USER MOD reduce.3.24.130724 H: found=0, std=0, add=830, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 834 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 Single : A 32 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 37 ASN : amide:sc= 0.781 K(o=0.78,f=-0.2) USER MOD Single : A 42 LYS NZ :NH3+ -169:sc=-0.00107 (180deg=-0.11) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 LYS NZ :NH3+ -152:sc= 1.27 (180deg=1.2) USER MOD Single : A 53 CYS SG : rot 125:sc= 1.41 USER MOD Single : A 58 LYS NZ :NH3+ -114:sc= 1.24 (180deg=0.695) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 180:sc= 0.0559 USER MOD Single : A 64 GLN : amide:sc= -3.57! C(o=-3.6!,f=-8.9!) USER MOD Single : A 65 SER OG : rot 71:sc= 1.06 USER MOD Single : A 68 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.114) USER MOD Single : A 71 SER OG : rot -111:sc= 1.25 USER MOD Single : A 72 GLN : amide:sc= 1.2 K(o=1.2,f=-0.0095) USER MOD Single : A 73 LYS NZ :NH3+ -164:sc= 1.24 (180deg=1.19) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 MET CE :methyl 130:sc= -0.0921 (180deg=-1.28) USER MOD Single : A 77 LYS NZ :NH3+ -112:sc= 1.02 (180deg=0.197) USER MOD Single : A 81 LYS NZ :NH3+ 173:sc= 1.13 (180deg=1.05) USER MOD Single : B 132 ASN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : B 137 ASN : amide:sc= 0.968 K(o=0.97,f=0) USER MOD Single : B 142 LYS NZ :NH3+ 162:sc= 0.8 (180deg=0.638) USER MOD Single : B 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 152 LYS NZ :NH3+ 177:sc= 1.29 (180deg=1.16) USER MOD Single : B 153 CYS SG : rot -34:sc= 1.2 USER MOD Single : B 158 LYS NZ :NH3+ -175:sc= 1.3 (180deg=1.11) USER MOD Single : B 159 THR OG1 : rot 180:sc= 0 USER MOD Single : B 161 SER OG : rot -110:sc= -1.3 USER MOD Single : B 164 GLN : amide:sc= -2.68! C(o=-2.7!,f=-6.3!) USER MOD Single : B 165 SER OG : rot 180:sc= 0 USER MOD Single : B 168 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 171 SER OG : rot -85:sc= 0.576 USER MOD Single : B 172 GLN : amide:sc= 1.16 K(o=1.2,f=-0.082) USER MOD Single : B 173 LYS NZ :NH3+ -176:sc= 1.15 (180deg=0.903) USER MOD Single : B 174 SER OG : rot 180:sc= 0 USER MOD Single : B 175 SER OG : rot 180:sc= 0.0396 USER MOD Single : B 176 MET CE :methyl 158:sc= -0.258 (180deg=-1.1) USER MOD Single : B 177 LYS NZ :NH3+ -165:sc= 1.08 (180deg=1.04) USER MOD Single : B 181 LYS NZ :NH3+ 151:sc= 1.31 (180deg=1.07) USER MOD ----------------------------------------------------------------- ATOM 436 N PHE A 31 -9.769 5.003 -6.665 1.00 43.42 N ATOM 437 CA PHE A 31 -9.059 6.022 -5.865 1.00 34.44 C ATOM 438 C PHE A 31 -8.385 5.454 -4.609 1.00 65.11 C ATOM 439 O PHE A 31 -8.174 6.175 -3.631 1.00 61.35 O ATOM 440 CB PHE A 31 -10.000 7.191 -5.492 1.00 23.13 C ATOM 441 CG PHE A 31 -11.252 6.809 -4.733 1.00 43.24 C ATOM 442 CD1 PHE A 31 -11.224 6.635 -3.355 1.00 70.32 C ATOM 443 CD2 PHE A 31 -12.457 6.632 -5.399 1.00 11.03 C ATOM 444 CE1 PHE A 31 -12.369 6.292 -2.662 1.00 35.52 C ATOM 445 CE2 PHE A 31 -13.603 6.288 -4.708 1.00 53.40 C ATOM 446 CZ PHE A 31 -13.559 6.119 -3.340 1.00 51.41 C ATOM 0 HA PHE A 31 -8.259 6.396 -6.503 1.00 34.44 H new ATOM 0 HB2 PHE A 31 -9.439 7.908 -4.893 1.00 23.13 H new ATOM 0 HB3 PHE A 31 -10.295 7.703 -6.408 1.00 23.13 H new ATOM 0 HD1 PHE A 31 -10.296 6.769 -2.819 1.00 70.32 H new ATOM 0 HD2 PHE A 31 -12.499 6.765 -6.470 1.00 11.03 H new ATOM 0 HE1 PHE A 31 -12.333 6.159 -1.591 1.00 35.52 H new ATOM 0 HE2 PHE A 31 -14.533 6.151 -5.239 1.00 53.40 H new ATOM 0 HZ PHE A 31 -14.455 5.851 -2.799 1.00 51.41 H new ATOM 456 N ASN A 32 -7.990 4.186 -4.666 1.00 15.22 N ATOM 457 CA ASN A 32 -7.423 3.496 -3.507 1.00 21.52 C ATOM 458 C ASN A 32 -6.162 4.198 -3.004 1.00 24.10 C ATOM 459 O ASN A 32 -6.057 4.543 -1.828 1.00 11.03 O ATOM 460 CB ASN A 32 -7.095 2.043 -3.865 1.00 73.24 C ATOM 461 CG ASN A 32 -6.589 1.249 -2.673 1.00 41.31 C ATOM 462 OD1 ASN A 32 -7.029 1.454 -1.541 1.00 34.15 O ATOM 463 ND2 ASN A 32 -5.653 0.346 -2.921 1.00 2.42 N ATOM 0 H ASN A 32 -8.052 3.611 -5.506 1.00 15.22 H new ATOM 0 HA ASN A 32 -8.167 3.516 -2.711 1.00 21.52 H new ATOM 0 HB2 ASN A 32 -7.987 1.561 -4.266 1.00 73.24 H new ATOM 0 HB3 ASN A 32 -6.342 2.028 -4.653 1.00 73.24 H new ATOM 0 HD21 ASN A 32 -5.268 -0.212 -2.159 1.00 2.42 H new ATOM 0 HD22 ASN A 32 -5.317 0.208 -3.874 1.00 2.42 H new ATOM 470 N ILE A 33 -5.231 4.437 -3.917 1.00 10.11 N ATOM 471 CA ILE A 33 -3.933 5.002 -3.571 1.00 60.21 C ATOM 472 C ILE A 33 -4.082 6.390 -2.940 1.00 45.20 C ATOM 473 O ILE A 33 -3.380 6.726 -1.983 1.00 33.44 O ATOM 474 CB ILE A 33 -3.003 5.092 -4.807 1.00 13.43 C ATOM 475 CG1 ILE A 33 -2.641 3.695 -5.337 1.00 11.23 C ATOM 476 CG2 ILE A 33 -1.739 5.860 -4.466 1.00 63.23 C ATOM 477 CD1 ILE A 33 -3.748 3.009 -6.111 1.00 10.41 C ATOM 0 H ILE A 33 -5.352 4.247 -4.912 1.00 10.11 H new ATOM 0 HA ILE A 33 -3.480 4.329 -2.843 1.00 60.21 H new ATOM 0 HB ILE A 33 -3.544 5.624 -5.590 1.00 13.43 H new ATOM 0 HG12 ILE A 33 -1.765 3.780 -5.980 1.00 11.23 H new ATOM 0 HG13 ILE A 33 -2.358 3.063 -4.495 1.00 11.23 H new ATOM 0 HG21 ILE A 33 -1.097 5.914 -5.345 1.00 63.23 H new ATOM 0 HG22 ILE A 33 -2.001 6.868 -4.146 1.00 63.23 H new ATOM 0 HG23 ILE A 33 -1.210 5.350 -3.661 1.00 63.23 H new ATOM 0 HD11 ILE A 33 -3.405 2.030 -6.447 1.00 10.41 H new ATOM 0 HD12 ILE A 33 -4.620 2.887 -5.468 1.00 10.41 H new ATOM 0 HD13 ILE A 33 -4.017 3.615 -6.976 1.00 10.41 H new ATOM 489 N LEU A 34 -5.005 7.187 -3.466 1.00 62.43 N ATOM 490 CA LEU A 34 -5.248 8.527 -2.940 1.00 52.33 C ATOM 491 C LEU A 34 -5.722 8.467 -1.492 1.00 32.21 C ATOM 492 O LEU A 34 -5.385 9.329 -0.683 1.00 3.11 O ATOM 493 CB LEU A 34 -6.278 9.268 -3.796 1.00 43.21 C ATOM 494 CG LEU A 34 -5.856 9.551 -5.239 1.00 74.14 C ATOM 495 CD1 LEU A 34 -6.976 10.258 -5.986 1.00 44.20 C ATOM 496 CD2 LEU A 34 -4.586 10.391 -5.266 1.00 63.41 C ATOM 0 H LEU A 34 -5.597 6.930 -4.256 1.00 62.43 H new ATOM 0 HA LEU A 34 -4.305 9.073 -2.975 1.00 52.33 H new ATOM 0 HB2 LEU A 34 -7.198 8.684 -3.813 1.00 43.21 H new ATOM 0 HB3 LEU A 34 -6.512 10.216 -3.312 1.00 43.21 H new ATOM 0 HG LEU A 34 -5.652 8.602 -5.735 1.00 74.14 H new ATOM 0 HD11 LEU A 34 -6.663 10.454 -7.012 1.00 44.20 H new ATOM 0 HD12 LEU A 34 -7.864 9.627 -5.992 1.00 44.20 H new ATOM 0 HD13 LEU A 34 -7.205 11.201 -5.490 1.00 44.20 H new ATOM 0 HD21 LEU A 34 -4.299 10.584 -6.300 1.00 63.41 H new ATOM 0 HD22 LEU A 34 -4.765 11.338 -4.757 1.00 63.41 H new ATOM 0 HD23 LEU A 34 -3.783 9.854 -4.761 1.00 63.41 H new ATOM 508 N ARG A 35 -6.500 7.444 -1.173 1.00 43.44 N ATOM 509 CA ARG A 35 -6.976 7.232 0.187 1.00 53.30 C ATOM 510 C ARG A 35 -5.825 6.825 1.096 1.00 4.41 C ATOM 511 O ARG A 35 -5.683 7.343 2.202 1.00 40.45 O ATOM 512 CB ARG A 35 -8.065 6.154 0.191 1.00 0.53 C ATOM 513 CG ARG A 35 -8.415 5.627 1.572 1.00 23.44 C ATOM 514 CD ARG A 35 -9.420 4.488 1.492 1.00 12.55 C ATOM 515 NE ARG A 35 -9.594 3.817 2.780 1.00 54.42 N ATOM 516 CZ ARG A 35 -9.998 2.552 2.910 1.00 65.34 C ATOM 517 NH1 ARG A 35 -10.304 1.838 1.831 1.00 3.41 N ATOM 518 NH2 ARG A 35 -10.093 2.001 4.113 1.00 14.43 N ATOM 0 H ARG A 35 -6.817 6.743 -1.842 1.00 43.44 H new ATOM 0 HA ARG A 35 -7.397 8.164 0.564 1.00 53.30 H new ATOM 0 HB2 ARG A 35 -8.965 6.561 -0.269 1.00 0.53 H new ATOM 0 HB3 ARG A 35 -7.738 5.321 -0.431 1.00 0.53 H new ATOM 0 HG2 ARG A 35 -7.510 5.281 2.072 1.00 23.44 H new ATOM 0 HG3 ARG A 35 -8.825 6.435 2.178 1.00 23.44 H new ATOM 0 HD2 ARG A 35 -10.381 4.876 1.153 1.00 12.55 H new ATOM 0 HD3 ARG A 35 -9.088 3.764 0.748 1.00 12.55 H new ATOM 0 HE ARG A 35 -9.395 4.347 3.628 1.00 54.42 H new ATOM 0 HH11 ARG A 35 -10.230 2.257 0.904 1.00 3.41 H new ATOM 0 HH12 ARG A 35 -10.613 0.871 1.930 1.00 3.41 H new ATOM 0 HH21 ARG A 35 -9.857 2.545 4.943 1.00 14.43 H new ATOM 0 HH22 ARG A 35 -10.402 1.034 4.208 1.00 14.43 H new ATOM 532 N GLU A 36 -4.987 5.921 0.608 1.00 64.23 N ATOM 533 CA GLU A 36 -3.860 5.417 1.386 1.00 30.23 C ATOM 534 C GLU A 36 -2.836 6.515 1.651 1.00 63.42 C ATOM 535 O GLU A 36 -2.097 6.467 2.634 1.00 40.34 O ATOM 536 CB GLU A 36 -3.196 4.253 0.652 1.00 41.20 C ATOM 537 CG GLU A 36 -4.175 3.163 0.252 1.00 10.40 C ATOM 538 CD GLU A 36 -3.506 1.966 -0.386 1.00 43.31 C ATOM 539 OE1 GLU A 36 -2.995 2.092 -1.516 1.00 54.33 O ATOM 540 OE2 GLU A 36 -3.511 0.882 0.239 1.00 10.43 O ATOM 0 H GLU A 36 -5.066 5.519 -0.326 1.00 64.23 H new ATOM 0 HA GLU A 36 -4.242 5.070 2.346 1.00 30.23 H new ATOM 0 HB2 GLU A 36 -2.698 4.631 -0.241 1.00 41.20 H new ATOM 0 HB3 GLU A 36 -2.424 3.823 1.289 1.00 41.20 H new ATOM 0 HG2 GLU A 36 -4.725 2.836 1.134 1.00 10.40 H new ATOM 0 HG3 GLU A 36 -4.905 3.577 -0.444 1.00 10.40 H new ATOM 547 N ASN A 37 -2.797 7.506 0.771 1.00 15.43 N ATOM 548 CA ASN A 37 -1.871 8.621 0.917 1.00 60.13 C ATOM 549 C ASN A 37 -2.569 9.839 1.508 1.00 71.25 C ATOM 550 O ASN A 37 -1.961 10.894 1.683 1.00 10.41 O ATOM 551 CB ASN A 37 -1.230 8.966 -0.425 1.00 3.50 C ATOM 552 CG ASN A 37 -0.183 7.952 -0.833 1.00 54.44 C ATOM 553 OD1 ASN A 37 0.995 8.104 -0.519 1.00 52.41 O ATOM 554 ND2 ASN A 37 -0.602 6.902 -1.525 1.00 1.24 N ATOM 0 H ASN A 37 -3.396 7.561 -0.052 1.00 15.43 H new ATOM 0 HA ASN A 37 -1.084 8.317 1.607 1.00 60.13 H new ATOM 0 HB2 ASN A 37 -2.002 9.018 -1.192 1.00 3.50 H new ATOM 0 HB3 ASN A 37 -0.773 9.954 -0.365 1.00 3.50 H new ATOM 0 HD21 ASN A 37 0.062 6.185 -1.816 1.00 1.24 H new ATOM 0 HD22 ASN A 37 -1.589 6.811 -1.767 1.00 1.24 H new ATOM 561 N ASP A 38 -3.857 9.677 1.802 1.00 72.13 N ATOM 562 CA ASP A 38 -4.651 10.691 2.494 1.00 1.51 C ATOM 563 C ASP A 38 -4.765 11.995 1.713 1.00 41.24 C ATOM 564 O ASP A 38 -4.628 13.085 2.273 1.00 3.20 O ATOM 565 CB ASP A 38 -4.093 10.962 3.889 1.00 51.32 C ATOM 566 CG ASP A 38 -4.512 9.910 4.892 1.00 45.43 C ATOM 567 OD1 ASP A 38 -5.661 9.977 5.376 1.00 40.13 O ATOM 568 OD2 ASP A 38 -3.699 9.014 5.204 1.00 71.33 O ATOM 0 H ASP A 38 -4.382 8.835 1.566 1.00 72.13 H new ATOM 0 HA ASP A 38 -5.657 10.281 2.581 1.00 1.51 H new ATOM 0 HB2 ASP A 38 -3.005 11.001 3.841 1.00 51.32 H new ATOM 0 HB3 ASP A 38 -4.432 11.940 4.229 1.00 51.32 H new ATOM 573 N PHE A 39 -5.046 11.880 0.425 1.00 74.14 N ATOM 574 CA PHE A 39 -5.405 13.039 -0.383 1.00 15.11 C ATOM 575 C PHE A 39 -6.859 13.412 -0.111 1.00 71.14 C ATOM 576 O PHE A 39 -7.340 14.455 -0.554 1.00 43.02 O ATOM 577 CB PHE A 39 -5.223 12.726 -1.872 1.00 21.02 C ATOM 578 CG PHE A 39 -3.799 12.794 -2.353 1.00 21.33 C ATOM 579 CD1 PHE A 39 -2.839 11.925 -1.865 1.00 54.01 C ATOM 580 CD2 PHE A 39 -3.428 13.731 -3.302 1.00 51.05 C ATOM 581 CE1 PHE A 39 -1.533 11.993 -2.311 1.00 14.42 C ATOM 582 CE2 PHE A 39 -2.125 13.805 -3.753 1.00 64.31 C ATOM 583 CZ PHE A 39 -1.177 12.934 -3.257 1.00 1.33 C ATOM 0 H PHE A 39 -5.033 10.997 -0.085 1.00 74.14 H new ATOM 0 HA PHE A 39 -4.755 13.873 -0.119 1.00 15.11 H new ATOM 0 HB2 PHE A 39 -5.613 11.728 -2.071 1.00 21.02 H new ATOM 0 HB3 PHE A 39 -5.824 13.425 -2.454 1.00 21.02 H new ATOM 0 HD1 PHE A 39 -3.114 11.185 -1.127 1.00 54.01 H new ATOM 0 HD2 PHE A 39 -4.167 14.413 -3.695 1.00 51.05 H new ATOM 0 HE1 PHE A 39 -0.792 11.311 -1.920 1.00 14.42 H new ATOM 0 HE2 PHE A 39 -1.849 14.543 -4.492 1.00 64.31 H new ATOM 0 HZ PHE A 39 -0.157 12.988 -3.608 1.00 1.33 H new ATOM 593 N GLU A 40 -7.527 12.538 0.643 1.00 42.13 N ATOM 594 CA GLU A 40 -8.960 12.619 0.907 1.00 73.32 C ATOM 595 C GLU A 40 -9.758 12.691 -0.389 1.00 50.33 C ATOM 596 O GLU A 40 -10.169 13.767 -0.829 1.00 4.24 O ATOM 597 CB GLU A 40 -9.325 13.793 1.822 1.00 34.21 C ATOM 598 CG GLU A 40 -10.778 13.739 2.270 1.00 3.33 C ATOM 599 CD GLU A 40 -11.194 14.916 3.117 1.00 53.23 C ATOM 600 OE1 GLU A 40 -11.601 15.946 2.550 1.00 33.31 O ATOM 601 OE2 GLU A 40 -11.139 14.806 4.359 1.00 30.35 O ATOM 0 H GLU A 40 -7.078 11.741 1.094 1.00 42.13 H new ATOM 0 HA GLU A 40 -9.226 11.702 1.433 1.00 73.32 H new ATOM 0 HB2 GLU A 40 -8.676 13.785 2.697 1.00 34.21 H new ATOM 0 HB3 GLU A 40 -9.142 14.731 1.298 1.00 34.21 H new ATOM 0 HG2 GLU A 40 -11.419 13.691 1.390 1.00 3.33 H new ATOM 0 HG3 GLU A 40 -10.942 12.821 2.834 1.00 3.33 H new ATOM 608 N PRO A 41 -9.958 11.540 -1.040 1.00 74.44 N ATOM 609 CA PRO A 41 -10.790 11.450 -2.232 1.00 71.32 C ATOM 610 C PRO A 41 -12.262 11.587 -1.874 1.00 62.11 C ATOM 611 O PRO A 41 -12.638 11.492 -0.704 1.00 71.11 O ATOM 612 CB PRO A 41 -10.496 10.050 -2.790 1.00 14.33 C ATOM 613 CG PRO A 41 -9.348 9.525 -1.993 1.00 71.40 C ATOM 614 CD PRO A 41 -9.392 10.238 -0.675 1.00 65.41 C ATOM 0 HA PRO A 41 -10.577 12.241 -2.951 1.00 71.32 H new ATOM 0 HB2 PRO A 41 -11.367 9.401 -2.695 1.00 14.33 H new ATOM 0 HB3 PRO A 41 -10.247 10.096 -3.850 1.00 14.33 H new ATOM 0 HG2 PRO A 41 -9.431 8.447 -1.855 1.00 71.40 H new ATOM 0 HG3 PRO A 41 -8.403 9.709 -2.504 1.00 71.40 H new ATOM 0 HD2 PRO A 41 -10.014 9.713 0.050 1.00 65.41 H new ATOM 0 HD3 PRO A 41 -8.401 10.336 -0.233 1.00 65.41 H new ATOM 622 N LYS A 42 -13.102 11.814 -2.866 1.00 50.51 N ATOM 623 CA LYS A 42 -14.519 11.967 -2.604 1.00 53.51 C ATOM 624 C LYS A 42 -15.230 10.625 -2.738 1.00 64.44 C ATOM 625 O LYS A 42 -14.584 9.578 -2.733 1.00 75.43 O ATOM 626 CB LYS A 42 -15.135 13.006 -3.539 1.00 23.42 C ATOM 627 CG LYS A 42 -15.903 14.110 -2.814 1.00 44.00 C ATOM 628 CD LYS A 42 -14.976 15.145 -2.176 1.00 43.45 C ATOM 629 CE LYS A 42 -14.255 14.630 -0.931 1.00 11.24 C ATOM 630 NZ LYS A 42 -15.191 14.370 0.196 1.00 35.30 N ATOM 0 H LYS A 42 -12.833 11.896 -3.846 1.00 50.51 H new ATOM 0 HA LYS A 42 -14.645 12.322 -1.581 1.00 53.51 H new ATOM 0 HB2 LYS A 42 -14.343 13.459 -4.136 1.00 23.42 H new ATOM 0 HB3 LYS A 42 -15.809 12.503 -4.233 1.00 23.42 H new ATOM 0 HG2 LYS A 42 -16.569 14.608 -3.519 1.00 44.00 H new ATOM 0 HG3 LYS A 42 -16.531 13.665 -2.042 1.00 44.00 H new ATOM 0 HD2 LYS A 42 -14.235 15.460 -2.911 1.00 43.45 H new ATOM 0 HD3 LYS A 42 -15.558 16.028 -1.911 1.00 43.45 H new ATOM 0 HE2 LYS A 42 -13.721 13.712 -1.177 1.00 11.24 H new ATOM 0 HE3 LYS A 42 -13.508 15.359 -0.619 1.00 11.24 H new ATOM 0 HZ1 LYS A 42 -14.648 14.204 1.067 1.00 35.30 H new ATOM 0 HZ2 LYS A 42 -15.813 15.193 0.328 1.00 35.30 H new ATOM 0 HZ3 LYS A 42 -15.767 13.531 -0.018 1.00 35.30 H new ATOM 725 N LYS A 48 -26.358 5.629 -9.128 1.00 53.23 N ATOM 726 CA LYS A 48 -27.582 5.043 -9.643 1.00 10.34 C ATOM 727 C LYS A 48 -28.060 3.987 -8.680 1.00 73.23 C ATOM 728 O LYS A 48 -27.321 3.059 -8.350 1.00 43.11 O ATOM 729 CB LYS A 48 -27.421 4.378 -11.014 1.00 21.23 C ATOM 730 CG LYS A 48 -26.458 5.056 -11.959 1.00 70.35 C ATOM 731 CD LYS A 48 -25.072 4.470 -11.813 1.00 14.33 C ATOM 732 CE LYS A 48 -24.418 4.279 -13.167 1.00 24.12 C ATOM 733 NZ LYS A 48 -22.983 3.932 -13.041 1.00 1.04 N ATOM 0 HA LYS A 48 -28.291 5.864 -9.754 1.00 10.34 H new ATOM 0 HB2 LYS A 48 -27.091 3.350 -10.863 1.00 21.23 H new ATOM 0 HB3 LYS A 48 -28.399 4.331 -11.492 1.00 21.23 H new ATOM 0 HG2 LYS A 48 -26.803 4.937 -12.986 1.00 70.35 H new ATOM 0 HG3 LYS A 48 -26.430 6.126 -11.754 1.00 70.35 H new ATOM 0 HD2 LYS A 48 -24.458 5.128 -11.198 1.00 14.33 H new ATOM 0 HD3 LYS A 48 -25.131 3.513 -11.295 1.00 14.33 H new ATOM 0 HE2 LYS A 48 -24.936 3.490 -13.713 1.00 24.12 H new ATOM 0 HE3 LYS A 48 -24.521 5.193 -13.753 1.00 24.12 H new ATOM 0 HZ1 LYS A 48 -22.571 3.809 -13.988 1.00 1.04 H new ATOM 0 HZ2 LYS A 48 -22.484 4.696 -12.542 1.00 1.04 H new ATOM 0 HZ3 LYS A 48 -22.886 3.047 -12.504 1.00 1.04 H new ATOM 747 N LEU A 49 -29.276 4.133 -8.220 1.00 2.53 N ATOM 748 CA LEU A 49 -29.892 3.101 -7.426 1.00 60.01 C ATOM 749 C LEU A 49 -30.289 1.943 -8.314 1.00 34.03 C ATOM 750 O LEU A 49 -31.380 1.934 -8.878 1.00 70.13 O ATOM 751 CB LEU A 49 -31.108 3.632 -6.671 1.00 21.45 C ATOM 752 CG LEU A 49 -30.823 4.162 -5.270 1.00 64.01 C ATOM 753 CD1 LEU A 49 -29.738 5.224 -5.297 1.00 52.33 C ATOM 754 CD2 LEU A 49 -32.091 4.708 -4.645 1.00 12.15 C ATOM 0 H LEU A 49 -29.858 4.955 -8.381 1.00 2.53 H new ATOM 0 HA LEU A 49 -29.167 2.758 -6.687 1.00 60.01 H new ATOM 0 HB2 LEU A 49 -31.560 4.431 -7.259 1.00 21.45 H new ATOM 0 HB3 LEU A 49 -31.846 2.834 -6.597 1.00 21.45 H new ATOM 0 HG LEU A 49 -30.463 3.333 -4.660 1.00 64.01 H new ATOM 0 HD11 LEU A 49 -29.556 5.584 -4.284 1.00 52.33 H new ATOM 0 HD12 LEU A 49 -28.820 4.796 -5.701 1.00 52.33 H new ATOM 0 HD13 LEU A 49 -30.058 6.055 -5.925 1.00 52.33 H new ATOM 0 HD21 LEU A 49 -31.872 5.083 -3.645 1.00 12.15 H new ATOM 0 HD22 LEU A 49 -32.479 5.520 -5.260 1.00 12.15 H new ATOM 0 HD23 LEU A 49 -32.835 3.914 -4.580 1.00 12.15 H new ATOM 766 N ALA A 50 -29.363 1.012 -8.493 1.00 41.01 N ATOM 767 CA ALA A 50 -29.651 -0.216 -9.206 1.00 23.41 C ATOM 768 C ALA A 50 -30.125 -1.270 -8.221 1.00 44.30 C ATOM 769 O ALA A 50 -29.332 -2.047 -7.685 1.00 5.04 O ATOM 770 CB ALA A 50 -28.435 -0.700 -9.983 1.00 71.14 C ATOM 0 H ALA A 50 -28.405 1.088 -8.152 1.00 41.01 H new ATOM 0 HA ALA A 50 -30.441 -0.026 -9.932 1.00 23.41 H new ATOM 0 HB1 ALA A 50 -28.682 -1.623 -10.507 1.00 71.14 H new ATOM 0 HB2 ALA A 50 -28.139 0.060 -10.706 1.00 71.14 H new ATOM 0 HB3 ALA A 50 -27.612 -0.884 -9.293 1.00 71.14 H new ATOM 776 N PHE A 51 -31.420 -1.260 -7.962 1.00 21.34 N ATOM 777 CA PHE A 51 -32.004 -2.111 -6.943 1.00 44.01 C ATOM 778 C PHE A 51 -33.105 -2.974 -7.530 1.00 1.02 C ATOM 779 O PHE A 51 -33.566 -2.736 -8.646 1.00 4.40 O ATOM 780 CB PHE A 51 -32.558 -1.265 -5.794 1.00 24.31 C ATOM 781 CG PHE A 51 -33.623 -0.280 -6.206 1.00 23.04 C ATOM 782 CD1 PHE A 51 -33.281 0.963 -6.715 1.00 11.04 C ATOM 783 CD2 PHE A 51 -34.964 -0.595 -6.070 1.00 2.10 C ATOM 784 CE1 PHE A 51 -34.257 1.868 -7.084 1.00 71.32 C ATOM 785 CE2 PHE A 51 -35.943 0.308 -6.437 1.00 32.33 C ATOM 786 CZ PHE A 51 -35.589 1.541 -6.941 1.00 3.20 C ATOM 0 H PHE A 51 -32.092 -0.666 -8.448 1.00 21.34 H new ATOM 0 HA PHE A 51 -31.221 -2.763 -6.556 1.00 44.01 H new ATOM 0 HB2 PHE A 51 -32.969 -1.930 -5.034 1.00 24.31 H new ATOM 0 HB3 PHE A 51 -31.736 -0.720 -5.330 1.00 24.31 H new ATOM 0 HD1 PHE A 51 -32.239 1.227 -6.824 1.00 11.04 H new ATOM 0 HD2 PHE A 51 -35.248 -1.558 -5.672 1.00 2.10 H new ATOM 0 HE1 PHE A 51 -33.977 2.831 -7.484 1.00 71.32 H new ATOM 0 HE2 PHE A 51 -36.986 0.048 -6.329 1.00 32.33 H new ATOM 0 HZ PHE A 51 -36.353 2.250 -7.223 1.00 3.20 H new ATOM 796 N LYS A 52 -33.528 -3.965 -6.770 1.00 2.51 N ATOM 797 CA LYS A 52 -34.580 -4.858 -7.214 1.00 45.44 C ATOM 798 C LYS A 52 -35.942 -4.334 -6.778 1.00 23.12 C ATOM 799 O LYS A 52 -36.257 -4.304 -5.587 1.00 64.05 O ATOM 800 CB LYS A 52 -34.364 -6.266 -6.662 1.00 51.11 C ATOM 801 CG LYS A 52 -35.448 -7.240 -7.082 1.00 73.25 C ATOM 802 CD LYS A 52 -35.364 -7.584 -8.559 1.00 30.31 C ATOM 803 CE LYS A 52 -34.779 -8.970 -8.771 1.00 54.52 C ATOM 804 NZ LYS A 52 -34.773 -9.364 -10.204 1.00 31.11 N ATOM 0 H LYS A 52 -33.159 -4.172 -5.842 1.00 2.51 H new ATOM 0 HA LYS A 52 -34.549 -4.902 -8.303 1.00 45.44 H new ATOM 0 HB2 LYS A 52 -33.397 -6.639 -7.001 1.00 51.11 H new ATOM 0 HB3 LYS A 52 -34.325 -6.222 -5.574 1.00 51.11 H new ATOM 0 HG2 LYS A 52 -35.364 -8.153 -6.492 1.00 73.25 H new ATOM 0 HG3 LYS A 52 -36.426 -6.810 -6.865 1.00 73.25 H new ATOM 0 HD2 LYS A 52 -36.358 -7.535 -9.003 1.00 30.31 H new ATOM 0 HD3 LYS A 52 -34.749 -6.845 -9.072 1.00 30.31 H new ATOM 0 HE2 LYS A 52 -33.760 -8.995 -8.385 1.00 54.52 H new ATOM 0 HE3 LYS A 52 -35.355 -9.697 -8.199 1.00 54.52 H new ATOM 0 HZ1 LYS A 52 -34.832 -10.400 -10.280 1.00 31.11 H new ATOM 0 HZ2 LYS A 52 -35.589 -8.935 -10.685 1.00 31.11 H new ATOM 0 HZ3 LYS A 52 -33.894 -9.034 -10.651 1.00 31.11 H new ATOM 818 N CYS A 53 -36.743 -3.925 -7.746 1.00 62.23 N ATOM 819 CA CYS A 53 -38.071 -3.415 -7.468 1.00 3.25 C ATOM 820 C CYS A 53 -39.107 -4.194 -8.259 1.00 73.21 C ATOM 821 O CYS A 53 -39.110 -4.163 -9.490 1.00 1.52 O ATOM 822 CB CYS A 53 -38.153 -1.928 -7.814 1.00 62.45 C ATOM 823 SG CYS A 53 -39.721 -1.145 -7.374 1.00 40.13 S ATOM 0 H CYS A 53 -36.494 -3.937 -8.735 1.00 62.23 H new ATOM 0 HA CYS A 53 -38.275 -3.537 -6.404 1.00 3.25 H new ATOM 0 HB2 CYS A 53 -37.344 -1.404 -7.305 1.00 62.45 H new ATOM 0 HB3 CYS A 53 -37.988 -1.807 -8.885 1.00 62.45 H new ATOM 0 HG CYS A 53 -39.494 -0.119 -6.608 1.00 40.13 H new ATOM 829 N ASP A 54 -39.948 -4.928 -7.541 1.00 24.23 N ATOM 830 CA ASP A 54 -41.087 -5.630 -8.130 1.00 33.21 C ATOM 831 C ASP A 54 -40.632 -6.722 -9.098 1.00 32.15 C ATOM 832 O ASP A 54 -41.368 -7.115 -9.999 1.00 10.52 O ATOM 833 CB ASP A 54 -42.005 -4.636 -8.851 1.00 41.13 C ATOM 834 CG ASP A 54 -43.475 -4.963 -8.680 1.00 0.13 C ATOM 835 OD1 ASP A 54 -43.928 -6.013 -9.181 1.00 41.21 O ATOM 836 OD2 ASP A 54 -44.189 -4.147 -8.054 1.00 74.20 O ATOM 0 H ASP A 54 -39.862 -5.055 -6.533 1.00 24.23 H new ATOM 0 HA ASP A 54 -41.639 -6.108 -7.321 1.00 33.21 H new ATOM 0 HB2 ASP A 54 -41.814 -3.632 -8.472 1.00 41.13 H new ATOM 0 HB3 ASP A 54 -41.761 -4.628 -9.913 1.00 41.13 H new ATOM 841 N GLY A 55 -39.418 -7.222 -8.913 1.00 35.15 N ATOM 842 CA GLY A 55 -38.940 -8.302 -9.748 1.00 14.43 C ATOM 843 C GLY A 55 -37.912 -7.862 -10.770 1.00 72.13 C ATOM 844 O GLY A 55 -37.160 -8.686 -11.286 1.00 24.42 O ATOM 0 H GLY A 55 -38.760 -6.900 -8.203 1.00 35.15 H new ATOM 0 HA2 GLY A 55 -38.505 -9.075 -9.115 1.00 14.43 H new ATOM 0 HA3 GLY A 55 -39.786 -8.753 -10.266 1.00 14.43 H new ATOM 848 N GLU A 56 -37.859 -6.571 -11.060 1.00 54.52 N ATOM 849 CA GLU A 56 -36.910 -6.055 -12.036 1.00 24.45 C ATOM 850 C GLU A 56 -35.904 -5.117 -11.381 1.00 45.21 C ATOM 851 O GLU A 56 -36.217 -4.436 -10.402 1.00 13.12 O ATOM 852 CB GLU A 56 -37.647 -5.341 -13.175 1.00 34.14 C ATOM 853 CG GLU A 56 -38.612 -4.258 -12.713 1.00 62.41 C ATOM 854 CD GLU A 56 -39.372 -3.626 -13.863 1.00 45.43 C ATOM 855 OE1 GLU A 56 -40.283 -4.279 -14.413 1.00 35.34 O ATOM 856 OE2 GLU A 56 -39.056 -2.476 -14.234 1.00 61.23 O ATOM 0 H GLU A 56 -38.459 -5.864 -10.636 1.00 54.52 H new ATOM 0 HA GLU A 56 -36.361 -6.900 -12.451 1.00 24.45 H new ATOM 0 HB2 GLU A 56 -36.912 -4.895 -13.845 1.00 34.14 H new ATOM 0 HB3 GLU A 56 -38.199 -6.080 -13.755 1.00 34.14 H new ATOM 0 HG2 GLU A 56 -39.322 -4.686 -12.005 1.00 62.41 H new ATOM 0 HG3 GLU A 56 -38.058 -3.485 -12.180 1.00 62.41 H new ATOM 863 N ILE A 57 -34.687 -5.112 -11.904 1.00 73.34 N ATOM 864 CA ILE A 57 -33.655 -4.209 -11.425 1.00 31.10 C ATOM 865 C ILE A 57 -33.833 -2.832 -12.054 1.00 31.14 C ATOM 866 O ILE A 57 -33.809 -2.685 -13.278 1.00 45.11 O ATOM 867 CB ILE A 57 -32.234 -4.735 -11.746 1.00 54.11 C ATOM 868 CG1 ILE A 57 -31.993 -6.088 -11.070 1.00 44.12 C ATOM 869 CG2 ILE A 57 -31.173 -3.728 -11.316 1.00 21.54 C ATOM 870 CD1 ILE A 57 -32.014 -6.032 -9.557 1.00 31.41 C ATOM 0 H ILE A 57 -34.391 -5.726 -12.663 1.00 73.34 H new ATOM 0 HA ILE A 57 -33.758 -4.143 -10.342 1.00 31.10 H new ATOM 0 HB ILE A 57 -32.160 -4.870 -12.825 1.00 54.11 H new ATOM 0 HG12 ILE A 57 -32.753 -6.792 -11.408 1.00 44.12 H new ATOM 0 HG13 ILE A 57 -31.029 -6.479 -11.396 1.00 44.12 H new ATOM 0 HG21 ILE A 57 -30.183 -4.119 -11.551 1.00 21.54 H new ATOM 0 HG22 ILE A 57 -31.327 -2.788 -11.846 1.00 21.54 H new ATOM 0 HG23 ILE A 57 -31.249 -3.556 -10.242 1.00 21.54 H new ATOM 0 HD11 ILE A 57 -31.836 -7.029 -9.154 1.00 31.41 H new ATOM 0 HD12 ILE A 57 -31.235 -5.354 -9.207 1.00 31.41 H new ATOM 0 HD13 ILE A 57 -32.986 -5.673 -9.220 1.00 31.41 H new ATOM 882 N LYS A 58 -34.023 -1.833 -11.214 1.00 33.14 N ATOM 883 CA LYS A 58 -34.200 -0.467 -11.675 1.00 23.20 C ATOM 884 C LYS A 58 -32.903 0.305 -11.488 1.00 11.52 C ATOM 885 O LYS A 58 -32.144 0.004 -10.575 1.00 23.11 O ATOM 886 CB LYS A 58 -35.320 0.218 -10.882 1.00 4.04 C ATOM 887 CG LYS A 58 -36.591 -0.610 -10.758 1.00 51.41 C ATOM 888 CD LYS A 58 -37.217 -0.903 -12.109 1.00 75.03 C ATOM 889 CE LYS A 58 -37.758 0.350 -12.773 1.00 70.51 C ATOM 890 NZ LYS A 58 -38.282 0.063 -14.130 1.00 71.04 N ATOM 0 H LYS A 58 -34.059 -1.942 -10.200 1.00 33.14 H new ATOM 0 HA LYS A 58 -34.470 -0.482 -12.731 1.00 23.20 H new ATOM 0 HB2 LYS A 58 -34.952 0.451 -9.883 1.00 4.04 H new ATOM 0 HB3 LYS A 58 -35.562 1.166 -11.362 1.00 4.04 H new ATOM 0 HG2 LYS A 58 -36.363 -1.549 -10.253 1.00 51.41 H new ATOM 0 HG3 LYS A 58 -37.310 -0.079 -10.134 1.00 51.41 H new ATOM 0 HD2 LYS A 58 -36.474 -1.365 -12.759 1.00 75.03 H new ATOM 0 HD3 LYS A 58 -38.025 -1.624 -11.985 1.00 75.03 H new ATOM 0 HE2 LYS A 58 -38.551 0.775 -12.158 1.00 70.51 H new ATOM 0 HE3 LYS A 58 -36.968 1.099 -12.838 1.00 70.51 H new ATOM 0 HZ1 LYS A 58 -37.693 0.545 -14.839 1.00 71.04 H new ATOM 0 HZ2 LYS A 58 -38.260 -0.963 -14.301 1.00 71.04 H new ATOM 0 HZ3 LYS A 58 -39.261 0.405 -14.203 1.00 71.04 H new ATOM 904 N THR A 59 -32.640 1.273 -12.353 1.00 0.44 N ATOM 905 CA THR A 59 -31.494 2.154 -12.176 1.00 24.52 C ATOM 906 C THR A 59 -31.935 3.607 -12.082 1.00 74.40 C ATOM 907 O THR A 59 -32.386 4.197 -13.064 1.00 50.04 O ATOM 908 CB THR A 59 -30.465 2.011 -13.317 1.00 63.53 C ATOM 909 OG1 THR A 59 -31.108 1.586 -14.523 1.00 74.54 O ATOM 910 CG2 THR A 59 -29.355 1.038 -12.944 1.00 61.24 C ATOM 0 H THR A 59 -33.202 1.469 -13.182 1.00 0.44 H new ATOM 0 HA THR A 59 -31.016 1.854 -11.244 1.00 24.52 H new ATOM 0 HB THR A 59 -30.016 2.990 -13.482 1.00 63.53 H new ATOM 0 HG1 THR A 59 -30.442 1.502 -15.237 1.00 74.54 H new ATOM 0 HG21 THR A 59 -28.647 0.960 -13.769 1.00 61.24 H new ATOM 0 HG22 THR A 59 -28.838 1.399 -12.055 1.00 61.24 H new ATOM 0 HG23 THR A 59 -29.784 0.057 -12.740 1.00 61.24 H new ATOM 918 N PHE A 60 -31.827 4.178 -10.892 1.00 32.44 N ATOM 919 CA PHE A 60 -32.175 5.575 -10.698 1.00 31.12 C ATOM 920 C PHE A 60 -30.966 6.382 -10.267 1.00 35.21 C ATOM 921 O PHE A 60 -30.553 6.339 -9.110 1.00 45.13 O ATOM 922 CB PHE A 60 -33.308 5.717 -9.686 1.00 20.34 C ATOM 923 CG PHE A 60 -34.636 5.286 -10.231 1.00 22.54 C ATOM 924 CD1 PHE A 60 -34.998 3.951 -10.248 1.00 50.14 C ATOM 925 CD2 PHE A 60 -35.521 6.223 -10.735 1.00 34.13 C ATOM 926 CE1 PHE A 60 -36.218 3.558 -10.759 1.00 3.42 C ATOM 927 CE2 PHE A 60 -36.741 5.837 -11.248 1.00 12.42 C ATOM 928 CZ PHE A 60 -37.090 4.501 -11.260 1.00 54.21 C ATOM 0 H PHE A 60 -31.503 3.698 -10.052 1.00 32.44 H new ATOM 0 HA PHE A 60 -32.521 5.970 -11.653 1.00 31.12 H new ATOM 0 HB2 PHE A 60 -33.074 5.124 -8.802 1.00 20.34 H new ATOM 0 HB3 PHE A 60 -33.373 6.757 -9.365 1.00 20.34 H new ATOM 0 HD1 PHE A 60 -34.318 3.208 -9.857 1.00 50.14 H new ATOM 0 HD2 PHE A 60 -35.253 7.269 -10.726 1.00 34.13 H new ATOM 0 HE1 PHE A 60 -36.490 2.513 -10.766 1.00 3.42 H new ATOM 0 HE2 PHE A 60 -37.422 6.578 -11.640 1.00 12.42 H new ATOM 0 HZ PHE A 60 -38.045 4.195 -11.661 1.00 54.21 H new ATOM 938 N SER A 61 -30.394 7.100 -11.218 1.00 31.45 N ATOM 939 CA SER A 61 -29.239 7.946 -10.965 1.00 75.10 C ATOM 940 C SER A 61 -29.687 9.314 -10.464 1.00 40.12 C ATOM 941 O SER A 61 -28.888 10.112 -9.973 1.00 23.11 O ATOM 942 CB SER A 61 -28.413 8.084 -12.246 1.00 33.03 C ATOM 943 OG SER A 61 -29.256 8.222 -13.384 1.00 60.25 O ATOM 0 H SER A 61 -30.716 7.114 -12.186 1.00 31.45 H new ATOM 0 HA SER A 61 -28.619 7.488 -10.194 1.00 75.10 H new ATOM 0 HB2 SER A 61 -27.757 8.951 -12.168 1.00 33.03 H new ATOM 0 HB3 SER A 61 -27.774 7.210 -12.367 1.00 33.03 H new ATOM 0 HG SER A 61 -28.706 8.310 -14.190 1.00 60.25 H new ATOM 949 N ASP A 62 -30.977 9.575 -10.606 1.00 22.14 N ATOM 950 CA ASP A 62 -31.572 10.811 -10.127 1.00 63.41 C ATOM 951 C ASP A 62 -32.773 10.487 -9.249 1.00 15.54 C ATOM 952 O ASP A 62 -33.779 9.953 -9.723 1.00 72.33 O ATOM 953 CB ASP A 62 -31.986 11.689 -11.310 1.00 2.31 C ATOM 954 CG ASP A 62 -32.539 13.026 -10.882 1.00 45.52 C ATOM 955 OD1 ASP A 62 -31.749 13.891 -10.436 1.00 4.23 O ATOM 956 OD2 ASP A 62 -33.761 13.224 -11.018 1.00 64.45 O ATOM 0 H ASP A 62 -31.637 8.940 -11.054 1.00 22.14 H new ATOM 0 HA ASP A 62 -30.841 11.362 -9.535 1.00 63.41 H new ATOM 0 HB2 ASP A 62 -31.124 11.848 -11.957 1.00 2.31 H new ATOM 0 HB3 ASP A 62 -32.736 11.164 -11.901 1.00 2.31 H new ATOM 961 N LEU A 63 -32.657 10.797 -7.964 1.00 22.22 N ATOM 962 CA LEU A 63 -33.692 10.455 -6.989 1.00 50.33 C ATOM 963 C LEU A 63 -34.940 11.309 -7.190 1.00 43.41 C ATOM 964 O LEU A 63 -36.038 10.925 -6.788 1.00 11.01 O ATOM 965 CB LEU A 63 -33.157 10.616 -5.564 1.00 12.20 C ATOM 966 CG LEU A 63 -31.938 9.753 -5.228 1.00 2.51 C ATOM 967 CD1 LEU A 63 -31.499 9.980 -3.791 1.00 42.32 C ATOM 968 CD2 LEU A 63 -32.240 8.282 -5.470 1.00 31.15 C ATOM 0 H LEU A 63 -31.854 11.287 -7.569 1.00 22.22 H new ATOM 0 HA LEU A 63 -33.969 9.412 -7.143 1.00 50.33 H new ATOM 0 HB2 LEU A 63 -32.897 11.663 -5.406 1.00 12.20 H new ATOM 0 HB3 LEU A 63 -33.957 10.377 -4.863 1.00 12.20 H new ATOM 0 HG LEU A 63 -31.120 10.047 -5.885 1.00 2.51 H new ATOM 0 HD11 LEU A 63 -30.631 9.357 -3.573 1.00 42.32 H new ATOM 0 HD12 LEU A 63 -31.237 11.029 -3.652 1.00 42.32 H new ATOM 0 HD13 LEU A 63 -32.313 9.717 -3.116 1.00 42.32 H new ATOM 0 HD21 LEU A 63 -31.361 7.685 -5.225 1.00 31.15 H new ATOM 0 HD22 LEU A 63 -33.075 7.974 -4.841 1.00 31.15 H new ATOM 0 HD23 LEU A 63 -32.501 8.132 -6.518 1.00 31.15 H new ATOM 980 N GLN A 64 -34.760 12.466 -7.813 1.00 31.43 N ATOM 981 CA GLN A 64 -35.880 13.305 -8.222 1.00 25.15 C ATOM 982 C GLN A 64 -36.780 12.503 -9.155 1.00 73.15 C ATOM 983 O GLN A 64 -37.989 12.405 -8.947 1.00 31.40 O ATOM 984 CB GLN A 64 -35.339 14.569 -8.908 1.00 74.44 C ATOM 985 CG GLN A 64 -36.381 15.575 -9.383 1.00 13.34 C ATOM 986 CD GLN A 64 -37.018 15.218 -10.714 1.00 2.44 C ATOM 987 OE1 GLN A 64 -38.087 14.615 -10.762 1.00 53.13 O ATOM 988 NE2 GLN A 64 -36.351 15.562 -11.804 1.00 61.43 N ATOM 0 H GLN A 64 -33.843 12.847 -8.048 1.00 31.43 H new ATOM 0 HA GLN A 64 -36.468 13.615 -7.358 1.00 25.15 H new ATOM 0 HB2 GLN A 64 -34.666 15.074 -8.215 1.00 74.44 H new ATOM 0 HB3 GLN A 64 -34.741 14.264 -9.767 1.00 74.44 H new ATOM 0 HG2 GLN A 64 -37.163 15.658 -8.628 1.00 13.34 H new ATOM 0 HG3 GLN A 64 -35.913 16.556 -9.467 1.00 13.34 H new ATOM 0 HE21 GLN A 64 -35.466 16.062 -11.724 1.00 61.43 H new ATOM 0 HE22 GLN A 64 -36.722 15.327 -12.725 1.00 61.43 H new ATOM 997 N SER A 65 -36.162 11.899 -10.157 1.00 15.30 N ATOM 998 CA SER A 65 -36.872 11.058 -11.103 1.00 41.01 C ATOM 999 C SER A 65 -37.446 9.820 -10.408 1.00 51.53 C ATOM 1000 O SER A 65 -38.467 9.276 -10.829 1.00 34.04 O ATOM 1001 CB SER A 65 -35.926 10.657 -12.233 1.00 45.51 C ATOM 1002 OG SER A 65 -35.338 11.807 -12.827 1.00 24.11 O ATOM 0 H SER A 65 -35.161 11.978 -10.336 1.00 15.30 H new ATOM 0 HA SER A 65 -37.709 11.618 -11.520 1.00 41.01 H new ATOM 0 HB2 SER A 65 -35.145 10.002 -11.846 1.00 45.51 H new ATOM 0 HB3 SER A 65 -36.472 10.091 -12.987 1.00 45.51 H new ATOM 0 HG SER A 65 -34.696 12.206 -12.203 1.00 24.11 H new ATOM 1008 N LEU A 66 -36.798 9.391 -9.327 1.00 55.03 N ATOM 1009 CA LEU A 66 -37.283 8.258 -8.545 1.00 40.14 C ATOM 1010 C LEU A 66 -38.575 8.621 -7.816 1.00 22.34 C ATOM 1011 O LEU A 66 -39.447 7.773 -7.618 1.00 70.35 O ATOM 1012 CB LEU A 66 -36.223 7.792 -7.541 1.00 65.23 C ATOM 1013 CG LEU A 66 -36.638 6.612 -6.655 1.00 53.20 C ATOM 1014 CD1 LEU A 66 -36.893 5.364 -7.485 1.00 5.03 C ATOM 1015 CD2 LEU A 66 -35.579 6.347 -5.597 1.00 64.34 C ATOM 0 H LEU A 66 -35.938 9.810 -8.974 1.00 55.03 H new ATOM 0 HA LEU A 66 -37.488 7.439 -9.234 1.00 40.14 H new ATOM 0 HB2 LEU A 66 -35.323 7.515 -8.090 1.00 65.23 H new ATOM 0 HB3 LEU A 66 -35.959 8.633 -6.899 1.00 65.23 H new ATOM 0 HG LEU A 66 -37.571 6.875 -6.156 1.00 53.20 H new ATOM 0 HD11 LEU A 66 -37.186 4.544 -6.829 1.00 5.03 H new ATOM 0 HD12 LEU A 66 -37.692 5.560 -8.200 1.00 5.03 H new ATOM 0 HD13 LEU A 66 -35.984 5.092 -8.022 1.00 5.03 H new ATOM 0 HD21 LEU A 66 -35.888 5.506 -4.976 1.00 64.34 H new ATOM 0 HD22 LEU A 66 -34.632 6.111 -6.082 1.00 64.34 H new ATOM 0 HD23 LEU A 66 -35.457 7.233 -4.974 1.00 64.34 H new ATOM 1027 N ARG A 67 -38.700 9.886 -7.425 1.00 25.21 N ATOM 1028 CA ARG A 67 -39.924 10.374 -6.797 1.00 51.41 C ATOM 1029 C ARG A 67 -41.101 10.233 -7.758 1.00 64.31 C ATOM 1030 O ARG A 67 -42.224 9.946 -7.345 1.00 34.14 O ATOM 1031 CB ARG A 67 -39.765 11.837 -6.360 1.00 60.10 C ATOM 1032 CG ARG A 67 -41.058 12.484 -5.879 1.00 44.15 C ATOM 1033 CD ARG A 67 -40.839 13.934 -5.477 1.00 73.33 C ATOM 1034 NE ARG A 67 -42.099 14.663 -5.313 1.00 75.42 N ATOM 1035 CZ ARG A 67 -42.172 15.988 -5.201 1.00 43.13 C ATOM 1036 NH1 ARG A 67 -41.064 16.712 -5.114 1.00 11.13 N ATOM 1037 NH2 ARG A 67 -43.355 16.585 -5.137 1.00 22.52 N ATOM 0 H ARG A 67 -37.970 10.591 -7.532 1.00 25.21 H new ATOM 0 HA ARG A 67 -40.119 9.772 -5.910 1.00 51.41 H new ATOM 0 HB2 ARG A 67 -39.026 11.888 -5.561 1.00 60.10 H new ATOM 0 HB3 ARG A 67 -39.371 12.415 -7.196 1.00 60.10 H new ATOM 0 HG2 ARG A 67 -41.807 12.433 -6.669 1.00 44.15 H new ATOM 0 HG3 ARG A 67 -41.452 11.925 -5.030 1.00 44.15 H new ATOM 0 HD2 ARG A 67 -40.278 13.969 -4.543 1.00 73.33 H new ATOM 0 HD3 ARG A 67 -40.231 14.430 -6.233 1.00 73.33 H new ATOM 0 HE ARG A 67 -42.966 14.127 -5.283 1.00 75.42 H new ATOM 0 HH11 ARG A 67 -40.153 16.254 -5.133 1.00 11.13 H new ATOM 0 HH12 ARG A 67 -41.123 17.727 -5.028 1.00 11.13 H new ATOM 0 HH21 ARG A 67 -44.209 16.029 -5.174 1.00 22.52 H new ATOM 0 HH22 ARG A 67 -43.410 17.600 -5.051 1.00 22.52 H new ATOM 1051 N LYS A 68 -40.829 10.417 -9.047 1.00 11.04 N ATOM 1052 CA LYS A 68 -41.851 10.273 -10.076 1.00 71.12 C ATOM 1053 C LYS A 68 -42.277 8.812 -10.210 1.00 23.31 C ATOM 1054 O LYS A 68 -43.397 8.510 -10.616 1.00 13.10 O ATOM 1055 CB LYS A 68 -41.334 10.782 -11.418 1.00 22.01 C ATOM 1056 CG LYS A 68 -40.899 12.237 -11.400 1.00 30.22 C ATOM 1057 CD LYS A 68 -40.663 12.732 -12.812 1.00 65.34 C ATOM 1058 CE LYS A 68 -40.194 14.178 -12.855 1.00 34.32 C ATOM 1059 NZ LYS A 68 -41.166 15.111 -12.225 1.00 5.41 N ATOM 0 H LYS A 68 -39.906 10.667 -9.403 1.00 11.04 H new ATOM 0 HA LYS A 68 -42.715 10.868 -9.779 1.00 71.12 H new ATOM 0 HB2 LYS A 68 -40.491 10.165 -11.729 1.00 22.01 H new ATOM 0 HB3 LYS A 68 -42.115 10.656 -12.168 1.00 22.01 H new ATOM 0 HG2 LYS A 68 -41.663 12.846 -10.917 1.00 30.22 H new ATOM 0 HG3 LYS A 68 -39.987 12.344 -10.813 1.00 30.22 H new ATOM 0 HD2 LYS A 68 -39.919 12.098 -13.295 1.00 65.34 H new ATOM 0 HD3 LYS A 68 -41.585 12.636 -13.385 1.00 65.34 H new ATOM 0 HE2 LYS A 68 -39.234 14.260 -12.346 1.00 34.32 H new ATOM 0 HE3 LYS A 68 -40.031 14.473 -13.892 1.00 34.32 H new ATOM 0 HZ1 LYS A 68 -40.877 16.092 -12.413 1.00 5.41 H new ATOM 0 HZ2 LYS A 68 -42.113 14.947 -12.623 1.00 5.41 H new ATOM 0 HZ3 LYS A 68 -41.189 14.947 -11.198 1.00 5.41 H new ATOM 1073 N PHE A 69 -41.371 7.913 -9.847 1.00 14.42 N ATOM 1074 CA PHE A 69 -41.605 6.482 -9.972 1.00 21.45 C ATOM 1075 C PHE A 69 -42.338 5.931 -8.748 1.00 25.21 C ATOM 1076 O PHE A 69 -43.382 5.295 -8.875 1.00 52.14 O ATOM 1077 CB PHE A 69 -40.265 5.761 -10.157 1.00 62.20 C ATOM 1078 CG PHE A 69 -40.372 4.274 -10.356 1.00 63.45 C ATOM 1079 CD1 PHE A 69 -40.891 3.755 -11.530 1.00 13.42 C ATOM 1080 CD2 PHE A 69 -39.937 3.399 -9.373 1.00 71.14 C ATOM 1081 CE1 PHE A 69 -40.978 2.388 -11.720 1.00 31.41 C ATOM 1082 CE2 PHE A 69 -40.018 2.032 -9.559 1.00 42.32 C ATOM 1083 CZ PHE A 69 -40.539 1.526 -10.735 1.00 60.01 C ATOM 0 H PHE A 69 -40.459 8.154 -9.460 1.00 14.42 H new ATOM 0 HA PHE A 69 -42.237 6.308 -10.843 1.00 21.45 H new ATOM 0 HB2 PHE A 69 -39.752 6.193 -11.016 1.00 62.20 H new ATOM 0 HB3 PHE A 69 -39.641 5.953 -9.284 1.00 62.20 H new ATOM 0 HD1 PHE A 69 -41.232 4.425 -12.306 1.00 13.42 H new ATOM 0 HD2 PHE A 69 -39.530 3.790 -8.452 1.00 71.14 H new ATOM 0 HE1 PHE A 69 -41.389 1.995 -12.638 1.00 31.41 H new ATOM 0 HE2 PHE A 69 -39.675 1.360 -8.786 1.00 42.32 H new ATOM 0 HZ PHE A 69 -40.603 0.458 -10.883 1.00 60.01 H new ATOM 1093 N ALA A 70 -41.801 6.200 -7.564 1.00 50.10 N ATOM 1094 CA ALA A 70 -42.347 5.649 -6.330 1.00 24.42 C ATOM 1095 C ALA A 70 -43.719 6.222 -5.999 1.00 62.52 C ATOM 1096 O ALA A 70 -44.432 5.684 -5.156 1.00 33.13 O ATOM 1097 CB ALA A 70 -41.388 5.901 -5.186 1.00 2.42 C ATOM 0 H ALA A 70 -40.985 6.798 -7.432 1.00 50.10 H new ATOM 0 HA ALA A 70 -42.472 4.576 -6.477 1.00 24.42 H new ATOM 0 HB1 ALA A 70 -41.802 5.487 -4.267 1.00 2.42 H new ATOM 0 HB2 ALA A 70 -40.432 5.424 -5.401 1.00 2.42 H new ATOM 0 HB3 ALA A 70 -41.239 6.974 -5.066 1.00 2.42 H new ATOM 1103 N SER A 71 -44.090 7.309 -6.658 1.00 11.32 N ATOM 1104 CA SER A 71 -45.388 7.917 -6.427 1.00 11.43 C ATOM 1105 C SER A 71 -46.484 7.144 -7.156 1.00 2.10 C ATOM 1106 O SER A 71 -47.615 7.062 -6.684 1.00 62.22 O ATOM 1107 CB SER A 71 -45.374 9.381 -6.864 1.00 23.54 C ATOM 1108 OG SER A 71 -44.741 9.528 -8.122 1.00 4.14 O ATOM 0 H SER A 71 -43.514 7.785 -7.352 1.00 11.32 H new ATOM 0 HA SER A 71 -45.602 7.879 -5.359 1.00 11.43 H new ATOM 0 HB2 SER A 71 -46.395 9.757 -6.920 1.00 23.54 H new ATOM 0 HB3 SER A 71 -44.854 9.982 -6.118 1.00 23.54 H new ATOM 0 HG SER A 71 -43.888 9.996 -8.006 1.00 4.14 H new ATOM 1114 N GLN A 72 -46.140 6.566 -8.298 1.00 31.34 N ATOM 1115 CA GLN A 72 -47.094 5.766 -9.050 1.00 12.22 C ATOM 1116 C GLN A 72 -46.991 4.301 -8.630 1.00 23.12 C ATOM 1117 O GLN A 72 -47.928 3.526 -8.798 1.00 21.40 O ATOM 1118 CB GLN A 72 -46.868 5.937 -10.557 1.00 4.12 C ATOM 1119 CG GLN A 72 -45.526 5.426 -11.054 1.00 43.54 C ATOM 1120 CD GLN A 72 -45.234 5.862 -12.475 1.00 21.15 C ATOM 1121 OE1 GLN A 72 -45.625 5.198 -13.434 1.00 32.10 O ATOM 1122 NE2 GLN A 72 -44.539 6.979 -12.623 1.00 25.54 N ATOM 0 H GLN A 72 -45.214 6.635 -8.721 1.00 31.34 H new ATOM 0 HA GLN A 72 -48.104 6.111 -8.829 1.00 12.22 H new ATOM 0 HB2 GLN A 72 -47.662 5.416 -11.092 1.00 4.12 H new ATOM 0 HB3 GLN A 72 -46.955 6.994 -10.807 1.00 4.12 H new ATOM 0 HG2 GLN A 72 -44.736 5.788 -10.396 1.00 43.54 H new ATOM 0 HG3 GLN A 72 -45.512 4.337 -11.000 1.00 43.54 H new ATOM 0 HE21 GLN A 72 -44.233 7.502 -11.802 1.00 25.54 H new ATOM 0 HE22 GLN A 72 -44.310 7.317 -13.558 1.00 25.54 H new ATOM 1131 N LYS A 73 -45.848 3.943 -8.062 1.00 45.21 N ATOM 1132 CA LYS A 73 -45.637 2.610 -7.516 1.00 22.24 C ATOM 1133 C LYS A 73 -46.272 2.495 -6.143 1.00 42.22 C ATOM 1134 O LYS A 73 -45.752 3.045 -5.180 1.00 73.40 O ATOM 1135 CB LYS A 73 -44.138 2.322 -7.404 1.00 2.22 C ATOM 1136 CG LYS A 73 -43.478 1.982 -8.731 1.00 71.22 C ATOM 1137 CD LYS A 73 -44.073 0.728 -9.354 1.00 31.32 C ATOM 1138 CE LYS A 73 -43.736 -0.526 -8.556 1.00 75.21 C ATOM 1139 NZ LYS A 73 -44.333 -1.743 -9.168 1.00 41.23 N ATOM 0 H LYS A 73 -45.045 4.565 -7.967 1.00 45.21 H new ATOM 0 HA LYS A 73 -46.099 1.886 -8.187 1.00 22.24 H new ATOM 0 HB2 LYS A 73 -43.641 3.192 -6.974 1.00 2.22 H new ATOM 0 HB3 LYS A 73 -43.987 1.494 -6.711 1.00 2.22 H new ATOM 0 HG2 LYS A 73 -43.593 2.819 -9.419 1.00 71.22 H new ATOM 0 HG3 LYS A 73 -42.408 1.840 -8.579 1.00 71.22 H new ATOM 0 HD2 LYS A 73 -45.156 0.835 -9.419 1.00 31.32 H new ATOM 0 HD3 LYS A 73 -43.702 0.619 -10.373 1.00 31.32 H new ATOM 0 HE2 LYS A 73 -42.654 -0.641 -8.498 1.00 75.21 H new ATOM 0 HE3 LYS A 73 -44.100 -0.416 -7.534 1.00 75.21 H new ATOM 0 HZ1 LYS A 73 -44.321 -2.520 -8.477 1.00 41.23 H new ATOM 0 HZ2 LYS A 73 -45.314 -1.545 -9.449 1.00 41.23 H new ATOM 0 HZ3 LYS A 73 -43.781 -2.016 -10.006 1.00 41.23 H new ATOM 1153 N SER A 74 -47.391 1.786 -6.050 1.00 20.00 N ATOM 1154 CA SER A 74 -48.068 1.602 -4.771 1.00 4.44 C ATOM 1155 C SER A 74 -47.129 0.942 -3.763 1.00 74.23 C ATOM 1156 O SER A 74 -47.134 1.278 -2.578 1.00 30.43 O ATOM 1157 CB SER A 74 -49.335 0.758 -4.949 1.00 71.12 C ATOM 1158 OG SER A 74 -50.049 0.633 -3.728 1.00 24.42 O ATOM 0 H SER A 74 -47.847 1.331 -6.841 1.00 20.00 H new ATOM 0 HA SER A 74 -48.356 2.582 -4.390 1.00 4.44 H new ATOM 0 HB2 SER A 74 -49.976 1.216 -5.702 1.00 71.12 H new ATOM 0 HB3 SER A 74 -49.066 -0.232 -5.318 1.00 71.12 H new ATOM 0 HG SER A 74 -50.853 0.091 -3.873 1.00 24.42 H new ATOM 1164 N SER A 75 -46.318 0.007 -4.245 1.00 4.02 N ATOM 1165 CA SER A 75 -45.351 -0.686 -3.404 1.00 40.14 C ATOM 1166 C SER A 75 -44.377 0.299 -2.757 1.00 3.32 C ATOM 1167 O SER A 75 -44.205 0.314 -1.539 1.00 61.54 O ATOM 1168 CB SER A 75 -44.579 -1.700 -4.241 1.00 21.45 C ATOM 1169 OG SER A 75 -45.461 -2.541 -4.965 1.00 11.23 O ATOM 0 H SER A 75 -46.312 -0.290 -5.221 1.00 4.02 H new ATOM 0 HA SER A 75 -45.893 -1.200 -2.610 1.00 40.14 H new ATOM 0 HB2 SER A 75 -43.919 -1.177 -4.934 1.00 21.45 H new ATOM 0 HB3 SER A 75 -43.945 -2.305 -3.592 1.00 21.45 H new ATOM 0 HG SER A 75 -44.941 -3.181 -5.495 1.00 11.23 H new ATOM 1175 N MET A 76 -43.761 1.141 -3.580 1.00 42.00 N ATOM 1176 CA MET A 76 -42.745 2.069 -3.099 1.00 50.55 C ATOM 1177 C MET A 76 -43.382 3.297 -2.459 1.00 5.04 C ATOM 1178 O MET A 76 -42.727 4.029 -1.714 1.00 44.11 O ATOM 1179 CB MET A 76 -41.813 2.476 -4.237 1.00 61.31 C ATOM 1180 CG MET A 76 -40.930 1.340 -4.726 1.00 43.31 C ATOM 1181 SD MET A 76 -39.648 1.891 -5.868 1.00 72.50 S ATOM 1182 CE MET A 76 -38.619 2.862 -4.767 1.00 14.01 C ATOM 0 H MET A 76 -43.947 1.200 -4.581 1.00 42.00 H new ATOM 0 HA MET A 76 -42.157 1.561 -2.334 1.00 50.55 H new ATOM 0 HB2 MET A 76 -42.409 2.848 -5.070 1.00 61.31 H new ATOM 0 HB3 MET A 76 -41.182 3.300 -3.904 1.00 61.31 H new ATOM 0 HG2 MET A 76 -40.462 0.855 -3.869 1.00 43.31 H new ATOM 0 HG3 MET A 76 -41.550 0.590 -5.218 1.00 43.31 H new ATOM 0 HE1 MET A 76 -37.579 2.556 -4.877 1.00 14.01 H new ATOM 0 HE2 MET A 76 -38.715 3.919 -5.017 1.00 14.01 H new ATOM 0 HE3 MET A 76 -38.937 2.702 -3.737 1.00 14.01 H new ATOM 1192 N LYS A 77 -44.661 3.509 -2.740 1.00 75.15 N ATOM 1193 CA LYS A 77 -45.421 4.586 -2.115 1.00 60.15 C ATOM 1194 C LYS A 77 -45.498 4.369 -0.612 1.00 42.31 C ATOM 1195 O LYS A 77 -45.633 5.311 0.150 1.00 44.24 O ATOM 1196 CB LYS A 77 -46.836 4.659 -2.705 1.00 12.43 C ATOM 1197 CG LYS A 77 -47.721 5.720 -2.062 1.00 11.43 C ATOM 1198 CD LYS A 77 -49.139 5.680 -2.611 1.00 25.43 C ATOM 1199 CE LYS A 77 -49.179 6.059 -4.082 1.00 43.14 C ATOM 1200 NZ LYS A 77 -48.798 7.480 -4.300 1.00 24.12 N ATOM 0 H LYS A 77 -45.197 2.946 -3.400 1.00 75.15 H new ATOM 0 HA LYS A 77 -44.910 5.528 -2.314 1.00 60.15 H new ATOM 0 HB2 LYS A 77 -46.763 4.860 -3.774 1.00 12.43 H new ATOM 0 HB3 LYS A 77 -47.315 3.686 -2.596 1.00 12.43 H new ATOM 0 HG2 LYS A 77 -47.744 5.569 -0.983 1.00 11.43 H new ATOM 0 HG3 LYS A 77 -47.291 6.706 -2.236 1.00 11.43 H new ATOM 0 HD2 LYS A 77 -49.552 4.680 -2.481 1.00 25.43 H new ATOM 0 HD3 LYS A 77 -49.770 6.362 -2.041 1.00 25.43 H new ATOM 0 HE2 LYS A 77 -48.503 5.412 -4.642 1.00 43.14 H new ATOM 0 HE3 LYS A 77 -50.182 5.888 -4.474 1.00 43.14 H new ATOM 0 HZ1 LYS A 77 -49.628 8.016 -4.625 1.00 24.12 H new ATOM 0 HZ2 LYS A 77 -48.451 7.887 -3.408 1.00 24.12 H new ATOM 0 HZ3 LYS A 77 -48.049 7.532 -5.019 1.00 24.12 H new ATOM 1214 N GLU A 78 -45.365 3.122 -0.198 1.00 73.50 N ATOM 1215 CA GLU A 78 -45.478 2.767 1.207 1.00 54.32 C ATOM 1216 C GLU A 78 -44.117 2.784 1.858 1.00 31.53 C ATOM 1217 O GLU A 78 -43.990 2.677 3.079 1.00 34.12 O ATOM 1218 CB GLU A 78 -46.114 1.394 1.342 1.00 14.02 C ATOM 1219 CG GLU A 78 -47.616 1.436 1.213 1.00 14.43 C ATOM 1220 CD GLU A 78 -48.285 1.702 2.542 1.00 15.11 C ATOM 1221 OE1 GLU A 78 -48.102 0.889 3.470 1.00 22.10 O ATOM 1222 OE2 GLU A 78 -48.978 2.733 2.678 1.00 50.44 O ATOM 0 H GLU A 78 -45.178 2.334 -0.818 1.00 73.50 H new ATOM 0 HA GLU A 78 -46.111 3.498 1.710 1.00 54.32 H new ATOM 0 HB2 GLU A 78 -45.706 0.732 0.579 1.00 14.02 H new ATOM 0 HB3 GLU A 78 -45.848 0.968 2.309 1.00 14.02 H new ATOM 0 HG2 GLU A 78 -47.898 2.212 0.502 1.00 14.43 H new ATOM 0 HG3 GLU A 78 -47.973 0.489 0.809 1.00 14.43 H new ATOM 1229 N LEU A 79 -43.107 2.917 1.025 1.00 24.33 N ATOM 1230 CA LEU A 79 -41.741 2.983 1.482 1.00 42.30 C ATOM 1231 C LEU A 79 -41.308 4.433 1.616 1.00 43.34 C ATOM 1232 O LEU A 79 -40.806 4.854 2.655 1.00 15.42 O ATOM 1233 CB LEU A 79 -40.824 2.261 0.494 1.00 51.22 C ATOM 1234 CG LEU A 79 -41.107 0.772 0.293 1.00 0.34 C ATOM 1235 CD1 LEU A 79 -40.086 0.166 -0.656 1.00 11.20 C ATOM 1236 CD2 LEU A 79 -41.093 0.037 1.625 1.00 21.32 C ATOM 0 H LEU A 79 -43.213 2.982 0.013 1.00 24.33 H new ATOM 0 HA LEU A 79 -41.671 2.497 2.455 1.00 42.30 H new ATOM 0 HB2 LEU A 79 -40.897 2.760 -0.472 1.00 51.22 H new ATOM 0 HB3 LEU A 79 -39.794 2.374 0.833 1.00 51.22 H new ATOM 0 HG LEU A 79 -42.099 0.666 -0.145 1.00 0.34 H new ATOM 0 HD11 LEU A 79 -40.299 -0.895 -0.791 1.00 11.20 H new ATOM 0 HD12 LEU A 79 -40.140 0.672 -1.620 1.00 11.20 H new ATOM 0 HD13 LEU A 79 -39.086 0.285 -0.239 1.00 11.20 H new ATOM 0 HD21 LEU A 79 -41.297 -1.021 1.459 1.00 21.32 H new ATOM 0 HD22 LEU A 79 -40.115 0.149 2.092 1.00 21.32 H new ATOM 0 HD23 LEU A 79 -41.858 0.455 2.279 1.00 21.32 H new ATOM 1248 N LEU A 80 -41.529 5.204 0.562 1.00 42.21 N ATOM 1249 CA LEU A 80 -41.012 6.558 0.506 1.00 3.13 C ATOM 1250 C LEU A 80 -42.004 7.570 1.067 1.00 62.44 C ATOM 1251 O LEU A 80 -41.680 8.749 1.187 1.00 5.20 O ATOM 1252 CB LEU A 80 -40.651 6.941 -0.930 1.00 44.10 C ATOM 1253 CG LEU A 80 -39.837 5.913 -1.727 1.00 53.15 C ATOM 1254 CD1 LEU A 80 -39.139 6.597 -2.879 1.00 41.21 C ATOM 1255 CD2 LEU A 80 -38.824 5.184 -0.853 1.00 62.14 C ATOM 0 H LEU A 80 -42.060 4.916 -0.260 1.00 42.21 H new ATOM 0 HA LEU A 80 -40.115 6.580 1.125 1.00 3.13 H new ATOM 0 HB2 LEU A 80 -41.575 7.140 -1.473 1.00 44.10 H new ATOM 0 HB3 LEU A 80 -40.089 7.875 -0.903 1.00 44.10 H new ATOM 0 HG LEU A 80 -40.530 5.164 -2.111 1.00 53.15 H new ATOM 0 HD11 LEU A 80 -38.562 5.863 -3.442 1.00 41.21 H new ATOM 0 HD12 LEU A 80 -39.881 7.055 -3.533 1.00 41.21 H new ATOM 0 HD13 LEU A 80 -38.470 7.366 -2.494 1.00 41.21 H new ATOM 0 HD21 LEU A 80 -38.271 4.466 -1.459 1.00 62.14 H new ATOM 0 HD22 LEU A 80 -38.130 5.905 -0.421 1.00 62.14 H new ATOM 0 HD23 LEU A 80 -39.345 4.658 -0.053 1.00 62.14 H new ATOM 1267 N LYS A 81 -43.209 7.118 1.412 1.00 41.34 N ATOM 1268 CA LYS A 81 -44.229 8.016 1.969 1.00 32.52 C ATOM 1269 C LYS A 81 -43.753 8.711 3.247 1.00 74.01 C ATOM 1270 O LYS A 81 -44.309 9.729 3.647 1.00 22.52 O ATOM 1271 CB LYS A 81 -45.530 7.263 2.261 1.00 75.21 C ATOM 1272 CG LYS A 81 -45.407 6.164 3.303 1.00 61.20 C ATOM 1273 CD LYS A 81 -46.761 5.534 3.582 1.00 12.12 C ATOM 1274 CE LYS A 81 -46.678 4.506 4.692 1.00 64.24 C ATOM 1275 NZ LYS A 81 -48.015 3.955 5.043 1.00 52.42 N ATOM 0 H LYS A 81 -43.504 6.146 1.318 1.00 41.34 H new ATOM 0 HA LYS A 81 -44.412 8.777 1.211 1.00 32.52 H new ATOM 0 HB2 LYS A 81 -46.281 7.979 2.595 1.00 75.21 H new ATOM 0 HB3 LYS A 81 -45.897 6.825 1.333 1.00 75.21 H new ATOM 0 HG2 LYS A 81 -44.711 5.402 2.954 1.00 61.20 H new ATOM 0 HG3 LYS A 81 -44.995 6.574 4.225 1.00 61.20 H new ATOM 0 HD2 LYS A 81 -47.475 6.311 3.857 1.00 12.12 H new ATOM 0 HD3 LYS A 81 -47.137 5.062 2.675 1.00 12.12 H new ATOM 0 HE2 LYS A 81 -46.020 3.693 4.385 1.00 64.24 H new ATOM 0 HE3 LYS A 81 -46.230 4.962 5.575 1.00 64.24 H new ATOM 0 HZ1 LYS A 81 -47.902 3.174 5.720 1.00 52.42 H new ATOM 0 HZ2 LYS A 81 -48.597 4.703 5.472 1.00 52.42 H new ATOM 0 HZ3 LYS A 81 -48.482 3.603 4.183 1.00 52.42 H new ATOM 1289 N ASP A 82 -42.726 8.163 3.883 1.00 73.03 N ATOM 1290 CA ASP A 82 -42.226 8.729 5.130 1.00 54.13 C ATOM 1291 C ASP A 82 -41.389 9.981 4.863 1.00 10.15 C ATOM 1292 O ASP A 82 -41.346 10.898 5.685 1.00 31.10 O ATOM 1293 CB ASP A 82 -41.400 7.692 5.891 1.00 73.30 C ATOM 1294 CG ASP A 82 -41.140 8.103 7.329 1.00 72.21 C ATOM 1295 OD1 ASP A 82 -40.129 8.787 7.589 1.00 44.51 O ATOM 1296 OD2 ASP A 82 -41.952 7.739 8.207 1.00 72.40 O ATOM 0 H ASP A 82 -42.226 7.335 3.560 1.00 73.03 H new ATOM 0 HA ASP A 82 -43.082 9.014 5.742 1.00 54.13 H new ATOM 0 HB2 ASP A 82 -41.922 6.735 5.878 1.00 73.30 H new ATOM 0 HB3 ASP A 82 -40.448 7.543 5.381 1.00 73.30 H new ATOM 1301 N VAL A 83 -40.748 10.026 3.701 1.00 62.31 N ATOM 1302 CA VAL A 83 -39.891 11.155 3.349 1.00 52.42 C ATOM 1303 C VAL A 83 -40.521 12.026 2.263 1.00 3.44 C ATOM 1304 O VAL A 83 -40.244 13.221 2.182 1.00 61.03 O ATOM 1305 CB VAL A 83 -38.487 10.697 2.890 1.00 61.32 C ATOM 1306 CG1 VAL A 83 -37.750 10.011 4.029 1.00 34.12 C ATOM 1307 CG2 VAL A 83 -38.575 9.772 1.680 1.00 43.10 C ATOM 0 H VAL A 83 -40.804 9.298 2.989 1.00 62.31 H new ATOM 0 HA VAL A 83 -39.783 11.747 4.258 1.00 52.42 H new ATOM 0 HB VAL A 83 -37.927 11.584 2.595 1.00 61.32 H new ATOM 0 HG11 VAL A 83 -36.764 9.696 3.687 1.00 34.12 H new ATOM 0 HG12 VAL A 83 -37.640 10.706 4.862 1.00 34.12 H new ATOM 0 HG13 VAL A 83 -38.316 9.139 4.356 1.00 34.12 H new ATOM 0 HG21 VAL A 83 -37.572 9.467 1.381 1.00 43.10 H new ATOM 0 HG22 VAL A 83 -39.160 8.890 1.938 1.00 43.10 H new ATOM 0 HG23 VAL A 83 -39.056 10.297 0.855 1.00 43.10 H new ATOM 1317 N LEU A 84 -41.365 11.426 1.434 1.00 53.30 N ATOM 1318 CA LEU A 84 -42.028 12.150 0.355 1.00 43.31 C ATOM 1319 C LEU A 84 -43.481 12.424 0.714 1.00 24.31 C ATOM 1320 O LEU A 84 -44.141 11.579 1.318 1.00 63.44 O ATOM 1321 CB LEU A 84 -41.967 11.346 -0.946 1.00 31.41 C ATOM 1322 CG LEU A 84 -40.560 11.054 -1.473 1.00 63.43 C ATOM 1323 CD1 LEU A 84 -40.628 10.216 -2.739 1.00 65.11 C ATOM 1324 CD2 LEU A 84 -39.802 12.350 -1.732 1.00 3.03 C ATOM 0 H LEU A 84 -41.608 10.437 1.488 1.00 53.30 H new ATOM 0 HA LEU A 84 -41.509 13.098 0.213 1.00 43.31 H new ATOM 0 HB2 LEU A 84 -42.483 10.398 -0.792 1.00 31.41 H new ATOM 0 HB3 LEU A 84 -42.519 11.888 -1.714 1.00 31.41 H new ATOM 0 HG LEU A 84 -40.022 10.488 -0.713 1.00 63.43 H new ATOM 0 HD11 LEU A 84 -39.618 10.018 -3.099 1.00 65.11 H new ATOM 0 HD12 LEU A 84 -41.128 9.272 -2.524 1.00 65.11 H new ATOM 0 HD13 LEU A 84 -41.187 10.756 -3.503 1.00 65.11 H new ATOM 0 HD21 LEU A 84 -38.804 12.120 -2.106 1.00 3.03 H new ATOM 0 HD22 LEU A 84 -40.339 12.944 -2.472 1.00 3.03 H new ATOM 0 HD23 LEU A 84 -39.720 12.915 -0.804 1.00 3.03 H new ATOM 1838 N PHE B 131 -31.178 6.198 -1.012 1.00 34.54 N ATOM 1839 CA PHE B 131 -31.496 4.758 -0.915 1.00 42.24 C ATOM 1840 C PHE B 131 -31.672 4.253 0.522 1.00 22.31 C ATOM 1841 O PHE B 131 -31.594 3.051 0.767 1.00 72.13 O ATOM 1842 CB PHE B 131 -30.462 3.887 -1.665 1.00 14.34 C ATOM 1843 CG PHE B 131 -29.044 3.938 -1.150 1.00 44.20 C ATOM 1844 CD1 PHE B 131 -28.679 3.272 0.014 1.00 22.11 C ATOM 1845 CD2 PHE B 131 -28.073 4.640 -1.842 1.00 13.34 C ATOM 1846 CE1 PHE B 131 -27.377 3.312 0.474 1.00 44.13 C ATOM 1847 CE2 PHE B 131 -26.770 4.682 -1.388 1.00 52.31 C ATOM 1848 CZ PHE B 131 -26.421 4.019 -0.227 1.00 74.34 C ATOM 0 HA PHE B 131 -32.466 4.655 -1.402 1.00 42.24 H new ATOM 0 HB2 PHE B 131 -30.800 2.851 -1.633 1.00 14.34 H new ATOM 0 HB3 PHE B 131 -30.456 4.189 -2.712 1.00 14.34 H new ATOM 0 HD1 PHE B 131 -29.423 2.716 0.566 1.00 22.11 H new ATOM 0 HD2 PHE B 131 -28.338 5.162 -2.750 1.00 13.34 H new ATOM 0 HE1 PHE B 131 -27.108 2.791 1.381 1.00 44.13 H new ATOM 0 HE2 PHE B 131 -26.023 5.233 -1.940 1.00 52.31 H new ATOM 0 HZ PHE B 131 -25.403 4.054 0.131 1.00 74.34 H new ATOM 1858 N ASN B 132 -31.971 5.151 1.451 1.00 31.33 N ATOM 1859 CA ASN B 132 -32.081 4.783 2.862 1.00 2.22 C ATOM 1860 C ASN B 132 -33.165 3.728 3.072 1.00 40.41 C ATOM 1861 O ASN B 132 -32.899 2.651 3.604 1.00 72.13 O ATOM 1862 CB ASN B 132 -32.381 6.014 3.718 1.00 31.15 C ATOM 1863 CG ASN B 132 -32.423 5.691 5.201 1.00 43.14 C ATOM 1864 OD1 ASN B 132 -31.708 4.811 5.681 1.00 64.24 O ATOM 1865 ND2 ASN B 132 -33.264 6.398 5.934 1.00 23.04 N ATOM 0 H ASN B 132 -32.142 6.138 1.257 1.00 31.33 H new ATOM 0 HA ASN B 132 -31.124 4.362 3.170 1.00 2.22 H new ATOM 0 HB2 ASN B 132 -31.621 6.774 3.536 1.00 31.15 H new ATOM 0 HB3 ASN B 132 -33.337 6.440 3.414 1.00 31.15 H new ATOM 0 HD21 ASN B 132 -33.338 6.223 6.936 1.00 23.04 H new ATOM 0 HD22 ASN B 132 -33.839 7.119 5.498 1.00 23.04 H new ATOM 1872 N ILE B 133 -34.376 4.032 2.619 1.00 50.00 N ATOM 1873 CA ILE B 133 -35.511 3.122 2.773 1.00 4.14 C ATOM 1874 C ILE B 133 -35.224 1.780 2.103 1.00 23.12 C ATOM 1875 O ILE B 133 -35.582 0.716 2.613 1.00 70.44 O ATOM 1876 CB ILE B 133 -36.790 3.724 2.154 1.00 73.32 C ATOM 1877 CG1 ILE B 133 -37.042 5.138 2.696 1.00 72.21 C ATOM 1878 CG2 ILE B 133 -37.985 2.828 2.433 1.00 40.12 C ATOM 1879 CD1 ILE B 133 -37.241 5.197 4.199 1.00 2.33 C ATOM 0 H ILE B 133 -34.600 4.904 2.140 1.00 50.00 H new ATOM 0 HA ILE B 133 -35.664 2.971 3.842 1.00 4.14 H new ATOM 0 HB ILE B 133 -36.650 3.792 1.075 1.00 73.32 H new ATOM 0 HG12 ILE B 133 -36.199 5.775 2.426 1.00 72.21 H new ATOM 0 HG13 ILE B 133 -37.924 5.552 2.207 1.00 72.21 H new ATOM 0 HG21 ILE B 133 -38.879 3.266 1.990 1.00 40.12 H new ATOM 0 HG22 ILE B 133 -37.810 1.843 2.000 1.00 40.12 H new ATOM 0 HG23 ILE B 133 -38.124 2.731 3.510 1.00 40.12 H new ATOM 0 HD11 ILE B 133 -37.413 6.229 4.503 1.00 2.33 H new ATOM 0 HD12 ILE B 133 -38.102 4.589 4.476 1.00 2.33 H new ATOM 0 HD13 ILE B 133 -36.351 4.815 4.699 1.00 2.33 H new ATOM 1891 N LEU B 134 -34.563 1.849 0.959 1.00 74.21 N ATOM 1892 CA LEU B 134 -34.213 0.663 0.191 1.00 70.04 C ATOM 1893 C LEU B 134 -33.206 -0.198 0.941 1.00 64.12 C ATOM 1894 O LEU B 134 -33.231 -1.422 0.848 1.00 3.50 O ATOM 1895 CB LEU B 134 -33.636 1.066 -1.165 1.00 64.14 C ATOM 1896 CG LEU B 134 -34.662 1.470 -2.227 1.00 44.32 C ATOM 1897 CD1 LEU B 134 -35.479 2.673 -1.804 1.00 3.24 C ATOM 1898 CD2 LEU B 134 -33.961 1.756 -3.537 1.00 43.31 C ATOM 0 H LEU B 134 -34.254 2.725 0.537 1.00 74.21 H new ATOM 0 HA LEU B 134 -35.121 0.080 0.040 1.00 70.04 H new ATOM 0 HB2 LEU B 134 -32.949 1.899 -1.014 1.00 64.14 H new ATOM 0 HB3 LEU B 134 -33.048 0.233 -1.552 1.00 64.14 H new ATOM 0 HG LEU B 134 -35.351 0.635 -2.351 1.00 44.32 H new ATOM 0 HD11 LEU B 134 -36.193 2.922 -2.589 1.00 3.24 H new ATOM 0 HD12 LEU B 134 -36.017 2.442 -0.884 1.00 3.24 H new ATOM 0 HD13 LEU B 134 -34.816 3.521 -1.634 1.00 3.24 H new ATOM 0 HD21 LEU B 134 -34.697 2.043 -4.288 1.00 43.31 H new ATOM 0 HD22 LEU B 134 -33.248 2.569 -3.398 1.00 43.31 H new ATOM 0 HD23 LEU B 134 -33.432 0.863 -3.869 1.00 43.31 H new ATOM 1910 N ARG B 135 -32.322 0.452 1.678 1.00 13.11 N ATOM 1911 CA ARG B 135 -31.327 -0.244 2.482 1.00 32.31 C ATOM 1912 C ARG B 135 -32.006 -0.996 3.624 1.00 65.12 C ATOM 1913 O ARG B 135 -31.656 -2.137 3.932 1.00 44.44 O ATOM 1914 CB ARG B 135 -30.310 0.769 3.023 1.00 4.34 C ATOM 1915 CG ARG B 135 -29.278 0.189 3.978 1.00 72.12 C ATOM 1916 CD ARG B 135 -28.275 1.249 4.402 1.00 62.03 C ATOM 1917 NE ARG B 135 -27.350 0.760 5.422 1.00 4.41 N ATOM 1918 CZ ARG B 135 -26.337 1.468 5.922 1.00 41.35 C ATOM 1919 NH1 ARG B 135 -26.058 2.679 5.452 1.00 41.55 N ATOM 1920 NH2 ARG B 135 -25.591 0.950 6.886 1.00 62.02 N ATOM 0 H ARG B 135 -32.272 1.469 1.737 1.00 13.11 H new ATOM 0 HA ARG B 135 -30.803 -0.972 1.863 1.00 32.31 H new ATOM 0 HB2 ARG B 135 -29.789 1.225 2.181 1.00 4.34 H new ATOM 0 HB3 ARG B 135 -30.849 1.567 3.534 1.00 4.34 H new ATOM 0 HG2 ARG B 135 -29.778 -0.217 4.857 1.00 72.12 H new ATOM 0 HG3 ARG B 135 -28.757 -0.639 3.497 1.00 72.12 H new ATOM 0 HD2 ARG B 135 -27.710 1.580 3.531 1.00 62.03 H new ATOM 0 HD3 ARG B 135 -28.809 2.119 4.785 1.00 62.03 H new ATOM 0 HE ARG B 135 -27.489 -0.187 5.775 1.00 4.41 H new ATOM 0 HH11 ARG B 135 -26.621 3.077 4.700 1.00 41.55 H new ATOM 0 HH12 ARG B 135 -25.280 3.211 5.843 1.00 41.55 H new ATOM 0 HH21 ARG B 135 -25.793 0.015 7.241 1.00 62.02 H new ATOM 0 HH22 ARG B 135 -24.814 1.486 7.273 1.00 62.02 H new ATOM 1934 N GLU B 136 -33.001 -0.361 4.223 1.00 60.11 N ATOM 1935 CA GLU B 136 -33.721 -0.947 5.344 1.00 55.33 C ATOM 1936 C GLU B 136 -34.565 -2.138 4.893 1.00 1.02 C ATOM 1937 O GLU B 136 -34.588 -3.175 5.551 1.00 11.45 O ATOM 1938 CB GLU B 136 -34.605 0.109 6.010 1.00 2.02 C ATOM 1939 CG GLU B 136 -33.849 1.380 6.353 1.00 23.24 C ATOM 1940 CD GLU B 136 -34.638 2.328 7.229 1.00 52.34 C ATOM 1941 OE1 GLU B 136 -35.427 3.129 6.693 1.00 30.33 O ATOM 1942 OE2 GLU B 136 -34.453 2.284 8.467 1.00 74.12 O ATOM 0 H GLU B 136 -33.330 0.565 3.950 1.00 60.11 H new ATOM 0 HA GLU B 136 -32.990 -1.307 6.068 1.00 55.33 H new ATOM 0 HB2 GLU B 136 -35.434 0.353 5.346 1.00 2.02 H new ATOM 0 HB3 GLU B 136 -35.037 -0.307 6.920 1.00 2.02 H new ATOM 0 HG2 GLU B 136 -32.920 1.117 6.859 1.00 23.24 H new ATOM 0 HG3 GLU B 136 -33.575 1.892 5.430 1.00 23.24 H new ATOM 1949 N ASN B 137 -35.235 -1.988 3.758 1.00 34.22 N ATOM 1950 CA ASN B 137 -36.113 -3.038 3.236 1.00 52.55 C ATOM 1951 C ASN B 137 -35.339 -4.035 2.376 1.00 42.15 C ATOM 1952 O ASN B 137 -35.916 -4.979 1.837 1.00 42.24 O ATOM 1953 CB ASN B 137 -37.253 -2.422 2.419 1.00 33.31 C ATOM 1954 CG ASN B 137 -38.263 -1.687 3.280 1.00 12.24 C ATOM 1955 OD1 ASN B 137 -39.260 -2.262 3.714 1.00 34.33 O ATOM 1956 ND2 ASN B 137 -38.016 -0.411 3.535 1.00 72.13 N ATOM 0 H ASN B 137 -35.190 -1.150 3.178 1.00 34.22 H new ATOM 0 HA ASN B 137 -36.530 -3.575 4.088 1.00 52.55 H new ATOM 0 HB2 ASN B 137 -36.836 -1.731 1.686 1.00 33.31 H new ATOM 0 HB3 ASN B 137 -37.761 -3.209 1.862 1.00 33.31 H new ATOM 0 HD21 ASN B 137 -38.664 0.129 4.109 1.00 72.13 H new ATOM 0 HD22 ASN B 137 -37.178 0.032 3.157 1.00 72.13 H new ATOM 1963 N ASP B 138 -34.032 -3.811 2.264 1.00 25.40 N ATOM 1964 CA ASP B 138 -33.138 -4.652 1.462 1.00 21.43 C ATOM 1965 C ASP B 138 -33.638 -4.793 0.025 1.00 44.20 C ATOM 1966 O ASP B 138 -34.078 -5.862 -0.406 1.00 42.31 O ATOM 1967 CB ASP B 138 -32.930 -6.032 2.101 1.00 30.51 C ATOM 1968 CG ASP B 138 -31.889 -6.864 1.367 1.00 32.04 C ATOM 1969 OD1 ASP B 138 -30.705 -6.466 1.345 1.00 54.45 O ATOM 1970 OD2 ASP B 138 -32.245 -7.927 0.817 1.00 62.13 O ATOM 0 H ASP B 138 -33.558 -3.037 2.729 1.00 25.40 H new ATOM 0 HA ASP B 138 -32.172 -4.148 1.434 1.00 21.43 H new ATOM 0 HB2 ASP B 138 -32.623 -5.905 3.139 1.00 30.51 H new ATOM 0 HB3 ASP B 138 -33.878 -6.570 2.112 1.00 30.51 H new ATOM 1975 N PHE B 139 -33.611 -3.683 -0.694 1.00 73.50 N ATOM 1976 CA PHE B 139 -33.879 -3.686 -2.126 1.00 65.54 C ATOM 1977 C PHE B 139 -32.580 -3.880 -2.894 1.00 33.43 C ATOM 1978 O PHE B 139 -32.574 -3.957 -4.122 1.00 64.31 O ATOM 1979 CB PHE B 139 -34.559 -2.376 -2.539 1.00 55.44 C ATOM 1980 CG PHE B 139 -36.056 -2.411 -2.427 1.00 50.02 C ATOM 1981 CD1 PHE B 139 -36.675 -3.131 -1.418 1.00 22.21 C ATOM 1982 CD2 PHE B 139 -36.843 -1.724 -3.335 1.00 14.14 C ATOM 1983 CE1 PHE B 139 -38.050 -3.168 -1.321 1.00 51.51 C ATOM 1984 CE2 PHE B 139 -38.218 -1.755 -3.242 1.00 23.41 C ATOM 1985 CZ PHE B 139 -38.822 -2.479 -2.234 1.00 22.43 C ATOM 0 H PHE B 139 -33.405 -2.762 -0.308 1.00 73.50 H new ATOM 0 HA PHE B 139 -34.551 -4.511 -2.362 1.00 65.54 H new ATOM 0 HB2 PHE B 139 -34.176 -1.567 -1.918 1.00 55.44 H new ATOM 0 HB3 PHE B 139 -34.286 -2.144 -3.568 1.00 55.44 H new ATOM 0 HD1 PHE B 139 -36.074 -3.669 -0.700 1.00 22.21 H new ATOM 0 HD2 PHE B 139 -36.374 -1.157 -4.126 1.00 14.14 H new ATOM 0 HE1 PHE B 139 -38.522 -3.735 -0.532 1.00 51.51 H new ATOM 0 HE2 PHE B 139 -38.821 -1.214 -3.956 1.00 23.41 H new ATOM 0 HZ PHE B 139 -39.899 -2.506 -2.160 1.00 22.43 H new ATOM 1995 N GLU B 140 -31.490 -3.976 -2.135 1.00 30.12 N ATOM 1996 CA GLU B 140 -30.138 -4.080 -2.674 1.00 41.04 C ATOM 1997 C GLU B 140 -29.819 -2.891 -3.579 1.00 42.11 C ATOM 1998 O GLU B 140 -29.666 -3.038 -4.795 1.00 4.11 O ATOM 1999 CB GLU B 140 -29.931 -5.390 -3.433 1.00 44.10 C ATOM 2000 CG GLU B 140 -28.465 -5.714 -3.653 1.00 3.34 C ATOM 2001 CD GLU B 140 -28.248 -6.772 -4.707 1.00 23.24 C ATOM 2002 OE1 GLU B 140 -28.784 -7.890 -4.557 1.00 32.00 O ATOM 2003 OE2 GLU B 140 -27.537 -6.485 -5.695 1.00 3.51 O ATOM 0 H GLU B 140 -31.523 -3.984 -1.116 1.00 30.12 H new ATOM 0 HA GLU B 140 -29.452 -4.071 -1.827 1.00 41.04 H new ATOM 0 HB2 GLU B 140 -30.400 -6.204 -2.880 1.00 44.10 H new ATOM 0 HB3 GLU B 140 -30.434 -5.329 -4.398 1.00 44.10 H new ATOM 0 HG2 GLU B 140 -27.937 -4.806 -3.943 1.00 3.34 H new ATOM 0 HG3 GLU B 140 -28.028 -6.050 -2.713 1.00 3.34 H new ATOM 2010 N PRO B 141 -29.722 -1.686 -2.996 1.00 64.05 N ATOM 2011 CA PRO B 141 -29.405 -0.480 -3.751 1.00 2.33 C ATOM 2012 C PRO B 141 -27.930 -0.435 -4.128 1.00 4.43 C ATOM 2013 O PRO B 141 -27.108 -1.136 -3.534 1.00 40.42 O ATOM 2014 CB PRO B 141 -29.754 0.645 -2.780 1.00 3.51 C ATOM 2015 CG PRO B 141 -29.562 0.051 -1.427 1.00 74.43 C ATOM 2016 CD PRO B 141 -29.896 -1.410 -1.556 1.00 24.13 C ATOM 0 HA PRO B 141 -29.948 -0.417 -4.694 1.00 2.33 H new ATOM 0 HB2 PRO B 141 -29.108 1.510 -2.928 1.00 3.51 H new ATOM 0 HB3 PRO B 141 -30.780 0.986 -2.921 1.00 3.51 H new ATOM 0 HG2 PRO B 141 -28.536 0.187 -1.085 1.00 74.43 H new ATOM 0 HG3 PRO B 141 -30.209 0.535 -0.695 1.00 74.43 H new ATOM 0 HD2 PRO B 141 -29.234 -2.027 -0.948 1.00 24.13 H new ATOM 0 HD3 PRO B 141 -30.915 -1.618 -1.229 1.00 24.13 H new ATOM 2024 N LYS B 142 -27.591 0.378 -5.114 1.00 31.50 N ATOM 2025 CA LYS B 142 -26.208 0.472 -5.548 1.00 51.54 C ATOM 2026 C LYS B 142 -25.532 1.671 -4.898 1.00 55.13 C ATOM 2027 O LYS B 142 -26.162 2.411 -4.146 1.00 74.33 O ATOM 2028 CB LYS B 142 -26.106 0.554 -7.075 1.00 42.51 C ATOM 2029 CG LYS B 142 -25.276 -0.564 -7.700 1.00 74.31 C ATOM 2030 CD LYS B 142 -26.066 -1.862 -7.855 1.00 12.41 C ATOM 2031 CE LYS B 142 -26.362 -2.544 -6.526 1.00 35.33 C ATOM 2032 NZ LYS B 142 -27.250 -3.725 -6.698 1.00 72.32 N ATOM 0 H LYS B 142 -28.244 0.974 -5.623 1.00 31.50 H new ATOM 0 HA LYS B 142 -25.692 -0.435 -5.232 1.00 51.54 H new ATOM 0 HB2 LYS B 142 -27.110 0.528 -7.498 1.00 42.51 H new ATOM 0 HB3 LYS B 142 -25.669 1.514 -7.349 1.00 42.51 H new ATOM 0 HG2 LYS B 142 -24.916 -0.242 -8.677 1.00 74.31 H new ATOM 0 HG3 LYS B 142 -24.397 -0.749 -7.082 1.00 74.31 H new ATOM 0 HD2 LYS B 142 -27.006 -1.650 -8.365 1.00 12.41 H new ATOM 0 HD3 LYS B 142 -25.506 -2.547 -8.491 1.00 12.41 H new ATOM 0 HE2 LYS B 142 -25.427 -2.857 -6.062 1.00 35.33 H new ATOM 0 HE3 LYS B 142 -26.832 -1.831 -5.848 1.00 35.33 H new ATOM 0 HZ1 LYS B 142 -27.187 -4.332 -5.856 1.00 72.32 H new ATOM 0 HZ2 LYS B 142 -28.232 -3.406 -6.822 1.00 72.32 H new ATOM 0 HZ3 LYS B 142 -26.952 -4.264 -7.536 1.00 72.32 H new ATOM 2127 N LYS B 148 -16.164 11.873 -8.762 1.00 34.02 N ATOM 2128 CA LYS B 148 -15.142 12.849 -9.079 1.00 64.32 C ATOM 2129 C LYS B 148 -14.267 13.067 -7.869 1.00 44.43 C ATOM 2130 O LYS B 148 -14.719 13.561 -6.834 1.00 71.24 O ATOM 2131 CB LYS B 148 -15.710 14.183 -9.593 1.00 70.10 C ATOM 2132 CG LYS B 148 -17.163 14.470 -9.243 1.00 72.12 C ATOM 2133 CD LYS B 148 -17.378 14.753 -7.767 1.00 64.14 C ATOM 2134 CE LYS B 148 -18.748 15.369 -7.539 1.00 72.30 C ATOM 2135 NZ LYS B 148 -19.089 15.470 -6.098 1.00 45.21 N ATOM 0 HA LYS B 148 -14.550 12.445 -9.900 1.00 64.32 H new ATOM 0 HB2 LYS B 148 -15.096 14.992 -9.199 1.00 70.10 H new ATOM 0 HB3 LYS B 148 -15.608 14.204 -10.678 1.00 70.10 H new ATOM 0 HG2 LYS B 148 -17.508 15.325 -9.824 1.00 72.12 H new ATOM 0 HG3 LYS B 148 -17.776 13.617 -9.536 1.00 72.12 H new ATOM 0 HD2 LYS B 148 -17.289 13.829 -7.196 1.00 64.14 H new ATOM 0 HD3 LYS B 148 -16.604 15.428 -7.403 1.00 64.14 H new ATOM 0 HE2 LYS B 148 -18.776 16.362 -7.987 1.00 72.30 H new ATOM 0 HE3 LYS B 148 -19.503 14.769 -8.047 1.00 72.30 H new ATOM 0 HZ1 LYS B 148 -20.032 15.896 -5.993 1.00 45.21 H new ATOM 0 HZ2 LYS B 148 -19.089 14.520 -5.674 1.00 45.21 H new ATOM 0 HZ3 LYS B 148 -18.385 16.065 -5.616 1.00 45.21 H new ATOM 2149 N LEU B 149 -13.022 12.652 -7.988 1.00 60.44 N ATOM 2150 CA LEU B 149 -12.084 12.764 -6.894 1.00 52.23 C ATOM 2151 C LEU B 149 -11.764 14.210 -6.602 1.00 73.41 C ATOM 2152 O LEU B 149 -10.886 14.804 -7.226 1.00 65.02 O ATOM 2153 CB LEU B 149 -10.799 11.990 -7.175 1.00 75.43 C ATOM 2154 CG LEU B 149 -10.933 10.470 -7.160 1.00 32.40 C ATOM 2155 CD1 LEU B 149 -11.913 10.029 -6.084 1.00 14.14 C ATOM 2156 CD2 LEU B 149 -11.345 9.941 -8.525 1.00 42.10 C ATOM 0 H LEU B 149 -12.637 12.233 -8.835 1.00 60.44 H new ATOM 0 HA LEU B 149 -12.559 12.326 -6.016 1.00 52.23 H new ATOM 0 HB2 LEU B 149 -10.418 12.294 -8.150 1.00 75.43 H new ATOM 0 HB3 LEU B 149 -10.052 12.279 -6.436 1.00 75.43 H new ATOM 0 HG LEU B 149 -9.956 10.047 -6.924 1.00 32.40 H new ATOM 0 HD11 LEU B 149 -11.995 8.942 -6.090 1.00 14.14 H new ATOM 0 HD12 LEU B 149 -11.557 10.361 -5.109 1.00 14.14 H new ATOM 0 HD13 LEU B 149 -12.891 10.467 -6.281 1.00 14.14 H new ATOM 0 HD21 LEU B 149 -11.432 8.855 -8.483 1.00 42.10 H new ATOM 0 HD22 LEU B 149 -12.306 10.372 -8.807 1.00 42.10 H new ATOM 0 HD23 LEU B 149 -10.593 10.216 -9.264 1.00 42.10 H new ATOM 2168 N ALA B 150 -12.518 14.775 -5.678 1.00 12.11 N ATOM 2169 CA ALA B 150 -12.254 16.109 -5.190 1.00 33.33 C ATOM 2170 C ALA B 150 -11.296 16.035 -4.018 1.00 33.33 C ATOM 2171 O ALA B 150 -11.706 16.078 -2.859 1.00 31.22 O ATOM 2172 CB ALA B 150 -13.543 16.819 -4.804 1.00 31.05 C ATOM 0 H ALA B 150 -13.325 14.323 -5.249 1.00 12.11 H new ATOM 0 HA ALA B 150 -11.794 16.693 -5.987 1.00 33.33 H new ATOM 0 HB1 ALA B 150 -13.312 17.820 -4.441 1.00 31.05 H new ATOM 0 HB2 ALA B 150 -14.194 16.890 -5.675 1.00 31.05 H new ATOM 0 HB3 ALA B 150 -14.048 16.256 -4.019 1.00 31.05 H new ATOM 2178 N PHE B 151 -10.022 15.865 -4.332 1.00 53.13 N ATOM 2179 CA PHE B 151 -8.999 15.698 -3.317 1.00 32.43 C ATOM 2180 C PHE B 151 -8.079 16.905 -3.275 1.00 2.11 C ATOM 2181 O PHE B 151 -8.050 17.712 -4.205 1.00 60.44 O ATOM 2182 CB PHE B 151 -8.189 14.417 -3.567 1.00 11.31 C ATOM 2183 CG PHE B 151 -7.489 14.364 -4.899 1.00 1.10 C ATOM 2184 CD1 PHE B 151 -6.230 14.920 -5.057 1.00 62.42 C ATOM 2185 CD2 PHE B 151 -8.086 13.753 -5.991 1.00 20.14 C ATOM 2186 CE1 PHE B 151 -5.581 14.868 -6.275 1.00 43.50 C ATOM 2187 CE2 PHE B 151 -7.440 13.699 -7.211 1.00 73.04 C ATOM 2188 CZ PHE B 151 -6.186 14.258 -7.354 1.00 64.24 C ATOM 0 H PHE B 151 -9.672 15.839 -5.290 1.00 53.13 H new ATOM 0 HA PHE B 151 -9.495 15.610 -2.350 1.00 32.43 H new ATOM 0 HB2 PHE B 151 -7.445 14.314 -2.777 1.00 11.31 H new ATOM 0 HB3 PHE B 151 -8.858 13.560 -3.489 1.00 11.31 H new ATOM 0 HD1 PHE B 151 -5.750 15.400 -4.217 1.00 62.42 H new ATOM 0 HD2 PHE B 151 -9.067 13.314 -5.887 1.00 20.14 H new ATOM 0 HE1 PHE B 151 -4.599 15.305 -6.383 1.00 43.50 H new ATOM 0 HE2 PHE B 151 -7.916 13.219 -8.053 1.00 73.04 H new ATOM 0 HZ PHE B 151 -5.680 14.218 -8.307 1.00 64.24 H new ATOM 2198 N LYS B 152 -7.321 17.014 -2.200 1.00 70.24 N ATOM 2199 CA LYS B 152 -6.433 18.148 -2.006 1.00 41.43 C ATOM 2200 C LYS B 152 -5.055 17.865 -2.594 1.00 15.14 C ATOM 2201 O LYS B 152 -4.348 16.962 -2.143 1.00 33.40 O ATOM 2202 CB LYS B 152 -6.307 18.477 -0.519 1.00 45.44 C ATOM 2203 CG LYS B 152 -5.420 19.677 -0.244 1.00 11.22 C ATOM 2204 CD LYS B 152 -6.047 20.969 -0.742 1.00 70.22 C ATOM 2205 CE LYS B 152 -6.452 21.863 0.415 1.00 25.31 C ATOM 2206 NZ LYS B 152 -7.067 23.132 -0.050 1.00 44.32 N ATOM 0 H LYS B 152 -7.302 16.329 -1.444 1.00 70.24 H new ATOM 0 HA LYS B 152 -6.862 19.006 -2.525 1.00 41.43 H new ATOM 0 HB2 LYS B 152 -7.300 18.666 -0.110 1.00 45.44 H new ATOM 0 HB3 LYS B 152 -5.906 17.610 0.005 1.00 45.44 H new ATOM 0 HG2 LYS B 152 -5.233 19.753 0.827 1.00 11.22 H new ATOM 0 HG3 LYS B 152 -4.453 19.533 -0.727 1.00 11.22 H new ATOM 0 HD2 LYS B 152 -5.340 21.496 -1.382 1.00 70.22 H new ATOM 0 HD3 LYS B 152 -6.921 20.741 -1.352 1.00 70.22 H new ATOM 0 HE2 LYS B 152 -7.157 21.331 1.054 1.00 25.31 H new ATOM 0 HE3 LYS B 152 -5.576 22.087 1.024 1.00 25.31 H new ATOM 0 HZ1 LYS B 152 -7.375 23.690 0.772 1.00 44.32 H new ATOM 0 HZ2 LYS B 152 -6.369 23.676 -0.596 1.00 44.32 H new ATOM 0 HZ3 LYS B 152 -7.888 22.920 -0.652 1.00 44.32 H new ATOM 2220 N CYS B 153 -4.676 18.639 -3.598 1.00 65.42 N ATOM 2221 CA CYS B 153 -3.376 18.482 -4.223 1.00 31.05 C ATOM 2222 C CYS B 153 -2.675 19.828 -4.330 1.00 51.14 C ATOM 2223 O CYS B 153 -3.150 20.731 -5.020 1.00 2.42 O ATOM 2224 CB CYS B 153 -3.517 17.846 -5.610 1.00 64.05 C ATOM 2225 SG CYS B 153 -1.945 17.419 -6.402 1.00 64.31 S ATOM 0 H CYS B 153 -5.251 19.381 -3.996 1.00 65.42 H new ATOM 0 HA CYS B 153 -2.773 17.821 -3.600 1.00 31.05 H new ATOM 0 HB2 CYS B 153 -4.122 16.944 -5.523 1.00 64.05 H new ATOM 0 HB3 CYS B 153 -4.061 18.533 -6.258 1.00 64.05 H new ATOM 0 HG CYS B 153 -1.042 18.294 -6.073 1.00 64.31 H new ATOM 2231 N ASP B 154 -1.572 19.961 -3.598 1.00 14.05 N ATOM 2232 CA ASP B 154 -0.699 21.136 -3.675 1.00 43.34 C ATOM 2233 C ASP B 154 -1.393 22.411 -3.213 1.00 12.23 C ATOM 2234 O ASP B 154 -0.981 23.516 -3.570 1.00 22.03 O ATOM 2235 CB ASP B 154 -0.165 21.331 -5.098 1.00 23.32 C ATOM 2236 CG ASP B 154 0.715 20.187 -5.554 1.00 0.10 C ATOM 2237 OD1 ASP B 154 1.848 20.050 -5.031 1.00 60.14 O ATOM 2238 OD2 ASP B 154 0.282 19.419 -6.436 1.00 73.41 O ATOM 0 H ASP B 154 -1.255 19.257 -2.932 1.00 14.05 H new ATOM 0 HA ASP B 154 0.133 20.944 -2.997 1.00 43.34 H new ATOM 0 HB2 ASP B 154 -1.004 21.435 -5.786 1.00 23.32 H new ATOM 0 HB3 ASP B 154 0.402 22.261 -5.145 1.00 23.32 H new ATOM 2243 N GLY B 155 -2.429 22.263 -2.406 1.00 50.35 N ATOM 2244 CA GLY B 155 -3.098 23.424 -1.863 1.00 70.01 C ATOM 2245 C GLY B 155 -4.478 23.636 -2.444 1.00 1.21 C ATOM 2246 O GLY B 155 -5.333 24.246 -1.805 1.00 1.51 O ATOM 0 H GLY B 155 -2.818 21.365 -2.118 1.00 50.35 H new ATOM 0 HA2 GLY B 155 -3.178 23.318 -0.781 1.00 70.01 H new ATOM 0 HA3 GLY B 155 -2.490 24.309 -2.053 1.00 70.01 H new ATOM 2250 N GLU B 156 -4.714 23.126 -3.643 1.00 44.01 N ATOM 2251 CA GLU B 156 -6.011 23.285 -4.282 1.00 23.53 C ATOM 2252 C GLU B 156 -6.727 21.943 -4.401 1.00 34.50 C ATOM 2253 O GLU B 156 -6.092 20.890 -4.494 1.00 72.13 O ATOM 2254 CB GLU B 156 -5.872 23.940 -5.663 1.00 41.01 C ATOM 2255 CG GLU B 156 -5.006 23.163 -6.643 1.00 23.32 C ATOM 2256 CD GLU B 156 -5.129 23.679 -8.065 1.00 73.12 C ATOM 2257 OE1 GLU B 156 -6.061 23.242 -8.778 1.00 4.11 O ATOM 2258 OE2 GLU B 156 -4.299 24.508 -8.486 1.00 42.51 O ATOM 0 H GLU B 156 -4.030 22.602 -4.190 1.00 44.01 H new ATOM 0 HA GLU B 156 -6.611 23.942 -3.652 1.00 23.53 H new ATOM 0 HB2 GLU B 156 -6.865 24.064 -6.094 1.00 41.01 H new ATOM 0 HB3 GLU B 156 -5.452 24.938 -5.538 1.00 41.01 H new ATOM 0 HG2 GLU B 156 -3.964 23.222 -6.328 1.00 23.32 H new ATOM 0 HG3 GLU B 156 -5.288 22.110 -6.616 1.00 23.32 H new ATOM 2265 N ILE B 157 -8.047 21.984 -4.366 1.00 71.23 N ATOM 2266 CA ILE B 157 -8.851 20.790 -4.551 1.00 31.24 C ATOM 2267 C ILE B 157 -8.958 20.459 -6.038 1.00 65.34 C ATOM 2268 O ILE B 157 -9.252 21.332 -6.858 1.00 71.52 O ATOM 2269 CB ILE B 157 -10.269 20.974 -3.963 1.00 31.42 C ATOM 2270 CG1 ILE B 157 -10.200 21.230 -2.453 1.00 24.41 C ATOM 2271 CG2 ILE B 157 -11.145 19.764 -4.260 1.00 31.25 C ATOM 2272 CD1 ILE B 157 -9.568 20.102 -1.668 1.00 65.43 C ATOM 0 H ILE B 157 -8.587 22.836 -4.210 1.00 71.23 H new ATOM 0 HA ILE B 157 -8.361 19.971 -4.024 1.00 31.24 H new ATOM 0 HB ILE B 157 -10.720 21.844 -4.440 1.00 31.42 H new ATOM 0 HG12 ILE B 157 -9.635 22.145 -2.275 1.00 24.41 H new ATOM 0 HG13 ILE B 157 -11.209 21.401 -2.077 1.00 24.41 H new ATOM 0 HG21 ILE B 157 -12.137 19.920 -3.835 1.00 31.25 H new ATOM 0 HG22 ILE B 157 -11.229 19.632 -5.339 1.00 31.25 H new ATOM 0 HG23 ILE B 157 -10.697 18.874 -3.819 1.00 31.25 H new ATOM 0 HD11 ILE B 157 -9.556 20.358 -0.609 1.00 65.43 H new ATOM 0 HD12 ILE B 157 -10.145 19.189 -1.814 1.00 65.43 H new ATOM 0 HD13 ILE B 157 -8.547 19.945 -2.015 1.00 65.43 H new ATOM 2284 N LYS B 158 -8.701 19.211 -6.384 1.00 11.22 N ATOM 2285 CA LYS B 158 -8.807 18.766 -7.763 1.00 1.22 C ATOM 2286 C LYS B 158 -10.128 18.028 -7.948 1.00 14.11 C ATOM 2287 O LYS B 158 -10.698 17.556 -6.979 1.00 51.44 O ATOM 2288 CB LYS B 158 -7.643 17.836 -8.114 1.00 33.20 C ATOM 2289 CG LYS B 158 -6.285 18.306 -7.610 1.00 24.11 C ATOM 2290 CD LYS B 158 -5.927 19.696 -8.111 1.00 52.13 C ATOM 2291 CE LYS B 158 -5.812 19.745 -9.623 1.00 72.10 C ATOM 2292 NZ LYS B 158 -5.304 21.061 -10.089 1.00 52.32 N ATOM 0 H LYS B 158 -8.416 18.485 -5.727 1.00 11.22 H new ATOM 0 HA LYS B 158 -8.770 19.632 -8.423 1.00 1.22 H new ATOM 0 HB2 LYS B 158 -7.847 16.848 -7.702 1.00 33.20 H new ATOM 0 HB3 LYS B 158 -7.596 17.726 -9.197 1.00 33.20 H new ATOM 0 HG2 LYS B 158 -6.285 18.305 -6.520 1.00 24.11 H new ATOM 0 HG3 LYS B 158 -5.518 17.600 -7.929 1.00 24.11 H new ATOM 0 HD2 LYS B 158 -6.686 20.406 -7.782 1.00 52.13 H new ATOM 0 HD3 LYS B 158 -4.983 20.010 -7.666 1.00 52.13 H new ATOM 0 HE2 LYS B 158 -5.143 18.955 -9.964 1.00 72.10 H new ATOM 0 HE3 LYS B 158 -6.787 19.552 -10.069 1.00 72.10 H new ATOM 0 HZ1 LYS B 158 -5.318 21.090 -11.129 1.00 52.32 H new ATOM 0 HZ2 LYS B 158 -5.909 21.819 -9.713 1.00 52.32 H new ATOM 0 HZ3 LYS B 158 -4.330 21.196 -9.752 1.00 52.32 H new ATOM 2306 N THR B 159 -10.621 17.952 -9.178 1.00 23.40 N ATOM 2307 CA THR B 159 -11.811 17.159 -9.475 1.00 34.31 C ATOM 2308 C THR B 159 -11.589 16.283 -10.704 1.00 32.42 C ATOM 2309 O THR B 159 -11.496 16.780 -11.828 1.00 64.34 O ATOM 2310 CB THR B 159 -13.056 18.041 -9.691 1.00 21.23 C ATOM 2311 OG1 THR B 159 -12.676 19.316 -10.233 1.00 73.22 O ATOM 2312 CG2 THR B 159 -13.827 18.229 -8.392 1.00 31.51 C ATOM 0 H THR B 159 -10.218 18.428 -9.985 1.00 23.40 H new ATOM 0 HA THR B 159 -11.989 16.526 -8.606 1.00 34.31 H new ATOM 0 HB THR B 159 -13.709 17.535 -10.402 1.00 21.23 H new ATOM 0 HG1 THR B 159 -13.476 19.866 -10.367 1.00 73.22 H new ATOM 0 HG21 THR B 159 -14.700 18.855 -8.575 1.00 31.51 H new ATOM 0 HG22 THR B 159 -14.149 17.258 -8.016 1.00 31.51 H new ATOM 0 HG23 THR B 159 -13.184 18.709 -7.654 1.00 31.51 H new ATOM 2320 N PHE B 160 -11.484 14.981 -10.481 1.00 73.33 N ATOM 2321 CA PHE B 160 -11.262 14.034 -11.567 1.00 71.32 C ATOM 2322 C PHE B 160 -12.384 13.010 -11.640 1.00 54.43 C ATOM 2323 O PHE B 160 -12.567 12.216 -10.720 1.00 34.33 O ATOM 2324 CB PHE B 160 -9.922 13.319 -11.386 1.00 72.03 C ATOM 2325 CG PHE B 160 -8.729 14.202 -11.610 1.00 53.42 C ATOM 2326 CD1 PHE B 160 -8.241 15.007 -10.596 1.00 5.44 C ATOM 2327 CD2 PHE B 160 -8.097 14.227 -12.843 1.00 22.54 C ATOM 2328 CE1 PHE B 160 -7.144 15.820 -10.805 1.00 72.02 C ATOM 2329 CE2 PHE B 160 -7.001 15.038 -13.057 1.00 62.51 C ATOM 2330 CZ PHE B 160 -6.525 15.836 -12.037 1.00 72.12 C ATOM 0 H PHE B 160 -11.549 14.555 -9.557 1.00 73.33 H new ATOM 0 HA PHE B 160 -11.246 14.596 -12.501 1.00 71.32 H new ATOM 0 HB2 PHE B 160 -9.874 12.908 -10.378 1.00 72.03 H new ATOM 0 HB3 PHE B 160 -9.874 12.477 -12.077 1.00 72.03 H new ATOM 0 HD1 PHE B 160 -8.723 15.000 -9.630 1.00 5.44 H new ATOM 0 HD2 PHE B 160 -8.466 13.605 -13.645 1.00 22.54 H new ATOM 0 HE1 PHE B 160 -6.772 16.442 -10.005 1.00 72.02 H new ATOM 0 HE2 PHE B 160 -6.516 15.048 -14.022 1.00 62.51 H new ATOM 0 HZ PHE B 160 -5.668 16.472 -12.203 1.00 72.12 H new ATOM 2340 N SER B 161 -13.129 13.035 -12.737 1.00 32.24 N ATOM 2341 CA SER B 161 -14.220 12.089 -12.952 1.00 72.20 C ATOM 2342 C SER B 161 -13.762 10.933 -13.838 1.00 23.22 C ATOM 2343 O SER B 161 -14.551 10.065 -14.212 1.00 24.11 O ATOM 2344 CB SER B 161 -15.401 12.804 -13.608 1.00 5.43 C ATOM 2345 OG SER B 161 -15.819 13.912 -12.831 1.00 2.42 O ATOM 0 H SER B 161 -12.998 13.703 -13.496 1.00 32.24 H new ATOM 0 HA SER B 161 -14.528 11.687 -11.986 1.00 72.20 H new ATOM 0 HB2 SER B 161 -15.118 13.141 -14.605 1.00 5.43 H new ATOM 0 HB3 SER B 161 -16.230 12.107 -13.730 1.00 5.43 H new ATOM 0 HG SER B 161 -16.693 13.720 -12.431 1.00 2.42 H new ATOM 2351 N ASP B 162 -12.481 10.927 -14.170 1.00 3.01 N ATOM 2352 CA ASP B 162 -11.926 9.915 -15.056 1.00 24.13 C ATOM 2353 C ASP B 162 -10.486 9.616 -14.658 1.00 74.11 C ATOM 2354 O ASP B 162 -9.663 10.528 -14.554 1.00 44.43 O ATOM 2355 CB ASP B 162 -11.980 10.397 -16.513 1.00 41.01 C ATOM 2356 CG ASP B 162 -11.810 9.272 -17.517 1.00 70.44 C ATOM 2357 OD1 ASP B 162 -11.011 8.354 -17.259 1.00 40.03 O ATOM 2358 OD2 ASP B 162 -12.488 9.297 -18.567 1.00 21.42 O ATOM 0 H ASP B 162 -11.804 11.614 -13.838 1.00 3.01 H new ATOM 0 HA ASP B 162 -12.518 9.004 -14.968 1.00 24.13 H new ATOM 0 HB2 ASP B 162 -12.934 10.894 -16.690 1.00 41.01 H new ATOM 0 HB3 ASP B 162 -11.199 11.140 -16.673 1.00 41.01 H new ATOM 2363 N LEU B 163 -10.185 8.344 -14.437 1.00 1.03 N ATOM 2364 CA LEU B 163 -8.843 7.929 -14.047 1.00 52.11 C ATOM 2365 C LEU B 163 -7.876 8.050 -15.218 1.00 32.10 C ATOM 2366 O LEU B 163 -6.665 8.135 -15.024 1.00 20.31 O ATOM 2367 CB LEU B 163 -8.852 6.493 -13.520 1.00 54.54 C ATOM 2368 CG LEU B 163 -9.687 6.268 -12.258 1.00 53.01 C ATOM 2369 CD1 LEU B 163 -9.630 4.808 -11.837 1.00 73.10 C ATOM 2370 CD2 LEU B 163 -9.206 7.166 -11.127 1.00 73.34 C ATOM 0 H LEU B 163 -10.854 7.579 -14.521 1.00 1.03 H new ATOM 0 HA LEU B 163 -8.507 8.592 -13.250 1.00 52.11 H new ATOM 0 HB2 LEU B 163 -9.226 5.837 -14.306 1.00 54.54 H new ATOM 0 HB3 LEU B 163 -7.825 6.192 -13.315 1.00 54.54 H new ATOM 0 HG LEU B 163 -10.722 6.525 -12.482 1.00 53.01 H new ATOM 0 HD11 LEU B 163 -10.229 4.665 -10.938 1.00 73.10 H new ATOM 0 HD12 LEU B 163 -10.023 4.183 -12.638 1.00 73.10 H new ATOM 0 HD13 LEU B 163 -8.596 4.528 -11.633 1.00 73.10 H new ATOM 0 HD21 LEU B 163 -9.813 6.990 -10.239 1.00 73.34 H new ATOM 0 HD22 LEU B 163 -8.163 6.942 -10.903 1.00 73.34 H new ATOM 0 HD23 LEU B 163 -9.297 8.210 -11.427 1.00 73.34 H new ATOM 2382 N GLN B 164 -8.415 8.063 -16.431 1.00 4.23 N ATOM 2383 CA GLN B 164 -7.605 8.258 -17.624 1.00 60.32 C ATOM 2384 C GLN B 164 -7.104 9.697 -17.647 1.00 32.24 C ATOM 2385 O GLN B 164 -5.936 9.962 -17.938 1.00 64.01 O ATOM 2386 CB GLN B 164 -8.434 7.925 -18.875 1.00 1.02 C ATOM 2387 CG GLN B 164 -7.660 7.923 -20.190 1.00 65.13 C ATOM 2388 CD GLN B 164 -7.587 9.287 -20.845 1.00 43.01 C ATOM 2389 OE1 GLN B 164 -6.638 10.039 -20.638 1.00 45.43 O ATOM 2390 NE2 GLN B 164 -8.591 9.617 -21.640 1.00 52.55 N ATOM 0 H GLN B 164 -9.411 7.941 -16.613 1.00 4.23 H new ATOM 0 HA GLN B 164 -6.743 7.591 -17.614 1.00 60.32 H new ATOM 0 HB2 GLN B 164 -8.888 6.944 -18.739 1.00 1.02 H new ATOM 0 HB3 GLN B 164 -9.248 8.645 -18.953 1.00 1.02 H new ATOM 0 HG2 GLN B 164 -6.648 7.561 -20.007 1.00 65.13 H new ATOM 0 HG3 GLN B 164 -8.130 7.221 -20.879 1.00 65.13 H new ATOM 0 HE21 GLN B 164 -9.361 8.965 -21.786 1.00 52.55 H new ATOM 0 HE22 GLN B 164 -8.595 10.524 -22.107 1.00 52.55 H new ATOM 2399 N SER B 165 -7.995 10.613 -17.292 1.00 34.33 N ATOM 2400 CA SER B 165 -7.648 12.021 -17.175 1.00 42.43 C ATOM 2401 C SER B 165 -6.692 12.225 -16.001 1.00 30.44 C ATOM 2402 O SER B 165 -5.704 12.957 -16.105 1.00 12.54 O ATOM 2403 CB SER B 165 -8.920 12.856 -16.983 1.00 52.44 C ATOM 2404 OG SER B 165 -8.633 14.243 -16.958 1.00 63.22 O ATOM 0 H SER B 165 -8.970 10.403 -17.079 1.00 34.33 H new ATOM 0 HA SER B 165 -7.151 12.347 -18.089 1.00 42.43 H new ATOM 0 HB2 SER B 165 -9.621 12.643 -17.790 1.00 52.44 H new ATOM 0 HB3 SER B 165 -9.408 12.568 -16.052 1.00 52.44 H new ATOM 0 HG SER B 165 -9.465 14.747 -16.836 1.00 63.22 H new ATOM 2410 N LEU B 166 -6.979 11.550 -14.889 1.00 65.33 N ATOM 2411 CA LEU B 166 -6.132 11.621 -13.704 1.00 1.20 C ATOM 2412 C LEU B 166 -4.749 11.049 -14.001 1.00 3.13 C ATOM 2413 O LEU B 166 -3.754 11.495 -13.435 1.00 51.41 O ATOM 2414 CB LEU B 166 -6.777 10.869 -12.536 1.00 32.53 C ATOM 2415 CG LEU B 166 -5.976 10.874 -11.231 1.00 32.50 C ATOM 2416 CD1 LEU B 166 -5.806 12.286 -10.698 1.00 11.33 C ATOM 2417 CD2 LEU B 166 -6.647 9.993 -10.191 1.00 20.42 C ATOM 0 H LEU B 166 -7.795 10.946 -14.786 1.00 65.33 H new ATOM 0 HA LEU B 166 -6.023 12.669 -13.424 1.00 1.20 H new ATOM 0 HB2 LEU B 166 -7.757 11.304 -12.343 1.00 32.53 H new ATOM 0 HB3 LEU B 166 -6.941 9.835 -12.838 1.00 32.53 H new ATOM 0 HG LEU B 166 -4.986 10.472 -11.444 1.00 32.50 H new ATOM 0 HD11 LEU B 166 -5.233 12.258 -9.771 1.00 11.33 H new ATOM 0 HD12 LEU B 166 -5.276 12.891 -11.434 1.00 11.33 H new ATOM 0 HD13 LEU B 166 -6.786 12.723 -10.506 1.00 11.33 H new ATOM 0 HD21 LEU B 166 -6.064 10.009 -9.270 1.00 20.42 H new ATOM 0 HD22 LEU B 166 -7.651 10.367 -9.991 1.00 20.42 H new ATOM 0 HD23 LEU B 166 -6.708 8.971 -10.565 1.00 20.42 H new ATOM 2429 N ARG B 167 -4.699 10.069 -14.896 1.00 32.42 N ATOM 2430 CA ARG B 167 -3.438 9.484 -15.335 1.00 22.54 C ATOM 2431 C ARG B 167 -2.512 10.553 -15.902 1.00 55.22 C ATOM 2432 O ARG B 167 -1.334 10.604 -15.561 1.00 65.31 O ATOM 2433 CB ARG B 167 -3.690 8.403 -16.388 1.00 74.15 C ATOM 2434 CG ARG B 167 -2.435 7.958 -17.123 1.00 55.40 C ATOM 2435 CD ARG B 167 -2.750 6.927 -18.188 1.00 23.41 C ATOM 2436 NE ARG B 167 -1.656 6.787 -19.145 1.00 13.44 N ATOM 2437 CZ ARG B 167 -1.679 5.960 -20.184 1.00 64.14 C ATOM 2438 NH1 ARG B 167 -2.674 5.095 -20.324 1.00 34.34 N ATOM 2439 NH2 ARG B 167 -0.686 5.977 -21.067 1.00 73.42 N ATOM 0 H ARG B 167 -5.524 9.660 -15.335 1.00 32.42 H new ATOM 0 HA ARG B 167 -2.956 9.032 -14.468 1.00 22.54 H new ATOM 0 HB2 ARG B 167 -4.143 7.537 -15.905 1.00 74.15 H new ATOM 0 HB3 ARG B 167 -4.412 8.777 -17.114 1.00 74.15 H new ATOM 0 HG2 ARG B 167 -1.956 8.822 -17.583 1.00 55.40 H new ATOM 0 HG3 ARG B 167 -1.724 7.541 -16.410 1.00 55.40 H new ATOM 0 HD2 ARG B 167 -2.946 5.964 -17.716 1.00 23.41 H new ATOM 0 HD3 ARG B 167 -3.660 7.214 -18.715 1.00 23.41 H new ATOM 0 HE ARG B 167 -0.823 7.359 -19.007 1.00 13.44 H new ATOM 0 HH11 ARG B 167 -3.424 5.064 -19.633 1.00 34.34 H new ATOM 0 HH12 ARG B 167 -2.690 4.461 -21.123 1.00 34.34 H new ATOM 0 HH21 ARG B 167 0.093 6.625 -20.946 1.00 73.42 H new ATOM 0 HH22 ARG B 167 -0.703 5.342 -21.865 1.00 73.42 H new ATOM 2453 N LYS B 168 -3.064 11.416 -16.750 1.00 10.32 N ATOM 2454 CA LYS B 168 -2.285 12.471 -17.390 1.00 24.12 C ATOM 2455 C LYS B 168 -1.745 13.451 -16.355 1.00 15.12 C ATOM 2456 O LYS B 168 -0.682 14.037 -16.534 1.00 32.52 O ATOM 2457 CB LYS B 168 -3.134 13.215 -18.413 1.00 23.11 C ATOM 2458 CG LYS B 168 -3.642 12.329 -19.535 1.00 22.13 C ATOM 2459 CD LYS B 168 -4.275 13.164 -20.627 1.00 3.22 C ATOM 2460 CE LYS B 168 -4.852 12.307 -21.738 1.00 15.23 C ATOM 2461 NZ LYS B 168 -5.438 13.133 -22.825 1.00 34.21 N ATOM 0 H LYS B 168 -4.050 11.405 -17.010 1.00 10.32 H new ATOM 0 HA LYS B 168 -1.442 12.004 -17.900 1.00 24.12 H new ATOM 0 HB2 LYS B 168 -3.985 13.670 -17.906 1.00 23.11 H new ATOM 0 HB3 LYS B 168 -2.546 14.027 -18.840 1.00 23.11 H new ATOM 0 HG2 LYS B 168 -2.818 11.746 -19.947 1.00 22.13 H new ATOM 0 HG3 LYS B 168 -4.371 11.619 -19.144 1.00 22.13 H new ATOM 0 HD2 LYS B 168 -5.064 13.782 -20.199 1.00 3.22 H new ATOM 0 HD3 LYS B 168 -3.530 13.842 -21.043 1.00 3.22 H new ATOM 0 HE2 LYS B 168 -4.069 11.669 -22.148 1.00 15.23 H new ATOM 0 HE3 LYS B 168 -5.618 11.649 -21.329 1.00 15.23 H new ATOM 0 HZ1 LYS B 168 -5.822 12.511 -23.565 1.00 34.21 H new ATOM 0 HZ2 LYS B 168 -6.202 13.724 -22.439 1.00 34.21 H new ATOM 0 HZ3 LYS B 168 -4.701 13.743 -23.233 1.00 34.21 H new ATOM 2475 N PHE B 169 -2.488 13.617 -15.271 1.00 22.41 N ATOM 2476 CA PHE B 169 -2.096 14.519 -14.198 1.00 45.05 C ATOM 2477 C PHE B 169 -1.065 13.855 -13.287 1.00 11.41 C ATOM 2478 O PHE B 169 -0.025 14.437 -12.983 1.00 51.30 O ATOM 2479 CB PHE B 169 -3.336 14.931 -13.397 1.00 51.42 C ATOM 2480 CG PHE B 169 -3.062 15.861 -12.244 1.00 32.30 C ATOM 2481 CD1 PHE B 169 -2.840 17.213 -12.459 1.00 13.43 C ATOM 2482 CD2 PHE B 169 -3.047 15.383 -10.941 1.00 62.50 C ATOM 2483 CE1 PHE B 169 -2.606 18.067 -11.397 1.00 44.22 C ATOM 2484 CE2 PHE B 169 -2.817 16.237 -9.879 1.00 54.31 C ATOM 2485 CZ PHE B 169 -2.595 17.579 -10.108 1.00 2.23 C ATOM 0 H PHE B 169 -3.372 13.135 -15.111 1.00 22.41 H new ATOM 0 HA PHE B 169 -1.639 15.409 -14.631 1.00 45.05 H new ATOM 0 HB2 PHE B 169 -4.045 15.411 -14.072 1.00 51.42 H new ATOM 0 HB3 PHE B 169 -3.819 14.032 -13.014 1.00 51.42 H new ATOM 0 HD1 PHE B 169 -2.850 17.603 -13.466 1.00 13.43 H new ATOM 0 HD2 PHE B 169 -3.217 14.333 -10.755 1.00 62.50 H new ATOM 0 HE1 PHE B 169 -2.432 19.117 -11.578 1.00 44.22 H new ATOM 0 HE2 PHE B 169 -2.811 15.853 -8.869 1.00 54.31 H new ATOM 0 HZ PHE B 169 -2.413 18.246 -9.279 1.00 2.23 H new ATOM 2495 N ALA B 170 -1.353 12.622 -12.885 1.00 22.43 N ATOM 2496 CA ALA B 170 -0.512 11.893 -11.943 1.00 32.22 C ATOM 2497 C ALA B 170 0.856 11.577 -12.539 1.00 5.24 C ATOM 2498 O ALA B 170 1.845 11.484 -11.815 1.00 40.23 O ATOM 2499 CB ALA B 170 -1.204 10.608 -11.505 1.00 34.43 C ATOM 0 H ALA B 170 -2.172 12.102 -13.201 1.00 22.43 H new ATOM 0 HA ALA B 170 -0.356 12.532 -11.074 1.00 32.22 H new ATOM 0 HB1 ALA B 170 -0.566 10.073 -10.802 1.00 34.43 H new ATOM 0 HB2 ALA B 170 -2.151 10.851 -11.023 1.00 34.43 H new ATOM 0 HB3 ALA B 170 -1.391 9.980 -12.376 1.00 34.43 H new ATOM 2505 N SER B 171 0.912 11.416 -13.854 1.00 32.24 N ATOM 2506 CA SER B 171 2.164 11.096 -14.519 1.00 75.34 C ATOM 2507 C SER B 171 3.129 12.275 -14.459 1.00 23.30 C ATOM 2508 O SER B 171 4.301 12.107 -14.130 1.00 3.43 O ATOM 2509 CB SER B 171 1.904 10.688 -15.968 1.00 12.42 C ATOM 2510 OG SER B 171 1.132 11.664 -16.643 1.00 63.44 O ATOM 0 H SER B 171 0.109 11.501 -14.477 1.00 32.24 H new ATOM 0 HA SER B 171 2.625 10.257 -13.997 1.00 75.34 H new ATOM 0 HB2 SER B 171 2.853 10.549 -16.486 1.00 12.42 H new ATOM 0 HB3 SER B 171 1.385 9.730 -15.991 1.00 12.42 H new ATOM 0 HG SER B 171 0.180 11.500 -16.478 1.00 63.44 H new ATOM 2516 N GLN B 172 2.625 13.471 -14.744 1.00 41.30 N ATOM 2517 CA GLN B 172 3.464 14.664 -14.759 1.00 1.35 C ATOM 2518 C GLN B 172 3.642 15.222 -13.347 1.00 2.14 C ATOM 2519 O GLN B 172 4.378 16.184 -13.130 1.00 21.03 O ATOM 2520 CB GLN B 172 2.886 15.722 -15.707 1.00 11.44 C ATOM 2521 CG GLN B 172 1.492 16.197 -15.336 1.00 63.41 C ATOM 2522 CD GLN B 172 0.886 17.091 -16.399 1.00 32.34 C ATOM 2523 OE1 GLN B 172 1.069 18.308 -16.387 1.00 3.13 O ATOM 2524 NE2 GLN B 172 0.150 16.495 -17.322 1.00 0.11 N ATOM 0 H GLN B 172 1.644 13.640 -14.967 1.00 41.30 H new ATOM 0 HA GLN B 172 4.450 14.385 -15.131 1.00 1.35 H new ATOM 0 HB2 GLN B 172 3.557 16.581 -15.727 1.00 11.44 H new ATOM 0 HB3 GLN B 172 2.861 15.313 -16.717 1.00 11.44 H new ATOM 0 HG2 GLN B 172 0.846 15.333 -15.180 1.00 63.41 H new ATOM 0 HG3 GLN B 172 1.535 16.738 -14.391 1.00 63.41 H new ATOM 0 HE21 GLN B 172 0.022 15.483 -17.298 1.00 0.11 H new ATOM 0 HE22 GLN B 172 -0.290 17.047 -18.058 1.00 0.11 H new ATOM 2533 N LYS B 173 2.965 14.605 -12.386 1.00 32.22 N ATOM 2534 CA LYS B 173 3.150 14.941 -10.983 1.00 24.43 C ATOM 2535 C LYS B 173 4.305 14.137 -10.402 1.00 44.12 C ATOM 2536 O LYS B 173 4.201 12.927 -10.243 1.00 73.02 O ATOM 2537 CB LYS B 173 1.870 14.674 -10.187 1.00 44.22 C ATOM 2538 CG LYS B 173 0.845 15.793 -10.276 1.00 22.14 C ATOM 2539 CD LYS B 173 1.334 17.052 -9.577 1.00 25.04 C ATOM 2540 CE LYS B 173 1.648 16.785 -8.114 1.00 34.32 C ATOM 2541 NZ LYS B 173 2.183 17.986 -7.429 1.00 72.22 N ATOM 0 H LYS B 173 2.281 13.867 -12.555 1.00 32.22 H new ATOM 0 HA LYS B 173 3.383 16.003 -10.911 1.00 24.43 H new ATOM 0 HB2 LYS B 173 1.417 13.750 -10.546 1.00 44.22 H new ATOM 0 HB3 LYS B 173 2.131 14.516 -9.141 1.00 44.22 H new ATOM 0 HG2 LYS B 173 0.636 16.014 -11.323 1.00 22.14 H new ATOM 0 HG3 LYS B 173 -0.092 15.466 -9.826 1.00 22.14 H new ATOM 0 HD2 LYS B 173 2.225 17.427 -10.080 1.00 25.04 H new ATOM 0 HD3 LYS B 173 0.575 17.830 -9.652 1.00 25.04 H new ATOM 0 HE2 LYS B 173 0.744 16.451 -7.605 1.00 34.32 H new ATOM 0 HE3 LYS B 173 2.373 15.974 -8.042 1.00 34.32 H new ATOM 0 HZ1 LYS B 173 2.446 17.741 -6.453 1.00 72.22 H new ATOM 0 HZ2 LYS B 173 3.022 18.331 -7.938 1.00 72.22 H new ATOM 0 HZ3 LYS B 173 1.456 18.730 -7.415 1.00 72.22 H new ATOM 2555 N SER B 174 5.399 14.817 -10.084 1.00 23.41 N ATOM 2556 CA SER B 174 6.598 14.155 -9.571 1.00 20.25 C ATOM 2557 C SER B 174 6.294 13.319 -8.323 1.00 75.30 C ATOM 2558 O SER B 174 6.841 12.229 -8.145 1.00 52.44 O ATOM 2559 CB SER B 174 7.675 15.202 -9.265 1.00 52.31 C ATOM 2560 OG SER B 174 8.855 14.604 -8.755 1.00 12.30 O ATOM 0 H SER B 174 5.484 15.830 -10.172 1.00 23.41 H new ATOM 0 HA SER B 174 6.963 13.472 -10.338 1.00 20.25 H new ATOM 0 HB2 SER B 174 7.911 15.758 -10.172 1.00 52.31 H new ATOM 0 HB3 SER B 174 7.289 15.921 -8.542 1.00 52.31 H new ATOM 0 HG SER B 174 9.521 15.299 -8.572 1.00 12.30 H new ATOM 2566 N SER B 175 5.410 13.824 -7.476 1.00 51.13 N ATOM 2567 CA SER B 175 5.059 13.142 -6.239 1.00 50.54 C ATOM 2568 C SER B 175 4.084 11.986 -6.489 1.00 23.21 C ATOM 2569 O SER B 175 4.283 10.873 -5.996 1.00 2.42 O ATOM 2570 CB SER B 175 4.461 14.149 -5.256 1.00 4.41 C ATOM 2571 OG SER B 175 3.508 14.982 -5.902 1.00 2.24 O ATOM 0 H SER B 175 4.921 14.707 -7.623 1.00 51.13 H new ATOM 0 HA SER B 175 5.965 12.712 -5.812 1.00 50.54 H new ATOM 0 HB2 SER B 175 3.987 13.619 -4.430 1.00 4.41 H new ATOM 0 HB3 SER B 175 5.255 14.761 -4.828 1.00 4.41 H new ATOM 0 HG SER B 175 3.137 15.617 -5.255 1.00 2.24 H new ATOM 2577 N MET B 176 3.047 12.249 -7.277 1.00 52.33 N ATOM 2578 CA MET B 176 1.992 11.264 -7.522 1.00 31.04 C ATOM 2579 C MET B 176 2.445 10.184 -8.500 1.00 45.13 C ATOM 2580 O MET B 176 1.794 9.143 -8.637 1.00 61.24 O ATOM 2581 CB MET B 176 0.741 11.957 -8.059 1.00 22.45 C ATOM 2582 CG MET B 176 0.161 12.987 -7.103 1.00 35.30 C ATOM 2583 SD MET B 176 -1.382 13.697 -7.706 1.00 54.03 S ATOM 2584 CE MET B 176 -2.410 12.232 -7.763 1.00 33.35 C ATOM 0 H MET B 176 2.912 13.137 -7.759 1.00 52.33 H new ATOM 0 HA MET B 176 1.763 10.782 -6.572 1.00 31.04 H new ATOM 0 HB2 MET B 176 0.983 12.445 -9.003 1.00 22.45 H new ATOM 0 HB3 MET B 176 -0.018 11.204 -8.274 1.00 22.45 H new ATOM 0 HG2 MET B 176 -0.012 12.521 -6.133 1.00 35.30 H new ATOM 0 HG3 MET B 176 0.888 13.784 -6.948 1.00 35.30 H new ATOM 0 HE1 MET B 176 -3.460 12.523 -7.730 1.00 33.35 H new ATOM 0 HE2 MET B 176 -2.213 11.685 -8.685 1.00 33.35 H new ATOM 0 HE3 MET B 176 -2.183 11.595 -6.908 1.00 33.35 H new ATOM 2594 N LYS B 177 3.568 10.435 -9.160 1.00 43.51 N ATOM 2595 CA LYS B 177 4.133 9.512 -10.136 1.00 74.03 C ATOM 2596 C LYS B 177 4.393 8.140 -9.512 1.00 24.32 C ATOM 2597 O LYS B 177 4.313 7.113 -10.181 1.00 71.33 O ATOM 2598 CB LYS B 177 5.445 10.090 -10.664 1.00 74.31 C ATOM 2599 CG LYS B 177 5.942 9.448 -11.947 1.00 13.02 C ATOM 2600 CD LYS B 177 7.376 9.863 -12.241 1.00 32.34 C ATOM 2601 CE LYS B 177 7.531 11.375 -12.336 1.00 35.14 C ATOM 2602 NZ LYS B 177 6.823 11.950 -13.507 1.00 11.23 N ATOM 0 H LYS B 177 4.114 11.287 -9.033 1.00 43.51 H new ATOM 0 HA LYS B 177 3.420 9.384 -10.950 1.00 74.03 H new ATOM 0 HB2 LYS B 177 5.315 11.159 -10.834 1.00 74.31 H new ATOM 0 HB3 LYS B 177 6.211 9.980 -9.897 1.00 74.31 H new ATOM 0 HG2 LYS B 177 5.883 8.363 -11.862 1.00 13.02 H new ATOM 0 HG3 LYS B 177 5.298 9.738 -12.777 1.00 13.02 H new ATOM 0 HD2 LYS B 177 8.030 9.481 -11.457 1.00 32.34 H new ATOM 0 HD3 LYS B 177 7.699 9.407 -13.177 1.00 32.34 H new ATOM 0 HE2 LYS B 177 7.149 11.834 -11.424 1.00 35.14 H new ATOM 0 HE3 LYS B 177 8.590 11.625 -12.398 1.00 35.14 H new ATOM 0 HZ1 LYS B 177 7.159 12.920 -13.674 1.00 11.23 H new ATOM 0 HZ2 LYS B 177 7.013 11.368 -14.348 1.00 11.23 H new ATOM 0 HZ3 LYS B 177 5.800 11.966 -13.321 1.00 11.23 H new ATOM 2616 N GLU B 178 4.681 8.134 -8.220 1.00 61.43 N ATOM 2617 CA GLU B 178 5.045 6.908 -7.528 1.00 44.11 C ATOM 2618 C GLU B 178 3.866 6.360 -6.754 1.00 14.54 C ATOM 2619 O GLU B 178 3.981 5.379 -6.024 1.00 73.44 O ATOM 2620 CB GLU B 178 6.212 7.176 -6.588 1.00 11.12 C ATOM 2621 CG GLU B 178 7.450 7.668 -7.308 1.00 54.24 C ATOM 2622 CD GLU B 178 8.603 7.938 -6.368 1.00 53.05 C ATOM 2623 OE1 GLU B 178 8.710 9.073 -5.859 1.00 44.35 O ATOM 2624 OE2 GLU B 178 9.411 7.017 -6.133 1.00 75.44 O ATOM 0 H GLU B 178 4.670 8.965 -7.629 1.00 61.43 H new ATOM 0 HA GLU B 178 5.343 6.164 -8.267 1.00 44.11 H new ATOM 0 HB2 GLU B 178 5.911 7.916 -5.846 1.00 11.12 H new ATOM 0 HB3 GLU B 178 6.453 6.261 -6.046 1.00 11.12 H new ATOM 0 HG2 GLU B 178 7.755 6.926 -8.046 1.00 54.24 H new ATOM 0 HG3 GLU B 178 7.210 8.581 -7.853 1.00 54.24 H new ATOM 2631 N LEU B 179 2.731 7.002 -6.919 1.00 22.23 N ATOM 2632 CA LEU B 179 1.525 6.596 -6.227 1.00 20.43 C ATOM 2633 C LEU B 179 0.664 5.729 -7.135 1.00 45.22 C ATOM 2634 O LEU B 179 0.300 4.610 -6.786 1.00 3.10 O ATOM 2635 CB LEU B 179 0.743 7.828 -5.766 1.00 24.42 C ATOM 2636 CG LEU B 179 1.510 8.783 -4.848 1.00 53.32 C ATOM 2637 CD1 LEU B 179 0.600 9.903 -4.366 1.00 24.33 C ATOM 2638 CD2 LEU B 179 2.111 8.033 -3.668 1.00 74.24 C ATOM 0 H LEU B 179 2.616 7.811 -7.529 1.00 22.23 H new ATOM 0 HA LEU B 179 1.802 6.011 -5.350 1.00 20.43 H new ATOM 0 HB2 LEU B 179 0.416 8.381 -6.647 1.00 24.42 H new ATOM 0 HB3 LEU B 179 -0.156 7.495 -5.247 1.00 24.42 H new ATOM 0 HG LEU B 179 2.327 9.224 -5.419 1.00 53.32 H new ATOM 0 HD11 LEU B 179 1.161 10.573 -3.714 1.00 24.33 H new ATOM 0 HD12 LEU B 179 0.225 10.461 -5.224 1.00 24.33 H new ATOM 0 HD13 LEU B 179 -0.239 9.478 -3.814 1.00 24.33 H new ATOM 0 HD21 LEU B 179 2.651 8.732 -3.030 1.00 74.24 H new ATOM 0 HD22 LEU B 179 1.315 7.559 -3.094 1.00 74.24 H new ATOM 0 HD23 LEU B 179 2.798 7.270 -4.034 1.00 74.24 H new ATOM 2650 N LEU B 180 0.369 6.248 -8.318 1.00 45.30 N ATOM 2651 CA LEU B 180 -0.501 5.563 -9.271 1.00 20.20 C ATOM 2652 C LEU B 180 0.286 4.590 -10.139 1.00 52.22 C ATOM 2653 O LEU B 180 -0.274 3.933 -11.016 1.00 12.25 O ATOM 2654 CB LEU B 180 -1.218 6.578 -10.164 1.00 45.23 C ATOM 2655 CG LEU B 180 -2.306 7.421 -9.490 1.00 53.04 C ATOM 2656 CD1 LEU B 180 -3.343 6.536 -8.817 1.00 60.34 C ATOM 2657 CD2 LEU B 180 -1.717 8.412 -8.494 1.00 21.12 C ATOM 0 H LEU B 180 0.721 7.148 -8.645 1.00 45.30 H new ATOM 0 HA LEU B 180 -1.237 4.999 -8.698 1.00 20.20 H new ATOM 0 HB2 LEU B 180 -0.472 7.253 -10.583 1.00 45.23 H new ATOM 0 HB3 LEU B 180 -1.668 6.042 -10.999 1.00 45.23 H new ATOM 0 HG LEU B 180 -2.800 7.996 -10.273 1.00 53.04 H new ATOM 0 HD11 LEU B 180 -4.103 7.160 -8.347 1.00 60.34 H new ATOM 0 HD12 LEU B 180 -3.811 5.893 -9.562 1.00 60.34 H new ATOM 0 HD13 LEU B 180 -2.859 5.920 -8.059 1.00 60.34 H new ATOM 0 HD21 LEU B 180 -2.520 8.990 -8.038 1.00 21.12 H new ATOM 0 HD22 LEU B 180 -1.175 7.870 -7.719 1.00 21.12 H new ATOM 0 HD23 LEU B 180 -1.034 9.085 -9.012 1.00 21.12 H new ATOM 2669 N LYS B 181 1.584 4.508 -9.873 1.00 75.31 N ATOM 2670 CA LYS B 181 2.501 3.635 -10.615 1.00 13.11 C ATOM 2671 C LYS B 181 1.986 2.195 -10.749 1.00 45.21 C ATOM 2672 O LYS B 181 2.307 1.503 -11.711 1.00 13.34 O ATOM 2673 CB LYS B 181 3.866 3.607 -9.923 1.00 21.34 C ATOM 2674 CG LYS B 181 3.813 3.078 -8.500 1.00 71.24 C ATOM 2675 CD LYS B 181 5.203 2.836 -7.945 1.00 23.44 C ATOM 2676 CE LYS B 181 5.135 2.333 -6.516 1.00 14.41 C ATOM 2677 NZ LYS B 181 4.432 1.026 -6.406 1.00 61.25 N ATOM 0 H LYS B 181 2.037 5.045 -9.134 1.00 75.31 H new ATOM 0 HA LYS B 181 2.580 4.052 -11.619 1.00 13.11 H new ATOM 0 HB2 LYS B 181 4.548 2.989 -10.507 1.00 21.34 H new ATOM 0 HB3 LYS B 181 4.280 4.615 -9.912 1.00 21.34 H new ATOM 0 HG2 LYS B 181 3.286 3.790 -7.865 1.00 71.24 H new ATOM 0 HG3 LYS B 181 3.244 2.149 -8.477 1.00 71.24 H new ATOM 0 HD2 LYS B 181 5.725 2.109 -8.566 1.00 23.44 H new ATOM 0 HD3 LYS B 181 5.780 3.760 -7.982 1.00 23.44 H new ATOM 0 HE2 LYS B 181 6.146 2.233 -6.121 1.00 14.41 H new ATOM 0 HE3 LYS B 181 4.623 3.071 -5.898 1.00 14.41 H new ATOM 0 HZ1 LYS B 181 4.807 0.498 -5.593 1.00 61.25 H new ATOM 0 HZ2 LYS B 181 3.414 1.190 -6.273 1.00 61.25 H new ATOM 0 HZ3 LYS B 181 4.583 0.476 -7.276 1.00 61.25 H new ATOM 2691 N ASP B 182 1.200 1.745 -9.782 1.00 64.14 N ATOM 2692 CA ASP B 182 0.759 0.358 -9.741 1.00 43.43 C ATOM 2693 C ASP B 182 -0.295 0.051 -10.801 1.00 63.21 C ATOM 2694 O ASP B 182 -0.397 -1.086 -11.265 1.00 52.33 O ATOM 2695 CB ASP B 182 0.231 0.012 -8.351 1.00 63.34 C ATOM 2696 CG ASP B 182 1.352 -0.210 -7.357 1.00 32.22 C ATOM 2697 OD1 ASP B 182 1.793 0.766 -6.718 1.00 13.14 O ATOM 2698 OD2 ASP B 182 1.801 -1.368 -7.218 1.00 30.54 O ATOM 0 H ASP B 182 0.854 2.321 -9.014 1.00 64.14 H new ATOM 0 HA ASP B 182 1.627 -0.263 -9.963 1.00 43.43 H new ATOM 0 HB2 ASP B 182 -0.413 0.817 -7.997 1.00 63.34 H new ATOM 0 HB3 ASP B 182 -0.384 -0.886 -8.410 1.00 63.34 H new ATOM 2703 N VAL B 183 -1.074 1.052 -11.185 1.00 41.35 N ATOM 2704 CA VAL B 183 -2.102 0.854 -12.203 1.00 43.04 C ATOM 2705 C VAL B 183 -1.760 1.608 -13.483 1.00 25.21 C ATOM 2706 O VAL B 183 -2.344 1.359 -14.538 1.00 2.25 O ATOM 2707 CB VAL B 183 -3.500 1.289 -11.706 1.00 51.52 C ATOM 2708 CG1 VAL B 183 -3.957 0.394 -10.567 1.00 13.24 C ATOM 2709 CG2 VAL B 183 -3.502 2.750 -11.278 1.00 31.23 C ATOM 0 H VAL B 183 -1.017 2.000 -10.814 1.00 41.35 H new ATOM 0 HA VAL B 183 -2.130 -0.215 -12.413 1.00 43.04 H new ATOM 0 HB VAL B 183 -4.202 1.185 -12.533 1.00 51.52 H new ATOM 0 HG11 VAL B 183 -4.943 0.712 -10.227 1.00 13.24 H new ATOM 0 HG12 VAL B 183 -4.008 -0.638 -10.913 1.00 13.24 H new ATOM 0 HG13 VAL B 183 -3.248 0.465 -9.742 1.00 13.24 H new ATOM 0 HG21 VAL B 183 -4.498 3.027 -10.934 1.00 31.23 H new ATOM 0 HG22 VAL B 183 -2.786 2.893 -10.469 1.00 31.23 H new ATOM 0 HG23 VAL B 183 -3.223 3.378 -12.125 1.00 31.23 H new ATOM 2719 N LEU B 184 -0.804 2.520 -13.385 1.00 31.14 N ATOM 2720 CA LEU B 184 -0.398 3.337 -14.519 1.00 44.23 C ATOM 2721 C LEU B 184 1.115 3.273 -14.697 1.00 22.04 C ATOM 2722 O LEU B 184 1.860 3.649 -13.793 1.00 52.54 O ATOM 2723 CB LEU B 184 -0.834 4.791 -14.304 1.00 70.10 C ATOM 2724 CG LEU B 184 -2.321 4.992 -14.005 1.00 42.20 C ATOM 2725 CD1 LEU B 184 -2.591 6.423 -13.581 1.00 54.40 C ATOM 2726 CD2 LEU B 184 -3.172 4.633 -15.215 1.00 32.33 C ATOM 0 H LEU B 184 -0.291 2.714 -12.525 1.00 31.14 H new ATOM 0 HA LEU B 184 -0.878 2.951 -15.418 1.00 44.23 H new ATOM 0 HB2 LEU B 184 -0.255 5.208 -13.480 1.00 70.10 H new ATOM 0 HB3 LEU B 184 -0.579 5.365 -15.195 1.00 70.10 H new ATOM 0 HG LEU B 184 -2.592 4.327 -13.185 1.00 42.20 H new ATOM 0 HD11 LEU B 184 -3.654 6.546 -13.373 1.00 54.40 H new ATOM 0 HD12 LEU B 184 -2.016 6.651 -12.683 1.00 54.40 H new ATOM 0 HD13 LEU B 184 -2.297 7.101 -14.382 1.00 54.40 H new ATOM 0 HD21 LEU B 184 -4.225 4.784 -14.977 1.00 32.33 H new ATOM 0 HD22 LEU B 184 -2.895 5.269 -16.056 1.00 32.33 H new ATOM 0 HD23 LEU B 184 -3.006 3.589 -15.479 1.00 32.33 H new