USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 914 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 123 THR OG1 : rot 11:sc= 1.14 USER MOD Set 1.2: A 141 THR OG1 : rot -57:sc= 0.926 USER MOD Set 2.1: A 101 THR OG1 : rot 93:sc= 1.14 USER MOD Set 2.2: A 103 GLN :FLIP amide:sc= 0.931 F(o=1.2,f=2.1) USER MOD Set 3.1: A 86 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 110 MET CE :methyl 180:sc= -0.0484 (180deg=-0.0484) USER MOD Set 4.1: A 55 SER OG : rot -64:sc= 1.56 USER MOD Set 4.2: A 57 GLN :FLIP amide:sc= 1.48 F(o=1.2,f=3) USER MOD Single : A 29 THR OG1 : rot 64:sc= 0.165 USER MOD Single : A 31 GLN :FLIP amide:sc= -0.524 F(o=-2.3!,f=-0.52) USER MOD Single : A 34 THR OG1 : rot -47:sc= 0.726 USER MOD Single : A 41 SER OG : rot 60:sc= 0.375 USER MOD Single : A 45 THR OG1 : rot 160:sc= 0.894 USER MOD Single : A 48 TYR OH : rot 180:sc= -0.13 USER MOD Single : A 49 MET CE :methyl -146:sc= -0.526 (180deg=-1.35) USER MOD Single : A 50 THR OG1 : rot 13:sc= 0.743 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0.86 K(o=0.86,f=-3!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 145:sc= 0.855 (180deg=-3.76!) USER MOD Single : A 66 THR OG1 : rot 158:sc= 0.605 USER MOD Single : A 70 THR OG1 : rot -169:sc= 0.0198 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl -162:sc= -0.488 (180deg=-1.62) USER MOD Single : A 76 THR OG1 : rot -67:sc= 1.78 USER MOD Single : A 77 THR OG1 : rot -39:sc= 0.109 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0.742 USER MOD Single : A 79 HIS : no HD1:sc= -0.0518 X(o=-0.052,f=-0.11) USER MOD Single : A 80 SER OG : rot 180:sc= 0.0544 USER MOD Single : A 83 MET CE :methyl -171:sc= 0 (180deg=-0.106) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 MET CE :methyl -179:sc= 0 (180deg=-1.02e-05) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 73:sc= 0.927 USER MOD Single : A 108 HIS : no HD1:sc= -0.77 K(o=-0.77,f=-1.3) USER MOD Single : A 112 MET CE :methyl 174:sc= 0 (180deg=-0.0482) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ -168:sc= 0.941 (180deg=0.53) USER MOD Single : A 125 ASN : amide:sc= -0.0104 K(o=-0.01,f=-1.3) USER MOD Single : A 127 THR OG1 : rot 180:sc=-0.00452 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 61:sc= 1.26 USER MOD Single : A 137 ASN : amide:sc= 0.445 K(o=0.44,f=-3.7!) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.225) USER MOD ----------------------------------------------------------------- ATOM 369 N VAL A 28 -6.073 6.041 -0.040 1.00 10.00 N ATOM 370 CA VAL A 28 -5.377 5.139 -0.956 1.00 10.00 C ATOM 371 C VAL A 28 -3.889 5.047 -0.616 1.00 10.00 C ATOM 372 O VAL A 28 -3.018 5.198 -1.472 1.00 10.00 O ATOM 373 CB VAL A 28 -5.601 5.646 -2.395 1.00 10.00 C ATOM 374 CG1 VAL A 28 -7.089 5.570 -2.748 1.00 10.00 C ATOM 375 CG2 VAL A 28 -5.138 7.090 -2.636 1.00 10.00 C ATOM 0 HA VAL A 28 -5.778 4.130 -0.860 1.00 10.00 H new ATOM 0 HB VAL A 28 -4.994 4.996 -3.026 1.00 10.00 H new ATOM 0 HG11 VAL A 28 -7.240 5.930 -3.766 1.00 10.00 H new ATOM 0 HG12 VAL A 28 -7.428 4.537 -2.674 1.00 10.00 H new ATOM 0 HG13 VAL A 28 -7.659 6.189 -2.056 1.00 10.00 H new ATOM 0 HG21 VAL A 28 -5.332 7.366 -3.672 1.00 10.00 H new ATOM 0 HG22 VAL A 28 -5.683 7.762 -1.973 1.00 10.00 H new ATOM 0 HG23 VAL A 28 -4.070 7.168 -2.434 1.00 10.00 H new ATOM 385 N THR A 29 -3.593 4.764 0.650 1.00 10.00 N ATOM 386 CA THR A 29 -2.260 4.932 1.194 1.00 10.00 C ATOM 387 C THR A 29 -2.099 4.047 2.428 1.00 10.00 C ATOM 388 O THR A 29 -1.696 4.547 3.478 1.00 10.00 O ATOM 389 CB THR A 29 -2.047 6.420 1.555 1.00 10.00 C ATOM 390 OG1 THR A 29 -3.005 6.826 2.511 1.00 10.00 O ATOM 391 CG2 THR A 29 -2.103 7.396 0.375 1.00 10.00 C ATOM 0 H THR A 29 -4.274 4.412 1.323 1.00 10.00 H new ATOM 0 HA THR A 29 -1.512 4.637 0.458 1.00 10.00 H new ATOM 0 HB THR A 29 -1.030 6.466 1.945 1.00 10.00 H new ATOM 0 HG1 THR A 29 -2.876 6.319 3.339 1.00 10.00 H new ATOM 0 HG21 THR A 29 -1.942 8.412 0.735 1.00 10.00 H new ATOM 0 HG22 THR A 29 -1.327 7.139 -0.346 1.00 10.00 H new ATOM 0 HG23 THR A 29 -3.080 7.332 -0.104 1.00 10.00 H new ATOM 399 N VAL A 30 -2.346 2.740 2.297 1.00 10.00 N ATOM 400 CA VAL A 30 -2.153 1.780 3.382 1.00 10.00 C ATOM 401 C VAL A 30 -0.849 1.009 3.140 1.00 10.00 C ATOM 402 O VAL A 30 -0.824 -0.213 3.034 1.00 10.00 O ATOM 403 CB VAL A 30 -3.433 0.939 3.583 1.00 10.00 C ATOM 404 CG1 VAL A 30 -3.880 0.152 2.345 1.00 10.00 C ATOM 405 CG2 VAL A 30 -3.337 0.010 4.802 1.00 10.00 C ATOM 0 H VAL A 30 -2.686 2.319 1.432 1.00 10.00 H new ATOM 0 HA VAL A 30 -2.014 2.269 4.346 1.00 10.00 H new ATOM 0 HB VAL A 30 -4.209 1.681 3.769 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -4.785 -0.409 2.578 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -4.082 0.844 1.527 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -3.091 -0.539 2.049 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -4.262 -0.559 4.899 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -2.500 -0.676 4.671 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -3.181 0.605 5.702 1.00 10.00 H new ATOM 415 N GLN A 31 0.246 1.767 3.053 1.00 10.00 N ATOM 416 CA GLN A 31 1.614 1.263 3.011 1.00 10.00 C ATOM 417 C GLN A 31 2.252 1.329 4.407 1.00 10.00 C ATOM 418 O GLN A 31 1.627 1.786 5.362 1.00 10.00 O ATOM 419 CB GLN A 31 2.410 2.030 1.933 1.00 10.00 C ATOM 420 CG GLN A 31 3.013 3.388 2.343 1.00 10.00 C ATOM 421 CD GLN A 31 2.034 4.316 3.050 1.00 10.00 C ATOM 422 OE1 GLN A 31 0.933 4.654 2.391 1.00 10.00 O flip ATOM 423 NE2 GLN A 31 2.245 4.704 4.192 1.00 10.00 N flip ATOM 0 H GLN A 31 0.199 2.785 3.008 1.00 10.00 H new ATOM 0 HA GLN A 31 1.622 0.211 2.727 1.00 10.00 H new ATOM 0 HB2 GLN A 31 3.222 1.388 1.591 1.00 10.00 H new ATOM 0 HB3 GLN A 31 1.752 2.195 1.079 1.00 10.00 H new ATOM 0 HG2 GLN A 31 3.867 3.211 2.997 1.00 10.00 H new ATOM 0 HG3 GLN A 31 3.392 3.889 1.452 1.00 10.00 H new ATOM 0 HE21 GLN A 31 3.100 4.428 4.674 1.00 10.00 H new ATOM 0 HE22 GLN A 31 1.565 5.303 4.661 1.00 10.00 H new ATOM 432 N GLY A 32 3.510 0.897 4.507 1.00 10.00 N ATOM 433 CA GLY A 32 4.398 1.125 5.641 1.00 10.00 C ATOM 434 C GLY A 32 5.774 1.468 5.071 1.00 10.00 C ATOM 435 O GLY A 32 5.848 2.167 4.062 1.00 10.00 O ATOM 0 H GLY A 32 3.954 0.355 3.766 1.00 10.00 H new ATOM 0 HA2 GLY A 32 4.026 1.938 6.265 1.00 10.00 H new ATOM 0 HA3 GLY A 32 4.453 0.238 6.272 1.00 10.00 H new ATOM 439 N ALA A 33 6.859 0.920 5.625 1.00 10.00 N ATOM 440 CA ALA A 33 8.154 0.946 4.957 1.00 10.00 C ATOM 441 C ALA A 33 9.076 -0.132 5.525 1.00 10.00 C ATOM 442 O ALA A 33 9.225 -0.261 6.741 1.00 10.00 O ATOM 443 CB ALA A 33 8.789 2.337 5.068 1.00 10.00 C ATOM 0 H ALA A 33 6.862 0.455 6.533 1.00 10.00 H new ATOM 0 HA ALA A 33 8.003 0.730 3.899 1.00 10.00 H new ATOM 0 HB1 ALA A 33 9.755 2.337 4.564 1.00 10.00 H new ATOM 0 HB2 ALA A 33 8.135 3.074 4.601 1.00 10.00 H new ATOM 0 HB3 ALA A 33 8.928 2.591 6.119 1.00 10.00 H new ATOM 449 N THR A 34 9.716 -0.892 4.633 1.00 10.00 N ATOM 450 CA THR A 34 10.844 -1.743 4.962 1.00 10.00 C ATOM 451 C THR A 34 11.964 -1.364 3.993 1.00 10.00 C ATOM 452 O THR A 34 11.661 -1.140 2.822 1.00 10.00 O ATOM 453 CB THR A 34 10.447 -3.223 4.879 1.00 10.00 C ATOM 454 OG1 THR A 34 10.167 -3.660 3.563 1.00 10.00 O ATOM 455 CG2 THR A 34 9.253 -3.544 5.784 1.00 10.00 C ATOM 0 H THR A 34 9.455 -0.928 3.648 1.00 10.00 H new ATOM 0 HA THR A 34 11.184 -1.597 5.987 1.00 10.00 H new ATOM 0 HB THR A 34 11.324 -3.768 5.228 1.00 10.00 H new ATOM 0 HG1 THR A 34 9.578 -3.013 3.122 1.00 10.00 H new ATOM 0 HG21 THR A 34 9.004 -4.601 5.696 1.00 10.00 H new ATOM 0 HG22 THR A 34 9.509 -3.316 6.819 1.00 10.00 H new ATOM 0 HG23 THR A 34 8.395 -2.943 5.482 1.00 10.00 H new ATOM 463 N VAL A 35 13.206 -1.204 4.463 1.00 10.00 N ATOM 464 CA VAL A 35 14.317 -0.676 3.670 1.00 10.00 C ATOM 465 C VAL A 35 15.437 -1.706 3.636 1.00 10.00 C ATOM 466 O VAL A 35 15.774 -2.260 4.681 1.00 10.00 O ATOM 467 CB VAL A 35 14.791 0.660 4.269 1.00 10.00 C ATOM 468 CG1 VAL A 35 15.962 1.255 3.474 1.00 10.00 C ATOM 469 CG2 VAL A 35 13.634 1.665 4.286 1.00 10.00 C ATOM 0 H VAL A 35 13.469 -1.442 5.419 1.00 10.00 H new ATOM 0 HA VAL A 35 13.996 -0.485 2.646 1.00 10.00 H new ATOM 0 HB VAL A 35 15.132 0.461 5.285 1.00 10.00 H new ATOM 0 HG11 VAL A 35 16.268 2.198 3.928 1.00 10.00 H new ATOM 0 HG12 VAL A 35 16.800 0.558 3.484 1.00 10.00 H new ATOM 0 HG13 VAL A 35 15.650 1.432 2.445 1.00 10.00 H new ATOM 0 HG21 VAL A 35 13.977 2.608 4.711 1.00 10.00 H new ATOM 0 HG22 VAL A 35 13.283 1.833 3.268 1.00 10.00 H new ATOM 0 HG23 VAL A 35 12.818 1.270 4.891 1.00 10.00 H new ATOM 479 N ALA A 36 16.036 -1.956 2.465 1.00 10.00 N ATOM 480 CA ALA A 36 16.992 -3.049 2.283 1.00 10.00 C ATOM 481 C ALA A 36 18.397 -2.733 2.816 1.00 10.00 C ATOM 482 O ALA A 36 19.392 -3.018 2.154 1.00 10.00 O ATOM 483 CB ALA A 36 17.031 -3.450 0.811 1.00 10.00 C ATOM 0 H ALA A 36 15.871 -1.407 1.621 1.00 10.00 H new ATOM 0 HA ALA A 36 16.642 -3.889 2.883 1.00 10.00 H new ATOM 0 HB1 ALA A 36 17.743 -4.264 0.674 1.00 10.00 H new ATOM 0 HB2 ALA A 36 16.040 -3.778 0.497 1.00 10.00 H new ATOM 0 HB3 ALA A 36 17.338 -2.595 0.209 1.00 10.00 H new ATOM 489 N ALA A 37 18.469 -2.152 4.017 1.00 10.00 N ATOM 490 CA ALA A 37 19.631 -1.481 4.592 1.00 10.00 C ATOM 491 C ALA A 37 20.554 -0.921 3.503 1.00 10.00 C ATOM 492 O ALA A 37 20.089 -0.115 2.704 1.00 10.00 O ATOM 493 CB ALA A 37 20.323 -2.365 5.637 1.00 10.00 C ATOM 0 H ALA A 37 17.668 -2.139 4.649 1.00 10.00 H new ATOM 0 HA ALA A 37 19.295 -0.604 5.145 1.00 10.00 H new ATOM 0 HB1 ALA A 37 21.184 -1.838 6.047 1.00 10.00 H new ATOM 0 HB2 ALA A 37 19.623 -2.595 6.440 1.00 10.00 H new ATOM 0 HB3 ALA A 37 20.654 -3.291 5.168 1.00 10.00 H new ATOM 499 N VAL A 38 21.811 -1.365 3.425 1.00 10.00 N ATOM 500 CA VAL A 38 22.637 -1.219 2.233 1.00 10.00 C ATOM 501 C VAL A 38 22.855 -2.636 1.691 1.00 10.00 C ATOM 502 O VAL A 38 23.488 -3.440 2.378 1.00 10.00 O ATOM 503 CB VAL A 38 23.960 -0.503 2.577 1.00 10.00 C ATOM 504 CG1 VAL A 38 24.950 -0.539 1.410 1.00 10.00 C ATOM 505 CG2 VAL A 38 23.681 0.964 2.918 1.00 10.00 C ATOM 0 H VAL A 38 22.284 -1.839 4.195 1.00 10.00 H new ATOM 0 HA VAL A 38 22.159 -0.600 1.474 1.00 10.00 H new ATOM 0 HB VAL A 38 24.398 -1.027 3.427 1.00 10.00 H new ATOM 0 HG11 VAL A 38 25.867 -0.024 1.695 1.00 10.00 H new ATOM 0 HG12 VAL A 38 25.179 -1.575 1.159 1.00 10.00 H new ATOM 0 HG13 VAL A 38 24.510 -0.044 0.544 1.00 10.00 H new ATOM 0 HG21 VAL A 38 24.618 1.466 3.160 1.00 10.00 H new ATOM 0 HG22 VAL A 38 23.217 1.455 2.062 1.00 10.00 H new ATOM 0 HG23 VAL A 38 23.009 1.017 3.775 1.00 10.00 H new ATOM 515 N PRO A 39 22.331 -2.983 0.503 1.00 10.00 N ATOM 516 CA PRO A 39 22.708 -4.210 -0.181 1.00 10.00 C ATOM 517 C PRO A 39 24.201 -4.145 -0.524 1.00 10.00 C ATOM 518 O PRO A 39 24.777 -3.058 -0.517 1.00 10.00 O ATOM 519 CB PRO A 39 21.853 -4.258 -1.457 1.00 10.00 C ATOM 520 CG PRO A 39 20.744 -3.234 -1.218 1.00 10.00 C ATOM 521 CD PRO A 39 21.426 -2.205 -0.323 1.00 10.00 C ATOM 0 HA PRO A 39 22.543 -5.100 0.427 1.00 10.00 H new ATOM 0 HB2 PRO A 39 22.442 -4.005 -2.339 1.00 10.00 H new ATOM 0 HB3 PRO A 39 21.443 -5.254 -1.622 1.00 10.00 H new ATOM 0 HG2 PRO A 39 20.394 -2.791 -2.150 1.00 10.00 H new ATOM 0 HG3 PRO A 39 19.877 -3.682 -0.732 1.00 10.00 H new ATOM 0 HD2 PRO A 39 21.965 -1.463 -0.912 1.00 10.00 H new ATOM 0 HD3 PRO A 39 20.700 -1.664 0.284 1.00 10.00 H new ATOM 529 N PRO A 40 24.854 -5.266 -0.861 1.00 10.00 N ATOM 530 CA PRO A 40 26.250 -5.263 -1.271 1.00 10.00 C ATOM 531 C PRO A 40 26.390 -4.720 -2.699 1.00 10.00 C ATOM 532 O PRO A 40 26.834 -5.422 -3.605 1.00 10.00 O ATOM 533 CB PRO A 40 26.697 -6.719 -1.134 1.00 10.00 C ATOM 534 CG PRO A 40 25.415 -7.501 -1.430 1.00 10.00 C ATOM 535 CD PRO A 40 24.318 -6.616 -0.834 1.00 10.00 C ATOM 0 HA PRO A 40 26.876 -4.610 -0.663 1.00 10.00 H new ATOM 0 HB2 PRO A 40 27.492 -6.965 -1.838 1.00 10.00 H new ATOM 0 HB3 PRO A 40 27.078 -6.932 -0.135 1.00 10.00 H new ATOM 0 HG2 PRO A 40 25.273 -7.651 -2.500 1.00 10.00 H new ATOM 0 HG3 PRO A 40 25.430 -8.488 -0.969 1.00 10.00 H new ATOM 0 HD2 PRO A 40 23.398 -6.685 -1.415 1.00 10.00 H new ATOM 0 HD3 PRO A 40 24.076 -6.922 0.184 1.00 10.00 H new ATOM 543 N SER A 41 26.009 -3.458 -2.903 1.00 10.00 N ATOM 544 CA SER A 41 26.032 -2.799 -4.192 1.00 10.00 C ATOM 545 C SER A 41 25.932 -1.292 -3.971 1.00 10.00 C ATOM 546 O SER A 41 24.978 -0.679 -4.437 1.00 10.00 O ATOM 547 CB SER A 41 24.884 -3.327 -5.066 1.00 10.00 C ATOM 548 OG SER A 41 23.636 -3.073 -4.450 1.00 10.00 O ATOM 0 H SER A 41 25.669 -2.858 -2.151 1.00 10.00 H new ATOM 0 HA SER A 41 26.964 -3.011 -4.716 1.00 10.00 H new ATOM 0 HB2 SER A 41 24.916 -2.851 -6.046 1.00 10.00 H new ATOM 0 HB3 SER A 41 25.005 -4.398 -5.228 1.00 10.00 H new ATOM 0 HG SER A 41 23.527 -2.108 -4.318 1.00 10.00 H new ATOM 554 N ILE A 42 26.925 -0.713 -3.284 1.00 10.00 N ATOM 555 CA ILE A 42 27.086 0.724 -3.101 1.00 10.00 C ATOM 556 C ILE A 42 26.072 1.245 -2.072 1.00 10.00 C ATOM 557 O ILE A 42 25.073 0.597 -1.785 1.00 10.00 O ATOM 558 CB ILE A 42 27.042 1.472 -4.455 1.00 10.00 C ATOM 559 CG1 ILE A 42 27.966 0.778 -5.483 1.00 10.00 C ATOM 560 CG2 ILE A 42 27.490 2.927 -4.268 1.00 10.00 C ATOM 561 CD1 ILE A 42 28.013 1.471 -6.846 1.00 10.00 C ATOM 0 H ILE A 42 27.659 -1.255 -2.828 1.00 10.00 H new ATOM 0 HA ILE A 42 28.076 0.926 -2.692 1.00 10.00 H new ATOM 0 HB ILE A 42 26.017 1.454 -4.826 1.00 10.00 H new ATOM 0 HG12 ILE A 42 28.976 0.732 -5.075 1.00 10.00 H new ATOM 0 HG13 ILE A 42 27.631 -0.250 -5.621 1.00 10.00 H new ATOM 0 HG21 ILE A 42 27.455 3.444 -5.227 1.00 10.00 H new ATOM 0 HG22 ILE A 42 26.825 3.425 -3.563 1.00 10.00 H new ATOM 0 HG23 ILE A 42 28.509 2.947 -3.881 1.00 10.00 H new ATOM 0 HD11 ILE A 42 28.682 0.923 -7.510 1.00 10.00 H new ATOM 0 HD12 ILE A 42 27.012 1.493 -7.278 1.00 10.00 H new ATOM 0 HD13 ILE A 42 28.378 2.491 -6.723 1.00 10.00 H new ATOM 573 N ARG A 43 26.321 2.427 -1.499 1.00 10.00 N ATOM 574 CA ARG A 43 25.457 3.076 -0.515 1.00 10.00 C ATOM 575 C ARG A 43 24.091 3.531 -1.058 1.00 10.00 C ATOM 576 O ARG A 43 23.512 4.465 -0.499 1.00 10.00 O ATOM 577 CB ARG A 43 26.214 4.263 0.102 1.00 10.00 C ATOM 578 CG ARG A 43 26.397 5.432 -0.874 1.00 10.00 C ATOM 579 CD ARG A 43 27.512 6.369 -0.394 1.00 10.00 C ATOM 580 NE ARG A 43 27.550 7.621 -1.169 1.00 10.00 N ATOM 581 CZ ARG A 43 28.014 7.758 -2.424 1.00 10.00 C ATOM 582 NH1 ARG A 43 28.500 6.697 -3.076 1.00 10.00 N ATOM 583 NH2 ARG A 43 27.989 8.955 -3.021 1.00 10.00 N ATOM 0 H ARG A 43 27.155 2.973 -1.716 1.00 10.00 H new ATOM 0 HA ARG A 43 25.221 2.324 0.238 1.00 10.00 H new ATOM 0 HB2 ARG A 43 25.674 4.613 0.982 1.00 10.00 H new ATOM 0 HB3 ARG A 43 27.193 3.925 0.442 1.00 10.00 H new ATOM 0 HG2 ARG A 43 26.638 5.050 -1.866 1.00 10.00 H new ATOM 0 HG3 ARG A 43 25.463 5.986 -0.964 1.00 10.00 H new ATOM 0 HD2 ARG A 43 27.363 6.600 0.661 1.00 10.00 H new ATOM 0 HD3 ARG A 43 28.473 5.862 -0.477 1.00 10.00 H new ATOM 0 HE ARG A 43 27.192 8.460 -0.713 1.00 10.00 H new ATOM 0 HH11 ARG A 43 28.519 5.784 -2.622 1.00 10.00 H new ATOM 0 HH12 ARG A 43 28.852 6.801 -4.028 1.00 10.00 H new ATOM 0 HH21 ARG A 43 27.618 9.765 -2.524 1.00 10.00 H new ATOM 0 HH22 ARG A 43 28.341 9.058 -3.973 1.00 10.00 H new ATOM 597 N ASP A 44 23.573 2.912 -2.121 1.00 10.00 N ATOM 598 CA ASP A 44 22.201 3.105 -2.552 1.00 10.00 C ATOM 599 C ASP A 44 21.382 1.938 -2.026 1.00 10.00 C ATOM 600 O ASP A 44 21.922 0.907 -1.631 1.00 10.00 O ATOM 601 CB ASP A 44 22.089 3.337 -4.066 1.00 10.00 C ATOM 602 CG ASP A 44 21.805 2.085 -4.888 1.00 10.00 C ATOM 603 OD1 ASP A 44 20.648 1.615 -4.825 1.00 10.00 O ATOM 604 OD2 ASP A 44 22.725 1.667 -5.618 1.00 10.00 O ATOM 0 H ASP A 44 24.101 2.262 -2.704 1.00 10.00 H new ATOM 0 HA ASP A 44 21.792 4.024 -2.132 1.00 10.00 H new ATOM 0 HB2 ASP A 44 21.296 4.062 -4.250 1.00 10.00 H new ATOM 0 HB3 ASP A 44 23.018 3.783 -4.420 1.00 10.00 H new ATOM 609 N THR A 45 20.079 2.149 -1.929 1.00 10.00 N ATOM 610 CA THR A 45 19.140 1.176 -1.428 1.00 10.00 C ATOM 611 C THR A 45 17.766 1.683 -1.833 1.00 10.00 C ATOM 612 O THR A 45 17.662 2.719 -2.493 1.00 10.00 O ATOM 613 CB THR A 45 19.296 1.020 0.093 1.00 10.00 C ATOM 614 OG1 THR A 45 18.408 0.038 0.592 1.00 10.00 O ATOM 615 CG2 THR A 45 19.073 2.335 0.847 1.00 10.00 C ATOM 0 H THR A 45 19.640 3.027 -2.206 1.00 10.00 H new ATOM 0 HA THR A 45 19.306 0.181 -1.840 1.00 10.00 H new ATOM 0 HB THR A 45 20.326 0.707 0.264 1.00 10.00 H new ATOM 0 HG1 THR A 45 18.727 -0.280 1.462 1.00 10.00 H new ATOM 0 HG21 THR A 45 19.195 2.166 1.917 1.00 10.00 H new ATOM 0 HG22 THR A 45 19.799 3.075 0.511 1.00 10.00 H new ATOM 0 HG23 THR A 45 18.065 2.701 0.650 1.00 10.00 H new ATOM 623 N ALA A 46 16.715 0.994 -1.401 1.00 10.00 N ATOM 624 CA ALA A 46 15.355 1.433 -1.612 1.00 10.00 C ATOM 625 C ALA A 46 14.464 0.845 -0.532 1.00 10.00 C ATOM 626 O ALA A 46 14.882 -0.053 0.208 1.00 10.00 O ATOM 627 CB ALA A 46 14.880 1.033 -3.014 1.00 10.00 C ATOM 0 H ALA A 46 16.791 0.113 -0.893 1.00 10.00 H new ATOM 0 HA ALA A 46 15.304 2.520 -1.547 1.00 10.00 H new ATOM 0 HB1 ALA A 46 13.854 1.370 -3.160 1.00 10.00 H new ATOM 0 HB2 ALA A 46 15.524 1.496 -3.762 1.00 10.00 H new ATOM 0 HB3 ALA A 46 14.924 -0.051 -3.118 1.00 10.00 H new ATOM 633 N ALA A 47 13.230 1.349 -0.470 1.00 10.00 N ATOM 634 CA ALA A 47 12.193 0.717 0.318 1.00 10.00 C ATOM 635 C ALA A 47 11.589 -0.422 -0.504 1.00 10.00 C ATOM 636 O ALA A 47 11.761 -0.471 -1.723 1.00 10.00 O ATOM 637 CB ALA A 47 11.150 1.744 0.768 1.00 10.00 C ATOM 0 H ALA A 47 12.933 2.193 -0.959 1.00 10.00 H new ATOM 0 HA ALA A 47 12.611 0.296 1.233 1.00 10.00 H new ATOM 0 HB1 ALA A 47 10.381 1.246 1.358 1.00 10.00 H new ATOM 0 HB2 ALA A 47 11.633 2.511 1.373 1.00 10.00 H new ATOM 0 HB3 ALA A 47 10.693 2.206 -0.107 1.00 10.00 H new ATOM 643 N TYR A 48 10.912 -1.348 0.172 1.00 10.00 N ATOM 644 CA TYR A 48 10.200 -2.466 -0.419 1.00 10.00 C ATOM 645 C TYR A 48 8.819 -2.464 0.231 1.00 10.00 C ATOM 646 O TYR A 48 8.697 -2.733 1.428 1.00 10.00 O ATOM 647 CB TYR A 48 10.966 -3.772 -0.195 1.00 10.00 C ATOM 648 CG TYR A 48 12.227 -3.915 -1.035 1.00 10.00 C ATOM 649 CD1 TYR A 48 13.354 -3.107 -0.790 1.00 10.00 C ATOM 650 CD2 TYR A 48 12.267 -4.858 -2.082 1.00 10.00 C ATOM 651 CE1 TYR A 48 14.497 -3.227 -1.597 1.00 10.00 C ATOM 652 CE2 TYR A 48 13.451 -5.052 -2.814 1.00 10.00 C ATOM 653 CZ TYR A 48 14.576 -4.256 -2.546 1.00 10.00 C ATOM 654 OH TYR A 48 15.767 -4.527 -3.148 1.00 10.00 O ATOM 0 H TYR A 48 10.845 -1.334 1.190 1.00 10.00 H new ATOM 0 HA TYR A 48 10.105 -2.376 -1.501 1.00 10.00 H new ATOM 0 HB2 TYR A 48 11.236 -3.844 0.859 1.00 10.00 H new ATOM 0 HB3 TYR A 48 10.303 -4.609 -0.412 1.00 10.00 H new ATOM 0 HD1 TYR A 48 13.339 -2.393 0.020 1.00 10.00 H new ATOM 0 HD2 TYR A 48 11.385 -5.433 -2.322 1.00 10.00 H new ATOM 0 HE1 TYR A 48 15.313 -2.528 -1.487 1.00 10.00 H new ATOM 0 HE2 TYR A 48 13.495 -5.811 -3.581 1.00 10.00 H new ATOM 0 HH TYR A 48 15.653 -5.268 -3.779 1.00 10.00 H new ATOM 664 N MET A 49 7.819 -2.011 -0.527 1.00 10.00 N ATOM 665 CA MET A 49 6.468 -1.714 -0.077 1.00 10.00 C ATOM 666 C MET A 49 5.506 -1.656 -1.271 1.00 10.00 C ATOM 667 O MET A 49 5.850 -2.065 -2.378 1.00 10.00 O ATOM 668 CB MET A 49 6.463 -0.451 0.791 1.00 10.00 C ATOM 669 CG MET A 49 5.514 -0.550 1.992 1.00 10.00 C ATOM 670 SD MET A 49 6.069 -1.434 3.485 1.00 10.00 S ATOM 671 CE MET A 49 5.797 -3.181 3.110 1.00 10.00 C ATOM 0 H MET A 49 7.942 -1.834 -1.524 1.00 10.00 H new ATOM 0 HA MET A 49 6.103 -2.519 0.561 1.00 10.00 H new ATOM 0 HB2 MET A 49 7.474 -0.260 1.150 1.00 10.00 H new ATOM 0 HB3 MET A 49 6.175 0.403 0.178 1.00 10.00 H new ATOM 0 HG2 MET A 49 5.252 0.465 2.289 1.00 10.00 H new ATOM 0 HG3 MET A 49 4.597 -1.028 1.648 1.00 10.00 H new ATOM 0 HE1 MET A 49 5.514 -3.709 4.021 1.00 10.00 H new ATOM 0 HE2 MET A 49 4.999 -3.275 2.373 1.00 10.00 H new ATOM 0 HE3 MET A 49 6.714 -3.614 2.710 1.00 10.00 H new ATOM 681 N THR A 50 4.263 -1.219 -1.062 1.00 10.00 N ATOM 682 CA THR A 50 3.248 -1.128 -2.096 1.00 10.00 C ATOM 683 C THR A 50 2.275 -0.011 -1.708 1.00 10.00 C ATOM 684 O THR A 50 1.789 0.001 -0.577 1.00 10.00 O ATOM 685 CB THR A 50 2.575 -2.506 -2.207 1.00 10.00 C ATOM 686 OG1 THR A 50 3.447 -3.407 -2.861 1.00 10.00 O ATOM 687 CG2 THR A 50 1.250 -2.479 -2.962 1.00 10.00 C ATOM 0 H THR A 50 3.933 -0.913 -0.146 1.00 10.00 H new ATOM 0 HA THR A 50 3.658 -0.877 -3.074 1.00 10.00 H new ATOM 0 HB THR A 50 2.361 -2.825 -1.187 1.00 10.00 H new ATOM 0 HG1 THR A 50 4.343 -3.013 -2.916 1.00 10.00 H new ATOM 0 HG21 THR A 50 0.833 -3.485 -3.001 1.00 10.00 H new ATOM 0 HG22 THR A 50 0.552 -1.817 -2.449 1.00 10.00 H new ATOM 0 HG23 THR A 50 1.416 -2.116 -3.976 1.00 10.00 H new ATOM 695 N LEU A 51 1.992 0.920 -2.625 1.00 10.00 N ATOM 696 CA LEU A 51 0.894 1.865 -2.481 1.00 10.00 C ATOM 697 C LEU A 51 -0.354 1.175 -2.996 1.00 10.00 C ATOM 698 O LEU A 51 -0.307 0.531 -4.042 1.00 10.00 O ATOM 699 CB LEU A 51 1.108 3.136 -3.308 1.00 10.00 C ATOM 700 CG LEU A 51 2.031 4.187 -2.680 1.00 10.00 C ATOM 701 CD1 LEU A 51 1.602 4.619 -1.273 1.00 10.00 C ATOM 702 CD2 LEU A 51 3.503 3.762 -2.695 1.00 10.00 C ATOM 0 H LEU A 51 2.523 1.035 -3.488 1.00 10.00 H new ATOM 0 HA LEU A 51 0.818 2.158 -1.434 1.00 10.00 H new ATOM 0 HB2 LEU A 51 1.517 2.852 -4.278 1.00 10.00 H new ATOM 0 HB3 LEU A 51 0.137 3.595 -3.493 1.00 10.00 H new ATOM 0 HG LEU A 51 1.930 5.063 -3.321 1.00 10.00 H new ATOM 0 HD11 LEU A 51 2.301 5.364 -0.892 1.00 10.00 H new ATOM 0 HD12 LEU A 51 0.601 5.048 -1.314 1.00 10.00 H new ATOM 0 HD13 LEU A 51 1.599 3.753 -0.612 1.00 10.00 H new ATOM 0 HD21 LEU A 51 4.112 4.543 -2.239 1.00 10.00 H new ATOM 0 HD22 LEU A 51 3.620 2.835 -2.133 1.00 10.00 H new ATOM 0 HD23 LEU A 51 3.826 3.605 -3.724 1.00 10.00 H new ATOM 714 N THR A 52 -1.449 1.309 -2.248 1.00 10.00 N ATOM 715 CA THR A 52 -2.656 0.527 -2.433 1.00 10.00 C ATOM 716 C THR A 52 -3.863 1.443 -2.646 1.00 10.00 C ATOM 717 O THR A 52 -4.410 1.974 -1.679 1.00 10.00 O ATOM 718 CB THR A 52 -2.825 -0.373 -1.200 1.00 10.00 C ATOM 719 OG1 THR A 52 -1.672 -1.174 -1.032 1.00 10.00 O ATOM 720 CG2 THR A 52 -4.035 -1.304 -1.322 1.00 10.00 C ATOM 0 H THR A 52 -1.516 1.980 -1.483 1.00 10.00 H new ATOM 0 HA THR A 52 -2.581 -0.095 -3.325 1.00 10.00 H new ATOM 0 HB THR A 52 -2.977 0.286 -0.345 1.00 10.00 H new ATOM 0 HG1 THR A 52 -1.783 -1.745 -0.244 1.00 10.00 H new ATOM 0 HG21 THR A 52 -4.112 -1.920 -0.426 1.00 10.00 H new ATOM 0 HG22 THR A 52 -4.942 -0.709 -1.433 1.00 10.00 H new ATOM 0 HG23 THR A 52 -3.914 -1.946 -2.194 1.00 10.00 H new ATOM 728 N ASN A 53 -4.334 1.557 -3.891 1.00 10.00 N ATOM 729 CA ASN A 53 -5.629 2.175 -4.164 1.00 10.00 C ATOM 730 C ASN A 53 -6.747 1.186 -3.851 1.00 10.00 C ATOM 731 O ASN A 53 -6.923 0.190 -4.547 1.00 10.00 O ATOM 732 CB ASN A 53 -5.759 2.601 -5.634 1.00 10.00 C ATOM 733 CG ASN A 53 -5.729 4.112 -5.816 1.00 10.00 C ATOM 734 OD1 ASN A 53 -6.776 4.748 -5.934 1.00 10.00 O ATOM 735 ND2 ASN A 53 -4.537 4.689 -5.869 1.00 10.00 N ATOM 0 H ASN A 53 -3.839 1.230 -4.721 1.00 10.00 H new ATOM 0 HA ASN A 53 -5.706 3.061 -3.534 1.00 10.00 H new ATOM 0 HB2 ASN A 53 -4.948 2.154 -6.210 1.00 10.00 H new ATOM 0 HB3 ASN A 53 -6.692 2.209 -6.040 1.00 10.00 H new ATOM 0 HD21 ASN A 53 -4.464 5.696 -6.012 1.00 10.00 H new ATOM 0 HD22 ASN A 53 -3.693 4.126 -5.767 1.00 10.00 H new ATOM 742 N LYS A 54 -7.537 1.500 -2.824 1.00 10.00 N ATOM 743 CA LYS A 54 -8.813 0.863 -2.547 1.00 10.00 C ATOM 744 C LYS A 54 -9.799 1.984 -2.208 1.00 10.00 C ATOM 745 O LYS A 54 -10.220 2.137 -1.065 1.00 10.00 O ATOM 746 CB LYS A 54 -8.610 -0.196 -1.455 1.00 10.00 C ATOM 747 CG LYS A 54 -9.924 -0.743 -0.882 1.00 10.00 C ATOM 748 CD LYS A 54 -9.800 -2.193 -0.396 1.00 10.00 C ATOM 749 CE LYS A 54 -8.783 -2.326 0.747 1.00 10.00 C ATOM 750 NZ LYS A 54 -8.692 -3.715 1.244 1.00 10.00 N ATOM 0 H LYS A 54 -7.296 2.224 -2.147 1.00 10.00 H new ATOM 0 HA LYS A 54 -9.230 0.316 -3.392 1.00 10.00 H new ATOM 0 HB2 LYS A 54 -8.029 -1.023 -1.865 1.00 10.00 H new ATOM 0 HB3 LYS A 54 -8.022 0.236 -0.646 1.00 10.00 H new ATOM 0 HG2 LYS A 54 -10.244 -0.112 -0.053 1.00 10.00 H new ATOM 0 HG3 LYS A 54 -10.700 -0.685 -1.645 1.00 10.00 H new ATOM 0 HD2 LYS A 54 -10.774 -2.548 -0.059 1.00 10.00 H new ATOM 0 HD3 LYS A 54 -9.498 -2.830 -1.227 1.00 10.00 H new ATOM 0 HE2 LYS A 54 -7.803 -1.999 0.401 1.00 10.00 H new ATOM 0 HE3 LYS A 54 -9.068 -1.665 1.566 1.00 10.00 H new ATOM 0 HZ1 LYS A 54 -7.995 -3.763 2.015 1.00 10.00 H new ATOM 0 HZ2 LYS A 54 -9.622 -4.019 1.598 1.00 10.00 H new ATOM 0 HZ3 LYS A 54 -8.395 -4.342 0.469 1.00 10.00 H new ATOM 764 N SER A 55 -10.122 2.786 -3.227 1.00 10.00 N ATOM 765 CA SER A 55 -11.019 3.941 -3.146 1.00 10.00 C ATOM 766 C SER A 55 -11.194 4.612 -4.512 1.00 10.00 C ATOM 767 O SER A 55 -12.266 5.149 -4.775 1.00 10.00 O ATOM 768 CB SER A 55 -10.499 4.996 -2.161 1.00 10.00 C ATOM 769 OG SER A 55 -11.521 5.907 -1.806 1.00 10.00 O ATOM 0 H SER A 55 -9.751 2.642 -4.166 1.00 10.00 H new ATOM 0 HA SER A 55 -11.977 3.555 -2.797 1.00 10.00 H new ATOM 0 HB2 SER A 55 -10.117 4.505 -1.266 1.00 10.00 H new ATOM 0 HB3 SER A 55 -9.665 5.536 -2.609 1.00 10.00 H new ATOM 0 HG SER A 55 -11.803 6.408 -2.600 1.00 10.00 H new ATOM 775 N ASP A 56 -10.132 4.630 -5.334 1.00 10.00 N ATOM 776 CA ASP A 56 -10.020 5.358 -6.591 1.00 10.00 C ATOM 777 C ASP A 56 -9.871 6.858 -6.375 1.00 10.00 C ATOM 778 O ASP A 56 -10.817 7.623 -6.568 1.00 10.00 O ATOM 779 CB ASP A 56 -11.124 4.993 -7.598 1.00 10.00 C ATOM 780 CG ASP A 56 -10.865 3.672 -8.286 1.00 10.00 C ATOM 781 OD1 ASP A 56 -9.707 3.206 -8.257 1.00 10.00 O ATOM 782 OD2 ASP A 56 -11.792 3.184 -8.972 1.00 10.00 O ATOM 0 H ASP A 56 -9.285 4.104 -5.119 1.00 10.00 H new ATOM 0 HA ASP A 56 -9.092 5.028 -7.057 1.00 10.00 H new ATOM 0 HB2 ASP A 56 -12.083 4.948 -7.081 1.00 10.00 H new ATOM 0 HB3 ASP A 56 -11.203 5.780 -8.348 1.00 10.00 H new ATOM 787 N GLN A 57 -8.657 7.286 -6.013 1.00 10.00 N ATOM 788 CA GLN A 57 -8.273 8.688 -6.008 1.00 10.00 C ATOM 789 C GLN A 57 -6.808 8.829 -6.455 1.00 10.00 C ATOM 790 O GLN A 57 -6.005 7.950 -6.144 1.00 10.00 O ATOM 791 CB GLN A 57 -8.419 9.284 -4.605 1.00 10.00 C ATOM 792 CG GLN A 57 -9.853 9.580 -4.142 1.00 10.00 C ATOM 793 CD GLN A 57 -10.468 8.445 -3.329 1.00 10.00 C ATOM 794 OE1 GLN A 57 -11.417 7.719 -3.902 1.00 10.00 O flip ATOM 795 NE2 GLN A 57 -10.102 8.222 -2.176 1.00 10.00 N flip ATOM 0 H GLN A 57 -7.912 6.657 -5.714 1.00 10.00 H new ATOM 0 HA GLN A 57 -8.928 9.223 -6.696 1.00 10.00 H new ATOM 0 HB2 GLN A 57 -7.963 8.597 -3.892 1.00 10.00 H new ATOM 0 HB3 GLN A 57 -7.847 10.211 -4.565 1.00 10.00 H new ATOM 0 HG2 GLN A 57 -9.854 10.490 -3.542 1.00 10.00 H new ATOM 0 HG3 GLN A 57 -10.477 9.773 -5.015 1.00 10.00 H new ATOM 0 HE21 GLN A 57 -9.370 8.793 -1.754 1.00 10.00 H new ATOM 0 HE22 GLN A 57 -10.531 7.466 -1.642 1.00 10.00 H new ATOM 804 N PRO A 58 -6.445 9.925 -7.147 1.00 10.00 N ATOM 805 CA PRO A 58 -5.069 10.235 -7.508 1.00 10.00 C ATOM 806 C PRO A 58 -4.360 10.997 -6.375 1.00 10.00 C ATOM 807 O PRO A 58 -4.720 12.141 -6.111 1.00 10.00 O ATOM 808 CB PRO A 58 -5.192 11.105 -8.763 1.00 10.00 C ATOM 809 CG PRO A 58 -6.496 11.874 -8.540 1.00 10.00 C ATOM 810 CD PRO A 58 -7.359 10.885 -7.752 1.00 10.00 C ATOM 0 HA PRO A 58 -4.474 9.339 -7.682 1.00 10.00 H new ATOM 0 HB2 PRO A 58 -4.342 11.779 -8.869 1.00 10.00 H new ATOM 0 HB3 PRO A 58 -5.233 10.499 -9.668 1.00 10.00 H new ATOM 0 HG2 PRO A 58 -6.329 12.795 -7.982 1.00 10.00 H new ATOM 0 HG3 PRO A 58 -6.964 12.153 -9.484 1.00 10.00 H new ATOM 0 HD2 PRO A 58 -7.940 11.401 -6.988 1.00 10.00 H new ATOM 0 HD3 PRO A 58 -8.070 10.383 -8.408 1.00 10.00 H new ATOM 818 N ILE A 59 -3.364 10.393 -5.709 1.00 10.00 N ATOM 819 CA ILE A 59 -2.602 11.033 -4.624 1.00 10.00 C ATOM 820 C ILE A 59 -1.109 10.995 -4.979 1.00 10.00 C ATOM 821 O ILE A 59 -0.446 9.980 -4.782 1.00 10.00 O ATOM 822 CB ILE A 59 -2.896 10.373 -3.251 1.00 10.00 C ATOM 823 CG1 ILE A 59 -4.250 10.772 -2.628 1.00 10.00 C ATOM 824 CG2 ILE A 59 -1.859 10.782 -2.187 1.00 10.00 C ATOM 825 CD1 ILE A 59 -5.497 10.420 -3.435 1.00 10.00 C ATOM 0 H ILE A 59 -3.062 9.440 -5.909 1.00 10.00 H new ATOM 0 HA ILE A 59 -2.914 12.073 -4.526 1.00 10.00 H new ATOM 0 HB ILE A 59 -2.879 9.309 -3.486 1.00 10.00 H new ATOM 0 HG12 ILE A 59 -4.330 10.297 -1.650 1.00 10.00 H new ATOM 0 HG13 ILE A 59 -4.245 11.849 -2.459 1.00 10.00 H new ATOM 0 HG21 ILE A 59 -2.100 10.299 -1.240 1.00 10.00 H new ATOM 0 HG22 ILE A 59 -0.865 10.472 -2.510 1.00 10.00 H new ATOM 0 HG23 ILE A 59 -1.878 11.864 -2.058 1.00 10.00 H new ATOM 0 HD11 ILE A 59 -6.385 10.750 -2.895 1.00 10.00 H new ATOM 0 HD12 ILE A 59 -5.456 10.917 -4.404 1.00 10.00 H new ATOM 0 HD13 ILE A 59 -5.542 9.341 -3.583 1.00 10.00 H new ATOM 837 N LYS A 60 -0.551 12.095 -5.489 1.00 10.00 N ATOM 838 CA LYS A 60 0.822 12.122 -5.978 1.00 10.00 C ATOM 839 C LYS A 60 1.817 12.327 -4.825 1.00 10.00 C ATOM 840 O LYS A 60 1.966 13.433 -4.296 1.00 10.00 O ATOM 841 CB LYS A 60 0.944 13.118 -7.144 1.00 10.00 C ATOM 842 CG LYS A 60 0.829 14.610 -6.806 1.00 10.00 C ATOM 843 CD LYS A 60 0.603 15.447 -8.085 1.00 10.00 C ATOM 844 CE LYS A 60 -0.472 16.529 -7.897 1.00 10.00 C ATOM 845 NZ LYS A 60 -1.816 15.950 -7.700 1.00 10.00 N ATOM 0 H LYS A 60 -1.039 12.987 -5.573 1.00 10.00 H new ATOM 0 HA LYS A 60 1.095 11.153 -6.395 1.00 10.00 H new ATOM 0 HB2 LYS A 60 1.907 12.955 -7.629 1.00 10.00 H new ATOM 0 HB3 LYS A 60 0.173 12.877 -7.876 1.00 10.00 H new ATOM 0 HG2 LYS A 60 0.003 14.768 -6.112 1.00 10.00 H new ATOM 0 HG3 LYS A 60 1.736 14.944 -6.303 1.00 10.00 H new ATOM 0 HD2 LYS A 60 1.541 15.918 -8.378 1.00 10.00 H new ATOM 0 HD3 LYS A 60 0.310 14.786 -8.901 1.00 10.00 H new ATOM 0 HE2 LYS A 60 -0.215 17.149 -7.038 1.00 10.00 H new ATOM 0 HE3 LYS A 60 -0.484 17.183 -8.769 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 -2.355 16.542 -7.036 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 -2.314 15.911 -8.612 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 -1.727 14.989 -7.313 1.00 10.00 H new ATOM 859 N LEU A 61 2.494 11.242 -4.426 1.00 10.00 N ATOM 860 CA LEU A 61 3.419 11.235 -3.300 1.00 10.00 C ATOM 861 C LEU A 61 4.790 11.755 -3.739 1.00 10.00 C ATOM 862 O LEU A 61 5.333 11.276 -4.729 1.00 10.00 O ATOM 863 CB LEU A 61 3.363 9.902 -2.527 1.00 10.00 C ATOM 864 CG LEU A 61 4.257 8.720 -2.932 1.00 10.00 C ATOM 865 CD1 LEU A 61 4.063 8.267 -4.384 1.00 10.00 C ATOM 866 CD2 LEU A 61 5.724 8.972 -2.567 1.00 10.00 C ATOM 0 H LEU A 61 2.409 10.336 -4.887 1.00 10.00 H new ATOM 0 HA LEU A 61 3.111 11.948 -2.535 1.00 10.00 H new ATOM 0 HB2 LEU A 61 3.583 10.127 -1.484 1.00 10.00 H new ATOM 0 HB3 LEU A 61 2.332 9.552 -2.567 1.00 10.00 H new ATOM 0 HG LEU A 61 3.925 7.868 -2.338 1.00 10.00 H new ATOM 0 HD11 LEU A 61 4.728 7.429 -4.596 1.00 10.00 H new ATOM 0 HD12 LEU A 61 3.029 7.956 -4.533 1.00 10.00 H new ATOM 0 HD13 LEU A 61 4.294 9.093 -5.057 1.00 10.00 H new ATOM 0 HD21 LEU A 61 6.326 8.115 -2.868 1.00 10.00 H new ATOM 0 HD22 LEU A 61 6.079 9.864 -3.083 1.00 10.00 H new ATOM 0 HD23 LEU A 61 5.811 9.116 -1.490 1.00 10.00 H new ATOM 878 N VAL A 62 5.328 12.784 -3.069 1.00 10.00 N ATOM 879 CA VAL A 62 6.611 13.378 -3.435 1.00 10.00 C ATOM 880 C VAL A 62 7.363 13.795 -2.171 1.00 10.00 C ATOM 881 O VAL A 62 7.800 14.934 -2.016 1.00 10.00 O ATOM 882 CB VAL A 62 6.398 14.518 -4.448 1.00 10.00 C ATOM 883 CG1 VAL A 62 5.565 15.695 -3.928 1.00 10.00 C ATOM 884 CG2 VAL A 62 7.710 14.986 -5.086 1.00 10.00 C ATOM 0 H VAL A 62 4.884 13.223 -2.262 1.00 10.00 H new ATOM 0 HA VAL A 62 7.243 12.648 -3.940 1.00 10.00 H new ATOM 0 HB VAL A 62 5.789 14.068 -5.232 1.00 10.00 H new ATOM 0 HG11 VAL A 62 5.469 16.447 -4.711 1.00 10.00 H new ATOM 0 HG12 VAL A 62 4.575 15.341 -3.642 1.00 10.00 H new ATOM 0 HG13 VAL A 62 6.058 16.135 -3.061 1.00 10.00 H new ATOM 0 HG21 VAL A 62 7.505 15.791 -5.792 1.00 10.00 H new ATOM 0 HG22 VAL A 62 8.383 15.348 -4.309 1.00 10.00 H new ATOM 0 HG23 VAL A 62 8.177 14.153 -5.611 1.00 10.00 H new ATOM 894 N GLY A 63 7.550 12.845 -1.255 1.00 10.00 N ATOM 895 CA GLY A 63 8.437 13.042 -0.131 1.00 10.00 C ATOM 896 C GLY A 63 8.826 11.699 0.458 1.00 10.00 C ATOM 897 O GLY A 63 8.003 10.787 0.510 1.00 10.00 O ATOM 0 H GLY A 63 7.094 11.933 -1.278 1.00 10.00 H new ATOM 0 HA2 GLY A 63 9.329 13.582 -0.450 1.00 10.00 H new ATOM 0 HA3 GLY A 63 7.948 13.654 0.627 1.00 10.00 H new ATOM 901 N ALA A 64 10.069 11.613 0.924 1.00 10.00 N ATOM 902 CA ALA A 64 10.595 10.548 1.759 1.00 10.00 C ATOM 903 C ALA A 64 11.794 11.118 2.517 1.00 10.00 C ATOM 904 O ALA A 64 12.938 10.745 2.272 1.00 10.00 O ATOM 905 CB ALA A 64 10.971 9.342 0.898 1.00 10.00 C ATOM 0 H ALA A 64 10.770 12.324 0.716 1.00 10.00 H new ATOM 0 HA ALA A 64 9.852 10.195 2.474 1.00 10.00 H new ATOM 0 HB1 ALA A 64 11.364 8.549 1.534 1.00 10.00 H new ATOM 0 HB2 ALA A 64 10.087 8.981 0.372 1.00 10.00 H new ATOM 0 HB3 ALA A 64 11.730 9.635 0.173 1.00 10.00 H new ATOM 911 N ALA A 65 11.526 12.067 3.414 1.00 10.00 N ATOM 912 CA ALA A 65 12.543 12.757 4.190 1.00 10.00 C ATOM 913 C ALA A 65 12.903 11.876 5.380 1.00 10.00 C ATOM 914 O ALA A 65 12.072 11.097 5.848 1.00 10.00 O ATOM 915 CB ALA A 65 12.006 14.113 4.652 1.00 10.00 C ATOM 0 H ALA A 65 10.577 12.380 3.622 1.00 10.00 H new ATOM 0 HA ALA A 65 13.434 12.939 3.589 1.00 10.00 H new ATOM 0 HB1 ALA A 65 12.771 14.628 5.234 1.00 10.00 H new ATOM 0 HB2 ALA A 65 11.744 14.716 3.783 1.00 10.00 H new ATOM 0 HB3 ALA A 65 11.120 13.962 5.269 1.00 10.00 H new ATOM 921 N THR A 66 14.154 11.944 5.837 1.00 10.00 N ATOM 922 CA THR A 66 14.695 10.933 6.726 1.00 10.00 C ATOM 923 C THR A 66 16.049 11.391 7.272 1.00 10.00 C ATOM 924 O THR A 66 16.763 12.122 6.584 1.00 10.00 O ATOM 925 CB THR A 66 14.833 9.617 5.938 1.00 10.00 C ATOM 926 OG1 THR A 66 15.564 8.667 6.684 1.00 10.00 O ATOM 927 CG2 THR A 66 15.529 9.792 4.585 1.00 10.00 C ATOM 0 H THR A 66 14.807 12.692 5.602 1.00 10.00 H new ATOM 0 HA THR A 66 14.030 10.776 7.575 1.00 10.00 H new ATOM 0 HB THR A 66 13.814 9.275 5.757 1.00 10.00 H new ATOM 0 HG1 THR A 66 15.354 7.766 6.362 1.00 10.00 H new ATOM 0 HG21 THR A 66 15.594 8.827 4.082 1.00 10.00 H new ATOM 0 HG22 THR A 66 14.957 10.485 3.968 1.00 10.00 H new ATOM 0 HG23 THR A 66 16.532 10.188 4.741 1.00 10.00 H new ATOM 935 N PRO A 67 16.440 10.943 8.476 1.00 10.00 N ATOM 936 CA PRO A 67 17.799 11.092 8.968 1.00 10.00 C ATOM 937 C PRO A 67 18.754 10.055 8.349 1.00 10.00 C ATOM 938 O PRO A 67 19.938 10.068 8.681 1.00 10.00 O ATOM 939 CB PRO A 67 17.679 10.897 10.481 1.00 10.00 C ATOM 940 CG PRO A 67 16.561 9.861 10.593 1.00 10.00 C ATOM 941 CD PRO A 67 15.612 10.257 9.460 1.00 10.00 C ATOM 0 HA PRO A 67 18.221 12.061 8.702 1.00 10.00 H new ATOM 0 HB2 PRO A 67 18.610 10.538 10.919 1.00 10.00 H new ATOM 0 HB3 PRO A 67 17.424 11.826 10.991 1.00 10.00 H new ATOM 0 HG2 PRO A 67 16.937 8.846 10.468 1.00 10.00 H new ATOM 0 HG3 PRO A 67 16.069 9.901 11.565 1.00 10.00 H new ATOM 0 HD2 PRO A 67 15.133 9.380 9.026 1.00 10.00 H new ATOM 0 HD3 PRO A 67 14.817 10.907 9.824 1.00 10.00 H new ATOM 949 N LEU A 68 18.263 9.148 7.489 1.00 10.00 N ATOM 950 CA LEU A 68 18.954 7.920 7.097 1.00 10.00 C ATOM 951 C LEU A 68 19.555 7.982 5.685 1.00 10.00 C ATOM 952 O LEU A 68 20.629 7.428 5.435 1.00 10.00 O ATOM 953 CB LEU A 68 17.929 6.783 7.201 1.00 10.00 C ATOM 954 CG LEU A 68 18.543 5.385 7.345 1.00 10.00 C ATOM 955 CD1 LEU A 68 19.365 5.256 8.636 1.00 10.00 C ATOM 956 CD2 LEU A 68 17.408 4.354 7.355 1.00 10.00 C ATOM 0 H LEU A 68 17.354 9.255 7.040 1.00 10.00 H new ATOM 0 HA LEU A 68 19.805 7.762 7.760 1.00 10.00 H new ATOM 0 HB2 LEU A 68 17.281 6.972 8.057 1.00 10.00 H new ATOM 0 HB3 LEU A 68 17.296 6.799 6.313 1.00 10.00 H new ATOM 0 HG LEU A 68 19.217 5.212 6.506 1.00 10.00 H new ATOM 0 HD11 LEU A 68 19.784 4.252 8.702 1.00 10.00 H new ATOM 0 HD12 LEU A 68 20.174 5.986 8.627 1.00 10.00 H new ATOM 0 HD13 LEU A 68 18.722 5.438 9.497 1.00 10.00 H new ATOM 0 HD21 LEU A 68 17.827 3.353 7.457 1.00 10.00 H new ATOM 0 HD22 LEU A 68 16.741 4.555 8.193 1.00 10.00 H new ATOM 0 HD23 LEU A 68 16.848 4.420 6.422 1.00 10.00 H new ATOM 968 N ALA A 69 18.861 8.656 4.762 1.00 10.00 N ATOM 969 CA ALA A 69 19.268 8.810 3.370 1.00 10.00 C ATOM 970 C ALA A 69 19.807 10.218 3.141 1.00 10.00 C ATOM 971 O ALA A 69 19.112 11.194 3.415 1.00 10.00 O ATOM 972 CB ALA A 69 18.069 8.571 2.452 1.00 10.00 C ATOM 0 H ALA A 69 17.978 9.120 4.973 1.00 10.00 H new ATOM 0 HA ALA A 69 20.048 8.083 3.146 1.00 10.00 H new ATOM 0 HB1 ALA A 69 18.377 8.687 1.413 1.00 10.00 H new ATOM 0 HB2 ALA A 69 17.688 7.562 2.607 1.00 10.00 H new ATOM 0 HB3 ALA A 69 17.286 9.294 2.681 1.00 10.00 H new ATOM 978 N THR A 70 21.035 10.334 2.638 1.00 10.00 N ATOM 979 CA THR A 70 21.625 11.601 2.223 1.00 10.00 C ATOM 980 C THR A 70 20.958 12.096 0.938 1.00 10.00 C ATOM 981 O THR A 70 20.869 13.300 0.713 1.00 10.00 O ATOM 982 CB THR A 70 23.142 11.415 2.050 1.00 10.00 C ATOM 983 OG1 THR A 70 23.592 10.440 2.977 1.00 10.00 O ATOM 984 CG2 THR A 70 23.901 12.721 2.294 1.00 10.00 C ATOM 0 H THR A 70 21.656 9.536 2.506 1.00 10.00 H new ATOM 0 HA THR A 70 21.459 12.362 2.985 1.00 10.00 H new ATOM 0 HB THR A 70 23.334 11.097 1.025 1.00 10.00 H new ATOM 0 HG1 THR A 70 24.572 10.437 2.999 1.00 10.00 H new ATOM 0 HG21 THR A 70 24.970 12.551 2.163 1.00 10.00 H new ATOM 0 HG22 THR A 70 23.564 13.476 1.584 1.00 10.00 H new ATOM 0 HG23 THR A 70 23.711 13.068 3.310 1.00 10.00 H new ATOM 992 N SER A 71 20.489 11.157 0.111 1.00 10.00 N ATOM 993 CA SER A 71 20.019 11.397 -1.240 1.00 10.00 C ATOM 994 C SER A 71 18.705 10.640 -1.480 1.00 10.00 C ATOM 995 O SER A 71 18.696 9.685 -2.254 1.00 10.00 O ATOM 996 CB SER A 71 21.120 10.918 -2.196 1.00 10.00 C ATOM 997 OG SER A 71 22.361 11.519 -1.865 1.00 10.00 O ATOM 0 H SER A 71 20.428 10.176 0.382 1.00 10.00 H new ATOM 0 HA SER A 71 19.817 12.455 -1.406 1.00 10.00 H new ATOM 0 HB2 SER A 71 21.209 9.833 -2.143 1.00 10.00 H new ATOM 0 HB3 SER A 71 20.851 11.166 -3.223 1.00 10.00 H new ATOM 0 HG SER A 71 23.053 11.202 -2.482 1.00 10.00 H new ATOM 1003 N PRO A 72 17.598 11.032 -0.829 1.00 10.00 N ATOM 1004 CA PRO A 72 16.300 10.420 -1.053 1.00 10.00 C ATOM 1005 C PRO A 72 15.702 10.909 -2.371 1.00 10.00 C ATOM 1006 O PRO A 72 15.403 12.095 -2.508 1.00 10.00 O ATOM 1007 CB PRO A 72 15.449 10.833 0.151 1.00 10.00 C ATOM 1008 CG PRO A 72 16.032 12.192 0.545 1.00 10.00 C ATOM 1009 CD PRO A 72 17.518 12.056 0.202 1.00 10.00 C ATOM 0 HA PRO A 72 16.357 9.335 -1.137 1.00 10.00 H new ATOM 0 HB2 PRO A 72 14.393 10.909 -0.110 1.00 10.00 H new ATOM 0 HB3 PRO A 72 15.526 10.111 0.964 1.00 10.00 H new ATOM 0 HG2 PRO A 72 15.565 13.005 -0.010 1.00 10.00 H new ATOM 0 HG3 PRO A 72 15.882 12.401 1.604 1.00 10.00 H new ATOM 0 HD2 PRO A 72 17.924 13.002 -0.155 1.00 10.00 H new ATOM 0 HD3 PRO A 72 18.097 11.772 1.081 1.00 10.00 H new ATOM 1017 N MET A 73 15.515 10.003 -3.336 1.00 10.00 N ATOM 1018 CA MET A 73 14.978 10.345 -4.648 1.00 10.00 C ATOM 1019 C MET A 73 13.990 9.284 -5.135 1.00 10.00 C ATOM 1020 O MET A 73 14.213 8.091 -4.952 1.00 10.00 O ATOM 1021 CB MET A 73 16.138 10.502 -5.637 1.00 10.00 C ATOM 1022 CG MET A 73 16.812 11.879 -5.537 1.00 10.00 C ATOM 1023 SD MET A 73 18.315 11.949 -4.532 1.00 10.00 S ATOM 1024 CE MET A 73 18.655 13.721 -4.592 1.00 10.00 C ATOM 0 H MET A 73 15.733 9.013 -3.225 1.00 10.00 H new ATOM 0 HA MET A 73 14.432 11.286 -4.575 1.00 10.00 H new ATOM 0 HB2 MET A 73 16.878 9.724 -5.451 1.00 10.00 H new ATOM 0 HB3 MET A 73 15.769 10.354 -6.652 1.00 10.00 H new ATOM 0 HG2 MET A 73 17.055 12.218 -6.544 1.00 10.00 H new ATOM 0 HG3 MET A 73 16.091 12.587 -5.128 1.00 10.00 H new ATOM 0 HE1 MET A 73 19.556 13.938 -4.018 1.00 10.00 H new ATOM 0 HE2 MET A 73 18.801 14.029 -5.627 1.00 10.00 H new ATOM 0 HE3 MET A 73 17.813 14.268 -4.167 1.00 10.00 H new ATOM 1034 N LEU A 74 12.901 9.725 -5.767 1.00 10.00 N ATOM 1035 CA LEU A 74 11.847 8.871 -6.302 1.00 10.00 C ATOM 1036 C LEU A 74 12.247 8.361 -7.692 1.00 10.00 C ATOM 1037 O LEU A 74 12.941 9.054 -8.436 1.00 10.00 O ATOM 1038 CB LEU A 74 10.546 9.698 -6.328 1.00 10.00 C ATOM 1039 CG LEU A 74 9.928 9.734 -4.920 1.00 10.00 C ATOM 1040 CD1 LEU A 74 9.162 11.034 -4.693 1.00 10.00 C ATOM 1041 CD2 LEU A 74 8.968 8.551 -4.751 1.00 10.00 C ATOM 0 H LEU A 74 12.726 10.718 -5.924 1.00 10.00 H new ATOM 0 HA LEU A 74 11.691 7.989 -5.681 1.00 10.00 H new ATOM 0 HB2 LEU A 74 10.755 10.712 -6.670 1.00 10.00 H new ATOM 0 HB3 LEU A 74 9.840 9.262 -7.035 1.00 10.00 H new ATOM 0 HG LEU A 74 10.735 9.671 -4.190 1.00 10.00 H new ATOM 0 HD11 LEU A 74 8.735 11.034 -3.690 1.00 10.00 H new ATOM 0 HD12 LEU A 74 9.841 11.880 -4.798 1.00 10.00 H new ATOM 0 HD13 LEU A 74 8.362 11.118 -5.428 1.00 10.00 H new ATOM 0 HD21 LEU A 74 8.530 8.577 -3.753 1.00 10.00 H new ATOM 0 HD22 LEU A 74 8.175 8.616 -5.496 1.00 10.00 H new ATOM 0 HD23 LEU A 74 9.514 7.617 -4.883 1.00 10.00 H new ATOM 1053 N MET A 75 11.844 7.129 -8.021 1.00 10.00 N ATOM 1054 CA MET A 75 12.194 6.421 -9.245 1.00 10.00 C ATOM 1055 C MET A 75 11.018 5.572 -9.704 1.00 10.00 C ATOM 1056 O MET A 75 10.122 5.296 -8.913 1.00 10.00 O ATOM 1057 CB MET A 75 13.344 5.443 -8.962 1.00 10.00 C ATOM 1058 CG MET A 75 14.329 5.377 -10.130 1.00 10.00 C ATOM 1059 SD MET A 75 16.048 5.848 -9.837 1.00 10.00 S ATOM 1060 CE MET A 75 15.888 7.274 -8.737 1.00 10.00 C ATOM 0 H MET A 75 11.239 6.579 -7.411 1.00 10.00 H new ATOM 0 HA MET A 75 12.470 7.159 -9.998 1.00 10.00 H new ATOM 0 HB2 MET A 75 13.870 5.751 -8.059 1.00 10.00 H new ATOM 0 HB3 MET A 75 12.938 4.449 -8.771 1.00 10.00 H new ATOM 0 HG2 MET A 75 14.326 4.355 -10.509 1.00 10.00 H new ATOM 0 HG3 MET A 75 13.942 6.013 -10.926 1.00 10.00 H new ATOM 0 HE1 MET A 75 16.819 7.841 -8.739 1.00 10.00 H new ATOM 0 HE2 MET A 75 15.074 7.911 -9.083 1.00 10.00 H new ATOM 0 HE3 MET A 75 15.675 6.931 -7.725 1.00 10.00 H new ATOM 1070 N THR A 76 11.088 5.028 -10.922 1.00 10.00 N ATOM 1071 CA THR A 76 10.195 3.945 -11.316 1.00 10.00 C ATOM 1072 C THR A 76 10.906 2.975 -12.254 1.00 10.00 C ATOM 1073 O THR A 76 11.893 3.336 -12.881 1.00 10.00 O ATOM 1074 CB THR A 76 8.906 4.522 -11.917 1.00 10.00 C ATOM 1075 OG1 THR A 76 8.051 3.480 -12.346 1.00 10.00 O ATOM 1076 CG2 THR A 76 9.217 5.488 -13.068 1.00 10.00 C ATOM 0 H THR A 76 11.748 5.319 -11.643 1.00 10.00 H new ATOM 0 HA THR A 76 9.910 3.368 -10.436 1.00 10.00 H new ATOM 0 HB THR A 76 8.392 5.089 -11.141 1.00 10.00 H new ATOM 0 HG1 THR A 76 8.463 3.008 -13.099 1.00 10.00 H new ATOM 0 HG21 THR A 76 8.285 5.881 -13.475 1.00 10.00 H new ATOM 0 HG22 THR A 76 9.827 6.311 -12.697 1.00 10.00 H new ATOM 0 HG23 THR A 76 9.760 4.958 -13.851 1.00 10.00 H new ATOM 1084 N THR A 77 10.439 1.729 -12.352 1.00 10.00 N ATOM 1085 CA THR A 77 10.942 0.763 -13.327 1.00 10.00 C ATOM 1086 C THR A 77 9.862 -0.285 -13.602 1.00 10.00 C ATOM 1087 O THR A 77 10.034 -1.467 -13.324 1.00 10.00 O ATOM 1088 CB THR A 77 12.264 0.127 -12.863 1.00 10.00 C ATOM 1089 OG1 THR A 77 13.009 1.022 -12.068 1.00 10.00 O ATOM 1090 CG2 THR A 77 13.109 -0.329 -14.056 1.00 10.00 C ATOM 0 H THR A 77 9.699 1.361 -11.755 1.00 10.00 H new ATOM 0 HA THR A 77 11.168 1.280 -14.260 1.00 10.00 H new ATOM 0 HB THR A 77 12.007 -0.745 -12.262 1.00 10.00 H new ATOM 0 HG1 THR A 77 12.936 1.927 -12.438 1.00 10.00 H new ATOM 0 HG21 THR A 77 14.037 -0.774 -13.696 1.00 10.00 H new ATOM 0 HG22 THR A 77 12.553 -1.067 -14.635 1.00 10.00 H new ATOM 0 HG23 THR A 77 13.340 0.529 -14.688 1.00 10.00 H new ATOM 1098 N THR A 78 8.718 0.157 -14.114 1.00 10.00 N ATOM 1099 CA THR A 78 7.574 -0.709 -14.354 1.00 10.00 C ATOM 1100 C THR A 78 6.708 -0.104 -15.455 1.00 10.00 C ATOM 1101 O THR A 78 6.497 1.104 -15.487 1.00 10.00 O ATOM 1102 CB THR A 78 6.789 -0.936 -13.048 1.00 10.00 C ATOM 1103 OG1 THR A 78 5.578 -1.625 -13.307 1.00 10.00 O ATOM 1104 CG2 THR A 78 6.450 0.376 -12.337 1.00 10.00 C ATOM 0 H THR A 78 8.560 1.130 -14.375 1.00 10.00 H new ATOM 0 HA THR A 78 7.911 -1.689 -14.692 1.00 10.00 H new ATOM 0 HB THR A 78 7.436 -1.528 -12.401 1.00 10.00 H new ATOM 0 HG1 THR A 78 5.093 -1.762 -12.466 1.00 10.00 H new ATOM 0 HG21 THR A 78 5.897 0.162 -11.422 1.00 10.00 H new ATOM 0 HG22 THR A 78 7.371 0.904 -12.089 1.00 10.00 H new ATOM 0 HG23 THR A 78 5.840 0.998 -12.992 1.00 10.00 H new ATOM 1112 N HIS A 79 6.217 -0.955 -16.356 1.00 10.00 N ATOM 1113 CA HIS A 79 5.227 -0.580 -17.355 1.00 10.00 C ATOM 1114 C HIS A 79 3.846 -0.586 -16.700 1.00 10.00 C ATOM 1115 O HIS A 79 3.013 0.269 -16.981 1.00 10.00 O ATOM 1116 CB HIS A 79 5.282 -1.562 -18.532 1.00 10.00 C ATOM 1117 CG HIS A 79 6.550 -1.474 -19.345 1.00 10.00 C ATOM 1118 ND1 HIS A 79 6.633 -0.959 -20.639 1.00 10.00 N ATOM 1119 CD2 HIS A 79 7.787 -1.902 -18.950 1.00 10.00 C ATOM 1120 CE1 HIS A 79 7.918 -1.089 -20.996 1.00 10.00 C ATOM 1121 NE2 HIS A 79 8.633 -1.653 -20.006 1.00 10.00 N ATOM 0 H HIS A 79 6.501 -1.933 -16.410 1.00 10.00 H new ATOM 0 HA HIS A 79 5.435 0.418 -17.740 1.00 10.00 H new ATOM 0 HB2 HIS A 79 5.177 -2.577 -18.150 1.00 10.00 H new ATOM 0 HB3 HIS A 79 4.430 -1.378 -19.186 1.00 10.00 H new ATOM 0 HD2 HIS A 79 8.047 -2.346 -18.001 1.00 10.00 H new ATOM 0 HE1 HIS A 79 8.324 -0.783 -21.949 1.00 10.00 H new ATOM 0 HE2 HIS A 79 9.631 -1.861 -20.033 1.00 10.00 H new ATOM 1129 N SER A 80 3.606 -1.569 -15.828 1.00 10.00 N ATOM 1130 CA SER A 80 2.366 -1.741 -15.095 1.00 10.00 C ATOM 1131 C SER A 80 2.091 -0.553 -14.171 1.00 10.00 C ATOM 1132 O SER A 80 0.957 -0.092 -14.080 1.00 10.00 O ATOM 1133 CB SER A 80 2.474 -3.041 -14.292 1.00 10.00 C ATOM 1134 OG SER A 80 3.165 -4.014 -15.058 1.00 10.00 O ATOM 0 H SER A 80 4.298 -2.287 -15.611 1.00 10.00 H new ATOM 0 HA SER A 80 1.530 -1.793 -15.793 1.00 10.00 H new ATOM 0 HB2 SER A 80 3.000 -2.859 -13.355 1.00 10.00 H new ATOM 0 HB3 SER A 80 1.480 -3.405 -14.034 1.00 10.00 H new ATOM 0 HG SER A 80 3.236 -4.845 -14.544 1.00 10.00 H new ATOM 1140 N GLY A 81 3.122 -0.108 -13.445 1.00 10.00 N ATOM 1141 CA GLY A 81 3.013 0.999 -12.508 1.00 10.00 C ATOM 1142 C GLY A 81 3.333 2.330 -13.190 1.00 10.00 C ATOM 1143 O GLY A 81 2.739 2.670 -14.207 1.00 10.00 O ATOM 0 H GLY A 81 4.057 -0.512 -13.496 1.00 10.00 H new ATOM 0 HA2 GLY A 81 2.005 1.032 -12.094 1.00 10.00 H new ATOM 0 HA3 GLY A 81 3.695 0.841 -11.673 1.00 10.00 H new ATOM 1147 N GLY A 82 4.268 3.090 -12.610 1.00 10.00 N ATOM 1148 CA GLY A 82 4.615 4.431 -13.058 1.00 10.00 C ATOM 1149 C GLY A 82 5.179 4.484 -14.482 1.00 10.00 C ATOM 1150 O GLY A 82 4.512 4.962 -15.397 1.00 10.00 O ATOM 0 H GLY A 82 4.810 2.780 -11.804 1.00 10.00 H new ATOM 0 HA2 GLY A 82 3.728 5.062 -13.006 1.00 10.00 H new ATOM 0 HA3 GLY A 82 5.348 4.854 -12.371 1.00 10.00 H new ATOM 1154 N MET A 83 6.438 4.070 -14.659 1.00 10.00 N ATOM 1155 CA MET A 83 7.147 4.145 -15.937 1.00 10.00 C ATOM 1156 C MET A 83 8.386 3.240 -15.903 1.00 10.00 C ATOM 1157 O MET A 83 8.881 2.886 -14.831 1.00 10.00 O ATOM 1158 CB MET A 83 7.518 5.612 -16.246 1.00 10.00 C ATOM 1159 CG MET A 83 6.958 6.089 -17.593 1.00 10.00 C ATOM 1160 SD MET A 83 7.672 5.357 -19.090 1.00 10.00 S ATOM 1161 CE MET A 83 9.359 6.001 -19.019 1.00 10.00 C ATOM 0 H MET A 83 6.999 3.668 -13.908 1.00 10.00 H new ATOM 0 HA MET A 83 6.499 3.789 -16.738 1.00 10.00 H new ATOM 0 HB2 MET A 83 7.139 6.254 -15.451 1.00 10.00 H new ATOM 0 HB3 MET A 83 8.603 5.716 -16.250 1.00 10.00 H new ATOM 0 HG2 MET A 83 5.885 5.896 -17.601 1.00 10.00 H new ATOM 0 HG3 MET A 83 7.088 7.170 -17.650 1.00 10.00 H new ATOM 0 HE1 MET A 83 9.876 5.772 -19.951 1.00 10.00 H new ATOM 0 HE2 MET A 83 9.330 7.081 -18.876 1.00 10.00 H new ATOM 0 HE3 MET A 83 9.890 5.539 -18.187 1.00 10.00 H new ATOM 1171 N ALA A 84 8.934 2.874 -17.063 1.00 10.00 N ATOM 1172 CA ALA A 84 10.086 1.993 -17.175 1.00 10.00 C ATOM 1173 C ALA A 84 11.339 2.860 -17.104 1.00 10.00 C ATOM 1174 O ALA A 84 12.160 2.859 -18.018 1.00 10.00 O ATOM 1175 CB ALA A 84 9.986 1.216 -18.491 1.00 10.00 C ATOM 0 H ALA A 84 8.579 3.191 -17.965 1.00 10.00 H new ATOM 0 HA ALA A 84 10.125 1.262 -16.368 1.00 10.00 H new ATOM 0 HB1 ALA A 84 10.844 0.551 -18.587 1.00 10.00 H new ATOM 0 HB2 ALA A 84 9.069 0.627 -18.497 1.00 10.00 H new ATOM 0 HB3 ALA A 84 9.974 1.916 -19.327 1.00 10.00 H new ATOM 1181 N GLY A 85 11.429 3.668 -16.045 1.00 10.00 N ATOM 1182 CA GLY A 85 12.246 4.869 -16.044 1.00 10.00 C ATOM 1183 C GLY A 85 13.090 4.984 -14.778 1.00 10.00 C ATOM 1184 O GLY A 85 12.798 5.832 -13.933 1.00 10.00 O ATOM 0 H GLY A 85 10.935 3.502 -15.168 1.00 10.00 H new ATOM 0 HA2 GLY A 85 12.900 4.864 -16.916 1.00 10.00 H new ATOM 0 HA3 GLY A 85 11.603 5.745 -16.132 1.00 10.00 H new ATOM 1188 N MET A 86 14.122 4.141 -14.626 1.00 10.00 N ATOM 1189 CA MET A 86 14.891 4.050 -13.381 1.00 10.00 C ATOM 1190 C MET A 86 15.902 5.199 -13.297 1.00 10.00 C ATOM 1191 O MET A 86 17.114 5.001 -13.306 1.00 10.00 O ATOM 1192 CB MET A 86 15.519 2.657 -13.231 1.00 10.00 C ATOM 1193 CG MET A 86 15.790 2.152 -11.801 1.00 10.00 C ATOM 1194 SD MET A 86 17.204 2.820 -10.871 1.00 10.00 S ATOM 1195 CE MET A 86 17.743 1.342 -9.979 1.00 10.00 C ATOM 0 H MET A 86 14.444 3.508 -15.358 1.00 10.00 H new ATOM 0 HA MET A 86 14.224 4.167 -12.527 1.00 10.00 H new ATOM 0 HB2 MET A 86 14.865 1.938 -13.724 1.00 10.00 H new ATOM 0 HB3 MET A 86 16.464 2.653 -13.774 1.00 10.00 H new ATOM 0 HG2 MET A 86 14.893 2.341 -11.212 1.00 10.00 H new ATOM 0 HG3 MET A 86 15.915 1.070 -11.854 1.00 10.00 H new ATOM 0 HE1 MET A 86 18.607 1.585 -9.360 1.00 10.00 H new ATOM 0 HE2 MET A 86 16.932 0.983 -9.345 1.00 10.00 H new ATOM 0 HE3 MET A 86 18.016 0.565 -10.693 1.00 10.00 H new ATOM 1205 N LYS A 87 15.366 6.412 -13.226 1.00 10.00 N ATOM 1206 CA LYS A 87 16.075 7.680 -13.189 1.00 10.00 C ATOM 1207 C LYS A 87 15.443 8.581 -12.127 1.00 10.00 C ATOM 1208 O LYS A 87 14.359 8.292 -11.623 1.00 10.00 O ATOM 1209 CB LYS A 87 16.026 8.322 -14.584 1.00 10.00 C ATOM 1210 CG LYS A 87 14.605 8.771 -14.966 1.00 10.00 C ATOM 1211 CD LYS A 87 14.427 8.957 -16.476 1.00 10.00 C ATOM 1212 CE LYS A 87 15.339 10.065 -17.028 1.00 10.00 C ATOM 1213 NZ LYS A 87 15.110 10.313 -18.467 1.00 10.00 N ATOM 0 H LYS A 87 14.355 6.541 -13.190 1.00 10.00 H new ATOM 0 HA LYS A 87 17.121 7.529 -12.921 1.00 10.00 H new ATOM 0 HB2 LYS A 87 16.696 9.181 -14.611 1.00 10.00 H new ATOM 0 HB3 LYS A 87 16.391 7.609 -15.323 1.00 10.00 H new ATOM 0 HG2 LYS A 87 13.887 8.033 -14.608 1.00 10.00 H new ATOM 0 HG3 LYS A 87 14.377 9.709 -14.460 1.00 10.00 H new ATOM 0 HD2 LYS A 87 14.646 8.019 -16.986 1.00 10.00 H new ATOM 0 HD3 LYS A 87 13.387 9.202 -16.692 1.00 10.00 H new ATOM 0 HE2 LYS A 87 15.167 10.986 -16.471 1.00 10.00 H new ATOM 0 HE3 LYS A 87 16.381 9.787 -16.871 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 15.747 11.067 -18.795 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 15.299 9.443 -19.004 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 14.123 10.604 -18.616 1.00 10.00 H new ATOM 1227 N MET A 88 16.096 9.702 -11.825 1.00 10.00 N ATOM 1228 CA MET A 88 15.706 10.593 -10.740 1.00 10.00 C ATOM 1229 C MET A 88 14.563 11.488 -11.213 1.00 10.00 C ATOM 1230 O MET A 88 14.744 12.674 -11.480 1.00 10.00 O ATOM 1231 CB MET A 88 16.937 11.400 -10.302 1.00 10.00 C ATOM 1232 CG MET A 88 17.981 10.488 -9.645 1.00 10.00 C ATOM 1233 SD MET A 88 19.678 11.125 -9.619 1.00 10.00 S ATOM 1234 CE MET A 88 19.475 12.640 -8.659 1.00 10.00 C ATOM 0 H MET A 88 16.921 10.019 -12.335 1.00 10.00 H new ATOM 0 HA MET A 88 15.346 10.032 -9.877 1.00 10.00 H new ATOM 0 HB2 MET A 88 17.376 11.900 -11.166 1.00 10.00 H new ATOM 0 HB3 MET A 88 16.636 12.179 -9.602 1.00 10.00 H new ATOM 0 HG2 MET A 88 17.671 10.292 -8.619 1.00 10.00 H new ATOM 0 HG3 MET A 88 17.980 9.531 -10.167 1.00 10.00 H new ATOM 0 HE1 MET A 88 20.435 13.149 -8.576 1.00 10.00 H new ATOM 0 HE2 MET A 88 18.760 13.294 -9.158 1.00 10.00 H new ATOM 0 HE3 MET A 88 19.108 12.393 -7.663 1.00 10.00 H new ATOM 1244 N VAL A 89 13.380 10.889 -11.344 1.00 10.00 N ATOM 1245 CA VAL A 89 12.174 11.609 -11.714 1.00 10.00 C ATOM 1246 C VAL A 89 11.724 12.524 -10.564 1.00 10.00 C ATOM 1247 O VAL A 89 12.069 12.263 -9.412 1.00 10.00 O ATOM 1248 CB VAL A 89 11.057 10.622 -12.121 1.00 10.00 C ATOM 1249 CG1 VAL A 89 11.460 9.810 -13.357 1.00 10.00 C ATOM 1250 CG2 VAL A 89 10.667 9.658 -10.993 1.00 10.00 C ATOM 0 H VAL A 89 13.236 9.890 -11.195 1.00 10.00 H new ATOM 0 HA VAL A 89 12.390 12.238 -12.577 1.00 10.00 H new ATOM 0 HB VAL A 89 10.188 11.239 -12.349 1.00 10.00 H new ATOM 0 HG11 VAL A 89 10.655 9.124 -13.620 1.00 10.00 H new ATOM 0 HG12 VAL A 89 11.648 10.486 -14.191 1.00 10.00 H new ATOM 0 HG13 VAL A 89 12.364 9.242 -13.140 1.00 10.00 H new ATOM 0 HG21 VAL A 89 9.878 8.991 -11.341 1.00 10.00 H new ATOM 0 HG22 VAL A 89 11.537 9.070 -10.700 1.00 10.00 H new ATOM 0 HG23 VAL A 89 10.308 10.227 -10.136 1.00 10.00 H new ATOM 1260 N PRO A 90 10.917 13.564 -10.848 1.00 10.00 N ATOM 1261 CA PRO A 90 10.157 14.291 -9.835 1.00 10.00 C ATOM 1262 C PRO A 90 9.474 13.345 -8.841 1.00 10.00 C ATOM 1263 O PRO A 90 9.672 13.498 -7.639 1.00 10.00 O ATOM 1264 CB PRO A 90 9.201 15.215 -10.598 1.00 10.00 C ATOM 1265 CG PRO A 90 9.206 14.685 -12.034 1.00 10.00 C ATOM 1266 CD PRO A 90 10.590 14.065 -12.174 1.00 10.00 C ATOM 0 HA PRO A 90 10.803 14.894 -9.196 1.00 10.00 H new ATOM 0 HB2 PRO A 90 8.199 15.188 -10.170 1.00 10.00 H new ATOM 0 HB3 PRO A 90 9.537 16.251 -10.558 1.00 10.00 H new ATOM 0 HG2 PRO A 90 8.418 13.949 -12.194 1.00 10.00 H new ATOM 0 HG3 PRO A 90 9.048 15.484 -12.758 1.00 10.00 H new ATOM 0 HD2 PRO A 90 10.589 13.261 -12.910 1.00 10.00 H new ATOM 0 HD3 PRO A 90 11.320 14.802 -12.508 1.00 10.00 H new ATOM 1274 N TRP A 91 8.695 12.376 -9.338 1.00 10.00 N ATOM 1275 CA TRP A 91 7.880 11.436 -8.586 1.00 10.00 C ATOM 1276 C TRP A 91 7.053 10.606 -9.563 1.00 10.00 C ATOM 1277 O TRP A 91 7.386 10.550 -10.747 1.00 10.00 O ATOM 1278 CB TRP A 91 6.951 12.166 -7.617 1.00 10.00 C ATOM 1279 CG TRP A 91 5.806 12.954 -8.164 1.00 10.00 C ATOM 1280 CD1 TRP A 91 4.734 13.242 -7.413 1.00 10.00 C ATOM 1281 CD2 TRP A 91 5.627 13.711 -9.401 1.00 10.00 C ATOM 1282 NE1 TRP A 91 4.095 14.337 -7.941 1.00 10.00 N ATOM 1283 CE2 TRP A 91 4.641 14.701 -9.151 1.00 10.00 C ATOM 1284 CE3 TRP A 91 6.179 13.698 -10.698 1.00 10.00 C ATOM 1285 CZ2 TRP A 91 4.394 15.746 -10.043 1.00 10.00 C ATOM 1286 CZ3 TRP A 91 5.827 14.663 -11.661 1.00 10.00 C ATOM 1287 CH2 TRP A 91 4.987 15.730 -11.312 1.00 10.00 C ATOM 0 H TRP A 91 8.618 12.225 -10.344 1.00 10.00 H new ATOM 0 HA TRP A 91 8.536 10.790 -8.003 1.00 10.00 H new ATOM 0 HB2 TRP A 91 6.542 11.424 -6.932 1.00 10.00 H new ATOM 0 HB3 TRP A 91 7.563 12.845 -7.023 1.00 10.00 H new ATOM 0 HD1 TRP A 91 4.422 12.699 -6.533 1.00 10.00 H new ATOM 0 HE1 TRP A 91 3.315 14.819 -7.494 1.00 10.00 H new ATOM 0 HE3 TRP A 91 6.890 12.928 -10.960 1.00 10.00 H new ATOM 0 HZ2 TRP A 91 3.749 16.563 -9.756 1.00 10.00 H new ATOM 0 HZ3 TRP A 91 6.204 14.581 -12.670 1.00 10.00 H new ATOM 0 HH2 TRP A 91 4.799 16.530 -12.013 1.00 10.00 H new ATOM 1298 N LEU A 92 5.946 10.041 -9.073 1.00 10.00 N ATOM 1299 CA LEU A 92 4.869 9.478 -9.859 1.00 10.00 C ATOM 1300 C LEU A 92 3.575 10.101 -9.338 1.00 10.00 C ATOM 1301 O LEU A 92 3.404 10.257 -8.129 1.00 10.00 O ATOM 1302 CB LEU A 92 4.803 7.954 -9.679 1.00 10.00 C ATOM 1303 CG LEU A 92 5.978 7.155 -10.264 1.00 10.00 C ATOM 1304 CD1 LEU A 92 6.147 7.419 -11.764 1.00 10.00 C ATOM 1305 CD2 LEU A 92 7.297 7.368 -9.508 1.00 10.00 C ATOM 0 H LEU A 92 5.778 9.965 -8.070 1.00 10.00 H new ATOM 0 HA LEU A 92 5.023 9.685 -10.918 1.00 10.00 H new ATOM 0 HB2 LEU A 92 4.737 7.737 -8.613 1.00 10.00 H new ATOM 0 HB3 LEU A 92 3.881 7.594 -10.136 1.00 10.00 H new ATOM 0 HG LEU A 92 5.719 6.105 -10.130 1.00 10.00 H new ATOM 0 HD11 LEU A 92 6.987 6.837 -12.143 1.00 10.00 H new ATOM 0 HD12 LEU A 92 5.237 7.128 -12.289 1.00 10.00 H new ATOM 0 HD13 LEU A 92 6.337 8.480 -11.928 1.00 10.00 H new ATOM 0 HD21 LEU A 92 8.083 6.775 -9.974 1.00 10.00 H new ATOM 0 HD22 LEU A 92 7.570 8.423 -9.542 1.00 10.00 H new ATOM 0 HD23 LEU A 92 7.176 7.058 -8.470 1.00 10.00 H new ATOM 1317 N THR A 93 2.658 10.438 -10.245 1.00 10.00 N ATOM 1318 CA THR A 93 1.273 10.707 -9.898 1.00 10.00 C ATOM 1319 C THR A 93 0.547 9.369 -9.953 1.00 10.00 C ATOM 1320 O THR A 93 0.218 8.904 -11.041 1.00 10.00 O ATOM 1321 CB THR A 93 0.697 11.748 -10.871 1.00 10.00 C ATOM 1322 OG1 THR A 93 1.381 12.969 -10.666 1.00 10.00 O ATOM 1323 CG2 THR A 93 -0.804 11.991 -10.680 1.00 10.00 C ATOM 0 H THR A 93 2.860 10.531 -11.240 1.00 10.00 H new ATOM 0 HA THR A 93 1.161 11.131 -8.900 1.00 10.00 H new ATOM 0 HB THR A 93 0.833 11.362 -11.881 1.00 10.00 H new ATOM 0 HG1 THR A 93 1.029 13.648 -11.279 1.00 10.00 H new ATOM 0 HG21 THR A 93 -1.146 12.736 -11.398 1.00 10.00 H new ATOM 0 HG22 THR A 93 -1.346 11.059 -10.838 1.00 10.00 H new ATOM 0 HG23 THR A 93 -0.988 12.351 -9.668 1.00 10.00 H new ATOM 1331 N ILE A 94 0.318 8.734 -8.799 1.00 10.00 N ATOM 1332 CA ILE A 94 -0.330 7.434 -8.769 1.00 10.00 C ATOM 1333 C ILE A 94 -1.838 7.708 -8.857 1.00 10.00 C ATOM 1334 O ILE A 94 -2.340 8.521 -8.078 1.00 10.00 O ATOM 1335 CB ILE A 94 0.122 6.618 -7.538 1.00 10.00 C ATOM 1336 CG1 ILE A 94 -0.444 7.109 -6.198 1.00 10.00 C ATOM 1337 CG2 ILE A 94 1.655 6.649 -7.439 1.00 10.00 C ATOM 1338 CD1 ILE A 94 -1.734 6.394 -5.800 1.00 10.00 C ATOM 0 H ILE A 94 0.573 9.102 -7.883 1.00 10.00 H new ATOM 0 HA ILE A 94 -0.046 6.798 -9.608 1.00 10.00 H new ATOM 0 HB ILE A 94 -0.267 5.613 -7.700 1.00 10.00 H new ATOM 0 HG12 ILE A 94 0.303 6.961 -5.418 1.00 10.00 H new ATOM 0 HG13 ILE A 94 -0.633 8.181 -6.260 1.00 10.00 H new ATOM 0 HG21 ILE A 94 1.975 6.073 -6.571 1.00 10.00 H new ATOM 0 HG22 ILE A 94 2.087 6.215 -8.341 1.00 10.00 H new ATOM 0 HG23 ILE A 94 1.992 7.680 -7.335 1.00 10.00 H new ATOM 0 HD11 ILE A 94 -2.086 6.783 -4.845 1.00 10.00 H new ATOM 0 HD12 ILE A 94 -2.494 6.563 -6.563 1.00 10.00 H new ATOM 0 HD13 ILE A 94 -1.544 5.325 -5.708 1.00 10.00 H new ATOM 1350 N PRO A 95 -2.547 7.149 -9.849 1.00 10.00 N ATOM 1351 CA PRO A 95 -3.917 7.540 -10.150 1.00 10.00 C ATOM 1352 C PRO A 95 -4.927 6.803 -9.262 1.00 10.00 C ATOM 1353 O PRO A 95 -4.559 6.043 -8.368 1.00 10.00 O ATOM 1354 CB PRO A 95 -4.095 7.179 -11.630 1.00 10.00 C ATOM 1355 CG PRO A 95 -3.206 5.948 -11.795 1.00 10.00 C ATOM 1356 CD PRO A 95 -2.022 6.276 -10.890 1.00 10.00 C ATOM 0 HA PRO A 95 -4.096 8.598 -9.957 1.00 10.00 H new ATOM 0 HB2 PRO A 95 -5.136 6.960 -11.869 1.00 10.00 H new ATOM 0 HB3 PRO A 95 -3.782 7.993 -12.284 1.00 10.00 H new ATOM 0 HG2 PRO A 95 -3.714 5.035 -11.484 1.00 10.00 H new ATOM 0 HG3 PRO A 95 -2.898 5.805 -12.831 1.00 10.00 H new ATOM 0 HD2 PRO A 95 -1.595 5.369 -10.461 1.00 10.00 H new ATOM 0 HD3 PRO A 95 -1.227 6.769 -11.450 1.00 10.00 H new ATOM 1364 N ALA A 96 -6.219 6.969 -9.565 1.00 10.00 N ATOM 1365 CA ALA A 96 -7.227 5.979 -9.204 1.00 10.00 C ATOM 1366 C ALA A 96 -6.759 4.589 -9.679 1.00 10.00 C ATOM 1367 O ALA A 96 -6.033 4.499 -10.668 1.00 10.00 O ATOM 1368 CB ALA A 96 -8.554 6.353 -9.866 1.00 10.00 C ATOM 0 H ALA A 96 -6.587 7.782 -10.060 1.00 10.00 H new ATOM 0 HA ALA A 96 -7.366 5.955 -8.123 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -9.313 5.617 -9.601 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -8.868 7.338 -9.521 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -8.428 6.370 -10.949 1.00 10.00 H new ATOM 1374 N ARG A 97 -7.123 3.502 -8.991 1.00 10.00 N ATOM 1375 CA ARG A 97 -6.514 2.172 -9.140 1.00 10.00 C ATOM 1376 C ARG A 97 -4.987 2.147 -9.019 1.00 10.00 C ATOM 1377 O ARG A 97 -4.384 1.096 -9.241 1.00 10.00 O ATOM 1378 CB ARG A 97 -6.924 1.454 -10.436 1.00 10.00 C ATOM 1379 CG ARG A 97 -8.439 1.361 -10.585 1.00 10.00 C ATOM 1380 CD ARG A 97 -8.950 2.487 -11.483 1.00 10.00 C ATOM 1381 NE ARG A 97 -10.366 2.729 -11.186 1.00 10.00 N ATOM 1382 CZ ARG A 97 -11.353 3.119 -12.000 1.00 10.00 C ATOM 1383 NH1 ARG A 97 -11.149 3.255 -13.314 1.00 10.00 N ATOM 1384 NH2 ARG A 97 -12.547 3.370 -11.461 1.00 10.00 N ATOM 0 H ARG A 97 -7.869 3.521 -8.296 1.00 10.00 H new ATOM 0 HA ARG A 97 -6.921 1.630 -8.287 1.00 10.00 H new ATOM 0 HB2 ARG A 97 -6.508 1.986 -11.292 1.00 10.00 H new ATOM 0 HB3 ARG A 97 -6.497 0.451 -10.445 1.00 10.00 H new ATOM 0 HG2 ARG A 97 -8.712 0.395 -11.010 1.00 10.00 H new ATOM 0 HG3 ARG A 97 -8.913 1.424 -9.605 1.00 10.00 H new ATOM 0 HD2 ARG A 97 -8.370 3.395 -11.316 1.00 10.00 H new ATOM 0 HD3 ARG A 97 -8.826 2.218 -12.532 1.00 10.00 H new ATOM 0 HE ARG A 97 -10.638 2.577 -10.215 1.00 10.00 H new ATOM 0 HH11 ARG A 97 -10.229 3.060 -13.710 1.00 10.00 H new ATOM 0 HH12 ARG A 97 -11.913 3.553 -13.921 1.00 10.00 H new ATOM 0 HH21 ARG A 97 -12.686 3.263 -10.456 1.00 10.00 H new ATOM 0 HH22 ARG A 97 -13.321 3.669 -12.054 1.00 10.00 H new ATOM 1398 N GLY A 98 -4.342 3.253 -8.645 1.00 10.00 N ATOM 1399 CA GLY A 98 -2.909 3.326 -8.492 1.00 10.00 C ATOM 1400 C GLY A 98 -2.460 2.405 -7.360 1.00 10.00 C ATOM 1401 O GLY A 98 -2.448 2.793 -6.191 1.00 10.00 O ATOM 0 H GLY A 98 -4.819 4.131 -8.439 1.00 10.00 H new ATOM 0 HA2 GLY A 98 -2.420 3.038 -9.423 1.00 10.00 H new ATOM 0 HA3 GLY A 98 -2.609 4.352 -8.279 1.00 10.00 H new ATOM 1405 N THR A 99 -2.149 1.164 -7.731 1.00 10.00 N ATOM 1406 CA THR A 99 -1.762 0.079 -6.849 1.00 10.00 C ATOM 1407 C THR A 99 -0.328 -0.296 -7.194 1.00 10.00 C ATOM 1408 O THR A 99 -0.060 -1.366 -7.739 1.00 10.00 O ATOM 1409 CB THR A 99 -2.756 -1.079 -7.018 1.00 10.00 C ATOM 1410 OG1 THR A 99 -4.074 -0.565 -6.992 1.00 10.00 O ATOM 1411 CG2 THR A 99 -2.623 -2.129 -5.912 1.00 10.00 C ATOM 0 H THR A 99 -2.163 0.879 -8.710 1.00 10.00 H new ATOM 0 HA THR A 99 -1.793 0.361 -5.796 1.00 10.00 H new ATOM 0 HB THR A 99 -2.535 -1.562 -7.970 1.00 10.00 H new ATOM 0 HG1 THR A 99 -4.254 -0.084 -7.827 1.00 10.00 H new ATOM 0 HG21 THR A 99 -3.348 -2.926 -6.078 1.00 10.00 H new ATOM 0 HG22 THR A 99 -1.616 -2.546 -5.925 1.00 10.00 H new ATOM 0 HG23 THR A 99 -2.810 -1.664 -4.944 1.00 10.00 H new ATOM 1419 N LEU A 100 0.584 0.645 -6.959 1.00 10.00 N ATOM 1420 CA LEU A 100 1.951 0.536 -7.426 1.00 10.00 C ATOM 1421 C LEU A 100 2.790 -0.187 -6.386 1.00 10.00 C ATOM 1422 O LEU A 100 2.457 -0.221 -5.205 1.00 10.00 O ATOM 1423 CB LEU A 100 2.506 1.913 -7.795 1.00 10.00 C ATOM 1424 CG LEU A 100 2.164 2.267 -9.249 1.00 10.00 C ATOM 1425 CD1 LEU A 100 0.659 2.306 -9.539 1.00 10.00 C ATOM 1426 CD2 LEU A 100 2.766 3.618 -9.640 1.00 10.00 C ATOM 0 H LEU A 100 0.390 1.501 -6.439 1.00 10.00 H new ATOM 0 HA LEU A 100 1.985 -0.059 -8.338 1.00 10.00 H new ATOM 0 HB2 LEU A 100 2.093 2.668 -7.126 1.00 10.00 H new ATOM 0 HB3 LEU A 100 3.587 1.923 -7.658 1.00 10.00 H new ATOM 0 HG LEU A 100 2.597 1.463 -9.845 1.00 10.00 H new ATOM 0 HD11 LEU A 100 0.497 2.563 -10.586 1.00 10.00 H new ATOM 0 HD12 LEU A 100 0.223 1.328 -9.333 1.00 10.00 H new ATOM 0 HD13 LEU A 100 0.185 3.055 -8.904 1.00 10.00 H new ATOM 0 HD21 LEU A 100 2.509 3.845 -10.675 1.00 10.00 H new ATOM 0 HD22 LEU A 100 2.368 4.396 -8.988 1.00 10.00 H new ATOM 0 HD23 LEU A 100 3.850 3.577 -9.536 1.00 10.00 H new ATOM 1438 N THR A 101 3.865 -0.809 -6.854 1.00 10.00 N ATOM 1439 CA THR A 101 4.656 -1.761 -6.106 1.00 10.00 C ATOM 1440 C THR A 101 6.051 -1.157 -6.007 1.00 10.00 C ATOM 1441 O THR A 101 6.752 -1.012 -7.006 1.00 10.00 O ATOM 1442 CB THR A 101 4.591 -3.145 -6.776 1.00 10.00 C ATOM 1443 OG1 THR A 101 4.695 -3.057 -8.186 1.00 10.00 O ATOM 1444 CG2 THR A 101 3.256 -3.827 -6.463 1.00 10.00 C ATOM 0 H THR A 101 4.217 -0.655 -7.799 1.00 10.00 H new ATOM 0 HA THR A 101 4.285 -1.938 -5.097 1.00 10.00 H new ATOM 0 HB THR A 101 5.430 -3.718 -6.381 1.00 10.00 H new ATOM 0 HG1 THR A 101 5.632 -3.162 -8.452 1.00 10.00 H new ATOM 0 HG21 THR A 101 3.225 -4.805 -6.944 1.00 10.00 H new ATOM 0 HG22 THR A 101 3.154 -3.950 -5.385 1.00 10.00 H new ATOM 0 HG23 THR A 101 2.437 -3.213 -6.837 1.00 10.00 H new ATOM 1452 N LEU A 102 6.401 -0.742 -4.795 1.00 10.00 N ATOM 1453 CA LEU A 102 7.612 -0.020 -4.466 1.00 10.00 C ATOM 1454 C LEU A 102 8.701 -1.077 -4.293 1.00 10.00 C ATOM 1455 O LEU A 102 8.692 -1.789 -3.294 1.00 10.00 O ATOM 1456 CB LEU A 102 7.300 0.793 -3.188 1.00 10.00 C ATOM 1457 CG LEU A 102 8.217 1.970 -2.846 1.00 10.00 C ATOM 1458 CD1 LEU A 102 7.694 2.671 -1.587 1.00 10.00 C ATOM 1459 CD2 LEU A 102 9.640 1.490 -2.581 1.00 10.00 C ATOM 0 H LEU A 102 5.814 -0.911 -3.978 1.00 10.00 H new ATOM 0 HA LEU A 102 7.957 0.686 -5.222 1.00 10.00 H new ATOM 0 HB2 LEU A 102 6.283 1.176 -3.275 1.00 10.00 H new ATOM 0 HB3 LEU A 102 7.310 0.105 -2.343 1.00 10.00 H new ATOM 0 HG LEU A 102 8.225 2.657 -3.692 1.00 10.00 H new ATOM 0 HD11 LEU A 102 8.345 3.510 -1.341 1.00 10.00 H new ATOM 0 HD12 LEU A 102 6.683 3.037 -1.768 1.00 10.00 H new ATOM 0 HD13 LEU A 102 7.681 1.965 -0.756 1.00 10.00 H new ATOM 0 HD21 LEU A 102 10.273 2.344 -2.340 1.00 10.00 H new ATOM 0 HD22 LEU A 102 9.639 0.792 -1.744 1.00 10.00 H new ATOM 0 HD23 LEU A 102 10.027 0.991 -3.469 1.00 10.00 H new ATOM 1471 N GLN A 103 9.590 -1.254 -5.277 1.00 10.00 N ATOM 1472 CA GLN A 103 10.534 -2.371 -5.279 1.00 10.00 C ATOM 1473 C GLN A 103 11.813 -2.016 -6.039 1.00 10.00 C ATOM 1474 O GLN A 103 11.857 -1.001 -6.729 1.00 10.00 O ATOM 1475 CB GLN A 103 9.842 -3.604 -5.884 1.00 10.00 C ATOM 1476 CG GLN A 103 9.705 -3.492 -7.409 1.00 10.00 C ATOM 1477 CD GLN A 103 8.460 -4.190 -7.938 1.00 10.00 C ATOM 1478 OE1 GLN A 103 7.393 -3.425 -8.129 1.00 10.00 O flip ATOM 1479 NE2 GLN A 103 8.452 -5.398 -8.153 1.00 10.00 N flip ATOM 0 H GLN A 103 9.673 -0.635 -6.083 1.00 10.00 H new ATOM 0 HA GLN A 103 10.833 -2.595 -4.255 1.00 10.00 H new ATOM 0 HB2 GLN A 103 10.412 -4.499 -5.635 1.00 10.00 H new ATOM 0 HB3 GLN A 103 8.854 -3.721 -5.438 1.00 10.00 H new ATOM 0 HG2 GLN A 103 9.674 -2.440 -7.691 1.00 10.00 H new ATOM 0 HG3 GLN A 103 10.587 -3.923 -7.882 1.00 10.00 H new ATOM 0 HE21 GLN A 103 9.295 -5.950 -7.993 1.00 10.00 H new ATOM 0 HE22 GLN A 103 7.603 -5.850 -8.492 1.00 10.00 H new ATOM 1488 N ARG A 104 12.832 -2.883 -5.948 1.00 10.00 N ATOM 1489 CA ARG A 104 14.130 -2.723 -6.616 1.00 10.00 C ATOM 1490 C ARG A 104 13.979 -2.093 -8.005 1.00 10.00 C ATOM 1491 O ARG A 104 14.685 -1.145 -8.346 1.00 10.00 O ATOM 1492 CB ARG A 104 14.843 -4.084 -6.742 1.00 10.00 C ATOM 1493 CG ARG A 104 16.357 -4.033 -6.478 1.00 10.00 C ATOM 1494 CD ARG A 104 17.168 -2.943 -7.192 1.00 10.00 C ATOM 1495 NE ARG A 104 17.080 -3.011 -8.662 1.00 10.00 N ATOM 1496 CZ ARG A 104 17.933 -2.415 -9.510 1.00 10.00 C ATOM 1497 NH1 ARG A 104 19.024 -1.797 -9.038 1.00 10.00 N ATOM 1498 NH2 ARG A 104 17.704 -2.424 -10.825 1.00 10.00 N ATOM 0 H ARG A 104 12.774 -3.737 -5.393 1.00 10.00 H new ATOM 0 HA ARG A 104 14.730 -2.053 -6.001 1.00 10.00 H new ATOM 0 HB2 ARG A 104 14.388 -4.785 -6.043 1.00 10.00 H new ATOM 0 HB3 ARG A 104 14.674 -4.478 -7.744 1.00 10.00 H new ATOM 0 HG2 ARG A 104 16.507 -3.914 -5.405 1.00 10.00 H new ATOM 0 HG3 ARG A 104 16.779 -5.000 -6.753 1.00 10.00 H new ATOM 0 HD2 ARG A 104 16.818 -1.965 -6.860 1.00 10.00 H new ATOM 0 HD3 ARG A 104 18.213 -3.026 -6.894 1.00 10.00 H new ATOM 0 HE ARG A 104 16.314 -3.551 -9.065 1.00 10.00 H new ATOM 0 HH11 ARG A 104 19.206 -1.779 -8.035 1.00 10.00 H new ATOM 0 HH12 ARG A 104 19.672 -1.344 -9.682 1.00 10.00 H new ATOM 0 HH21 ARG A 104 16.874 -2.887 -11.195 1.00 10.00 H new ATOM 0 HH22 ARG A 104 18.359 -1.968 -11.460 1.00 10.00 H new ATOM 1512 N ASP A 105 13.029 -2.627 -8.778 1.00 10.00 N ATOM 1513 CA ASP A 105 12.656 -2.168 -10.102 1.00 10.00 C ATOM 1514 C ASP A 105 11.132 -2.005 -10.128 1.00 10.00 C ATOM 1515 O ASP A 105 10.411 -2.976 -10.339 1.00 10.00 O ATOM 1516 CB ASP A 105 13.153 -3.189 -11.137 1.00 10.00 C ATOM 1517 CG ASP A 105 14.669 -3.254 -11.153 1.00 10.00 C ATOM 1518 OD1 ASP A 105 15.248 -3.977 -10.316 1.00 10.00 O ATOM 1519 OD2 ASP A 105 15.300 -2.520 -11.943 1.00 10.00 O ATOM 0 H ASP A 105 12.478 -3.430 -8.475 1.00 10.00 H new ATOM 0 HA ASP A 105 13.110 -1.208 -10.346 1.00 10.00 H new ATOM 0 HB2 ASP A 105 12.746 -4.173 -10.906 1.00 10.00 H new ATOM 0 HB3 ASP A 105 12.787 -2.916 -12.127 1.00 10.00 H new ATOM 1524 N GLY A 106 10.639 -0.785 -9.881 1.00 10.00 N ATOM 1525 CA GLY A 106 9.215 -0.475 -9.828 1.00 10.00 C ATOM 1526 C GLY A 106 8.921 0.608 -8.787 1.00 10.00 C ATOM 1527 O GLY A 106 9.194 0.385 -7.611 1.00 10.00 O ATOM 0 H GLY A 106 11.234 0.025 -9.710 1.00 10.00 H new ATOM 0 HA2 GLY A 106 8.876 -0.141 -10.809 1.00 10.00 H new ATOM 0 HA3 GLY A 106 8.653 -1.377 -9.586 1.00 10.00 H new ATOM 1531 N ASP A 107 8.397 1.760 -9.246 1.00 10.00 N ATOM 1532 CA ASP A 107 7.889 2.904 -8.479 1.00 10.00 C ATOM 1533 C ASP A 107 8.496 3.020 -7.084 1.00 10.00 C ATOM 1534 O ASP A 107 7.798 2.830 -6.092 1.00 10.00 O ATOM 1535 CB ASP A 107 6.357 2.847 -8.424 1.00 10.00 C ATOM 1536 CG ASP A 107 5.777 4.058 -7.688 1.00 10.00 C ATOM 1537 OD1 ASP A 107 6.400 5.134 -7.787 1.00 10.00 O ATOM 1538 OD2 ASP A 107 4.704 3.900 -7.068 1.00 10.00 O ATOM 0 H ASP A 107 8.313 1.924 -10.249 1.00 10.00 H new ATOM 0 HA ASP A 107 8.200 3.809 -9.001 1.00 10.00 H new ATOM 0 HB2 ASP A 107 5.957 2.809 -9.437 1.00 10.00 H new ATOM 0 HB3 ASP A 107 6.044 1.931 -7.923 1.00 10.00 H new ATOM 1543 N HIS A 108 9.808 3.268 -7.005 1.00 10.00 N ATOM 1544 CA HIS A 108 10.545 3.099 -5.762 1.00 10.00 C ATOM 1545 C HIS A 108 11.123 4.408 -5.248 1.00 10.00 C ATOM 1546 O HIS A 108 11.332 5.353 -6.004 1.00 10.00 O ATOM 1547 CB HIS A 108 11.605 1.998 -5.868 1.00 10.00 C ATOM 1548 CG HIS A 108 12.720 2.204 -6.866 1.00 10.00 C ATOM 1549 ND1 HIS A 108 12.995 1.398 -7.947 1.00 10.00 N ATOM 1550 CD2 HIS A 108 13.803 3.022 -6.695 1.00 10.00 C ATOM 1551 CE1 HIS A 108 14.184 1.766 -8.441 1.00 10.00 C ATOM 1552 NE2 HIS A 108 14.728 2.768 -7.725 1.00 10.00 N ATOM 0 H HIS A 108 10.375 3.586 -7.791 1.00 10.00 H new ATOM 0 HA HIS A 108 9.823 2.769 -5.015 1.00 10.00 H new ATOM 0 HB2 HIS A 108 12.054 1.866 -4.883 1.00 10.00 H new ATOM 0 HB3 HIS A 108 11.099 1.065 -6.116 1.00 10.00 H new ATOM 0 HD2 HIS A 108 13.928 3.743 -5.901 1.00 10.00 H new ATOM 0 HE1 HIS A 108 14.648 1.315 -9.306 1.00 10.00 H new ATOM 0 HE2 HIS A 108 15.617 3.240 -7.892 1.00 10.00 H new ATOM 1560 N VAL A 109 11.429 4.429 -3.952 1.00 10.00 N ATOM 1561 CA VAL A 109 12.140 5.507 -3.296 1.00 10.00 C ATOM 1562 C VAL A 109 13.566 5.009 -3.110 1.00 10.00 C ATOM 1563 O VAL A 109 13.772 4.067 -2.347 1.00 10.00 O ATOM 1564 CB VAL A 109 11.494 5.805 -1.932 1.00 10.00 C ATOM 1565 CG1 VAL A 109 12.203 6.988 -1.265 1.00 10.00 C ATOM 1566 CG2 VAL A 109 10.004 6.140 -2.056 1.00 10.00 C ATOM 0 H VAL A 109 11.178 3.671 -3.317 1.00 10.00 H new ATOM 0 HA VAL A 109 12.113 6.428 -3.879 1.00 10.00 H new ATOM 0 HB VAL A 109 11.596 4.902 -1.329 1.00 10.00 H new ATOM 0 HG11 VAL A 109 11.740 7.193 -0.300 1.00 10.00 H new ATOM 0 HG12 VAL A 109 13.256 6.746 -1.118 1.00 10.00 H new ATOM 0 HG13 VAL A 109 12.119 7.869 -1.902 1.00 10.00 H new ATOM 0 HG21 VAL A 109 9.593 6.343 -1.067 1.00 10.00 H new ATOM 0 HG22 VAL A 109 9.880 7.020 -2.688 1.00 10.00 H new ATOM 0 HG23 VAL A 109 9.477 5.296 -2.502 1.00 10.00 H new ATOM 1576 N MET A 110 14.541 5.631 -3.774 1.00 10.00 N ATOM 1577 CA MET A 110 15.941 5.372 -3.505 1.00 10.00 C ATOM 1578 C MET A 110 16.342 6.198 -2.294 1.00 10.00 C ATOM 1579 O MET A 110 16.684 7.373 -2.413 1.00 10.00 O ATOM 1580 CB MET A 110 16.839 5.712 -4.697 1.00 10.00 C ATOM 1581 CG MET A 110 16.529 4.820 -5.893 1.00 10.00 C ATOM 1582 SD MET A 110 17.824 4.766 -7.153 1.00 10.00 S ATOM 1583 CE MET A 110 18.918 3.528 -6.427 1.00 10.00 C ATOM 0 H MET A 110 14.376 6.322 -4.506 1.00 10.00 H new ATOM 0 HA MET A 110 16.072 4.306 -3.316 1.00 10.00 H new ATOM 0 HB2 MET A 110 16.700 6.757 -4.974 1.00 10.00 H new ATOM 0 HB3 MET A 110 17.885 5.594 -4.413 1.00 10.00 H new ATOM 0 HG2 MET A 110 16.347 3.807 -5.535 1.00 10.00 H new ATOM 0 HG3 MET A 110 15.605 5.165 -6.356 1.00 10.00 H new ATOM 0 HE1 MET A 110 19.776 3.372 -7.081 1.00 10.00 H new ATOM 0 HE2 MET A 110 19.263 3.874 -5.453 1.00 10.00 H new ATOM 0 HE3 MET A 110 18.377 2.589 -6.308 1.00 10.00 H new ATOM 1593 N LEU A 111 16.325 5.560 -1.127 1.00 10.00 N ATOM 1594 CA LEU A 111 16.777 6.136 0.131 1.00 10.00 C ATOM 1595 C LEU A 111 18.303 6.024 0.183 1.00 10.00 C ATOM 1596 O LEU A 111 18.868 5.402 1.079 1.00 10.00 O ATOM 1597 CB LEU A 111 16.117 5.363 1.283 1.00 10.00 C ATOM 1598 CG LEU A 111 14.588 5.501 1.316 1.00 10.00 C ATOM 1599 CD1 LEU A 111 14.025 4.465 2.289 1.00 10.00 C ATOM 1600 CD2 LEU A 111 14.157 6.905 1.757 1.00 10.00 C ATOM 0 H LEU A 111 15.987 4.603 -1.030 1.00 10.00 H new ATOM 0 HA LEU A 111 16.500 7.187 0.218 1.00 10.00 H new ATOM 0 HB2 LEU A 111 16.377 4.308 1.198 1.00 10.00 H new ATOM 0 HB3 LEU A 111 16.526 5.717 2.229 1.00 10.00 H new ATOM 0 HG LEU A 111 14.202 5.336 0.310 1.00 10.00 H new ATOM 0 HD11 LEU A 111 12.939 4.551 2.323 1.00 10.00 H new ATOM 0 HD12 LEU A 111 14.300 3.465 1.954 1.00 10.00 H new ATOM 0 HD13 LEU A 111 14.434 4.640 3.284 1.00 10.00 H new ATOM 0 HD21 LEU A 111 13.069 6.965 1.768 1.00 10.00 H new ATOM 0 HD22 LEU A 111 14.542 7.107 2.757 1.00 10.00 H new ATOM 0 HD23 LEU A 111 14.554 7.643 1.060 1.00 10.00 H new ATOM 1612 N MET A 112 18.970 6.635 -0.796 1.00 10.00 N ATOM 1613 CA MET A 112 20.393 6.453 -1.029 1.00 10.00 C ATOM 1614 C MET A 112 21.206 7.363 -0.109 1.00 10.00 C ATOM 1615 O MET A 112 20.719 8.396 0.349 1.00 10.00 O ATOM 1616 CB MET A 112 20.656 6.739 -2.520 1.00 10.00 C ATOM 1617 CG MET A 112 22.132 6.846 -2.933 1.00 10.00 C ATOM 1618 SD MET A 112 22.436 6.916 -4.719 1.00 10.00 S ATOM 1619 CE MET A 112 21.582 8.446 -5.163 1.00 10.00 C ATOM 0 H MET A 112 18.528 7.276 -1.454 1.00 10.00 H new ATOM 0 HA MET A 112 20.704 5.434 -0.798 1.00 10.00 H new ATOM 0 HB2 MET A 112 20.190 5.949 -3.109 1.00 10.00 H new ATOM 0 HB3 MET A 112 20.156 7.671 -2.785 1.00 10.00 H new ATOM 0 HG2 MET A 112 22.556 7.739 -2.474 1.00 10.00 H new ATOM 0 HG3 MET A 112 22.669 5.991 -2.523 1.00 10.00 H new ATOM 0 HE1 MET A 112 21.771 8.677 -6.211 1.00 10.00 H new ATOM 0 HE2 MET A 112 20.510 8.323 -5.006 1.00 10.00 H new ATOM 0 HE3 MET A 112 21.949 9.261 -4.540 1.00 10.00 H new ATOM 1629 N GLY A 113 22.475 7.009 0.118 1.00 10.00 N ATOM 1630 CA GLY A 113 23.491 7.971 0.524 1.00 10.00 C ATOM 1631 C GLY A 113 24.206 7.648 1.835 1.00 10.00 C ATOM 1632 O GLY A 113 25.166 8.345 2.158 1.00 10.00 O ATOM 0 H GLY A 113 22.820 6.054 0.025 1.00 10.00 H new ATOM 0 HA2 GLY A 113 24.236 8.045 -0.269 1.00 10.00 H new ATOM 0 HA3 GLY A 113 23.024 8.952 0.615 1.00 10.00 H new ATOM 1636 N LEU A 114 23.750 6.630 2.576 1.00 10.00 N ATOM 1637 CA LEU A 114 24.322 6.190 3.855 1.00 10.00 C ATOM 1638 C LEU A 114 24.592 7.374 4.796 1.00 10.00 C ATOM 1639 O LEU A 114 25.735 7.713 5.088 1.00 10.00 O ATOM 1640 CB LEU A 114 25.555 5.310 3.574 1.00 10.00 C ATOM 1641 CG LEU A 114 26.324 4.735 4.775 1.00 10.00 C ATOM 1642 CD1 LEU A 114 25.419 3.905 5.685 1.00 10.00 C ATOM 1643 CD2 LEU A 114 27.458 3.845 4.252 1.00 10.00 C ATOM 0 H LEU A 114 22.945 6.071 2.292 1.00 10.00 H new ATOM 0 HA LEU A 114 23.602 5.577 4.396 1.00 10.00 H new ATOM 0 HB2 LEU A 114 25.233 4.474 2.953 1.00 10.00 H new ATOM 0 HB3 LEU A 114 26.255 5.897 2.980 1.00 10.00 H new ATOM 0 HG LEU A 114 26.716 5.567 5.360 1.00 10.00 H new ATOM 0 HD11 LEU A 114 26.001 3.517 6.521 1.00 10.00 H new ATOM 0 HD12 LEU A 114 24.612 4.531 6.064 1.00 10.00 H new ATOM 0 HD13 LEU A 114 24.998 3.074 5.119 1.00 10.00 H new ATOM 0 HD21 LEU A 114 28.012 3.430 5.094 1.00 10.00 H new ATOM 0 HD22 LEU A 114 27.039 3.033 3.658 1.00 10.00 H new ATOM 0 HD23 LEU A 114 28.130 4.439 3.632 1.00 10.00 H new ATOM 1655 N LYS A 115 23.524 8.011 5.284 1.00 10.00 N ATOM 1656 CA LYS A 115 23.612 9.181 6.138 1.00 10.00 C ATOM 1657 C LYS A 115 23.967 8.779 7.571 1.00 10.00 C ATOM 1658 O LYS A 115 24.694 9.487 8.265 1.00 10.00 O ATOM 1659 CB LYS A 115 22.237 9.837 6.083 1.00 10.00 C ATOM 1660 CG LYS A 115 22.196 11.294 6.502 1.00 10.00 C ATOM 1661 CD LYS A 115 20.804 11.802 6.098 1.00 10.00 C ATOM 1662 CE LYS A 115 20.289 12.959 6.952 1.00 10.00 C ATOM 1663 NZ LYS A 115 21.045 14.203 6.709 1.00 10.00 N ATOM 0 H LYS A 115 22.566 7.719 5.090 1.00 10.00 H new ATOM 0 HA LYS A 115 24.393 9.864 5.804 1.00 10.00 H new ATOM 0 HB2 LYS A 115 21.856 9.758 5.065 1.00 10.00 H new ATOM 0 HB3 LYS A 115 21.558 9.273 6.722 1.00 10.00 H new ATOM 0 HG2 LYS A 115 22.355 11.398 7.575 1.00 10.00 H new ATOM 0 HG3 LYS A 115 22.981 11.866 6.007 1.00 10.00 H new ATOM 0 HD2 LYS A 115 20.833 12.119 5.056 1.00 10.00 H new ATOM 0 HD3 LYS A 115 20.096 10.976 6.160 1.00 10.00 H new ATOM 0 HE2 LYS A 115 19.234 13.128 6.736 1.00 10.00 H new ATOM 0 HE3 LYS A 115 20.360 12.691 8.006 1.00 10.00 H new ATOM 0 HZ1 LYS A 115 20.664 14.963 7.308 1.00 10.00 H new ATOM 0 HZ2 LYS A 115 22.048 14.050 6.939 1.00 10.00 H new ATOM 0 HZ3 LYS A 115 20.957 14.473 5.709 1.00 10.00 H new ATOM 1677 N ARG A 116 23.410 7.650 8.016 1.00 10.00 N ATOM 1678 CA ARG A 116 23.679 6.999 9.287 1.00 10.00 C ATOM 1679 C ARG A 116 23.693 5.498 8.990 1.00 10.00 C ATOM 1680 O ARG A 116 23.054 5.093 8.019 1.00 10.00 O ATOM 1681 CB ARG A 116 22.575 7.352 10.296 1.00 10.00 C ATOM 1682 CG ARG A 116 22.713 8.792 10.803 1.00 10.00 C ATOM 1683 CD ARG A 116 21.683 9.061 11.906 1.00 10.00 C ATOM 1684 NE ARG A 116 21.898 10.382 12.518 1.00 10.00 N ATOM 1685 CZ ARG A 116 21.239 10.845 13.593 1.00 10.00 C ATOM 1686 NH1 ARG A 116 20.263 10.112 14.140 1.00 10.00 N ATOM 1687 NH2 ARG A 116 21.559 12.034 14.115 1.00 10.00 N ATOM 0 H ARG A 116 22.721 7.142 7.462 1.00 10.00 H new ATOM 0 HA ARG A 116 24.625 7.320 9.723 1.00 10.00 H new ATOM 0 HB2 ARG A 116 21.599 7.222 9.828 1.00 10.00 H new ATOM 0 HB3 ARG A 116 22.618 6.663 11.139 1.00 10.00 H new ATOM 0 HG2 ARG A 116 23.720 8.956 11.187 1.00 10.00 H new ATOM 0 HG3 ARG A 116 22.568 9.492 9.980 1.00 10.00 H new ATOM 0 HD2 ARG A 116 20.677 9.009 11.490 1.00 10.00 H new ATOM 0 HD3 ARG A 116 21.752 8.287 12.670 1.00 10.00 H new ATOM 0 HE ARG A 116 22.599 10.991 12.095 1.00 10.00 H new ATOM 0 HH11 ARG A 116 20.022 9.205 13.741 1.00 10.00 H new ATOM 0 HH12 ARG A 116 19.760 10.460 14.956 1.00 10.00 H new ATOM 0 HH21 ARG A 116 22.304 12.591 13.697 1.00 10.00 H new ATOM 0 HH22 ARG A 116 21.058 12.384 14.931 1.00 10.00 H new ATOM 1701 N PRO A 117 24.417 4.676 9.767 1.00 10.00 N ATOM 1702 CA PRO A 117 24.570 3.257 9.488 1.00 10.00 C ATOM 1703 C PRO A 117 23.218 2.539 9.485 1.00 10.00 C ATOM 1704 O PRO A 117 22.598 2.361 10.532 1.00 10.00 O ATOM 1705 CB PRO A 117 25.525 2.717 10.560 1.00 10.00 C ATOM 1706 CG PRO A 117 25.410 3.733 11.696 1.00 10.00 C ATOM 1707 CD PRO A 117 25.174 5.046 10.951 1.00 10.00 C ATOM 0 HA PRO A 117 24.980 3.084 8.493 1.00 10.00 H new ATOM 0 HB2 PRO A 117 25.236 1.718 10.886 1.00 10.00 H new ATOM 0 HB3 PRO A 117 26.547 2.648 10.187 1.00 10.00 H new ATOM 0 HG2 PRO A 117 24.586 3.496 12.369 1.00 10.00 H new ATOM 0 HG3 PRO A 117 26.316 3.768 12.301 1.00 10.00 H new ATOM 0 HD2 PRO A 117 24.621 5.755 11.567 1.00 10.00 H new ATOM 0 HD3 PRO A 117 26.117 5.523 10.683 1.00 10.00 H new ATOM 1715 N LEU A 118 22.768 2.109 8.302 1.00 10.00 N ATOM 1716 CA LEU A 118 21.568 1.308 8.154 1.00 10.00 C ATOM 1717 C LEU A 118 21.825 -0.081 8.747 1.00 10.00 C ATOM 1718 O LEU A 118 22.454 -0.930 8.118 1.00 10.00 O ATOM 1719 CB LEU A 118 21.147 1.243 6.678 1.00 10.00 C ATOM 1720 CG LEU A 118 20.624 2.592 6.150 1.00 10.00 C ATOM 1721 CD1 LEU A 118 21.694 3.415 5.427 1.00 10.00 C ATOM 1722 CD2 LEU A 118 19.456 2.376 5.184 1.00 10.00 C ATOM 0 H LEU A 118 23.236 2.313 7.419 1.00 10.00 H new ATOM 0 HA LEU A 118 20.739 1.764 8.696 1.00 10.00 H new ATOM 0 HB2 LEU A 118 21.998 0.927 6.075 1.00 10.00 H new ATOM 0 HB3 LEU A 118 20.372 0.485 6.558 1.00 10.00 H new ATOM 0 HG LEU A 118 20.305 3.148 7.031 1.00 10.00 H new ATOM 0 HD11 LEU A 118 21.259 4.353 5.080 1.00 10.00 H new ATOM 0 HD12 LEU A 118 22.515 3.627 6.112 1.00 10.00 H new ATOM 0 HD13 LEU A 118 22.071 2.852 4.573 1.00 10.00 H new ATOM 0 HD21 LEU A 118 19.100 3.341 4.822 1.00 10.00 H new ATOM 0 HD22 LEU A 118 19.789 1.772 4.340 1.00 10.00 H new ATOM 0 HD23 LEU A 118 18.646 1.862 5.701 1.00 10.00 H new ATOM 1734 N LYS A 119 21.353 -0.294 9.975 1.00 10.00 N ATOM 1735 CA LYS A 119 21.608 -1.476 10.776 1.00 10.00 C ATOM 1736 C LYS A 119 20.421 -2.428 10.635 1.00 10.00 C ATOM 1737 O LYS A 119 19.310 -2.109 11.066 1.00 10.00 O ATOM 1738 CB LYS A 119 21.800 -1.026 12.229 1.00 10.00 C ATOM 1739 CG LYS A 119 22.067 -2.170 13.225 1.00 10.00 C ATOM 1740 CD LYS A 119 21.222 -1.889 14.470 1.00 10.00 C ATOM 1741 CE LYS A 119 21.500 -2.812 15.661 1.00 10.00 C ATOM 1742 NZ LYS A 119 20.581 -2.484 16.770 1.00 10.00 N ATOM 0 H LYS A 119 20.759 0.384 10.452 1.00 10.00 H new ATOM 0 HA LYS A 119 22.504 -2.002 10.447 1.00 10.00 H new ATOM 0 HB2 LYS A 119 22.633 -0.324 12.271 1.00 10.00 H new ATOM 0 HB3 LYS A 119 20.910 -0.484 12.548 1.00 10.00 H new ATOM 0 HG2 LYS A 119 21.800 -3.132 12.787 1.00 10.00 H new ATOM 0 HG3 LYS A 119 23.125 -2.219 13.481 1.00 10.00 H new ATOM 0 HD2 LYS A 119 21.391 -0.858 14.781 1.00 10.00 H new ATOM 0 HD3 LYS A 119 20.169 -1.972 14.203 1.00 10.00 H new ATOM 0 HE2 LYS A 119 21.371 -3.853 15.365 1.00 10.00 H new ATOM 0 HE3 LYS A 119 22.534 -2.699 15.987 1.00 10.00 H new ATOM 0 HZ1 LYS A 119 20.899 -2.962 17.637 1.00 10.00 H new ATOM 0 HZ2 LYS A 119 20.576 -1.455 16.924 1.00 10.00 H new ATOM 0 HZ3 LYS A 119 19.620 -2.803 16.531 1.00 10.00 H new ATOM 1756 N VAL A 120 20.674 -3.604 10.055 1.00 10.00 N ATOM 1757 CA VAL A 120 19.706 -4.688 9.995 1.00 10.00 C ATOM 1758 C VAL A 120 19.066 -4.899 11.373 1.00 10.00 C ATOM 1759 O VAL A 120 19.773 -5.157 12.346 1.00 10.00 O ATOM 1760 CB VAL A 120 20.363 -5.965 9.425 1.00 10.00 C ATOM 1761 CG1 VAL A 120 21.588 -6.450 10.216 1.00 10.00 C ATOM 1762 CG2 VAL A 120 19.352 -7.115 9.326 1.00 10.00 C ATOM 0 H VAL A 120 21.565 -3.827 9.612 1.00 10.00 H new ATOM 0 HA VAL A 120 18.899 -4.426 9.311 1.00 10.00 H new ATOM 0 HB VAL A 120 20.710 -5.676 8.433 1.00 10.00 H new ATOM 0 HG11 VAL A 120 21.989 -7.350 9.750 1.00 10.00 H new ATOM 0 HG12 VAL A 120 22.351 -5.672 10.218 1.00 10.00 H new ATOM 0 HG13 VAL A 120 21.294 -6.673 11.242 1.00 10.00 H new ATOM 0 HG21 VAL A 120 19.845 -7.999 8.922 1.00 10.00 H new ATOM 0 HG22 VAL A 120 18.959 -7.340 10.317 1.00 10.00 H new ATOM 0 HG23 VAL A 120 18.533 -6.824 8.669 1.00 10.00 H new ATOM 1772 N GLY A 121 17.742 -4.751 11.461 1.00 10.00 N ATOM 1773 CA GLY A 121 16.988 -5.003 12.674 1.00 10.00 C ATOM 1774 C GLY A 121 16.433 -3.716 13.272 1.00 10.00 C ATOM 1775 O GLY A 121 15.442 -3.781 13.997 1.00 10.00 O ATOM 0 H GLY A 121 17.163 -4.449 10.677 1.00 10.00 H new ATOM 0 HA2 GLY A 121 16.167 -5.686 12.457 1.00 10.00 H new ATOM 0 HA3 GLY A 121 17.629 -5.497 13.405 1.00 10.00 H new ATOM 1779 N GLU A 122 17.035 -2.554 12.983 1.00 10.00 N ATOM 1780 CA GLU A 122 16.539 -1.319 13.546 1.00 10.00 C ATOM 1781 C GLU A 122 15.304 -0.871 12.781 1.00 10.00 C ATOM 1782 O GLU A 122 14.772 -1.537 11.887 1.00 10.00 O ATOM 1783 CB GLU A 122 17.630 -0.228 13.559 1.00 10.00 C ATOM 1784 CG GLU A 122 17.835 0.392 14.955 1.00 10.00 C ATOM 1785 CD GLU A 122 18.602 -0.530 15.897 1.00 10.00 C ATOM 1786 OE1 GLU A 122 18.253 -1.727 15.995 1.00 10.00 O ATOM 1787 OE2 GLU A 122 19.628 -0.097 16.469 1.00 10.00 O ATOM 0 H GLU A 122 17.848 -2.457 12.375 1.00 10.00 H new ATOM 0 HA GLU A 122 16.259 -1.492 14.585 1.00 10.00 H new ATOM 0 HB2 GLU A 122 18.571 -0.657 13.215 1.00 10.00 H new ATOM 0 HB3 GLU A 122 17.361 0.558 12.853 1.00 10.00 H new ATOM 0 HG2 GLU A 122 18.374 1.334 14.855 1.00 10.00 H new ATOM 0 HG3 GLU A 122 16.864 0.626 15.391 1.00 10.00 H new ATOM 1794 N THR A 123 14.850 0.305 13.167 1.00 10.00 N ATOM 1795 CA THR A 123 13.696 0.977 12.608 1.00 10.00 C ATOM 1796 C THR A 123 13.889 2.473 12.822 1.00 10.00 C ATOM 1797 O THR A 123 14.278 2.888 13.912 1.00 10.00 O ATOM 1798 CB THR A 123 12.402 0.414 13.224 1.00 10.00 C ATOM 1799 OG1 THR A 123 12.178 -0.908 12.760 1.00 10.00 O ATOM 1800 CG2 THR A 123 11.164 1.235 12.860 1.00 10.00 C ATOM 0 H THR A 123 15.296 0.841 13.912 1.00 10.00 H new ATOM 0 HA THR A 123 13.600 0.801 11.537 1.00 10.00 H new ATOM 0 HB THR A 123 12.544 0.447 14.304 1.00 10.00 H new ATOM 0 HG1 THR A 123 12.978 -1.232 12.297 1.00 10.00 H new ATOM 0 HG21 THR A 123 10.283 0.790 13.323 1.00 10.00 H new ATOM 0 HG22 THR A 123 11.286 2.256 13.220 1.00 10.00 H new ATOM 0 HG23 THR A 123 11.039 1.245 11.777 1.00 10.00 H new ATOM 1808 N VAL A 124 13.684 3.259 11.764 1.00 10.00 N ATOM 1809 CA VAL A 124 13.972 4.685 11.731 1.00 10.00 C ATOM 1810 C VAL A 124 12.740 5.421 11.206 1.00 10.00 C ATOM 1811 O VAL A 124 12.117 4.981 10.241 1.00 10.00 O ATOM 1812 CB VAL A 124 15.208 4.935 10.851 1.00 10.00 C ATOM 1813 CG1 VAL A 124 15.562 6.425 10.807 1.00 10.00 C ATOM 1814 CG2 VAL A 124 16.423 4.153 11.373 1.00 10.00 C ATOM 0 H VAL A 124 13.303 2.908 10.886 1.00 10.00 H new ATOM 0 HA VAL A 124 14.196 5.060 12.730 1.00 10.00 H new ATOM 0 HB VAL A 124 14.960 4.593 9.846 1.00 10.00 H new ATOM 0 HG11 VAL A 124 16.440 6.572 10.178 1.00 10.00 H new ATOM 0 HG12 VAL A 124 14.723 6.986 10.396 1.00 10.00 H new ATOM 0 HG13 VAL A 124 15.776 6.778 11.816 1.00 10.00 H new ATOM 0 HG21 VAL A 124 17.283 4.348 10.733 1.00 10.00 H new ATOM 0 HG22 VAL A 124 16.649 4.470 12.391 1.00 10.00 H new ATOM 0 HG23 VAL A 124 16.199 3.086 11.366 1.00 10.00 H new ATOM 1824 N ASN A 125 12.384 6.543 11.833 1.00 10.00 N ATOM 1825 CA ASN A 125 11.244 7.345 11.406 1.00 10.00 C ATOM 1826 C ASN A 125 11.620 8.155 10.168 1.00 10.00 C ATOM 1827 O ASN A 125 12.462 9.049 10.250 1.00 10.00 O ATOM 1828 CB ASN A 125 10.770 8.272 12.535 1.00 10.00 C ATOM 1829 CG ASN A 125 10.066 7.527 13.668 1.00 10.00 C ATOM 1830 OD1 ASN A 125 9.734 6.351 13.553 1.00 10.00 O ATOM 1831 ND2 ASN A 125 9.827 8.209 14.785 1.00 10.00 N ATOM 0 H ASN A 125 12.876 6.917 12.645 1.00 10.00 H new ATOM 0 HA ASN A 125 10.420 6.676 11.158 1.00 10.00 H new ATOM 0 HB2 ASN A 125 11.628 8.809 12.940 1.00 10.00 H new ATOM 0 HB3 ASN A 125 10.091 9.019 12.123 1.00 10.00 H new ATOM 0 HD21 ASN A 125 9.358 7.755 15.569 1.00 10.00 H new ATOM 0 HD22 ASN A 125 10.112 9.186 14.857 1.00 10.00 H new ATOM 1838 N ILE A 126 10.986 7.852 9.035 1.00 10.00 N ATOM 1839 CA ILE A 126 10.972 8.712 7.862 1.00 10.00 C ATOM 1840 C ILE A 126 9.735 9.611 7.916 1.00 10.00 C ATOM 1841 O ILE A 126 8.906 9.484 8.820 1.00 10.00 O ATOM 1842 CB ILE A 126 11.019 7.873 6.576 1.00 10.00 C ATOM 1843 CG1 ILE A 126 9.778 6.996 6.352 1.00 10.00 C ATOM 1844 CG2 ILE A 126 12.288 7.011 6.566 1.00 10.00 C ATOM 1845 CD1 ILE A 126 9.696 6.552 4.891 1.00 10.00 C ATOM 0 H ILE A 126 10.461 6.987 8.909 1.00 10.00 H new ATOM 0 HA ILE A 126 11.858 9.346 7.857 1.00 10.00 H new ATOM 0 HB ILE A 126 11.033 8.582 5.748 1.00 10.00 H new ATOM 0 HG12 ILE A 126 9.820 6.122 7.002 1.00 10.00 H new ATOM 0 HG13 ILE A 126 8.879 7.551 6.621 1.00 10.00 H new ATOM 0 HG21 ILE A 126 12.317 6.417 5.652 1.00 10.00 H new ATOM 0 HG22 ILE A 126 13.166 7.656 6.609 1.00 10.00 H new ATOM 0 HG23 ILE A 126 12.283 6.347 7.430 1.00 10.00 H new ATOM 0 HD11 ILE A 126 8.811 5.931 4.748 1.00 10.00 H new ATOM 0 HD12 ILE A 126 9.631 7.429 4.247 1.00 10.00 H new ATOM 0 HD13 ILE A 126 10.587 5.978 4.634 1.00 10.00 H new ATOM 1857 N THR A 127 9.585 10.522 6.953 1.00 10.00 N ATOM 1858 CA THR A 127 8.403 11.361 6.820 1.00 10.00 C ATOM 1859 C THR A 127 8.149 11.660 5.340 1.00 10.00 C ATOM 1860 O THR A 127 9.051 12.134 4.652 1.00 10.00 O ATOM 1861 CB THR A 127 8.581 12.631 7.669 1.00 10.00 C ATOM 1862 OG1 THR A 127 8.711 12.289 9.036 1.00 10.00 O ATOM 1863 CG2 THR A 127 7.403 13.599 7.542 1.00 10.00 C ATOM 0 H THR A 127 10.291 10.696 6.238 1.00 10.00 H new ATOM 0 HA THR A 127 7.519 10.845 7.195 1.00 10.00 H new ATOM 0 HB THR A 127 9.479 13.123 7.295 1.00 10.00 H new ATOM 0 HG1 THR A 127 8.825 13.104 9.568 1.00 10.00 H new ATOM 0 HG21 THR A 127 7.584 14.476 8.163 1.00 10.00 H new ATOM 0 HG22 THR A 127 7.295 13.907 6.502 1.00 10.00 H new ATOM 0 HG23 THR A 127 6.489 13.105 7.871 1.00 10.00 H new ATOM 1871 N LEU A 128 6.942 11.366 4.839 1.00 10.00 N ATOM 1872 CA LEU A 128 6.572 11.609 3.444 1.00 10.00 C ATOM 1873 C LEU A 128 5.927 12.985 3.255 1.00 10.00 C ATOM 1874 O LEU A 128 5.769 13.728 4.221 1.00 10.00 O ATOM 1875 CB LEU A 128 5.725 10.459 2.865 1.00 10.00 C ATOM 1876 CG LEU A 128 4.555 9.927 3.702 1.00 10.00 C ATOM 1877 CD1 LEU A 128 3.395 10.915 3.606 1.00 10.00 C ATOM 1878 CD2 LEU A 128 4.098 8.573 3.146 1.00 10.00 C ATOM 0 H LEU A 128 6.194 10.951 5.395 1.00 10.00 H new ATOM 0 HA LEU A 128 7.493 11.627 2.861 1.00 10.00 H new ATOM 0 HB2 LEU A 128 5.325 10.790 1.907 1.00 10.00 H new ATOM 0 HB3 LEU A 128 6.394 9.624 2.660 1.00 10.00 H new ATOM 0 HG LEU A 128 4.870 9.809 4.739 1.00 10.00 H new ATOM 0 HD11 LEU A 128 2.555 10.549 4.197 1.00 10.00 H new ATOM 0 HD12 LEU A 128 3.711 11.886 3.987 1.00 10.00 H new ATOM 0 HD13 LEU A 128 3.089 11.017 2.565 1.00 10.00 H new ATOM 0 HD21 LEU A 128 3.267 8.197 3.742 1.00 10.00 H new ATOM 0 HD22 LEU A 128 3.777 8.694 2.111 1.00 10.00 H new ATOM 0 HD23 LEU A 128 4.925 7.864 3.189 1.00 10.00 H new ATOM 1890 N LYS A 129 5.561 13.326 2.012 1.00 10.00 N ATOM 1891 CA LYS A 129 4.798 14.509 1.643 1.00 10.00 C ATOM 1892 C LYS A 129 4.137 14.244 0.290 1.00 10.00 C ATOM 1893 O LYS A 129 4.797 14.300 -0.745 1.00 10.00 O ATOM 1894 CB LYS A 129 5.713 15.738 1.600 1.00 10.00 C ATOM 1895 CG LYS A 129 4.977 17.022 1.192 1.00 10.00 C ATOM 1896 CD LYS A 129 5.969 18.191 1.150 1.00 10.00 C ATOM 1897 CE LYS A 129 5.264 19.484 0.711 1.00 10.00 C ATOM 1898 NZ LYS A 129 6.200 20.624 0.619 1.00 10.00 N ATOM 0 H LYS A 129 5.804 12.753 1.204 1.00 10.00 H new ATOM 0 HA LYS A 129 4.025 14.716 2.383 1.00 10.00 H new ATOM 0 HB2 LYS A 129 6.165 15.882 2.581 1.00 10.00 H new ATOM 0 HB3 LYS A 129 6.526 15.554 0.898 1.00 10.00 H new ATOM 0 HG2 LYS A 129 4.511 16.892 0.215 1.00 10.00 H new ATOM 0 HG3 LYS A 129 4.177 17.236 1.901 1.00 10.00 H new ATOM 0 HD2 LYS A 129 6.416 18.331 2.134 1.00 10.00 H new ATOM 0 HD3 LYS A 129 6.781 17.961 0.460 1.00 10.00 H new ATOM 0 HE2 LYS A 129 4.789 19.327 -0.257 1.00 10.00 H new ATOM 0 HE3 LYS A 129 4.471 19.723 1.420 1.00 10.00 H new ATOM 0 HZ1 LYS A 129 5.682 21.475 0.320 1.00 10.00 H new ATOM 0 HZ2 LYS A 129 6.635 20.792 1.549 1.00 10.00 H new ATOM 0 HZ3 LYS A 129 6.943 20.408 -0.076 1.00 10.00 H new ATOM 1912 N ALA A 130 2.838 13.960 0.283 1.00 10.00 N ATOM 1913 CA ALA A 130 2.050 13.933 -0.939 1.00 10.00 C ATOM 1914 C ALA A 130 1.455 15.304 -1.219 1.00 10.00 C ATOM 1915 O ALA A 130 0.722 15.844 -0.391 1.00 10.00 O ATOM 1916 CB ALA A 130 0.970 12.853 -0.866 1.00 10.00 C ATOM 0 H ALA A 130 2.305 13.743 1.125 1.00 10.00 H new ATOM 0 HA ALA A 130 2.707 13.680 -1.771 1.00 10.00 H new ATOM 0 HB1 ALA A 130 0.394 12.852 -1.791 1.00 10.00 H new ATOM 0 HB2 ALA A 130 1.439 11.878 -0.729 1.00 10.00 H new ATOM 0 HB3 ALA A 130 0.307 13.058 -0.026 1.00 10.00 H new ATOM 1922 N THR A 131 1.745 15.857 -2.400 1.00 10.00 N ATOM 1923 CA THR A 131 1.198 17.139 -2.824 1.00 10.00 C ATOM 1924 C THR A 131 -0.200 16.885 -3.404 1.00 10.00 C ATOM 1925 O THR A 131 -0.454 17.055 -4.593 1.00 10.00 O ATOM 1926 CB THR A 131 2.210 17.902 -3.704 1.00 10.00 C ATOM 1927 OG1 THR A 131 1.765 19.221 -3.935 1.00 10.00 O ATOM 1928 CG2 THR A 131 2.570 17.237 -5.035 1.00 10.00 C ATOM 0 H THR A 131 2.365 15.425 -3.085 1.00 10.00 H new ATOM 0 HA THR A 131 1.046 17.832 -1.997 1.00 10.00 H new ATOM 0 HB THR A 131 3.133 17.895 -3.124 1.00 10.00 H new ATOM 0 HG1 THR A 131 2.417 19.693 -4.493 1.00 10.00 H new ATOM 0 HG21 THR A 131 3.287 17.859 -5.570 1.00 10.00 H new ATOM 0 HG22 THR A 131 3.010 16.258 -4.845 1.00 10.00 H new ATOM 0 HG23 THR A 131 1.670 17.120 -5.638 1.00 10.00 H new ATOM 1936 N ASP A 132 -1.076 16.414 -2.512 1.00 10.00 N ATOM 1937 CA ASP A 132 -2.478 16.054 -2.705 1.00 10.00 C ATOM 1938 C ASP A 132 -3.003 15.705 -1.317 1.00 10.00 C ATOM 1939 O ASP A 132 -3.923 16.331 -0.802 1.00 10.00 O ATOM 1940 CB ASP A 132 -2.646 14.805 -3.593 1.00 10.00 C ATOM 1941 CG ASP A 132 -2.698 15.075 -5.084 1.00 10.00 C ATOM 1942 OD1 ASP A 132 -3.170 16.147 -5.523 1.00 10.00 O ATOM 1943 OD2 ASP A 132 -2.206 14.204 -5.837 1.00 10.00 O ATOM 0 H ASP A 132 -0.791 16.262 -1.545 1.00 10.00 H new ATOM 0 HA ASP A 132 -3.004 16.877 -3.189 1.00 10.00 H new ATOM 0 HB2 ASP A 132 -1.820 14.122 -3.392 1.00 10.00 H new ATOM 0 HB3 ASP A 132 -3.562 14.292 -3.301 1.00 10.00 H new ATOM 1948 N GLY A 133 -2.386 14.674 -0.731 1.00 10.00 N ATOM 1949 CA GLY A 133 -2.772 14.111 0.547 1.00 10.00 C ATOM 1950 C GLY A 133 -2.165 14.891 1.710 1.00 10.00 C ATOM 1951 O GLY A 133 -2.751 15.864 2.180 1.00 10.00 O ATOM 0 H GLY A 133 -1.585 14.203 -1.151 1.00 10.00 H new ATOM 0 HA2 GLY A 133 -3.859 14.114 0.634 1.00 10.00 H new ATOM 0 HA3 GLY A 133 -2.451 13.071 0.599 1.00 10.00 H new ATOM 1955 N ARG A 134 -1.036 14.419 2.249 1.00 10.00 N ATOM 1956 CA ARG A 134 -0.464 14.972 3.458 1.00 10.00 C ATOM 1957 C ARG A 134 1.009 14.584 3.552 1.00 10.00 C ATOM 1958 O ARG A 134 1.505 13.792 2.751 1.00 10.00 O ATOM 1959 CB ARG A 134 -1.263 14.474 4.678 1.00 10.00 C ATOM 1960 CG ARG A 134 -1.671 15.648 5.571 1.00 10.00 C ATOM 1961 CD ARG A 134 -2.394 15.139 6.822 1.00 10.00 C ATOM 1962 NE ARG A 134 -2.864 16.258 7.655 1.00 10.00 N ATOM 1963 CZ ARG A 134 -3.532 16.123 8.813 1.00 10.00 C ATOM 1964 NH1 ARG A 134 -3.795 14.901 9.288 1.00 10.00 N ATOM 1965 NH2 ARG A 134 -3.933 17.208 9.485 1.00 10.00 N ATOM 0 H ARG A 134 -0.503 13.645 1.853 1.00 10.00 H new ATOM 0 HA ARG A 134 -0.522 16.060 3.438 1.00 10.00 H new ATOM 0 HB2 ARG A 134 -2.152 13.939 4.344 1.00 10.00 H new ATOM 0 HB3 ARG A 134 -0.661 13.767 5.250 1.00 10.00 H new ATOM 0 HG2 ARG A 134 -0.788 16.218 5.860 1.00 10.00 H new ATOM 0 HG3 ARG A 134 -2.321 16.326 5.018 1.00 10.00 H new ATOM 0 HD2 ARG A 134 -3.241 14.519 6.529 1.00 10.00 H new ATOM 0 HD3 ARG A 134 -1.722 14.507 7.402 1.00 10.00 H new ATOM 0 HE ARG A 134 -2.668 17.205 7.329 1.00 10.00 H new ATOM 0 HH11 ARG A 134 -3.489 14.076 8.772 1.00 10.00 H new ATOM 0 HH12 ARG A 134 -4.302 14.794 10.167 1.00 10.00 H new ATOM 0 HH21 ARG A 134 -3.732 18.138 9.118 1.00 10.00 H new ATOM 0 HH22 ARG A 134 -4.440 17.105 10.364 1.00 10.00 H new ATOM 1979 N THR A 135 1.669 15.107 4.581 1.00 10.00 N ATOM 1980 CA THR A 135 2.870 14.571 5.176 1.00 10.00 C ATOM 1981 C THR A 135 2.431 13.620 6.291 1.00 10.00 C ATOM 1982 O THR A 135 1.358 13.801 6.869 1.00 10.00 O ATOM 1983 CB THR A 135 3.756 15.724 5.684 1.00 10.00 C ATOM 1984 OG1 THR A 135 4.914 15.223 6.311 1.00 10.00 O ATOM 1985 CG2 THR A 135 3.047 16.654 6.676 1.00 10.00 C ATOM 0 H THR A 135 1.356 15.962 5.041 1.00 10.00 H new ATOM 0 HA THR A 135 3.474 14.017 4.458 1.00 10.00 H new ATOM 0 HB THR A 135 4.007 16.304 4.796 1.00 10.00 H new ATOM 0 HG1 THR A 135 5.431 14.694 5.668 1.00 10.00 H new ATOM 0 HG21 THR A 135 3.732 17.441 6.990 1.00 10.00 H new ATOM 0 HG22 THR A 135 2.176 17.101 6.197 1.00 10.00 H new ATOM 0 HG23 THR A 135 2.728 16.082 7.547 1.00 10.00 H new ATOM 1993 N LEU A 136 3.236 12.595 6.564 1.00 10.00 N ATOM 1994 CA LEU A 136 2.998 11.610 7.602 1.00 10.00 C ATOM 1995 C LEU A 136 4.367 11.059 7.972 1.00 10.00 C ATOM 1996 O LEU A 136 5.217 10.926 7.091 1.00 10.00 O ATOM 1997 CB LEU A 136 2.074 10.501 7.076 1.00 10.00 C ATOM 1998 CG LEU A 136 1.636 9.481 8.140 1.00 10.00 C ATOM 1999 CD1 LEU A 136 0.719 10.111 9.195 1.00 10.00 C ATOM 2000 CD2 LEU A 136 0.898 8.327 7.452 1.00 10.00 C ATOM 0 H LEU A 136 4.100 12.427 6.048 1.00 10.00 H new ATOM 0 HA LEU A 136 2.504 12.043 8.472 1.00 10.00 H new ATOM 0 HB2 LEU A 136 1.185 10.960 6.643 1.00 10.00 H new ATOM 0 HB3 LEU A 136 2.584 9.972 6.271 1.00 10.00 H new ATOM 0 HG LEU A 136 2.530 9.120 8.649 1.00 10.00 H new ATOM 0 HD11 LEU A 136 0.434 9.355 9.927 1.00 10.00 H new ATOM 0 HD12 LEU A 136 1.246 10.922 9.697 1.00 10.00 H new ATOM 0 HD13 LEU A 136 -0.175 10.504 8.712 1.00 10.00 H new ATOM 0 HD21 LEU A 136 0.584 7.599 8.200 1.00 10.00 H new ATOM 0 HD22 LEU A 136 0.022 8.714 6.932 1.00 10.00 H new ATOM 0 HD23 LEU A 136 1.563 7.846 6.734 1.00 10.00 H new ATOM 2012 N ASN A 137 4.575 10.779 9.258 1.00 10.00 N ATOM 2013 CA ASN A 137 5.781 10.209 9.826 1.00 10.00 C ATOM 2014 C ASN A 137 5.578 8.705 9.859 1.00 10.00 C ATOM 2015 O ASN A 137 4.509 8.242 10.252 1.00 10.00 O ATOM 2016 CB ASN A 137 6.024 10.753 11.238 1.00 10.00 C ATOM 2017 CG ASN A 137 4.872 10.431 12.191 1.00 10.00 C ATOM 2018 OD1 ASN A 137 3.732 10.811 11.933 1.00 10.00 O ATOM 2019 ND2 ASN A 137 5.148 9.734 13.290 1.00 10.00 N ATOM 0 H ASN A 137 3.862 10.956 9.965 1.00 10.00 H new ATOM 0 HA ASN A 137 6.655 10.472 9.229 1.00 10.00 H new ATOM 0 HB2 ASN A 137 6.948 10.331 11.633 1.00 10.00 H new ATOM 0 HB3 ASN A 137 6.162 11.833 11.190 1.00 10.00 H new ATOM 0 HD21 ASN A 137 4.403 9.501 13.946 1.00 10.00 H new ATOM 0 HD22 ASN A 137 6.105 9.433 13.476 1.00 10.00 H new ATOM 2026 N VAL A 138 6.565 7.950 9.390 1.00 10.00 N ATOM 2027 CA VAL A 138 6.391 6.541 9.093 1.00 10.00 C ATOM 2028 C VAL A 138 7.635 5.806 9.586 1.00 10.00 C ATOM 2029 O VAL A 138 8.752 6.207 9.274 1.00 10.00 O ATOM 2030 CB VAL A 138 6.134 6.413 7.580 1.00 10.00 C ATOM 2031 CG1 VAL A 138 6.484 5.024 7.026 1.00 10.00 C ATOM 2032 CG2 VAL A 138 4.665 6.717 7.253 1.00 10.00 C ATOM 0 H VAL A 138 7.505 8.301 9.207 1.00 10.00 H new ATOM 0 HA VAL A 138 5.538 6.089 9.598 1.00 10.00 H new ATOM 0 HB VAL A 138 6.790 7.141 7.103 1.00 10.00 H new ATOM 0 HG11 VAL A 138 6.281 4.998 5.955 1.00 10.00 H new ATOM 0 HG12 VAL A 138 7.540 4.818 7.200 1.00 10.00 H new ATOM 0 HG13 VAL A 138 5.880 4.269 7.529 1.00 10.00 H new ATOM 0 HG21 VAL A 138 4.504 6.621 6.179 1.00 10.00 H new ATOM 0 HG22 VAL A 138 4.022 6.013 7.781 1.00 10.00 H new ATOM 0 HG23 VAL A 138 4.425 7.733 7.567 1.00 10.00 H new ATOM 2042 N ALA A 139 7.445 4.750 10.378 1.00 10.00 N ATOM 2043 CA ALA A 139 8.537 3.977 10.947 1.00 10.00 C ATOM 2044 C ALA A 139 9.002 2.951 9.918 1.00 10.00 C ATOM 2045 O ALA A 139 8.292 1.990 9.634 1.00 10.00 O ATOM 2046 CB ALA A 139 8.065 3.310 12.241 1.00 10.00 C ATOM 0 H ALA A 139 6.520 4.409 10.641 1.00 10.00 H new ATOM 0 HA ALA A 139 9.381 4.622 11.193 1.00 10.00 H new ATOM 0 HB1 ALA A 139 8.882 2.730 12.670 1.00 10.00 H new ATOM 0 HB2 ALA A 139 7.751 4.075 12.951 1.00 10.00 H new ATOM 0 HB3 ALA A 139 7.225 2.650 12.025 1.00 10.00 H new ATOM 2052 N ALA A 140 10.182 3.177 9.343 1.00 10.00 N ATOM 2053 CA ALA A 140 10.770 2.318 8.333 1.00 10.00 C ATOM 2054 C ALA A 140 11.688 1.300 8.992 1.00 10.00 C ATOM 2055 O ALA A 140 12.677 1.693 9.610 1.00 10.00 O ATOM 2056 CB ALA A 140 11.568 3.167 7.351 1.00 10.00 C ATOM 0 H ALA A 140 10.764 3.982 9.576 1.00 10.00 H new ATOM 0 HA ALA A 140 9.978 1.791 7.801 1.00 10.00 H new ATOM 0 HB1 ALA A 140 12.011 2.524 6.591 1.00 10.00 H new ATOM 0 HB2 ALA A 140 10.906 3.890 6.874 1.00 10.00 H new ATOM 0 HB3 ALA A 140 12.358 3.695 7.885 1.00 10.00 H new ATOM 2062 N THR A 141 11.390 0.009 8.844 1.00 10.00 N ATOM 2063 CA THR A 141 12.220 -1.051 9.410 1.00 10.00 C ATOM 2064 C THR A 141 13.378 -1.362 8.464 1.00 10.00 C ATOM 2065 O THR A 141 13.185 -1.493 7.256 1.00 10.00 O ATOM 2066 CB THR A 141 11.360 -2.269 9.765 1.00 10.00 C ATOM 2067 OG1 THR A 141 10.432 -1.876 10.756 1.00 10.00 O ATOM 2068 CG2 THR A 141 12.183 -3.438 10.318 1.00 10.00 C ATOM 0 H THR A 141 10.574 -0.328 8.333 1.00 10.00 H new ATOM 0 HA THR A 141 12.669 -0.722 10.347 1.00 10.00 H new ATOM 0 HB THR A 141 10.874 -2.610 8.851 1.00 10.00 H new ATOM 0 HG1 THR A 141 10.913 -1.513 11.529 1.00 10.00 H new ATOM 0 HG21 THR A 141 11.520 -4.271 10.551 1.00 10.00 H new ATOM 0 HG22 THR A 141 12.914 -3.753 9.573 1.00 10.00 H new ATOM 0 HG23 THR A 141 12.701 -3.122 11.223 1.00 10.00 H new ATOM 2076 N VAL A 142 14.595 -1.443 9.000 1.00 10.00 N ATOM 2077 CA VAL A 142 15.812 -1.495 8.214 1.00 10.00 C ATOM 2078 C VAL A 142 16.274 -2.947 8.205 1.00 10.00 C ATOM 2079 O VAL A 142 16.652 -3.461 9.253 1.00 10.00 O ATOM 2080 CB VAL A 142 16.840 -0.558 8.865 1.00 10.00 C ATOM 2081 CG1 VAL A 142 18.183 -0.610 8.134 1.00 10.00 C ATOM 2082 CG2 VAL A 142 16.335 0.893 8.875 1.00 10.00 C ATOM 0 H VAL A 142 14.758 -1.474 10.006 1.00 10.00 H new ATOM 0 HA VAL A 142 15.669 -1.166 7.185 1.00 10.00 H new ATOM 0 HB VAL A 142 16.978 -0.902 9.890 1.00 10.00 H new ATOM 0 HG11 VAL A 142 18.888 0.064 8.620 1.00 10.00 H new ATOM 0 HG12 VAL A 142 18.574 -1.627 8.164 1.00 10.00 H new ATOM 0 HG13 VAL A 142 18.045 -0.305 7.097 1.00 10.00 H new ATOM 0 HG21 VAL A 142 17.082 1.535 9.341 1.00 10.00 H new ATOM 0 HG22 VAL A 142 16.160 1.224 7.851 1.00 10.00 H new ATOM 0 HG23 VAL A 142 15.404 0.950 9.439 1.00 10.00 H new ATOM 2092 N LYS A 143 16.213 -3.629 7.060 1.00 10.00 N ATOM 2093 CA LYS A 143 16.649 -5.010 6.947 1.00 10.00 C ATOM 2094 C LYS A 143 16.991 -5.369 5.495 1.00 10.00 C ATOM 2095 O LYS A 143 16.114 -5.343 4.638 1.00 10.00 O ATOM 2096 CB LYS A 143 15.573 -5.940 7.531 1.00 10.00 C ATOM 2097 CG LYS A 143 14.156 -5.675 6.986 1.00 10.00 C ATOM 2098 CD LYS A 143 13.219 -6.815 7.392 1.00 10.00 C ATOM 2099 CE LYS A 143 11.970 -6.859 6.499 1.00 10.00 C ATOM 2100 NZ LYS A 143 11.210 -8.097 6.743 1.00 10.00 N ATOM 0 H LYS A 143 15.859 -3.234 6.189 1.00 10.00 H new ATOM 0 HA LYS A 143 17.565 -5.142 7.523 1.00 10.00 H new ATOM 0 HB2 LYS A 143 15.846 -6.974 7.319 1.00 10.00 H new ATOM 0 HB3 LYS A 143 15.561 -5.830 8.615 1.00 10.00 H new ATOM 0 HG2 LYS A 143 13.780 -4.728 7.373 1.00 10.00 H new ATOM 0 HG3 LYS A 143 14.185 -5.586 5.900 1.00 10.00 H new ATOM 0 HD2 LYS A 143 13.749 -7.765 7.326 1.00 10.00 H new ATOM 0 HD3 LYS A 143 12.920 -6.689 8.433 1.00 10.00 H new ATOM 0 HE2 LYS A 143 11.340 -5.992 6.700 1.00 10.00 H new ATOM 0 HE3 LYS A 143 12.262 -6.804 5.450 1.00 10.00 H new ATOM 0 HZ1 LYS A 143 10.368 -8.114 6.133 1.00 10.00 H new ATOM 0 HZ2 LYS A 143 11.809 -8.920 6.529 1.00 10.00 H new ATOM 0 HZ3 LYS A 143 10.916 -8.133 7.740 1.00 10.00 H new ATOM 2114 N LYS A 144 18.250 -5.714 5.203 1.00 10.00 N ATOM 2115 CA LYS A 144 18.639 -6.195 3.877 1.00 10.00 C ATOM 2116 C LYS A 144 18.390 -7.695 3.742 1.00 10.00 C ATOM 2117 O LYS A 144 18.088 -8.350 4.732 1.00 10.00 O ATOM 2118 CB LYS A 144 20.115 -5.854 3.608 1.00 10.00 C ATOM 2119 CG LYS A 144 21.039 -6.876 4.282 1.00 10.00 C ATOM 2120 CD LYS A 144 22.446 -6.352 4.579 1.00 10.00 C ATOM 2121 CE LYS A 144 23.394 -7.518 4.912 1.00 10.00 C ATOM 2122 NZ LYS A 144 22.804 -8.502 5.852 1.00 10.00 N ATOM 0 H LYS A 144 19.018 -5.668 5.872 1.00 10.00 H new ATOM 0 HA LYS A 144 18.023 -5.693 3.131 1.00 10.00 H new ATOM 0 HB2 LYS A 144 20.301 -5.841 2.534 1.00 10.00 H new ATOM 0 HB3 LYS A 144 20.336 -4.854 3.982 1.00 10.00 H new ATOM 0 HG2 LYS A 144 20.581 -7.203 5.216 1.00 10.00 H new ATOM 0 HG3 LYS A 144 21.119 -7.754 3.642 1.00 10.00 H new ATOM 0 HD2 LYS A 144 22.825 -5.801 3.718 1.00 10.00 H new ATOM 0 HD3 LYS A 144 22.412 -5.653 5.415 1.00 10.00 H new ATOM 0 HE2 LYS A 144 23.670 -8.028 3.989 1.00 10.00 H new ATOM 0 HE3 LYS A 144 24.312 -7.119 5.343 1.00 10.00 H new ATOM 0 HZ1 LYS A 144 23.540 -9.165 6.168 1.00 10.00 H new ATOM 0 HZ2 LYS A 144 22.411 -8.003 6.675 1.00 10.00 H new ATOM 0 HZ3 LYS A 144 22.047 -9.029 5.373 1.00 10.00 H new