USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 915 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 155:sc= 1.26 USER MOD Set 1.2: A 133 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 119 GLN :FLIP amide:sc= 0.531 F(o=-4.2!,f=1.7) USER MOD Set 2.2: A 137 SER OG : rot -97:sc= 1.18 USER MOD Set 3.1: A 52 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 53 HIS : no HD1:sc= -0.264 K(o=-0.26,f=-1.4) USER MOD Set 4.1: A 48 THR OG1 : rot 140:sc= -0.261 USER MOD Set 4.2: A 87 MET CE :methyl -114:sc= -0.385 (180deg=-0.483) USER MOD Single : A 25 SER OG : rot 11:sc= -1.09! USER MOD Single : A 27 THR OG1 : rot -91:sc= 1.25 USER MOD Single : A 32 LYS NZ :NH3+ -179:sc= 0.113 (180deg=0.0508) USER MOD Single : A 38 SER OG : rot 180:sc= -1.35 USER MOD Single : A 41 TYR OH : rot 165:sc= 1.35 USER MOD Single : A 44 LYS NZ :NH3+ 179:sc= 0.0674 (180deg=0.0401) USER MOD Single : A 46 SER OG : rot -103:sc= 0.588 USER MOD Single : A 49 ASN : amide:sc= -0.943 K(o=-0.94,f=-6.3!) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot -29:sc= 1.09 USER MOD Single : A 58 CYS SG : rot -20:sc= -0.655 USER MOD Single : A 61 SER OG : rot -105:sc= 1.23 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 HIS : no HE2:sc= -2.74! X(o=-2.7!,f=-2.4) USER MOD Single : A 66 SER OG : rot 14:sc= 0.845 USER MOD Single : A 73 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00223) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 10:sc= 0.564 USER MOD Single : A 83 LYS NZ :NH3+ 159:sc= 0.0145 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot -120:sc= -2.02 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0.0768 USER MOD Single : A 103 ASN :FLIP amide:sc= -0.112 F(o=-2.3!,f=-0.11) USER MOD Single : A 116 TYR OH : rot 168:sc= -0.55 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 168:sc= 1.29 (180deg=1.13) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 364 N GLY A 24 8.503 -0.285 -4.856 1.00 0.54 N ATOM 365 CA GLY A 24 7.265 -0.270 -4.096 1.00 0.46 C ATOM 366 C GLY A 24 6.782 -1.561 -3.491 1.00 0.33 C ATOM 367 O GLY A 24 7.557 -2.394 -3.032 1.00 0.39 O ATOM 0 HA2 GLY A 24 7.380 0.453 -3.288 1.00 0.46 H new ATOM 0 HA3 GLY A 24 6.478 0.105 -4.750 1.00 0.46 H new ATOM 371 N SER A 25 5.456 -1.671 -3.511 1.00 0.28 N ATOM 372 CA SER A 25 4.675 -2.697 -2.833 1.00 0.30 C ATOM 373 C SER A 25 3.205 -2.444 -3.156 1.00 0.32 C ATOM 374 O SER A 25 2.313 -2.649 -2.339 1.00 0.39 O ATOM 375 CB SER A 25 4.869 -2.662 -1.321 1.00 0.37 C ATOM 376 OG SER A 25 6.151 -3.126 -0.941 1.00 1.20 O ATOM 0 H SER A 25 4.870 -1.014 -4.026 1.00 0.28 H new ATOM 0 HA SER A 25 5.004 -3.677 -3.178 1.00 0.30 H new ATOM 0 HB2 SER A 25 4.731 -1.642 -0.961 1.00 0.37 H new ATOM 0 HB3 SER A 25 4.105 -3.275 -0.843 1.00 0.37 H new ATOM 0 HG SER A 25 6.716 -3.215 -1.737 1.00 1.20 H new ATOM 382 N VAL A 26 2.978 -1.969 -4.361 1.00 0.28 N ATOM 383 CA VAL A 26 1.647 -1.606 -4.826 1.00 0.30 C ATOM 384 C VAL A 26 1.432 -2.145 -6.227 1.00 0.30 C ATOM 385 O VAL A 26 2.387 -2.301 -6.965 1.00 0.30 O ATOM 386 CB VAL A 26 1.458 -0.077 -4.854 1.00 0.33 C ATOM 387 CG1 VAL A 26 1.414 0.493 -3.449 1.00 0.93 C ATOM 388 CG2 VAL A 26 2.569 0.569 -5.660 1.00 0.88 C ATOM 0 H VAL A 26 3.712 -1.821 -5.053 1.00 0.28 H new ATOM 0 HA VAL A 26 0.924 -2.037 -4.133 1.00 0.30 H new ATOM 0 HB VAL A 26 0.503 0.143 -5.331 1.00 0.33 H new ATOM 0 HG11 VAL A 26 1.280 1.574 -3.499 1.00 0.93 H new ATOM 0 HG12 VAL A 26 0.582 0.049 -2.902 1.00 0.93 H new ATOM 0 HG13 VAL A 26 2.348 0.267 -2.935 1.00 0.93 H new ATOM 0 HG21 VAL A 26 2.427 1.650 -5.674 1.00 0.88 H new ATOM 0 HG22 VAL A 26 3.532 0.335 -5.205 1.00 0.88 H new ATOM 0 HG23 VAL A 26 2.548 0.187 -6.681 1.00 0.88 H new ATOM 398 N THR A 27 0.206 -2.459 -6.586 1.00 0.33 N ATOM 399 CA THR A 27 -0.115 -2.743 -7.969 1.00 0.36 C ATOM 400 C THR A 27 -1.609 -2.595 -8.196 1.00 0.38 C ATOM 401 O THR A 27 -2.037 -1.863 -9.091 1.00 0.48 O ATOM 402 CB THR A 27 0.382 -4.142 -8.408 1.00 0.39 C ATOM 403 OG1 THR A 27 -0.211 -4.522 -9.657 1.00 0.47 O ATOM 404 CG2 THR A 27 0.078 -5.190 -7.351 1.00 0.39 C ATOM 0 H THR A 27 -0.583 -2.524 -5.943 1.00 0.33 H new ATOM 0 HA THR A 27 0.410 -2.017 -8.590 1.00 0.36 H new ATOM 0 HB THR A 27 1.463 -4.083 -8.533 1.00 0.39 H new ATOM 0 HG1 THR A 27 -1.040 -5.017 -9.488 1.00 0.47 H new ATOM 0 HG21 THR A 27 0.439 -6.162 -7.688 1.00 0.39 H new ATOM 0 HG22 THR A 27 0.575 -4.922 -6.419 1.00 0.39 H new ATOM 0 HG23 THR A 27 -0.998 -5.240 -7.187 1.00 0.39 H new ATOM 412 N ASP A 28 -2.408 -3.254 -7.366 1.00 0.35 N ATOM 413 CA ASP A 28 -3.849 -3.174 -7.497 1.00 0.42 C ATOM 414 C ASP A 28 -4.559 -3.537 -6.210 1.00 0.35 C ATOM 415 O ASP A 28 -4.071 -4.331 -5.417 1.00 0.37 O ATOM 416 CB ASP A 28 -4.348 -4.085 -8.609 1.00 0.57 C ATOM 417 CG ASP A 28 -3.666 -5.435 -8.637 1.00 1.08 C ATOM 418 OD1 ASP A 28 -2.614 -5.557 -9.288 1.00 1.69 O ATOM 419 OD2 ASP A 28 -4.168 -6.382 -7.989 1.00 1.44 O ATOM 0 H ASP A 28 -2.081 -3.845 -6.601 1.00 0.35 H new ATOM 0 HA ASP A 28 -4.078 -2.137 -7.740 1.00 0.42 H new ATOM 0 HB2 ASP A 28 -5.422 -4.232 -8.493 1.00 0.57 H new ATOM 0 HB3 ASP A 28 -4.196 -3.590 -9.568 1.00 0.57 H new ATOM 424 N VAL A 29 -5.722 -2.940 -6.019 1.00 0.39 N ATOM 425 CA VAL A 29 -6.569 -3.240 -4.880 1.00 0.41 C ATOM 426 C VAL A 29 -7.998 -3.467 -5.371 1.00 0.37 C ATOM 427 O VAL A 29 -8.550 -2.637 -6.096 1.00 0.42 O ATOM 428 CB VAL A 29 -6.530 -2.104 -3.833 1.00 0.60 C ATOM 429 CG1 VAL A 29 -7.397 -2.446 -2.638 1.00 1.13 C ATOM 430 CG2 VAL A 29 -5.100 -1.834 -3.385 1.00 1.14 C ATOM 0 H VAL A 29 -6.105 -2.235 -6.649 1.00 0.39 H new ATOM 0 HA VAL A 29 -6.198 -4.142 -4.392 1.00 0.41 H new ATOM 0 HB VAL A 29 -6.924 -1.201 -4.300 1.00 0.60 H new ATOM 0 HG11 VAL A 29 -7.355 -1.633 -1.913 1.00 1.13 H new ATOM 0 HG12 VAL A 29 -8.427 -2.588 -2.965 1.00 1.13 H new ATOM 0 HG13 VAL A 29 -7.033 -3.363 -2.175 1.00 1.13 H new ATOM 0 HG21 VAL A 29 -5.095 -1.031 -2.648 1.00 1.14 H new ATOM 0 HG22 VAL A 29 -4.681 -2.737 -2.941 1.00 1.14 H new ATOM 0 HG23 VAL A 29 -4.498 -1.541 -4.245 1.00 1.14 H new ATOM 440 N ASP A 30 -8.583 -4.589 -4.983 1.00 0.37 N ATOM 441 CA ASP A 30 -9.850 -5.036 -5.555 1.00 0.38 C ATOM 442 C ASP A 30 -10.932 -5.147 -4.486 1.00 0.42 C ATOM 443 O ASP A 30 -10.702 -5.701 -3.409 1.00 0.54 O ATOM 444 CB ASP A 30 -9.669 -6.384 -6.249 1.00 0.51 C ATOM 445 CG ASP A 30 -10.978 -6.945 -6.760 1.00 1.00 C ATOM 446 OD1 ASP A 30 -11.459 -6.476 -7.814 1.00 1.16 O ATOM 447 OD2 ASP A 30 -11.523 -7.871 -6.119 1.00 1.83 O ATOM 0 H ASP A 30 -8.201 -5.212 -4.271 1.00 0.37 H new ATOM 0 HA ASP A 30 -10.167 -4.292 -6.286 1.00 0.38 H new ATOM 0 HB2 ASP A 30 -8.974 -6.272 -7.081 1.00 0.51 H new ATOM 0 HB3 ASP A 30 -9.220 -7.092 -5.552 1.00 0.51 H new ATOM 452 N LEU A 31 -12.117 -4.647 -4.802 1.00 0.47 N ATOM 453 CA LEU A 31 -13.181 -4.513 -3.819 1.00 0.57 C ATOM 454 C LEU A 31 -14.164 -5.680 -3.882 1.00 0.58 C ATOM 455 O LEU A 31 -14.684 -6.013 -4.948 1.00 0.67 O ATOM 456 CB LEU A 31 -13.909 -3.170 -4.042 1.00 0.71 C ATOM 457 CG LEU A 31 -14.941 -2.756 -2.979 1.00 0.85 C ATOM 458 CD1 LEU A 31 -16.295 -3.394 -3.249 1.00 0.94 C ATOM 459 CD2 LEU A 31 -14.451 -3.126 -1.589 1.00 0.86 C ATOM 0 H LEU A 31 -12.367 -4.326 -5.737 1.00 0.47 H new ATOM 0 HA LEU A 31 -12.737 -4.529 -2.823 1.00 0.57 H new ATOM 0 HB2 LEU A 31 -13.158 -2.383 -4.110 1.00 0.71 H new ATOM 0 HB3 LEU A 31 -14.414 -3.213 -5.007 1.00 0.71 H new ATOM 0 HG LEU A 31 -15.061 -1.674 -3.033 1.00 0.85 H new ATOM 0 HD11 LEU A 31 -17.003 -3.083 -2.481 1.00 0.94 H new ATOM 0 HD12 LEU A 31 -16.658 -3.078 -4.227 1.00 0.94 H new ATOM 0 HD13 LEU A 31 -16.196 -4.479 -3.232 1.00 0.94 H new ATOM 0 HD21 LEU A 31 -15.193 -2.826 -0.850 1.00 0.86 H new ATOM 0 HD22 LEU A 31 -14.297 -4.204 -1.532 1.00 0.86 H new ATOM 0 HD23 LEU A 31 -13.510 -2.614 -1.387 1.00 0.86 H new ATOM 471 N LYS A 32 -14.392 -6.306 -2.732 1.00 0.56 N ATOM 472 CA LYS A 32 -15.500 -7.237 -2.567 1.00 0.60 C ATOM 473 C LYS A 32 -16.293 -6.876 -1.311 1.00 0.82 C ATOM 474 O LYS A 32 -16.865 -5.791 -1.250 1.00 1.33 O ATOM 475 CB LYS A 32 -15.052 -8.708 -2.540 1.00 0.62 C ATOM 476 CG LYS A 32 -13.883 -9.006 -1.618 1.00 0.65 C ATOM 477 CD LYS A 32 -12.555 -8.891 -2.358 1.00 0.90 C ATOM 478 CE LYS A 32 -12.522 -9.830 -3.558 1.00 1.10 C ATOM 479 NZ LYS A 32 -11.240 -9.769 -4.307 1.00 1.32 N ATOM 0 H LYS A 32 -13.820 -6.184 -1.897 1.00 0.56 H new ATOM 0 HA LYS A 32 -16.143 -7.139 -3.442 1.00 0.60 H new ATOM 0 HB2 LYS A 32 -15.899 -9.325 -2.239 1.00 0.62 H new ATOM 0 HB3 LYS A 32 -14.783 -9.009 -3.552 1.00 0.62 H new ATOM 0 HG2 LYS A 32 -13.895 -8.314 -0.776 1.00 0.65 H new ATOM 0 HG3 LYS A 32 -13.987 -10.010 -1.207 1.00 0.65 H new ATOM 0 HD2 LYS A 32 -12.406 -7.864 -2.690 1.00 0.90 H new ATOM 0 HD3 LYS A 32 -11.734 -9.129 -1.681 1.00 0.90 H new ATOM 0 HE2 LYS A 32 -12.689 -10.852 -3.218 1.00 1.10 H new ATOM 0 HE3 LYS A 32 -13.342 -9.580 -4.231 1.00 1.10 H new ATOM 0 HZ1 LYS A 32 -11.282 -10.415 -5.121 1.00 1.32 H new ATOM 0 HZ2 LYS A 32 -11.081 -8.798 -4.644 1.00 1.32 H new ATOM 0 HZ3 LYS A 32 -10.459 -10.051 -3.681 1.00 1.32 H new ATOM 493 N ASP A 33 -16.283 -7.744 -0.293 1.00 0.60 N ATOM 494 CA ASP A 33 -17.144 -7.552 0.879 1.00 0.94 C ATOM 495 C ASP A 33 -17.108 -8.745 1.813 1.00 0.53 C ATOM 496 O ASP A 33 -16.471 -9.752 1.514 1.00 1.46 O ATOM 497 CB ASP A 33 -18.583 -7.323 0.451 1.00 2.08 C ATOM 498 CG ASP A 33 -19.200 -8.522 -0.248 1.00 2.37 C ATOM 499 OD1 ASP A 33 -18.966 -8.704 -1.464 1.00 2.85 O ATOM 500 OD2 ASP A 33 -19.930 -9.284 0.414 1.00 2.32 O ATOM 0 H ASP A 33 -15.695 -8.577 -0.256 1.00 0.60 H new ATOM 0 HA ASP A 33 -16.761 -6.679 1.407 1.00 0.94 H new ATOM 0 HB2 ASP A 33 -19.181 -7.075 1.328 1.00 2.08 H new ATOM 0 HB3 ASP A 33 -18.624 -6.462 -0.216 1.00 2.08 H new ATOM 571 N SER A 38 -17.721 -6.267 8.105 1.00 0.54 N ATOM 572 CA SER A 38 -16.716 -5.469 7.449 1.00 0.48 C ATOM 573 C SER A 38 -16.898 -5.696 5.963 1.00 0.50 C ATOM 574 O SER A 38 -17.826 -6.387 5.561 1.00 0.94 O ATOM 575 CB SER A 38 -15.311 -5.888 7.910 1.00 0.55 C ATOM 576 OG SER A 38 -14.309 -5.026 7.394 1.00 0.76 O ATOM 0 HA SER A 38 -16.821 -4.412 7.694 1.00 0.48 H new ATOM 0 HB2 SER A 38 -15.269 -5.883 8.999 1.00 0.55 H new ATOM 0 HB3 SER A 38 -15.112 -6.910 7.588 1.00 0.55 H new ATOM 0 HG SER A 38 -13.429 -5.322 7.709 1.00 0.76 H new ATOM 582 N VAL A 39 -16.097 -5.070 5.153 1.00 0.33 N ATOM 583 CA VAL A 39 -16.017 -5.443 3.761 1.00 0.35 C ATOM 584 C VAL A 39 -14.565 -5.758 3.431 1.00 0.31 C ATOM 585 O VAL A 39 -13.665 -5.419 4.201 1.00 0.34 O ATOM 586 CB VAL A 39 -16.650 -4.355 2.857 1.00 0.43 C ATOM 587 CG1 VAL A 39 -16.109 -4.365 1.435 1.00 0.86 C ATOM 588 CG2 VAL A 39 -18.162 -4.559 2.835 1.00 0.86 C ATOM 0 H VAL A 39 -15.488 -4.299 5.426 1.00 0.33 H new ATOM 0 HA VAL A 39 -16.602 -6.342 3.565 1.00 0.35 H new ATOM 0 HB VAL A 39 -16.389 -3.384 3.278 1.00 0.43 H new ATOM 0 HG11 VAL A 39 -16.594 -3.579 0.856 1.00 0.86 H new ATOM 0 HG12 VAL A 39 -15.033 -4.191 1.454 1.00 0.86 H new ATOM 0 HG13 VAL A 39 -16.312 -5.332 0.975 1.00 0.86 H new ATOM 0 HG21 VAL A 39 -18.622 -3.800 2.202 1.00 0.86 H new ATOM 0 HG22 VAL A 39 -18.390 -5.549 2.439 1.00 0.86 H new ATOM 0 HG23 VAL A 39 -18.555 -4.474 3.848 1.00 0.86 H new ATOM 598 N GLU A 40 -14.321 -6.460 2.350 1.00 0.33 N ATOM 599 CA GLU A 40 -12.995 -6.965 2.107 1.00 0.36 C ATOM 600 C GLU A 40 -12.357 -6.329 0.893 1.00 0.38 C ATOM 601 O GLU A 40 -12.964 -6.232 -0.177 1.00 0.50 O ATOM 602 CB GLU A 40 -13.026 -8.478 1.990 1.00 0.52 C ATOM 603 CG GLU A 40 -13.156 -9.154 3.341 1.00 0.62 C ATOM 604 CD GLU A 40 -13.162 -10.665 3.245 1.00 0.89 C ATOM 605 OE1 GLU A 40 -13.605 -11.200 2.212 1.00 1.16 O ATOM 606 OE2 GLU A 40 -12.729 -11.327 4.211 1.00 1.19 O ATOM 0 H GLU A 40 -15.012 -6.691 1.636 1.00 0.33 H new ATOM 0 HA GLU A 40 -12.372 -6.695 2.960 1.00 0.36 H new ATOM 0 HB2 GLU A 40 -13.861 -8.775 1.355 1.00 0.52 H new ATOM 0 HB3 GLU A 40 -12.115 -8.822 1.500 1.00 0.52 H new ATOM 0 HG2 GLU A 40 -12.331 -8.839 3.980 1.00 0.62 H new ATOM 0 HG3 GLU A 40 -14.076 -8.822 3.821 1.00 0.62 H new ATOM 613 N TYR A 41 -11.126 -5.893 1.078 1.00 0.37 N ATOM 614 CA TYR A 41 -10.372 -5.263 0.007 1.00 0.56 C ATOM 615 C TYR A 41 -9.142 -6.090 -0.297 1.00 0.43 C ATOM 616 O TYR A 41 -8.173 -6.059 0.464 1.00 0.40 O ATOM 617 CB TYR A 41 -9.924 -3.862 0.422 1.00 0.89 C ATOM 618 CG TYR A 41 -10.258 -2.768 -0.563 1.00 0.86 C ATOM 619 CD1 TYR A 41 -10.706 -3.077 -1.841 1.00 1.65 C ATOM 620 CD2 TYR A 41 -10.137 -1.431 -0.220 1.00 1.30 C ATOM 621 CE1 TYR A 41 -11.021 -2.083 -2.749 1.00 2.63 C ATOM 622 CE2 TYR A 41 -10.450 -0.431 -1.120 1.00 2.04 C ATOM 623 CZ TYR A 41 -10.856 -0.744 -2.375 1.00 2.72 C ATOM 624 OH TYR A 41 -11.200 0.238 -3.275 1.00 3.73 O ATOM 0 H TYR A 41 -10.624 -5.963 1.963 1.00 0.37 H new ATOM 0 HA TYR A 41 -11.012 -5.194 -0.873 1.00 0.56 H new ATOM 0 HB2 TYR A 41 -10.382 -3.619 1.381 1.00 0.89 H new ATOM 0 HB3 TYR A 41 -8.845 -3.873 0.578 1.00 0.89 H new ATOM 0 HD1 TYR A 41 -10.810 -4.112 -2.131 1.00 1.65 H new ATOM 0 HD2 TYR A 41 -9.792 -1.166 0.768 1.00 1.30 H new ATOM 0 HE1 TYR A 41 -11.389 -2.336 -3.732 1.00 2.63 H new ATOM 0 HE2 TYR A 41 -10.371 0.604 -0.823 1.00 2.04 H new ATOM 0 HH TYR A 41 -11.264 1.099 -2.811 1.00 3.73 H new ATOM 634 N LEU A 42 -9.175 -6.833 -1.387 1.00 0.41 N ATOM 635 CA LEU A 42 -8.005 -7.599 -1.790 1.00 0.38 C ATOM 636 C LEU A 42 -6.968 -6.629 -2.323 1.00 0.34 C ATOM 637 O LEU A 42 -7.132 -6.070 -3.403 1.00 0.38 O ATOM 638 CB LEU A 42 -8.369 -8.635 -2.870 1.00 0.49 C ATOM 639 CG LEU A 42 -7.393 -9.819 -3.060 1.00 0.55 C ATOM 640 CD1 LEU A 42 -5.976 -9.355 -3.360 1.00 0.71 C ATOM 641 CD2 LEU A 42 -7.397 -10.721 -1.841 1.00 0.81 C ATOM 0 H LEU A 42 -9.984 -6.924 -2.002 1.00 0.41 H new ATOM 0 HA LEU A 42 -7.611 -8.144 -0.932 1.00 0.38 H new ATOM 0 HB2 LEU A 42 -9.353 -9.041 -2.633 1.00 0.49 H new ATOM 0 HB3 LEU A 42 -8.460 -8.114 -3.823 1.00 0.49 H new ATOM 0 HG LEU A 42 -7.746 -10.383 -3.924 1.00 0.55 H new ATOM 0 HD11 LEU A 42 -5.328 -10.222 -3.485 1.00 0.71 H new ATOM 0 HD12 LEU A 42 -5.973 -8.764 -4.276 1.00 0.71 H new ATOM 0 HD13 LEU A 42 -5.610 -8.745 -2.534 1.00 0.71 H new ATOM 0 HD21 LEU A 42 -6.703 -11.547 -1.997 1.00 0.81 H new ATOM 0 HD22 LEU A 42 -7.090 -10.150 -0.965 1.00 0.81 H new ATOM 0 HD23 LEU A 42 -8.401 -11.115 -1.683 1.00 0.81 H new ATOM 653 N ALA A 43 -5.902 -6.435 -1.582 1.00 0.33 N ATOM 654 CA ALA A 43 -4.872 -5.517 -1.999 1.00 0.36 C ATOM 655 C ALA A 43 -3.652 -6.286 -2.446 1.00 0.35 C ATOM 656 O ALA A 43 -2.895 -6.810 -1.633 1.00 0.37 O ATOM 657 CB ALA A 43 -4.530 -4.548 -0.877 1.00 0.42 C ATOM 0 H ALA A 43 -5.727 -6.899 -0.691 1.00 0.33 H new ATOM 0 HA ALA A 43 -5.239 -4.930 -2.841 1.00 0.36 H new ATOM 0 HB1 ALA A 43 -3.751 -3.864 -1.212 1.00 0.42 H new ATOM 0 HB2 ALA A 43 -5.419 -3.980 -0.604 1.00 0.42 H new ATOM 0 HB3 ALA A 43 -4.175 -5.106 -0.010 1.00 0.42 H new ATOM 663 N LYS A 44 -3.479 -6.378 -3.746 1.00 0.38 N ATOM 664 CA LYS A 44 -2.331 -7.046 -4.290 1.00 0.39 C ATOM 665 C LYS A 44 -1.169 -6.075 -4.323 1.00 0.36 C ATOM 666 O LYS A 44 -1.306 -4.914 -4.724 1.00 0.47 O ATOM 667 CB LYS A 44 -2.631 -7.621 -5.676 1.00 0.53 C ATOM 668 CG LYS A 44 -1.406 -8.171 -6.386 1.00 0.95 C ATOM 669 CD LYS A 44 -1.717 -9.430 -7.182 1.00 1.58 C ATOM 670 CE LYS A 44 -2.851 -9.232 -8.178 1.00 1.61 C ATOM 671 NZ LYS A 44 -2.489 -8.277 -9.257 1.00 2.63 N ATOM 0 H LYS A 44 -4.121 -5.997 -4.441 1.00 0.38 H new ATOM 0 HA LYS A 44 -2.066 -7.892 -3.655 1.00 0.39 H new ATOM 0 HB2 LYS A 44 -3.371 -8.416 -5.578 1.00 0.53 H new ATOM 0 HB3 LYS A 44 -3.079 -6.843 -6.294 1.00 0.53 H new ATOM 0 HG2 LYS A 44 -1.005 -7.410 -7.056 1.00 0.95 H new ATOM 0 HG3 LYS A 44 -0.631 -8.390 -5.652 1.00 0.95 H new ATOM 0 HD2 LYS A 44 -0.821 -9.747 -7.716 1.00 1.58 H new ATOM 0 HD3 LYS A 44 -1.980 -10.234 -6.494 1.00 1.58 H new ATOM 0 HE2 LYS A 44 -3.117 -10.193 -8.619 1.00 1.61 H new ATOM 0 HE3 LYS A 44 -3.734 -8.867 -7.653 1.00 1.61 H new ATOM 0 HZ1 LYS A 44 -3.284 -8.186 -9.921 1.00 2.63 H new ATOM 0 HZ2 LYS A 44 -2.277 -7.348 -8.841 1.00 2.63 H new ATOM 0 HZ3 LYS A 44 -1.652 -8.628 -9.765 1.00 2.63 H new ATOM 685 N VAL A 45 -0.042 -6.553 -3.866 1.00 0.31 N ATOM 686 CA VAL A 45 1.136 -5.741 -3.677 1.00 0.33 C ATOM 687 C VAL A 45 2.193 -6.101 -4.695 1.00 0.28 C ATOM 688 O VAL A 45 2.339 -7.265 -5.053 1.00 0.30 O ATOM 689 CB VAL A 45 1.688 -5.988 -2.264 1.00 0.44 C ATOM 690 CG1 VAL A 45 3.113 -5.499 -2.117 1.00 0.82 C ATOM 691 CG2 VAL A 45 0.790 -5.336 -1.231 1.00 0.51 C ATOM 0 H VAL A 45 0.088 -7.532 -3.610 1.00 0.31 H new ATOM 0 HA VAL A 45 0.871 -4.691 -3.802 1.00 0.33 H new ATOM 0 HB VAL A 45 1.700 -7.065 -2.098 1.00 0.44 H new ATOM 0 HG11 VAL A 45 3.462 -5.694 -1.103 1.00 0.82 H new ATOM 0 HG12 VAL A 45 3.752 -6.023 -2.828 1.00 0.82 H new ATOM 0 HG13 VAL A 45 3.152 -4.428 -2.314 1.00 0.82 H new ATOM 0 HG21 VAL A 45 1.191 -5.518 -0.234 1.00 0.51 H new ATOM 0 HG22 VAL A 45 0.745 -4.262 -1.414 1.00 0.51 H new ATOM 0 HG23 VAL A 45 -0.212 -5.759 -1.302 1.00 0.51 H new ATOM 701 N SER A 46 2.906 -5.116 -5.196 1.00 0.25 N ATOM 702 CA SER A 46 4.074 -5.413 -5.973 1.00 0.25 C ATOM 703 C SER A 46 5.291 -4.791 -5.311 1.00 0.24 C ATOM 704 O SER A 46 5.537 -3.593 -5.420 1.00 0.26 O ATOM 705 CB SER A 46 3.890 -4.937 -7.413 1.00 0.28 C ATOM 706 OG SER A 46 4.377 -3.627 -7.629 1.00 0.72 O ATOM 0 H SER A 46 2.698 -4.124 -5.079 1.00 0.25 H new ATOM 0 HA SER A 46 4.229 -6.491 -6.014 1.00 0.25 H new ATOM 0 HB2 SER A 46 4.403 -5.625 -8.085 1.00 0.28 H new ATOM 0 HB3 SER A 46 2.831 -4.972 -7.669 1.00 0.28 H new ATOM 0 HG SER A 46 3.624 -3.001 -7.669 1.00 0.72 H new ATOM 712 N VAL A 47 6.044 -5.602 -4.600 1.00 0.25 N ATOM 713 CA VAL A 47 7.193 -5.097 -3.890 1.00 0.28 C ATOM 714 C VAL A 47 8.340 -4.970 -4.860 1.00 0.28 C ATOM 715 O VAL A 47 8.836 -5.961 -5.395 1.00 0.30 O ATOM 716 CB VAL A 47 7.619 -6.003 -2.706 1.00 0.41 C ATOM 717 CG1 VAL A 47 8.846 -5.429 -2.009 1.00 1.14 C ATOM 718 CG2 VAL A 47 6.484 -6.182 -1.706 1.00 1.05 C ATOM 0 H VAL A 47 5.882 -6.604 -4.500 1.00 0.25 H new ATOM 0 HA VAL A 47 6.921 -4.130 -3.467 1.00 0.28 H new ATOM 0 HB VAL A 47 7.868 -6.983 -3.113 1.00 0.41 H new ATOM 0 HG11 VAL A 47 9.131 -6.078 -1.181 1.00 1.14 H new ATOM 0 HG12 VAL A 47 9.671 -5.364 -2.719 1.00 1.14 H new ATOM 0 HG13 VAL A 47 8.616 -4.434 -1.628 1.00 1.14 H new ATOM 0 HG21 VAL A 47 6.817 -6.822 -0.889 1.00 1.05 H new ATOM 0 HG22 VAL A 47 6.192 -5.210 -1.309 1.00 1.05 H new ATOM 0 HG23 VAL A 47 5.630 -6.642 -2.203 1.00 1.05 H new ATOM 728 N THR A 48 8.727 -3.740 -5.121 1.00 0.30 N ATOM 729 CA THR A 48 9.814 -3.485 -6.020 1.00 0.31 C ATOM 730 C THR A 48 11.030 -3.142 -5.193 1.00 0.34 C ATOM 731 O THR A 48 11.069 -2.089 -4.563 1.00 0.37 O ATOM 732 CB THR A 48 9.489 -2.333 -6.981 1.00 0.36 C ATOM 733 OG1 THR A 48 8.107 -2.394 -7.354 1.00 0.41 O ATOM 734 CG2 THR A 48 10.357 -2.407 -8.225 1.00 0.41 C ATOM 0 H THR A 48 8.300 -2.905 -4.719 1.00 0.30 H new ATOM 0 HA THR A 48 9.997 -4.371 -6.628 1.00 0.31 H new ATOM 0 HB THR A 48 9.692 -1.390 -6.473 1.00 0.36 H new ATOM 0 HG1 THR A 48 7.735 -1.488 -7.380 1.00 0.41 H new ATOM 0 HG21 THR A 48 10.109 -1.581 -8.891 1.00 0.41 H new ATOM 0 HG22 THR A 48 11.407 -2.341 -7.940 1.00 0.41 H new ATOM 0 HG23 THR A 48 10.179 -3.352 -8.737 1.00 0.41 H new ATOM 742 N ASN A 49 11.988 -4.057 -5.190 1.00 0.38 N ATOM 743 CA ASN A 49 13.202 -3.937 -4.390 1.00 0.44 C ATOM 744 C ASN A 49 14.258 -3.178 -5.168 1.00 0.42 C ATOM 745 O ASN A 49 14.633 -3.587 -6.266 1.00 0.46 O ATOM 746 CB ASN A 49 13.691 -5.344 -4.025 1.00 0.59 C ATOM 747 CG ASN A 49 15.160 -5.438 -3.646 1.00 0.73 C ATOM 748 OD1 ASN A 49 15.750 -4.516 -3.085 1.00 1.48 O ATOM 749 ND2 ASN A 49 15.761 -6.575 -3.967 1.00 0.76 N ATOM 0 H ASN A 49 11.946 -4.911 -5.746 1.00 0.38 H new ATOM 0 HA ASN A 49 12.998 -3.382 -3.474 1.00 0.44 H new ATOM 0 HB2 ASN A 49 13.093 -5.715 -3.193 1.00 0.59 H new ATOM 0 HB3 ASN A 49 13.507 -6.007 -4.871 1.00 0.59 H new ATOM 0 HD21 ASN A 49 16.748 -6.709 -3.749 1.00 0.76 H new ATOM 0 HD22 ASN A 49 15.236 -7.316 -4.432 1.00 0.76 H new ATOM 756 N PRO A 50 14.742 -2.067 -4.591 1.00 0.46 N ATOM 757 CA PRO A 50 15.627 -1.120 -5.260 1.00 0.51 C ATOM 758 C PRO A 50 17.109 -1.486 -5.195 1.00 0.53 C ATOM 759 O PRO A 50 17.960 -0.681 -5.578 1.00 0.65 O ATOM 760 CB PRO A 50 15.387 0.195 -4.489 1.00 0.64 C ATOM 761 CG PRO A 50 14.428 -0.126 -3.383 1.00 0.73 C ATOM 762 CD PRO A 50 14.435 -1.619 -3.232 1.00 0.55 C ATOM 0 HA PRO A 50 15.406 -1.081 -6.327 1.00 0.51 H new ATOM 0 HB2 PRO A 50 16.323 0.586 -4.089 1.00 0.64 H new ATOM 0 HB3 PRO A 50 14.977 0.961 -5.147 1.00 0.64 H new ATOM 0 HG2 PRO A 50 14.730 0.359 -2.455 1.00 0.73 H new ATOM 0 HG3 PRO A 50 13.427 0.235 -3.620 1.00 0.73 H new ATOM 0 HD2 PRO A 50 15.185 -1.952 -2.515 1.00 0.55 H new ATOM 0 HD3 PRO A 50 13.473 -1.998 -2.886 1.00 0.55 H new ATOM 770 N TYR A 51 17.435 -2.680 -4.718 1.00 0.53 N ATOM 771 CA TYR A 51 18.832 -3.068 -4.616 1.00 0.68 C ATOM 772 C TYR A 51 19.235 -3.901 -5.836 1.00 0.88 C ATOM 773 O TYR A 51 19.252 -3.383 -6.948 1.00 1.88 O ATOM 774 CB TYR A 51 19.097 -3.806 -3.296 1.00 0.74 C ATOM 775 CG TYR A 51 20.566 -3.885 -2.941 1.00 0.88 C ATOM 776 CD1 TYR A 51 21.216 -2.789 -2.393 1.00 1.22 C ATOM 777 CD2 TYR A 51 21.304 -5.042 -3.158 1.00 1.06 C ATOM 778 CE1 TYR A 51 22.557 -2.842 -2.070 1.00 1.63 C ATOM 779 CE2 TYR A 51 22.645 -5.102 -2.837 1.00 1.36 C ATOM 780 CZ TYR A 51 23.266 -4.000 -2.294 1.00 1.64 C ATOM 781 OH TYR A 51 24.603 -4.055 -1.976 1.00 2.08 O ATOM 0 H TYR A 51 16.766 -3.382 -4.402 1.00 0.53 H new ATOM 0 HA TYR A 51 19.453 -2.172 -4.608 1.00 0.68 H new ATOM 0 HB2 TYR A 51 18.562 -3.301 -2.491 1.00 0.74 H new ATOM 0 HB3 TYR A 51 18.692 -4.816 -3.364 1.00 0.74 H new ATOM 0 HD1 TYR A 51 20.663 -1.878 -2.216 1.00 1.22 H new ATOM 0 HD2 TYR A 51 20.821 -5.908 -3.585 1.00 1.06 H new ATOM 0 HE1 TYR A 51 23.047 -1.979 -1.644 1.00 1.63 H new ATOM 0 HE2 TYR A 51 23.204 -6.009 -3.011 1.00 1.36 H new ATOM 0 HH TYR A 51 24.955 -4.943 -2.195 1.00 2.08 H new ATOM 791 N SER A 52 19.556 -5.179 -5.637 1.00 0.69 N ATOM 792 CA SER A 52 19.864 -6.068 -6.745 1.00 0.66 C ATOM 793 C SER A 52 19.929 -7.525 -6.301 1.00 0.65 C ATOM 794 O SER A 52 20.462 -8.369 -7.013 1.00 0.77 O ATOM 795 CB SER A 52 21.193 -5.655 -7.374 1.00 0.80 C ATOM 796 OG SER A 52 22.203 -5.500 -6.388 1.00 1.51 O ATOM 0 H SER A 52 19.608 -5.617 -4.717 1.00 0.69 H new ATOM 0 HA SER A 52 19.062 -5.984 -7.479 1.00 0.66 H new ATOM 0 HB2 SER A 52 21.503 -6.406 -8.101 1.00 0.80 H new ATOM 0 HB3 SER A 52 21.065 -4.719 -7.918 1.00 0.80 H new ATOM 0 HG SER A 52 23.043 -5.237 -6.819 1.00 1.51 H new ATOM 802 N HIS A 53 19.360 -7.833 -5.140 1.00 0.58 N ATOM 803 CA HIS A 53 19.382 -9.192 -4.619 1.00 0.66 C ATOM 804 C HIS A 53 18.121 -9.448 -3.820 1.00 0.65 C ATOM 805 O HIS A 53 17.592 -8.534 -3.186 1.00 1.08 O ATOM 806 CB HIS A 53 20.608 -9.439 -3.726 1.00 0.74 C ATOM 807 CG HIS A 53 21.922 -9.271 -4.423 1.00 0.95 C ATOM 808 ND1 HIS A 53 22.802 -8.261 -4.119 1.00 1.06 N ATOM 809 CD2 HIS A 53 22.489 -9.967 -5.441 1.00 1.41 C ATOM 810 CE1 HIS A 53 23.845 -8.331 -4.918 1.00 1.43 C ATOM 811 NE2 HIS A 53 23.685 -9.358 -5.730 1.00 1.67 N ATOM 0 H HIS A 53 18.879 -7.160 -4.544 1.00 0.58 H new ATOM 0 HA HIS A 53 19.438 -9.874 -5.467 1.00 0.66 H new ATOM 0 HB2 HIS A 53 20.569 -8.754 -2.879 1.00 0.74 H new ATOM 0 HB3 HIS A 53 20.551 -10.450 -3.322 1.00 0.74 H new ATOM 0 HD2 HIS A 53 22.077 -10.836 -5.931 1.00 1.41 H new ATOM 0 HE1 HIS A 53 24.691 -7.660 -4.910 1.00 1.43 H new ATOM 0 HE2 HIS A 53 24.342 -9.651 -6.453 1.00 1.67 H new ATOM 820 N SER A 54 17.619 -10.665 -3.929 1.00 0.55 N ATOM 821 CA SER A 54 16.535 -11.170 -3.110 1.00 0.51 C ATOM 822 C SER A 54 16.657 -10.761 -1.650 1.00 0.47 C ATOM 823 O SER A 54 17.295 -11.456 -0.890 1.00 0.51 O ATOM 824 CB SER A 54 16.570 -12.699 -3.187 1.00 0.61 C ATOM 825 OG SER A 54 16.735 -13.125 -4.530 1.00 1.39 O ATOM 0 H SER A 54 17.963 -11.345 -4.607 1.00 0.55 H new ATOM 0 HA SER A 54 15.602 -10.752 -3.488 1.00 0.51 H new ATOM 0 HB2 SER A 54 17.387 -13.081 -2.575 1.00 0.61 H new ATOM 0 HB3 SER A 54 15.647 -13.111 -2.779 1.00 0.61 H new ATOM 0 HG SER A 54 16.343 -12.461 -5.134 1.00 1.39 H new ATOM 831 N ILE A 55 15.962 -9.718 -1.216 1.00 0.44 N ATOM 832 CA ILE A 55 16.107 -9.289 0.168 1.00 0.49 C ATOM 833 C ILE A 55 15.368 -10.278 1.034 1.00 0.58 C ATOM 834 O ILE A 55 14.750 -11.172 0.502 1.00 1.03 O ATOM 835 CB ILE A 55 15.553 -7.873 0.434 1.00 0.49 C ATOM 836 CG1 ILE A 55 14.207 -7.654 -0.252 1.00 0.47 C ATOM 837 CG2 ILE A 55 16.558 -6.821 -0.001 1.00 0.48 C ATOM 838 CD1 ILE A 55 13.496 -6.400 0.200 1.00 0.56 C ATOM 0 H ILE A 55 15.313 -9.169 -1.780 1.00 0.44 H new ATOM 0 HA ILE A 55 17.172 -9.252 0.397 1.00 0.49 H new ATOM 0 HB ILE A 55 15.389 -7.777 1.507 1.00 0.49 H new ATOM 0 HG12 ILE A 55 14.361 -7.606 -1.330 1.00 0.47 H new ATOM 0 HG13 ILE A 55 13.566 -8.515 -0.060 1.00 0.47 H new ATOM 0 HG21 ILE A 55 16.152 -5.828 0.193 1.00 0.48 H new ATOM 0 HG22 ILE A 55 17.485 -6.950 0.558 1.00 0.48 H new ATOM 0 HG23 ILE A 55 16.759 -6.929 -1.067 1.00 0.48 H new ATOM 0 HD11 ILE A 55 12.547 -6.309 -0.329 1.00 0.56 H new ATOM 0 HD12 ILE A 55 13.310 -6.454 1.273 1.00 0.56 H new ATOM 0 HD13 ILE A 55 14.117 -5.531 -0.017 1.00 0.56 H new ATOM 850 N PRO A 56 15.495 -10.230 2.355 1.00 0.35 N ATOM 851 CA PRO A 56 14.822 -11.187 3.199 1.00 0.34 C ATOM 852 C PRO A 56 13.438 -10.751 3.668 1.00 0.30 C ATOM 853 O PRO A 56 12.439 -11.388 3.346 1.00 0.32 O ATOM 854 CB PRO A 56 15.764 -11.327 4.385 1.00 0.37 C ATOM 855 CG PRO A 56 16.646 -10.110 4.383 1.00 0.35 C ATOM 856 CD PRO A 56 16.342 -9.323 3.130 1.00 0.35 C ATOM 0 HA PRO A 56 14.629 -12.113 2.657 1.00 0.34 H new ATOM 0 HB2 PRO A 56 15.204 -11.397 5.318 1.00 0.37 H new ATOM 0 HB3 PRO A 56 16.359 -12.236 4.301 1.00 0.37 H new ATOM 0 HG2 PRO A 56 16.462 -9.503 5.270 1.00 0.35 H new ATOM 0 HG3 PRO A 56 17.697 -10.399 4.407 1.00 0.35 H new ATOM 0 HD2 PRO A 56 15.828 -8.389 3.357 1.00 0.35 H new ATOM 0 HD3 PRO A 56 17.252 -9.062 2.589 1.00 0.35 H new ATOM 864 N ILE A 57 13.372 -9.691 4.452 1.00 0.29 N ATOM 865 CA ILE A 57 12.140 -9.389 5.177 1.00 0.30 C ATOM 866 C ILE A 57 11.658 -7.965 4.917 1.00 0.27 C ATOM 867 O ILE A 57 12.415 -7.131 4.420 1.00 0.30 O ATOM 868 CB ILE A 57 12.373 -9.636 6.694 1.00 0.38 C ATOM 869 CG1 ILE A 57 12.854 -11.083 6.911 1.00 0.58 C ATOM 870 CG2 ILE A 57 11.116 -9.366 7.516 1.00 0.38 C ATOM 871 CD1 ILE A 57 11.770 -12.126 6.728 1.00 1.23 C ATOM 0 H ILE A 57 14.137 -9.034 4.605 1.00 0.29 H new ATOM 0 HA ILE A 57 11.352 -10.050 4.817 1.00 0.30 H new ATOM 0 HB ILE A 57 13.137 -8.938 7.036 1.00 0.38 H new ATOM 0 HG12 ILE A 57 13.667 -11.293 6.216 1.00 0.58 H new ATOM 0 HG13 ILE A 57 13.264 -11.172 7.917 1.00 0.58 H new ATOM 0 HG21 ILE A 57 11.324 -9.551 8.570 1.00 0.38 H new ATOM 0 HG22 ILE A 57 10.810 -8.328 7.383 1.00 0.38 H new ATOM 0 HG23 ILE A 57 10.315 -10.026 7.183 1.00 0.38 H new ATOM 0 HD11 ILE A 57 12.188 -13.118 6.898 1.00 1.23 H new ATOM 0 HD12 ILE A 57 10.966 -11.944 7.441 1.00 1.23 H new ATOM 0 HD13 ILE A 57 11.376 -12.067 5.714 1.00 1.23 H new ATOM 883 N CYS A 58 10.382 -7.705 5.200 1.00 0.26 N ATOM 884 CA CYS A 58 9.831 -6.376 5.050 1.00 0.24 C ATOM 885 C CYS A 58 8.670 -6.120 6.003 1.00 0.23 C ATOM 886 O CYS A 58 8.238 -6.986 6.766 1.00 0.25 O ATOM 887 CB CYS A 58 9.364 -6.135 3.615 1.00 0.26 C ATOM 888 SG CYS A 58 8.030 -7.221 3.064 1.00 1.15 S ATOM 0 H CYS A 58 9.717 -8.403 5.534 1.00 0.26 H new ATOM 0 HA CYS A 58 10.635 -5.682 5.296 1.00 0.24 H new ATOM 0 HB2 CYS A 58 9.033 -5.100 3.524 1.00 0.26 H new ATOM 0 HB3 CYS A 58 10.215 -6.258 2.945 1.00 0.26 H new ATOM 0 HG CYS A 58 7.992 -8.279 3.819 1.00 1.15 H new ATOM 894 N GLU A 59 8.220 -4.892 5.943 1.00 0.25 N ATOM 895 CA GLU A 59 7.068 -4.438 6.676 1.00 0.27 C ATOM 896 C GLU A 59 6.205 -3.579 5.773 1.00 0.29 C ATOM 897 O GLU A 59 6.627 -2.518 5.307 1.00 0.32 O ATOM 898 CB GLU A 59 7.517 -3.673 7.929 1.00 0.32 C ATOM 899 CG GLU A 59 6.390 -3.024 8.718 1.00 0.39 C ATOM 900 CD GLU A 59 6.346 -1.520 8.531 1.00 0.67 C ATOM 901 OE1 GLU A 59 7.158 -0.815 9.165 1.00 1.04 O ATOM 902 OE2 GLU A 59 5.507 -1.037 7.752 1.00 1.36 O ATOM 0 H GLU A 59 8.654 -4.167 5.372 1.00 0.25 H new ATOM 0 HA GLU A 59 6.473 -5.290 7.004 1.00 0.27 H new ATOM 0 HB2 GLU A 59 8.052 -4.360 8.585 1.00 0.32 H new ATOM 0 HB3 GLU A 59 8.225 -2.900 7.631 1.00 0.32 H new ATOM 0 HG2 GLU A 59 5.438 -3.454 8.407 1.00 0.39 H new ATOM 0 HG3 GLU A 59 6.513 -3.252 9.777 1.00 0.39 H new ATOM 909 N ILE A 60 5.018 -4.085 5.493 1.00 0.32 N ATOM 910 CA ILE A 60 4.034 -3.331 4.750 1.00 0.34 C ATOM 911 C ILE A 60 3.006 -2.685 5.674 1.00 0.31 C ATOM 912 O ILE A 60 2.272 -3.352 6.404 1.00 0.36 O ATOM 913 CB ILE A 60 3.345 -4.160 3.628 1.00 0.48 C ATOM 914 CG1 ILE A 60 3.415 -5.675 3.878 1.00 0.33 C ATOM 915 CG2 ILE A 60 3.977 -3.831 2.283 1.00 0.99 C ATOM 916 CD1 ILE A 60 2.443 -6.182 4.918 1.00 1.05 C ATOM 0 H ILE A 60 4.715 -5.018 5.771 1.00 0.32 H new ATOM 0 HA ILE A 60 4.584 -2.535 4.247 1.00 0.34 H new ATOM 0 HB ILE A 60 2.291 -3.884 3.628 1.00 0.48 H new ATOM 0 HG12 ILE A 60 3.227 -6.195 2.939 1.00 0.33 H new ATOM 0 HG13 ILE A 60 4.428 -5.933 4.188 1.00 0.33 H new ATOM 0 HG21 ILE A 60 3.491 -4.414 1.500 1.00 0.99 H new ATOM 0 HG22 ILE A 60 3.854 -2.768 2.073 1.00 0.99 H new ATOM 0 HG23 ILE A 60 5.039 -4.075 2.311 1.00 0.99 H new ATOM 0 HD11 ILE A 60 2.560 -7.260 5.031 1.00 1.05 H new ATOM 0 HD12 ILE A 60 2.643 -5.693 5.872 1.00 1.05 H new ATOM 0 HD13 ILE A 60 1.424 -5.959 4.603 1.00 1.05 H new ATOM 928 N SER A 61 3.002 -1.368 5.621 1.00 0.26 N ATOM 929 CA SER A 61 2.089 -0.549 6.403 1.00 0.25 C ATOM 930 C SER A 61 1.157 0.191 5.471 1.00 0.24 C ATOM 931 O SER A 61 1.567 1.113 4.775 1.00 0.24 O ATOM 932 CB SER A 61 2.849 0.428 7.298 1.00 0.29 C ATOM 933 OG SER A 61 4.071 0.826 6.707 1.00 0.83 O ATOM 0 H SER A 61 3.636 -0.829 5.031 1.00 0.26 H new ATOM 0 HA SER A 61 1.505 -1.199 7.055 1.00 0.25 H new ATOM 0 HB2 SER A 61 2.232 1.306 7.487 1.00 0.29 H new ATOM 0 HB3 SER A 61 3.045 -0.038 8.264 1.00 0.29 H new ATOM 0 HG SER A 61 4.814 0.370 7.154 1.00 0.83 H new ATOM 939 N PHE A 62 -0.099 -0.199 5.468 1.00 0.24 N ATOM 940 CA PHE A 62 -1.025 0.257 4.458 1.00 0.25 C ATOM 941 C PHE A 62 -2.095 1.119 5.085 1.00 0.26 C ATOM 942 O PHE A 62 -2.717 0.732 6.061 1.00 0.30 O ATOM 943 CB PHE A 62 -1.654 -0.942 3.727 1.00 0.27 C ATOM 944 CG PHE A 62 -1.997 -2.101 4.625 1.00 0.29 C ATOM 945 CD1 PHE A 62 -1.068 -3.097 4.874 1.00 0.34 C ATOM 946 CD2 PHE A 62 -3.246 -2.192 5.217 1.00 0.31 C ATOM 947 CE1 PHE A 62 -1.377 -4.162 5.697 1.00 0.40 C ATOM 948 CE2 PHE A 62 -3.561 -3.254 6.043 1.00 0.37 C ATOM 949 CZ PHE A 62 -2.625 -4.241 6.283 1.00 0.40 C ATOM 0 H PHE A 62 -0.502 -0.833 6.157 1.00 0.24 H new ATOM 0 HA PHE A 62 -0.481 0.856 3.727 1.00 0.25 H new ATOM 0 HB2 PHE A 62 -2.560 -0.610 3.220 1.00 0.27 H new ATOM 0 HB3 PHE A 62 -0.964 -1.286 2.956 1.00 0.27 H new ATOM 0 HD1 PHE A 62 -0.090 -3.040 4.419 1.00 0.34 H new ATOM 0 HD2 PHE A 62 -3.982 -1.424 5.031 1.00 0.31 H new ATOM 0 HE1 PHE A 62 -0.643 -4.933 5.882 1.00 0.40 H new ATOM 0 HE2 PHE A 62 -4.538 -3.312 6.500 1.00 0.37 H new ATOM 0 HZ PHE A 62 -2.869 -5.073 6.928 1.00 0.40 H new ATOM 959 N THR A 63 -2.266 2.301 4.544 1.00 0.25 N ATOM 960 CA THR A 63 -3.326 3.189 4.959 1.00 0.27 C ATOM 961 C THR A 63 -4.234 3.478 3.773 1.00 0.25 C ATOM 962 O THR A 63 -3.878 4.231 2.872 1.00 0.27 O ATOM 963 CB THR A 63 -2.769 4.512 5.520 1.00 0.32 C ATOM 964 OG1 THR A 63 -1.719 4.234 6.456 1.00 0.36 O ATOM 965 CG2 THR A 63 -3.867 5.312 6.209 1.00 0.38 C ATOM 0 H THR A 63 -1.674 2.675 3.803 1.00 0.25 H new ATOM 0 HA THR A 63 -3.890 2.699 5.753 1.00 0.27 H new ATOM 0 HB THR A 63 -2.378 5.102 4.691 1.00 0.32 H new ATOM 0 HG1 THR A 63 -1.365 5.076 6.810 1.00 0.36 H new ATOM 0 HG21 THR A 63 -3.451 6.242 6.597 1.00 0.38 H new ATOM 0 HG22 THR A 63 -4.656 5.539 5.492 1.00 0.38 H new ATOM 0 HG23 THR A 63 -4.281 4.728 7.031 1.00 0.38 H new ATOM 973 N PHE A 64 -5.392 2.862 3.773 1.00 0.24 N ATOM 974 CA PHE A 64 -6.352 3.033 2.704 1.00 0.24 C ATOM 975 C PHE A 64 -7.396 4.065 3.109 1.00 0.22 C ATOM 976 O PHE A 64 -7.839 4.088 4.248 1.00 0.23 O ATOM 977 CB PHE A 64 -7.047 1.714 2.386 1.00 0.27 C ATOM 978 CG PHE A 64 -6.149 0.655 1.829 1.00 0.43 C ATOM 979 CD1 PHE A 64 -5.787 0.676 0.494 1.00 0.58 C ATOM 980 CD2 PHE A 64 -5.656 -0.351 2.643 1.00 0.65 C ATOM 981 CE1 PHE A 64 -4.951 -0.291 -0.022 1.00 0.84 C ATOM 982 CE2 PHE A 64 -4.822 -1.318 2.131 1.00 0.90 C ATOM 983 CZ PHE A 64 -4.506 -1.322 0.798 1.00 0.96 C ATOM 0 H PHE A 64 -5.697 2.229 4.512 1.00 0.24 H new ATOM 0 HA PHE A 64 -5.819 3.374 1.816 1.00 0.24 H new ATOM 0 HB2 PHE A 64 -7.513 1.335 3.296 1.00 0.27 H new ATOM 0 HB3 PHE A 64 -7.849 1.904 1.673 1.00 0.27 H new ATOM 0 HD1 PHE A 64 -6.163 1.457 -0.150 1.00 0.58 H new ATOM 0 HD2 PHE A 64 -5.928 -0.377 3.688 1.00 0.65 H new ATOM 0 HE1 PHE A 64 -4.644 -0.248 -1.056 1.00 0.84 H new ATOM 0 HE2 PHE A 64 -4.415 -2.077 2.783 1.00 0.90 H new ATOM 0 HZ PHE A 64 -3.913 -2.124 0.385 1.00 0.96 H new ATOM 993 N HIS A 65 -7.725 4.960 2.191 1.00 0.24 N ATOM 994 CA HIS A 65 -8.766 5.970 2.406 1.00 0.26 C ATOM 995 C HIS A 65 -9.477 6.259 1.098 1.00 0.24 C ATOM 996 O HIS A 65 -8.850 6.298 0.048 1.00 0.36 O ATOM 997 CB HIS A 65 -8.217 7.256 3.062 1.00 0.42 C ATOM 998 CG HIS A 65 -6.807 7.610 2.716 1.00 0.51 C ATOM 999 ND1 HIS A 65 -6.402 8.890 2.425 1.00 1.02 N ATOM 1000 CD2 HIS A 65 -5.698 6.843 2.672 1.00 0.53 C ATOM 1001 CE1 HIS A 65 -5.104 8.896 2.208 1.00 1.29 C ATOM 1002 NE2 HIS A 65 -4.644 7.665 2.352 1.00 1.02 N ATOM 0 H HIS A 65 -7.282 5.012 1.274 1.00 0.24 H new ATOM 0 HA HIS A 65 -9.489 5.565 3.114 1.00 0.26 H new ATOM 0 HB2 HIS A 65 -8.861 8.089 2.780 1.00 0.42 H new ATOM 0 HB3 HIS A 65 -8.290 7.149 4.144 1.00 0.42 H new ATOM 0 HD1 HIS A 65 -7.011 9.707 2.384 1.00 1.02 H new ATOM 0 HD2 HIS A 65 -5.648 5.780 2.854 1.00 0.53 H new ATOM 0 HE1 HIS A 65 -4.512 9.763 1.954 1.00 1.29 H new ATOM 1011 N SER A 66 -10.787 6.429 1.161 1.00 0.22 N ATOM 1012 CA SER A 66 -11.586 6.572 -0.044 1.00 0.25 C ATOM 1013 C SER A 66 -11.969 8.021 -0.292 1.00 0.24 C ATOM 1014 O SER A 66 -11.176 8.779 -0.845 1.00 0.30 O ATOM 1015 CB SER A 66 -12.829 5.699 0.037 1.00 0.38 C ATOM 1016 OG SER A 66 -13.630 5.824 -1.119 1.00 1.27 O ATOM 0 H SER A 66 -11.318 6.471 2.031 1.00 0.22 H new ATOM 0 HA SER A 66 -10.978 6.242 -0.886 1.00 0.25 H new ATOM 0 HB2 SER A 66 -12.535 4.657 0.165 1.00 0.38 H new ATOM 0 HB3 SER A 66 -13.412 5.976 0.916 1.00 0.38 H new ATOM 0 HG SER A 66 -13.118 6.272 -1.825 1.00 1.27 H new ATOM 1022 N ALA A 67 -13.172 8.422 0.138 1.00 0.24 N ATOM 1023 CA ALA A 67 -13.645 9.771 -0.110 1.00 0.28 C ATOM 1024 C ALA A 67 -12.718 10.738 0.579 1.00 0.30 C ATOM 1025 O ALA A 67 -12.126 11.607 -0.056 1.00 0.36 O ATOM 1026 CB ALA A 67 -15.069 9.943 0.383 1.00 0.32 C ATOM 0 H ALA A 67 -13.823 7.831 0.654 1.00 0.24 H new ATOM 0 HA ALA A 67 -13.648 9.967 -1.182 1.00 0.28 H new ATOM 0 HB1 ALA A 67 -15.402 10.962 0.186 1.00 0.32 H new ATOM 0 HB2 ALA A 67 -15.721 9.242 -0.137 1.00 0.32 H new ATOM 0 HB3 ALA A 67 -15.109 9.749 1.455 1.00 0.32 H new ATOM 1032 N GLY A 68 -12.600 10.595 1.890 1.00 0.29 N ATOM 1033 CA GLY A 68 -11.507 11.192 2.616 1.00 0.32 C ATOM 1034 C GLY A 68 -11.415 10.468 3.930 1.00 0.34 C ATOM 1035 O GLY A 68 -10.783 10.913 4.884 1.00 0.39 O ATOM 0 H GLY A 68 -13.254 10.067 2.468 1.00 0.29 H new ATOM 0 HA2 GLY A 68 -10.575 11.100 2.058 1.00 0.32 H new ATOM 0 HA3 GLY A 68 -11.682 12.257 2.772 1.00 0.32 H new ATOM 1039 N ARG A 69 -12.065 9.308 3.926 1.00 0.36 N ATOM 1040 CA ARG A 69 -12.282 8.489 5.095 1.00 0.46 C ATOM 1041 C ARG A 69 -11.368 7.297 5.029 1.00 0.52 C ATOM 1042 O ARG A 69 -10.920 6.933 3.949 1.00 1.08 O ATOM 1043 CB ARG A 69 -13.737 8.049 5.100 1.00 0.48 C ATOM 1044 CG ARG A 69 -14.251 7.797 3.692 1.00 0.47 C ATOM 1045 CD ARG A 69 -15.711 8.177 3.537 1.00 0.58 C ATOM 1046 NE ARG A 69 -15.981 9.550 3.979 1.00 0.55 N ATOM 1047 CZ ARG A 69 -16.891 10.366 3.452 1.00 1.05 C ATOM 1048 NH1 ARG A 69 -17.672 9.966 2.455 1.00 1.97 N ATOM 1049 NH2 ARG A 69 -17.012 11.595 3.929 1.00 1.04 N ATOM 0 H ARG A 69 -12.465 8.907 3.078 1.00 0.36 H new ATOM 0 HA ARG A 69 -12.068 9.043 6.009 1.00 0.46 H new ATOM 0 HB2 ARG A 69 -13.841 7.141 5.694 1.00 0.48 H new ATOM 0 HB3 ARG A 69 -14.347 8.815 5.579 1.00 0.48 H new ATOM 0 HG2 ARG A 69 -13.652 8.366 2.981 1.00 0.47 H new ATOM 0 HG3 ARG A 69 -14.124 6.743 3.444 1.00 0.47 H new ATOM 0 HD2 ARG A 69 -16.003 8.071 2.492 1.00 0.58 H new ATOM 0 HD3 ARG A 69 -16.327 7.485 4.112 1.00 0.58 H new ATOM 0 HE ARG A 69 -15.425 9.909 4.755 1.00 0.55 H new ATOM 0 HH11 ARG A 69 -17.579 9.021 2.082 1.00 1.97 H new ATOM 0 HH12 ARG A 69 -18.364 10.604 2.062 1.00 1.97 H new ATOM 0 HH21 ARG A 69 -16.412 11.907 4.692 1.00 1.04 H new ATOM 0 HH22 ARG A 69 -17.706 12.230 3.533 1.00 1.04 H new ATOM 1063 N GLU A 70 -11.180 6.633 6.138 1.00 0.52 N ATOM 1064 CA GLU A 70 -10.064 5.745 6.283 1.00 0.52 C ATOM 1065 C GLU A 70 -10.511 4.333 6.004 1.00 0.67 C ATOM 1066 O GLU A 70 -10.953 3.612 6.895 1.00 1.28 O ATOM 1067 CB GLU A 70 -9.441 5.880 7.675 1.00 0.66 C ATOM 1068 CG GLU A 70 -8.109 5.160 7.829 1.00 1.35 C ATOM 1069 CD GLU A 70 -7.387 5.555 9.101 1.00 1.91 C ATOM 1070 OE1 GLU A 70 -7.889 5.239 10.200 1.00 2.61 O ATOM 1071 OE2 GLU A 70 -6.315 6.193 9.011 1.00 2.12 O ATOM 0 H GLU A 70 -11.788 6.692 6.955 1.00 0.52 H new ATOM 0 HA GLU A 70 -9.291 6.010 5.562 1.00 0.52 H new ATOM 0 HB2 GLU A 70 -9.299 6.938 7.897 1.00 0.66 H new ATOM 0 HB3 GLU A 70 -10.141 5.490 8.414 1.00 0.66 H new ATOM 0 HG2 GLU A 70 -8.278 4.083 7.829 1.00 1.35 H new ATOM 0 HG3 GLU A 70 -7.476 5.383 6.970 1.00 1.35 H new ATOM 1078 N ILE A 71 -10.443 3.993 4.730 1.00 0.28 N ATOM 1079 CA ILE A 71 -10.760 2.666 4.239 1.00 0.28 C ATOM 1080 C ILE A 71 -10.137 1.590 5.119 1.00 0.29 C ATOM 1081 O ILE A 71 -10.783 0.599 5.438 1.00 0.33 O ATOM 1082 CB ILE A 71 -10.261 2.500 2.791 1.00 0.31 C ATOM 1083 CG1 ILE A 71 -11.158 3.246 1.809 1.00 0.37 C ATOM 1084 CG2 ILE A 71 -10.178 1.043 2.424 1.00 0.30 C ATOM 1085 CD1 ILE A 71 -12.542 2.654 1.683 1.00 0.40 C ATOM 0 H ILE A 71 -10.161 4.643 3.996 1.00 0.28 H new ATOM 0 HA ILE A 71 -11.844 2.551 4.266 1.00 0.28 H new ATOM 0 HB ILE A 71 -9.262 2.933 2.730 1.00 0.31 H new ATOM 0 HG12 ILE A 71 -11.244 4.285 2.126 1.00 0.37 H new ATOM 0 HG13 ILE A 71 -10.683 3.251 0.828 1.00 0.37 H new ATOM 0 HG21 ILE A 71 -9.824 0.946 1.398 1.00 0.30 H new ATOM 0 HG22 ILE A 71 -9.485 0.537 3.096 1.00 0.30 H new ATOM 0 HG23 ILE A 71 -11.165 0.589 2.512 1.00 0.30 H new ATOM 0 HD11 ILE A 71 -13.123 3.236 0.968 1.00 0.40 H new ATOM 0 HD12 ILE A 71 -12.467 1.624 1.336 1.00 0.40 H new ATOM 0 HD13 ILE A 71 -13.036 2.674 2.654 1.00 0.40 H new ATOM 1097 N GLY A 72 -8.886 1.782 5.504 1.00 0.29 N ATOM 1098 CA GLY A 72 -8.253 0.836 6.397 1.00 0.36 C ATOM 1099 C GLY A 72 -6.825 1.210 6.678 1.00 0.34 C ATOM 1100 O GLY A 72 -6.283 2.079 6.012 1.00 0.49 O ATOM 0 H GLY A 72 -8.302 2.568 5.218 1.00 0.29 H new ATOM 0 HA2 GLY A 72 -8.809 0.791 7.334 1.00 0.36 H new ATOM 0 HA3 GLY A 72 -8.289 -0.161 5.957 1.00 0.36 H new ATOM 1104 N LYS A 73 -6.209 0.584 7.667 1.00 0.36 N ATOM 1105 CA LYS A 73 -4.792 0.794 7.902 1.00 0.35 C ATOM 1106 C LYS A 73 -4.223 -0.259 8.840 1.00 0.39 C ATOM 1107 O LYS A 73 -4.962 -0.950 9.545 1.00 0.47 O ATOM 1108 CB LYS A 73 -4.508 2.198 8.452 1.00 0.44 C ATOM 1109 CG LYS A 73 -4.786 2.360 9.933 1.00 0.61 C ATOM 1110 CD LYS A 73 -6.268 2.361 10.246 1.00 0.68 C ATOM 1111 CE LYS A 73 -6.504 2.610 11.721 1.00 1.26 C ATOM 1112 NZ LYS A 73 -6.144 1.436 12.557 1.00 1.81 N ATOM 0 H LYS A 73 -6.661 -0.065 8.311 1.00 0.36 H new ATOM 0 HA LYS A 73 -4.297 0.701 6.935 1.00 0.35 H new ATOM 0 HB2 LYS A 73 -3.463 2.445 8.262 1.00 0.44 H new ATOM 0 HB3 LYS A 73 -5.111 2.919 7.901 1.00 0.44 H new ATOM 0 HG2 LYS A 73 -4.302 1.552 10.481 1.00 0.61 H new ATOM 0 HG3 LYS A 73 -4.343 3.292 10.283 1.00 0.61 H new ATOM 0 HD2 LYS A 73 -6.768 3.130 9.658 1.00 0.68 H new ATOM 0 HD3 LYS A 73 -6.706 1.405 9.959 1.00 0.68 H new ATOM 0 HE2 LYS A 73 -5.919 3.473 12.039 1.00 1.26 H new ATOM 0 HE3 LYS A 73 -7.553 2.859 11.882 1.00 1.26 H new ATOM 0 HZ1 LYS A 73 -6.339 1.649 13.556 1.00 1.81 H new ATOM 0 HZ2 LYS A 73 -6.708 0.614 12.262 1.00 1.81 H new ATOM 0 HZ3 LYS A 73 -5.133 1.223 12.439 1.00 1.81 H new ATOM 1126 N GLY A 74 -2.906 -0.380 8.821 1.00 0.39 N ATOM 1127 CA GLY A 74 -2.214 -1.329 9.663 1.00 0.43 C ATOM 1128 C GLY A 74 -0.864 -1.682 9.078 1.00 0.34 C ATOM 1129 O GLY A 74 -0.492 -1.163 8.026 1.00 0.32 O ATOM 0 H GLY A 74 -2.294 0.175 8.224 1.00 0.39 H new ATOM 0 HA2 GLY A 74 -2.085 -0.910 10.661 1.00 0.43 H new ATOM 0 HA3 GLY A 74 -2.815 -2.232 9.772 1.00 0.43 H new ATOM 1133 N LYS A 75 -0.132 -2.564 9.742 1.00 0.37 N ATOM 1134 CA LYS A 75 1.172 -2.985 9.254 1.00 0.37 C ATOM 1135 C LYS A 75 1.454 -4.431 9.619 1.00 0.39 C ATOM 1136 O LYS A 75 1.102 -4.893 10.706 1.00 0.50 O ATOM 1137 CB LYS A 75 2.296 -2.084 9.772 1.00 0.56 C ATOM 1138 CG LYS A 75 2.267 -1.848 11.269 1.00 0.84 C ATOM 1139 CD LYS A 75 3.542 -1.164 11.749 1.00 0.90 C ATOM 1140 CE LYS A 75 3.806 0.142 11.013 1.00 1.17 C ATOM 1141 NZ LYS A 75 2.803 1.190 11.336 1.00 1.72 N ATOM 0 H LYS A 75 -0.418 -3.001 10.618 1.00 0.37 H new ATOM 0 HA LYS A 75 1.144 -2.896 8.168 1.00 0.37 H new ATOM 0 HB2 LYS A 75 3.255 -2.529 9.505 1.00 0.56 H new ATOM 0 HB3 LYS A 75 2.238 -1.122 9.263 1.00 0.56 H new ATOM 0 HG2 LYS A 75 1.404 -1.233 11.525 1.00 0.84 H new ATOM 0 HG3 LYS A 75 2.146 -2.800 11.787 1.00 0.84 H new ATOM 0 HD2 LYS A 75 3.466 -0.967 12.818 1.00 0.90 H new ATOM 0 HD3 LYS A 75 4.388 -1.836 11.608 1.00 0.90 H new ATOM 0 HE2 LYS A 75 4.801 0.505 11.269 1.00 1.17 H new ATOM 0 HE3 LYS A 75 3.801 -0.043 9.939 1.00 1.17 H new ATOM 0 HZ1 LYS A 75 3.027 2.059 10.810 1.00 1.72 H new ATOM 0 HZ2 LYS A 75 1.855 0.858 11.068 1.00 1.72 H new ATOM 0 HZ3 LYS A 75 2.824 1.388 12.357 1.00 1.72 H new ATOM 1155 N ILE A 76 2.088 -5.137 8.699 1.00 0.35 N ATOM 1156 CA ILE A 76 2.404 -6.542 8.886 1.00 0.39 C ATOM 1157 C ILE A 76 3.854 -6.813 8.491 1.00 0.34 C ATOM 1158 O ILE A 76 4.274 -6.476 7.384 1.00 0.35 O ATOM 1159 CB ILE A 76 1.474 -7.443 8.038 1.00 0.45 C ATOM 1160 CG1 ILE A 76 0.008 -7.268 8.451 1.00 0.51 C ATOM 1161 CG2 ILE A 76 1.885 -8.907 8.154 1.00 0.56 C ATOM 1162 CD1 ILE A 76 -0.966 -8.004 7.553 1.00 0.73 C ATOM 0 H ILE A 76 2.397 -4.755 7.805 1.00 0.35 H new ATOM 0 HA ILE A 76 2.256 -6.776 9.940 1.00 0.39 H new ATOM 0 HB ILE A 76 1.574 -7.136 6.997 1.00 0.45 H new ATOM 0 HG12 ILE A 76 -0.117 -7.620 9.475 1.00 0.51 H new ATOM 0 HG13 ILE A 76 -0.238 -6.206 8.447 1.00 0.51 H new ATOM 0 HG21 ILE A 76 1.217 -9.521 7.550 1.00 0.56 H new ATOM 0 HG22 ILE A 76 2.909 -9.027 7.799 1.00 0.56 H new ATOM 0 HG23 ILE A 76 1.823 -9.221 9.196 1.00 0.56 H new ATOM 0 HD11 ILE A 76 -1.984 -7.835 7.905 1.00 0.73 H new ATOM 0 HD12 ILE A 76 -0.869 -7.635 6.532 1.00 0.73 H new ATOM 0 HD13 ILE A 76 -0.747 -9.071 7.576 1.00 0.73 H new ATOM 1174 N PRO A 77 4.651 -7.385 9.403 1.00 0.34 N ATOM 1175 CA PRO A 77 5.995 -7.855 9.083 1.00 0.32 C ATOM 1176 C PRO A 77 5.935 -9.125 8.237 1.00 0.33 C ATOM 1177 O PRO A 77 5.518 -10.181 8.718 1.00 0.44 O ATOM 1178 CB PRO A 77 6.628 -8.147 10.455 1.00 0.40 C ATOM 1179 CG PRO A 77 5.674 -7.596 11.467 1.00 0.57 C ATOM 1180 CD PRO A 77 4.322 -7.600 10.816 1.00 0.42 C ATOM 0 HA PRO A 77 6.565 -7.128 8.504 1.00 0.32 H new ATOM 0 HB2 PRO A 77 6.775 -9.217 10.598 1.00 0.40 H new ATOM 0 HB3 PRO A 77 7.607 -7.676 10.543 1.00 0.40 H new ATOM 0 HG2 PRO A 77 5.672 -8.204 12.371 1.00 0.57 H new ATOM 0 HG3 PRO A 77 5.960 -6.587 11.762 1.00 0.57 H new ATOM 0 HD2 PRO A 77 3.799 -8.543 10.972 1.00 0.42 H new ATOM 0 HD3 PRO A 77 3.680 -6.811 11.208 1.00 0.42 H new ATOM 1188 N ASP A 78 6.337 -9.023 6.979 1.00 0.30 N ATOM 1189 CA ASP A 78 6.198 -10.136 6.052 1.00 0.35 C ATOM 1190 C ASP A 78 7.534 -10.419 5.382 1.00 0.32 C ATOM 1191 O ASP A 78 8.319 -9.499 5.164 1.00 0.28 O ATOM 1192 CB ASP A 78 5.124 -9.801 5.005 1.00 0.39 C ATOM 1193 CG ASP A 78 4.645 -11.014 4.229 1.00 0.52 C ATOM 1194 OD1 ASP A 78 3.832 -11.793 4.762 1.00 0.79 O ATOM 1195 OD2 ASP A 78 5.084 -11.196 3.074 1.00 0.52 O ATOM 0 H ASP A 78 6.760 -8.186 6.578 1.00 0.30 H new ATOM 0 HA ASP A 78 5.890 -11.029 6.595 1.00 0.35 H new ATOM 0 HB2 ASP A 78 4.273 -9.337 5.503 1.00 0.39 H new ATOM 0 HB3 ASP A 78 5.524 -9.066 4.307 1.00 0.39 H new ATOM 1200 N PRO A 79 7.849 -11.692 5.104 1.00 0.39 N ATOM 1201 CA PRO A 79 9.061 -12.051 4.367 1.00 0.40 C ATOM 1202 C PRO A 79 9.063 -11.479 2.949 1.00 0.38 C ATOM 1203 O PRO A 79 8.569 -12.106 2.013 1.00 0.47 O ATOM 1204 CB PRO A 79 9.035 -13.584 4.332 1.00 0.52 C ATOM 1205 CG PRO A 79 8.101 -13.981 5.425 1.00 0.58 C ATOM 1206 CD PRO A 79 7.084 -12.879 5.516 1.00 0.49 C ATOM 0 HA PRO A 79 9.956 -11.648 4.841 1.00 0.40 H new ATOM 0 HB2 PRO A 79 8.689 -13.951 3.365 1.00 0.52 H new ATOM 0 HB3 PRO A 79 10.030 -13.999 4.493 1.00 0.52 H new ATOM 0 HG2 PRO A 79 7.624 -14.936 5.204 1.00 0.58 H new ATOM 0 HG3 PRO A 79 8.633 -14.101 6.369 1.00 0.58 H new ATOM 0 HD2 PRO A 79 6.233 -13.059 4.859 1.00 0.49 H new ATOM 0 HD3 PRO A 79 6.690 -12.775 6.527 1.00 0.49 H new ATOM 1214 N GLY A 80 9.610 -10.276 2.807 1.00 0.34 N ATOM 1215 CA GLY A 80 9.682 -9.624 1.513 1.00 0.40 C ATOM 1216 C GLY A 80 10.876 -10.080 0.707 1.00 0.35 C ATOM 1217 O GLY A 80 11.477 -9.299 -0.028 1.00 0.40 O ATOM 0 H GLY A 80 10.009 -9.736 3.575 1.00 0.34 H new ATOM 0 HA2 GLY A 80 8.769 -9.829 0.954 1.00 0.40 H new ATOM 0 HA3 GLY A 80 9.733 -8.544 1.655 1.00 0.40 H new ATOM 1221 N SER A 81 11.214 -11.345 0.854 1.00 0.34 N ATOM 1222 CA SER A 81 12.304 -11.944 0.128 1.00 0.36 C ATOM 1223 C SER A 81 11.896 -12.137 -1.332 1.00 0.37 C ATOM 1224 O SER A 81 10.880 -12.783 -1.604 1.00 0.43 O ATOM 1225 CB SER A 81 12.671 -13.272 0.802 1.00 0.41 C ATOM 1226 OG SER A 81 11.720 -14.287 0.519 1.00 0.62 O ATOM 0 H SER A 81 10.734 -11.986 1.486 1.00 0.34 H new ATOM 0 HA SER A 81 13.182 -11.299 0.141 1.00 0.36 H new ATOM 0 HB2 SER A 81 13.656 -13.592 0.462 1.00 0.41 H new ATOM 0 HB3 SER A 81 12.737 -13.126 1.880 1.00 0.41 H new ATOM 0 HG SER A 81 11.103 -13.973 -0.175 1.00 0.62 H new ATOM 1232 N LEU A 82 12.665 -11.582 -2.283 1.00 0.37 N ATOM 1233 CA LEU A 82 12.117 -11.444 -3.649 1.00 0.39 C ATOM 1234 C LEU A 82 13.183 -11.521 -4.745 1.00 0.49 C ATOM 1235 O LEU A 82 14.263 -12.038 -4.526 1.00 0.82 O ATOM 1236 CB LEU A 82 11.316 -10.132 -3.768 1.00 0.36 C ATOM 1237 CG LEU A 82 12.115 -8.863 -4.093 1.00 0.52 C ATOM 1238 CD1 LEU A 82 11.201 -7.652 -4.100 1.00 1.10 C ATOM 1239 CD2 LEU A 82 13.252 -8.663 -3.114 1.00 1.08 C ATOM 0 H LEU A 82 13.616 -11.238 -2.149 1.00 0.37 H new ATOM 0 HA LEU A 82 11.457 -12.297 -3.807 1.00 0.39 H new ATOM 0 HB2 LEU A 82 10.559 -10.265 -4.541 1.00 0.36 H new ATOM 0 HB3 LEU A 82 10.787 -9.970 -2.829 1.00 0.36 H new ATOM 0 HG LEU A 82 12.548 -8.983 -5.086 1.00 0.52 H new ATOM 0 HD11 LEU A 82 11.782 -6.759 -4.332 1.00 1.10 H new ATOM 0 HD12 LEU A 82 10.425 -7.786 -4.854 1.00 1.10 H new ATOM 0 HD13 LEU A 82 10.739 -7.539 -3.119 1.00 1.10 H new ATOM 0 HD21 LEU A 82 13.799 -7.756 -3.372 1.00 1.08 H new ATOM 0 HD22 LEU A 82 12.851 -8.571 -2.105 1.00 1.08 H new ATOM 0 HD23 LEU A 82 13.926 -9.518 -3.160 1.00 1.08 H new ATOM 1251 N LYS A 83 12.855 -11.003 -5.930 1.00 0.40 N ATOM 1252 CA LYS A 83 13.730 -11.111 -7.094 1.00 0.46 C ATOM 1253 C LYS A 83 15.090 -10.445 -6.868 1.00 0.47 C ATOM 1254 O LYS A 83 15.998 -11.064 -6.318 1.00 0.63 O ATOM 1255 CB LYS A 83 13.054 -10.502 -8.321 1.00 0.52 C ATOM 1256 CG LYS A 83 11.651 -11.038 -8.560 1.00 0.58 C ATOM 1257 CD LYS A 83 11.042 -10.471 -9.827 1.00 0.68 C ATOM 1258 CE LYS A 83 9.706 -11.122 -10.138 1.00 1.08 C ATOM 1259 NZ LYS A 83 9.155 -10.675 -11.447 1.00 1.84 N ATOM 0 H LYS A 83 11.984 -10.502 -6.107 1.00 0.40 H new ATOM 0 HA LYS A 83 13.910 -12.173 -7.260 1.00 0.46 H new ATOM 0 HB2 LYS A 83 13.007 -9.420 -8.202 1.00 0.52 H new ATOM 0 HB3 LYS A 83 13.666 -10.700 -9.201 1.00 0.52 H new ATOM 0 HG2 LYS A 83 11.684 -12.125 -8.627 1.00 0.58 H new ATOM 0 HG3 LYS A 83 11.017 -10.790 -7.709 1.00 0.58 H new ATOM 0 HD2 LYS A 83 10.908 -9.395 -9.718 1.00 0.68 H new ATOM 0 HD3 LYS A 83 11.726 -10.624 -10.662 1.00 0.68 H new ATOM 0 HE2 LYS A 83 9.825 -12.205 -10.146 1.00 1.08 H new ATOM 0 HE3 LYS A 83 8.995 -10.885 -9.346 1.00 1.08 H new ATOM 0 HZ1 LYS A 83 8.461 -11.371 -11.787 1.00 1.84 H new ATOM 0 HZ2 LYS A 83 8.691 -9.752 -11.331 1.00 1.84 H new ATOM 0 HZ3 LYS A 83 9.928 -10.590 -12.138 1.00 1.84 H new ATOM 1273 N ALA A 84 15.206 -9.175 -7.272 1.00 0.47 N ATOM 1274 CA ALA A 84 16.472 -8.461 -7.307 1.00 0.50 C ATOM 1275 C ALA A 84 16.295 -7.247 -8.190 1.00 0.58 C ATOM 1276 O ALA A 84 16.129 -7.404 -9.398 1.00 0.99 O ATOM 1277 CB ALA A 84 17.592 -9.329 -7.868 1.00 0.56 C ATOM 0 H ALA A 84 14.413 -8.616 -7.585 1.00 0.47 H new ATOM 0 HA ALA A 84 16.749 -8.179 -6.291 1.00 0.50 H new ATOM 0 HB1 ALA A 84 18.522 -8.761 -7.878 1.00 0.56 H new ATOM 0 HB2 ALA A 84 17.714 -10.214 -7.243 1.00 0.56 H new ATOM 0 HB3 ALA A 84 17.342 -9.634 -8.884 1.00 0.56 H new ATOM 1283 N LYS A 85 16.305 -6.057 -7.583 1.00 0.49 N ATOM 1284 CA LYS A 85 16.053 -4.793 -8.294 1.00 0.54 C ATOM 1285 C LYS A 85 14.907 -4.937 -9.281 1.00 0.53 C ATOM 1286 O LYS A 85 14.996 -4.546 -10.447 1.00 0.61 O ATOM 1287 CB LYS A 85 17.314 -4.264 -8.977 1.00 0.65 C ATOM 1288 CG LYS A 85 17.978 -5.250 -9.902 1.00 1.07 C ATOM 1289 CD LYS A 85 19.357 -4.772 -10.308 1.00 1.25 C ATOM 1290 CE LYS A 85 20.090 -5.829 -11.107 1.00 1.60 C ATOM 1291 NZ LYS A 85 21.362 -5.312 -11.674 1.00 1.84 N ATOM 0 H LYS A 85 16.487 -5.939 -6.586 1.00 0.49 H new ATOM 0 HA LYS A 85 15.759 -4.055 -7.548 1.00 0.54 H new ATOM 0 HB2 LYS A 85 17.058 -3.368 -9.543 1.00 0.65 H new ATOM 0 HB3 LYS A 85 18.029 -3.964 -8.211 1.00 0.65 H new ATOM 0 HG2 LYS A 85 18.056 -6.220 -9.410 1.00 1.07 H new ATOM 0 HG3 LYS A 85 17.362 -5.392 -10.790 1.00 1.07 H new ATOM 0 HD2 LYS A 85 19.269 -3.861 -10.900 1.00 1.25 H new ATOM 0 HD3 LYS A 85 19.934 -4.520 -9.418 1.00 1.25 H new ATOM 0 HE2 LYS A 85 20.300 -6.687 -10.468 1.00 1.60 H new ATOM 0 HE3 LYS A 85 19.449 -6.182 -11.915 1.00 1.60 H new ATOM 0 HZ1 LYS A 85 21.833 -6.066 -12.214 1.00 1.84 H new ATOM 0 HZ2 LYS A 85 21.160 -4.509 -12.304 1.00 1.84 H new ATOM 0 HZ3 LYS A 85 21.984 -4.998 -10.902 1.00 1.84 H new ATOM 1305 N ASP A 86 13.818 -5.488 -8.784 1.00 0.48 N ATOM 1306 CA ASP A 86 12.694 -5.848 -9.629 1.00 0.46 C ATOM 1307 C ASP A 86 11.405 -5.827 -8.822 1.00 0.40 C ATOM 1308 O ASP A 86 11.418 -5.539 -7.624 1.00 0.38 O ATOM 1309 CB ASP A 86 12.913 -7.238 -10.242 1.00 0.49 C ATOM 1310 CG ASP A 86 12.245 -7.406 -11.597 1.00 0.53 C ATOM 1311 OD1 ASP A 86 11.002 -7.350 -11.673 1.00 0.55 O ATOM 1312 OD2 ASP A 86 12.963 -7.588 -12.598 1.00 0.64 O ATOM 0 H ASP A 86 13.686 -5.698 -7.795 1.00 0.48 H new ATOM 0 HA ASP A 86 12.615 -5.120 -10.436 1.00 0.46 H new ATOM 0 HB2 ASP A 86 13.983 -7.417 -10.347 1.00 0.49 H new ATOM 0 HB3 ASP A 86 12.528 -7.995 -9.558 1.00 0.49 H new ATOM 1317 N MET A 87 10.317 -6.179 -9.476 1.00 0.39 N ATOM 1318 CA MET A 87 8.992 -6.067 -8.906 1.00 0.35 C ATOM 1319 C MET A 87 8.430 -7.456 -8.630 1.00 0.34 C ATOM 1320 O MET A 87 8.433 -8.322 -9.503 1.00 0.37 O ATOM 1321 CB MET A 87 8.091 -5.280 -9.862 1.00 0.35 C ATOM 1322 CG MET A 87 6.779 -4.843 -9.246 1.00 0.35 C ATOM 1323 SD MET A 87 5.809 -3.792 -10.350 1.00 0.41 S ATOM 1324 CE MET A 87 6.809 -2.303 -10.362 1.00 1.35 C ATOM 0 H MET A 87 10.329 -6.553 -10.425 1.00 0.39 H new ATOM 0 HA MET A 87 9.039 -5.529 -7.959 1.00 0.35 H new ATOM 0 HB2 MET A 87 8.629 -4.399 -10.210 1.00 0.35 H new ATOM 0 HB3 MET A 87 7.883 -5.894 -10.738 1.00 0.35 H new ATOM 0 HG2 MET A 87 6.194 -5.724 -8.983 1.00 0.35 H new ATOM 0 HG3 MET A 87 6.978 -4.304 -8.320 1.00 0.35 H new ATOM 0 HE1 MET A 87 6.258 -1.491 -9.888 1.00 1.35 H new ATOM 0 HE2 MET A 87 7.734 -2.482 -9.814 1.00 1.35 H new ATOM 0 HE3 MET A 87 7.043 -2.030 -11.391 1.00 1.35 H new ATOM 1334 N THR A 88 7.985 -7.668 -7.407 1.00 0.31 N ATOM 1335 CA THR A 88 7.518 -8.970 -6.963 1.00 0.30 C ATOM 1336 C THR A 88 6.065 -8.901 -6.479 1.00 0.27 C ATOM 1337 O THR A 88 5.661 -7.923 -5.855 1.00 0.27 O ATOM 1338 CB THR A 88 8.444 -9.496 -5.841 1.00 0.32 C ATOM 1339 OG1 THR A 88 9.292 -10.533 -6.347 1.00 0.77 O ATOM 1340 CG2 THR A 88 7.653 -10.000 -4.641 1.00 0.54 C ATOM 0 H THR A 88 7.936 -6.943 -6.691 1.00 0.31 H new ATOM 0 HA THR A 88 7.550 -9.660 -7.807 1.00 0.30 H new ATOM 0 HB THR A 88 9.058 -8.661 -5.502 1.00 0.32 H new ATOM 0 HG1 THR A 88 9.131 -11.360 -5.847 1.00 0.77 H new ATOM 0 HG21 THR A 88 8.342 -10.360 -3.877 1.00 0.54 H new ATOM 0 HG22 THR A 88 7.052 -9.187 -4.234 1.00 0.54 H new ATOM 0 HG23 THR A 88 6.999 -10.814 -4.953 1.00 0.54 H new ATOM 1348 N ALA A 89 5.287 -9.938 -6.770 1.00 0.27 N ATOM 1349 CA ALA A 89 3.881 -9.971 -6.380 1.00 0.28 C ATOM 1350 C ALA A 89 3.706 -10.450 -4.934 1.00 0.29 C ATOM 1351 O ALA A 89 3.992 -11.604 -4.605 1.00 0.48 O ATOM 1352 CB ALA A 89 3.086 -10.852 -7.335 1.00 0.31 C ATOM 0 H ALA A 89 5.605 -10.766 -7.274 1.00 0.27 H new ATOM 0 HA ALA A 89 3.497 -8.952 -6.437 1.00 0.28 H new ATOM 0 HB1 ALA A 89 2.039 -10.866 -7.031 1.00 0.31 H new ATOM 0 HB2 ALA A 89 3.164 -10.455 -8.347 1.00 0.31 H new ATOM 0 HB3 ALA A 89 3.485 -11.866 -7.312 1.00 0.31 H new ATOM 1358 N LEU A 90 3.229 -9.549 -4.090 1.00 0.27 N ATOM 1359 CA LEU A 90 2.948 -9.833 -2.686 1.00 0.30 C ATOM 1360 C LEU A 90 1.448 -9.629 -2.438 1.00 0.29 C ATOM 1361 O LEU A 90 0.747 -9.129 -3.319 1.00 0.32 O ATOM 1362 CB LEU A 90 3.816 -8.914 -1.806 1.00 0.35 C ATOM 1363 CG LEU A 90 3.659 -9.047 -0.287 1.00 0.40 C ATOM 1364 CD1 LEU A 90 5.018 -8.986 0.391 1.00 0.77 C ATOM 1365 CD2 LEU A 90 2.765 -7.942 0.257 1.00 0.72 C ATOM 0 H LEU A 90 3.023 -8.588 -4.361 1.00 0.27 H new ATOM 0 HA LEU A 90 3.195 -10.863 -2.431 1.00 0.30 H new ATOM 0 HB2 LEU A 90 4.861 -9.097 -2.055 1.00 0.35 H new ATOM 0 HB3 LEU A 90 3.599 -7.881 -2.079 1.00 0.35 H new ATOM 0 HG LEU A 90 3.197 -10.011 -0.075 1.00 0.40 H new ATOM 0 HD11 LEU A 90 4.891 -9.082 1.469 1.00 0.77 H new ATOM 0 HD12 LEU A 90 5.644 -9.800 0.026 1.00 0.77 H new ATOM 0 HD13 LEU A 90 5.495 -8.032 0.165 1.00 0.77 H new ATOM 0 HD21 LEU A 90 2.665 -8.053 1.337 1.00 0.72 H new ATOM 0 HD22 LEU A 90 3.207 -6.972 0.031 1.00 0.72 H new ATOM 0 HD23 LEU A 90 1.781 -8.009 -0.207 1.00 0.72 H new ATOM 1377 N ASP A 91 0.943 -10.002 -1.267 1.00 0.35 N ATOM 1378 CA ASP A 91 -0.501 -9.972 -1.041 1.00 0.43 C ATOM 1379 C ASP A 91 -0.862 -9.353 0.300 1.00 0.43 C ATOM 1380 O ASP A 91 -0.257 -9.667 1.327 1.00 0.52 O ATOM 1381 CB ASP A 91 -1.101 -11.384 -1.113 1.00 0.63 C ATOM 1382 CG ASP A 91 -1.044 -11.997 -2.497 1.00 1.07 C ATOM 1383 OD1 ASP A 91 0.002 -12.575 -2.861 1.00 1.81 O ATOM 1384 OD2 ASP A 91 -2.037 -11.880 -3.243 1.00 1.67 O ATOM 0 H ASP A 91 1.497 -10.323 -0.473 1.00 0.35 H new ATOM 0 HA ASP A 91 -0.920 -9.352 -1.833 1.00 0.43 H new ATOM 0 HB2 ASP A 91 -0.569 -12.032 -0.416 1.00 0.63 H new ATOM 0 HB3 ASP A 91 -2.139 -11.346 -0.784 1.00 0.63 H new ATOM 1389 N ILE A 92 -1.844 -8.462 0.272 1.00 0.39 N ATOM 1390 CA ILE A 92 -2.475 -7.953 1.481 1.00 0.38 C ATOM 1391 C ILE A 92 -3.925 -8.422 1.507 1.00 0.38 C ATOM 1392 O ILE A 92 -4.716 -7.998 0.668 1.00 0.54 O ATOM 1393 CB ILE A 92 -2.441 -6.408 1.560 1.00 0.43 C ATOM 1394 CG1 ILE A 92 -1.002 -5.896 1.524 1.00 0.52 C ATOM 1395 CG2 ILE A 92 -3.155 -5.910 2.811 1.00 0.52 C ATOM 1396 CD1 ILE A 92 -0.116 -6.475 2.603 1.00 0.65 C ATOM 0 H ILE A 92 -2.225 -8.072 -0.590 1.00 0.39 H new ATOM 0 HA ILE A 92 -1.919 -8.336 2.337 1.00 0.38 H new ATOM 0 HB ILE A 92 -2.967 -6.016 0.690 1.00 0.43 H new ATOM 0 HG12 ILE A 92 -0.569 -6.127 0.550 1.00 0.52 H new ATOM 0 HG13 ILE A 92 -1.011 -4.810 1.620 1.00 0.52 H new ATOM 0 HG21 ILE A 92 -3.117 -4.821 2.843 1.00 0.52 H new ATOM 0 HG22 ILE A 92 -4.195 -6.236 2.791 1.00 0.52 H new ATOM 0 HG23 ILE A 92 -2.665 -6.316 3.696 1.00 0.52 H new ATOM 0 HD11 ILE A 92 0.888 -6.062 2.509 1.00 0.65 H new ATOM 0 HD12 ILE A 92 -0.523 -6.222 3.582 1.00 0.65 H new ATOM 0 HD13 ILE A 92 -0.074 -7.559 2.497 1.00 0.65 H new ATOM 1408 N PRO A 93 -4.261 -9.302 2.477 1.00 0.41 N ATOM 1409 CA PRO A 93 -5.536 -10.027 2.574 1.00 0.55 C ATOM 1410 C PRO A 93 -6.749 -9.310 1.967 1.00 0.61 C ATOM 1411 O PRO A 93 -6.924 -9.316 0.754 1.00 1.07 O ATOM 1412 CB PRO A 93 -5.689 -10.196 4.082 1.00 0.67 C ATOM 1413 CG PRO A 93 -4.293 -10.357 4.583 1.00 0.70 C ATOM 1414 CD PRO A 93 -3.382 -9.658 3.599 1.00 0.52 C ATOM 0 HA PRO A 93 -5.510 -10.953 2.000 1.00 0.55 H new ATOM 0 HB2 PRO A 93 -6.175 -9.330 4.531 1.00 0.67 H new ATOM 0 HB3 PRO A 93 -6.300 -11.065 4.324 1.00 0.67 H new ATOM 0 HG2 PRO A 93 -4.189 -9.924 5.578 1.00 0.70 H new ATOM 0 HG3 PRO A 93 -4.033 -11.412 4.665 1.00 0.70 H new ATOM 0 HD2 PRO A 93 -2.924 -8.773 4.041 1.00 0.52 H new ATOM 0 HD3 PRO A 93 -2.570 -10.310 3.277 1.00 0.52 H new ATOM 1422 N VAL A 94 -7.594 -8.714 2.806 1.00 0.38 N ATOM 1423 CA VAL A 94 -8.808 -8.055 2.333 1.00 0.34 C ATOM 1424 C VAL A 94 -9.354 -7.102 3.395 1.00 0.34 C ATOM 1425 O VAL A 94 -10.162 -7.495 4.221 1.00 0.36 O ATOM 1426 CB VAL A 94 -9.913 -9.089 1.992 1.00 0.36 C ATOM 1427 CG1 VAL A 94 -9.857 -9.519 0.535 1.00 0.42 C ATOM 1428 CG2 VAL A 94 -9.808 -10.308 2.902 1.00 0.46 C ATOM 0 H VAL A 94 -7.460 -8.674 3.816 1.00 0.38 H new ATOM 0 HA VAL A 94 -8.540 -7.499 1.434 1.00 0.34 H new ATOM 0 HB VAL A 94 -10.873 -8.601 2.159 1.00 0.36 H new ATOM 0 HG11 VAL A 94 -10.648 -10.243 0.339 1.00 0.42 H new ATOM 0 HG12 VAL A 94 -9.995 -8.649 -0.107 1.00 0.42 H new ATOM 0 HG13 VAL A 94 -8.889 -9.974 0.327 1.00 0.42 H new ATOM 0 HG21 VAL A 94 -10.592 -11.021 2.647 1.00 0.46 H new ATOM 0 HG22 VAL A 94 -8.833 -10.778 2.770 1.00 0.46 H new ATOM 0 HG23 VAL A 94 -9.924 -9.998 3.940 1.00 0.46 H new ATOM 1438 N VAL A 95 -8.984 -5.832 3.341 1.00 0.35 N ATOM 1439 CA VAL A 95 -9.281 -4.941 4.465 1.00 0.35 C ATOM 1440 C VAL A 95 -10.003 -3.645 4.075 1.00 0.36 C ATOM 1441 O VAL A 95 -9.403 -2.726 3.516 1.00 0.44 O ATOM 1442 CB VAL A 95 -7.982 -4.598 5.229 1.00 0.42 C ATOM 1443 CG1 VAL A 95 -6.953 -3.977 4.291 1.00 0.48 C ATOM 1444 CG2 VAL A 95 -8.270 -3.680 6.407 1.00 0.45 C ATOM 0 H VAL A 95 -8.492 -5.399 2.559 1.00 0.35 H new ATOM 0 HA VAL A 95 -9.972 -5.494 5.101 1.00 0.35 H new ATOM 0 HB VAL A 95 -7.565 -5.525 5.623 1.00 0.42 H new ATOM 0 HG11 VAL A 95 -6.046 -3.743 4.849 1.00 0.48 H new ATOM 0 HG12 VAL A 95 -6.717 -4.681 3.493 1.00 0.48 H new ATOM 0 HG13 VAL A 95 -7.359 -3.062 3.859 1.00 0.48 H new ATOM 0 HG21 VAL A 95 -7.340 -3.454 6.928 1.00 0.45 H new ATOM 0 HG22 VAL A 95 -8.718 -2.754 6.046 1.00 0.45 H new ATOM 0 HG23 VAL A 95 -8.959 -4.173 7.093 1.00 0.45 H new ATOM 1454 N VAL A 96 -11.305 -3.593 4.317 1.00 0.34 N ATOM 1455 CA VAL A 96 -11.998 -2.319 4.405 1.00 0.34 C ATOM 1456 C VAL A 96 -13.248 -2.420 5.283 1.00 0.36 C ATOM 1457 O VAL A 96 -14.261 -2.978 4.866 1.00 0.47 O ATOM 1458 CB VAL A 96 -12.339 -1.726 3.027 1.00 0.45 C ATOM 1459 CG1 VAL A 96 -13.009 -2.747 2.119 1.00 1.02 C ATOM 1460 CG2 VAL A 96 -13.210 -0.501 3.207 1.00 1.07 C ATOM 0 H VAL A 96 -11.897 -4.412 4.455 1.00 0.34 H new ATOM 0 HA VAL A 96 -11.302 -1.628 4.880 1.00 0.34 H new ATOM 0 HB VAL A 96 -11.409 -1.437 2.538 1.00 0.45 H new ATOM 0 HG11 VAL A 96 -13.233 -2.287 1.157 1.00 1.02 H new ATOM 0 HG12 VAL A 96 -12.340 -3.595 1.969 1.00 1.02 H new ATOM 0 HG13 VAL A 96 -13.935 -3.092 2.580 1.00 1.02 H new ATOM 0 HG21 VAL A 96 -13.452 -0.080 2.231 1.00 1.07 H new ATOM 0 HG22 VAL A 96 -14.130 -0.781 3.720 1.00 1.07 H new ATOM 0 HG23 VAL A 96 -12.676 0.241 3.800 1.00 1.07 H new ATOM 1470 N PRO A 97 -13.189 -1.915 6.523 1.00 0.34 N ATOM 1471 CA PRO A 97 -14.345 -1.895 7.416 1.00 0.36 C ATOM 1472 C PRO A 97 -15.633 -1.445 6.735 1.00 0.33 C ATOM 1473 O PRO A 97 -15.653 -0.474 5.976 1.00 0.34 O ATOM 1474 CB PRO A 97 -13.924 -0.917 8.505 1.00 0.41 C ATOM 1475 CG PRO A 97 -12.447 -1.074 8.580 1.00 0.48 C ATOM 1476 CD PRO A 97 -11.989 -1.354 7.171 1.00 0.36 C ATOM 0 HA PRO A 97 -14.586 -2.892 7.786 1.00 0.36 H new ATOM 0 HB2 PRO A 97 -14.204 0.106 8.253 1.00 0.41 H new ATOM 0 HB3 PRO A 97 -14.399 -1.152 9.458 1.00 0.41 H new ATOM 0 HG2 PRO A 97 -11.978 -0.171 8.971 1.00 0.48 H new ATOM 0 HG3 PRO A 97 -12.174 -1.890 9.249 1.00 0.48 H new ATOM 0 HD2 PRO A 97 -11.651 -0.446 6.671 1.00 0.36 H new ATOM 0 HD3 PRO A 97 -11.157 -2.058 7.152 1.00 0.36 H new ATOM 1484 N TYR A 98 -16.702 -2.169 7.038 1.00 0.35 N ATOM 1485 CA TYR A 98 -18.019 -1.956 6.442 1.00 0.37 C ATOM 1486 C TYR A 98 -18.445 -0.493 6.570 1.00 0.36 C ATOM 1487 O TYR A 98 -19.034 0.079 5.653 1.00 0.39 O ATOM 1488 CB TYR A 98 -19.016 -2.899 7.147 1.00 0.47 C ATOM 1489 CG TYR A 98 -20.485 -2.663 6.854 1.00 0.60 C ATOM 1490 CD1 TYR A 98 -21.142 -1.526 7.317 1.00 0.90 C ATOM 1491 CD2 TYR A 98 -21.223 -3.604 6.152 1.00 1.04 C ATOM 1492 CE1 TYR A 98 -22.485 -1.334 7.079 1.00 1.06 C ATOM 1493 CE2 TYR A 98 -22.570 -3.422 5.919 1.00 1.23 C ATOM 1494 CZ TYR A 98 -23.195 -2.287 6.387 1.00 1.08 C ATOM 1495 OH TYR A 98 -24.534 -2.102 6.162 1.00 1.31 O ATOM 0 H TYR A 98 -16.681 -2.932 7.714 1.00 0.35 H new ATOM 0 HA TYR A 98 -17.993 -2.181 5.376 1.00 0.37 H new ATOM 0 HB2 TYR A 98 -18.772 -3.924 6.869 1.00 0.47 H new ATOM 0 HB3 TYR A 98 -18.864 -2.815 8.223 1.00 0.47 H new ATOM 0 HD1 TYR A 98 -20.589 -0.782 7.872 1.00 0.90 H new ATOM 0 HD2 TYR A 98 -20.735 -4.494 5.782 1.00 1.04 H new ATOM 0 HE1 TYR A 98 -22.977 -0.441 7.434 1.00 1.06 H new ATOM 0 HE2 TYR A 98 -23.132 -4.165 5.373 1.00 1.23 H new ATOM 0 HH TYR A 98 -24.890 -2.864 5.659 1.00 1.31 H new ATOM 1505 N SER A 99 -18.113 0.107 7.701 1.00 0.37 N ATOM 1506 CA SER A 99 -18.518 1.469 8.010 1.00 0.41 C ATOM 1507 C SER A 99 -17.931 2.492 7.039 1.00 0.38 C ATOM 1508 O SER A 99 -18.509 3.554 6.821 1.00 0.39 O ATOM 1509 CB SER A 99 -18.096 1.791 9.436 1.00 0.50 C ATOM 1510 OG SER A 99 -16.918 1.078 9.778 1.00 1.20 O ATOM 0 H SER A 99 -17.555 -0.336 8.431 1.00 0.37 H new ATOM 0 HA SER A 99 -19.601 1.533 7.907 1.00 0.41 H new ATOM 0 HB2 SER A 99 -17.922 2.862 9.537 1.00 0.50 H new ATOM 0 HB3 SER A 99 -18.899 1.532 10.126 1.00 0.50 H new ATOM 0 HG SER A 99 -16.658 1.297 10.697 1.00 1.20 H new ATOM 1516 N ILE A 100 -16.801 2.166 6.439 1.00 0.36 N ATOM 1517 CA ILE A 100 -16.113 3.116 5.580 1.00 0.37 C ATOM 1518 C ILE A 100 -16.874 3.318 4.293 1.00 0.34 C ATOM 1519 O ILE A 100 -17.193 4.445 3.897 1.00 0.36 O ATOM 1520 CB ILE A 100 -14.713 2.619 5.206 1.00 0.41 C ATOM 1521 CG1 ILE A 100 -13.991 2.060 6.439 1.00 0.45 C ATOM 1522 CG2 ILE A 100 -13.921 3.759 4.593 1.00 0.48 C ATOM 1523 CD1 ILE A 100 -13.929 3.025 7.608 1.00 0.51 C ATOM 0 H ILE A 100 -16.342 1.259 6.528 1.00 0.36 H new ATOM 0 HA ILE A 100 -16.043 4.049 6.140 1.00 0.37 H new ATOM 0 HB ILE A 100 -14.802 1.814 4.477 1.00 0.41 H new ATOM 0 HG12 ILE A 100 -14.495 1.148 6.760 1.00 0.45 H new ATOM 0 HG13 ILE A 100 -12.976 1.781 6.157 1.00 0.45 H new ATOM 0 HG21 ILE A 100 -12.924 3.407 4.326 1.00 0.48 H new ATOM 0 HG22 ILE A 100 -14.431 4.117 3.699 1.00 0.48 H new ATOM 0 HG23 ILE A 100 -13.838 4.573 5.313 1.00 0.48 H new ATOM 0 HD11 ILE A 100 -13.404 2.556 8.440 1.00 0.51 H new ATOM 0 HD12 ILE A 100 -13.398 3.928 7.307 1.00 0.51 H new ATOM 0 HD13 ILE A 100 -14.941 3.286 7.919 1.00 0.51 H new ATOM 1535 N LEU A 101 -17.122 2.199 3.643 1.00 0.33 N ATOM 1536 CA LEU A 101 -17.921 2.147 2.425 1.00 0.34 C ATOM 1537 C LEU A 101 -19.263 2.800 2.678 1.00 0.34 C ATOM 1538 O LEU A 101 -19.804 3.522 1.843 1.00 0.36 O ATOM 1539 CB LEU A 101 -18.106 0.704 1.973 1.00 0.35 C ATOM 1540 CG LEU A 101 -16.812 -0.077 1.740 1.00 0.41 C ATOM 1541 CD1 LEU A 101 -15.665 0.836 1.346 1.00 0.89 C ATOM 1542 CD2 LEU A 101 -16.469 -0.937 2.946 1.00 1.00 C ATOM 0 H LEU A 101 -16.773 1.289 3.944 1.00 0.33 H new ATOM 0 HA LEU A 101 -17.404 2.687 1.631 1.00 0.34 H new ATOM 0 HB2 LEU A 101 -18.699 0.179 2.722 1.00 0.35 H new ATOM 0 HB3 LEU A 101 -18.685 0.701 1.049 1.00 0.35 H new ATOM 0 HG LEU A 101 -16.978 -0.748 0.897 1.00 0.41 H new ATOM 0 HD11 LEU A 101 -14.764 0.242 1.190 1.00 0.89 H new ATOM 0 HD12 LEU A 101 -15.918 1.361 0.425 1.00 0.89 H new ATOM 0 HD13 LEU A 101 -15.488 1.561 2.140 1.00 0.89 H new ATOM 0 HD21 LEU A 101 -15.545 -1.482 2.753 1.00 1.00 H new ATOM 0 HD22 LEU A 101 -16.340 -0.301 3.822 1.00 1.00 H new ATOM 0 HD23 LEU A 101 -17.276 -1.646 3.129 1.00 1.00 H new ATOM 1554 N PHE A 102 -19.705 2.623 3.906 1.00 0.34 N ATOM 1555 CA PHE A 102 -20.971 3.154 4.349 1.00 0.36 C ATOM 1556 C PHE A 102 -20.943 4.679 4.226 1.00 0.35 C ATOM 1557 O PHE A 102 -21.916 5.303 3.810 1.00 0.36 O ATOM 1558 CB PHE A 102 -21.238 2.722 5.788 1.00 0.42 C ATOM 1559 CG PHE A 102 -22.628 3.016 6.266 1.00 0.57 C ATOM 1560 CD1 PHE A 102 -23.686 2.200 5.899 1.00 0.74 C ATOM 1561 CD2 PHE A 102 -22.880 4.104 7.083 1.00 0.80 C ATOM 1562 CE1 PHE A 102 -24.969 2.464 6.338 1.00 0.90 C ATOM 1563 CE2 PHE A 102 -24.161 4.372 7.526 1.00 0.96 C ATOM 1564 CZ PHE A 102 -25.205 3.551 7.152 1.00 0.94 C ATOM 0 H PHE A 102 -19.195 2.107 4.622 1.00 0.34 H new ATOM 0 HA PHE A 102 -21.778 2.767 3.727 1.00 0.36 H new ATOM 0 HB2 PHE A 102 -21.054 1.651 5.875 1.00 0.42 H new ATOM 0 HB3 PHE A 102 -20.526 3.222 6.444 1.00 0.42 H new ATOM 0 HD1 PHE A 102 -23.505 1.347 5.262 1.00 0.74 H new ATOM 0 HD2 PHE A 102 -22.067 4.751 7.378 1.00 0.80 H new ATOM 0 HE1 PHE A 102 -25.785 1.820 6.044 1.00 0.90 H new ATOM 0 HE2 PHE A 102 -24.345 5.223 8.164 1.00 0.96 H new ATOM 0 HZ PHE A 102 -26.207 3.760 7.497 1.00 0.94 H new ATOM 1574 N ASN A 103 -19.803 5.278 4.569 1.00 0.36 N ATOM 1575 CA ASN A 103 -19.638 6.726 4.455 1.00 0.38 C ATOM 1576 C ASN A 103 -19.452 7.152 2.996 1.00 0.36 C ATOM 1577 O ASN A 103 -20.207 7.974 2.483 1.00 0.38 O ATOM 1578 CB ASN A 103 -18.426 7.214 5.258 1.00 0.43 C ATOM 1579 CG ASN A 103 -18.606 7.177 6.772 1.00 0.49 C ATOM 1580 OD1 ASN A 103 -19.227 6.130 7.289 1.00 0.82 O flip ATOM 1581 ND2 ASN A 103 -18.143 8.072 7.474 1.00 0.49 N flip ATOM 0 H ASN A 103 -18.984 4.786 4.926 1.00 0.36 H new ATOM 0 HA ASN A 103 -20.547 7.175 4.855 1.00 0.38 H new ATOM 0 HB2 ASN A 103 -17.563 6.603 4.994 1.00 0.43 H new ATOM 0 HB3 ASN A 103 -18.197 8.237 4.958 1.00 0.43 H new ATOM 0 HD21 ASN A 103 -17.670 8.866 7.042 1.00 0.49 H new ATOM 0 HD22 ASN A 103 -18.232 8.022 8.489 1.00 0.49 H new ATOM 1588 N LEU A 104 -18.431 6.601 2.336 1.00 0.36 N ATOM 1589 CA LEU A 104 -18.109 6.969 0.951 1.00 0.39 C ATOM 1590 C LEU A 104 -19.267 6.740 -0.027 1.00 0.37 C ATOM 1591 O LEU A 104 -19.617 7.642 -0.780 1.00 0.40 O ATOM 1592 CB LEU A 104 -16.845 6.240 0.484 1.00 0.45 C ATOM 1593 CG LEU A 104 -16.881 4.716 0.580 1.00 0.51 C ATOM 1594 CD1 LEU A 104 -17.286 4.091 -0.746 1.00 0.55 C ATOM 1595 CD2 LEU A 104 -15.535 4.193 1.028 1.00 0.65 C ATOM 0 H LEU A 104 -17.811 5.897 2.737 1.00 0.36 H new ATOM 0 HA LEU A 104 -17.925 8.043 0.951 1.00 0.39 H new ATOM 0 HB2 LEU A 104 -16.652 6.515 -0.553 1.00 0.45 H new ATOM 0 HB3 LEU A 104 -16.002 6.602 1.072 1.00 0.45 H new ATOM 0 HG LEU A 104 -17.631 4.437 1.320 1.00 0.51 H new ATOM 0 HD11 LEU A 104 -17.303 3.006 -0.647 1.00 0.55 H new ATOM 0 HD12 LEU A 104 -18.278 4.445 -1.027 1.00 0.55 H new ATOM 0 HD13 LEU A 104 -16.568 4.374 -1.516 1.00 0.55 H new ATOM 0 HD21 LEU A 104 -15.571 3.106 1.093 1.00 0.65 H new ATOM 0 HD22 LEU A 104 -14.772 4.488 0.308 1.00 0.65 H new ATOM 0 HD23 LEU A 104 -15.291 4.608 2.006 1.00 0.65 H new ATOM 1607 N ALA A 105 -19.857 5.553 -0.018 1.00 0.35 N ATOM 1608 CA ALA A 105 -20.955 5.241 -0.937 1.00 0.38 C ATOM 1609 C ALA A 105 -22.183 6.069 -0.600 1.00 0.37 C ATOM 1610 O ALA A 105 -23.009 6.365 -1.450 1.00 0.39 O ATOM 1611 CB ALA A 105 -21.287 3.761 -0.897 1.00 0.43 C ATOM 0 H ALA A 105 -19.600 4.791 0.609 1.00 0.35 H new ATOM 0 HA ALA A 105 -20.634 5.492 -1.948 1.00 0.38 H new ATOM 0 HB1 ALA A 105 -22.105 3.553 -1.587 1.00 0.43 H new ATOM 0 HB2 ALA A 105 -20.410 3.183 -1.189 1.00 0.43 H new ATOM 0 HB3 ALA A 105 -21.585 3.482 0.114 1.00 0.43 H new ATOM 1617 N ARG A 106 -22.282 6.445 0.652 1.00 0.36 N ATOM 1618 CA ARG A 106 -23.361 7.323 1.069 1.00 0.40 C ATOM 1619 C ARG A 106 -23.152 8.737 0.533 1.00 0.38 C ATOM 1620 O ARG A 106 -24.038 9.294 -0.098 1.00 0.40 O ATOM 1621 CB ARG A 106 -23.504 7.337 2.576 1.00 0.48 C ATOM 1622 CG ARG A 106 -24.363 8.472 3.101 1.00 0.53 C ATOM 1623 CD ARG A 106 -24.508 8.379 4.607 1.00 0.73 C ATOM 1624 NE ARG A 106 -23.355 7.707 5.200 1.00 0.91 N ATOM 1625 CZ ARG A 106 -22.957 7.855 6.455 1.00 1.38 C ATOM 1626 NH1 ARG A 106 -23.591 8.687 7.275 1.00 1.52 N ATOM 1627 NH2 ARG A 106 -21.910 7.167 6.883 1.00 1.81 N ATOM 0 H ARG A 106 -21.641 6.165 1.394 1.00 0.36 H new ATOM 0 HA ARG A 106 -24.287 6.933 0.648 1.00 0.40 H new ATOM 0 HB2 ARG A 106 -23.934 6.389 2.899 1.00 0.48 H new ATOM 0 HB3 ARG A 106 -22.513 7.407 3.025 1.00 0.48 H new ATOM 0 HG2 ARG A 106 -23.915 9.429 2.832 1.00 0.53 H new ATOM 0 HG3 ARG A 106 -25.347 8.437 2.633 1.00 0.53 H new ATOM 0 HD2 ARG A 106 -24.608 9.379 5.029 1.00 0.73 H new ATOM 0 HD3 ARG A 106 -25.419 7.835 4.856 1.00 0.73 H new ATOM 0 HE ARG A 106 -22.817 7.078 4.604 1.00 0.91 H new ATOM 0 HH11 ARG A 106 -24.394 9.220 6.940 1.00 1.52 H new ATOM 0 HH12 ARG A 106 -23.275 8.792 8.239 1.00 1.52 H new ATOM 0 HH21 ARG A 106 -21.422 6.534 6.249 1.00 1.81 H new ATOM 0 HH22 ARG A 106 -21.591 7.270 7.846 1.00 1.81 H new ATOM 1641 N ASP A 107 -21.975 9.301 0.763 1.00 0.37 N ATOM 1642 CA ASP A 107 -21.718 10.693 0.394 1.00 0.41 C ATOM 1643 C ASP A 107 -21.370 10.832 -1.086 1.00 0.38 C ATOM 1644 O ASP A 107 -21.978 11.612 -1.827 1.00 0.41 O ATOM 1645 CB ASP A 107 -20.571 11.249 1.238 1.00 0.46 C ATOM 1646 CG ASP A 107 -20.260 12.696 0.919 1.00 0.57 C ATOM 1647 OD1 ASP A 107 -21.107 13.563 1.205 1.00 0.80 O ATOM 1648 OD2 ASP A 107 -19.179 12.973 0.365 1.00 0.68 O ATOM 0 H ASP A 107 -21.186 8.824 1.200 1.00 0.37 H new ATOM 0 HA ASP A 107 -22.631 11.258 0.582 1.00 0.41 H new ATOM 0 HB2 ASP A 107 -20.826 11.161 2.294 1.00 0.46 H new ATOM 0 HB3 ASP A 107 -19.679 10.645 1.074 1.00 0.46 H new ATOM 1653 N VAL A 108 -20.411 10.057 -1.537 1.00 0.34 N ATOM 1654 CA VAL A 108 -19.969 10.167 -2.906 1.00 0.33 C ATOM 1655 C VAL A 108 -20.758 9.218 -3.797 1.00 0.32 C ATOM 1656 O VAL A 108 -20.801 9.399 -4.999 1.00 0.37 O ATOM 1657 CB VAL A 108 -18.462 9.892 -3.045 1.00 0.32 C ATOM 1658 CG1 VAL A 108 -17.925 10.487 -4.337 1.00 0.77 C ATOM 1659 CG2 VAL A 108 -17.701 10.436 -1.849 1.00 0.88 C ATOM 0 H VAL A 108 -19.927 9.351 -0.982 1.00 0.34 H new ATOM 0 HA VAL A 108 -20.150 11.193 -3.225 1.00 0.33 H new ATOM 0 HB VAL A 108 -18.316 8.812 -3.078 1.00 0.32 H new ATOM 0 HG11 VAL A 108 -16.857 10.281 -4.416 1.00 0.77 H new ATOM 0 HG12 VAL A 108 -18.444 10.042 -5.186 1.00 0.77 H new ATOM 0 HG13 VAL A 108 -18.088 11.565 -4.337 1.00 0.77 H new ATOM 0 HG21 VAL A 108 -16.638 10.230 -1.970 1.00 0.88 H new ATOM 0 HG22 VAL A 108 -17.856 11.513 -1.778 1.00 0.88 H new ATOM 0 HG23 VAL A 108 -18.062 9.957 -0.939 1.00 0.88 H new ATOM 1669 N GLY A 109 -21.340 8.176 -3.204 1.00 0.29 N ATOM 1670 CA GLY A 109 -22.315 7.367 -3.925 1.00 0.30 C ATOM 1671 C GLY A 109 -23.625 8.107 -4.082 1.00 0.33 C ATOM 1672 O GLY A 109 -24.461 7.765 -4.921 1.00 0.38 O ATOM 0 H GLY A 109 -21.157 7.878 -2.246 1.00 0.29 H new ATOM 0 HA2 GLY A 109 -21.921 7.106 -4.907 1.00 0.30 H new ATOM 0 HA3 GLY A 109 -22.483 6.432 -3.390 1.00 0.30 H new ATOM 1676 N VAL A 110 -23.791 9.102 -3.221 1.00 0.37 N ATOM 1677 CA VAL A 110 -24.818 10.110 -3.424 1.00 0.46 C ATOM 1678 C VAL A 110 -24.637 10.638 -4.843 1.00 0.47 C ATOM 1679 O VAL A 110 -25.594 10.746 -5.612 1.00 0.54 O ATOM 1680 CB VAL A 110 -24.746 11.258 -2.386 1.00 0.56 C ATOM 1681 CG1 VAL A 110 -24.698 12.629 -3.043 1.00 1.09 C ATOM 1682 CG2 VAL A 110 -25.924 11.182 -1.429 1.00 0.78 C ATOM 0 H VAL A 110 -23.229 9.231 -2.379 1.00 0.37 H new ATOM 0 HA VAL A 110 -25.804 9.665 -3.287 1.00 0.46 H new ATOM 0 HB VAL A 110 -23.817 11.128 -1.831 1.00 0.56 H new ATOM 0 HG11 VAL A 110 -24.648 13.400 -2.274 1.00 1.09 H new ATOM 0 HG12 VAL A 110 -23.817 12.696 -3.681 1.00 1.09 H new ATOM 0 HG13 VAL A 110 -25.594 12.775 -3.646 1.00 1.09 H new ATOM 0 HG21 VAL A 110 -25.859 11.995 -0.706 1.00 0.78 H new ATOM 0 HG22 VAL A 110 -26.855 11.269 -1.990 1.00 0.78 H new ATOM 0 HG23 VAL A 110 -25.905 10.227 -0.904 1.00 0.78 H new ATOM 1692 N ASP A 111 -23.388 10.974 -5.166 1.00 0.45 N ATOM 1693 CA ASP A 111 -22.981 11.142 -6.562 1.00 0.52 C ATOM 1694 C ASP A 111 -22.958 9.785 -7.278 1.00 0.59 C ATOM 1695 O ASP A 111 -23.997 9.300 -7.726 1.00 1.05 O ATOM 1696 CB ASP A 111 -21.606 11.817 -6.664 1.00 0.60 C ATOM 1697 CG ASP A 111 -21.619 13.261 -6.201 1.00 1.30 C ATOM 1698 OD1 ASP A 111 -21.969 14.146 -7.007 1.00 1.86 O ATOM 1699 OD2 ASP A 111 -21.295 13.513 -5.020 1.00 1.87 O ATOM 0 H ASP A 111 -22.645 11.134 -4.486 1.00 0.45 H new ATOM 0 HA ASP A 111 -23.712 11.788 -7.048 1.00 0.52 H new ATOM 0 HB2 ASP A 111 -20.887 11.256 -6.067 1.00 0.60 H new ATOM 0 HB3 ASP A 111 -21.263 11.776 -7.698 1.00 0.60 H new ATOM 1704 N TRP A 112 -21.771 9.177 -7.374 1.00 0.43 N ATOM 1705 CA TRP A 112 -21.621 7.830 -7.942 1.00 0.45 C ATOM 1706 C TRP A 112 -20.165 7.331 -7.902 1.00 0.42 C ATOM 1707 O TRP A 112 -19.892 6.235 -7.425 1.00 0.43 O ATOM 1708 CB TRP A 112 -22.162 7.763 -9.386 1.00 0.57 C ATOM 1709 CG TRP A 112 -21.475 8.664 -10.373 1.00 0.64 C ATOM 1710 CD1 TRP A 112 -21.332 10.025 -10.317 1.00 0.72 C ATOM 1711 CD2 TRP A 112 -20.859 8.249 -11.589 1.00 0.78 C ATOM 1712 NE1 TRP A 112 -20.645 10.470 -11.420 1.00 0.83 N ATOM 1713 CE2 TRP A 112 -20.345 9.396 -12.217 1.00 0.86 C ATOM 1714 CE3 TRP A 112 -20.685 7.009 -12.198 1.00 0.96 C ATOM 1715 CZ2 TRP A 112 -19.668 9.339 -13.432 1.00 1.04 C ATOM 1716 CZ3 TRP A 112 -20.018 6.950 -13.408 1.00 1.16 C ATOM 1717 CH2 TRP A 112 -19.515 8.108 -14.012 1.00 1.17 C ATOM 0 H TRP A 112 -20.895 9.598 -7.064 1.00 0.43 H new ATOM 0 HA TRP A 112 -22.215 7.168 -7.312 1.00 0.45 H new ATOM 0 HB2 TRP A 112 -22.080 6.735 -9.740 1.00 0.57 H new ATOM 0 HB3 TRP A 112 -23.223 8.011 -9.370 1.00 0.57 H new ATOM 0 HD1 TRP A 112 -21.704 10.655 -9.523 1.00 0.72 H new ATOM 0 HE1 TRP A 112 -20.399 11.441 -11.614 1.00 0.83 H new ATOM 0 HE3 TRP A 112 -21.064 6.110 -11.734 1.00 0.96 H new ATOM 0 HZ2 TRP A 112 -19.278 10.231 -13.899 1.00 1.04 H new ATOM 0 HZ3 TRP A 112 -19.883 5.995 -13.895 1.00 1.16 H new ATOM 0 HH2 TRP A 112 -18.995 8.029 -14.955 1.00 1.17 H new ATOM 1728 N ASP A 113 -19.254 8.132 -8.429 1.00 0.42 N ATOM 1729 CA ASP A 113 -17.843 7.733 -8.554 1.00 0.42 C ATOM 1730 C ASP A 113 -17.010 8.246 -7.377 1.00 0.40 C ATOM 1731 O ASP A 113 -16.992 9.448 -7.109 1.00 0.50 O ATOM 1732 CB ASP A 113 -17.281 8.267 -9.877 1.00 0.51 C ATOM 1733 CG ASP A 113 -15.925 7.688 -10.238 1.00 1.26 C ATOM 1734 OD1 ASP A 113 -14.900 8.221 -9.771 1.00 1.61 O ATOM 1735 OD2 ASP A 113 -15.878 6.721 -11.027 1.00 2.15 O ATOM 0 H ASP A 113 -19.457 9.067 -8.781 1.00 0.42 H new ATOM 0 HA ASP A 113 -17.788 6.644 -8.544 1.00 0.42 H new ATOM 0 HB2 ASP A 113 -17.986 8.045 -10.678 1.00 0.51 H new ATOM 0 HB3 ASP A 113 -17.199 9.352 -9.816 1.00 0.51 H new ATOM 1740 N ILE A 114 -16.317 7.336 -6.679 1.00 0.32 N ATOM 1741 CA ILE A 114 -15.528 7.709 -5.498 1.00 0.32 C ATOM 1742 C ILE A 114 -14.046 7.410 -5.736 1.00 0.32 C ATOM 1743 O ILE A 114 -13.699 6.550 -6.550 1.00 0.33 O ATOM 1744 CB ILE A 114 -15.993 6.981 -4.185 1.00 0.31 C ATOM 1745 CG1 ILE A 114 -17.512 7.000 -4.038 1.00 0.39 C ATOM 1746 CG2 ILE A 114 -15.354 7.623 -2.961 1.00 0.33 C ATOM 1747 CD1 ILE A 114 -18.193 5.889 -4.789 1.00 0.38 C ATOM 0 H ILE A 114 -16.287 6.343 -6.910 1.00 0.32 H new ATOM 0 HA ILE A 114 -15.686 8.778 -5.352 1.00 0.32 H new ATOM 0 HB ILE A 114 -15.669 5.943 -4.260 1.00 0.31 H new ATOM 0 HG12 ILE A 114 -17.769 6.927 -2.981 1.00 0.39 H new ATOM 0 HG13 ILE A 114 -17.893 7.957 -4.393 1.00 0.39 H new ATOM 0 HG21 ILE A 114 -15.688 7.105 -2.062 1.00 0.33 H new ATOM 0 HG22 ILE A 114 -14.269 7.553 -3.038 1.00 0.33 H new ATOM 0 HG23 ILE A 114 -15.647 8.672 -2.906 1.00 0.33 H new ATOM 0 HD11 ILE A 114 -19.271 5.959 -4.644 1.00 0.38 H new ATOM 0 HD12 ILE A 114 -17.964 5.974 -5.851 1.00 0.38 H new ATOM 0 HD13 ILE A 114 -17.838 4.928 -4.417 1.00 0.38 H new ATOM 1759 N ASP A 115 -13.181 8.117 -5.017 1.00 0.35 N ATOM 1760 CA ASP A 115 -11.736 7.927 -5.121 1.00 0.38 C ATOM 1761 C ASP A 115 -11.289 6.984 -4.015 1.00 0.34 C ATOM 1762 O ASP A 115 -11.965 6.863 -2.996 1.00 0.31 O ATOM 1763 CB ASP A 115 -10.993 9.260 -4.969 1.00 0.46 C ATOM 1764 CG ASP A 115 -9.664 9.308 -5.703 1.00 1.27 C ATOM 1765 OD1 ASP A 115 -8.795 8.448 -5.450 1.00 1.36 O ATOM 1766 OD2 ASP A 115 -9.475 10.231 -6.526 1.00 2.11 O ATOM 0 H ASP A 115 -13.458 8.835 -4.348 1.00 0.35 H new ATOM 0 HA ASP A 115 -11.506 7.513 -6.102 1.00 0.38 H new ATOM 0 HB2 ASP A 115 -11.630 10.064 -5.337 1.00 0.46 H new ATOM 0 HB3 ASP A 115 -10.820 9.450 -3.910 1.00 0.46 H new ATOM 1771 N TYR A 116 -10.185 6.293 -4.223 1.00 0.37 N ATOM 1772 CA TYR A 116 -9.622 5.408 -3.213 1.00 0.37 C ATOM 1773 C TYR A 116 -8.113 5.556 -3.243 1.00 0.40 C ATOM 1774 O TYR A 116 -7.557 5.825 -4.298 1.00 0.62 O ATOM 1775 CB TYR A 116 -9.996 3.947 -3.479 1.00 0.38 C ATOM 1776 CG TYR A 116 -11.470 3.656 -3.349 1.00 0.37 C ATOM 1777 CD1 TYR A 116 -12.354 4.006 -4.356 1.00 0.37 C ATOM 1778 CD2 TYR A 116 -11.975 3.035 -2.218 1.00 0.40 C ATOM 1779 CE1 TYR A 116 -13.703 3.749 -4.238 1.00 0.39 C ATOM 1780 CE2 TYR A 116 -13.320 2.767 -2.092 1.00 0.42 C ATOM 1781 CZ TYR A 116 -14.182 3.114 -3.116 1.00 0.41 C ATOM 1782 OH TYR A 116 -15.529 2.876 -2.970 1.00 0.45 O ATOM 0 H TYR A 116 -9.652 6.326 -5.092 1.00 0.37 H new ATOM 0 HA TYR A 116 -10.023 5.682 -2.237 1.00 0.37 H new ATOM 0 HB2 TYR A 116 -9.670 3.677 -4.483 1.00 0.38 H new ATOM 0 HB3 TYR A 116 -9.448 3.310 -2.784 1.00 0.38 H new ATOM 0 HD1 TYR A 116 -11.981 4.488 -5.248 1.00 0.37 H new ATOM 0 HD2 TYR A 116 -11.302 2.756 -1.421 1.00 0.40 H new ATOM 0 HE1 TYR A 116 -14.382 4.045 -5.024 1.00 0.39 H new ATOM 0 HE2 TYR A 116 -13.699 2.290 -1.200 1.00 0.42 H new ATOM 0 HH TYR A 116 -15.673 2.259 -2.223 1.00 0.45 H new ATOM 1792 N GLU A 117 -7.443 5.380 -2.116 1.00 0.27 N ATOM 1793 CA GLU A 117 -5.999 5.545 -2.086 1.00 0.28 C ATOM 1794 C GLU A 117 -5.363 4.589 -1.102 1.00 0.28 C ATOM 1795 O GLU A 117 -5.887 4.359 -0.010 1.00 0.31 O ATOM 1796 CB GLU A 117 -5.602 6.972 -1.702 1.00 0.31 C ATOM 1797 CG GLU A 117 -4.106 7.231 -1.839 1.00 0.39 C ATOM 1798 CD GLU A 117 -3.620 8.345 -0.947 1.00 0.51 C ATOM 1799 OE1 GLU A 117 -3.790 9.521 -1.327 1.00 0.66 O ATOM 1800 OE2 GLU A 117 -3.064 8.052 0.132 1.00 0.80 O ATOM 0 H GLU A 117 -7.867 5.127 -1.223 1.00 0.27 H new ATOM 0 HA GLU A 117 -5.641 5.331 -3.093 1.00 0.28 H new ATOM 0 HB2 GLU A 117 -6.146 7.676 -2.331 1.00 0.31 H new ATOM 0 HB3 GLU A 117 -5.906 7.163 -0.673 1.00 0.31 H new ATOM 0 HG2 GLU A 117 -3.561 6.318 -1.601 1.00 0.39 H new ATOM 0 HG3 GLU A 117 -3.878 7.477 -2.876 1.00 0.39 H new ATOM 1807 N LEU A 118 -4.238 4.033 -1.503 1.00 0.29 N ATOM 1808 CA LEU A 118 -3.407 3.255 -0.620 1.00 0.28 C ATOM 1809 C LEU A 118 -2.172 4.051 -0.237 1.00 0.28 C ATOM 1810 O LEU A 118 -1.465 4.570 -1.099 1.00 0.32 O ATOM 1811 CB LEU A 118 -3.006 1.941 -1.289 1.00 0.35 C ATOM 1812 CG LEU A 118 -1.799 1.231 -0.671 1.00 0.40 C ATOM 1813 CD1 LEU A 118 -2.029 1.001 0.809 1.00 1.24 C ATOM 1814 CD2 LEU A 118 -1.526 -0.086 -1.382 1.00 1.25 C ATOM 0 H LEU A 118 -3.877 4.111 -2.454 1.00 0.29 H new ATOM 0 HA LEU A 118 -3.971 3.024 0.283 1.00 0.28 H new ATOM 0 HB2 LEU A 118 -3.859 1.263 -1.260 1.00 0.35 H new ATOM 0 HB3 LEU A 118 -2.791 2.138 -2.339 1.00 0.35 H new ATOM 0 HG LEU A 118 -0.923 1.868 -0.793 1.00 0.40 H new ATOM 0 HD11 LEU A 118 -1.164 0.495 1.237 1.00 1.24 H new ATOM 0 HD12 LEU A 118 -2.173 1.959 1.308 1.00 1.24 H new ATOM 0 HD13 LEU A 118 -2.916 0.383 0.948 1.00 1.24 H new ATOM 0 HD21 LEU A 118 -0.664 -0.574 -0.926 1.00 1.25 H new ATOM 0 HD22 LEU A 118 -2.398 -0.734 -1.295 1.00 1.25 H new ATOM 0 HD23 LEU A 118 -1.320 0.105 -2.435 1.00 1.25 H new ATOM 1826 N GLN A 119 -1.930 4.153 1.052 1.00 0.26 N ATOM 1827 CA GLN A 119 -0.725 4.777 1.558 1.00 0.27 C ATOM 1828 C GLN A 119 0.120 3.714 2.229 1.00 0.26 C ATOM 1829 O GLN A 119 -0.147 3.321 3.360 1.00 0.27 O ATOM 1830 CB GLN A 119 -1.057 5.883 2.558 1.00 0.30 C ATOM 1831 CG GLN A 119 0.112 6.817 2.831 1.00 0.37 C ATOM 1832 CD GLN A 119 0.287 7.874 1.755 1.00 0.46 C ATOM 1833 OE1 GLN A 119 -0.135 7.565 0.537 1.00 0.63 O flip ATOM 1834 NE2 GLN A 119 0.781 8.965 2.022 1.00 0.51 N flip ATOM 0 H GLN A 119 -2.559 3.808 1.777 1.00 0.26 H new ATOM 0 HA GLN A 119 -0.181 5.230 0.729 1.00 0.27 H new ATOM 0 HB2 GLN A 119 -1.898 6.465 2.180 1.00 0.30 H new ATOM 0 HB3 GLN A 119 -1.379 5.431 3.496 1.00 0.30 H new ATOM 0 HG2 GLN A 119 -0.038 7.307 3.793 1.00 0.37 H new ATOM 0 HG3 GLN A 119 1.028 6.231 2.910 1.00 0.37 H new ATOM 0 HE21 GLN A 119 1.094 9.164 2.972 1.00 0.51 H new ATOM 0 HE22 GLN A 119 0.879 9.673 1.294 1.00 0.51 H new ATOM 1843 N ILE A 120 1.122 3.239 1.529 1.00 0.26 N ATOM 1844 CA ILE A 120 1.882 2.098 1.997 1.00 0.26 C ATOM 1845 C ILE A 120 3.316 2.489 2.356 1.00 0.23 C ATOM 1846 O ILE A 120 4.041 3.067 1.544 1.00 0.24 O ATOM 1847 CB ILE A 120 1.853 0.970 0.935 1.00 0.31 C ATOM 1848 CG1 ILE A 120 2.536 -0.300 1.439 1.00 0.45 C ATOM 1849 CG2 ILE A 120 2.475 1.426 -0.367 1.00 0.36 C ATOM 1850 CD1 ILE A 120 1.678 -1.115 2.374 1.00 0.81 C ATOM 0 H ILE A 120 1.432 3.621 0.636 1.00 0.26 H new ATOM 0 HA ILE A 120 1.417 1.726 2.910 1.00 0.26 H new ATOM 0 HB ILE A 120 0.805 0.734 0.750 1.00 0.31 H new ATOM 0 HG12 ILE A 120 2.815 -0.917 0.584 1.00 0.45 H new ATOM 0 HG13 ILE A 120 3.459 -0.028 1.950 1.00 0.45 H new ATOM 0 HG21 ILE A 120 2.440 0.613 -1.092 1.00 0.36 H new ATOM 0 HG22 ILE A 120 1.922 2.282 -0.755 1.00 0.36 H new ATOM 0 HG23 ILE A 120 3.512 1.713 -0.194 1.00 0.36 H new ATOM 0 HD11 ILE A 120 2.227 -2.002 2.692 1.00 0.81 H new ATOM 0 HD12 ILE A 120 1.420 -0.515 3.247 1.00 0.81 H new ATOM 0 HD13 ILE A 120 0.766 -1.418 1.860 1.00 0.81 H new ATOM 1862 N GLY A 121 3.698 2.229 3.600 1.00 0.23 N ATOM 1863 CA GLY A 121 5.064 2.443 4.019 1.00 0.23 C ATOM 1864 C GLY A 121 5.880 1.186 3.861 1.00 0.22 C ATOM 1865 O GLY A 121 5.479 0.117 4.324 1.00 0.26 O ATOM 0 H GLY A 121 3.080 1.872 4.328 1.00 0.23 H new ATOM 0 HA2 GLY A 121 5.508 3.245 3.430 1.00 0.23 H new ATOM 0 HA3 GLY A 121 5.083 2.765 5.060 1.00 0.23 H new ATOM 1869 N LEU A 122 7.012 1.305 3.197 1.00 0.23 N ATOM 1870 CA LEU A 122 7.827 0.153 2.857 1.00 0.25 C ATOM 1871 C LEU A 122 9.049 0.066 3.741 1.00 0.23 C ATOM 1872 O LEU A 122 10.044 0.744 3.508 1.00 0.30 O ATOM 1873 CB LEU A 122 8.268 0.229 1.398 1.00 0.30 C ATOM 1874 CG LEU A 122 7.247 -0.226 0.355 1.00 0.45 C ATOM 1875 CD1 LEU A 122 5.835 0.174 0.737 1.00 1.20 C ATOM 1876 CD2 LEU A 122 7.605 0.372 -0.984 1.00 1.00 C ATOM 0 H LEU A 122 7.392 2.196 2.879 1.00 0.23 H new ATOM 0 HA LEU A 122 7.219 -0.738 3.012 1.00 0.25 H new ATOM 0 HB2 LEU A 122 8.545 1.260 1.178 1.00 0.30 H new ATOM 0 HB3 LEU A 122 9.168 -0.375 1.281 1.00 0.30 H new ATOM 0 HG LEU A 122 7.277 -1.314 0.301 1.00 0.45 H new ATOM 0 HD11 LEU A 122 5.140 -0.168 -0.030 1.00 1.20 H new ATOM 0 HD12 LEU A 122 5.574 -0.281 1.692 1.00 1.20 H new ATOM 0 HD13 LEU A 122 5.775 1.259 0.824 1.00 1.20 H new ATOM 0 HD21 LEU A 122 6.880 0.051 -1.732 1.00 1.00 H new ATOM 0 HD22 LEU A 122 7.594 1.460 -0.912 1.00 1.00 H new ATOM 0 HD23 LEU A 122 8.600 0.038 -1.277 1.00 1.00 H new ATOM 1888 N THR A 123 8.956 -0.748 4.766 1.00 0.22 N ATOM 1889 CA THR A 123 10.107 -1.061 5.581 1.00 0.21 C ATOM 1890 C THR A 123 10.694 -2.376 5.117 1.00 0.23 C ATOM 1891 O THR A 123 10.245 -3.433 5.518 1.00 0.32 O ATOM 1892 CB THR A 123 9.722 -1.192 7.060 1.00 0.24 C ATOM 1893 OG1 THR A 123 9.095 0.009 7.524 1.00 0.26 O ATOM 1894 CG2 THR A 123 10.939 -1.503 7.921 1.00 0.26 C ATOM 0 H THR A 123 8.093 -1.207 5.056 1.00 0.22 H new ATOM 0 HA THR A 123 10.830 -0.252 5.479 1.00 0.21 H new ATOM 0 HB THR A 123 9.018 -2.020 7.146 1.00 0.24 H new ATOM 0 HG1 THR A 123 8.512 -0.199 8.284 1.00 0.26 H new ATOM 0 HG21 THR A 123 10.634 -1.590 8.964 1.00 0.26 H new ATOM 0 HG22 THR A 123 11.386 -2.442 7.594 1.00 0.26 H new ATOM 0 HG23 THR A 123 11.669 -0.700 7.822 1.00 0.26 H new ATOM 1902 N ILE A 124 11.684 -2.325 4.266 1.00 0.20 N ATOM 1903 CA ILE A 124 12.258 -3.548 3.749 1.00 0.21 C ATOM 1904 C ILE A 124 13.666 -3.722 4.275 1.00 0.24 C ATOM 1905 O ILE A 124 14.360 -2.740 4.527 1.00 0.32 O ATOM 1906 CB ILE A 124 12.245 -3.619 2.200 1.00 0.23 C ATOM 1907 CG1 ILE A 124 12.811 -2.336 1.558 1.00 0.25 C ATOM 1908 CG2 ILE A 124 10.834 -3.902 1.696 1.00 0.25 C ATOM 1909 CD1 ILE A 124 11.809 -1.210 1.384 1.00 0.98 C ATOM 0 H ILE A 124 12.108 -1.465 3.917 1.00 0.20 H new ATOM 0 HA ILE A 124 11.630 -4.367 4.100 1.00 0.21 H new ATOM 0 HB ILE A 124 12.897 -4.440 1.901 1.00 0.23 H new ATOM 0 HG12 ILE A 124 13.637 -1.975 2.171 1.00 0.25 H new ATOM 0 HG13 ILE A 124 13.224 -2.588 0.582 1.00 0.25 H new ATOM 0 HG21 ILE A 124 10.839 -3.949 0.607 1.00 0.25 H new ATOM 0 HG22 ILE A 124 10.488 -4.854 2.099 1.00 0.25 H new ATOM 0 HG23 ILE A 124 10.165 -3.105 2.021 1.00 0.25 H new ATOM 0 HD11 ILE A 124 12.301 -0.352 0.925 1.00 0.98 H new ATOM 0 HD12 ILE A 124 10.993 -1.545 0.744 1.00 0.98 H new ATOM 0 HD13 ILE A 124 11.412 -0.922 2.358 1.00 0.98 H new ATOM 1921 N ASP A 125 14.071 -4.966 4.474 1.00 0.25 N ATOM 1922 CA ASP A 125 15.400 -5.261 4.976 1.00 0.30 C ATOM 1923 C ASP A 125 16.360 -5.367 3.818 1.00 0.30 C ATOM 1924 O ASP A 125 16.347 -6.366 3.100 1.00 0.31 O ATOM 1925 CB ASP A 125 15.411 -6.578 5.758 1.00 0.37 C ATOM 1926 CG ASP A 125 14.730 -6.484 7.107 1.00 0.91 C ATOM 1927 OD1 ASP A 125 13.494 -6.609 7.169 1.00 1.52 O ATOM 1928 OD2 ASP A 125 15.436 -6.316 8.122 1.00 1.44 O ATOM 0 H ASP A 125 13.495 -5.789 4.294 1.00 0.25 H new ATOM 0 HA ASP A 125 15.702 -4.455 5.645 1.00 0.30 H new ATOM 0 HB2 ASP A 125 14.919 -7.348 5.164 1.00 0.37 H new ATOM 0 HB3 ASP A 125 16.443 -6.897 5.902 1.00 0.37 H new ATOM 1933 N LEU A 126 17.195 -4.340 3.662 1.00 0.32 N ATOM 1934 CA LEU A 126 18.165 -4.280 2.572 1.00 0.33 C ATOM 1935 C LEU A 126 19.552 -4.609 3.104 1.00 0.37 C ATOM 1936 O LEU A 126 19.778 -4.555 4.302 1.00 0.55 O ATOM 1937 CB LEU A 126 18.208 -2.884 1.918 1.00 0.42 C ATOM 1938 CG LEU A 126 16.900 -2.343 1.332 1.00 0.38 C ATOM 1939 CD1 LEU A 126 16.105 -3.440 0.644 1.00 1.26 C ATOM 1940 CD2 LEU A 126 16.080 -1.648 2.403 1.00 1.28 C ATOM 0 H LEU A 126 17.218 -3.532 4.284 1.00 0.32 H new ATOM 0 HA LEU A 126 17.857 -5.006 1.819 1.00 0.33 H new ATOM 0 HB2 LEU A 126 18.563 -2.173 2.664 1.00 0.42 H new ATOM 0 HB3 LEU A 126 18.951 -2.908 1.121 1.00 0.42 H new ATOM 0 HG LEU A 126 17.151 -1.604 0.571 1.00 0.38 H new ATOM 0 HD11 LEU A 126 15.183 -3.022 0.240 1.00 1.26 H new ATOM 0 HD12 LEU A 126 16.697 -3.865 -0.167 1.00 1.26 H new ATOM 0 HD13 LEU A 126 15.864 -4.221 1.365 1.00 1.26 H new ATOM 0 HD21 LEU A 126 15.155 -1.271 1.966 1.00 1.28 H new ATOM 0 HD22 LEU A 126 15.844 -2.356 3.197 1.00 1.28 H new ATOM 0 HD23 LEU A 126 16.651 -0.817 2.816 1.00 1.28 H new ATOM 1952 N PRO A 127 20.504 -4.962 2.234 1.00 0.43 N ATOM 1953 CA PRO A 127 21.884 -5.214 2.654 1.00 0.52 C ATOM 1954 C PRO A 127 22.628 -3.951 3.035 1.00 0.60 C ATOM 1955 O PRO A 127 23.521 -3.969 3.878 1.00 0.74 O ATOM 1956 CB PRO A 127 22.535 -5.874 1.430 1.00 0.60 C ATOM 1957 CG PRO A 127 21.413 -6.194 0.495 1.00 0.73 C ATOM 1958 CD PRO A 127 20.315 -5.217 0.798 1.00 0.55 C ATOM 0 HA PRO A 127 21.913 -5.834 3.550 1.00 0.52 H new ATOM 0 HB2 PRO A 127 23.256 -5.204 0.961 1.00 0.60 H new ATOM 0 HB3 PRO A 127 23.077 -6.776 1.714 1.00 0.60 H new ATOM 0 HG2 PRO A 127 21.735 -6.106 -0.543 1.00 0.73 H new ATOM 0 HG3 PRO A 127 21.070 -7.219 0.636 1.00 0.73 H new ATOM 0 HD2 PRO A 127 20.409 -4.305 0.208 1.00 0.55 H new ATOM 0 HD3 PRO A 127 19.331 -5.634 0.586 1.00 0.55 H new ATOM 1966 N VAL A 128 22.254 -2.860 2.414 1.00 0.60 N ATOM 1967 CA VAL A 128 22.926 -1.599 2.633 1.00 0.72 C ATOM 1968 C VAL A 128 22.567 -0.943 3.971 1.00 0.71 C ATOM 1969 O VAL A 128 23.442 -0.687 4.795 1.00 0.82 O ATOM 1970 CB VAL A 128 22.620 -0.633 1.494 1.00 0.83 C ATOM 1971 CG1 VAL A 128 23.635 -0.788 0.378 1.00 1.12 C ATOM 1972 CG2 VAL A 128 21.211 -0.845 0.963 1.00 1.02 C ATOM 0 H VAL A 128 21.483 -2.818 1.748 1.00 0.60 H new ATOM 0 HA VAL A 128 23.992 -1.823 2.663 1.00 0.72 H new ATOM 0 HB VAL A 128 22.686 0.382 1.886 1.00 0.83 H new ATOM 0 HG11 VAL A 128 23.401 -0.091 -0.426 1.00 1.12 H new ATOM 0 HG12 VAL A 128 24.633 -0.577 0.762 1.00 1.12 H new ATOM 0 HG13 VAL A 128 23.602 -1.808 -0.005 1.00 1.12 H new ATOM 0 HG21 VAL A 128 21.019 -0.143 0.151 1.00 1.02 H new ATOM 0 HG22 VAL A 128 21.112 -1.865 0.592 1.00 1.02 H new ATOM 0 HG23 VAL A 128 20.491 -0.679 1.765 1.00 1.02 H new ATOM 1982 N VAL A 129 21.281 -0.685 4.190 1.00 0.62 N ATOM 1983 CA VAL A 129 20.827 0.012 5.398 1.00 0.63 C ATOM 1984 C VAL A 129 20.411 -0.999 6.451 1.00 0.55 C ATOM 1985 O VAL A 129 20.045 -0.656 7.576 1.00 0.55 O ATOM 1986 CB VAL A 129 19.613 0.919 5.110 1.00 0.69 C ATOM 1987 CG1 VAL A 129 19.707 2.215 5.902 1.00 1.35 C ATOM 1988 CG2 VAL A 129 19.471 1.190 3.622 1.00 1.26 C ATOM 0 H VAL A 129 20.532 -0.946 3.549 1.00 0.62 H new ATOM 0 HA VAL A 129 21.658 0.624 5.748 1.00 0.63 H new ATOM 0 HB VAL A 129 18.715 0.393 5.434 1.00 0.69 H new ATOM 0 HG11 VAL A 129 18.840 2.839 5.683 1.00 1.35 H new ATOM 0 HG12 VAL A 129 19.731 1.989 6.968 1.00 1.35 H new ATOM 0 HG13 VAL A 129 20.617 2.747 5.623 1.00 1.35 H new ATOM 0 HG21 VAL A 129 18.607 1.832 3.450 1.00 1.26 H new ATOM 0 HG22 VAL A 129 20.370 1.685 3.255 1.00 1.26 H new ATOM 0 HG23 VAL A 129 19.334 0.247 3.092 1.00 1.26 H new ATOM 1998 N GLY A 130 20.475 -2.246 6.047 1.00 0.53 N ATOM 1999 CA GLY A 130 19.942 -3.339 6.847 1.00 0.55 C ATOM 2000 C GLY A 130 18.429 -3.402 6.752 1.00 0.58 C ATOM 2001 O GLY A 130 17.840 -4.480 6.719 1.00 1.05 O ATOM 0 H GLY A 130 20.893 -2.537 5.163 1.00 0.53 H new ATOM 0 HA2 GLY A 130 20.370 -4.283 6.509 1.00 0.55 H new ATOM 0 HA3 GLY A 130 20.239 -3.209 7.888 1.00 0.55 H new ATOM 2005 N GLU A 131 17.821 -2.227 6.686 1.00 0.49 N ATOM 2006 CA GLU A 131 16.393 -2.063 6.510 1.00 0.46 C ATOM 2007 C GLU A 131 16.112 -0.575 6.342 1.00 0.49 C ATOM 2008 O GLU A 131 16.757 0.253 6.989 1.00 0.75 O ATOM 2009 CB GLU A 131 15.614 -2.626 7.707 1.00 0.59 C ATOM 2010 CG GLU A 131 15.730 -1.793 8.974 1.00 0.73 C ATOM 2011 CD GLU A 131 15.057 -2.439 10.163 1.00 0.93 C ATOM 2012 OE1 GLU A 131 15.713 -3.242 10.862 1.00 1.01 O ATOM 2013 OE2 GLU A 131 13.865 -2.159 10.400 1.00 1.16 O ATOM 0 H GLU A 131 18.323 -1.342 6.755 1.00 0.49 H new ATOM 0 HA GLU A 131 16.065 -2.616 5.630 1.00 0.46 H new ATOM 0 HB2 GLU A 131 14.562 -2.708 7.435 1.00 0.59 H new ATOM 0 HB3 GLU A 131 15.969 -3.635 7.915 1.00 0.59 H new ATOM 0 HG2 GLU A 131 16.784 -1.632 9.202 1.00 0.73 H new ATOM 0 HG3 GLU A 131 15.287 -0.812 8.800 1.00 0.73 H new ATOM 2020 N PHE A 132 15.208 -0.225 5.450 1.00 0.39 N ATOM 2021 CA PHE A 132 14.869 1.173 5.242 1.00 0.48 C ATOM 2022 C PHE A 132 13.371 1.320 5.013 1.00 0.35 C ATOM 2023 O PHE A 132 12.742 0.431 4.439 1.00 0.33 O ATOM 2024 CB PHE A 132 15.650 1.733 4.053 1.00 0.69 C ATOM 2025 CG PHE A 132 15.737 3.232 4.041 1.00 1.02 C ATOM 2026 CD1 PHE A 132 16.438 3.903 5.031 1.00 1.22 C ATOM 2027 CD2 PHE A 132 15.118 3.970 3.048 1.00 1.31 C ATOM 2028 CE1 PHE A 132 16.520 5.282 5.029 1.00 1.66 C ATOM 2029 CE2 PHE A 132 15.198 5.350 3.040 1.00 1.74 C ATOM 2030 CZ PHE A 132 15.899 6.007 4.030 1.00 1.91 C ATOM 0 H PHE A 132 14.697 -0.882 4.860 1.00 0.39 H new ATOM 0 HA PHE A 132 15.141 1.739 6.133 1.00 0.48 H new ATOM 0 HB2 PHE A 132 16.658 1.319 4.065 1.00 0.69 H new ATOM 0 HB3 PHE A 132 15.178 1.398 3.129 1.00 0.69 H new ATOM 0 HD1 PHE A 132 16.926 3.341 5.813 1.00 1.22 H new ATOM 0 HD2 PHE A 132 14.566 3.462 2.271 1.00 1.31 H new ATOM 0 HE1 PHE A 132 17.068 5.792 5.807 1.00 1.66 H new ATOM 0 HE2 PHE A 132 14.711 5.914 2.258 1.00 1.74 H new ATOM 0 HZ PHE A 132 15.962 7.085 4.024 1.00 1.91 H new ATOM 2040 N THR A 133 12.809 2.427 5.478 1.00 0.37 N ATOM 2041 CA THR A 133 11.383 2.676 5.335 1.00 0.32 C ATOM 2042 C THR A 133 11.109 3.875 4.421 1.00 0.31 C ATOM 2043 O THR A 133 11.458 5.016 4.732 1.00 0.36 O ATOM 2044 CB THR A 133 10.697 2.879 6.709 1.00 0.44 C ATOM 2045 OG1 THR A 133 9.326 3.257 6.533 1.00 1.19 O ATOM 2046 CG2 THR A 133 11.416 3.929 7.546 1.00 1.17 C ATOM 0 H THR A 133 13.320 3.167 5.958 1.00 0.37 H new ATOM 0 HA THR A 133 10.954 1.788 4.870 1.00 0.32 H new ATOM 0 HB THR A 133 10.745 1.929 7.241 1.00 0.44 H new ATOM 0 HG1 THR A 133 8.906 3.380 7.410 1.00 1.19 H new ATOM 0 HG21 THR A 133 10.906 4.044 8.502 1.00 1.17 H new ATOM 0 HG22 THR A 133 12.445 3.614 7.719 1.00 1.17 H new ATOM 0 HG23 THR A 133 11.412 4.882 7.016 1.00 1.17 H new ATOM 2054 N ILE A 134 10.520 3.594 3.269 1.00 0.28 N ATOM 2055 CA ILE A 134 10.070 4.631 2.348 1.00 0.31 C ATOM 2056 C ILE A 134 8.603 4.409 1.999 1.00 0.28 C ATOM 2057 O ILE A 134 8.173 3.277 1.821 1.00 0.26 O ATOM 2058 CB ILE A 134 10.927 4.676 1.056 1.00 0.36 C ATOM 2059 CG1 ILE A 134 11.147 3.269 0.483 1.00 0.41 C ATOM 2060 CG2 ILE A 134 12.256 5.362 1.320 1.00 0.41 C ATOM 2061 CD1 ILE A 134 10.094 2.851 -0.518 1.00 0.50 C ATOM 0 H ILE A 134 10.340 2.644 2.945 1.00 0.28 H new ATOM 0 HA ILE A 134 10.188 5.592 2.848 1.00 0.31 H new ATOM 0 HB ILE A 134 10.380 5.256 0.312 1.00 0.36 H new ATOM 0 HG12 ILE A 134 12.126 3.229 0.006 1.00 0.41 H new ATOM 0 HG13 ILE A 134 11.163 2.551 1.303 1.00 0.41 H new ATOM 0 HG21 ILE A 134 12.843 5.384 0.402 1.00 0.41 H new ATOM 0 HG22 ILE A 134 12.078 6.382 1.661 1.00 0.41 H new ATOM 0 HG23 ILE A 134 12.803 4.813 2.087 1.00 0.41 H new ATOM 0 HD11 ILE A 134 10.314 1.847 -0.880 1.00 0.50 H new ATOM 0 HD12 ILE A 134 9.114 2.858 -0.040 1.00 0.50 H new ATOM 0 HD13 ILE A 134 10.093 3.547 -1.357 1.00 0.50 H new ATOM 2073 N PRO A 135 7.797 5.469 1.939 1.00 0.30 N ATOM 2074 CA PRO A 135 6.384 5.345 1.630 1.00 0.29 C ATOM 2075 C PRO A 135 6.073 5.510 0.144 1.00 0.28 C ATOM 2076 O PRO A 135 6.896 6.009 -0.628 1.00 0.31 O ATOM 2077 CB PRO A 135 5.783 6.490 2.441 1.00 0.35 C ATOM 2078 CG PRO A 135 6.846 7.550 2.462 1.00 0.45 C ATOM 2079 CD PRO A 135 8.172 6.867 2.205 1.00 0.39 C ATOM 0 HA PRO A 135 5.990 4.357 1.870 1.00 0.29 H new ATOM 0 HB2 PRO A 135 4.866 6.860 1.982 1.00 0.35 H new ATOM 0 HB3 PRO A 135 5.527 6.167 3.450 1.00 0.35 H new ATOM 0 HG2 PRO A 135 6.650 8.305 1.701 1.00 0.45 H new ATOM 0 HG3 PRO A 135 6.858 8.062 3.424 1.00 0.45 H new ATOM 0 HD2 PRO A 135 8.693 7.310 1.357 1.00 0.39 H new ATOM 0 HD3 PRO A 135 8.837 6.947 3.065 1.00 0.39 H new ATOM 2087 N ILE A 136 4.880 5.081 -0.245 1.00 0.26 N ATOM 2088 CA ILE A 136 4.410 5.218 -1.612 1.00 0.27 C ATOM 2089 C ILE A 136 2.887 5.018 -1.631 1.00 0.26 C ATOM 2090 O ILE A 136 2.305 4.598 -0.630 1.00 0.26 O ATOM 2091 CB ILE A 136 5.150 4.241 -2.577 1.00 0.28 C ATOM 2092 CG1 ILE A 136 4.831 4.565 -4.050 1.00 0.44 C ATOM 2093 CG2 ILE A 136 4.830 2.792 -2.245 1.00 0.33 C ATOM 2094 CD1 ILE A 136 3.866 3.607 -4.723 1.00 0.32 C ATOM 0 H ILE A 136 4.213 4.629 0.380 1.00 0.26 H new ATOM 0 HA ILE A 136 4.638 6.219 -1.977 1.00 0.27 H new ATOM 0 HB ILE A 136 6.222 4.381 -2.435 1.00 0.28 H new ATOM 0 HG12 ILE A 136 4.416 5.572 -4.103 1.00 0.44 H new ATOM 0 HG13 ILE A 136 5.763 4.574 -4.614 1.00 0.44 H new ATOM 0 HG21 ILE A 136 5.360 2.135 -2.935 1.00 0.33 H new ATOM 0 HG22 ILE A 136 5.143 2.575 -1.224 1.00 0.33 H new ATOM 0 HG23 ILE A 136 3.757 2.626 -2.338 1.00 0.33 H new ATOM 0 HD11 ILE A 136 3.705 3.918 -5.755 1.00 0.32 H new ATOM 0 HD12 ILE A 136 4.283 2.600 -4.709 1.00 0.32 H new ATOM 0 HD13 ILE A 136 2.916 3.613 -4.189 1.00 0.32 H new ATOM 2106 N SER A 137 2.247 5.342 -2.741 1.00 0.28 N ATOM 2107 CA SER A 137 0.794 5.412 -2.784 1.00 0.30 C ATOM 2108 C SER A 137 0.228 4.806 -4.061 1.00 0.30 C ATOM 2109 O SER A 137 0.912 4.734 -5.078 1.00 0.32 O ATOM 2110 CB SER A 137 0.371 6.871 -2.692 1.00 0.34 C ATOM 2111 OG SER A 137 1.253 7.592 -1.851 1.00 0.88 O ATOM 0 H SER A 137 2.708 5.561 -3.624 1.00 0.28 H new ATOM 0 HA SER A 137 0.403 4.837 -1.944 1.00 0.30 H new ATOM 0 HB2 SER A 137 0.362 7.316 -3.687 1.00 0.34 H new ATOM 0 HB3 SER A 137 -0.646 6.937 -2.304 1.00 0.34 H new ATOM 0 HG SER A 137 0.868 7.657 -0.952 1.00 0.88 H new ATOM 2117 N SER A 138 -1.026 4.372 -4.005 1.00 0.31 N ATOM 2118 CA SER A 138 -1.741 3.929 -5.188 1.00 0.34 C ATOM 2119 C SER A 138 -3.216 4.303 -5.036 1.00 0.34 C ATOM 2120 O SER A 138 -3.930 3.716 -4.223 1.00 0.35 O ATOM 2121 CB SER A 138 -1.574 2.415 -5.378 1.00 0.40 C ATOM 2122 OG SER A 138 -2.290 1.944 -6.507 1.00 0.96 O ATOM 0 H SER A 138 -1.569 4.319 -3.143 1.00 0.31 H new ATOM 0 HA SER A 138 -1.334 4.418 -6.073 1.00 0.34 H new ATOM 0 HB2 SER A 138 -0.516 2.178 -5.493 1.00 0.40 H new ATOM 0 HB3 SER A 138 -1.922 1.896 -4.485 1.00 0.40 H new ATOM 0 HG SER A 138 -2.159 0.977 -6.597 1.00 0.96 H new ATOM 2128 N LYS A 139 -3.654 5.309 -5.781 1.00 0.36 N ATOM 2129 CA LYS A 139 -5.018 5.816 -5.662 1.00 0.38 C ATOM 2130 C LYS A 139 -5.761 5.708 -6.988 1.00 0.41 C ATOM 2131 O LYS A 139 -5.145 5.782 -8.054 1.00 0.47 O ATOM 2132 CB LYS A 139 -4.991 7.264 -5.167 1.00 0.44 C ATOM 2133 CG LYS A 139 -4.069 8.175 -5.957 1.00 0.57 C ATOM 2134 CD LYS A 139 -3.560 9.317 -5.095 1.00 0.92 C ATOM 2135 CE LYS A 139 -4.697 10.164 -4.550 1.00 1.35 C ATOM 2136 NZ LYS A 139 -4.240 11.078 -3.472 1.00 1.76 N ATOM 0 H LYS A 139 -3.085 5.792 -6.476 1.00 0.36 H new ATOM 0 HA LYS A 139 -5.555 5.206 -4.936 1.00 0.38 H new ATOM 0 HB2 LYS A 139 -6.003 7.668 -5.205 1.00 0.44 H new ATOM 0 HB3 LYS A 139 -4.684 7.273 -4.121 1.00 0.44 H new ATOM 0 HG2 LYS A 139 -3.226 7.600 -6.340 1.00 0.57 H new ATOM 0 HG3 LYS A 139 -4.600 8.576 -6.820 1.00 0.57 H new ATOM 0 HD2 LYS A 139 -2.977 8.915 -4.266 1.00 0.92 H new ATOM 0 HD3 LYS A 139 -2.889 9.944 -5.682 1.00 0.92 H new ATOM 0 HE2 LYS A 139 -5.135 10.748 -5.360 1.00 1.35 H new ATOM 0 HE3 LYS A 139 -5.482 9.513 -4.165 1.00 1.35 H new ATOM 0 HZ1 LYS A 139 -4.985 11.774 -3.268 1.00 1.76 H new ATOM 0 HZ2 LYS A 139 -4.036 10.528 -2.613 1.00 1.76 H new ATOM 0 HZ3 LYS A 139 -3.378 11.573 -3.779 1.00 1.76 H new ATOM 2150 N GLY A 140 -7.080 5.527 -6.930 1.00 0.42 N ATOM 2151 CA GLY A 140 -7.849 5.318 -8.137 1.00 0.50 C ATOM 2152 C GLY A 140 -9.339 5.503 -7.913 1.00 0.46 C ATOM 2153 O GLY A 140 -9.861 5.203 -6.842 1.00 0.47 O ATOM 0 H GLY A 140 -7.625 5.522 -6.068 1.00 0.42 H new ATOM 0 HA2 GLY A 140 -7.511 6.013 -8.905 1.00 0.50 H new ATOM 0 HA3 GLY A 140 -7.663 4.312 -8.513 1.00 0.50 H new ATOM 2157 N GLU A 141 -10.000 6.003 -8.938 1.00 0.44 N ATOM 2158 CA GLU A 141 -11.432 6.289 -8.887 1.00 0.42 C ATOM 2159 C GLU A 141 -12.216 5.279 -9.719 1.00 0.43 C ATOM 2160 O GLU A 141 -11.862 5.027 -10.875 1.00 0.48 O ATOM 2161 CB GLU A 141 -11.687 7.689 -9.431 1.00 0.45 C ATOM 2162 CG GLU A 141 -10.702 8.721 -8.923 1.00 0.52 C ATOM 2163 CD GLU A 141 -10.398 9.785 -9.953 1.00 1.24 C ATOM 2164 OE1 GLU A 141 -9.667 9.480 -10.919 1.00 1.51 O ATOM 2165 OE2 GLU A 141 -10.885 10.925 -9.806 1.00 2.10 O ATOM 0 H GLU A 141 -9.565 6.225 -9.833 1.00 0.44 H new ATOM 0 HA GLU A 141 -11.762 6.221 -7.850 1.00 0.42 H new ATOM 0 HB2 GLU A 141 -11.643 7.661 -10.520 1.00 0.45 H new ATOM 0 HB3 GLU A 141 -12.697 7.997 -9.160 1.00 0.45 H new ATOM 0 HG2 GLU A 141 -11.104 9.192 -8.026 1.00 0.52 H new ATOM 0 HG3 GLU A 141 -9.776 8.224 -8.634 1.00 0.52 H new ATOM 2172 N ILE A 142 -13.289 4.715 -9.157 1.00 0.42 N ATOM 2173 CA ILE A 142 -14.143 3.774 -9.880 1.00 0.47 C ATOM 2174 C ILE A 142 -15.571 3.951 -9.368 1.00 0.46 C ATOM 2175 O ILE A 142 -15.787 4.681 -8.396 1.00 0.42 O ATOM 2176 CB ILE A 142 -13.736 2.274 -9.729 1.00 0.54 C ATOM 2177 CG1 ILE A 142 -14.055 1.728 -8.326 1.00 0.76 C ATOM 2178 CG2 ILE A 142 -12.266 2.058 -10.066 1.00 0.60 C ATOM 2179 CD1 ILE A 142 -13.221 2.316 -7.212 1.00 0.67 C ATOM 0 H ILE A 142 -13.586 4.896 -8.198 1.00 0.42 H new ATOM 0 HA ILE A 142 -14.040 4.004 -10.940 1.00 0.47 H new ATOM 0 HB ILE A 142 -14.336 1.714 -10.446 1.00 0.54 H new ATOM 0 HG12 ILE A 142 -15.107 1.914 -8.110 1.00 0.76 H new ATOM 0 HG13 ILE A 142 -13.917 0.647 -8.332 1.00 0.76 H new ATOM 0 HG21 ILE A 142 -12.017 1.003 -9.950 1.00 0.60 H new ATOM 0 HG22 ILE A 142 -12.080 2.364 -11.096 1.00 0.60 H new ATOM 0 HG23 ILE A 142 -11.647 2.652 -9.394 1.00 0.60 H new ATOM 0 HD11 ILE A 142 -13.517 1.871 -6.262 1.00 0.67 H new ATOM 0 HD12 ILE A 142 -12.167 2.108 -7.397 1.00 0.67 H new ATOM 0 HD13 ILE A 142 -13.376 3.394 -7.172 1.00 0.67 H new ATOM 2191 N LYS A 143 -16.539 3.304 -10.008 1.00 0.53 N ATOM 2192 CA LYS A 143 -17.930 3.419 -9.579 1.00 0.57 C ATOM 2193 C LYS A 143 -18.120 2.849 -8.171 1.00 0.54 C ATOM 2194 O LYS A 143 -17.374 1.968 -7.737 1.00 0.57 O ATOM 2195 CB LYS A 143 -18.870 2.719 -10.564 1.00 0.70 C ATOM 2196 CG LYS A 143 -18.650 1.217 -10.681 1.00 1.44 C ATOM 2197 CD LYS A 143 -19.710 0.576 -11.559 1.00 2.04 C ATOM 2198 CE LYS A 143 -19.520 -0.927 -11.656 1.00 2.74 C ATOM 2199 NZ LYS A 143 -20.574 -1.568 -12.485 1.00 3.53 N ATOM 0 H LYS A 143 -16.390 2.701 -10.817 1.00 0.53 H new ATOM 0 HA LYS A 143 -18.180 4.480 -9.559 1.00 0.57 H new ATOM 0 HB2 LYS A 143 -19.900 2.901 -10.257 1.00 0.70 H new ATOM 0 HB3 LYS A 143 -18.747 3.170 -11.549 1.00 0.70 H new ATOM 0 HG2 LYS A 143 -17.662 1.022 -11.098 1.00 1.44 H new ATOM 0 HG3 LYS A 143 -18.672 0.765 -9.690 1.00 1.44 H new ATOM 0 HD2 LYS A 143 -20.699 0.793 -11.154 1.00 2.04 H new ATOM 0 HD3 LYS A 143 -19.671 1.014 -12.557 1.00 2.04 H new ATOM 0 HE2 LYS A 143 -18.541 -1.142 -12.084 1.00 2.74 H new ATOM 0 HE3 LYS A 143 -19.532 -1.360 -10.656 1.00 2.74 H new ATOM 0 HZ1 LYS A 143 -20.408 -2.594 -12.526 1.00 3.53 H new ATOM 0 HZ2 LYS A 143 -21.507 -1.385 -12.063 1.00 3.53 H new ATOM 0 HZ3 LYS A 143 -20.546 -1.174 -13.447 1.00 3.53 H new ATOM 2213 N LEU A 144 -19.117 3.371 -7.468 1.00 0.60 N ATOM 2214 CA LEU A 144 -19.400 2.977 -6.090 1.00 0.66 C ATOM 2215 C LEU A 144 -19.642 1.472 -5.952 1.00 0.60 C ATOM 2216 O LEU A 144 -20.105 0.811 -6.887 1.00 0.63 O ATOM 2217 CB LEU A 144 -20.595 3.776 -5.527 1.00 0.83 C ATOM 2218 CG LEU A 144 -22.004 3.419 -6.035 1.00 0.69 C ATOM 2219 CD1 LEU A 144 -23.031 4.311 -5.353 1.00 1.21 C ATOM 2220 CD2 LEU A 144 -22.120 3.564 -7.549 1.00 1.23 C ATOM 0 H LEU A 144 -19.753 4.079 -7.835 1.00 0.60 H new ATOM 0 HA LEU A 144 -18.512 3.213 -5.503 1.00 0.66 H new ATOM 0 HB2 LEU A 144 -20.592 3.663 -4.443 1.00 0.83 H new ATOM 0 HB3 LEU A 144 -20.421 4.831 -5.738 1.00 0.83 H new ATOM 0 HG LEU A 144 -22.192 2.374 -5.790 1.00 0.69 H new ATOM 0 HD11 LEU A 144 -24.028 4.058 -5.713 1.00 1.21 H new ATOM 0 HD12 LEU A 144 -22.985 4.160 -4.274 1.00 1.21 H new ATOM 0 HD13 LEU A 144 -22.816 5.355 -5.583 1.00 1.21 H new ATOM 0 HD21 LEU A 144 -23.130 3.302 -7.863 1.00 1.23 H new ATOM 0 HD22 LEU A 144 -21.907 4.595 -7.833 1.00 1.23 H new ATOM 0 HD23 LEU A 144 -21.405 2.899 -8.034 1.00 1.23 H new ATOM 2232 N PRO A 145 -19.299 0.917 -4.775 1.00 0.61 N ATOM 2233 CA PRO A 145 -19.456 -0.512 -4.478 1.00 0.64 C ATOM 2234 C PRO A 145 -20.915 -0.955 -4.431 1.00 0.66 C ATOM 2235 O PRO A 145 -21.834 -0.142 -4.555 1.00 0.65 O ATOM 2236 CB PRO A 145 -18.801 -0.675 -3.103 1.00 0.71 C ATOM 2237 CG PRO A 145 -18.829 0.682 -2.493 1.00 0.69 C ATOM 2238 CD PRO A 145 -18.726 1.652 -3.633 1.00 0.67 C ATOM 0 HA PRO A 145 -19.005 -1.129 -5.255 1.00 0.64 H new ATOM 0 HB2 PRO A 145 -19.346 -1.393 -2.490 1.00 0.71 H new ATOM 0 HB3 PRO A 145 -17.780 -1.044 -3.195 1.00 0.71 H new ATOM 0 HG2 PRO A 145 -19.750 0.838 -1.931 1.00 0.69 H new ATOM 0 HG3 PRO A 145 -18.003 0.812 -1.794 1.00 0.69 H new ATOM 0 HD2 PRO A 145 -19.280 2.569 -3.429 1.00 0.67 H new ATOM 0 HD3 PRO A 145 -17.692 1.939 -3.821 1.00 0.67 H new