOM 0 HE21 GLN A 91 66.806 36.982 22.729 1.00 0.00 H new ATOM 0 HE22 GLN A 91 66.282 35.327 23.056 1.00 0.00 H new ATOM 1363 N SER A 92 69.127 39.064 28.109 1.00 0.00 N ATOM 1364 CA SER A 92 70.058 38.555 29.096 1.00 0.00 C ATOM 1365 C SER A 92 69.151 37.832 30.102 1.00 0.00 C ATOM 1366 O SER A 92 68.044 38.297 30.387 1.00 0.00 O ATOM 1367 CB SER A 92 70.864 39.673 29.755 1.00 0.00 C ATOM 1368 OG SER A 92 70.059 40.729 30.240 1.00 0.00 O ATOM 0 H SER A 92 68.177 39.001 28.476 1.00 0.00 H new ATOM 0 HA SER A 92 70.813 37.900 28.662 1.00 0.00 H new ATOM 0 HB2 SER A 92 71.442 39.257 30.580 1.00 0.00 H new ATOM 0 HB3 SER A 92 71.578 40.071 29.034 1.00 0.00 H new ATOM 0 HG SER A 92 69.971 40.653 31.213 1.00 0.00 H new ATOM 1374 N ARG A 93 69.530 36.625 30.518 1.00 0.00 N ATOM 1375 CA ARG A 93 68.633 35.684 31.209 1.00 0.00 C ATOM 1376 C ARG A 93 69.220 35.245 32.546 1.00 0.00 C ATOM 1377 O ARG A 93 70.257 34.583 32.581 1.00 0.00 O ATOM 1378 CB ARG A 93 68.379 34.474 30.295 1.00 0.00 C ATOM 1379 CG ARG A 93 67.553 34.779 29.033 1.00 0.00 C ATOM 1380 CD ARG A 93 67.568 33.565 28.091 1.00 0.00 C ATOM 1381 NE ARG A 93 66.598 33.703 26.987 1.00 0.00 N ATOM 1382 CZ ARG A 93 66.001 32.709 26.353 1.00 0.00 C ATOM 1383 NH1 ARG A 93 66.325 31.463 26.496 1.00 0.00 N ATOM 1384 NH2 ARG A 93 65.027 32.953 25.532 1.00 0.00 N ATOM 0 H ARG A 93 70.475 36.264 30.387 1.00 0.00 H new ATOM 0 HA ARG A 93 67.687 36.181 31.422 1.00 0.00 H new ATOM 0 HB2 ARG A 93 69.340 34.058 29.991 1.00 0.00 H new ATOM 0 HB3 ARG A 93 67.866 33.704 30.870 1.00 0.00 H new ATOM 0 HG2 ARG A 93 66.527 35.023 29.310 1.00 0.00 H new ATOM 0 HG3 ARG A 93 67.961 35.651 28.523 1.00 0.00 H new ATOM 0 HD2 ARG A 93 68.569 33.440 27.679 1.00 0.00 H new ATOM 0 HD3 ARG A 93 67.342 32.663 28.660 1.00 0.00 H new ATOM 0 HE ARG A 93 66.368 34.650 26.687 1.00 0.00 H new ATOM 0 HH11 ARG A 93 67.082 31.202 27.128 1.00 0.00 H new ATOM 0 HH12 ARG A 93 65.823 30.743 25.976 1.00 0.00 H new ATOM 0 HH21 ARG A 93 64.721 33.913 25.375 1.00 0.00 H new ATOM 0 HH22 ARG A 93 64.567 32.185 25.043 1.00 0.00 H new ATOM 1398 N PHE A 94 68.535 35.566 33.640 1.00 0.00 N ATOM 1399 CA PHE A 94 68.949 35.212 34.998 1.00 0.00 C ATOM 1400 C PHE A 94 67.788 34.588 35.790 1.00 0.00 C ATOM 1401 O PHE A 94 66.662 35.083 35.762 1.00 0.00 O ATOM 1402 CB PHE A 94 69.557 36.447 35.684 1.00 0.00 C ATOM 1403 CG PHE A 94 70.438 36.118 36.874 1.00 0.00 C ATOM 1404 CD1 PHE A 94 69.877 35.895 38.146 1.00 0.00 C ATOM 1405 CD2 PHE A 94 71.830 36.006 36.702 1.00 0.00 C ATOM 1406 CE1 PHE A 94 70.704 35.548 39.232 1.00 0.00 C ATOM 1407 CE2 PHE A 94 72.654 35.676 37.791 1.00 0.00 C ATOM 1408 CZ PHE A 94 72.092 35.438 39.056 1.00 0.00 C ATOM 0 H PHE A 94 67.660 36.089 33.609 1.00 0.00 H new ATOM 0 HA PHE A 94 69.721 34.444 34.958 1.00 0.00 H new ATOM 0 HB2 PHE A 94 70.143 37.004 34.953 1.00 0.00 H new ATOM 0 HB3 PHE A 94 68.750 37.102 36.012 1.00 0.00 H new ATOM 0 HD1 PHE A 94 68.811 35.990 38.289 1.00 0.00 H new ATOM 0 HD2 PHE A 94 72.267 36.174 35.729 1.00 0.00 H new ATOM 0 HE1 PHE A 94 70.269 35.366 40.203 1.00 0.00 H new ATOM 0 HE2 PHE A 94 73.723 35.605 37.655 1.00 0.00 H new ATOM 0 HZ PHE A 94 72.725 35.172 39.889 1.00 0.00 H new ATOM 1418 N CYS A 95 68.042 33.488 36.501 1.00 0.00 N ATOM 1419 CA CYS A 95 67.021 32.761 37.269 1.00 0.00 C ATOM 1420 C CYS A 95 67.414 32.590 38.747 1.00 0.00 C ATOM 1421 O CYS A 95 68.304 31.803 39.070 1.00 0.00 O ATOM 1422 CB CYS A 95 66.693 31.440 36.559 1.00 0.00 C ATOM 1423 SG CYS A 95 65.210 30.708 37.304 1.00 0.00 S ATOM 0 H CYS A 95 68.970 33.070 36.563 1.00 0.00 H new ATOM 0 HA CYS A 95 66.107 33.353 37.299 1.00 0.00 H new ATOM 0 HB2 CYS A 95 66.530 31.616 35.496 1.00 0.00 H new ATOM 0 HB3 CYS A 95 67.533 30.751 36.643 1.00 0.00 H new ATOM 0 HG CYS A 95 64.929 29.590 36.703 1.00 0.00 H new ATOM 1429 N ILE A 96 66.779 33.356 39.642 1.00 0.00 N ATOM 1430 CA ILE A 96 67.240 33.603 41.020 1.00 0.00 C ATOM 1431 C ILE A 96 66.323 32.994 42.090 1.00 0.00 C ATOM 1432 O ILE A 96 65.133 32.780 41.871 1.00 0.00 O ATOM 1433 CB ILE A 96 67.440 35.124 41.218 1.00 0.00 C ATOM 1434 CG1 ILE A 96 68.376 35.483 42.391 1.00 0.00 C ATOM 1435 CG2 ILE A 96 66.102 35.880 41.303 1.00 0.00 C ATOM 1436 CD1 ILE A 96 68.830 36.950 42.386 1.00 0.00 C ATOM 0 H ILE A 96 65.906 33.836 39.425 1.00 0.00 H new ATOM 0 HA ILE A 96 68.193 33.092 41.154 1.00 0.00 H new ATOM 0 HB ILE A 96 67.953 35.464 40.318 1.00 0.00 H new ATOM 0 HG12 ILE A 96 67.865 35.272 43.331 1.00 0.00 H new ATOM 0 HG13 ILE A 96 69.255 34.839 42.354 1.00 0.00 H new ATOM 0 HG21 ILE A 96 66.293 36.944 41.442 1.00 0.00 H new ATOM 0 HG22 ILE A 96 65.540 35.730 40.381 1.00 0.00 H new ATOM 0 HG23 ILE A 96 65.524 35.502 42.146 1.00 0.00 H new ATOM 0 HD11 ILE A 96 69.485 37.131 43.238 1.00 0.00 H new ATOM 0 HD12 ILE A 96 69.369 37.161 41.463 1.00 0.00 H new ATOM 0 HD13 ILE A 96 67.958 37.601 42.454 1.00 0.00 H new ATOM 1448 N PHE A 97 66.879 32.763 43.275 1.00 0.00 N ATOM 1449 CA PHE A 97 66.199 32.209 44.437 1.00 0.00 C ATOM 1450 C PHE A 97 65.933 33.267 45.523 1.00 0.00 C ATOM 1451 O PHE A 97 66.859 33.765 46.165 1.00 0.00 O ATOM 1452 CB PHE A 97 67.062 31.087 45.013 1.00 0.00 C ATOM 1453 CG PHE A 97 67.207 29.819 44.190 1.00 0.00 C ATOM 1454 CD1 PHE A 97 66.082 29.023 43.905 1.00 0.00 C ATOM 1455 CD2 PHE A 97 68.487 29.387 43.786 1.00 0.00 C ATOM 1456 CE1 PHE A 97 66.238 27.795 43.236 1.00 0.00 C ATOM 1457 CE2 PHE A 97 68.644 28.158 43.122 1.00 0.00 C ATOM 1458 CZ PHE A 97 67.519 27.356 42.856 1.00 0.00 C ATOM 0 H PHE A 97 67.861 32.967 43.458 1.00 0.00 H new ATOM 0 HA PHE A 97 65.228 31.832 44.116 1.00 0.00 H new ATOM 0 HB2 PHE A 97 68.060 31.488 45.191 1.00 0.00 H new ATOM 0 HB3 PHE A 97 66.651 30.812 45.984 1.00 0.00 H new ATOM 0 HD1 PHE A 97 65.098 29.355 44.200 1.00 0.00 H new ATOM 0 HD2 PHE A 97 69.351 30.003 43.988 1.00 0.00 H new ATOM 0 HE1 PHE A 97 65.372 27.188 43.014 1.00 0.00 H new ATOM 0 HE2 PHE A 97 69.627 27.830 42.817 1.00 0.00 H new ATOM 0 HZ PHE A 97 67.639 26.404 42.360 1.00 0.00 H new ATOM 1468 N SER A 98 64.658 33.488 45.853 1.00 0.00 N ATOM 1469 CA SER A 98 64.228 34.182 47.086 1.00 0.00 C ATOM 1470 C SER A 98 64.690 33.486 48.378 1.00 0.00 C ATOM 1471 O SER A 98 64.808 34.097 49.435 1.00 0.00 O ATOM 1472 CB SER A 98 62.710 34.286 47.097 1.00 0.00 C ATOM 1473 OG SER A 98 62.128 33.004 46.928 1.00 0.00 O ATOM 0 H SER A 98 63.878 33.188 45.268 1.00 0.00 H new ATOM 0 HA SER A 98 64.697 35.166 47.071 1.00 0.00 H new ATOM 0 HB2 SER A 98 62.375 34.724 48.038 1.00 0.00 H new ATOM 0 HB3 SER A 98 62.378 34.951 46.300 1.00 0.00 H new ATOM 0 HG SER A 98 61.151 33.084 46.939 1.00 0.00 H new ATOM 1479 N SER A 99 64.988 32.190 48.285 1.00 0.00 N ATOM 1480 CA SER A 99 65.609 31.387 49.346 1.00 0.00 C ATOM 1481 C SER A 99 67.066 31.803 49.644 1.00 0.00 C ATOM 1482 O SER A 99 67.574 31.548 50.740 1.00 0.00 O ATOM 1483 CB SER A 99 65.492 29.922 48.941 1.00 0.00 C ATOM 1484 OG SER A 99 65.671 29.031 50.022 1.00 0.00 O ATOM 0 H SER A 99 64.798 31.649 47.441 1.00 0.00 H new ATOM 0 HA SER A 99 65.084 31.558 50.286 1.00 0.00 H new ATOM 0 HB2 SER A 99 64.511 29.752 48.496 1.00 0.00 H new ATOM 0 HB3 SER A 99 66.233 29.704 48.172 1.00 0.00 H new ATOM 0 HG SER A 99 65.584 28.108 49.703 1.00 0.00 H new ATOM 1490 N SER A 100 67.737 32.464 48.692 1.00 0.00 N ATOM 1491 CA SER A 100 69.135 32.876 48.718 1.00 0.00 C ATOM 1492 C SER A 100 69.324 34.383 48.899 1.00 0.00 C ATOM 1493 O SER A 100 70.396 34.797 49.332 1.00 0.00 O ATOM 1494 CB SER A 100 69.795 32.461 47.410 1.00 0.00 C ATOM 1495 OG SER A 100 69.674 31.065 47.220 1.00 0.00 O ATOM 0 H SER A 100 67.279 32.742 47.824 1.00 0.00 H new ATOM 0 HA SER A 100 69.591 32.388 49.579 1.00 0.00 H new ATOM 0 HB2 SER A 100 69.331 32.990 46.577 1.00 0.00 H new ATOM 0 HB3 SER A 100 70.848 32.743 47.420 1.00 0.00 H new ATOM 0 HG SER A 100 70.318 30.770 46.543 1.00 0.00 H new ATOM 1501 N LEU A 101 68.326 35.212 48.592 1.00 0.00 N ATOM 1502 CA LEU A 101 68.280 36.610 49.022 1.00 0.00 C ATOM 1503 C LEU A 101 66.855 37.179 49.183 1.00 0.00 C ATOM 1504 O LEU A 101 65.913 36.723 48.538 1.00 0.00 O ATOM 1505 CB LEU A 101 69.198 37.443 48.119 1.00 0.00 C ATOM 1506 CG LEU A 101 68.548 38.222 46.959 1.00 0.00 C ATOM 1507 CD1 LEU A 101 69.575 39.154 46.321 1.00 0.00 C ATOM 1508 CD2 LEU A 101 68.017 37.283 45.875 1.00 0.00 C ATOM 0 H LEU A 101 67.520 34.930 48.034 1.00 0.00 H new ATOM 0 HA LEU A 101 68.664 36.667 50.040 1.00 0.00 H new ATOM 0 HB2 LEU A 101 69.728 38.158 48.748 1.00 0.00 H new ATOM 0 HB3 LEU A 101 69.948 36.775 47.695 1.00 0.00 H new ATOM 0 HG LEU A 101 67.716 38.789 47.376 1.00 0.00 H new ATOM 0 HD11 LEU A 101 69.110 39.702 45.502 1.00 0.00 H new ATOM 0 HD12 LEU A 101 69.940 39.859 47.068 1.00 0.00 H new ATOM 0 HD13 LEU A 101 70.410 38.567 45.937 1.00 0.00 H new ATOM 0 HD21 LEU A 101 67.566 37.870 45.074 1.00 0.00 H new ATOM 0 HD22 LEU A 101 68.839 36.691 45.472 1.00 0.00 H new ATOM 0 HD23 LEU A 101 67.267 36.619 46.305 1.00 0.00 H new ATOM 1520 N LYS A 102 66.701 38.184 50.052 1.00 0.00 N ATOM 1521 CA LYS A 102 65.424 38.650 50.625 1.00 0.00 C ATOM 1522 C LYS A 102 65.071 40.091 50.247 1.00 0.00 C ATOM 1523 O LYS A 102 65.911 40.839 49.766 1.00 0.00 O ATOM 1524 CB LYS A 102 65.405 38.441 52.158 1.00 0.00 C ATOM 1525 CG LYS A 102 66.768 38.185 52.836 1.00 0.00 C ATOM 1526 CD LYS A 102 66.679 38.131 54.367 1.00 0.00 C ATOM 1527 CE LYS A 102 65.928 36.880 54.836 1.00 0.00 C ATOM 1528 NZ LYS A 102 65.914 36.768 56.313 1.00 0.00 N ATOM 0 H LYS A 102 67.497 38.722 50.394 1.00 0.00 H new ATOM 0 HA LYS A 102 64.643 38.035 50.179 1.00 0.00 H new ATOM 0 HB2 LYS A 102 64.956 39.322 52.617 1.00 0.00 H new ATOM 0 HB3 LYS A 102 64.750 37.598 52.379 1.00 0.00 H new ATOM 0 HG2 LYS A 102 67.179 37.244 52.469 1.00 0.00 H new ATOM 0 HG3 LYS A 102 67.465 38.972 52.546 1.00 0.00 H new ATOM 0 HD2 LYS A 102 67.683 38.136 54.792 1.00 0.00 H new ATOM 0 HD3 LYS A 102 66.172 39.022 54.736 1.00 0.00 H new ATOM 0 HE2 LYS A 102 64.904 36.910 54.464 1.00 0.00 H new ATOM 0 HE3 LYS A 102 66.396 35.993 54.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 65.397 35.910 56.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 66.891 36.714 56.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 65.444 37.602 56.720 1.00 0.00 H new ATOM 1542 N PHE A 103 63.822 40.481 50.511 1.00 0.00 N ATOM 1543 CA PHE A 103 63.247 41.797 50.278 1.00 0.00 C ATOM 1544 C PHE A 103 62.945 42.499 51.605 1.00 0.00 C ATOM 1545 O PHE A 103 62.322 41.929 52.502 1.00 0.00 O ATOM 1546 CB PHE A 103 61.964 41.640 49.448 1.00 0.00 C ATOM 1547 CG PHE A 103 61.318 42.945 49.002 1.00 0.00 C ATOM 1548 CD1 PHE A 103 62.041 43.861 48.221 1.00 0.00 C ATOM 1549 CD2 PHE A 103 59.986 43.244 49.345 1.00 0.00 C ATOM 1550 CE1 PHE A 103 61.453 45.064 47.794 1.00 0.00 C ATOM 1551 CE2 PHE A 103 59.387 44.438 48.905 1.00 0.00 C ATOM 1552 CZ PHE A 103 60.124 45.356 48.140 1.00 0.00 C ATOM 0 H PHE A 103 63.144 39.838 50.921 1.00 0.00 H new ATOM 0 HA PHE A 103 63.962 42.412 49.732 1.00 0.00 H new ATOM 0 HB2 PHE A 103 62.193 41.045 48.564 1.00 0.00 H new ATOM 0 HB3 PHE A 103 61.238 41.075 50.033 1.00 0.00 H new ATOM 0 HD1 PHE A 103 63.061 43.638 47.945 1.00 0.00 H new ATOM 0 HD2 PHE A 103 59.420 42.552 49.950 1.00 0.00 H new ATOM 0 HE1 PHE A 103 62.023 45.763 47.200 1.00 0.00 H new ATOM 0 HE2 PHE A 103 58.358 44.649 49.156 1.00 0.00 H new ATOM 0 HZ PHE A 103 59.671 46.282 47.819 1.00 0.00 H new ATOM 1562 N VAL A 104 63.361 43.753 51.695 1.00 0.00 N ATOM 1563 CA VAL A 104 63.048 44.715 52.754 1.00 0.00 C ATOM 1564 C VAL A 104 62.276 45.923 52.188 1.00 0.00 C ATOM 1565 O VAL A 104 62.861 46.775 51.514 1.00 0.00 O ATOM 1566 CB VAL A 104 64.317 45.089 53.548 1.00 0.00 C ATOM 1567 CG1 VAL A 104 65.438 45.784 52.763 1.00 0.00 C ATOM 1568 CG2 VAL A 104 63.962 45.951 54.764 1.00 0.00 C ATOM 0 H VAL A 104 63.969 44.159 50.983 1.00 0.00 H new ATOM 0 HA VAL A 104 62.376 44.252 53.477 1.00 0.00 H new ATOM 0 HB VAL A 104 64.723 44.120 53.839 1.00 0.00 H new ATOM 0 HG11 VAL A 104 66.273 45.995 53.431 1.00 0.00 H new ATOM 0 HG12 VAL A 104 65.774 45.133 51.956 1.00 0.00 H new ATOM 0 HG13 VAL A 104 65.064 46.718 52.344 1.00 0.00 H new ATOM 0 HG21 VAL A 104 64.872 46.203 55.309 1.00 0.00 H new ATOM 0 HG22 VAL A 104 63.473 46.866 54.431 1.00 0.00 H new ATOM 0 HG23 VAL A 104 63.288 45.397 55.418 1.00 0.00 H new ATOM 1578 N PRO A 105 60.952 46.023 52.413 1.00 0.00 N ATOM 1579 CA PRO A 105 60.176 47.167 51.949 1.00 0.00 C ATOM 1580 C PRO A 105 60.327 48.391 52.862 1.00 0.00 C ATOM 1581 O PRO A 105 60.683 48.270 54.035 1.00 0.00 O ATOM 1582 CB PRO A 105 58.727 46.680 51.884 1.00 0.00 C ATOM 1583 CG PRO A 105 58.670 45.646 53.008 1.00 0.00 C ATOM 1584 CD PRO A 105 60.069 45.023 52.997 1.00 0.00 C ATOM 0 HA PRO A 105 60.530 47.508 50.976 1.00 0.00 H new ATOM 0 HB2 PRO A 105 58.019 47.493 52.045 1.00 0.00 H new ATOM 0 HB3 PRO A 105 58.491 46.239 50.916 1.00 0.00 H new ATOM 0 HG2 PRO A 105 58.446 46.110 53.968 1.00 0.00 H new ATOM 0 HG3 PRO A 105 57.897 44.899 52.827 1.00 0.00 H new ATOM 0 HD2 PRO A 105 60.388 44.763 54.006 1.00 0.00 H new ATOM 0 HD3 PRO A 105 60.081 44.103 52.412 1.00 0.00 H new ATOM 1592 N LYS A 106 60.046 49.584 52.320 1.00 0.00 N ATOM 1593 CA LYS A 106 60.062 50.847 53.053 1.00 0.00 C ATOM 1594 C LYS A 106 58.869 51.062 53.997 1.00 0.00 C ATOM 1595 O LYS A 106 58.009 50.208 54.193 1.00 0.00 O ATOM 1596 CB LYS A 106 60.330 52.024 52.105 1.00 0.00 C ATOM 1597 CG LYS A 106 61.545 52.863 52.541 1.00 0.00 C ATOM 1598 CD LYS A 106 62.864 52.116 52.264 1.00 0.00 C ATOM 1599 CE LYS A 106 64.085 52.760 52.927 1.00 0.00 C ATOM 1600 NZ LYS A 106 64.289 54.165 52.506 1.00 0.00 N ATOM 0 H LYS A 106 59.796 49.695 51.337 1.00 0.00 H new ATOM 0 HA LYS A 106 60.902 50.790 53.745 1.00 0.00 H new ATOM 0 HB2 LYS A 106 60.497 51.644 51.097 1.00 0.00 H new ATOM 0 HB3 LYS A 106 59.447 52.662 52.063 1.00 0.00 H new ATOM 0 HG2 LYS A 106 61.544 53.814 52.009 1.00 0.00 H new ATOM 0 HG3 LYS A 106 61.470 53.092 53.604 1.00 0.00 H new ATOM 0 HD2 LYS A 106 62.770 51.088 52.615 1.00 0.00 H new ATOM 0 HD3 LYS A 106 63.027 52.071 51.187 1.00 0.00 H new ATOM 0 HE2 LYS A 106 63.967 52.723 54.010 1.00 0.00 H new ATOM 0 HE3 LYS A 106 64.974 52.179 52.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 65.137 54.547 52.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 64.412 54.204 51.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 63.461 54.732 52.777 1.00 0.00 H new