USER MOD reduce.3.24.130724 H: found=0, std=0, add=854, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 854 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 132 ASN : amide:sc= -3.42! C(o=-3.1!,f=-8.2!) USER MOD Set 1.2: A 134 THR OG1 : rot -4:sc= 0.359 USER MOD Set 2.1: A 79 MET CE :methyl 146:sc= -1.73! (180deg=-2.98!) USER MOD Set 2.2: A 117 GLN : amide:sc= -1.33 K(o=-10,f=-4.4) USER MOD Set 2.3: A 118 ASN : amide:sc= -6.99! C(o=-10!,f=-4.4!) USER MOD Set 3.1: A 56 ASN : amide:sc= 0.893 K(o=0.91,f=-4.3!) USER MOD Set 3.2: A 58 SER OG : rot -68:sc= 0.0195 USER MOD Single : A 33 HIS : no HD1:sc= -0.0153 X(o=-0.015,f=-0.087) USER MOD Single : A 36 THR OG1 : rot 100:sc= -0.269 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0025) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= -1.58 K(o=-1.6,f=-0.35) USER MOD Single : A 62 GLN : amide:sc= -2.22 X(o=-2.2,f=-1.9) USER MOD Single : A 63 SER OG : rot 23:sc= 0.266 USER MOD Single : A 64 MET CE :methyl -154:sc= -0.582 (180deg=-1.48!) USER MOD Single : A 66 ASN : amide:sc= -3.07! K(o=-3.1!,f=-1.7) USER MOD Single : A 68 GLN : amide:sc= -2.08! C(o=-2.1!,f=-4.9!) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 ASN : amide:sc= -3.29 K(o=-3.3,f=-13!) USER MOD Single : A 80 THR OG1 : rot 150:sc= -0.0859 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 16:sc= 0.218 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 GLN : amide:sc= -2.34 K(o=-2.3,f=-0.71) USER MOD Single : A 96 THR OG1 : rot 180:sc= -1.19 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 37:sc= 0.418 USER MOD Single : A 106 HIS : no HD1:sc= -5.31! C(o=-5.3!,f=-9.2!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot -38:sc= 0.495 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot -42:sc= 0.988 USER MOD Single : A 124 SER OG : rot 180:sc= 0.00105 USER MOD Single : A 125 SER OG : rot 180:sc= -0.959 USER MOD Single : A 128 THR OG1 : rot -150:sc= -1.55! USER MOD Single : A 133 SER OG : rot 180:sc= -0.196 USER MOD Single : A 140 MET CE :methyl -143:sc= -0.0949 (180deg=-1) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 439 N HIS A 33 -5.957 5.161 8.195 1.00 0.00 N ATOM 440 CA HIS A 33 -5.161 5.176 9.410 1.00 0.00 C ATOM 441 C HIS A 33 -4.156 4.023 9.380 1.00 0.00 C ATOM 442 O HIS A 33 -4.373 2.988 10.008 1.00 0.00 O ATOM 443 CB HIS A 33 -6.060 5.146 10.649 1.00 0.00 C ATOM 444 CG HIS A 33 -6.840 6.419 10.872 1.00 0.00 C ATOM 445 ND1 HIS A 33 -6.248 7.670 10.878 1.00 0.00 N ATOM 446 CD2 HIS A 33 -8.170 6.621 11.096 1.00 0.00 C ATOM 447 CE1 HIS A 33 -7.189 8.577 11.097 1.00 0.00 C ATOM 448 NE2 HIS A 33 -8.379 7.925 11.233 1.00 0.00 N ATOM 0 HA HIS A 33 -4.594 6.105 9.466 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -6.759 4.315 10.558 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -5.445 4.950 11.527 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -8.925 5.851 11.152 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -7.040 9.645 11.157 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -9.281 8.366 11.411 1.00 0.00 H new ATOM 456 N ALA A 34 -3.077 4.241 8.642 1.00 0.00 N ATOM 457 CA ALA A 34 -2.037 3.233 8.521 1.00 0.00 C ATOM 458 C ALA A 34 -0.848 3.626 9.399 1.00 0.00 C ATOM 459 O ALA A 34 -0.685 4.795 9.743 1.00 0.00 O ATOM 460 CB ALA A 34 -1.649 3.075 7.049 1.00 0.00 C ATOM 0 H ALA A 34 -2.901 5.101 8.122 1.00 0.00 H new ATOM 0 HA ALA A 34 -2.397 2.265 8.869 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -0.869 2.319 6.957 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -2.522 2.767 6.474 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -1.279 4.026 6.666 1.00 0.00 H new ATOM 466 N ARG A 35 -0.047 2.625 9.737 1.00 0.00 N ATOM 467 CA ARG A 35 1.122 2.851 10.569 1.00 0.00 C ATOM 468 C ARG A 35 2.153 1.743 10.347 1.00 0.00 C ATOM 469 O ARG A 35 2.027 0.653 10.904 1.00 0.00 O ATOM 470 CB ARG A 35 0.744 2.898 12.051 1.00 0.00 C ATOM 471 CG ARG A 35 0.537 4.340 12.519 1.00 0.00 C ATOM 472 CD ARG A 35 -0.927 4.593 12.883 1.00 0.00 C ATOM 473 NE ARG A 35 -1.015 5.638 13.928 1.00 0.00 N ATOM 474 CZ ARG A 35 -1.039 6.954 13.674 1.00 0.00 C ATOM 475 NH1 ARG A 35 -0.982 7.393 12.409 1.00 0.00 N ATOM 476 NH2 ARG A 35 -1.120 7.830 14.685 1.00 0.00 N ATOM 0 H ARG A 35 -0.185 1.656 9.449 1.00 0.00 H new ATOM 0 HA ARG A 35 1.550 3.813 10.285 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -0.168 2.324 12.216 1.00 0.00 H new ATOM 0 HB3 ARG A 35 1.528 2.428 12.645 1.00 0.00 H new ATOM 0 HG2 ARG A 35 1.170 4.540 13.383 1.00 0.00 H new ATOM 0 HG3 ARG A 35 0.844 5.029 11.732 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -1.482 4.904 11.998 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -1.386 3.671 13.239 1.00 0.00 H new ATOM 0 HE ARG A 35 -1.060 5.338 14.902 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -0.920 6.726 11.640 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -1.000 8.394 12.215 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -1.163 7.495 15.648 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -1.138 8.831 14.492 1.00 0.00 H new ATOM 490 N THR A 36 3.150 2.059 9.534 1.00 0.00 N ATOM 491 CA THR A 36 4.202 1.104 9.232 1.00 0.00 C ATOM 492 C THR A 36 5.213 1.043 10.379 1.00 0.00 C ATOM 493 O THR A 36 5.451 2.043 11.054 1.00 0.00 O ATOM 494 CB THR A 36 4.827 1.496 7.891 1.00 0.00 C ATOM 495 OG1 THR A 36 4.133 0.696 6.938 1.00 0.00 O ATOM 496 CG2 THR A 36 6.283 1.042 7.769 1.00 0.00 C ATOM 0 H THR A 36 3.251 2.964 9.075 1.00 0.00 H new ATOM 0 HA THR A 36 3.803 0.094 9.138 1.00 0.00 H new ATOM 0 HB THR A 36 4.772 2.578 7.767 1.00 0.00 H new ATOM 0 HG1 THR A 36 3.438 1.233 6.504 1.00 0.00 H new ATOM 0 HG21 THR A 36 6.679 1.345 6.800 1.00 0.00 H new ATOM 0 HG22 THR A 36 6.875 1.500 8.562 1.00 0.00 H new ATOM 0 HG23 THR A 36 6.335 -0.043 7.859 1.00 0.00 H new ATOM 504 N SER A 37 5.781 -0.139 10.563 1.00 0.00 N ATOM 505 CA SER A 37 6.761 -0.343 11.617 1.00 0.00 C ATOM 506 C SER A 37 7.663 -1.529 11.270 1.00 0.00 C ATOM 507 O SER A 37 7.440 -2.642 11.743 1.00 0.00 O ATOM 508 CB SER A 37 6.078 -0.572 12.967 1.00 0.00 C ATOM 509 OG SER A 37 6.723 0.141 14.019 1.00 0.00 O ATOM 0 H SER A 37 5.582 -0.966 10.000 1.00 0.00 H new ATOM 0 HA SER A 37 7.370 0.557 11.697 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.036 -0.260 12.903 1.00 0.00 H new ATOM 0 HB3 SER A 37 6.078 -1.637 13.198 1.00 0.00 H new ATOM 0 HG SER A 37 6.257 -0.030 14.864 1.00 0.00 H new ATOM 515 N GLY A 38 8.663 -1.250 10.446 1.00 0.00 N ATOM 516 CA GLY A 38 9.599 -2.280 10.031 1.00 0.00 C ATOM 517 C GLY A 38 10.289 -1.898 8.719 1.00 0.00 C ATOM 518 O GLY A 38 10.747 -0.767 8.562 1.00 0.00 O ATOM 0 H GLY A 38 8.845 -0.326 10.055 1.00 0.00 H new ATOM 0 HA2 GLY A 38 10.347 -2.431 10.809 1.00 0.00 H new ATOM 0 HA3 GLY A 38 9.072 -3.226 9.907 1.00 0.00 H new ATOM 522 N ARG A 39 10.340 -2.862 7.812 1.00 0.00 N ATOM 523 CA ARG A 39 10.965 -2.640 6.519 1.00 0.00 C ATOM 524 C ARG A 39 9.902 -2.564 5.421 1.00 0.00 C ATOM 525 O ARG A 39 9.992 -1.729 4.523 1.00 0.00 O ATOM 526 CB ARG A 39 11.953 -3.760 6.186 1.00 0.00 C ATOM 527 CG ARG A 39 13.241 -3.614 6.999 1.00 0.00 C ATOM 528 CD ARG A 39 14.383 -4.411 6.364 1.00 0.00 C ATOM 529 NE ARG A 39 14.790 -5.515 7.262 1.00 0.00 N ATOM 530 CZ ARG A 39 15.950 -6.177 7.160 1.00 0.00 C ATOM 531 NH1 ARG A 39 16.826 -5.850 6.200 1.00 0.00 N ATOM 532 NH2 ARG A 39 16.236 -7.166 8.019 1.00 0.00 N ATOM 0 H ARG A 39 9.959 -3.799 7.947 1.00 0.00 H new ATOM 0 HA ARG A 39 11.507 -1.696 6.570 1.00 0.00 H new ATOM 0 HB2 ARG A 39 11.495 -4.727 6.394 1.00 0.00 H new ATOM 0 HB3 ARG A 39 12.186 -3.740 5.121 1.00 0.00 H new ATOM 0 HG2 ARG A 39 13.518 -2.562 7.062 1.00 0.00 H new ATOM 0 HG3 ARG A 39 13.073 -3.961 8.019 1.00 0.00 H new ATOM 0 HD2 ARG A 39 14.066 -4.812 5.401 1.00 0.00 H new ATOM 0 HD3 ARG A 39 15.232 -3.755 6.172 1.00 0.00 H new ATOM 0 HE ARG A 39 14.147 -5.789 8.005 1.00 0.00 H new ATOM 0 HH11 ARG A 39 16.609 -5.097 5.547 1.00 0.00 H new ATOM 0 HH12 ARG A 39 17.709 -6.354 6.122 1.00 0.00 H new ATOM 0 HH21 ARG A 39 15.570 -7.415 8.751 1.00 0.00 H new ATOM 0 HH22 ARG A 39 17.119 -7.670 7.941 1.00 0.00 H new ATOM 546 N VAL A 40 8.921 -3.447 5.530 1.00 0.00 N ATOM 547 CA VAL A 40 7.842 -3.490 4.558 1.00 0.00 C ATOM 548 C VAL A 40 6.696 -2.595 5.034 1.00 0.00 C ATOM 549 O VAL A 40 6.429 -2.507 6.231 1.00 0.00 O ATOM 550 CB VAL A 40 7.410 -4.938 4.319 1.00 0.00 C ATOM 551 CG1 VAL A 40 6.296 -5.013 3.273 1.00 0.00 C ATOM 552 CG2 VAL A 40 8.603 -5.806 3.913 1.00 0.00 C ATOM 0 H VAL A 40 8.851 -4.138 6.277 1.00 0.00 H new ATOM 0 HA VAL A 40 8.179 -3.103 3.596 1.00 0.00 H new ATOM 0 HB VAL A 40 7.015 -5.329 5.257 1.00 0.00 H new ATOM 0 HG11 VAL A 40 6.008 -6.053 3.122 1.00 0.00 H new ATOM 0 HG12 VAL A 40 5.433 -4.444 3.619 1.00 0.00 H new ATOM 0 HG13 VAL A 40 6.652 -4.595 2.331 1.00 0.00 H new ATOM 0 HG21 VAL A 40 8.269 -6.830 3.749 1.00 0.00 H new ATOM 0 HG22 VAL A 40 9.041 -5.416 2.994 1.00 0.00 H new ATOM 0 HG23 VAL A 40 9.351 -5.791 4.706 1.00 0.00 H new ATOM 562 N ALA A 41 6.049 -1.954 4.071 1.00 0.00 N ATOM 563 CA ALA A 41 4.938 -1.069 4.377 1.00 0.00 C ATOM 564 C ALA A 41 3.772 -1.377 3.436 1.00 0.00 C ATOM 565 O ALA A 41 3.981 -1.689 2.264 1.00 0.00 O ATOM 566 CB ALA A 41 5.401 0.386 4.276 1.00 0.00 C ATOM 0 H ALA A 41 6.273 -2.030 3.079 1.00 0.00 H new ATOM 0 HA ALA A 41 4.589 -1.230 5.397 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.567 1.050 4.506 1.00 0.00 H new ATOM 0 HB2 ALA A 41 6.210 0.561 4.985 1.00 0.00 H new ATOM 0 HB3 ALA A 41 5.756 0.586 3.265 1.00 0.00 H new ATOM 572 N VAL A 42 2.569 -1.279 3.983 1.00 0.00 N ATOM 573 CA VAL A 42 1.370 -1.544 3.206 1.00 0.00 C ATOM 574 C VAL A 42 1.168 -0.419 2.189 1.00 0.00 C ATOM 575 O VAL A 42 0.484 0.563 2.471 1.00 0.00 O ATOM 576 CB VAL A 42 0.172 -1.727 4.140 1.00 0.00 C ATOM 577 CG1 VAL A 42 -1.104 -2.014 3.345 1.00 0.00 C ATOM 578 CG2 VAL A 42 0.439 -2.831 5.165 1.00 0.00 C ATOM 0 H VAL A 42 2.399 -1.020 4.955 1.00 0.00 H new ATOM 0 HA VAL A 42 1.475 -2.474 2.646 1.00 0.00 H new ATOM 0 HB VAL A 42 0.026 -0.794 4.684 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -1.940 -2.140 4.032 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -1.309 -1.181 2.673 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -0.972 -2.926 2.763 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -0.428 -2.940 5.816 1.00 0.00 H new ATOM 0 HG22 VAL A 42 0.624 -3.772 4.647 1.00 0.00 H new ATOM 0 HG23 VAL A 42 1.311 -2.569 5.764 1.00 0.00 H new ATOM 588 N GLU A 43 1.777 -0.601 1.026 1.00 0.00 N ATOM 589 CA GLU A 43 1.673 0.386 -0.036 1.00 0.00 C ATOM 590 C GLU A 43 0.246 0.935 -0.112 1.00 0.00 C ATOM 591 O GLU A 43 0.013 2.107 0.178 1.00 0.00 O ATOM 592 CB GLU A 43 2.105 -0.205 -1.379 1.00 0.00 C ATOM 593 CG GLU A 43 2.481 0.899 -2.368 1.00 0.00 C ATOM 594 CD GLU A 43 1.236 1.634 -2.870 1.00 0.00 C ATOM 595 OE1 GLU A 43 0.660 1.156 -3.871 1.00 0.00 O ATOM 596 OE2 GLU A 43 0.889 2.657 -2.241 1.00 0.00 O ATOM 0 H GLU A 43 2.344 -1.417 0.796 1.00 0.00 H new ATOM 0 HA GLU A 43 2.348 1.211 0.194 1.00 0.00 H new ATOM 0 HB2 GLU A 43 2.955 -0.870 -1.231 1.00 0.00 H new ATOM 0 HB3 GLU A 43 1.296 -0.808 -1.792 1.00 0.00 H new ATOM 0 HG2 GLU A 43 3.157 1.607 -1.888 1.00 0.00 H new ATOM 0 HG3 GLU A 43 3.018 0.468 -3.213 1.00 0.00 H new ATOM 603 N GLU A 44 -0.670 0.062 -0.503 1.00 0.00 N ATOM 604 CA GLU A 44 -2.066 0.444 -0.621 1.00 0.00 C ATOM 605 C GLU A 44 -2.961 -0.797 -0.590 1.00 0.00 C ATOM 606 O GLU A 44 -2.698 -1.774 -1.290 1.00 0.00 O ATOM 607 CB GLU A 44 -2.306 1.261 -1.893 1.00 0.00 C ATOM 608 CG GLU A 44 -3.785 1.623 -2.042 1.00 0.00 C ATOM 609 CD GLU A 44 -4.067 3.018 -1.481 1.00 0.00 C ATOM 610 OE1 GLU A 44 -3.144 3.858 -1.556 1.00 0.00 O ATOM 611 OE2 GLU A 44 -5.199 3.214 -0.989 1.00 0.00 O ATOM 0 H GLU A 44 -0.472 -0.910 -0.742 1.00 0.00 H new ATOM 0 HA GLU A 44 -2.322 1.074 0.230 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -1.707 2.171 -1.863 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -1.978 0.691 -2.763 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -4.068 1.586 -3.094 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -4.398 0.887 -1.521 1.00 0.00 H new ATOM 618 N VAL A 45 -4.000 -0.717 0.228 1.00 0.00 N ATOM 619 CA VAL A 45 -4.935 -1.822 0.359 1.00 0.00 C ATOM 620 C VAL A 45 -6.339 -1.344 -0.018 1.00 0.00 C ATOM 621 O VAL A 45 -6.932 -0.530 0.688 1.00 0.00 O ATOM 622 CB VAL A 45 -4.862 -2.404 1.772 1.00 0.00 C ATOM 623 CG1 VAL A 45 -6.128 -3.196 2.105 1.00 0.00 C ATOM 624 CG2 VAL A 45 -3.612 -3.270 1.944 1.00 0.00 C ATOM 0 H VAL A 45 -4.215 0.095 0.806 1.00 0.00 H new ATOM 0 HA VAL A 45 -4.671 -2.629 -0.325 1.00 0.00 H new ATOM 0 HB VAL A 45 -4.793 -1.573 2.474 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -6.050 -3.599 3.115 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -6.995 -2.539 2.042 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.242 -4.015 1.395 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -3.584 -3.672 2.957 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -3.637 -4.092 1.228 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -2.723 -2.664 1.769 1.00 0.00 H new ATOM 634 N ASP A 46 -6.829 -1.870 -1.131 1.00 0.00 N ATOM 635 CA ASP A 46 -8.152 -1.507 -1.610 1.00 0.00 C ATOM 636 C ASP A 46 -9.172 -1.720 -0.490 1.00 0.00 C ATOM 637 O ASP A 46 -9.353 -2.840 -0.014 1.00 0.00 O ATOM 638 CB ASP A 46 -8.565 -2.378 -2.798 1.00 0.00 C ATOM 639 CG ASP A 46 -9.739 -1.839 -3.618 1.00 0.00 C ATOM 640 OD1 ASP A 46 -10.597 -1.167 -3.007 1.00 0.00 O ATOM 641 OD2 ASP A 46 -9.750 -2.110 -4.838 1.00 0.00 O ATOM 0 H ASP A 46 -6.334 -2.544 -1.715 1.00 0.00 H new ATOM 0 HA ASP A 46 -8.123 -0.463 -1.921 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -7.705 -2.498 -3.457 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -8.824 -3.370 -2.429 1.00 0.00 H new ATOM 646 N GLU A 47 -9.813 -0.627 -0.101 1.00 0.00 N ATOM 647 CA GLU A 47 -10.810 -0.680 0.954 1.00 0.00 C ATOM 648 C GLU A 47 -11.870 -1.734 0.630 1.00 0.00 C ATOM 649 O GLU A 47 -12.354 -2.428 1.523 1.00 0.00 O ATOM 650 CB GLU A 47 -11.450 0.692 1.173 1.00 0.00 C ATOM 651 CG GLU A 47 -11.877 1.316 -0.157 1.00 0.00 C ATOM 652 CD GLU A 47 -12.856 2.471 0.069 1.00 0.00 C ATOM 653 OE1 GLU A 47 -12.444 3.441 0.741 1.00 0.00 O ATOM 654 OE2 GLU A 47 -13.994 2.357 -0.436 1.00 0.00 O ATOM 0 H GLU A 47 -9.661 0.300 -0.498 1.00 0.00 H new ATOM 0 HA GLU A 47 -10.314 -0.965 1.882 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -12.316 0.593 1.827 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.743 1.351 1.678 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -10.999 1.678 -0.692 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -12.343 0.557 -0.786 1.00 0.00 H new ATOM 661 N GLU A 48 -12.200 -1.821 -0.650 1.00 0.00 N ATOM 662 CA GLU A 48 -13.195 -2.779 -1.103 1.00 0.00 C ATOM 663 C GLU A 48 -12.722 -4.207 -0.824 1.00 0.00 C ATOM 664 O GLU A 48 -13.536 -5.120 -0.695 1.00 0.00 O ATOM 665 CB GLU A 48 -13.506 -2.585 -2.588 1.00 0.00 C ATOM 666 CG GLU A 48 -14.280 -1.287 -2.822 1.00 0.00 C ATOM 667 CD GLU A 48 -15.123 -1.372 -4.095 1.00 0.00 C ATOM 668 OE1 GLU A 48 -16.150 -2.084 -4.050 1.00 0.00 O ATOM 669 OE2 GLU A 48 -14.723 -0.724 -5.086 1.00 0.00 O ATOM 0 H GLU A 48 -11.796 -1.244 -1.388 1.00 0.00 H new ATOM 0 HA GLU A 48 -14.117 -2.607 -0.547 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -12.577 -2.566 -3.158 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -14.088 -3.431 -2.955 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -14.926 -1.085 -1.967 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -13.583 -0.453 -2.899 1.00 0.00 H new ATOM 676 N GLY A 49 -11.408 -4.355 -0.737 1.00 0.00 N ATOM 677 CA GLY A 49 -10.817 -5.657 -0.476 1.00 0.00 C ATOM 678 C GLY A 49 -10.592 -6.429 -1.777 1.00 0.00 C ATOM 679 O GLY A 49 -10.691 -7.654 -1.802 1.00 0.00 O ATOM 0 H GLY A 49 -10.736 -3.595 -0.843 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -9.868 -5.531 0.045 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -11.469 -6.230 0.183 1.00 0.00 H new ATOM 683 N LYS A 50 -10.293 -5.679 -2.828 1.00 0.00 N ATOM 684 CA LYS A 50 -10.052 -6.277 -4.130 1.00 0.00 C ATOM 685 C LYS A 50 -8.645 -6.877 -4.159 1.00 0.00 C ATOM 686 O LYS A 50 -8.451 -7.993 -4.639 1.00 0.00 O ATOM 687 CB LYS A 50 -10.311 -5.260 -5.243 1.00 0.00 C ATOM 688 CG LYS A 50 -11.681 -5.486 -5.885 1.00 0.00 C ATOM 689 CD LYS A 50 -11.621 -5.265 -7.398 1.00 0.00 C ATOM 690 CE LYS A 50 -12.212 -3.906 -7.778 1.00 0.00 C ATOM 691 NZ LYS A 50 -13.690 -3.950 -7.724 1.00 0.00 N ATOM 0 H LYS A 50 -10.212 -4.662 -2.804 1.00 0.00 H new ATOM 0 HA LYS A 50 -10.750 -7.095 -4.309 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -10.258 -4.250 -4.837 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -9.532 -5.340 -6.002 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -12.022 -6.500 -5.675 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -12.410 -4.807 -5.443 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -10.587 -5.323 -7.737 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -12.168 -6.059 -7.907 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -11.840 -3.139 -7.099 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -11.887 -3.629 -8.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -14.076 -3.035 -8.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -14.038 -4.703 -8.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -13.996 -4.143 -6.749 1.00 0.00 H new ATOM 705 N PHE A 51 -7.699 -6.109 -3.640 1.00 0.00 N ATOM 706 CA PHE A 51 -6.315 -6.550 -3.600 1.00 0.00 C ATOM 707 C PHE A 51 -5.529 -5.794 -2.527 1.00 0.00 C ATOM 708 O PHE A 51 -5.943 -4.722 -2.088 1.00 0.00 O ATOM 709 CB PHE A 51 -5.708 -6.243 -4.971 1.00 0.00 C ATOM 710 CG PHE A 51 -5.604 -4.750 -5.285 1.00 0.00 C ATOM 711 CD1 PHE A 51 -4.511 -4.045 -4.885 1.00 0.00 C ATOM 712 CD2 PHE A 51 -6.603 -4.126 -5.964 1.00 0.00 C ATOM 713 CE1 PHE A 51 -4.414 -2.659 -5.176 1.00 0.00 C ATOM 714 CE2 PHE A 51 -6.506 -2.739 -6.255 1.00 0.00 C ATOM 715 CZ PHE A 51 -5.414 -2.035 -5.855 1.00 0.00 C ATOM 0 H PHE A 51 -7.863 -5.184 -3.243 1.00 0.00 H new ATOM 0 HA PHE A 51 -6.270 -7.613 -3.364 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -4.713 -6.685 -5.024 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -6.312 -6.724 -5.740 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -3.717 -4.540 -4.346 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -7.471 -4.685 -6.282 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -3.546 -2.100 -4.858 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -7.300 -2.244 -6.794 1.00 0.00 H new ATOM 0 HZ PHE A 51 -5.340 -0.980 -6.076 1.00 0.00 H new ATOM 725 N VAL A 52 -4.408 -6.382 -2.136 1.00 0.00 N ATOM 726 CA VAL A 52 -3.560 -5.777 -1.122 1.00 0.00 C ATOM 727 C VAL A 52 -2.161 -5.555 -1.700 1.00 0.00 C ATOM 728 O VAL A 52 -1.446 -6.513 -1.991 1.00 0.00 O ATOM 729 CB VAL A 52 -3.555 -6.642 0.140 1.00 0.00 C ATOM 730 CG1 VAL A 52 -2.455 -6.196 1.106 1.00 0.00 C ATOM 731 CG2 VAL A 52 -4.924 -6.624 0.822 1.00 0.00 C ATOM 0 H VAL A 52 -4.067 -7.271 -2.503 1.00 0.00 H new ATOM 0 HA VAL A 52 -3.950 -4.802 -0.830 1.00 0.00 H new ATOM 0 HB VAL A 52 -3.343 -7.669 -0.158 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -2.473 -6.827 1.995 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -1.484 -6.284 0.618 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -2.623 -5.158 1.394 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -4.893 -7.247 1.716 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -5.178 -5.601 1.100 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -5.677 -7.011 0.136 1.00 0.00 H new ATOM 741 N ARG A 53 -1.812 -4.286 -1.850 1.00 0.00 N ATOM 742 CA ARG A 53 -0.511 -3.926 -2.388 1.00 0.00 C ATOM 743 C ARG A 53 0.474 -3.644 -1.251 1.00 0.00 C ATOM 744 O ARG A 53 0.239 -2.764 -0.425 1.00 0.00 O ATOM 745 CB ARG A 53 -0.609 -2.691 -3.286 1.00 0.00 C ATOM 746 CG ARG A 53 -0.348 -3.056 -4.749 1.00 0.00 C ATOM 747 CD ARG A 53 0.623 -2.065 -5.396 1.00 0.00 C ATOM 748 NE ARG A 53 0.355 -1.969 -6.848 1.00 0.00 N ATOM 749 CZ ARG A 53 -0.467 -1.068 -7.402 1.00 0.00 C ATOM 750 NH1 ARG A 53 -1.106 -0.179 -6.629 1.00 0.00 N ATOM 751 NH2 ARG A 53 -0.650 -1.055 -8.730 1.00 0.00 N ATOM 0 H ARG A 53 -2.408 -3.494 -1.608 1.00 0.00 H new ATOM 0 HA ARG A 53 -0.154 -4.767 -2.983 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -1.599 -2.244 -3.190 1.00 0.00 H new ATOM 0 HB3 ARG A 53 0.112 -1.942 -2.960 1.00 0.00 H new ATOM 0 HG2 ARG A 53 0.062 -4.064 -4.809 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -1.289 -3.061 -5.300 1.00 0.00 H new ATOM 0 HD2 ARG A 53 0.517 -1.084 -4.933 1.00 0.00 H new ATOM 0 HD3 ARG A 53 1.651 -2.388 -5.228 1.00 0.00 H new ATOM 0 HE ARG A 53 0.826 -2.630 -7.466 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -0.966 -0.188 -5.619 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -1.732 0.507 -7.051 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -0.163 -1.731 -9.319 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -1.276 -0.369 -9.152 1.00 0.00 H new ATOM 765 N LEU A 54 1.556 -4.409 -1.246 1.00 0.00 N ATOM 766 CA LEU A 54 2.578 -4.253 -0.224 1.00 0.00 C ATOM 767 C LEU A 54 3.893 -3.835 -0.884 1.00 0.00 C ATOM 768 O LEU A 54 4.338 -4.464 -1.844 1.00 0.00 O ATOM 769 CB LEU A 54 2.690 -5.524 0.620 1.00 0.00 C ATOM 770 CG LEU A 54 1.528 -5.799 1.576 1.00 0.00 C ATOM 771 CD1 LEU A 54 1.476 -7.277 1.966 1.00 0.00 C ATOM 772 CD2 LEU A 54 1.599 -4.885 2.802 1.00 0.00 C ATOM 0 H LEU A 54 1.747 -5.138 -1.933 1.00 0.00 H new ATOM 0 HA LEU A 54 2.304 -3.460 0.471 1.00 0.00 H new ATOM 0 HB2 LEU A 54 2.790 -6.376 -0.053 1.00 0.00 H new ATOM 0 HB3 LEU A 54 3.609 -5.469 1.203 1.00 0.00 H new ATOM 0 HG LEU A 54 0.597 -5.571 1.057 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.641 -7.445 2.646 1.00 0.00 H new ATOM 0 HD12 LEU A 54 1.343 -7.885 1.071 1.00 0.00 H new ATOM 0 HD13 LEU A 54 2.407 -7.556 2.459 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.762 -5.101 3.466 1.00 0.00 H new ATOM 0 HD22 LEU A 54 2.536 -5.059 3.332 1.00 0.00 H new ATOM 0 HD23 LEU A 54 1.550 -3.844 2.483 1.00 0.00 H new ATOM 784 N ARG A 55 4.479 -2.777 -0.344 1.00 0.00 N ATOM 785 CA ARG A 55 5.735 -2.267 -0.869 1.00 0.00 C ATOM 786 C ARG A 55 6.809 -2.277 0.221 1.00 0.00 C ATOM 787 O ARG A 55 6.499 -2.136 1.403 1.00 0.00 O ATOM 788 CB ARG A 55 5.572 -0.843 -1.402 1.00 0.00 C ATOM 789 CG ARG A 55 6.926 -0.241 -1.781 1.00 0.00 C ATOM 790 CD ARG A 55 6.763 0.857 -2.834 1.00 0.00 C ATOM 791 NE ARG A 55 7.331 2.129 -2.332 1.00 0.00 N ATOM 792 CZ ARG A 55 8.639 2.419 -2.335 1.00 0.00 C ATOM 793 NH1 ARG A 55 9.522 1.532 -2.813 1.00 0.00 N ATOM 794 NH2 ARG A 55 9.064 3.598 -1.860 1.00 0.00 N ATOM 0 H ARG A 55 4.108 -2.258 0.452 1.00 0.00 H new ATOM 0 HA ARG A 55 6.039 -2.917 -1.690 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.916 -0.850 -2.273 1.00 0.00 H new ATOM 0 HB3 ARG A 55 5.092 -0.221 -0.647 1.00 0.00 H new ATOM 0 HG2 ARG A 55 7.406 0.170 -0.893 1.00 0.00 H new ATOM 0 HG3 ARG A 55 7.581 -1.023 -2.165 1.00 0.00 H new ATOM 0 HD2 ARG A 55 7.264 0.565 -3.757 1.00 0.00 H new ATOM 0 HD3 ARG A 55 5.708 0.990 -3.073 1.00 0.00 H new ATOM 0 HE ARG A 55 6.687 2.827 -1.961 1.00 0.00 H new ATOM 0 HH11 ARG A 55 9.199 0.635 -3.175 1.00 0.00 H new ATOM 0 HH12 ARG A 55 10.518 1.754 -2.815 1.00 0.00 H new ATOM 0 HH21 ARG A 55 8.392 4.274 -1.497 1.00 0.00 H new ATOM 0 HH22 ARG A 55 10.060 3.820 -1.862 1.00 0.00 H new ATOM 808 N ASN A 56 8.048 -2.444 -0.215 1.00 0.00 N ATOM 809 CA ASN A 56 9.169 -2.473 0.709 1.00 0.00 C ATOM 810 C ASN A 56 9.812 -1.086 0.769 1.00 0.00 C ATOM 811 O ASN A 56 9.899 -0.394 -0.244 1.00 0.00 O ATOM 812 CB ASN A 56 10.236 -3.469 0.249 1.00 0.00 C ATOM 813 CG ASN A 56 11.082 -3.951 1.429 1.00 0.00 C ATOM 814 OD1 ASN A 56 10.891 -3.553 2.566 1.00 0.00 O ATOM 815 ND2 ASN A 56 12.024 -4.829 1.097 1.00 0.00 N ATOM 0 H ASN A 56 8.301 -2.561 -1.196 1.00 0.00 H new ATOM 0 HA ASN A 56 8.792 -2.773 1.687 1.00 0.00 H new ATOM 0 HB2 ASN A 56 9.758 -4.322 -0.233 1.00 0.00 H new ATOM 0 HB3 ASN A 56 10.879 -3.000 -0.496 1.00 0.00 H new ATOM 0 HD21 ASN A 56 12.640 -5.211 1.814 1.00 0.00 H new ATOM 0 HD22 ASN A 56 12.130 -5.120 0.125 1.00 0.00 H new ATOM 822 N LYS A 57 10.245 -0.721 1.967 1.00 0.00 N ATOM 823 CA LYS A 57 10.877 0.571 2.172 1.00 0.00 C ATOM 824 C LYS A 57 12.367 0.366 2.453 1.00 0.00 C ATOM 825 O LYS A 57 13.177 1.258 2.205 1.00 0.00 O ATOM 826 CB LYS A 57 10.148 1.356 3.264 1.00 0.00 C ATOM 827 CG LYS A 57 8.651 1.454 2.963 1.00 0.00 C ATOM 828 CD LYS A 57 8.357 2.625 2.022 1.00 0.00 C ATOM 829 CE LYS A 57 7.380 2.210 0.920 1.00 0.00 C ATOM 830 NZ LYS A 57 6.280 3.194 0.806 1.00 0.00 N ATOM 0 H LYS A 57 10.171 -1.297 2.805 1.00 0.00 H new ATOM 0 HA LYS A 57 10.803 1.179 1.270 1.00 0.00 H new ATOM 0 HB2 LYS A 57 10.298 0.869 4.228 1.00 0.00 H new ATOM 0 HB3 LYS A 57 10.573 2.357 3.343 1.00 0.00 H new ATOM 0 HG2 LYS A 57 8.305 0.524 2.511 1.00 0.00 H new ATOM 0 HG3 LYS A 57 8.097 1.582 3.893 1.00 0.00 H new ATOM 0 HD2 LYS A 57 7.939 3.456 2.590 1.00 0.00 H new ATOM 0 HD3 LYS A 57 9.286 2.979 1.575 1.00 0.00 H new ATOM 0 HE2 LYS A 57 7.907 2.133 -0.031 1.00 0.00 H new ATOM 0 HE3 LYS A 57 6.972 1.223 1.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 5.626 2.898 0.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 5.767 3.248 1.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 6.673 4.129 0.575 1.00 0.00 H new ATOM 844 N SER A 58 12.683 -0.814 2.966 1.00 0.00 N ATOM 845 CA SER A 58 14.062 -1.147 3.283 1.00 0.00 C ATOM 846 C SER A 58 14.898 -1.187 2.002 1.00 0.00 C ATOM 847 O SER A 58 14.353 -1.155 0.900 1.00 0.00 O ATOM 848 CB SER A 58 14.150 -2.486 4.017 1.00 0.00 C ATOM 849 OG SER A 58 13.551 -3.543 3.273 1.00 0.00 O ATOM 0 H SER A 58 12.008 -1.551 3.170 1.00 0.00 H new ATOM 0 HA SER A 58 14.458 -0.375 3.943 1.00 0.00 H new ATOM 0 HB2 SER A 58 15.196 -2.726 4.210 1.00 0.00 H new ATOM 0 HB3 SER A 58 13.659 -2.401 4.986 1.00 0.00 H new ATOM 0 HG SER A 58 12.582 -3.403 3.228 1.00 0.00 H new ATOM 855 N ASN A 59 16.208 -1.258 2.191 1.00 0.00 N ATOM 856 CA ASN A 59 17.124 -1.303 1.064 1.00 0.00 C ATOM 857 C ASN A 59 17.663 -2.727 0.908 1.00 0.00 C ATOM 858 O ASN A 59 18.290 -3.050 -0.100 1.00 0.00 O ATOM 859 CB ASN A 59 18.315 -0.369 1.285 1.00 0.00 C ATOM 860 CG ASN A 59 18.860 -0.502 2.708 1.00 0.00 C ATOM 861 OD1 ASN A 59 18.665 0.352 3.558 1.00 0.00 O ATOM 862 ND2 ASN A 59 19.552 -1.618 2.920 1.00 0.00 N ATOM 0 H ASN A 59 16.656 -1.285 3.107 1.00 0.00 H new ATOM 0 HA ASN A 59 16.579 -0.989 0.174 1.00 0.00 H new ATOM 0 HB2 ASN A 59 19.102 -0.601 0.567 1.00 0.00 H new ATOM 0 HB3 ASN A 59 18.012 0.662 1.103 1.00 0.00 H new ATOM 0 HD21 ASN A 59 19.957 -1.800 3.838 1.00 0.00 H new ATOM 0 HD22 ASN A 59 19.678 -2.292 2.164 1.00 0.00 H new ATOM 869 N GLU A 60 17.400 -3.540 1.920 1.00 0.00 N ATOM 870 CA GLU A 60 17.850 -4.921 1.908 1.00 0.00 C ATOM 871 C GLU A 60 16.675 -5.860 1.629 1.00 0.00 C ATOM 872 O GLU A 60 15.657 -5.809 2.318 1.00 0.00 O ATOM 873 CB GLU A 60 18.542 -5.284 3.224 1.00 0.00 C ATOM 874 CG GLU A 60 20.055 -5.081 3.122 1.00 0.00 C ATOM 875 CD GLU A 60 20.698 -5.047 4.510 1.00 0.00 C ATOM 876 OE1 GLU A 60 20.740 -3.940 5.089 1.00 0.00 O ATOM 877 OE2 GLU A 60 21.132 -6.129 4.961 1.00 0.00 O ATOM 0 H GLU A 60 16.880 -3.268 2.755 1.00 0.00 H new ATOM 0 HA GLU A 60 18.581 -5.037 1.107 1.00 0.00 H new ATOM 0 HB2 GLU A 60 18.143 -4.669 4.031 1.00 0.00 H new ATOM 0 HB3 GLU A 60 18.327 -6.322 3.478 1.00 0.00 H new ATOM 0 HG2 GLU A 60 20.495 -5.886 2.533 1.00 0.00 H new ATOM 0 HG3 GLU A 60 20.266 -4.150 2.596 1.00 0.00 H new ATOM 884 N ASP A 61 16.855 -6.697 0.617 1.00 0.00 N ATOM 885 CA ASP A 61 15.822 -7.646 0.239 1.00 0.00 C ATOM 886 C ASP A 61 15.183 -8.228 1.501 1.00 0.00 C ATOM 887 O ASP A 61 15.882 -8.721 2.384 1.00 0.00 O ATOM 888 CB ASP A 61 16.409 -8.804 -0.571 1.00 0.00 C ATOM 889 CG ASP A 61 17.436 -8.398 -1.630 1.00 0.00 C ATOM 890 OD1 ASP A 61 18.299 -7.559 -1.291 1.00 0.00 O ATOM 891 OD2 ASP A 61 17.336 -8.935 -2.754 1.00 0.00 O ATOM 0 H ASP A 61 17.700 -6.737 0.048 1.00 0.00 H new ATOM 0 HA ASP A 61 15.085 -7.119 -0.366 1.00 0.00 H new ATOM 0 HB2 ASP A 61 16.878 -9.508 0.117 1.00 0.00 H new ATOM 0 HB3 ASP A 61 15.593 -9.334 -1.062 1.00 0.00 H new ATOM 896 N GLN A 62 13.861 -8.151 1.546 1.00 0.00 N ATOM 897 CA GLN A 62 13.120 -8.664 2.685 1.00 0.00 C ATOM 898 C GLN A 62 12.551 -10.049 2.369 1.00 0.00 C ATOM 899 O GLN A 62 11.899 -10.237 1.342 1.00 0.00 O ATOM 900 CB GLN A 62 12.009 -7.697 3.097 1.00 0.00 C ATOM 901 CG GLN A 62 11.144 -8.296 4.208 1.00 0.00 C ATOM 902 CD GLN A 62 12.002 -8.722 5.401 1.00 0.00 C ATOM 903 OE1 GLN A 62 12.742 -7.942 5.977 1.00 0.00 O ATOM 904 NE2 GLN A 62 11.862 -10.001 5.738 1.00 0.00 N ATOM 0 H GLN A 62 13.284 -7.741 0.812 1.00 0.00 H new ATOM 0 HA GLN A 62 13.806 -8.758 3.527 1.00 0.00 H new ATOM 0 HB2 GLN A 62 12.447 -6.759 3.438 1.00 0.00 H new ATOM 0 HB3 GLN A 62 11.387 -7.463 2.233 1.00 0.00 H new ATOM 0 HG2 GLN A 62 10.403 -7.565 4.531 1.00 0.00 H new ATOM 0 HG3 GLN A 62 10.596 -9.156 3.824 1.00 0.00 H new ATOM 0 HE21 GLN A 62 11.225 -10.600 5.213 1.00 0.00 H new ATOM 0 HE22 GLN A 62 12.392 -10.383 6.521 1.00 0.00 H new ATOM 913 N SER A 63 12.819 -10.984 3.269 1.00 0.00 N ATOM 914 CA SER A 63 12.342 -12.346 3.098 1.00 0.00 C ATOM 915 C SER A 63 10.978 -12.511 3.771 1.00 0.00 C ATOM 916 O SER A 63 10.833 -12.242 4.963 1.00 0.00 O ATOM 917 CB SER A 63 13.341 -13.354 3.669 1.00 0.00 C ATOM 918 OG SER A 63 13.597 -13.128 5.052 1.00 0.00 O ATOM 0 H SER A 63 13.360 -10.825 4.119 1.00 0.00 H new ATOM 0 HA SER A 63 12.239 -12.541 2.031 1.00 0.00 H new ATOM 0 HB2 SER A 63 12.955 -14.364 3.532 1.00 0.00 H new ATOM 0 HB3 SER A 63 14.276 -13.292 3.113 1.00 0.00 H new ATOM 0 HG SER A 63 12.847 -12.636 5.447 1.00 0.00 H new ATOM 924 N MET A 64 10.012 -12.952 2.979 1.00 0.00 N ATOM 925 CA MET A 64 8.665 -13.156 3.483 1.00 0.00 C ATOM 926 C MET A 64 8.263 -14.629 3.393 1.00 0.00 C ATOM 927 O MET A 64 7.158 -14.950 2.958 1.00 0.00 O ATOM 928 CB MET A 64 7.682 -12.308 2.672 1.00 0.00 C ATOM 929 CG MET A 64 8.263 -10.922 2.384 1.00 0.00 C ATOM 930 SD MET A 64 7.048 -9.665 2.746 1.00 0.00 S ATOM 931 CE MET A 64 5.659 -10.301 1.823 1.00 0.00 C ATOM 0 H MET A 64 10.136 -13.174 1.991 1.00 0.00 H new ATOM 0 HA MET A 64 8.640 -12.855 4.530 1.00 0.00 H new ATOM 0 HB2 MET A 64 7.450 -12.811 1.733 1.00 0.00 H new ATOM 0 HB3 MET A 64 6.745 -12.207 3.220 1.00 0.00 H new ATOM 0 HG2 MET A 64 9.157 -10.760 2.987 1.00 0.00 H new ATOM 0 HG3 MET A 64 8.567 -10.856 1.339 1.00 0.00 H new ATOM 0 HE1 MET A 64 4.998 -9.479 1.548 1.00 0.00 H new ATOM 0 HE2 MET A 64 6.018 -10.796 0.921 1.00 0.00 H new ATOM 0 HE3 MET A 64 5.112 -11.017 2.436 1.00 0.00 H new ATOM 941 N GLY A 65 9.182 -15.487 3.811 1.00 0.00 N ATOM 942 CA GLY A 65 8.937 -16.919 3.784 1.00 0.00 C ATOM 943 C GLY A 65 8.221 -17.378 5.055 1.00 0.00 C ATOM 944 O GLY A 65 8.724 -18.234 5.781 1.00 0.00 O ATOM 0 H GLY A 65 10.098 -15.218 4.170 1.00 0.00 H new ATOM 0 HA2 GLY A 65 8.334 -17.172 2.912 1.00 0.00 H new ATOM 0 HA3 GLY A 65 9.883 -17.451 3.683 1.00 0.00 H new ATOM 948 N ASN A 66 7.058 -16.787 5.286 1.00 0.00 N ATOM 949 CA ASN A 66 6.267 -17.124 6.458 1.00 0.00 C ATOM 950 C ASN A 66 5.371 -15.939 6.822 1.00 0.00 C ATOM 951 O ASN A 66 4.336 -16.112 7.463 1.00 0.00 O ATOM 952 CB ASN A 66 7.164 -17.425 7.660 1.00 0.00 C ATOM 953 CG ASN A 66 7.173 -18.922 7.977 1.00 0.00 C ATOM 954 OD1 ASN A 66 7.211 -19.340 9.123 1.00 0.00 O ATOM 955 ND2 ASN A 66 7.135 -19.703 6.901 1.00 0.00 N ATOM 0 H ASN A 66 6.644 -16.077 4.682 1.00 0.00 H new ATOM 0 HA ASN A 66 5.673 -18.007 6.221 1.00 0.00 H new ATOM 0 HB2 ASN A 66 8.180 -17.087 7.454 1.00 0.00 H new ATOM 0 HB3 ASN A 66 6.813 -16.868 8.529 1.00 0.00 H new ATOM 0 HD21 ASN A 66 7.137 -20.717 7.007 1.00 0.00 H new ATOM 0 HD22 ASN A 66 7.104 -19.287 5.970 1.00 0.00 H new ATOM 962 N TRP A 67 5.801 -14.760 6.396 1.00 0.00 N ATOM 963 CA TRP A 67 5.051 -13.546 6.669 1.00 0.00 C ATOM 964 C TRP A 67 3.571 -13.837 6.410 1.00 0.00 C ATOM 965 O TRP A 67 3.233 -14.831 5.769 1.00 0.00 O ATOM 966 CB TRP A 67 5.583 -12.375 5.841 1.00 0.00 C ATOM 967 CG TRP A 67 6.936 -11.842 6.316 1.00 0.00 C ATOM 968 CD1 TRP A 67 7.995 -12.542 6.744 1.00 0.00 C ATOM 969 CD2 TRP A 67 7.336 -10.457 6.393 1.00 0.00 C ATOM 970 NE1 TRP A 67 9.043 -11.714 7.091 1.00 0.00 N ATOM 971 CE2 TRP A 67 8.629 -10.406 6.870 1.00 0.00 C ATOM 972 CE3 TRP A 67 6.627 -9.286 6.070 1.00 0.00 C ATOM 973 CZ2 TRP A 67 9.327 -9.208 7.067 1.00 0.00 C ATOM 974 CZ3 TRP A 67 7.338 -8.097 6.273 1.00 0.00 C ATOM 975 CH2 TRP A 67 8.641 -8.029 6.752 1.00 0.00 C ATOM 0 H TRP A 67 6.660 -14.620 5.864 1.00 0.00 H new ATOM 0 HA TRP A 67 5.170 -13.245 7.710 1.00 0.00 H new ATOM 0 HB2 TRP A 67 5.673 -12.689 4.801 1.00 0.00 H new ATOM 0 HB3 TRP A 67 4.855 -11.564 5.867 1.00 0.00 H new ATOM 0 HD1 TRP A 67 8.025 -13.620 6.809 1.00 0.00 H new ATOM 0 HE1 TRP A 67 9.954 -12.008 7.444 1.00 0.00 H new ATOM 0 HE3 TRP A 67 5.614 -9.303 5.695 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 10.340 -9.194 7.442 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 6.839 -7.168 6.041 1.00 0.00 H new ATOM 0 HH2 TRP A 67 9.122 -7.071 6.881 1.00 0.00 H new ATOM 986 N GLN A 68 2.729 -12.952 6.923 1.00 0.00 N ATOM 987 CA GLN A 68 1.293 -13.102 6.756 1.00 0.00 C ATOM 988 C GLN A 68 0.610 -11.733 6.781 1.00 0.00 C ATOM 989 O GLN A 68 1.224 -10.736 7.159 1.00 0.00 O ATOM 990 CB GLN A 68 0.709 -14.025 7.828 1.00 0.00 C ATOM 991 CG GLN A 68 1.769 -14.996 8.352 1.00 0.00 C ATOM 992 CD GLN A 68 1.188 -15.911 9.432 1.00 0.00 C ATOM 993 OE1 GLN A 68 0.007 -16.216 9.453 1.00 0.00 O ATOM 994 NE2 GLN A 68 2.082 -16.330 10.323 1.00 0.00 N ATOM 0 H GLN A 68 3.013 -12.129 7.454 1.00 0.00 H new ATOM 0 HA GLN A 68 1.106 -13.563 5.786 1.00 0.00 H new ATOM 0 HB2 GLN A 68 0.318 -13.429 8.652 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -0.129 -14.585 7.413 1.00 0.00 H new ATOM 0 HG2 GLN A 68 2.155 -15.598 7.529 1.00 0.00 H new ATOM 0 HG3 GLN A 68 2.611 -14.436 8.759 1.00 0.00 H new ATOM 0 HE21 GLN A 68 3.056 -16.036 10.246 1.00 0.00 H new ATOM 0 HE22 GLN A 68 1.794 -16.946 11.084 1.00 0.00 H new ATOM 1003 N ILE A 69 -0.650 -11.728 6.373 1.00 0.00 N ATOM 1004 CA ILE A 69 -1.423 -10.498 6.344 1.00 0.00 C ATOM 1005 C ILE A 69 -2.736 -10.707 7.099 1.00 0.00 C ATOM 1006 O ILE A 69 -3.516 -11.597 6.762 1.00 0.00 O ATOM 1007 CB ILE A 69 -1.612 -10.018 4.903 1.00 0.00 C ATOM 1008 CG1 ILE A 69 -0.366 -10.304 4.062 1.00 0.00 C ATOM 1009 CG2 ILE A 69 -2.003 -8.539 4.864 1.00 0.00 C ATOM 1010 CD1 ILE A 69 -0.597 -9.934 2.596 1.00 0.00 C ATOM 0 H ILE A 69 -1.155 -12.557 6.060 1.00 0.00 H new ATOM 0 HA ILE A 69 -0.886 -9.699 6.855 1.00 0.00 H new ATOM 0 HB ILE A 69 -2.435 -10.580 4.461 1.00 0.00 H new ATOM 0 HG12 ILE A 69 0.479 -9.739 4.454 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -0.106 -11.360 4.138 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -2.131 -8.224 3.828 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -2.938 -8.395 5.405 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -1.219 -7.943 5.330 1.00 0.00 H new ATOM 0 HD11 ILE A 69 0.304 -10.147 2.021 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -1.427 -10.518 2.200 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -0.832 -8.872 2.521 1.00 0.00 H new ATOM 1022 N ARG A 70 -2.942 -9.873 8.108 1.00 0.00 N ATOM 1023 CA ARG A 70 -4.148 -9.955 8.914 1.00 0.00 C ATOM 1024 C ARG A 70 -5.235 -9.046 8.337 1.00 0.00 C ATOM 1025 O ARG A 70 -5.039 -7.838 8.216 1.00 0.00 O ATOM 1026 CB ARG A 70 -3.870 -9.551 10.363 1.00 0.00 C ATOM 1027 CG ARG A 70 -3.636 -10.782 11.241 1.00 0.00 C ATOM 1028 CD ARG A 70 -3.522 -10.390 12.716 1.00 0.00 C ATOM 1029 NE ARG A 70 -2.602 -11.314 13.415 1.00 0.00 N ATOM 1030 CZ ARG A 70 -2.897 -12.587 13.712 1.00 0.00 C ATOM 1031 NH1 ARG A 70 -4.090 -13.094 13.371 1.00 0.00 N ATOM 1032 NH2 ARG A 70 -2.001 -13.353 14.349 1.00 0.00 N ATOM 0 H ARG A 70 -2.293 -9.137 8.386 1.00 0.00 H new ATOM 0 HA ARG A 70 -4.489 -10.990 8.897 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -2.996 -8.901 10.402 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -4.711 -8.977 10.752 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -4.457 -11.487 11.111 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -2.725 -11.291 10.925 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -3.157 -9.366 12.802 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -4.505 -10.418 13.185 1.00 0.00 H new ATOM 0 HE ARG A 70 -1.685 -10.960 13.688 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -4.772 -12.511 12.886 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -4.316 -14.063 13.596 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -1.093 -12.967 14.608 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -2.227 -14.322 14.574 1.00 0.00 H new ATOM 1046 N ARG A 71 -6.358 -9.663 7.998 1.00 0.00 N ATOM 1047 CA ARG A 71 -7.476 -8.924 7.437 1.00 0.00 C ATOM 1048 C ARG A 71 -8.688 -9.009 8.367 1.00 0.00 C ATOM 1049 O ARG A 71 -9.273 -10.078 8.534 1.00 0.00 O ATOM 1050 CB ARG A 71 -7.860 -9.469 6.059 1.00 0.00 C ATOM 1051 CG ARG A 71 -9.056 -8.708 5.483 1.00 0.00 C ATOM 1052 CD ARG A 71 -8.742 -7.216 5.346 1.00 0.00 C ATOM 1053 NE ARG A 71 -9.557 -6.625 4.261 1.00 0.00 N ATOM 1054 CZ ARG A 71 -9.749 -5.309 4.097 1.00 0.00 C ATOM 1055 NH1 ARG A 71 -9.185 -4.439 4.947 1.00 0.00 N ATOM 1056 NH2 ARG A 71 -10.503 -4.863 3.084 1.00 0.00 N ATOM 0 H ARG A 71 -6.517 -10.665 8.101 1.00 0.00 H new ATOM 0 HA ARG A 71 -7.167 -7.884 7.331 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -7.010 -9.386 5.381 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -8.102 -10.529 6.138 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -9.318 -9.119 4.508 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -9.923 -8.843 6.129 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -8.948 -6.705 6.286 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -7.682 -7.077 5.133 1.00 0.00 H new ATOM 0 HE ARG A 71 -10.000 -7.259 3.596 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -8.610 -4.779 5.718 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -9.331 -3.437 4.823 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -10.931 -5.525 2.437 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -10.649 -3.861 2.959 1.00 0.00 H new ATOM 1070 N GLN A 72 -9.029 -7.868 8.948 1.00 0.00 N ATOM 1071 CA GLN A 72 -10.160 -7.800 9.857 1.00 0.00 C ATOM 1072 C GLN A 72 -11.078 -6.636 9.476 1.00 0.00 C ATOM 1073 O GLN A 72 -10.711 -5.473 9.641 1.00 0.00 O ATOM 1074 CB GLN A 72 -9.691 -7.677 11.308 1.00 0.00 C ATOM 1075 CG GLN A 72 -10.636 -8.421 12.254 1.00 0.00 C ATOM 1076 CD GLN A 72 -11.611 -7.454 12.928 1.00 0.00 C ATOM 1077 OE1 GLN A 72 -11.336 -6.880 13.969 1.00 0.00 O ATOM 1078 NE2 GLN A 72 -12.762 -7.306 12.279 1.00 0.00 N ATOM 0 H GLN A 72 -8.542 -6.983 8.807 1.00 0.00 H new ATOM 0 HA GLN A 72 -10.727 -8.727 9.771 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -8.683 -8.080 11.404 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -9.642 -6.625 11.590 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -11.193 -9.176 11.698 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -10.057 -8.947 13.013 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -12.928 -7.817 11.412 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -13.479 -6.682 12.648 1.00 0.00 H new ATOM 1087 N ASN A 73 -12.252 -6.989 8.975 1.00 0.00 N ATOM 1088 CA ASN A 73 -13.224 -5.988 8.570 1.00 0.00 C ATOM 1089 C ASN A 73 -14.565 -6.284 9.245 1.00 0.00 C ATOM 1090 O ASN A 73 -14.986 -7.437 9.319 1.00 0.00 O ATOM 1091 CB ASN A 73 -13.442 -6.013 7.056 1.00 0.00 C ATOM 1092 CG ASN A 73 -12.155 -6.399 6.324 1.00 0.00 C ATOM 1093 OD1 ASN A 73 -11.122 -5.764 6.453 1.00 0.00 O ATOM 1094 ND2 ASN A 73 -12.276 -7.474 5.550 1.00 0.00 N ATOM 0 H ASN A 73 -12.552 -7.954 8.840 1.00 0.00 H new ATOM 0 HA ASN A 73 -12.843 -5.010 8.864 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -14.232 -6.723 6.810 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -13.778 -5.033 6.717 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -11.474 -7.813 5.019 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -13.171 -7.959 5.487 1.00 0.00 H new ATOM 1146 N LEU A 78 -11.833 -12.973 10.778 1.00 0.00 N ATOM 1147 CA LEU A 78 -10.528 -12.418 10.463 1.00 0.00 C ATOM 1148 C LEU A 78 -9.707 -13.459 9.698 1.00 0.00 C ATOM 1149 O LEU A 78 -9.520 -14.578 10.172 1.00 0.00 O ATOM 1150 CB LEU A 78 -9.842 -11.906 11.731 1.00 0.00 C ATOM 1151 CG LEU A 78 -8.313 -11.856 11.694 1.00 0.00 C ATOM 1152 CD1 LEU A 78 -7.824 -10.732 10.780 1.00 0.00 C ATOM 1153 CD2 LEU A 78 -7.734 -11.741 13.105 1.00 0.00 C ATOM 0 HA LEU A 78 -10.631 -11.550 9.812 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -10.213 -10.903 11.941 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -10.145 -12.539 12.565 1.00 0.00 H new ATOM 0 HG LEU A 78 -7.950 -12.794 11.273 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -6.734 -10.718 10.771 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -8.193 -10.900 9.768 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -8.196 -9.776 11.148 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -6.646 -11.707 13.050 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -8.102 -10.830 13.576 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -8.041 -12.604 13.696 1.00 0.00 H new ATOM 1165 N MET A 79 -9.240 -13.053 8.526 1.00 0.00 N ATOM 1166 CA MET A 79 -8.444 -13.936 7.691 1.00 0.00 C ATOM 1167 C MET A 79 -6.972 -13.518 7.697 1.00 0.00 C ATOM 1168 O MET A 79 -6.655 -12.347 7.491 1.00 0.00 O ATOM 1169 CB MET A 79 -8.979 -13.902 6.258 1.00 0.00 C ATOM 1170 CG MET A 79 -10.458 -14.291 6.215 1.00 0.00 C ATOM 1171 SD MET A 79 -11.459 -12.852 5.880 1.00 0.00 S ATOM 1172 CE MET A 79 -10.987 -12.534 4.188 1.00 0.00 C ATOM 0 H MET A 79 -9.398 -12.124 8.135 1.00 0.00 H new ATOM 0 HA MET A 79 -8.516 -14.947 8.092 1.00 0.00 H new ATOM 0 HB2 MET A 79 -8.850 -12.903 5.842 1.00 0.00 H new ATOM 0 HB3 MET A 79 -8.402 -14.584 5.634 1.00 0.00 H new ATOM 0 HG2 MET A 79 -10.622 -15.045 5.445 1.00 0.00 H new ATOM 0 HG3 MET A 79 -10.753 -14.736 7.165 1.00 0.00 H new ATOM 0 HE1 MET A 79 -11.842 -12.138 3.640 1.00 0.00 H new ATOM 0 HE2 MET A 79 -10.174 -11.808 4.167 1.00 0.00 H new ATOM 0 HE3 MET A 79 -10.656 -13.462 3.722 1.00 0.00 H new ATOM 1182 N THR A 80 -6.113 -14.497 7.937 1.00 0.00 N ATOM 1183 CA THR A 80 -4.682 -14.245 7.973 1.00 0.00 C ATOM 1184 C THR A 80 -3.997 -14.891 6.767 1.00 0.00 C ATOM 1185 O THR A 80 -3.660 -16.073 6.799 1.00 0.00 O ATOM 1186 CB THR A 80 -4.148 -14.746 9.316 1.00 0.00 C ATOM 1187 OG1 THR A 80 -4.648 -13.805 10.262 1.00 0.00 O ATOM 1188 CG2 THR A 80 -2.628 -14.614 9.427 1.00 0.00 C ATOM 0 H THR A 80 -6.380 -15.466 8.109 1.00 0.00 H new ATOM 0 HA THR A 80 -4.465 -13.179 7.898 1.00 0.00 H new ATOM 0 HB THR A 80 -4.433 -15.789 9.453 1.00 0.00 H new ATOM 0 HG1 THR A 80 -4.785 -14.250 11.124 1.00 0.00 H new ATOM 0 HG21 THR A 80 -2.301 -14.983 10.399 1.00 0.00 H new ATOM 0 HG22 THR A 80 -2.154 -15.198 8.638 1.00 0.00 H new ATOM 0 HG23 THR A 80 -2.345 -13.566 9.323 1.00 0.00 H new ATOM 1196 N TYR A 81 -3.811 -14.086 5.731 1.00 0.00 N ATOM 1197 CA TYR A 81 -3.172 -14.563 4.517 1.00 0.00 C ATOM 1198 C TYR A 81 -1.674 -14.784 4.736 1.00 0.00 C ATOM 1199 O TYR A 81 -0.887 -13.841 4.664 1.00 0.00 O ATOM 1200 CB TYR A 81 -3.366 -13.459 3.476 1.00 0.00 C ATOM 1201 CG TYR A 81 -2.610 -13.698 2.167 1.00 0.00 C ATOM 1202 CD1 TYR A 81 -3.210 -14.400 1.142 1.00 0.00 C ATOM 1203 CD2 TYR A 81 -1.328 -13.212 2.013 1.00 0.00 C ATOM 1204 CE1 TYR A 81 -2.499 -14.625 -0.090 1.00 0.00 C ATOM 1205 CE2 TYR A 81 -0.616 -13.437 0.781 1.00 0.00 C ATOM 1206 CZ TYR A 81 -1.237 -14.132 -0.209 1.00 0.00 C ATOM 1207 OH TYR A 81 -0.565 -14.345 -1.373 1.00 0.00 O ATOM 0 H TYR A 81 -4.092 -13.106 5.708 1.00 0.00 H new ATOM 0 HA TYR A 81 -3.605 -15.513 4.204 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -4.429 -13.363 3.257 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -3.042 -12.510 3.903 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -4.213 -14.781 1.264 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -0.858 -12.663 2.816 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -2.957 -15.172 -0.900 1.00 0.00 H new ATOM 0 HE2 TYR A 81 0.388 -13.062 0.647 1.00 0.00 H new ATOM 0 HH TYR A 81 0.324 -13.936 -1.317 1.00 0.00 H new ATOM 1217 N ARG A 82 -1.325 -16.035 5.000 1.00 0.00 N ATOM 1218 CA ARG A 82 0.065 -16.391 5.230 1.00 0.00 C ATOM 1219 C ARG A 82 0.801 -16.545 3.898 1.00 0.00 C ATOM 1220 O ARG A 82 0.452 -17.403 3.087 1.00 0.00 O ATOM 1221 CB ARG A 82 0.175 -17.697 6.020 1.00 0.00 C ATOM 1222 CG ARG A 82 1.637 -18.035 6.319 1.00 0.00 C ATOM 1223 CD ARG A 82 1.786 -18.634 7.718 1.00 0.00 C ATOM 1224 NE ARG A 82 1.390 -20.060 7.703 1.00 0.00 N ATOM 1225 CZ ARG A 82 1.765 -20.954 8.629 1.00 0.00 C ATOM 1226 NH1 ARG A 82 2.548 -20.574 9.648 1.00 0.00 N ATOM 1227 NH2 ARG A 82 1.358 -22.227 8.535 1.00 0.00 N ATOM 0 H ARG A 82 -1.981 -16.814 5.060 1.00 0.00 H new ATOM 0 HA ARG A 82 0.521 -15.589 5.810 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -0.380 -17.609 6.954 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -0.281 -18.509 5.453 1.00 0.00 H new ATOM 0 HG2 ARG A 82 2.010 -18.740 5.576 1.00 0.00 H new ATOM 0 HG3 ARG A 82 2.246 -17.135 6.238 1.00 0.00 H new ATOM 0 HD2 ARG A 82 2.818 -18.538 8.056 1.00 0.00 H new ATOM 0 HD3 ARG A 82 1.167 -18.083 8.426 1.00 0.00 H new ATOM 0 HE ARG A 82 0.794 -20.383 6.940 1.00 0.00 H new ATOM 0 HH11 ARG A 82 2.858 -19.605 9.719 1.00 0.00 H new ATOM 0 HH12 ARG A 82 2.834 -21.254 10.353 1.00 0.00 H new ATOM 0 HH21 ARG A 82 0.763 -22.516 7.759 1.00 0.00 H new ATOM 0 HH22 ARG A 82 1.643 -22.907 9.240 1.00 0.00 H new ATOM 1241 N PHE A 83 1.806 -15.702 3.712 1.00 0.00 N ATOM 1242 CA PHE A 83 2.594 -15.734 2.492 1.00 0.00 C ATOM 1243 C PHE A 83 3.339 -17.063 2.355 1.00 0.00 C ATOM 1244 O PHE A 83 3.410 -17.840 3.306 1.00 0.00 O ATOM 1245 CB PHE A 83 3.615 -14.599 2.590 1.00 0.00 C ATOM 1246 CG PHE A 83 3.093 -13.248 2.097 1.00 0.00 C ATOM 1247 CD1 PHE A 83 2.963 -13.013 0.764 1.00 0.00 C ATOM 1248 CD2 PHE A 83 2.758 -12.281 2.993 1.00 0.00 C ATOM 1249 CE1 PHE A 83 2.479 -11.759 0.307 1.00 0.00 C ATOM 1250 CE2 PHE A 83 2.273 -11.027 2.537 1.00 0.00 C ATOM 1251 CZ PHE A 83 2.144 -10.792 1.203 1.00 0.00 C ATOM 0 H PHE A 83 2.093 -14.992 4.386 1.00 0.00 H new ATOM 0 HA PHE A 83 1.943 -15.622 1.625 1.00 0.00 H new ATOM 0 HB2 PHE A 83 3.932 -14.498 3.628 1.00 0.00 H new ATOM 0 HB3 PHE A 83 4.499 -14.868 2.012 1.00 0.00 H new ATOM 0 HD1 PHE A 83 3.228 -13.781 0.052 1.00 0.00 H new ATOM 0 HD2 PHE A 83 2.861 -12.467 4.052 1.00 0.00 H new ATOM 0 HE1 PHE A 83 2.377 -11.573 -0.752 1.00 0.00 H new ATOM 0 HE2 PHE A 83 2.006 -10.260 3.249 1.00 0.00 H new ATOM 0 HZ PHE A 83 1.776 -9.838 0.856 1.00 0.00 H new ATOM 1261 N PRO A 84 3.889 -17.291 1.132 1.00 0.00 N ATOM 1262 CA PRO A 84 4.625 -18.513 0.858 1.00 0.00 C ATOM 1263 C PRO A 84 6.008 -18.478 1.512 1.00 0.00 C ATOM 1264 O PRO A 84 6.604 -17.411 1.656 1.00 0.00 O ATOM 1265 CB PRO A 84 4.687 -18.603 -0.658 1.00 0.00 C ATOM 1266 CG PRO A 84 4.394 -17.203 -1.172 1.00 0.00 C ATOM 1267 CD PRO A 84 3.824 -16.393 -0.018 1.00 0.00 C ATOM 0 HA PRO A 84 4.144 -19.397 1.277 1.00 0.00 H new ATOM 0 HB2 PRO A 84 5.668 -18.943 -0.989 1.00 0.00 H new ATOM 0 HB3 PRO A 84 3.957 -19.319 -1.037 1.00 0.00 H new ATOM 0 HG2 PRO A 84 5.303 -16.738 -1.552 1.00 0.00 H new ATOM 0 HG3 PRO A 84 3.685 -17.240 -1.999 1.00 0.00 H new ATOM 0 HD2 PRO A 84 4.404 -15.486 0.154 1.00 0.00 H new ATOM 0 HD3 PRO A 84 2.799 -16.082 -0.220 1.00 0.00 H new ATOM 1275 N PRO A 85 6.491 -19.689 1.900 1.00 0.00 N ATOM 1276 CA PRO A 85 7.792 -19.807 2.535 1.00 0.00 C ATOM 1277 C PRO A 85 8.919 -19.647 1.512 1.00 0.00 C ATOM 1278 O PRO A 85 10.092 -19.800 1.846 1.00 0.00 O ATOM 1279 CB PRO A 85 7.783 -21.174 3.199 1.00 0.00 C ATOM 1280 CG PRO A 85 6.668 -21.957 2.527 1.00 0.00 C ATOM 1281 CD PRO A 85 5.813 -20.972 1.745 1.00 0.00 C ATOM 0 HA PRO A 85 7.974 -19.023 3.270 1.00 0.00 H new ATOM 0 HB2 PRO A 85 8.743 -21.675 3.073 1.00 0.00 H new ATOM 0 HB3 PRO A 85 7.607 -21.086 4.271 1.00 0.00 H new ATOM 0 HG2 PRO A 85 7.081 -22.716 1.862 1.00 0.00 H new ATOM 0 HG3 PRO A 85 6.066 -22.479 3.271 1.00 0.00 H new ATOM 0 HD2 PRO A 85 5.740 -21.257 0.695 1.00 0.00 H new ATOM 0 HD3 PRO A 85 4.796 -20.933 2.136 1.00 0.00 H new ATOM 1289 N LYS A 86 8.521 -19.340 0.285 1.00 0.00 N ATOM 1290 CA LYS A 86 9.482 -19.158 -0.789 1.00 0.00 C ATOM 1291 C LYS A 86 9.233 -17.809 -1.467 1.00 0.00 C ATOM 1292 O LYS A 86 9.132 -17.735 -2.691 1.00 0.00 O ATOM 1293 CB LYS A 86 9.442 -20.347 -1.751 1.00 0.00 C ATOM 1294 CG LYS A 86 10.026 -21.601 -1.098 1.00 0.00 C ATOM 1295 CD LYS A 86 8.969 -22.326 -0.262 1.00 0.00 C ATOM 1296 CE LYS A 86 8.386 -23.515 -1.028 1.00 0.00 C ATOM 1297 NZ LYS A 86 9.255 -24.704 -0.881 1.00 0.00 N ATOM 0 H LYS A 86 7.547 -19.213 0.012 1.00 0.00 H new ATOM 0 HA LYS A 86 10.497 -19.133 -0.392 1.00 0.00 H new ATOM 0 HB2 LYS A 86 8.413 -20.537 -2.057 1.00 0.00 H new ATOM 0 HB3 LYS A 86 10.004 -20.108 -2.654 1.00 0.00 H new ATOM 0 HG2 LYS A 86 10.409 -22.271 -1.867 1.00 0.00 H new ATOM 0 HG3 LYS A 86 10.870 -21.327 -0.465 1.00 0.00 H new ATOM 0 HD2 LYS A 86 9.413 -22.672 0.671 1.00 0.00 H new ATOM 0 HD3 LYS A 86 8.171 -21.632 0.003 1.00 0.00 H new ATOM 0 HE2 LYS A 86 7.386 -23.740 -0.656 1.00 0.00 H new ATOM 0 HE3 LYS A 86 8.284 -23.260 -2.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 8.844 -25.501 -1.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 10.201 -24.491 -1.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 9.331 -24.956 0.125 1.00 0.00 H new ATOM 1311 N PHE A 87 9.141 -16.776 -0.642 1.00 0.00 N ATOM 1312 CA PHE A 87 8.906 -15.434 -1.147 1.00 0.00 C ATOM 1313 C PHE A 87 9.931 -14.449 -0.583 1.00 0.00 C ATOM 1314 O PHE A 87 10.338 -14.564 0.572 1.00 0.00 O ATOM 1315 CB PHE A 87 7.508 -15.020 -0.681 1.00 0.00 C ATOM 1316 CG PHE A 87 6.851 -13.953 -1.559 1.00 0.00 C ATOM 1317 CD1 PHE A 87 6.127 -14.321 -2.650 1.00 0.00 C ATOM 1318 CD2 PHE A 87 6.990 -12.637 -1.248 1.00 0.00 C ATOM 1319 CE1 PHE A 87 5.517 -13.331 -3.465 1.00 0.00 C ATOM 1320 CE2 PHE A 87 6.380 -11.646 -2.062 1.00 0.00 C ATOM 1321 CZ PHE A 87 5.656 -12.014 -3.154 1.00 0.00 C ATOM 0 H PHE A 87 9.225 -16.841 0.372 1.00 0.00 H new ATOM 0 HA PHE A 87 8.993 -15.424 -2.234 1.00 0.00 H new ATOM 0 HB2 PHE A 87 6.868 -15.902 -0.658 1.00 0.00 H new ATOM 0 HB3 PHE A 87 7.573 -14.646 0.341 1.00 0.00 H new ATOM 0 HD1 PHE A 87 6.016 -15.367 -2.897 1.00 0.00 H new ATOM 0 HD2 PHE A 87 7.565 -12.345 -0.381 1.00 0.00 H new ATOM 0 HE1 PHE A 87 4.943 -13.624 -4.332 1.00 0.00 H new ATOM 0 HE2 PHE A 87 6.491 -10.601 -1.815 1.00 0.00 H new ATOM 0 HZ PHE A 87 5.192 -11.261 -3.773 1.00 0.00 H new ATOM 1331 N THR A 88 10.319 -13.501 -1.424 1.00 0.00 N ATOM 1332 CA THR A 88 11.288 -12.496 -1.024 1.00 0.00 C ATOM 1333 C THR A 88 10.945 -11.144 -1.651 1.00 0.00 C ATOM 1334 O THR A 88 11.038 -10.977 -2.866 1.00 0.00 O ATOM 1335 CB THR A 88 12.681 -13.005 -1.402 1.00 0.00 C ATOM 1336 OG1 THR A 88 13.037 -13.873 -0.330 1.00 0.00 O ATOM 1337 CG2 THR A 88 13.740 -11.902 -1.356 1.00 0.00 C ATOM 0 H THR A 88 9.979 -13.408 -2.381 1.00 0.00 H new ATOM 0 HA THR A 88 11.266 -12.334 0.054 1.00 0.00 H new ATOM 0 HB THR A 88 12.650 -13.437 -2.402 1.00 0.00 H new ATOM 0 HG1 THR A 88 12.237 -14.094 0.191 1.00 0.00 H new ATOM 0 HG21 THR A 88 14.709 -12.317 -1.633 1.00 0.00 H new ATOM 0 HG22 THR A 88 13.471 -11.110 -2.055 1.00 0.00 H new ATOM 0 HG23 THR A 88 13.795 -11.492 -0.347 1.00 0.00 H new ATOM 1345 N LEU A 89 10.555 -10.212 -0.793 1.00 0.00 N ATOM 1346 CA LEU A 89 10.196 -8.879 -1.248 1.00 0.00 C ATOM 1347 C LEU A 89 11.453 -8.009 -1.303 1.00 0.00 C ATOM 1348 O LEU A 89 11.840 -7.407 -0.302 1.00 0.00 O ATOM 1349 CB LEU A 89 9.082 -8.297 -0.376 1.00 0.00 C ATOM 1350 CG LEU A 89 8.597 -6.896 -0.755 1.00 0.00 C ATOM 1351 CD1 LEU A 89 7.863 -6.915 -2.097 1.00 0.00 C ATOM 1352 CD2 LEU A 89 7.739 -6.293 0.359 1.00 0.00 C ATOM 0 H LEU A 89 10.480 -10.354 0.214 1.00 0.00 H new ATOM 0 HA LEU A 89 9.790 -8.917 -2.259 1.00 0.00 H new ATOM 0 HB2 LEU A 89 8.230 -8.976 -0.408 1.00 0.00 H new ATOM 0 HB3 LEU A 89 9.431 -8.272 0.656 1.00 0.00 H new ATOM 0 HG LEU A 89 9.469 -6.253 -0.874 1.00 0.00 H new ATOM 0 HD11 LEU A 89 7.529 -5.907 -2.343 1.00 0.00 H new ATOM 0 HD12 LEU A 89 8.537 -7.274 -2.875 1.00 0.00 H new ATOM 0 HD13 LEU A 89 7.000 -7.577 -2.030 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.407 -5.297 0.064 1.00 0.00 H new ATOM 0 HD22 LEU A 89 6.870 -6.928 0.533 1.00 0.00 H new ATOM 0 HD23 LEU A 89 8.327 -6.223 1.274 1.00 0.00 H new ATOM 1364 N LYS A 90 12.057 -7.969 -2.482 1.00 0.00 N ATOM 1365 CA LYS A 90 13.262 -7.182 -2.680 1.00 0.00 C ATOM 1366 C LYS A 90 13.057 -5.786 -2.088 1.00 0.00 C ATOM 1367 O LYS A 90 11.937 -5.412 -1.743 1.00 0.00 O ATOM 1368 CB LYS A 90 13.658 -7.172 -4.158 1.00 0.00 C ATOM 1369 CG LYS A 90 13.710 -8.593 -4.721 1.00 0.00 C ATOM 1370 CD LYS A 90 14.810 -8.725 -5.777 1.00 0.00 C ATOM 1371 CE LYS A 90 16.197 -8.693 -5.131 1.00 0.00 C ATOM 1372 NZ LYS A 90 17.241 -8.474 -6.156 1.00 0.00 N ATOM 0 H LYS A 90 11.734 -8.469 -3.310 1.00 0.00 H new ATOM 0 HA LYS A 90 14.103 -7.632 -2.152 1.00 0.00 H new ATOM 0 HB2 LYS A 90 12.942 -6.578 -4.726 1.00 0.00 H new ATOM 0 HB3 LYS A 90 14.631 -6.695 -4.274 1.00 0.00 H new ATOM 0 HG2 LYS A 90 13.890 -9.302 -3.913 1.00 0.00 H new ATOM 0 HG3 LYS A 90 12.746 -8.849 -5.161 1.00 0.00 H new ATOM 0 HD2 LYS A 90 14.682 -9.658 -6.326 1.00 0.00 H new ATOM 0 HD3 LYS A 90 14.723 -7.915 -6.501 1.00 0.00 H new ATOM 0 HE2 LYS A 90 16.239 -7.899 -4.385 1.00 0.00 H new ATOM 0 HE3 LYS A 90 16.383 -9.631 -4.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 18.176 -8.455 -5.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 17.211 -9.246 -6.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 17.071 -7.567 -6.636 1.00 0.00 H new ATOM 1386 N ALA A 91 14.156 -5.053 -1.989 1.00 0.00 N ATOM 1387 CA ALA A 91 14.112 -3.707 -1.445 1.00 0.00 C ATOM 1388 C ALA A 91 13.540 -2.755 -2.498 1.00 0.00 C ATOM 1389 O ALA A 91 13.915 -2.819 -3.667 1.00 0.00 O ATOM 1390 CB ALA A 91 15.512 -3.295 -0.986 1.00 0.00 C ATOM 0 H ALA A 91 15.083 -5.366 -2.277 1.00 0.00 H new ATOM 0 HA ALA A 91 13.459 -3.667 -0.573 1.00 0.00 H new ATOM 0 HB1 ALA A 91 15.479 -2.285 -0.578 1.00 0.00 H new ATOM 0 HB2 ALA A 91 15.861 -3.985 -0.218 1.00 0.00 H new ATOM 0 HB3 ALA A 91 16.195 -3.321 -1.835 1.00 0.00 H new ATOM 1396 N GLY A 92 12.640 -1.894 -2.045 1.00 0.00 N ATOM 1397 CA GLY A 92 12.013 -0.930 -2.933 1.00 0.00 C ATOM 1398 C GLY A 92 11.048 -1.621 -3.898 1.00 0.00 C ATOM 1399 O GLY A 92 10.525 -0.991 -4.816 1.00 0.00 O ATOM 0 H GLY A 92 12.330 -1.844 -1.074 1.00 0.00 H new ATOM 0 HA2 GLY A 92 11.475 -0.186 -2.346 1.00 0.00 H new ATOM 0 HA3 GLY A 92 12.779 -0.398 -3.497 1.00 0.00 H new ATOM 1403 N GLN A 93 10.840 -2.908 -3.657 1.00 0.00 N ATOM 1404 CA GLN A 93 9.947 -3.691 -4.494 1.00 0.00 C ATOM 1405 C GLN A 93 8.504 -3.554 -4.004 1.00 0.00 C ATOM 1406 O GLN A 93 8.254 -2.954 -2.959 1.00 0.00 O ATOM 1407 CB GLN A 93 10.377 -5.159 -4.529 1.00 0.00 C ATOM 1408 CG GLN A 93 10.863 -5.555 -5.925 1.00 0.00 C ATOM 1409 CD GLN A 93 11.872 -4.538 -6.462 1.00 0.00 C ATOM 1410 OE1 GLN A 93 11.786 -4.075 -7.588 1.00 0.00 O ATOM 1411 NE2 GLN A 93 12.831 -4.219 -5.597 1.00 0.00 N ATOM 0 H GLN A 93 11.275 -3.427 -2.894 1.00 0.00 H new ATOM 0 HA GLN A 93 10.002 -3.305 -5.512 1.00 0.00 H new ATOM 0 HB2 GLN A 93 11.172 -5.326 -3.802 1.00 0.00 H new ATOM 0 HB3 GLN A 93 9.540 -5.794 -4.238 1.00 0.00 H new ATOM 0 HG2 GLN A 93 11.322 -6.543 -5.888 1.00 0.00 H new ATOM 0 HG3 GLN A 93 10.013 -5.623 -6.604 1.00 0.00 H new ATOM 0 HE21 GLN A 93 12.844 -4.644 -4.670 1.00 0.00 H new ATOM 0 HE22 GLN A 93 13.554 -3.549 -5.861 1.00 0.00 H new ATOM 1420 N VAL A 94 7.593 -4.119 -4.782 1.00 0.00 N ATOM 1421 CA VAL A 94 6.181 -4.066 -4.440 1.00 0.00 C ATOM 1422 C VAL A 94 5.506 -5.368 -4.879 1.00 0.00 C ATOM 1423 O VAL A 94 5.990 -6.048 -5.782 1.00 0.00 O ATOM 1424 CB VAL A 94 5.539 -2.822 -5.057 1.00 0.00 C ATOM 1425 CG1 VAL A 94 5.599 -2.875 -6.585 1.00 0.00 C ATOM 1426 CG2 VAL A 94 4.099 -2.650 -4.571 1.00 0.00 C ATOM 0 H VAL A 94 7.804 -4.616 -5.648 1.00 0.00 H new ATOM 0 HA VAL A 94 6.052 -3.980 -3.361 1.00 0.00 H new ATOM 0 HB VAL A 94 6.109 -1.953 -4.729 1.00 0.00 H new ATOM 0 HG11 VAL A 94 5.136 -1.979 -6.999 1.00 0.00 H new ATOM 0 HG12 VAL A 94 6.639 -2.927 -6.907 1.00 0.00 H new ATOM 0 HG13 VAL A 94 5.065 -3.756 -6.940 1.00 0.00 H new ATOM 0 HG21 VAL A 94 3.666 -1.758 -5.025 1.00 0.00 H new ATOM 0 HG22 VAL A 94 3.512 -3.523 -4.855 1.00 0.00 H new ATOM 0 HG23 VAL A 94 4.091 -2.545 -3.486 1.00 0.00 H new ATOM 1436 N VAL A 95 4.399 -5.674 -4.219 1.00 0.00 N ATOM 1437 CA VAL A 95 3.653 -6.882 -4.529 1.00 0.00 C ATOM 1438 C VAL A 95 2.156 -6.606 -4.371 1.00 0.00 C ATOM 1439 O VAL A 95 1.754 -5.814 -3.521 1.00 0.00 O ATOM 1440 CB VAL A 95 4.143 -8.039 -3.657 1.00 0.00 C ATOM 1441 CG1 VAL A 95 3.932 -7.734 -2.172 1.00 0.00 C ATOM 1442 CG2 VAL A 95 3.460 -9.350 -4.050 1.00 0.00 C ATOM 0 H VAL A 95 4.000 -5.107 -3.471 1.00 0.00 H new ATOM 0 HA VAL A 95 3.822 -7.180 -5.564 1.00 0.00 H new ATOM 0 HB VAL A 95 5.213 -8.156 -3.826 1.00 0.00 H new ATOM 0 HG11 VAL A 95 4.289 -8.573 -1.574 1.00 0.00 H new ATOM 0 HG12 VAL A 95 4.486 -6.835 -1.903 1.00 0.00 H new ATOM 0 HG13 VAL A 95 2.871 -7.577 -1.980 1.00 0.00 H new ATOM 0 HG21 VAL A 95 3.827 -10.156 -3.414 1.00 0.00 H new ATOM 0 HG22 VAL A 95 2.382 -9.251 -3.924 1.00 0.00 H new ATOM 0 HG23 VAL A 95 3.684 -9.579 -5.092 1.00 0.00 H new ATOM 1452 N THR A 96 1.373 -7.276 -5.203 1.00 0.00 N ATOM 1453 CA THR A 96 -0.071 -7.113 -5.167 1.00 0.00 C ATOM 1454 C THR A 96 -0.753 -8.459 -4.918 1.00 0.00 C ATOM 1455 O THR A 96 -0.554 -9.409 -5.673 1.00 0.00 O ATOM 1456 CB THR A 96 -0.505 -6.444 -6.472 1.00 0.00 C ATOM 1457 OG1 THR A 96 0.361 -5.318 -6.590 1.00 0.00 O ATOM 1458 CG2 THR A 96 -1.903 -5.830 -6.380 1.00 0.00 C ATOM 0 H THR A 96 1.711 -7.933 -5.906 1.00 0.00 H new ATOM 0 HA THR A 96 -0.376 -6.472 -4.340 1.00 0.00 H new ATOM 0 HB THR A 96 -0.483 -7.176 -7.279 1.00 0.00 H new ATOM 0 HG1 THR A 96 0.150 -4.827 -7.412 1.00 0.00 H new ATOM 0 HG21 THR A 96 -2.161 -5.369 -7.333 1.00 0.00 H new ATOM 0 HG22 THR A 96 -2.628 -6.610 -6.146 1.00 0.00 H new ATOM 0 HG23 THR A 96 -1.917 -5.074 -5.595 1.00 0.00 H new ATOM 1466 N ILE A 97 -1.544 -8.498 -3.856 1.00 0.00 N ATOM 1467 CA ILE A 97 -2.258 -9.712 -3.498 1.00 0.00 C ATOM 1468 C ILE A 97 -3.748 -9.529 -3.792 1.00 0.00 C ATOM 1469 O ILE A 97 -4.520 -9.170 -2.904 1.00 0.00 O ATOM 1470 CB ILE A 97 -1.960 -10.101 -2.048 1.00 0.00 C ATOM 1471 CG1 ILE A 97 -0.453 -10.125 -1.785 1.00 0.00 C ATOM 1472 CG2 ILE A 97 -2.625 -11.431 -1.689 1.00 0.00 C ATOM 1473 CD1 ILE A 97 0.066 -8.726 -1.445 1.00 0.00 C ATOM 0 H ILE A 97 -1.706 -7.708 -3.231 1.00 0.00 H new ATOM 0 HA ILE A 97 -1.914 -10.549 -4.106 1.00 0.00 H new ATOM 0 HB ILE A 97 -2.389 -9.340 -1.396 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -0.234 -10.808 -0.964 1.00 0.00 H new ATOM 0 HG13 ILE A 97 0.067 -10.506 -2.664 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -2.397 -11.684 -0.653 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -3.704 -11.343 -1.812 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -2.248 -12.215 -2.345 1.00 0.00 H new ATOM 0 HD11 ILE A 97 1.140 -8.771 -1.262 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -0.133 -8.052 -2.278 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -0.439 -8.358 -0.552 1.00 0.00 H new ATOM 1485 N TRP A 98 -4.108 -9.783 -5.041 1.00 0.00 N ATOM 1486 CA TRP A 98 -5.492 -9.650 -5.463 1.00 0.00 C ATOM 1487 C TRP A 98 -6.299 -10.764 -4.793 1.00 0.00 C ATOM 1488 O TRP A 98 -5.730 -11.729 -4.285 1.00 0.00 O ATOM 1489 CB TRP A 98 -5.603 -9.666 -6.989 1.00 0.00 C ATOM 1490 CG TRP A 98 -4.781 -8.580 -7.685 1.00 0.00 C ATOM 1491 CD1 TRP A 98 -3.479 -8.604 -7.999 1.00 0.00 C ATOM 1492 CD2 TRP A 98 -5.263 -7.298 -8.143 1.00 0.00 C ATOM 1493 NE1 TRP A 98 -3.087 -7.438 -8.623 1.00 0.00 N ATOM 1494 CE2 TRP A 98 -4.206 -6.618 -8.714 1.00 0.00 C ATOM 1495 CE3 TRP A 98 -6.548 -6.733 -8.077 1.00 0.00 C ATOM 1496 CZ2 TRP A 98 -4.327 -5.336 -9.262 1.00 0.00 C ATOM 1497 CZ3 TRP A 98 -6.652 -5.451 -8.629 1.00 0.00 C ATOM 1498 CH2 TRP A 98 -5.598 -4.753 -9.208 1.00 0.00 C ATOM 0 H TRP A 98 -3.465 -10.080 -5.775 1.00 0.00 H new ATOM 0 HA TRP A 98 -5.900 -8.689 -5.151 1.00 0.00 H new ATOM 0 HB2 TRP A 98 -5.282 -10.641 -7.356 1.00 0.00 H new ATOM 0 HB3 TRP A 98 -6.650 -9.549 -7.268 1.00 0.00 H new ATOM 0 HD1 TRP A 98 -2.819 -9.433 -7.790 1.00 0.00 H new ATOM 0 HE1 TRP A 98 -2.149 -7.218 -8.956 1.00 0.00 H new ATOM 0 HE3 TRP A 98 -7.389 -7.247 -7.635 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 -3.485 -4.824 -9.703 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 -7.619 -4.970 -8.603 1.00 0.00 H new ATOM 0 HH2 TRP A 98 -5.760 -3.765 -9.614 1.00 0.00 H new ATOM 1509 N ALA A 99 -7.613 -10.593 -4.813 1.00 0.00 N ATOM 1510 CA ALA A 99 -8.504 -11.571 -4.213 1.00 0.00 C ATOM 1511 C ALA A 99 -9.191 -12.374 -5.320 1.00 0.00 C ATOM 1512 O ALA A 99 -9.493 -11.838 -6.385 1.00 0.00 O ATOM 1513 CB ALA A 99 -9.506 -10.859 -3.303 1.00 0.00 C ATOM 0 H ALA A 99 -8.082 -9.792 -5.235 1.00 0.00 H new ATOM 0 HA ALA A 99 -7.944 -12.272 -3.595 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -10.174 -11.593 -2.853 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -8.970 -10.327 -2.517 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -10.089 -10.149 -3.889 1.00 0.00 H new ATOM 1519 N SER A 100 -9.417 -13.647 -5.029 1.00 0.00 N ATOM 1520 CA SER A 100 -10.063 -14.530 -5.986 1.00 0.00 C ATOM 1521 C SER A 100 -11.170 -13.778 -6.728 1.00 0.00 C ATOM 1522 O SER A 100 -11.178 -13.731 -7.957 1.00 0.00 O ATOM 1523 CB SER A 100 -10.634 -15.769 -5.294 1.00 0.00 C ATOM 1524 OG SER A 100 -11.736 -16.320 -6.011 1.00 0.00 O ATOM 0 H SER A 100 -9.164 -14.088 -4.145 1.00 0.00 H new ATOM 0 HA SER A 100 -9.314 -14.862 -6.705 1.00 0.00 H new ATOM 0 HB2 SER A 100 -9.852 -16.522 -5.196 1.00 0.00 H new ATOM 0 HB3 SER A 100 -10.952 -15.507 -4.285 1.00 0.00 H new ATOM 0 HG SER A 100 -12.072 -17.110 -5.538 1.00 0.00 H new ATOM 1530 N GLY A 101 -12.078 -13.208 -5.949 1.00 0.00 N ATOM 1531 CA GLY A 101 -13.188 -12.461 -6.516 1.00 0.00 C ATOM 1532 C GLY A 101 -12.873 -10.964 -6.563 1.00 0.00 C ATOM 1533 O GLY A 101 -13.381 -10.194 -5.750 1.00 0.00 O ATOM 0 H GLY A 101 -12.068 -13.249 -4.930 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -13.399 -12.824 -7.522 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -14.086 -12.629 -5.921 1.00 0.00 H new ATOM 1537 N ALA A 102 -12.037 -10.597 -7.524 1.00 0.00 N ATOM 1538 CA ALA A 102 -11.649 -9.207 -7.687 1.00 0.00 C ATOM 1539 C ALA A 102 -11.190 -8.976 -9.128 1.00 0.00 C ATOM 1540 O ALA A 102 -10.401 -8.071 -9.395 1.00 0.00 O ATOM 1541 CB ALA A 102 -10.565 -8.855 -6.667 1.00 0.00 C ATOM 0 H ALA A 102 -11.618 -11.239 -8.197 1.00 0.00 H new ATOM 0 HA ALA A 102 -12.497 -8.548 -7.501 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -10.275 -7.812 -6.790 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -10.951 -9.008 -5.659 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -9.696 -9.494 -6.824 1.00 0.00 H new ATOM 1547 N GLY A 103 -11.704 -9.810 -10.020 1.00 0.00 N ATOM 1548 CA GLY A 103 -11.357 -9.709 -11.427 1.00 0.00 C ATOM 1549 C GLY A 103 -9.889 -9.313 -11.603 1.00 0.00 C ATOM 1550 O GLY A 103 -9.582 -8.346 -12.298 1.00 0.00 O ATOM 0 H GLY A 103 -12.359 -10.559 -9.795 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -11.542 -10.663 -11.920 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -11.997 -8.971 -11.911 1.00 0.00 H new ATOM 1554 N ALA A 104 -9.022 -10.080 -10.959 1.00 0.00 N ATOM 1555 CA ALA A 104 -7.594 -9.822 -11.035 1.00 0.00 C ATOM 1556 C ALA A 104 -6.955 -10.800 -12.023 1.00 0.00 C ATOM 1557 O ALA A 104 -7.656 -11.483 -12.768 1.00 0.00 O ATOM 1558 CB ALA A 104 -6.981 -9.923 -9.637 1.00 0.00 C ATOM 0 H ALA A 104 -9.281 -10.880 -10.382 1.00 0.00 H new ATOM 0 HA ALA A 104 -7.406 -8.813 -11.401 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -5.910 -9.729 -9.695 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -7.448 -9.188 -8.981 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -7.148 -10.923 -9.238 1.00 0.00 H new ATOM 1564 N THR A 105 -5.630 -10.836 -11.998 1.00 0.00 N ATOM 1565 CA THR A 105 -4.889 -11.719 -12.882 1.00 0.00 C ATOM 1566 C THR A 105 -3.579 -12.156 -12.224 1.00 0.00 C ATOM 1567 O THR A 105 -2.647 -11.362 -12.102 1.00 0.00 O ATOM 1568 CB THR A 105 -4.688 -10.994 -14.214 1.00 0.00 C ATOM 1569 OG1 THR A 105 -5.758 -11.463 -15.030 1.00 0.00 O ATOM 1570 CG2 THR A 105 -3.429 -11.459 -14.949 1.00 0.00 C ATOM 0 H THR A 105 -5.051 -10.268 -11.379 1.00 0.00 H new ATOM 0 HA THR A 105 -5.441 -12.639 -13.076 1.00 0.00 H new ATOM 0 HB THR A 105 -4.630 -9.920 -14.037 1.00 0.00 H new ATOM 0 HG1 THR A 105 -6.561 -11.580 -14.481 1.00 0.00 H new ATOM 0 HG21 THR A 105 -3.333 -10.913 -15.888 1.00 0.00 H new ATOM 0 HG22 THR A 105 -2.554 -11.269 -14.328 1.00 0.00 H new ATOM 0 HG23 THR A 105 -3.502 -12.527 -15.156 1.00 0.00 H new ATOM 1578 N HIS A 106 -3.549 -13.416 -11.816 1.00 0.00 N ATOM 1579 CA HIS A 106 -2.369 -13.967 -11.173 1.00 0.00 C ATOM 1580 C HIS A 106 -1.127 -13.627 -12.001 1.00 0.00 C ATOM 1581 O HIS A 106 -0.922 -14.185 -13.077 1.00 0.00 O ATOM 1582 CB HIS A 106 -2.530 -15.471 -10.938 1.00 0.00 C ATOM 1583 CG HIS A 106 -1.720 -16.001 -9.779 1.00 0.00 C ATOM 1584 ND1 HIS A 106 -1.639 -15.350 -8.561 1.00 0.00 N ATOM 1585 CD2 HIS A 106 -0.959 -17.127 -9.666 1.00 0.00 C ATOM 1586 CE1 HIS A 106 -0.860 -16.060 -7.758 1.00 0.00 C ATOM 1587 NE2 HIS A 106 -0.439 -17.161 -8.445 1.00 0.00 N ATOM 0 H HIS A 106 -4.324 -14.071 -11.918 1.00 0.00 H new ATOM 0 HA HIS A 106 -2.243 -13.515 -10.189 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -3.583 -15.690 -10.762 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -2.240 -16.003 -11.844 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -0.805 -17.866 -10.439 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -0.603 -15.811 -6.739 1.00 0.00 H new ATOM 0 HE2 HIS A 106 0.174 -17.890 -8.081 1.00 0.00 H new ATOM 1595 N SER A 107 -0.332 -12.712 -11.466 1.00 0.00 N ATOM 1596 CA SER A 107 0.883 -12.290 -12.141 1.00 0.00 C ATOM 1597 C SER A 107 2.016 -12.124 -11.126 1.00 0.00 C ATOM 1598 O SER A 107 2.502 -11.016 -10.908 1.00 0.00 O ATOM 1599 CB SER A 107 0.662 -10.984 -12.908 1.00 0.00 C ATOM 1600 OG SER A 107 0.775 -11.166 -14.316 1.00 0.00 O ATOM 0 H SER A 107 -0.506 -12.251 -10.573 1.00 0.00 H new ATOM 0 HA SER A 107 1.159 -13.061 -12.861 1.00 0.00 H new ATOM 0 HB2 SER A 107 -0.326 -10.588 -12.672 1.00 0.00 H new ATOM 0 HB3 SER A 107 1.390 -10.243 -12.579 1.00 0.00 H new ATOM 0 HG SER A 107 0.626 -10.310 -14.769 1.00 0.00 H new ATOM 1606 N PRO A 108 2.413 -13.273 -10.517 1.00 0.00 N ATOM 1607 CA PRO A 108 3.479 -13.266 -9.529 1.00 0.00 C ATOM 1608 C PRO A 108 4.846 -13.108 -10.199 1.00 0.00 C ATOM 1609 O PRO A 108 4.958 -13.211 -11.420 1.00 0.00 O ATOM 1610 CB PRO A 108 3.333 -14.582 -8.783 1.00 0.00 C ATOM 1611 CG PRO A 108 2.491 -15.477 -9.677 1.00 0.00 C ATOM 1612 CD PRO A 108 1.860 -14.604 -10.750 1.00 0.00 C ATOM 0 HA PRO A 108 3.409 -12.423 -8.841 1.00 0.00 H new ATOM 0 HB2 PRO A 108 4.307 -15.030 -8.588 1.00 0.00 H new ATOM 0 HB3 PRO A 108 2.852 -14.432 -7.817 1.00 0.00 H new ATOM 0 HG2 PRO A 108 3.108 -16.253 -10.130 1.00 0.00 H new ATOM 0 HG3 PRO A 108 1.721 -15.982 -9.094 1.00 0.00 H new ATOM 0 HD2 PRO A 108 2.105 -14.965 -11.749 1.00 0.00 H new ATOM 0 HD3 PRO A 108 0.773 -14.601 -10.669 1.00 0.00 H new ATOM 1620 N PRO A 109 5.876 -12.854 -9.349 1.00 0.00 N ATOM 1621 CA PRO A 109 5.657 -12.747 -7.917 1.00 0.00 C ATOM 1622 C PRO A 109 4.990 -11.416 -7.562 1.00 0.00 C ATOM 1623 O PRO A 109 4.480 -11.249 -6.455 1.00 0.00 O ATOM 1624 CB PRO A 109 7.034 -12.906 -7.295 1.00 0.00 C ATOM 1625 CG PRO A 109 8.030 -12.631 -8.410 1.00 0.00 C ATOM 1626 CD PRO A 109 7.273 -12.661 -9.728 1.00 0.00 C ATOM 0 HA PRO A 109 4.974 -13.507 -7.538 1.00 0.00 H new ATOM 0 HB2 PRO A 109 7.172 -12.209 -6.468 1.00 0.00 H new ATOM 0 HB3 PRO A 109 7.167 -13.910 -6.892 1.00 0.00 H new ATOM 0 HG2 PRO A 109 8.507 -11.662 -8.266 1.00 0.00 H new ATOM 0 HG3 PRO A 109 8.822 -13.380 -8.408 1.00 0.00 H new ATOM 0 HD2 PRO A 109 7.408 -11.733 -10.283 1.00 0.00 H new ATOM 0 HD3 PRO A 109 7.625 -13.470 -10.368 1.00 0.00 H new ATOM 1634 N THR A 110 5.016 -10.504 -8.522 1.00 0.00 N ATOM 1635 CA THR A 110 4.420 -9.193 -8.325 1.00 0.00 C ATOM 1636 C THR A 110 2.952 -9.330 -7.918 1.00 0.00 C ATOM 1637 O THR A 110 2.622 -9.260 -6.735 1.00 0.00 O ATOM 1638 CB THR A 110 4.622 -8.384 -9.608 1.00 0.00 C ATOM 1639 OG1 THR A 110 3.864 -9.090 -10.586 1.00 0.00 O ATOM 1640 CG2 THR A 110 6.060 -8.458 -10.126 1.00 0.00 C ATOM 0 H THR A 110 5.440 -10.646 -9.439 1.00 0.00 H new ATOM 0 HA THR A 110 4.903 -8.658 -7.507 1.00 0.00 H new ATOM 0 HB THR A 110 4.354 -7.343 -9.427 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.948 -10.054 -10.432 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.149 -7.867 -11.038 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.740 -8.064 -9.370 1.00 0.00 H new ATOM 0 HG23 THR A 110 6.317 -9.496 -10.340 1.00 0.00 H new ATOM 1648 N ASP A 111 2.108 -9.524 -8.922 1.00 0.00 N ATOM 1649 CA ASP A 111 0.683 -9.671 -8.684 1.00 0.00 C ATOM 1650 C ASP A 111 0.394 -11.097 -8.211 1.00 0.00 C ATOM 1651 O ASP A 111 1.093 -12.035 -8.592 1.00 0.00 O ATOM 1652 CB ASP A 111 -0.118 -9.427 -9.964 1.00 0.00 C ATOM 1653 CG ASP A 111 -0.315 -7.955 -10.333 1.00 0.00 C ATOM 1654 OD1 ASP A 111 0.581 -7.157 -9.982 1.00 0.00 O ATOM 1655 OD2 ASP A 111 -1.357 -7.661 -10.958 1.00 0.00 O ATOM 0 H ASP A 111 2.385 -9.583 -9.902 1.00 0.00 H new ATOM 0 HA ASP A 111 0.390 -8.940 -7.931 1.00 0.00 H new ATOM 0 HB2 ASP A 111 0.385 -9.929 -10.791 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -1.097 -9.893 -9.856 1.00 0.00 H new ATOM 1660 N LEU A 112 -0.636 -11.216 -7.386 1.00 0.00 N ATOM 1661 CA LEU A 112 -1.026 -12.512 -6.857 1.00 0.00 C ATOM 1662 C LEU A 112 -2.553 -12.606 -6.823 1.00 0.00 C ATOM 1663 O LEU A 112 -3.243 -11.592 -6.915 1.00 0.00 O ATOM 1664 CB LEU A 112 -0.364 -12.757 -5.500 1.00 0.00 C ATOM 1665 CG LEU A 112 1.120 -13.126 -5.534 1.00 0.00 C ATOM 1666 CD1 LEU A 112 1.787 -12.841 -4.187 1.00 0.00 C ATOM 1667 CD2 LEU A 112 1.314 -14.579 -5.974 1.00 0.00 C ATOM 0 H LEU A 112 -1.213 -10.436 -7.071 1.00 0.00 H new ATOM 0 HA LEU A 112 -0.672 -13.312 -7.508 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -0.481 -11.859 -4.894 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -0.905 -13.556 -4.993 1.00 0.00 H new ATOM 0 HG LEU A 112 1.611 -12.497 -6.276 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.841 -13.112 -4.238 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.696 -11.780 -3.953 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.299 -13.427 -3.408 1.00 0.00 H new ATOM 0 HD21 LEU A 112 2.378 -14.815 -5.990 1.00 0.00 H new ATOM 0 HD22 LEU A 112 0.805 -15.242 -5.274 1.00 0.00 H new ATOM 0 HD23 LEU A 112 0.897 -14.716 -6.972 1.00 0.00 H new ATOM 1679 N VAL A 113 -3.035 -13.833 -6.690 1.00 0.00 N ATOM 1680 CA VAL A 113 -4.467 -14.073 -6.643 1.00 0.00 C ATOM 1681 C VAL A 113 -4.786 -15.002 -5.470 1.00 0.00 C ATOM 1682 O VAL A 113 -4.405 -16.171 -5.478 1.00 0.00 O ATOM 1683 CB VAL A 113 -4.951 -14.620 -7.987 1.00 0.00 C ATOM 1684 CG1 VAL A 113 -6.389 -15.132 -7.885 1.00 0.00 C ATOM 1685 CG2 VAL A 113 -4.821 -13.565 -9.088 1.00 0.00 C ATOM 0 H VAL A 113 -2.459 -14.671 -6.613 1.00 0.00 H new ATOM 0 HA VAL A 113 -5.005 -13.140 -6.475 1.00 0.00 H new ATOM 0 HB VAL A 113 -4.314 -15.463 -8.254 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -6.708 -15.515 -8.854 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -6.439 -15.930 -7.145 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -7.045 -14.316 -7.584 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -5.172 -13.980 -10.033 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -5.422 -12.693 -8.829 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -3.777 -13.269 -9.187 1.00 0.00 H new ATOM 1695 N TRP A 114 -5.482 -14.446 -4.489 1.00 0.00 N ATOM 1696 CA TRP A 114 -5.856 -15.210 -3.311 1.00 0.00 C ATOM 1697 C TRP A 114 -7.007 -16.142 -3.698 1.00 0.00 C ATOM 1698 O TRP A 114 -8.165 -15.729 -3.715 1.00 0.00 O ATOM 1699 CB TRP A 114 -6.204 -14.284 -2.144 1.00 0.00 C ATOM 1700 CG TRP A 114 -6.243 -14.983 -0.784 1.00 0.00 C ATOM 1701 CD1 TRP A 114 -5.927 -16.254 -0.501 1.00 0.00 C ATOM 1702 CD2 TRP A 114 -6.633 -14.395 0.475 1.00 0.00 C ATOM 1703 NE1 TRP A 114 -6.086 -16.528 0.843 1.00 0.00 N ATOM 1704 CE2 TRP A 114 -6.528 -15.361 1.455 1.00 0.00 C ATOM 1705 CE3 TRP A 114 -7.060 -13.090 0.775 1.00 0.00 C ATOM 1706 CZ2 TRP A 114 -6.833 -15.124 2.800 1.00 0.00 C ATOM 1707 CZ3 TRP A 114 -7.361 -12.869 2.125 1.00 0.00 C ATOM 1708 CH2 TRP A 114 -7.261 -13.830 3.123 1.00 0.00 C ATOM 0 H TRP A 114 -5.797 -13.476 -4.486 1.00 0.00 H new ATOM 0 HA TRP A 114 -5.019 -15.815 -2.962 1.00 0.00 H new ATOM 0 HB2 TRP A 114 -5.473 -13.476 -2.105 1.00 0.00 H new ATOM 0 HB3 TRP A 114 -7.175 -13.827 -2.334 1.00 0.00 H new ATOM 0 HD1 TRP A 114 -5.590 -16.974 -1.232 1.00 0.00 H new ATOM 0 HE1 TRP A 114 -5.911 -17.422 1.302 1.00 0.00 H new ATOM 0 HE3 TRP A 114 -7.149 -12.319 0.024 1.00 0.00 H new ATOM 0 HZ2 TRP A 114 -6.743 -15.897 3.549 1.00 0.00 H new ATOM 0 HZ3 TRP A 114 -7.694 -11.882 2.410 1.00 0.00 H new ATOM 0 HH2 TRP A 114 -7.512 -13.581 4.143 1.00 0.00 H new ATOM 1719 N LYS A 115 -6.647 -17.381 -3.998 1.00 0.00 N ATOM 1720 CA LYS A 115 -7.634 -18.375 -4.383 1.00 0.00 C ATOM 1721 C LYS A 115 -8.334 -18.904 -3.130 1.00 0.00 C ATOM 1722 O LYS A 115 -9.559 -19.012 -3.098 1.00 0.00 O ATOM 1723 CB LYS A 115 -6.989 -19.469 -5.236 1.00 0.00 C ATOM 1724 CG LYS A 115 -7.383 -19.322 -6.707 1.00 0.00 C ATOM 1725 CD LYS A 115 -7.667 -20.687 -7.337 1.00 0.00 C ATOM 1726 CE LYS A 115 -9.092 -20.749 -7.891 1.00 0.00 C ATOM 1727 NZ LYS A 115 -9.115 -21.470 -9.183 1.00 0.00 N ATOM 0 H LYS A 115 -5.685 -17.719 -3.982 1.00 0.00 H new ATOM 0 HA LYS A 115 -8.402 -17.925 -5.012 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -5.904 -19.418 -5.140 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -7.296 -20.449 -4.870 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -8.266 -18.689 -6.789 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.582 -18.825 -7.254 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -6.953 -20.877 -8.138 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -7.528 -21.471 -6.593 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -9.745 -21.250 -7.176 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -9.481 -19.739 -8.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -10.089 -21.503 -9.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -8.508 -20.975 -9.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -8.764 -22.439 -9.046 1.00 0.00 H new ATOM 1741 N ALA A 116 -7.527 -19.221 -2.129 1.00 0.00 N ATOM 1742 CA ALA A 116 -8.053 -19.737 -0.877 1.00 0.00 C ATOM 1743 C ALA A 116 -9.333 -18.979 -0.516 1.00 0.00 C ATOM 1744 O ALA A 116 -10.384 -19.586 -0.321 1.00 0.00 O ATOM 1745 CB ALA A 116 -6.984 -19.626 0.212 1.00 0.00 C ATOM 0 H ALA A 116 -6.511 -19.130 -2.159 1.00 0.00 H new ATOM 0 HA ALA A 116 -8.310 -20.792 -0.975 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -7.380 -20.013 1.151 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -6.107 -20.205 -0.079 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -6.703 -18.581 0.341 1.00 0.00 H new ATOM 1751 N GLN A 117 -9.201 -17.663 -0.438 1.00 0.00 N ATOM 1752 CA GLN A 117 -10.333 -16.816 -0.105 1.00 0.00 C ATOM 1753 C GLN A 117 -11.069 -16.388 -1.376 1.00 0.00 C ATOM 1754 O GLN A 117 -10.637 -16.703 -2.484 1.00 0.00 O ATOM 1755 CB GLN A 117 -9.887 -15.598 0.707 1.00 0.00 C ATOM 1756 CG GLN A 117 -10.388 -15.687 2.150 1.00 0.00 C ATOM 1757 CD GLN A 117 -11.908 -15.522 2.213 1.00 0.00 C ATOM 1758 OE1 GLN A 117 -12.638 -16.410 2.623 1.00 0.00 O ATOM 1759 NE2 GLN A 117 -12.343 -14.340 1.785 1.00 0.00 N ATOM 0 H GLN A 117 -8.327 -17.163 -0.600 1.00 0.00 H new ATOM 0 HA GLN A 117 -11.022 -17.391 0.513 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -8.799 -15.530 0.700 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -10.266 -14.688 0.242 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -10.105 -16.648 2.579 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -9.909 -14.916 2.753 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -11.678 -13.641 1.455 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -13.342 -14.133 1.787 1.00 0.00 H new ATOM 1768 N ASN A 118 -12.168 -15.675 -1.175 1.00 0.00 N ATOM 1769 CA ASN A 118 -12.967 -15.201 -2.291 1.00 0.00 C ATOM 1770 C ASN A 118 -12.823 -13.682 -2.407 1.00 0.00 C ATOM 1771 O ASN A 118 -13.046 -13.113 -3.475 1.00 0.00 O ATOM 1772 CB ASN A 118 -14.449 -15.520 -2.082 1.00 0.00 C ATOM 1773 CG ASN A 118 -14.824 -15.441 -0.601 1.00 0.00 C ATOM 1774 OD1 ASN A 118 -15.153 -16.428 0.036 1.00 0.00 O ATOM 1775 ND2 ASN A 118 -14.756 -14.214 -0.091 1.00 0.00 N ATOM 0 H ASN A 118 -12.523 -15.414 -0.255 1.00 0.00 H new ATOM 0 HA ASN A 118 -12.614 -15.699 -3.194 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -15.059 -14.820 -2.653 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -14.667 -16.518 -2.463 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -14.987 -14.056 0.890 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -14.473 -13.431 -0.681 1.00 0.00 H new ATOM 1782 N THR A 119 -12.450 -13.068 -1.294 1.00 0.00 N ATOM 1783 CA THR A 119 -12.273 -11.626 -1.257 1.00 0.00 C ATOM 1784 C THR A 119 -11.721 -11.191 0.102 1.00 0.00 C ATOM 1785 O THR A 119 -12.075 -11.763 1.132 1.00 0.00 O ATOM 1786 CB THR A 119 -13.614 -10.976 -1.605 1.00 0.00 C ATOM 1787 OG1 THR A 119 -13.311 -9.588 -1.705 1.00 0.00 O ATOM 1788 CG2 THR A 119 -14.619 -11.056 -0.454 1.00 0.00 C ATOM 0 H THR A 119 -12.265 -13.543 -0.410 1.00 0.00 H new ATOM 0 HA THR A 119 -11.537 -11.299 -1.991 1.00 0.00 H new ATOM 0 HB THR A 119 -14.033 -11.459 -2.488 1.00 0.00 H new ATOM 0 HG1 THR A 119 -14.125 -9.091 -1.930 1.00 0.00 H new ATOM 0 HG21 THR A 119 -15.553 -10.580 -0.753 1.00 0.00 H new ATOM 0 HG22 THR A 119 -14.807 -12.101 -0.207 1.00 0.00 H new ATOM 0 HG23 THR A 119 -14.214 -10.544 0.419 1.00 0.00 H new ATOM 1796 N TRP A 120 -10.863 -10.183 0.060 1.00 0.00 N ATOM 1797 CA TRP A 120 -10.258 -9.664 1.275 1.00 0.00 C ATOM 1798 C TRP A 120 -11.384 -9.306 2.248 1.00 0.00 C ATOM 1799 O TRP A 120 -11.321 -9.647 3.428 1.00 0.00 O ATOM 1800 CB TRP A 120 -9.336 -8.483 0.968 1.00 0.00 C ATOM 1801 CG TRP A 120 -7.942 -8.890 0.487 1.00 0.00 C ATOM 1802 CD1 TRP A 120 -7.453 -8.843 -0.759 1.00 0.00 C ATOM 1803 CD2 TRP A 120 -6.870 -9.412 1.301 1.00 0.00 C ATOM 1804 NE1 TRP A 120 -6.149 -9.294 -0.809 1.00 0.00 N ATOM 1805 CE2 TRP A 120 -5.784 -9.651 0.484 1.00 0.00 C ATOM 1806 CE3 TRP A 120 -6.820 -9.673 2.682 1.00 0.00 C ATOM 1807 CZ2 TRP A 120 -4.569 -10.163 0.955 1.00 0.00 C ATOM 1808 CZ3 TRP A 120 -5.599 -10.185 3.136 1.00 0.00 C ATOM 1809 CH2 TRP A 120 -4.496 -10.431 2.327 1.00 0.00 C ATOM 0 H TRP A 120 -10.572 -9.711 -0.796 1.00 0.00 H new ATOM 0 HA TRP A 120 -9.621 -10.416 1.740 1.00 0.00 H new ATOM 0 HB2 TRP A 120 -9.804 -7.859 0.207 1.00 0.00 H new ATOM 0 HB3 TRP A 120 -9.235 -7.871 1.865 1.00 0.00 H new ATOM 0 HD1 TRP A 120 -8.009 -8.496 -1.617 1.00 0.00 H new ATOM 0 HE1 TRP A 120 -5.562 -9.354 -1.641 1.00 0.00 H new ATOM 0 HE3 TRP A 120 -7.657 -9.493 3.340 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 -3.733 -10.342 0.295 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 -5.508 -10.404 4.190 1.00 0.00 H new ATOM 0 HH2 TRP A 120 -3.587 -10.827 2.755 1.00 0.00 H new ATOM 1820 N GLY A 121 -12.388 -8.625 1.716 1.00 0.00 N ATOM 1821 CA GLY A 121 -13.526 -8.217 2.523 1.00 0.00 C ATOM 1822 C GLY A 121 -13.859 -6.742 2.295 1.00 0.00 C ATOM 1823 O GLY A 121 -12.961 -5.916 2.139 1.00 0.00 O ATOM 0 H GLY A 121 -12.437 -8.345 0.736 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -14.391 -8.831 2.275 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -13.308 -8.385 3.578 1.00 0.00 H new ATOM 1827 N CYS A 122 -15.153 -6.455 2.283 1.00 0.00 N ATOM 1828 CA CYS A 122 -15.616 -5.093 2.077 1.00 0.00 C ATOM 1829 C CYS A 122 -16.236 -4.594 3.383 1.00 0.00 C ATOM 1830 O CYS A 122 -16.217 -5.297 4.392 1.00 0.00 O ATOM 1831 CB CYS A 122 -16.597 -5.000 0.907 1.00 0.00 C ATOM 1832 SG CYS A 122 -16.109 -6.170 -0.414 1.00 0.00 S ATOM 0 H CYS A 122 -15.895 -7.143 2.413 1.00 0.00 H new ATOM 0 HA CYS A 122 -14.773 -4.456 1.810 1.00 0.00 H new ATOM 0 HB2 CYS A 122 -17.607 -5.226 1.250 1.00 0.00 H new ATOM 0 HB3 CYS A 122 -16.613 -3.983 0.515 1.00 0.00 H new ATOM 0 HG CYS A 122 -14.820 -6.128 -0.576 1.00 0.00 H new ATOM 1838 N GLY A 123 -16.772 -3.384 3.322 1.00 0.00 N ATOM 1839 CA GLY A 123 -17.397 -2.782 4.487 1.00 0.00 C ATOM 1840 C GLY A 123 -16.805 -1.402 4.776 1.00 0.00 C ATOM 1841 O GLY A 123 -15.693 -1.097 4.346 1.00 0.00 O ATOM 0 H GLY A 123 -16.786 -2.804 2.483 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -18.471 -2.694 4.323 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -17.259 -3.429 5.353 1.00 0.00 H new ATOM 1845 N SER A 124 -17.572 -0.604 5.504 1.00 0.00 N ATOM 1846 CA SER A 124 -17.137 0.737 5.855 1.00 0.00 C ATOM 1847 C SER A 124 -15.832 0.672 6.652 1.00 0.00 C ATOM 1848 O SER A 124 -14.852 1.326 6.299 1.00 0.00 O ATOM 1849 CB SER A 124 -18.212 1.473 6.657 1.00 0.00 C ATOM 1850 OG SER A 124 -18.817 0.632 7.636 1.00 0.00 O ATOM 0 H SER A 124 -18.493 -0.861 5.861 1.00 0.00 H new ATOM 0 HA SER A 124 -16.966 1.293 4.933 1.00 0.00 H new ATOM 0 HB2 SER A 124 -17.769 2.340 7.147 1.00 0.00 H new ATOM 0 HB3 SER A 124 -18.978 1.848 5.978 1.00 0.00 H new ATOM 0 HG SER A 124 -19.496 1.139 8.128 1.00 0.00 H new ATOM 1856 N SER A 125 -15.862 -0.123 7.711 1.00 0.00 N ATOM 1857 CA SER A 125 -14.694 -0.282 8.561 1.00 0.00 C ATOM 1858 C SER A 125 -13.898 -1.515 8.129 1.00 0.00 C ATOM 1859 O SER A 125 -14.442 -2.616 8.058 1.00 0.00 O ATOM 1860 CB SER A 125 -15.095 -0.397 10.033 1.00 0.00 C ATOM 1861 OG SER A 125 -15.339 0.877 10.621 1.00 0.00 O ATOM 0 H SER A 125 -16.677 -0.664 8.000 1.00 0.00 H new ATOM 0 HA SER A 125 -14.068 0.604 8.452 1.00 0.00 H new ATOM 0 HB2 SER A 125 -15.990 -1.013 10.118 1.00 0.00 H new ATOM 0 HB3 SER A 125 -14.305 -0.906 10.585 1.00 0.00 H new ATOM 0 HG SER A 125 -15.594 0.760 11.560 1.00 0.00 H new ATOM 1867 N LEU A 126 -12.622 -1.290 7.853 1.00 0.00 N ATOM 1868 CA LEU A 126 -11.745 -2.369 7.430 1.00 0.00 C ATOM 1869 C LEU A 126 -10.421 -2.271 8.190 1.00 0.00 C ATOM 1870 O LEU A 126 -10.003 -1.181 8.579 1.00 0.00 O ATOM 1871 CB LEU A 126 -11.584 -2.363 5.909 1.00 0.00 C ATOM 1872 CG LEU A 126 -12.840 -2.029 5.102 1.00 0.00 C ATOM 1873 CD1 LEU A 126 -12.516 -1.067 3.957 1.00 0.00 C ATOM 1874 CD2 LEU A 126 -13.527 -3.302 4.605 1.00 0.00 C ATOM 0 H LEU A 126 -12.174 -0.376 7.914 1.00 0.00 H new ATOM 0 HA LEU A 126 -12.183 -3.336 7.677 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -10.807 -1.644 5.649 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -11.227 -3.345 5.598 1.00 0.00 H new ATOM 0 HG LEU A 126 -13.544 -1.520 5.760 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -13.426 -0.846 3.399 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -12.106 -0.143 4.364 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -11.785 -1.526 3.292 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -14.417 -3.036 4.034 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -12.841 -3.861 3.968 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -13.813 -3.918 5.458 1.00 0.00 H new ATOM 1886 N ARG A 127 -9.797 -3.424 8.378 1.00 0.00 N ATOM 1887 CA ARG A 127 -8.528 -3.482 9.084 1.00 0.00 C ATOM 1888 C ARG A 127 -7.580 -4.464 8.393 1.00 0.00 C ATOM 1889 O ARG A 127 -7.896 -5.644 8.253 1.00 0.00 O ATOM 1890 CB ARG A 127 -8.726 -3.914 10.539 1.00 0.00 C ATOM 1891 CG ARG A 127 -7.891 -3.051 11.486 1.00 0.00 C ATOM 1892 CD ARG A 127 -8.369 -3.203 12.931 1.00 0.00 C ATOM 1893 NE ARG A 127 -7.481 -2.445 13.841 1.00 0.00 N ATOM 1894 CZ ARG A 127 -6.223 -2.802 14.133 1.00 0.00 C ATOM 1895 NH1 ARG A 127 -5.698 -3.908 13.590 1.00 0.00 N ATOM 1896 NH2 ARG A 127 -5.491 -2.053 14.969 1.00 0.00 N ATOM 0 H ARG A 127 -10.146 -4.326 8.054 1.00 0.00 H new ATOM 0 HA ARG A 127 -8.095 -2.482 9.069 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -9.780 -3.836 10.805 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -8.445 -4.961 10.653 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -6.842 -3.337 11.414 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -7.958 -2.005 11.185 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -9.393 -2.841 13.024 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -8.377 -4.256 13.211 1.00 0.00 H new ATOM 0 HE ARG A 127 -7.850 -1.598 14.273 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -6.256 -4.478 12.954 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -4.740 -4.180 13.812 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -5.892 -1.211 15.383 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -4.533 -2.325 15.191 1.00 0.00 H new ATOM 1910 N THR A 128 -6.437 -3.939 7.977 1.00 0.00 N ATOM 1911 CA THR A 128 -5.440 -4.755 7.303 1.00 0.00 C ATOM 1912 C THR A 128 -4.058 -4.524 7.917 1.00 0.00 C ATOM 1913 O THR A 128 -3.507 -3.428 7.820 1.00 0.00 O ATOM 1914 CB THR A 128 -5.502 -4.437 5.808 1.00 0.00 C ATOM 1915 OG1 THR A 128 -6.758 -4.966 5.392 1.00 0.00 O ATOM 1916 CG2 THR A 128 -4.476 -5.232 4.998 1.00 0.00 C ATOM 0 H THR A 128 -6.179 -2.959 8.093 1.00 0.00 H new ATOM 0 HA THR A 128 -5.645 -5.818 7.433 1.00 0.00 H new ATOM 0 HB THR A 128 -5.337 -3.370 5.657 1.00 0.00 H new ATOM 0 HG1 THR A 128 -6.701 -5.244 4.454 1.00 0.00 H new ATOM 0 HG21 THR A 128 -4.562 -4.969 3.944 1.00 0.00 H new ATOM 0 HG22 THR A 128 -3.472 -4.995 5.350 1.00 0.00 H new ATOM 0 HG23 THR A 128 -4.662 -6.299 5.122 1.00 0.00 H new ATOM 1924 N ALA A 129 -3.538 -5.573 8.536 1.00 0.00 N ATOM 1925 CA ALA A 129 -2.230 -5.498 9.165 1.00 0.00 C ATOM 1926 C ALA A 129 -1.316 -6.566 8.561 1.00 0.00 C ATOM 1927 O ALA A 129 -1.790 -7.509 7.929 1.00 0.00 O ATOM 1928 CB ALA A 129 -2.383 -5.651 10.680 1.00 0.00 C ATOM 0 H ALA A 129 -3.998 -6.480 8.616 1.00 0.00 H new ATOM 0 HA ALA A 129 -1.770 -4.527 8.979 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -1.402 -5.595 11.152 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -3.017 -4.852 11.064 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -2.839 -6.615 10.904 1.00 0.00 H new ATOM 1934 N LEU A 130 -0.022 -6.383 8.777 1.00 0.00 N ATOM 1935 CA LEU A 130 0.963 -7.318 8.261 1.00 0.00 C ATOM 1936 C LEU A 130 1.682 -7.992 9.432 1.00 0.00 C ATOM 1937 O LEU A 130 2.190 -7.316 10.325 1.00 0.00 O ATOM 1938 CB LEU A 130 1.906 -6.618 7.282 1.00 0.00 C ATOM 1939 CG LEU A 130 2.975 -7.500 6.633 1.00 0.00 C ATOM 1940 CD1 LEU A 130 2.393 -8.296 5.464 1.00 0.00 C ATOM 1941 CD2 LEU A 130 4.190 -6.670 6.213 1.00 0.00 C ATOM 0 H LEU A 130 0.367 -5.600 9.303 1.00 0.00 H new ATOM 0 HA LEU A 130 0.475 -8.107 7.688 1.00 0.00 H new ATOM 0 HB2 LEU A 130 1.307 -6.166 6.491 1.00 0.00 H new ATOM 0 HB3 LEU A 130 2.405 -5.804 7.808 1.00 0.00 H new ATOM 0 HG LEU A 130 3.319 -8.221 7.374 1.00 0.00 H new ATOM 0 HD11 LEU A 130 3.173 -8.914 5.021 1.00 0.00 H new ATOM 0 HD12 LEU A 130 1.586 -8.934 5.824 1.00 0.00 H new ATOM 0 HD13 LEU A 130 2.005 -7.608 4.713 1.00 0.00 H new ATOM 0 HD21 LEU A 130 4.934 -7.321 5.755 1.00 0.00 H new ATOM 0 HD22 LEU A 130 3.881 -5.910 5.495 1.00 0.00 H new ATOM 0 HD23 LEU A 130 4.621 -6.187 7.090 1.00 0.00 H new ATOM 1953 N ILE A 131 1.701 -9.316 9.390 1.00 0.00 N ATOM 1954 CA ILE A 131 2.349 -10.089 10.436 1.00 0.00 C ATOM 1955 C ILE A 131 3.548 -10.834 9.846 1.00 0.00 C ATOM 1956 O ILE A 131 3.385 -11.692 8.979 1.00 0.00 O ATOM 1957 CB ILE A 131 1.338 -11.003 11.131 1.00 0.00 C ATOM 1958 CG1 ILE A 131 0.079 -10.229 11.527 1.00 0.00 C ATOM 1959 CG2 ILE A 131 1.974 -11.714 12.327 1.00 0.00 C ATOM 1960 CD1 ILE A 131 0.433 -9.004 12.372 1.00 0.00 C ATOM 0 H ILE A 131 1.278 -9.873 8.648 1.00 0.00 H new ATOM 0 HA ILE A 131 2.735 -9.429 11.213 1.00 0.00 H new ATOM 0 HB ILE A 131 1.032 -11.774 10.423 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -0.456 -9.915 10.631 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -0.592 -10.880 12.087 1.00 0.00 H new ATOM 0 HG21 ILE A 131 1.234 -12.357 12.803 1.00 0.00 H new ATOM 0 HG22 ILE A 131 2.815 -12.318 11.986 1.00 0.00 H new ATOM 0 HG23 ILE A 131 2.327 -10.974 13.045 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -0.479 -8.471 12.640 1.00 0.00 H new ATOM 0 HD12 ILE A 131 0.947 -9.324 13.279 1.00 0.00 H new ATOM 0 HD13 ILE A 131 1.084 -8.343 11.800 1.00 0.00 H new ATOM 1972 N ASN A 132 4.726 -10.479 10.338 1.00 0.00 N ATOM 1973 CA ASN A 132 5.951 -11.103 9.870 1.00 0.00 C ATOM 1974 C ASN A 132 5.955 -12.578 10.276 1.00 0.00 C ATOM 1975 O ASN A 132 4.966 -13.082 10.806 1.00 0.00 O ATOM 1976 CB ASN A 132 7.181 -10.438 10.493 1.00 0.00 C ATOM 1977 CG ASN A 132 7.203 -10.638 12.010 1.00 0.00 C ATOM 1978 OD1 ASN A 132 7.495 -11.709 12.516 1.00 0.00 O ATOM 1979 ND2 ASN A 132 6.878 -9.551 12.704 1.00 0.00 N ATOM 0 H ASN A 132 4.858 -9.767 11.056 1.00 0.00 H new ATOM 0 HA ASN A 132 5.992 -10.994 8.786 1.00 0.00 H new ATOM 0 HB2 ASN A 132 8.087 -10.857 10.054 1.00 0.00 H new ATOM 0 HB3 ASN A 132 7.179 -9.373 10.263 1.00 0.00 H new ATOM 0 HD21 ASN A 132 6.863 -9.582 13.723 1.00 0.00 H new ATOM 0 HD22 ASN A 132 6.644 -8.686 12.217 1.00 0.00 H new ATOM 1986 N SER A 133 7.078 -13.229 10.011 1.00 0.00 N ATOM 1987 CA SER A 133 7.223 -14.636 10.343 1.00 0.00 C ATOM 1988 C SER A 133 6.528 -14.935 11.673 1.00 0.00 C ATOM 1989 O SER A 133 5.590 -15.729 11.722 1.00 0.00 O ATOM 1990 CB SER A 133 8.698 -15.036 10.413 1.00 0.00 C ATOM 1991 OG SER A 133 9.007 -15.728 11.619 1.00 0.00 O ATOM 0 H SER A 133 7.896 -12.808 9.570 1.00 0.00 H new ATOM 0 HA SER A 133 6.752 -15.223 9.555 1.00 0.00 H new ATOM 0 HB2 SER A 133 8.943 -15.668 9.559 1.00 0.00 H new ATOM 0 HB3 SER A 133 9.319 -14.144 10.338 1.00 0.00 H new ATOM 0 HG SER A 133 9.957 -15.967 11.624 1.00 0.00 H new ATOM 1997 N THR A 134 7.016 -14.283 12.718 1.00 0.00 N ATOM 1998 CA THR A 134 6.453 -14.469 14.045 1.00 0.00 C ATOM 1999 C THR A 134 5.113 -13.741 14.163 1.00 0.00 C ATOM 2000 O THR A 134 4.814 -12.850 13.369 1.00 0.00 O ATOM 2001 CB THR A 134 7.491 -14.002 15.068 1.00 0.00 C ATOM 2002 OG1 THR A 134 7.742 -12.645 14.712 1.00 0.00 O ATOM 2003 CG2 THR A 134 8.844 -14.691 14.886 1.00 0.00 C ATOM 0 H THR A 134 7.795 -13.626 12.673 1.00 0.00 H new ATOM 0 HA THR A 134 6.234 -15.519 14.238 1.00 0.00 H new ATOM 0 HB THR A 134 7.120 -14.193 16.075 1.00 0.00 H new ATOM 0 HG1 THR A 134 7.242 -12.422 13.899 1.00 0.00 H new ATOM 0 HG21 THR A 134 9.543 -14.324 15.637 1.00 0.00 H new ATOM 0 HG22 THR A 134 8.722 -15.768 15.000 1.00 0.00 H new ATOM 0 HG23 THR A 134 9.232 -14.473 13.891 1.00 0.00 H new ATOM 2011 N GLY A 135 4.341 -14.148 15.160 1.00 0.00 N ATOM 2012 CA GLY A 135 3.039 -13.546 15.392 1.00 0.00 C ATOM 2013 C GLY A 135 3.181 -12.100 15.871 1.00 0.00 C ATOM 2014 O GLY A 135 2.712 -11.752 16.953 1.00 0.00 O ATOM 0 H GLY A 135 4.592 -14.887 15.816 1.00 0.00 H new ATOM 0 HA2 GLY A 135 2.453 -13.573 14.473 1.00 0.00 H new ATOM 0 HA3 GLY A 135 2.493 -14.127 16.135 1.00 0.00 H new ATOM 2018 N GLU A 136 3.832 -11.296 15.042 1.00 0.00 N ATOM 2019 CA GLU A 136 4.042 -9.896 15.368 1.00 0.00 C ATOM 2020 C GLU A 136 3.771 -9.020 14.143 1.00 0.00 C ATOM 2021 O GLU A 136 4.185 -9.353 13.034 1.00 0.00 O ATOM 2022 CB GLU A 136 5.455 -9.665 15.906 1.00 0.00 C ATOM 2023 CG GLU A 136 5.866 -8.198 15.756 1.00 0.00 C ATOM 2024 CD GLU A 136 7.214 -7.935 16.429 1.00 0.00 C ATOM 2025 OE1 GLU A 136 8.172 -8.661 16.085 1.00 0.00 O ATOM 2026 OE2 GLU A 136 7.257 -7.013 17.272 1.00 0.00 O ATOM 0 H GLU A 136 4.221 -11.588 14.145 1.00 0.00 H new ATOM 0 HA GLU A 136 3.340 -9.616 16.153 1.00 0.00 H new ATOM 0 HB2 GLU A 136 5.500 -9.953 16.956 1.00 0.00 H new ATOM 0 HB3 GLU A 136 6.160 -10.301 15.371 1.00 0.00 H new ATOM 0 HG2 GLU A 136 5.927 -7.940 14.699 1.00 0.00 H new ATOM 0 HG3 GLU A 136 5.104 -7.556 16.197 1.00 0.00 H new ATOM 2033 N GLU A 137 3.078 -7.917 14.386 1.00 0.00 N ATOM 2034 CA GLU A 137 2.747 -6.991 13.316 1.00 0.00 C ATOM 2035 C GLU A 137 3.905 -6.018 13.079 1.00 0.00 C ATOM 2036 O GLU A 137 4.527 -5.545 14.029 1.00 0.00 O ATOM 2037 CB GLU A 137 1.452 -6.237 13.625 1.00 0.00 C ATOM 2038 CG GLU A 137 1.076 -5.299 12.476 1.00 0.00 C ATOM 2039 CD GLU A 137 0.406 -4.028 13.002 1.00 0.00 C ATOM 2040 OE1 GLU A 137 -0.818 -4.093 13.249 1.00 0.00 O ATOM 2041 OE2 GLU A 137 1.133 -3.021 13.146 1.00 0.00 O ATOM 0 H GLU A 137 2.737 -7.644 15.308 1.00 0.00 H new ATOM 0 HA GLU A 137 2.586 -7.564 12.403 1.00 0.00 H new ATOM 0 HB2 GLU A 137 0.645 -6.949 13.797 1.00 0.00 H new ATOM 0 HB3 GLU A 137 1.572 -5.663 14.544 1.00 0.00 H new ATOM 0 HG2 GLU A 137 1.969 -5.036 11.910 1.00 0.00 H new ATOM 0 HG3 GLU A 137 0.403 -5.812 11.789 1.00 0.00 H new ATOM 2048 N VAL A 138 4.159 -5.750 11.807 1.00 0.00 N ATOM 2049 CA VAL A 138 5.230 -4.843 11.433 1.00 0.00 C ATOM 2050 C VAL A 138 4.628 -3.544 10.892 1.00 0.00 C ATOM 2051 O VAL A 138 5.124 -2.457 11.183 1.00 0.00 O ATOM 2052 CB VAL A 138 6.171 -5.526 10.439 1.00 0.00 C ATOM 2053 CG1 VAL A 138 7.181 -6.418 11.164 1.00 0.00 C ATOM 2054 CG2 VAL A 138 5.383 -6.323 9.398 1.00 0.00 C ATOM 0 H VAL A 138 3.641 -6.145 11.022 1.00 0.00 H new ATOM 0 HA VAL A 138 5.832 -4.584 12.304 1.00 0.00 H new ATOM 0 HB VAL A 138 6.727 -4.749 9.915 1.00 0.00 H new ATOM 0 HG11 VAL A 138 7.838 -6.892 10.434 1.00 0.00 H new ATOM 0 HG12 VAL A 138 7.776 -5.813 11.848 1.00 0.00 H new ATOM 0 HG13 VAL A 138 6.650 -7.186 11.727 1.00 0.00 H new ATOM 0 HG21 VAL A 138 6.075 -6.799 8.703 1.00 0.00 H new ATOM 0 HG22 VAL A 138 4.789 -7.087 9.899 1.00 0.00 H new ATOM 0 HG23 VAL A 138 4.723 -5.652 8.849 1.00 0.00 H new ATOM 2064 N ALA A 139 3.567 -3.701 10.113 1.00 0.00 N ATOM 2065 CA ALA A 139 2.893 -2.555 9.528 1.00 0.00 C ATOM 2066 C ALA A 139 1.380 -2.780 9.577 1.00 0.00 C ATOM 2067 O ALA A 139 0.913 -3.912 9.456 1.00 0.00 O ATOM 2068 CB ALA A 139 3.404 -2.334 8.103 1.00 0.00 C ATOM 0 H ALA A 139 3.158 -4.604 9.874 1.00 0.00 H new ATOM 0 HA ALA A 139 3.111 -1.650 10.096 1.00 0.00 H new ATOM 0 HB1 ALA A 139 2.898 -1.474 7.664 1.00 0.00 H new ATOM 0 HB2 ALA A 139 4.478 -2.150 8.126 1.00 0.00 H new ATOM 0 HB3 ALA A 139 3.200 -3.220 7.502 1.00 0.00 H new ATOM 2074 N MET A 140 0.656 -1.685 9.753 1.00 0.00 N ATOM 2075 CA MET A 140 -0.794 -1.748 9.819 1.00 0.00 C ATOM 2076 C MET A 140 -1.431 -0.745 8.855 1.00 0.00 C ATOM 2077 O MET A 140 -0.837 0.287 8.546 1.00 0.00 O ATOM 2078 CB MET A 140 -1.254 -1.448 11.247 1.00 0.00 C ATOM 2079 CG MET A 140 -0.959 0.005 11.623 1.00 0.00 C ATOM 2080 SD MET A 140 -1.933 0.478 13.043 1.00 0.00 S ATOM 2081 CE MET A 140 -3.536 0.645 12.277 1.00 0.00 C ATOM 0 H MET A 140 1.047 -0.748 9.852 1.00 0.00 H new ATOM 0 HA MET A 140 -1.109 -2.751 9.530 1.00 0.00 H new ATOM 0 HB2 MET A 140 -2.323 -1.641 11.337 1.00 0.00 H new ATOM 0 HB3 MET A 140 -0.750 -2.117 11.944 1.00 0.00 H new ATOM 0 HG2 MET A 140 0.102 0.124 11.843 1.00 0.00 H new ATOM 0 HG3 MET A 140 -1.185 0.660 10.782 1.00 0.00 H new ATOM 0 HE1 MET A 140 -4.069 1.482 12.728 1.00 0.00 H new ATOM 0 HE2 MET A 140 -3.412 0.827 11.209 1.00 0.00 H new ATOM 0 HE3 MET A 140 -4.107 -0.271 12.425 1.00 0.00 H new ATOM 2091 N ARG A 141 -2.631 -1.083 8.407 1.00 0.00 N ATOM 2092 CA ARG A 141 -3.355 -0.225 7.485 1.00 0.00 C ATOM 2093 C ARG A 141 -4.861 -0.326 7.737 1.00 0.00 C ATOM 2094 O ARG A 141 -5.521 -1.226 7.220 1.00 0.00 O ATOM 2095 CB ARG A 141 -3.061 -0.605 6.032 1.00 0.00 C ATOM 2096 CG ARG A 141 -3.609 0.448 5.068 1.00 0.00 C ATOM 2097 CD ARG A 141 -2.490 1.039 4.207 1.00 0.00 C ATOM 2098 NE ARG A 141 -3.057 1.618 2.969 1.00 0.00 N ATOM 2099 CZ ARG A 141 -3.748 2.766 2.924 1.00 0.00 C ATOM 2100 NH1 ARG A 141 -3.962 3.463 4.048 1.00 0.00 N ATOM 2101 NH2 ARG A 141 -4.224 3.216 1.755 1.00 0.00 N ATOM 0 H ARG A 141 -3.120 -1.940 8.666 1.00 0.00 H new ATOM 0 HA ARG A 141 -3.023 0.799 7.655 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -1.985 -0.708 5.890 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -3.506 -1.574 5.809 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -4.368 -0.001 4.427 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -4.097 1.243 5.632 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -1.956 1.807 4.767 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -1.764 0.265 3.957 1.00 0.00 H new ATOM 0 HE ARG A 141 -2.913 1.112 2.095 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -3.599 3.120 4.938 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -4.488 4.336 4.014 1.00 0.00 H new ATOM 0 HH21 ARG A 141 -4.061 2.685 0.900 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -4.750 4.089 1.721 1.00 0.00 H new ATOM 2115 N LYS A 142 -5.360 0.610 8.531 1.00 0.00 N ATOM 2116 CA LYS A 142 -6.775 0.638 8.857 1.00 0.00 C ATOM 2117 C LYS A 142 -7.481 1.658 7.962 1.00 0.00 C ATOM 2118 O LYS A 142 -6.864 2.618 7.502 1.00 0.00 O ATOM 2119 CB LYS A 142 -6.975 0.890 10.353 1.00 0.00 C ATOM 2120 CG LYS A 142 -8.459 0.845 10.723 1.00 0.00 C ATOM 2121 CD LYS A 142 -8.665 1.165 12.205 1.00 0.00 C ATOM 2122 CE LYS A 142 -10.146 1.088 12.582 1.00 0.00 C ATOM 2123 NZ LYS A 142 -10.497 2.171 13.527 1.00 0.00 N ATOM 0 H LYS A 142 -4.809 1.355 8.958 1.00 0.00 H new ATOM 0 HA LYS A 142 -7.231 -0.331 8.656 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -6.430 0.141 10.928 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -6.559 1.861 10.621 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -9.011 1.560 10.113 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -8.863 -0.143 10.501 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -8.094 0.465 12.815 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -8.282 2.162 12.422 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -10.760 1.167 11.685 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -10.363 0.120 13.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -11.505 2.104 13.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -9.924 2.078 14.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -10.309 3.093 13.084 1.00 0.00 H new ATOM 2137 N LEU A 143 -8.765 1.416 7.741 1.00 0.00 N ATOM 2138 CA LEU A 143 -9.561 2.301 6.909 1.00 0.00 C ATOM 2139 C LEU A 143 -11.004 2.313 7.418 1.00 0.00 C ATOM 2140 O LEU A 143 -11.638 1.264 7.519 1.00 0.00 O ATOM 2141 CB LEU A 143 -9.432 1.911 5.435 1.00 0.00 C ATOM 2142 CG LEU A 143 -8.541 2.813 4.578 1.00 0.00 C ATOM 2143 CD1 LEU A 143 -7.107 2.283 4.533 1.00 0.00 C ATOM 2144 CD2 LEU A 143 -9.129 2.993 3.177 1.00 0.00 C ATOM 0 H LEU A 143 -9.274 0.619 8.124 1.00 0.00 H new ATOM 0 HA LEU A 143 -9.190 3.324 6.978 1.00 0.00 H new ATOM 0 HB2 LEU A 143 -9.044 0.894 5.381 1.00 0.00 H new ATOM 0 HB3 LEU A 143 -10.429 1.895 4.995 1.00 0.00 H new ATOM 0 HG LEU A 143 -8.506 3.799 5.042 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -6.495 2.942 3.918 1.00 0.00 H new ATOM 0 HD12 LEU A 143 -6.700 2.248 5.544 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -7.103 1.280 4.106 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -8.476 3.638 2.589 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -9.213 2.021 2.690 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -10.117 3.448 3.253 1.00 0.00 H new ATOM 2156 N VAL A 144 -11.480 3.510 7.724 1.00 0.00 N ATOM 2157 CA VAL A 144 -12.836 3.672 8.221 1.00 0.00 C ATOM 2158 C VAL A 144 -13.580 4.680 7.342 1.00 0.00 C ATOM 2159 O VAL A 144 -13.130 5.812 7.174 1.00 0.00 O ATOM 2160 CB VAL A 144 -12.809 4.072 9.697 1.00 0.00 C ATOM 2161 CG1 VAL A 144 -14.203 3.966 10.320 1.00 0.00 C ATOM 2162 CG2 VAL A 144 -11.795 3.230 10.475 1.00 0.00 C ATOM 0 H VAL A 144 -10.951 4.378 7.638 1.00 0.00 H new ATOM 0 HA VAL A 144 -13.378 2.728 8.164 1.00 0.00 H new ATOM 0 HB VAL A 144 -12.494 5.114 9.756 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -14.155 4.256 11.370 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -14.889 4.628 9.791 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -14.559 2.939 10.243 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -11.796 3.535 11.522 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -12.066 2.177 10.404 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -10.800 3.378 10.055 1.00 0.00 H new ATOM 2172 N ARG A 145 -14.704 4.231 6.804 1.00 0.00 N ATOM 2173 CA ARG A 145 -15.514 5.080 5.946 1.00 0.00 C ATOM 2174 C ARG A 145 -16.320 6.071 6.789 1.00 0.00 C ATOM 2175 O ARG A 145 -16.759 5.742 7.890 1.00 0.00 O ATOM 2176 CB ARG A 145 -16.474 4.246 5.095 1.00 0.00 C ATOM 2177 CG ARG A 145 -17.466 5.142 4.351 1.00 0.00 C ATOM 2178 CD ARG A 145 -18.451 4.307 3.530 1.00 0.00 C ATOM 2179 NE ARG A 145 -19.712 5.056 3.336 1.00 0.00 N ATOM 2180 CZ ARG A 145 -19.879 6.022 2.423 1.00 0.00 C ATOM 2181 NH1 ARG A 145 -18.866 6.362 1.614 1.00 0.00 N ATOM 2182 NH2 ARG A 145 -21.059 6.649 2.318 1.00 0.00 N ATOM 0 H ARG A 145 -15.073 3.291 6.945 1.00 0.00 H new ATOM 0 HA ARG A 145 -14.840 5.624 5.285 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -15.908 3.651 4.379 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -17.016 3.547 5.732 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -18.013 5.757 5.066 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -16.925 5.822 3.694 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -18.013 4.060 2.563 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -18.653 3.364 4.039 1.00 0.00 H new ATOM 0 HE ARG A 145 -20.504 4.822 3.935 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -17.968 5.885 1.693 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -18.993 7.098 0.919 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -21.830 6.391 2.933 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -21.186 7.384 1.623 1.00 0.00 H new