USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 834 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 34 LYS NZ :NH3+ -116:sc= 0.0862 (180deg=0) USER MOD Set 1.2: A 59 GLN :FLIP amide:sc= -1.02 F(o=-2.8!,f=-0.93) USER MOD Single : A 35 HIS : no HD1:sc= -0.0582 X(o=-0.058,f=-0.0017) USER MOD Single : A 37 GLN : amide:sc= 1.25 K(o=1.3,f=-0.49) USER MOD Single : A 40 TYR OH : rot -153:sc= 0.137 USER MOD Single : A 50 SER OG : rot -48:sc= 1.23 USER MOD Single : A 51 HIS : no HD1:sc=-0.00936 X(o=-0.0094,f=0) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 LYS NZ :NH3+ -112:sc= 0.148 (180deg=-0.0244) USER MOD Single : A 66 ASN : amide:sc= -1.28 K(o=-1.3,f=-5.7!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl -143:sc= -0.665 (180deg=-1.45) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot -93:sc= 0.00164 USER MOD Single : A 91 GLN : amide:sc= 0.329 K(o=0.33,f=-5.5!) USER MOD Single : A 94 LYS NZ :NH3+ -156:sc= 0.467! (180deg=-0.243!) USER MOD Single : A 97 ASN : amide:sc= -0.251 K(o=-0.25,f=-2.7!) USER MOD Single : A 100 GLN : amide:sc= -0.0573 K(o=-0.057,f=-5.6!) USER MOD Single : A 105 SER OG : rot 70:sc= 1.23 USER MOD Single : A 108 ASN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 112 ASN : amide:sc= -0.099 K(o=-0.099,f=-0.7) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot -96:sc= 0.532 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.0695 USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 GLN : amide:sc= -1.68 K(o=-1.7,f=-2.4!) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 MET CE :methyl -161:sc= -0.128 (180deg=-0.671) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 142 CYS SG : rot 84:sc= -0.586 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 540 N LYS A 34 -8.368 1.612 -8.970 1.00 0.00 N ATOM 541 CA LYS A 34 -8.004 0.508 -8.088 1.00 0.00 C ATOM 542 C LYS A 34 -8.420 -0.833 -8.693 1.00 0.00 C ATOM 543 O LYS A 34 -9.480 -0.937 -9.308 1.00 0.00 O ATOM 544 CB LYS A 34 -8.636 0.710 -6.697 1.00 0.00 C ATOM 545 CG LYS A 34 -10.152 0.866 -6.707 1.00 0.00 C ATOM 546 CD LYS A 34 -10.863 -0.479 -6.637 1.00 0.00 C ATOM 547 CE LYS A 34 -12.369 -0.324 -6.760 1.00 0.00 C ATOM 548 NZ LYS A 34 -13.074 -1.617 -6.550 1.00 0.00 N ATOM 0 HA LYS A 34 -6.920 0.496 -7.974 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -8.375 -0.140 -6.067 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -8.196 1.595 -6.237 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -10.459 1.483 -5.862 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -10.457 1.391 -7.612 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -10.497 -1.126 -7.434 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -10.623 -0.969 -5.693 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -12.721 0.405 -6.030 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -12.615 0.069 -7.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -13.563 -1.892 -7.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -12.384 -2.351 -6.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -13.769 -1.513 -5.784 1.00 0.00 H new ATOM 562 N HIS A 35 -7.566 -1.841 -8.529 1.00 0.00 N ATOM 563 CA HIS A 35 -7.824 -3.193 -9.027 1.00 0.00 C ATOM 564 C HIS A 35 -6.842 -4.176 -8.403 1.00 0.00 C ATOM 565 O HIS A 35 -5.633 -3.993 -8.514 1.00 0.00 O ATOM 566 CB HIS A 35 -7.677 -3.263 -10.553 1.00 0.00 C ATOM 567 CG HIS A 35 -8.972 -3.245 -11.305 1.00 0.00 C ATOM 568 ND1 HIS A 35 -9.802 -4.338 -11.397 1.00 0.00 N ATOM 569 CD2 HIS A 35 -9.560 -2.269 -12.030 1.00 0.00 C ATOM 570 CE1 HIS A 35 -10.847 -4.033 -12.143 1.00 0.00 C ATOM 571 NE2 HIS A 35 -10.724 -2.783 -12.543 1.00 0.00 N ATOM 0 H HIS A 35 -6.673 -1.744 -8.046 1.00 0.00 H new ATOM 0 HA HIS A 35 -8.847 -3.453 -8.754 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -7.067 -2.423 -10.885 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -7.134 -4.172 -10.811 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -9.183 -1.268 -12.179 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -11.665 -4.696 -12.385 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -11.385 -2.281 -13.136 1.00 0.00 H new ATOM 580 N GLY A 36 -7.360 -5.203 -7.743 1.00 0.00 N ATOM 581 CA GLY A 36 -6.505 -6.247 -7.204 1.00 0.00 C ATOM 582 C GLY A 36 -6.929 -6.718 -5.827 1.00 0.00 C ATOM 583 O GLY A 36 -7.864 -6.177 -5.234 1.00 0.00 O ATOM 0 H GLY A 36 -8.357 -5.334 -7.570 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.506 -7.096 -7.887 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -5.480 -5.879 -7.155 1.00 0.00 H new ATOM 587 N GLN A 37 -6.245 -7.746 -5.337 1.00 0.00 N ATOM 588 CA GLN A 37 -6.467 -8.264 -3.990 1.00 0.00 C ATOM 589 C GLN A 37 -5.158 -8.318 -3.214 1.00 0.00 C ATOM 590 O GLN A 37 -5.121 -8.038 -2.016 1.00 0.00 O ATOM 591 CB GLN A 37 -7.089 -9.666 -4.029 1.00 0.00 C ATOM 592 CG GLN A 37 -7.085 -10.353 -2.668 1.00 0.00 C ATOM 593 CD GLN A 37 -7.720 -11.729 -2.669 1.00 0.00 C ATOM 594 OE1 GLN A 37 -7.745 -12.425 -3.686 1.00 0.00 O ATOM 595 NE2 GLN A 37 -8.214 -12.144 -1.511 1.00 0.00 N ATOM 0 H GLN A 37 -5.523 -8.243 -5.859 1.00 0.00 H new ATOM 0 HA GLN A 37 -7.159 -7.586 -3.490 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -8.115 -9.593 -4.391 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -6.542 -10.281 -4.743 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -6.056 -10.440 -2.319 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -7.612 -9.722 -1.952 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -8.174 -11.537 -0.692 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -8.635 -13.070 -1.439 1.00 0.00 H new ATOM 604 N PHE A 38 -4.094 -8.692 -3.901 1.00 0.00 N ATOM 605 CA PHE A 38 -2.794 -8.855 -3.272 1.00 0.00 C ATOM 606 C PHE A 38 -1.722 -8.175 -4.111 1.00 0.00 C ATOM 607 O PHE A 38 -1.033 -8.817 -4.909 1.00 0.00 O ATOM 608 CB PHE A 38 -2.484 -10.346 -3.118 1.00 0.00 C ATOM 609 CG PHE A 38 -1.441 -10.667 -2.088 1.00 0.00 C ATOM 610 CD1 PHE A 38 -1.373 -9.957 -0.902 1.00 0.00 C ATOM 611 CD2 PHE A 38 -0.535 -11.691 -2.305 1.00 0.00 C ATOM 612 CE1 PHE A 38 -0.419 -10.262 0.048 1.00 0.00 C ATOM 613 CE2 PHE A 38 0.419 -12.001 -1.357 1.00 0.00 C ATOM 614 CZ PHE A 38 0.477 -11.287 -0.180 1.00 0.00 C ATOM 0 H PHE A 38 -4.104 -8.890 -4.902 1.00 0.00 H new ATOM 0 HA PHE A 38 -2.808 -8.392 -2.286 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -3.404 -10.870 -2.859 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -2.156 -10.736 -4.081 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -2.074 -9.156 -0.718 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -0.575 -12.253 -3.226 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -0.374 -9.699 0.969 1.00 0.00 H new ATOM 0 HE2 PHE A 38 1.120 -12.803 -1.538 1.00 0.00 H new ATOM 0 HZ PHE A 38 1.222 -11.529 0.563 1.00 0.00 H new ATOM 624 N ILE A 39 -1.601 -6.865 -3.946 1.00 0.00 N ATOM 625 CA ILE A 39 -0.694 -6.080 -4.768 1.00 0.00 C ATOM 626 C ILE A 39 0.181 -5.158 -3.925 1.00 0.00 C ATOM 627 O ILE A 39 -0.292 -4.478 -3.013 1.00 0.00 O ATOM 628 CB ILE A 39 -1.461 -5.251 -5.825 1.00 0.00 C ATOM 629 CG1 ILE A 39 -2.145 -6.188 -6.824 1.00 0.00 C ATOM 630 CG2 ILE A 39 -0.520 -4.293 -6.547 1.00 0.00 C ATOM 631 CD1 ILE A 39 -2.883 -5.473 -7.932 1.00 0.00 C ATOM 0 H ILE A 39 -2.119 -6.326 -3.252 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.048 -6.791 -5.283 1.00 0.00 H new ATOM 0 HB ILE A 39 -2.222 -4.657 -5.319 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -1.394 -6.843 -7.266 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.847 -6.826 -6.286 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.081 -3.720 -7.286 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -0.070 -3.612 -5.825 1.00 0.00 H new ATOM 0 HG23 ILE A 39 0.264 -4.861 -7.047 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.340 -6.206 -8.597 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.659 -4.840 -7.503 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.183 -4.857 -8.497 1.00 0.00 H new ATOM 643 N TYR A 40 1.466 -5.169 -4.235 1.00 0.00 N ATOM 644 CA TYR A 40 2.434 -4.286 -3.616 1.00 0.00 C ATOM 645 C TYR A 40 2.870 -3.237 -4.627 1.00 0.00 C ATOM 646 O TYR A 40 3.358 -3.569 -5.710 1.00 0.00 O ATOM 647 CB TYR A 40 3.641 -5.097 -3.127 1.00 0.00 C ATOM 648 CG TYR A 40 4.826 -4.270 -2.672 1.00 0.00 C ATOM 649 CD1 TYR A 40 4.845 -3.678 -1.417 1.00 0.00 C ATOM 650 CD2 TYR A 40 5.936 -4.100 -3.495 1.00 0.00 C ATOM 651 CE1 TYR A 40 5.932 -2.940 -0.995 1.00 0.00 C ATOM 652 CE2 TYR A 40 7.028 -3.368 -3.074 1.00 0.00 C ATOM 653 CZ TYR A 40 7.021 -2.791 -1.825 1.00 0.00 C ATOM 654 OH TYR A 40 8.111 -2.076 -1.396 1.00 0.00 O ATOM 0 H TYR A 40 1.868 -5.798 -4.930 1.00 0.00 H new ATOM 0 HA TYR A 40 1.984 -3.788 -2.757 1.00 0.00 H new ATOM 0 HB2 TYR A 40 3.322 -5.733 -2.301 1.00 0.00 H new ATOM 0 HB3 TYR A 40 3.965 -5.758 -3.931 1.00 0.00 H new ATOM 0 HD1 TYR A 40 3.996 -3.797 -0.760 1.00 0.00 H new ATOM 0 HD2 TYR A 40 5.943 -4.548 -4.478 1.00 0.00 H new ATOM 0 HE1 TYR A 40 5.929 -2.481 -0.017 1.00 0.00 H new ATOM 0 HE2 TYR A 40 7.884 -3.249 -3.722 1.00 0.00 H new ATOM 0 HH TYR A 40 8.579 -1.698 -2.169 1.00 0.00 H new ATOM 664 N VAL A 41 2.670 -1.980 -4.288 1.00 0.00 N ATOM 665 CA VAL A 41 3.054 -0.891 -5.164 1.00 0.00 C ATOM 666 C VAL A 41 4.197 -0.094 -4.554 1.00 0.00 C ATOM 667 O VAL A 41 4.271 0.080 -3.335 1.00 0.00 O ATOM 668 CB VAL A 41 1.866 0.051 -5.471 1.00 0.00 C ATOM 669 CG1 VAL A 41 0.804 -0.669 -6.286 1.00 0.00 C ATOM 670 CG2 VAL A 41 1.262 0.607 -4.190 1.00 0.00 C ATOM 0 H VAL A 41 2.243 -1.686 -3.410 1.00 0.00 H new ATOM 0 HA VAL A 41 3.382 -1.335 -6.104 1.00 0.00 H new ATOM 0 HB VAL A 41 2.248 0.886 -6.058 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -0.022 0.012 -6.490 1.00 0.00 H new ATOM 0 HG12 VAL A 41 1.236 -1.008 -7.228 1.00 0.00 H new ATOM 0 HG13 VAL A 41 0.435 -1.528 -5.725 1.00 0.00 H new ATOM 0 HG21 VAL A 41 0.429 1.266 -4.436 1.00 0.00 H new ATOM 0 HG22 VAL A 41 0.904 -0.215 -3.570 1.00 0.00 H new ATOM 0 HG23 VAL A 41 2.020 1.169 -3.644 1.00 0.00 H new ATOM 680 N TRP A 42 5.101 0.367 -5.397 1.00 0.00 N ATOM 681 CA TRP A 42 6.214 1.176 -4.937 1.00 0.00 C ATOM 682 C TRP A 42 6.393 2.376 -5.856 1.00 0.00 C ATOM 683 O TRP A 42 5.999 2.335 -7.025 1.00 0.00 O ATOM 684 CB TRP A 42 7.506 0.342 -4.867 1.00 0.00 C ATOM 685 CG TRP A 42 8.094 0.010 -6.204 1.00 0.00 C ATOM 686 CD1 TRP A 42 7.603 -0.868 -7.127 1.00 0.00 C ATOM 687 CD2 TRP A 42 9.299 0.546 -6.761 1.00 0.00 C ATOM 688 NE1 TRP A 42 8.423 -0.897 -8.229 1.00 0.00 N ATOM 689 CE2 TRP A 42 9.472 -0.040 -8.026 1.00 0.00 C ATOM 690 CE3 TRP A 42 10.244 1.475 -6.314 1.00 0.00 C ATOM 691 CZ2 TRP A 42 10.552 0.270 -8.847 1.00 0.00 C ATOM 692 CZ3 TRP A 42 11.317 1.777 -7.126 1.00 0.00 C ATOM 693 CH2 TRP A 42 11.463 1.178 -8.383 1.00 0.00 C ATOM 0 H TRP A 42 5.087 0.196 -6.402 1.00 0.00 H new ATOM 0 HA TRP A 42 5.996 1.533 -3.931 1.00 0.00 H new ATOM 0 HB2 TRP A 42 8.246 0.888 -4.282 1.00 0.00 H new ATOM 0 HB3 TRP A 42 7.298 -0.585 -4.333 1.00 0.00 H new ATOM 0 HD1 TRP A 42 6.703 -1.453 -7.008 1.00 0.00 H new ATOM 0 HE1 TRP A 42 8.275 -1.465 -9.063 1.00 0.00 H new ATOM 0 HE3 TRP A 42 10.135 1.948 -5.349 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 10.667 -0.191 -9.817 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 12.057 2.487 -6.787 1.00 0.00 H new ATOM 0 HH2 TRP A 42 12.312 1.438 -8.998 1.00 0.00 H new ATOM 787 N SER A 50 0.459 7.212 -1.317 1.00 0.00 N ATOM 788 CA SER A 50 -0.685 6.845 -0.493 1.00 0.00 C ATOM 789 C SER A 50 -1.981 7.371 -1.115 1.00 0.00 C ATOM 790 O SER A 50 -3.055 7.290 -0.516 1.00 0.00 O ATOM 791 CB SER A 50 -0.499 7.435 0.908 1.00 0.00 C ATOM 792 OG SER A 50 0.855 7.328 1.322 1.00 0.00 O ATOM 0 HA SER A 50 -0.752 5.759 -0.430 1.00 0.00 H new ATOM 0 HB2 SER A 50 -0.804 8.482 0.911 1.00 0.00 H new ATOM 0 HB3 SER A 50 -1.143 6.914 1.616 1.00 0.00 H new ATOM 0 HG SER A 50 1.177 6.417 1.156 1.00 0.00 H new ATOM 798 N HIS A 51 -1.866 7.886 -2.334 1.00 0.00 N ATOM 799 CA HIS A 51 -2.980 8.541 -3.013 1.00 0.00 C ATOM 800 C HIS A 51 -4.062 7.528 -3.385 1.00 0.00 C ATOM 801 O HIS A 51 -5.238 7.713 -3.068 1.00 0.00 O ATOM 802 CB HIS A 51 -2.460 9.253 -4.268 1.00 0.00 C ATOM 803 CG HIS A 51 -3.399 10.248 -4.877 1.00 0.00 C ATOM 804 ND1 HIS A 51 -3.069 10.987 -5.994 1.00 0.00 N ATOM 805 CD2 HIS A 51 -4.645 10.641 -4.526 1.00 0.00 C ATOM 806 CE1 HIS A 51 -4.068 11.786 -6.303 1.00 0.00 C ATOM 807 NE2 HIS A 51 -5.038 11.596 -5.431 1.00 0.00 N ATOM 0 H HIS A 51 -1.003 7.862 -2.878 1.00 0.00 H new ATOM 0 HA HIS A 51 -3.425 9.273 -2.339 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -1.530 9.763 -4.017 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -2.218 8.500 -5.018 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -5.222 10.273 -3.691 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -4.089 12.480 -7.131 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -5.936 12.080 -5.429 1.00 0.00 H new ATOM 816 N LEU A 52 -3.657 6.451 -4.045 1.00 0.00 N ATOM 817 CA LEU A 52 -4.603 5.450 -4.523 1.00 0.00 C ATOM 818 C LEU A 52 -5.110 4.573 -3.379 1.00 0.00 C ATOM 819 O LEU A 52 -6.220 4.046 -3.442 1.00 0.00 O ATOM 820 CB LEU A 52 -3.972 4.607 -5.643 1.00 0.00 C ATOM 821 CG LEU A 52 -2.689 3.849 -5.280 1.00 0.00 C ATOM 822 CD1 LEU A 52 -3.005 2.437 -4.809 1.00 0.00 C ATOM 823 CD2 LEU A 52 -1.740 3.819 -6.468 1.00 0.00 C ATOM 0 H LEU A 52 -2.681 6.248 -4.262 1.00 0.00 H new ATOM 0 HA LEU A 52 -5.468 5.968 -4.937 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -4.712 3.884 -5.985 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -3.755 5.264 -6.485 1.00 0.00 H new ATOM 0 HG LEU A 52 -2.202 4.375 -4.459 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -2.078 1.921 -4.558 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -3.645 2.482 -3.928 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -3.518 1.895 -5.603 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -0.834 3.278 -6.196 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -2.223 3.319 -7.307 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.482 4.839 -6.753 1.00 0.00 H new ATOM 835 N LEU A 53 -4.298 4.441 -2.328 1.00 0.00 N ATOM 836 CA LEU A 53 -4.660 3.625 -1.168 1.00 0.00 C ATOM 837 C LEU A 53 -5.951 4.121 -0.525 1.00 0.00 C ATOM 838 O LEU A 53 -6.827 3.331 -0.181 1.00 0.00 O ATOM 839 CB LEU A 53 -3.536 3.619 -0.120 1.00 0.00 C ATOM 840 CG LEU A 53 -2.372 2.655 -0.386 1.00 0.00 C ATOM 841 CD1 LEU A 53 -1.564 3.087 -1.597 1.00 0.00 C ATOM 842 CD2 LEU A 53 -1.477 2.554 0.839 1.00 0.00 C ATOM 0 H LEU A 53 -3.385 4.889 -2.257 1.00 0.00 H new ATOM 0 HA LEU A 53 -4.813 2.608 -1.528 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -3.134 4.629 -0.042 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -3.971 3.373 0.849 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.793 1.672 -0.597 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.747 2.384 -1.759 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -2.208 3.104 -2.477 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -1.157 4.083 -1.426 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.656 1.867 0.634 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -1.075 3.538 1.078 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -2.058 2.184 1.684 1.00 0.00 H new ATOM 854 N GLN A 54 -6.068 5.433 -0.378 1.00 0.00 N ATOM 855 CA GLN A 54 -7.234 6.025 0.267 1.00 0.00 C ATOM 856 C GLN A 54 -8.496 5.830 -0.570 1.00 0.00 C ATOM 857 O GLN A 54 -9.577 5.597 -0.030 1.00 0.00 O ATOM 858 CB GLN A 54 -6.999 7.510 0.535 1.00 0.00 C ATOM 859 CG GLN A 54 -5.928 7.774 1.577 1.00 0.00 C ATOM 860 CD GLN A 54 -5.727 9.253 1.822 1.00 0.00 C ATOM 861 OE1 GLN A 54 -6.394 9.850 2.666 1.00 0.00 O ATOM 862 NE2 GLN A 54 -4.803 9.854 1.091 1.00 0.00 N ATOM 0 H GLN A 54 -5.372 6.108 -0.695 1.00 0.00 H new ATOM 0 HA GLN A 54 -7.382 5.513 1.218 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -6.716 7.999 -0.397 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -7.934 7.964 0.863 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -6.204 7.286 2.512 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -4.988 7.330 1.251 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -4.272 9.322 0.402 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -4.621 10.850 1.217 1.00 0.00 H new ATOM 871 N ALA A 55 -8.350 5.912 -1.888 1.00 0.00 N ATOM 872 CA ALA A 55 -9.474 5.714 -2.795 1.00 0.00 C ATOM 873 C ALA A 55 -9.965 4.273 -2.722 1.00 0.00 C ATOM 874 O ALA A 55 -11.167 4.007 -2.757 1.00 0.00 O ATOM 875 CB ALA A 55 -9.072 6.071 -4.219 1.00 0.00 C ATOM 0 H ALA A 55 -7.464 6.114 -2.352 1.00 0.00 H new ATOM 0 HA ALA A 55 -10.289 6.371 -2.492 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -9.921 5.919 -4.886 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -8.762 7.115 -4.259 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -8.245 5.435 -4.534 1.00 0.00 H new ATOM 881 N TRP A 56 -9.016 3.356 -2.605 1.00 0.00 N ATOM 882 CA TRP A 56 -9.310 1.933 -2.493 1.00 0.00 C ATOM 883 C TRP A 56 -10.040 1.638 -1.183 1.00 0.00 C ATOM 884 O TRP A 56 -11.003 0.871 -1.150 1.00 0.00 O ATOM 885 CB TRP A 56 -7.995 1.153 -2.579 1.00 0.00 C ATOM 886 CG TRP A 56 -8.141 -0.336 -2.563 1.00 0.00 C ATOM 887 CD1 TRP A 56 -8.659 -1.125 -3.550 1.00 0.00 C ATOM 888 CD2 TRP A 56 -7.727 -1.220 -1.517 1.00 0.00 C ATOM 889 NE1 TRP A 56 -8.598 -2.444 -3.179 1.00 0.00 N ATOM 890 CE2 TRP A 56 -8.031 -2.527 -1.934 1.00 0.00 C ATOM 891 CE3 TRP A 56 -7.130 -1.031 -0.265 1.00 0.00 C ATOM 892 CZ2 TRP A 56 -7.760 -3.639 -1.148 1.00 0.00 C ATOM 893 CZ3 TRP A 56 -6.862 -2.139 0.515 1.00 0.00 C ATOM 894 CH2 TRP A 56 -7.176 -3.429 0.071 1.00 0.00 C ATOM 0 H TRP A 56 -8.020 3.576 -2.585 1.00 0.00 H new ATOM 0 HA TRP A 56 -9.966 1.625 -3.307 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -7.477 1.442 -3.494 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -7.359 1.450 -1.745 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -9.058 -0.763 -4.486 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -8.922 -3.234 -3.738 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -6.884 -0.039 0.084 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -8.002 -4.635 -1.487 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -6.403 -2.008 1.484 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -6.953 -4.275 0.704 1.00 0.00 H new ATOM 905 N VAL A 57 -9.584 2.273 -0.111 1.00 0.00 N ATOM 906 CA VAL A 57 -10.214 2.124 1.194 1.00 0.00 C ATOM 907 C VAL A 57 -11.615 2.739 1.202 1.00 0.00 C ATOM 908 O VAL A 57 -12.570 2.116 1.664 1.00 0.00 O ATOM 909 CB VAL A 57 -9.350 2.770 2.304 1.00 0.00 C ATOM 910 CG1 VAL A 57 -10.080 2.778 3.641 1.00 0.00 C ATOM 911 CG2 VAL A 57 -8.020 2.035 2.433 1.00 0.00 C ATOM 0 H VAL A 57 -8.778 2.898 -0.120 1.00 0.00 H new ATOM 0 HA VAL A 57 -10.301 1.056 1.395 1.00 0.00 H new ATOM 0 HB VAL A 57 -9.159 3.805 2.020 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.446 3.238 4.399 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -11.005 3.347 3.547 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -10.312 1.754 3.935 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.422 2.500 3.217 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -8.204 0.991 2.687 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -7.482 2.088 1.487 1.00 0.00 H new ATOM 921 N ALA A 58 -11.732 3.946 0.658 1.00 0.00 N ATOM 922 CA ALA A 58 -12.993 4.681 0.668 1.00 0.00 C ATOM 923 C ALA A 58 -14.095 3.930 -0.068 1.00 0.00 C ATOM 924 O ALA A 58 -15.223 3.842 0.421 1.00 0.00 O ATOM 925 CB ALA A 58 -12.802 6.062 0.055 1.00 0.00 C ATOM 0 H ALA A 58 -10.964 4.439 0.202 1.00 0.00 H new ATOM 0 HA ALA A 58 -13.303 4.786 1.708 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -13.750 6.600 0.068 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -12.062 6.617 0.631 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -12.458 5.959 -0.974 1.00 0.00 H new ATOM 931 N GLN A 59 -13.774 3.374 -1.234 1.00 0.00 N ATOM 932 CA GLN A 59 -14.778 2.685 -2.036 1.00 0.00 C ATOM 933 C GLN A 59 -15.262 1.426 -1.317 1.00 0.00 C ATOM 934 O GLN A 59 -16.438 1.063 -1.403 1.00 0.00 O ATOM 935 CB GLN A 59 -14.240 2.366 -3.445 1.00 0.00 C ATOM 936 CG GLN A 59 -13.089 1.370 -3.486 1.00 0.00 C ATOM 937 CD GLN A 59 -13.551 -0.078 -3.510 1.00 0.00 C ATOM 938 OE1 GLN A 59 -14.698 -0.330 -4.123 1.00 0.00 O flip ATOM 939 NE2 GLN A 59 -12.873 -0.970 -3.001 1.00 0.00 N flip ATOM 0 H GLN A 59 -12.838 3.387 -1.639 1.00 0.00 H new ATOM 0 HA GLN A 59 -15.634 3.348 -2.162 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -15.059 1.977 -4.050 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -13.913 3.295 -3.911 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -12.480 1.565 -4.368 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -12.450 1.527 -2.617 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -11.994 -0.741 -2.537 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -13.190 -1.939 -3.044 1.00 0.00 H new ATOM 948 N ALA A 60 -14.355 0.773 -0.591 1.00 0.00 N ATOM 949 CA ALA A 60 -14.710 -0.399 0.197 1.00 0.00 C ATOM 950 C ALA A 60 -15.585 0.005 1.375 1.00 0.00 C ATOM 951 O ALA A 60 -16.539 -0.693 1.724 1.00 0.00 O ATOM 952 CB ALA A 60 -13.461 -1.119 0.681 1.00 0.00 C ATOM 0 H ALA A 60 -13.372 1.038 -0.534 1.00 0.00 H new ATOM 0 HA ALA A 60 -15.273 -1.085 -0.436 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -13.748 -1.992 1.268 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -12.869 -1.438 -0.177 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -12.869 -0.445 1.300 1.00 0.00 H new ATOM 958 N LEU A 61 -15.259 1.147 1.968 1.00 0.00 N ATOM 959 CA LEU A 61 -16.031 1.697 3.075 1.00 0.00 C ATOM 960 C LEU A 61 -17.473 1.966 2.655 1.00 0.00 C ATOM 961 O LEU A 61 -18.413 1.570 3.344 1.00 0.00 O ATOM 962 CB LEU A 61 -15.378 2.986 3.584 1.00 0.00 C ATOM 963 CG LEU A 61 -14.049 2.793 4.319 1.00 0.00 C ATOM 964 CD1 LEU A 61 -13.497 4.130 4.781 1.00 0.00 C ATOM 965 CD2 LEU A 61 -14.218 1.854 5.504 1.00 0.00 C ATOM 0 H LEU A 61 -14.456 1.715 1.697 1.00 0.00 H new ATOM 0 HA LEU A 61 -16.043 0.963 3.881 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -15.214 3.651 2.736 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -16.076 3.489 4.253 1.00 0.00 H new ATOM 0 HG LEU A 61 -13.339 2.344 3.624 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -12.552 3.973 5.301 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -13.333 4.774 3.917 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -14.209 4.604 5.457 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -13.261 1.732 6.011 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -14.946 2.273 6.199 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -14.569 0.884 5.152 1.00 0.00 H new ATOM 977 N GLU A 62 -17.642 2.620 1.512 1.00 0.00 N ATOM 978 CA GLU A 62 -18.976 2.939 1.010 1.00 0.00 C ATOM 979 C GLU A 62 -19.699 1.680 0.535 1.00 0.00 C ATOM 980 O GLU A 62 -20.919 1.678 0.360 1.00 0.00 O ATOM 981 CB GLU A 62 -18.901 3.960 -0.121 1.00 0.00 C ATOM 982 CG GLU A 62 -18.276 5.276 0.302 1.00 0.00 C ATOM 983 CD GLU A 62 -18.324 6.324 -0.789 1.00 0.00 C ATOM 984 OE1 GLU A 62 -17.509 6.255 -1.732 1.00 0.00 O ATOM 985 OE2 GLU A 62 -19.180 7.230 -0.704 1.00 0.00 O ATOM 0 H GLU A 62 -16.877 2.939 0.917 1.00 0.00 H new ATOM 0 HA GLU A 62 -19.544 3.373 1.833 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -18.324 3.539 -0.944 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -19.906 4.148 -0.500 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -18.794 5.652 1.184 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -17.239 5.105 0.590 1.00 0.00 H new ATOM 992 N ALA A 63 -18.942 0.611 0.330 1.00 0.00 N ATOM 993 CA ALA A 63 -19.512 -0.669 -0.076 1.00 0.00 C ATOM 994 C ALA A 63 -19.982 -1.460 1.138 1.00 0.00 C ATOM 995 O ALA A 63 -20.462 -2.587 1.008 1.00 0.00 O ATOM 996 CB ALA A 63 -18.499 -1.483 -0.871 1.00 0.00 C ATOM 0 H ALA A 63 -17.928 0.604 0.438 1.00 0.00 H new ATOM 0 HA ALA A 63 -20.373 -0.466 -0.713 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -18.945 -2.434 -1.164 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -18.207 -0.929 -1.763 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -17.619 -1.669 -0.256 1.00 0.00 H new ATOM 1002 N GLY A 64 -19.823 -0.876 2.320 1.00 0.00 N ATOM 1003 CA GLY A 64 -20.272 -1.527 3.534 1.00 0.00 C ATOM 1004 C GLY A 64 -19.244 -2.497 4.079 1.00 0.00 C ATOM 1005 O GLY A 64 -19.518 -3.256 5.011 1.00 0.00 O ATOM 0 H GLY A 64 -19.391 0.037 2.458 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -20.492 -0.772 4.289 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -21.202 -2.060 3.336 1.00 0.00 H new ATOM 1009 N LYS A 65 -18.054 -2.466 3.500 1.00 0.00 N ATOM 1010 CA LYS A 65 -16.986 -3.354 3.900 1.00 0.00 C ATOM 1011 C LYS A 65 -16.047 -2.613 4.829 1.00 0.00 C ATOM 1012 O LYS A 65 -16.033 -1.381 4.860 1.00 0.00 O ATOM 1013 CB LYS A 65 -16.220 -3.853 2.671 1.00 0.00 C ATOM 1014 CG LYS A 65 -17.106 -4.493 1.614 1.00 0.00 C ATOM 1015 CD LYS A 65 -17.778 -5.752 2.136 1.00 0.00 C ATOM 1016 CE LYS A 65 -18.676 -6.386 1.085 1.00 0.00 C ATOM 1017 NZ LYS A 65 -19.873 -5.554 0.786 1.00 0.00 N ATOM 0 H LYS A 65 -17.807 -1.827 2.744 1.00 0.00 H new ATOM 0 HA LYS A 65 -17.408 -4.216 4.416 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -15.684 -3.016 2.224 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -15.471 -4.577 2.991 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -17.866 -3.780 1.295 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -16.508 -4.736 0.736 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -17.018 -6.469 2.446 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -18.367 -5.510 3.021 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -18.106 -6.540 0.169 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -18.997 -7.369 1.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -20.727 -6.040 1.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -19.784 -4.634 1.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -19.945 -5.406 -0.241 1.00 0.00 H new ATOM 1031 N ASN A 66 -15.278 -3.355 5.592 1.00 0.00 N ATOM 1032 CA ASN A 66 -14.329 -2.746 6.507 1.00 0.00 C ATOM 1033 C ASN A 66 -12.992 -2.562 5.811 1.00 0.00 C ATOM 1034 O ASN A 66 -12.487 -3.479 5.161 1.00 0.00 O ATOM 1035 CB ASN A 66 -14.153 -3.600 7.760 1.00 0.00 C ATOM 1036 CG ASN A 66 -13.657 -2.790 8.948 1.00 0.00 C ATOM 1037 OD1 ASN A 66 -12.977 -1.779 8.790 1.00 0.00 O ATOM 1038 ND2 ASN A 66 -13.995 -3.232 10.146 1.00 0.00 N ATOM 0 H ASN A 66 -15.287 -4.375 5.601 1.00 0.00 H new ATOM 0 HA ASN A 66 -14.717 -1.774 6.810 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -15.104 -4.068 8.014 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -13.448 -4.404 7.552 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -13.690 -2.730 10.980 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -14.561 -4.076 10.237 1.00 0.00 H new ATOM 1045 N ALA A 67 -12.422 -1.383 5.965 1.00 0.00 N ATOM 1046 CA ALA A 67 -11.182 -1.028 5.296 1.00 0.00 C ATOM 1047 C ALA A 67 -10.443 0.040 6.085 1.00 0.00 C ATOM 1048 O ALA A 67 -11.069 0.894 6.717 1.00 0.00 O ATOM 1049 CB ALA A 67 -11.469 -0.539 3.883 1.00 0.00 C ATOM 0 H ALA A 67 -12.803 -0.644 6.556 1.00 0.00 H new ATOM 0 HA ALA A 67 -10.550 -1.914 5.237 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -10.532 -0.276 3.392 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -11.966 -1.328 3.319 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -12.115 0.338 3.926 1.00 0.00 H new ATOM 1055 N ALA A 68 -9.120 -0.018 6.063 1.00 0.00 N ATOM 1056 CA ALA A 68 -8.307 0.957 6.773 1.00 0.00 C ATOM 1057 C ALA A 68 -6.974 1.181 6.071 1.00 0.00 C ATOM 1058 O ALA A 68 -6.350 0.237 5.583 1.00 0.00 O ATOM 1059 CB ALA A 68 -8.075 0.503 8.207 1.00 0.00 C ATOM 0 H ALA A 68 -8.587 -0.729 5.562 1.00 0.00 H new ATOM 0 HA ALA A 68 -8.847 1.904 6.781 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.465 1.241 8.728 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -9.034 0.400 8.716 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.560 -0.458 8.206 1.00 0.00 H new ATOM 1065 N TYR A 69 -6.549 2.435 6.022 1.00 0.00 N ATOM 1066 CA TYR A 69 -5.247 2.788 5.475 1.00 0.00 C ATOM 1067 C TYR A 69 -4.328 3.229 6.608 1.00 0.00 C ATOM 1068 O TYR A 69 -4.627 4.173 7.340 1.00 0.00 O ATOM 1069 CB TYR A 69 -5.369 3.877 4.392 1.00 0.00 C ATOM 1070 CG TYR A 69 -6.066 5.154 4.830 1.00 0.00 C ATOM 1071 CD1 TYR A 69 -7.454 5.241 4.863 1.00 0.00 C ATOM 1072 CD2 TYR A 69 -5.334 6.280 5.190 1.00 0.00 C ATOM 1073 CE1 TYR A 69 -8.090 6.409 5.245 1.00 0.00 C ATOM 1074 CE2 TYR A 69 -5.963 7.451 5.576 1.00 0.00 C ATOM 1075 CZ TYR A 69 -7.340 7.512 5.602 1.00 0.00 C ATOM 1076 OH TYR A 69 -7.965 8.682 5.977 1.00 0.00 O ATOM 0 H TYR A 69 -7.092 3.231 6.357 1.00 0.00 H new ATOM 0 HA TYR A 69 -4.816 1.912 4.991 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -4.369 4.131 4.041 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -5.909 3.461 3.541 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -8.046 4.381 4.585 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -4.255 6.240 5.168 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -9.169 6.458 5.264 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -5.377 8.314 5.856 1.00 0.00 H new ATOM 0 HH TYR A 69 -7.290 9.357 6.197 1.00 0.00 H new ATOM 1086 N ILE A 70 -3.222 2.523 6.762 1.00 0.00 N ATOM 1087 CA ILE A 70 -2.325 2.747 7.883 1.00 0.00 C ATOM 1088 C ILE A 70 -0.957 3.226 7.413 1.00 0.00 C ATOM 1089 O ILE A 70 -0.311 2.589 6.579 1.00 0.00 O ATOM 1090 CB ILE A 70 -2.168 1.466 8.734 1.00 0.00 C ATOM 1091 CG1 ILE A 70 -3.543 0.982 9.210 1.00 0.00 C ATOM 1092 CG2 ILE A 70 -1.250 1.724 9.927 1.00 0.00 C ATOM 1093 CD1 ILE A 70 -3.505 -0.319 9.982 1.00 0.00 C ATOM 0 H ILE A 70 -2.922 1.787 6.123 1.00 0.00 H new ATOM 0 HA ILE A 70 -2.771 3.527 8.501 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.716 0.689 8.118 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.990 1.752 9.838 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.193 0.860 8.344 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.151 0.811 10.514 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -0.268 2.034 9.570 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -1.675 2.512 10.549 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.516 -0.593 10.283 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.089 -1.104 9.351 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.883 -0.198 10.869 1.00 0.00 H new ATOM 1105 N ASP A 71 -0.531 4.356 7.960 1.00 0.00 N ATOM 1106 CA ASP A 71 0.770 4.933 7.657 1.00 0.00 C ATOM 1107 C ASP A 71 1.755 4.501 8.728 1.00 0.00 C ATOM 1108 O ASP A 71 1.660 4.937 9.871 1.00 0.00 O ATOM 1109 CB ASP A 71 0.668 6.462 7.614 1.00 0.00 C ATOM 1110 CG ASP A 71 1.993 7.139 7.311 1.00 0.00 C ATOM 1111 OD1 ASP A 71 2.890 7.115 8.178 1.00 0.00 O ATOM 1112 OD2 ASP A 71 2.131 7.715 6.211 1.00 0.00 O ATOM 0 H ASP A 71 -1.079 4.899 8.627 1.00 0.00 H new ATOM 0 HA ASP A 71 1.113 4.585 6.683 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.062 6.750 6.858 1.00 0.00 H new ATOM 0 HB3 ASP A 71 0.293 6.822 8.572 1.00 0.00 H new ATOM 1117 N ALA A 72 2.687 3.639 8.361 1.00 0.00 N ATOM 1118 CA ALA A 72 3.583 3.018 9.333 1.00 0.00 C ATOM 1119 C ALA A 72 4.629 3.988 9.877 1.00 0.00 C ATOM 1120 O ALA A 72 5.312 3.682 10.860 1.00 0.00 O ATOM 1121 CB ALA A 72 4.257 1.804 8.717 1.00 0.00 C ATOM 0 H ALA A 72 2.847 3.350 7.396 1.00 0.00 H new ATOM 0 HA ALA A 72 2.972 2.708 10.181 1.00 0.00 H new ATOM 0 HB1 ALA A 72 4.923 1.347 9.449 1.00 0.00 H new ATOM 0 HB2 ALA A 72 3.499 1.081 8.415 1.00 0.00 H new ATOM 0 HB3 ALA A 72 4.833 2.111 7.844 1.00 0.00 H new ATOM 1127 N ALA A 73 4.751 5.151 9.264 1.00 0.00 N ATOM 1128 CA ALA A 73 5.736 6.126 9.697 1.00 0.00 C ATOM 1129 C ALA A 73 5.168 7.025 10.786 1.00 0.00 C ATOM 1130 O ALA A 73 5.843 7.330 11.772 1.00 0.00 O ATOM 1131 CB ALA A 73 6.224 6.960 8.522 1.00 0.00 C ATOM 0 H ALA A 73 4.183 5.443 8.468 1.00 0.00 H new ATOM 0 HA ALA A 73 6.586 5.582 10.110 1.00 0.00 H new ATOM 0 HB1 ALA A 73 6.961 7.683 8.871 1.00 0.00 H new ATOM 0 HB2 ALA A 73 6.680 6.308 7.777 1.00 0.00 H new ATOM 0 HB3 ALA A 73 5.381 7.487 8.075 1.00 0.00 H new ATOM 1137 N SER A 74 3.919 7.424 10.618 1.00 0.00 N ATOM 1138 CA SER A 74 3.277 8.342 11.547 1.00 0.00 C ATOM 1139 C SER A 74 2.406 7.586 12.554 1.00 0.00 C ATOM 1140 O SER A 74 2.206 8.042 13.683 1.00 0.00 O ATOM 1141 CB SER A 74 2.435 9.360 10.765 1.00 0.00 C ATOM 1142 OG SER A 74 1.936 10.387 11.609 1.00 0.00 O ATOM 0 H SER A 74 3.326 7.126 9.844 1.00 0.00 H new ATOM 0 HA SER A 74 4.050 8.869 12.107 1.00 0.00 H new ATOM 0 HB2 SER A 74 3.040 9.802 9.973 1.00 0.00 H new ATOM 0 HB3 SER A 74 1.602 8.849 10.282 1.00 0.00 H new ATOM 0 HG SER A 74 1.406 11.018 11.078 1.00 0.00 H new ATOM 1148 N MET A 75 1.908 6.423 12.155 1.00 0.00 N ATOM 1149 CA MET A 75 0.980 5.663 12.986 1.00 0.00 C ATOM 1150 C MET A 75 1.479 4.236 13.207 1.00 0.00 C ATOM 1151 O MET A 75 2.108 3.645 12.331 1.00 0.00 O ATOM 1152 CB MET A 75 -0.416 5.647 12.344 1.00 0.00 C ATOM 1153 CG MET A 75 -1.095 7.009 12.344 1.00 0.00 C ATOM 1154 SD MET A 75 -2.782 6.965 11.716 1.00 0.00 S ATOM 1155 CE MET A 75 -2.515 6.437 10.026 1.00 0.00 C ATOM 0 H MET A 75 2.130 5.984 11.261 1.00 0.00 H new ATOM 0 HA MET A 75 0.918 6.152 13.958 1.00 0.00 H new ATOM 0 HB2 MET A 75 -0.332 5.291 11.317 1.00 0.00 H new ATOM 0 HB3 MET A 75 -1.046 4.935 12.878 1.00 0.00 H new ATOM 0 HG2 MET A 75 -1.103 7.403 13.360 1.00 0.00 H new ATOM 0 HG3 MET A 75 -0.508 7.700 11.739 1.00 0.00 H new ATOM 0 HE1 MET A 75 -3.219 6.948 9.370 1.00 0.00 H new ATOM 0 HE2 MET A 75 -1.496 6.681 9.725 1.00 0.00 H new ATOM 0 HE3 MET A 75 -2.667 5.360 9.953 1.00 0.00 H new ATOM 1165 N PRO A 76 1.233 3.679 14.399 1.00 0.00 N ATOM 1166 CA PRO A 76 1.605 2.305 14.715 1.00 0.00 C ATOM 1167 C PRO A 76 0.579 1.308 14.206 1.00 0.00 C ATOM 1168 O PRO A 76 -0.602 1.636 14.053 1.00 0.00 O ATOM 1169 CB PRO A 76 1.642 2.291 16.240 1.00 0.00 C ATOM 1170 CG PRO A 76 0.672 3.344 16.664 1.00 0.00 C ATOM 1171 CD PRO A 76 0.589 4.352 15.542 1.00 0.00 C ATOM 0 HA PRO A 76 2.548 2.017 14.249 1.00 0.00 H new ATOM 0 HB2 PRO A 76 1.359 1.314 16.632 1.00 0.00 H new ATOM 0 HB3 PRO A 76 2.644 2.506 16.612 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -0.307 2.908 16.863 1.00 0.00 H new ATOM 0 HG3 PRO A 76 1.001 3.822 17.587 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -0.445 4.614 15.318 1.00 0.00 H new ATOM 0 HD3 PRO A 76 1.104 5.278 15.800 1.00 0.00 H new ATOM 1179 N LEU A 77 1.026 0.094 13.946 1.00 0.00 N ATOM 1180 CA LEU A 77 0.127 -0.963 13.527 1.00 0.00 C ATOM 1181 C LEU A 77 -0.538 -1.560 14.760 1.00 0.00 C ATOM 1182 O LEU A 77 0.086 -1.670 15.813 1.00 0.00 O ATOM 1183 CB LEU A 77 0.897 -2.033 12.746 1.00 0.00 C ATOM 1184 CG LEU A 77 0.039 -3.118 12.092 1.00 0.00 C ATOM 1185 CD1 LEU A 77 -1.018 -2.502 11.192 1.00 0.00 C ATOM 1186 CD2 LEU A 77 0.913 -4.064 11.291 1.00 0.00 C ATOM 0 H LEU A 77 2.005 -0.184 14.018 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.641 -0.559 12.868 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.482 -1.540 11.970 1.00 0.00 H new ATOM 0 HB3 LEU A 77 1.605 -2.513 13.422 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.463 -3.677 12.881 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.615 -3.293 10.738 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.664 -1.852 11.782 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.534 -1.918 10.409 1.00 0.00 H new ATOM 0 HD21 LEU A 77 0.291 -4.832 10.830 1.00 0.00 H new ATOM 0 HD22 LEU A 77 1.436 -3.506 10.514 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.641 -4.535 11.952 1.00 0.00 H new ATOM 1198 N THR A 78 -1.799 -1.934 14.639 1.00 0.00 N ATOM 1199 CA THR A 78 -2.565 -2.357 15.795 1.00 0.00 C ATOM 1200 C THR A 78 -3.444 -3.559 15.458 1.00 0.00 C ATOM 1201 O THR A 78 -3.662 -3.867 14.284 1.00 0.00 O ATOM 1202 CB THR A 78 -3.443 -1.199 16.310 1.00 0.00 C ATOM 1203 OG1 THR A 78 -2.957 0.047 15.787 1.00 0.00 O ATOM 1204 CG2 THR A 78 -3.425 -1.135 17.831 1.00 0.00 C ATOM 0 H THR A 78 -2.311 -1.953 13.757 1.00 0.00 H new ATOM 0 HA THR A 78 -1.862 -2.648 16.575 1.00 0.00 H new ATOM 0 HB THR A 78 -4.465 -1.375 15.976 1.00 0.00 H new ATOM 0 HG1 THR A 78 -3.518 0.781 16.115 1.00 0.00 H new ATOM 0 HG21 THR A 78 -4.052 -0.310 18.168 1.00 0.00 H new ATOM 0 HG22 THR A 78 -3.807 -2.071 18.239 1.00 0.00 H new ATOM 0 HG23 THR A 78 -2.403 -0.979 18.177 1.00 0.00 H new ATOM 1212 N ASP A 79 -3.956 -4.215 16.492 1.00 0.00 N ATOM 1213 CA ASP A 79 -4.779 -5.415 16.342 1.00 0.00 C ATOM 1214 C ASP A 79 -6.106 -5.097 15.656 1.00 0.00 C ATOM 1215 O ASP A 79 -6.752 -5.979 15.091 1.00 0.00 O ATOM 1216 CB ASP A 79 -5.048 -6.042 17.714 1.00 0.00 C ATOM 1217 CG ASP A 79 -5.934 -5.171 18.588 1.00 0.00 C ATOM 1218 OD1 ASP A 79 -5.609 -3.979 18.775 1.00 0.00 O ATOM 1219 OD2 ASP A 79 -6.960 -5.675 19.101 1.00 0.00 O ATOM 0 H ASP A 79 -3.814 -3.932 17.461 1.00 0.00 H new ATOM 0 HA ASP A 79 -4.231 -6.120 15.717 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -5.520 -7.015 17.579 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -4.100 -6.216 18.223 1.00 0.00 H new ATOM 1224 N ALA A 80 -6.497 -3.827 15.708 1.00 0.00 N ATOM 1225 CA ALA A 80 -7.732 -3.358 15.083 1.00 0.00 C ATOM 1226 C ALA A 80 -7.771 -3.686 13.589 1.00 0.00 C ATOM 1227 O ALA A 80 -8.844 -3.795 12.994 1.00 0.00 O ATOM 1228 CB ALA A 80 -7.891 -1.862 15.300 1.00 0.00 C ATOM 0 H ALA A 80 -5.969 -3.095 16.183 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.564 -3.880 15.555 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -8.814 -1.522 14.830 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.929 -1.651 16.369 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -7.044 -1.338 14.857 1.00 0.00 H new ATOM 1234 N ALA A 81 -6.592 -3.834 12.987 1.00 0.00 N ATOM 1235 CA ALA A 81 -6.482 -4.127 11.559 1.00 0.00 C ATOM 1236 C ALA A 81 -7.110 -5.475 11.198 1.00 0.00 C ATOM 1237 O ALA A 81 -7.451 -5.718 10.041 1.00 0.00 O ATOM 1238 CB ALA A 81 -5.024 -4.091 11.129 1.00 0.00 C ATOM 0 H ALA A 81 -5.696 -3.755 13.468 1.00 0.00 H new ATOM 0 HA ALA A 81 -7.037 -3.357 11.022 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -4.953 -4.311 10.064 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.612 -3.101 11.324 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.460 -4.836 11.691 1.00 0.00 H new ATOM 1244 N PHE A 82 -7.274 -6.344 12.187 1.00 0.00 N ATOM 1245 CA PHE A 82 -7.863 -7.657 11.953 1.00 0.00 C ATOM 1246 C PHE A 82 -9.374 -7.566 11.764 1.00 0.00 C ATOM 1247 O PHE A 82 -9.999 -8.515 11.295 1.00 0.00 O ATOM 1248 CB PHE A 82 -7.532 -8.612 13.103 1.00 0.00 C ATOM 1249 CG PHE A 82 -6.132 -9.151 13.044 1.00 0.00 C ATOM 1250 CD1 PHE A 82 -5.859 -10.315 12.341 1.00 0.00 C ATOM 1251 CD2 PHE A 82 -5.091 -8.499 13.683 1.00 0.00 C ATOM 1252 CE1 PHE A 82 -4.573 -10.816 12.280 1.00 0.00 C ATOM 1253 CE2 PHE A 82 -3.805 -8.996 13.624 1.00 0.00 C ATOM 1254 CZ PHE A 82 -3.547 -10.156 12.922 1.00 0.00 C ATOM 0 H PHE A 82 -7.009 -6.165 13.156 1.00 0.00 H new ATOM 0 HA PHE A 82 -7.430 -8.050 11.033 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -7.674 -8.092 14.050 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -8.235 -9.445 13.088 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -6.660 -10.835 11.836 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.288 -7.591 14.234 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -4.372 -11.723 11.730 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.002 -8.478 14.126 1.00 0.00 H new ATOM 0 HZ PHE A 82 -2.541 -10.547 12.876 1.00 0.00 H new ATOM 1264 N GLU A 83 -9.956 -6.430 12.123 1.00 0.00 N ATOM 1265 CA GLU A 83 -11.384 -6.229 11.954 1.00 0.00 C ATOM 1266 C GLU A 83 -11.700 -5.815 10.523 1.00 0.00 C ATOM 1267 O GLU A 83 -12.810 -6.018 10.032 1.00 0.00 O ATOM 1268 CB GLU A 83 -11.883 -5.165 12.919 1.00 0.00 C ATOM 1269 CG GLU A 83 -11.667 -5.518 14.375 1.00 0.00 C ATOM 1270 CD GLU A 83 -12.327 -4.532 15.314 1.00 0.00 C ATOM 1271 OE1 GLU A 83 -11.693 -3.519 15.668 1.00 0.00 O ATOM 1272 OE2 GLU A 83 -13.489 -4.763 15.699 1.00 0.00 O ATOM 0 H GLU A 83 -9.461 -5.637 12.532 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.890 -7.171 12.167 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.377 -4.224 12.703 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -12.947 -5.001 12.748 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -12.061 -6.516 14.566 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -10.597 -5.552 14.582 1.00 0.00 H new ATOM 1279 N ALA A 84 -10.709 -5.238 9.864 1.00 0.00 N ATOM 1280 CA ALA A 84 -10.861 -4.770 8.505 1.00 0.00 C ATOM 1281 C ALA A 84 -10.634 -5.902 7.519 1.00 0.00 C ATOM 1282 O ALA A 84 -9.822 -6.797 7.753 1.00 0.00 O ATOM 1283 CB ALA A 84 -9.904 -3.620 8.232 1.00 0.00 C ATOM 0 H ALA A 84 -9.781 -5.083 10.258 1.00 0.00 H new ATOM 0 HA ALA A 84 -11.881 -4.408 8.377 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -10.030 -3.278 7.205 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.117 -2.799 8.917 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -8.878 -3.958 8.379 1.00 0.00 H new ATOM 1289 N GLU A 85 -11.377 -5.867 6.431 1.00 0.00 N ATOM 1290 CA GLU A 85 -11.220 -6.848 5.369 1.00 0.00 C ATOM 1291 C GLU A 85 -10.232 -6.318 4.335 1.00 0.00 C ATOM 1292 O GLU A 85 -9.477 -7.073 3.727 1.00 0.00 O ATOM 1293 CB GLU A 85 -12.567 -7.139 4.709 1.00 0.00 C ATOM 1294 CG GLU A 85 -12.640 -8.512 4.065 1.00 0.00 C ATOM 1295 CD GLU A 85 -12.604 -9.627 5.090 1.00 0.00 C ATOM 1296 OE1 GLU A 85 -13.547 -9.708 5.904 1.00 0.00 O ATOM 1297 OE2 GLU A 85 -11.649 -10.431 5.079 1.00 0.00 O ATOM 0 H GLU A 85 -12.099 -5.168 6.256 1.00 0.00 H new ATOM 0 HA GLU A 85 -10.838 -7.777 5.793 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -13.355 -7.055 5.457 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -12.764 -6.380 3.952 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -13.556 -8.589 3.479 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -11.807 -8.631 3.372 1.00 0.00 H new ATOM 1304 N TYR A 86 -10.245 -5.002 4.157 1.00 0.00 N ATOM 1305 CA TYR A 86 -9.352 -4.337 3.217 1.00 0.00 C ATOM 1306 C TYR A 86 -8.278 -3.564 3.976 1.00 0.00 C ATOM 1307 O TYR A 86 -8.568 -2.554 4.621 1.00 0.00 O ATOM 1308 CB TYR A 86 -10.137 -3.378 2.312 1.00 0.00 C ATOM 1309 CG TYR A 86 -11.128 -4.054 1.378 1.00 0.00 C ATOM 1310 CD1 TYR A 86 -12.257 -4.701 1.869 1.00 0.00 C ATOM 1311 CD2 TYR A 86 -10.938 -4.027 0.002 1.00 0.00 C ATOM 1312 CE1 TYR A 86 -13.163 -5.305 1.018 1.00 0.00 C ATOM 1313 CE2 TYR A 86 -11.841 -4.629 -0.856 1.00 0.00 C ATOM 1314 CZ TYR A 86 -12.952 -5.267 -0.343 1.00 0.00 C ATOM 1315 OH TYR A 86 -13.859 -5.865 -1.195 1.00 0.00 O ATOM 0 H TYR A 86 -10.871 -4.370 4.657 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.879 -5.097 2.595 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -10.676 -2.668 2.939 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -9.430 -2.803 1.715 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -12.429 -4.732 2.935 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -10.071 -3.528 -0.405 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -14.033 -5.805 1.418 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -11.677 -4.600 -1.923 1.00 0.00 H new ATOM 0 HH TYR A 86 -13.571 -6.782 -1.388 1.00 0.00 H new ATOM 1325 N LEU A 87 -7.046 -4.043 3.916 1.00 0.00 N ATOM 1326 CA LEU A 87 -5.949 -3.395 4.621 1.00 0.00 C ATOM 1327 C LEU A 87 -4.979 -2.737 3.651 1.00 0.00 C ATOM 1328 O LEU A 87 -4.444 -3.389 2.753 1.00 0.00 O ATOM 1329 CB LEU A 87 -5.186 -4.394 5.503 1.00 0.00 C ATOM 1330 CG LEU A 87 -5.860 -4.782 6.822 1.00 0.00 C ATOM 1331 CD1 LEU A 87 -6.270 -3.542 7.602 1.00 0.00 C ATOM 1332 CD2 LEU A 87 -7.056 -5.693 6.579 1.00 0.00 C ATOM 0 H LEU A 87 -6.780 -4.875 3.389 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.391 -2.626 5.255 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -5.017 -5.302 4.925 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -4.206 -3.973 5.729 1.00 0.00 H new ATOM 0 HG LEU A 87 -5.136 -5.336 7.420 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -6.747 -3.841 8.536 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.387 -2.942 7.821 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.970 -2.954 7.009 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -7.515 -5.953 7.533 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -7.785 -5.178 5.954 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.725 -6.602 6.076 1.00 0.00 H new ATOM 1344 N ALA A 88 -4.764 -1.445 3.836 1.00 0.00 N ATOM 1345 CA ALA A 88 -3.784 -0.711 3.054 1.00 0.00 C ATOM 1346 C ALA A 88 -2.641 -0.259 3.951 1.00 0.00 C ATOM 1347 O ALA A 88 -2.812 0.618 4.799 1.00 0.00 O ATOM 1348 CB ALA A 88 -4.429 0.479 2.364 1.00 0.00 C ATOM 0 H ALA A 88 -5.259 -0.880 4.526 1.00 0.00 H new ATOM 0 HA ALA A 88 -3.385 -1.370 2.282 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.677 1.015 1.784 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -5.219 0.130 1.699 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.854 1.148 3.113 1.00 0.00 H new ATOM 1354 N VAL A 89 -1.481 -0.872 3.769 1.00 0.00 N ATOM 1355 CA VAL A 89 -0.323 -0.580 4.602 1.00 0.00 C ATOM 1356 C VAL A 89 0.685 0.259 3.833 1.00 0.00 C ATOM 1357 O VAL A 89 1.216 -0.174 2.808 1.00 0.00 O ATOM 1358 CB VAL A 89 0.360 -1.870 5.104 1.00 0.00 C ATOM 1359 CG1 VAL A 89 1.537 -1.539 6.013 1.00 0.00 C ATOM 1360 CG2 VAL A 89 -0.643 -2.761 5.823 1.00 0.00 C ATOM 0 H VAL A 89 -1.316 -1.577 3.050 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.680 -0.023 5.468 1.00 0.00 H new ATOM 0 HB VAL A 89 0.742 -2.413 4.240 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.003 -2.463 6.355 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.267 -0.946 5.462 1.00 0.00 H new ATOM 0 HG13 VAL A 89 1.184 -0.971 6.873 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -0.143 -3.665 6.170 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -1.058 -2.226 6.677 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -1.447 -3.031 5.138 1.00 0.00 H new ATOM 1370 N ASP A 90 0.941 1.454 4.336 1.00 0.00 N ATOM 1371 CA ASP A 90 1.835 2.393 3.675 1.00 0.00 C ATOM 1372 C ASP A 90 3.199 2.419 4.361 1.00 0.00 C ATOM 1373 O ASP A 90 3.276 2.430 5.592 1.00 0.00 O ATOM 1374 CB ASP A 90 1.210 3.792 3.689 1.00 0.00 C ATOM 1375 CG ASP A 90 2.054 4.821 2.975 1.00 0.00 C ATOM 1376 OD1 ASP A 90 1.868 5.014 1.756 1.00 0.00 O ATOM 1377 OD2 ASP A 90 2.895 5.463 3.631 1.00 0.00 O ATOM 0 H ASP A 90 0.539 1.800 5.207 1.00 0.00 H new ATOM 0 HA ASP A 90 1.981 2.071 2.644 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.226 3.749 3.222 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.059 4.107 4.722 1.00 0.00 H new ATOM 1382 N GLN A 91 4.260 2.413 3.553 1.00 0.00 N ATOM 1383 CA GLN A 91 5.641 2.454 4.041 1.00 0.00 C ATOM 1384 C GLN A 91 5.984 1.209 4.852 1.00 0.00 C ATOM 1385 O GLN A 91 6.326 1.293 6.032 1.00 0.00 O ATOM 1386 CB GLN A 91 5.899 3.719 4.866 1.00 0.00 C ATOM 1387 CG GLN A 91 5.893 4.994 4.042 1.00 0.00 C ATOM 1388 CD GLN A 91 5.890 6.239 4.904 1.00 0.00 C ATOM 1389 OE1 GLN A 91 6.942 6.763 5.268 1.00 0.00 O ATOM 1390 NE2 GLN A 91 4.704 6.722 5.235 1.00 0.00 N ATOM 0 H GLN A 91 4.186 2.379 2.536 1.00 0.00 H new ATOM 0 HA GLN A 91 6.292 2.476 3.167 1.00 0.00 H new ATOM 0 HB2 GLN A 91 5.140 3.796 5.645 1.00 0.00 H new ATOM 0 HB3 GLN A 91 6.862 3.625 5.368 1.00 0.00 H new ATOM 0 HG2 GLN A 91 6.768 5.007 3.392 1.00 0.00 H new ATOM 0 HG3 GLN A 91 5.016 5.001 3.395 1.00 0.00 H new ATOM 0 HE21 GLN A 91 3.856 6.257 4.912 1.00 0.00 H new ATOM 0 HE22 GLN A 91 4.638 7.560 5.813 1.00 0.00 H new ATOM 1399 N VAL A 92 5.914 0.055 4.196 1.00 0.00 N ATOM 1400 CA VAL A 92 6.220 -1.227 4.836 1.00 0.00 C ATOM 1401 C VAL A 92 7.679 -1.267 5.303 1.00 0.00 C ATOM 1402 O VAL A 92 8.013 -1.909 6.296 1.00 0.00 O ATOM 1403 CB VAL A 92 5.957 -2.408 3.871 1.00 0.00 C ATOM 1404 CG1 VAL A 92 6.173 -3.745 4.565 1.00 0.00 C ATOM 1405 CG2 VAL A 92 4.551 -2.329 3.299 1.00 0.00 C ATOM 0 H VAL A 92 5.646 -0.022 3.215 1.00 0.00 H new ATOM 0 HA VAL A 92 5.564 -1.325 5.701 1.00 0.00 H new ATOM 0 HB VAL A 92 6.672 -2.334 3.051 1.00 0.00 H new ATOM 0 HG11 VAL A 92 5.981 -4.555 3.862 1.00 0.00 H new ATOM 0 HG12 VAL A 92 7.202 -3.809 4.920 1.00 0.00 H new ATOM 0 HG13 VAL A 92 5.491 -3.830 5.411 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.386 -3.168 2.623 1.00 0.00 H new ATOM 0 HG22 VAL A 92 3.825 -2.369 4.111 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.433 -1.394 2.752 1.00 0.00 H new ATOM 1415 N GLU A 93 8.535 -0.555 4.586 1.00 0.00 N ATOM 1416 CA GLU A 93 9.954 -0.475 4.922 1.00 0.00 C ATOM 1417 C GLU A 93 10.180 0.265 6.242 1.00 0.00 C ATOM 1418 O GLU A 93 11.235 0.134 6.866 1.00 0.00 O ATOM 1419 CB GLU A 93 10.695 0.248 3.801 1.00 0.00 C ATOM 1420 CG GLU A 93 10.124 1.622 3.508 1.00 0.00 C ATOM 1421 CD GLU A 93 10.740 2.270 2.293 1.00 0.00 C ATOM 1422 OE1 GLU A 93 10.361 1.893 1.162 1.00 0.00 O ATOM 1423 OE2 GLU A 93 11.580 3.176 2.474 1.00 0.00 O ATOM 0 H GLU A 93 8.271 -0.019 3.760 1.00 0.00 H new ATOM 0 HA GLU A 93 10.334 -1.490 5.037 1.00 0.00 H new ATOM 0 HB2 GLU A 93 11.746 0.347 4.072 1.00 0.00 H new ATOM 0 HB3 GLU A 93 10.655 -0.358 2.896 1.00 0.00 H new ATOM 0 HG2 GLU A 93 9.047 1.538 3.361 1.00 0.00 H new ATOM 0 HG3 GLU A 93 10.279 2.266 4.374 1.00 0.00 H new ATOM 1430 N LYS A 94 9.185 1.039 6.665 1.00 0.00 N ATOM 1431 CA LYS A 94 9.321 1.875 7.851 1.00 0.00 C ATOM 1432 C LYS A 94 8.780 1.182 9.103 1.00 0.00 C ATOM 1433 O LYS A 94 8.609 1.819 10.144 1.00 0.00 O ATOM 1434 CB LYS A 94 8.611 3.219 7.646 1.00 0.00 C ATOM 1435 CG LYS A 94 9.567 4.399 7.516 1.00 0.00 C ATOM 1436 CD LYS A 94 10.331 4.393 6.196 1.00 0.00 C ATOM 1437 CE LYS A 94 9.466 4.882 5.042 1.00 0.00 C ATOM 1438 NZ LYS A 94 10.247 5.081 3.791 1.00 0.00 N ATOM 0 H LYS A 94 8.277 1.104 6.204 1.00 0.00 H new ATOM 0 HA LYS A 94 10.386 2.051 8.002 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.994 3.162 6.750 1.00 0.00 H new ATOM 0 HB3 LYS A 94 7.939 3.397 8.485 1.00 0.00 H new ATOM 0 HG2 LYS A 94 9.004 5.329 7.602 1.00 0.00 H new ATOM 0 HG3 LYS A 94 10.277 4.379 8.343 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.213 5.027 6.283 1.00 0.00 H new ATOM 0 HD3 LYS A 94 10.684 3.384 5.984 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.669 4.161 4.859 1.00 0.00 H new ATOM 0 HE3 LYS A 94 8.989 5.821 5.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 9.757 5.767 3.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 11.194 5.441 4.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 10.336 4.174 3.290 1.00 0.00 H new ATOM 1452 N LEU A 95 8.523 -0.120 9.005 1.00 0.00 N ATOM 1453 CA LEU A 95 8.070 -0.897 10.154 1.00 0.00 C ATOM 1454 C LEU A 95 9.174 -0.998 11.203 1.00 0.00 C ATOM 1455 O LEU A 95 10.362 -0.920 10.879 1.00 0.00 O ATOM 1456 CB LEU A 95 7.635 -2.302 9.725 1.00 0.00 C ATOM 1457 CG LEU A 95 6.388 -2.366 8.841 1.00 0.00 C ATOM 1458 CD1 LEU A 95 6.094 -3.807 8.456 1.00 0.00 C ATOM 1459 CD2 LEU A 95 5.193 -1.749 9.552 1.00 0.00 C ATOM 0 H LEU A 95 8.621 -0.657 8.144 1.00 0.00 H new ATOM 0 HA LEU A 95 7.213 -0.382 10.588 1.00 0.00 H new ATOM 0 HB2 LEU A 95 8.461 -2.772 9.192 1.00 0.00 H new ATOM 0 HB3 LEU A 95 7.455 -2.897 10.621 1.00 0.00 H new ATOM 0 HG LEU A 95 6.576 -1.792 7.933 1.00 0.00 H new ATOM 0 HD11 LEU A 95 5.205 -3.841 7.827 1.00 0.00 H new ATOM 0 HD12 LEU A 95 6.942 -4.217 7.908 1.00 0.00 H new ATOM 0 HD13 LEU A 95 5.924 -4.397 9.357 1.00 0.00 H new ATOM 0 HD21 LEU A 95 4.317 -1.805 8.906 1.00 0.00 H new ATOM 0 HD22 LEU A 95 4.998 -2.294 10.476 1.00 0.00 H new ATOM 0 HD23 LEU A 95 5.407 -0.706 9.784 1.00 0.00 H new ATOM 1471 N GLY A 96 8.778 -1.168 12.458 1.00 0.00 N ATOM 1472 CA GLY A 96 9.738 -1.238 13.539 1.00 0.00 C ATOM 1473 C GLY A 96 10.058 -2.661 13.953 1.00 0.00 C ATOM 1474 O GLY A 96 11.069 -3.226 13.535 1.00 0.00 O ATOM 0 H GLY A 96 7.804 -1.259 12.746 1.00 0.00 H new ATOM 0 HA2 GLY A 96 10.658 -0.738 13.234 1.00 0.00 H new ATOM 0 HA3 GLY A 96 9.349 -0.693 14.399 1.00 0.00 H new ATOM 1478 N ASN A 97 9.197 -3.248 14.772 1.00 0.00 N ATOM 1479 CA ASN A 97 9.437 -4.586 15.307 1.00 0.00 C ATOM 1480 C ASN A 97 8.112 -5.293 15.569 1.00 0.00 C ATOM 1481 O ASN A 97 7.767 -6.261 14.892 1.00 0.00 O ATOM 1482 CB ASN A 97 10.252 -4.485 16.602 1.00 0.00 C ATOM 1483 CG ASN A 97 10.798 -5.820 17.083 1.00 0.00 C ATOM 1484 OD1 ASN A 97 10.208 -6.878 16.859 1.00 0.00 O ATOM 1485 ND2 ASN A 97 11.939 -5.773 17.757 1.00 0.00 N ATOM 0 H ASN A 97 8.324 -2.821 15.082 1.00 0.00 H new ATOM 0 HA ASN A 97 10.000 -5.167 14.577 1.00 0.00 H new ATOM 0 HB2 ASN A 97 11.083 -3.797 16.446 1.00 0.00 H new ATOM 0 HB3 ASN A 97 9.625 -4.055 17.383 1.00 0.00 H new ATOM 0 HD21 ASN A 97 12.358 -6.633 18.110 1.00 0.00 H new ATOM 0 HD22 ASN A 97 12.397 -4.877 17.922 1.00 0.00 H new ATOM 1492 N GLU A 98 7.371 -4.780 16.542 1.00 0.00 N ATOM 1493 CA GLU A 98 6.054 -5.304 16.890 1.00 0.00 C ATOM 1494 C GLU A 98 5.130 -5.218 15.683 1.00 0.00 C ATOM 1495 O GLU A 98 4.299 -6.096 15.439 1.00 0.00 O ATOM 1496 CB GLU A 98 5.488 -4.481 18.044 1.00 0.00 C ATOM 1497 CG GLU A 98 4.147 -4.957 18.568 1.00 0.00 C ATOM 1498 CD GLU A 98 3.623 -4.054 19.659 1.00 0.00 C ATOM 1499 OE1 GLU A 98 2.974 -3.040 19.331 1.00 0.00 O ATOM 1500 OE2 GLU A 98 3.886 -4.335 20.849 1.00 0.00 O ATOM 0 H GLU A 98 7.665 -3.988 17.114 1.00 0.00 H new ATOM 0 HA GLU A 98 6.136 -6.348 17.191 1.00 0.00 H new ATOM 0 HB2 GLU A 98 6.206 -4.489 18.864 1.00 0.00 H new ATOM 0 HB3 GLU A 98 5.388 -3.446 17.718 1.00 0.00 H new ATOM 0 HG2 GLU A 98 3.428 -4.994 17.749 1.00 0.00 H new ATOM 0 HG3 GLU A 98 4.246 -5.972 18.952 1.00 0.00 H new ATOM 1507 N GLU A 99 5.320 -4.155 14.918 1.00 0.00 N ATOM 1508 CA GLU A 99 4.545 -3.901 13.718 1.00 0.00 C ATOM 1509 C GLU A 99 4.762 -5.015 12.700 1.00 0.00 C ATOM 1510 O GLU A 99 3.848 -5.383 11.969 1.00 0.00 O ATOM 1511 CB GLU A 99 4.940 -2.553 13.098 1.00 0.00 C ATOM 1512 CG GLU A 99 4.783 -1.350 14.027 1.00 0.00 C ATOM 1513 CD GLU A 99 5.758 -1.359 15.195 1.00 0.00 C ATOM 1514 OE1 GLU A 99 6.877 -1.899 15.038 1.00 0.00 O ATOM 1515 OE2 GLU A 99 5.405 -0.861 16.281 1.00 0.00 O ATOM 0 H GLU A 99 6.021 -3.441 15.115 1.00 0.00 H new ATOM 0 HA GLU A 99 3.491 -3.870 13.994 1.00 0.00 H new ATOM 0 HB2 GLU A 99 5.979 -2.609 12.772 1.00 0.00 H new ATOM 0 HB3 GLU A 99 4.335 -2.388 12.207 1.00 0.00 H new ATOM 0 HG2 GLU A 99 4.925 -0.435 13.452 1.00 0.00 H new ATOM 0 HG3 GLU A 99 3.764 -1.329 14.414 1.00 0.00 H new ATOM 1522 N GLN A 100 5.976 -5.561 12.676 1.00 0.00 N ATOM 1523 CA GLN A 100 6.321 -6.626 11.742 1.00 0.00 C ATOM 1524 C GLN A 100 5.612 -7.923 12.109 1.00 0.00 C ATOM 1525 O GLN A 100 5.123 -8.637 11.234 1.00 0.00 O ATOM 1526 CB GLN A 100 7.833 -6.850 11.708 1.00 0.00 C ATOM 1527 CG GLN A 100 8.607 -5.720 11.053 1.00 0.00 C ATOM 1528 CD GLN A 100 10.086 -6.025 10.945 1.00 0.00 C ATOM 1529 OE1 GLN A 100 10.533 -6.633 9.974 1.00 0.00 O ATOM 1530 NE2 GLN A 100 10.859 -5.592 11.927 1.00 0.00 N ATOM 0 H GLN A 100 6.737 -5.282 13.295 1.00 0.00 H new ATOM 0 HA GLN A 100 5.990 -6.317 10.750 1.00 0.00 H new ATOM 0 HB2 GLN A 100 8.194 -6.981 12.728 1.00 0.00 H new ATOM 0 HB3 GLN A 100 8.041 -7.777 11.174 1.00 0.00 H new ATOM 0 HG2 GLN A 100 8.203 -5.535 10.058 1.00 0.00 H new ATOM 0 HG3 GLN A 100 8.468 -4.805 11.629 1.00 0.00 H new ATOM 0 HE21 GLN A 100 10.449 -5.091 12.716 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.865 -5.759 11.896 1.00 0.00 H new ATOM 1539 N ALA A 101 5.557 -8.221 13.402 1.00 0.00 N ATOM 1540 CA ALA A 101 4.874 -9.416 13.880 1.00 0.00 C ATOM 1541 C ALA A 101 3.387 -9.343 13.555 1.00 0.00 C ATOM 1542 O ALA A 101 2.775 -10.331 13.143 1.00 0.00 O ATOM 1543 CB ALA A 101 5.089 -9.584 15.376 1.00 0.00 C ATOM 0 H ALA A 101 5.977 -7.652 14.137 1.00 0.00 H new ATOM 0 HA ALA A 101 5.293 -10.285 13.373 1.00 0.00 H new ATOM 0 HB1 ALA A 101 4.573 -10.481 15.719 1.00 0.00 H new ATOM 0 HB2 ALA A 101 6.155 -9.677 15.582 1.00 0.00 H new ATOM 0 HB3 ALA A 101 4.693 -8.714 15.900 1.00 0.00 H new ATOM 1549 N LEU A 102 2.817 -8.159 13.729 1.00 0.00 N ATOM 1550 CA LEU A 102 1.418 -7.928 13.411 1.00 0.00 C ATOM 1551 C LEU A 102 1.209 -8.061 11.901 1.00 0.00 C ATOM 1552 O LEU A 102 0.296 -8.751 11.449 1.00 0.00 O ATOM 1553 CB LEU A 102 1.005 -6.531 13.894 1.00 0.00 C ATOM 1554 CG LEU A 102 -0.484 -6.326 14.215 1.00 0.00 C ATOM 1555 CD1 LEU A 102 -1.357 -6.479 12.978 1.00 0.00 C ATOM 1556 CD2 LEU A 102 -0.931 -7.288 15.305 1.00 0.00 C ATOM 0 H LEU A 102 3.306 -7.340 14.091 1.00 0.00 H new ATOM 0 HA LEU A 102 0.797 -8.668 13.916 1.00 0.00 H new ATOM 0 HB2 LEU A 102 1.582 -6.295 14.788 1.00 0.00 H new ATOM 0 HB3 LEU A 102 1.292 -5.808 13.130 1.00 0.00 H new ATOM 0 HG LEU A 102 -0.603 -5.304 14.575 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -2.402 -6.326 13.249 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.064 -5.740 12.232 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -1.232 -7.480 12.566 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -1.988 -7.129 15.520 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -0.779 -8.314 14.969 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -0.347 -7.111 16.208 1.00 0.00 H new ATOM 1568 N LEU A 103 2.078 -7.406 11.138 1.00 0.00 N ATOM 1569 CA LEU A 103 2.040 -7.455 9.676 1.00 0.00 C ATOM 1570 C LEU A 103 2.100 -8.906 9.183 1.00 0.00 C ATOM 1571 O LEU A 103 1.315 -9.317 8.327 1.00 0.00 O ATOM 1572 CB LEU A 103 3.222 -6.656 9.108 1.00 0.00 C ATOM 1573 CG LEU A 103 2.969 -5.908 7.792 1.00 0.00 C ATOM 1574 CD1 LEU A 103 2.622 -6.863 6.665 1.00 0.00 C ATOM 1575 CD2 LEU A 103 1.870 -4.874 7.968 1.00 0.00 C ATOM 0 H LEU A 103 2.829 -6.826 11.513 1.00 0.00 H new ATOM 0 HA LEU A 103 1.104 -7.015 9.331 1.00 0.00 H new ATOM 0 HB2 LEU A 103 3.537 -5.931 9.858 1.00 0.00 H new ATOM 0 HB3 LEU A 103 4.057 -7.341 8.957 1.00 0.00 H new ATOM 0 HG LEU A 103 3.893 -5.396 7.521 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.450 -6.298 5.749 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.446 -7.560 6.512 1.00 0.00 H new ATOM 0 HD13 LEU A 103 1.721 -7.419 6.924 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.705 -4.354 7.024 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.949 -5.370 8.275 1.00 0.00 H new ATOM 0 HD23 LEU A 103 2.166 -4.155 8.732 1.00 0.00 H new ATOM 1587 N PHE A 104 3.033 -9.675 9.738 1.00 0.00 N ATOM 1588 CA PHE A 104 3.175 -11.089 9.401 1.00 0.00 C ATOM 1589 C PHE A 104 1.883 -11.842 9.693 1.00 0.00 C ATOM 1590 O PHE A 104 1.454 -12.695 8.913 1.00 0.00 O ATOM 1591 CB PHE A 104 4.329 -11.712 10.190 1.00 0.00 C ATOM 1592 CG PHE A 104 4.597 -13.149 9.837 1.00 0.00 C ATOM 1593 CD1 PHE A 104 5.226 -13.478 8.648 1.00 0.00 C ATOM 1594 CD2 PHE A 104 4.220 -14.167 10.696 1.00 0.00 C ATOM 1595 CE1 PHE A 104 5.475 -14.798 8.325 1.00 0.00 C ATOM 1596 CE2 PHE A 104 4.465 -15.488 10.377 1.00 0.00 C ATOM 1597 CZ PHE A 104 5.094 -15.803 9.191 1.00 0.00 C ATOM 0 H PHE A 104 3.706 -9.340 10.427 1.00 0.00 H new ATOM 0 HA PHE A 104 3.392 -11.165 8.336 1.00 0.00 H new ATOM 0 HB2 PHE A 104 5.233 -11.129 10.015 1.00 0.00 H new ATOM 0 HB3 PHE A 104 4.108 -11.644 11.255 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.525 -12.695 7.967 1.00 0.00 H new ATOM 0 HD2 PHE A 104 3.728 -13.925 11.627 1.00 0.00 H new ATOM 0 HE1 PHE A 104 5.967 -15.043 7.396 1.00 0.00 H new ATOM 0 HE2 PHE A 104 4.165 -16.273 11.055 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.288 -16.835 8.940 1.00 0.00 H new ATOM 1607 N SER A 105 1.266 -11.513 10.819 1.00 0.00 N ATOM 1608 CA SER A 105 0.006 -12.110 11.213 1.00 0.00 C ATOM 1609 C SER A 105 -1.096 -11.773 10.206 1.00 0.00 C ATOM 1610 O SER A 105 -2.001 -12.575 9.970 1.00 0.00 O ATOM 1611 CB SER A 105 -0.369 -11.615 12.605 1.00 0.00 C ATOM 1612 OG SER A 105 0.622 -11.973 13.559 1.00 0.00 O ATOM 0 H SER A 105 1.627 -10.826 11.481 1.00 0.00 H new ATOM 0 HA SER A 105 0.115 -13.194 11.232 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.489 -10.532 12.589 1.00 0.00 H new ATOM 0 HB3 SER A 105 -1.330 -12.038 12.898 1.00 0.00 H new ATOM 0 HG SER A 105 1.435 -11.450 13.398 1.00 0.00 H new ATOM 1618 N ILE A 106 -1.009 -10.586 9.615 1.00 0.00 N ATOM 1619 CA ILE A 106 -1.941 -10.178 8.566 1.00 0.00 C ATOM 1620 C ILE A 106 -1.809 -11.096 7.350 1.00 0.00 C ATOM 1621 O ILE A 106 -2.811 -11.578 6.816 1.00 0.00 O ATOM 1622 CB ILE A 106 -1.712 -8.708 8.138 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -1.900 -7.771 9.334 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -2.657 -8.325 7.004 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -1.640 -6.317 9.013 1.00 0.00 C ATOM 0 H ILE A 106 -0.302 -9.887 9.844 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.948 -10.259 8.975 1.00 0.00 H new ATOM 0 HB ILE A 106 -0.688 -8.609 7.777 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -2.918 -7.875 9.709 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -1.231 -8.082 10.137 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -2.480 -7.288 6.718 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -2.478 -8.974 6.147 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -3.689 -8.439 7.336 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -1.793 -5.714 9.908 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.613 -6.199 8.667 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -2.326 -5.988 8.233 1.00 0.00 H new ATOM 1637 N PHE A 107 -0.568 -11.342 6.924 1.00 0.00 N ATOM 1638 CA PHE A 107 -0.297 -12.290 5.846 1.00 0.00 C ATOM 1639 C PHE A 107 -0.829 -13.670 6.208 1.00 0.00 C ATOM 1640 O PHE A 107 -1.444 -14.347 5.386 1.00 0.00 O ATOM 1641 CB PHE A 107 1.206 -12.397 5.576 1.00 0.00 C ATOM 1642 CG PHE A 107 1.772 -11.292 4.732 1.00 0.00 C ATOM 1643 CD1 PHE A 107 1.475 -11.213 3.381 1.00 0.00 C ATOM 1644 CD2 PHE A 107 2.621 -10.348 5.282 1.00 0.00 C ATOM 1645 CE1 PHE A 107 2.015 -10.211 2.597 1.00 0.00 C ATOM 1646 CE2 PHE A 107 3.160 -9.344 4.501 1.00 0.00 C ATOM 1647 CZ PHE A 107 2.858 -9.277 3.157 1.00 0.00 C ATOM 0 H PHE A 107 0.264 -10.897 7.311 1.00 0.00 H new ATOM 0 HA PHE A 107 -0.798 -11.923 4.950 1.00 0.00 H new ATOM 0 HB2 PHE A 107 1.733 -12.413 6.530 1.00 0.00 H new ATOM 0 HB3 PHE A 107 1.406 -13.350 5.085 1.00 0.00 H new ATOM 0 HD1 PHE A 107 0.814 -11.942 2.936 1.00 0.00 H new ATOM 0 HD2 PHE A 107 2.865 -10.397 6.333 1.00 0.00 H new ATOM 0 HE1 PHE A 107 1.776 -10.160 1.545 1.00 0.00 H new ATOM 0 HE2 PHE A 107 3.818 -8.611 4.943 1.00 0.00 H new ATOM 0 HZ PHE A 107 3.281 -8.494 2.545 1.00 0.00 H new ATOM 1657 N ASN A 108 -0.574 -14.071 7.447 1.00 0.00 N ATOM 1658 CA ASN A 108 -1.023 -15.359 7.960 1.00 0.00 C ATOM 1659 C ASN A 108 -2.535 -15.496 7.827 1.00 0.00 C ATOM 1660 O ASN A 108 -3.034 -16.530 7.393 1.00 0.00 O ATOM 1661 CB ASN A 108 -0.605 -15.505 9.427 1.00 0.00 C ATOM 1662 CG ASN A 108 -0.936 -16.865 10.017 1.00 0.00 C ATOM 1663 OD1 ASN A 108 -0.950 -17.879 9.318 1.00 0.00 O ATOM 1664 ND2 ASN A 108 -1.199 -16.891 11.314 1.00 0.00 N ATOM 0 H ASN A 108 -0.051 -13.514 8.123 1.00 0.00 H new ATOM 0 HA ASN A 108 -0.557 -16.151 7.373 1.00 0.00 H new ATOM 0 HB2 ASN A 108 0.468 -15.333 9.510 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -1.098 -14.732 10.016 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -1.424 -17.775 11.771 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -1.176 -16.027 11.856 1.00 0.00 H new ATOM 1671 N ARG A 109 -3.253 -14.437 8.183 1.00 0.00 N ATOM 1672 CA ARG A 109 -4.707 -14.421 8.085 1.00 0.00 C ATOM 1673 C ARG A 109 -5.165 -14.589 6.635 1.00 0.00 C ATOM 1674 O ARG A 109 -5.945 -15.489 6.321 1.00 0.00 O ATOM 1675 CB ARG A 109 -5.260 -13.108 8.659 1.00 0.00 C ATOM 1676 CG ARG A 109 -6.764 -12.933 8.469 1.00 0.00 C ATOM 1677 CD ARG A 109 -7.223 -11.538 8.875 1.00 0.00 C ATOM 1678 NE ARG A 109 -8.640 -11.309 8.576 1.00 0.00 N ATOM 1679 CZ ARG A 109 -9.172 -10.110 8.322 1.00 0.00 C ATOM 1680 NH1 ARG A 109 -8.414 -9.018 8.363 1.00 0.00 N ATOM 1681 NH2 ARG A 109 -10.467 -10.004 8.035 1.00 0.00 N ATOM 0 H ARG A 109 -2.848 -13.573 8.544 1.00 0.00 H new ATOM 0 HA ARG A 109 -5.093 -15.260 8.664 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -5.031 -13.064 9.724 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -4.745 -12.271 8.187 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -7.023 -13.112 7.425 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.295 -13.678 9.061 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -7.052 -11.398 9.942 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -6.619 -10.794 8.355 1.00 0.00 H new ATOM 0 HE ARG A 109 -9.261 -12.118 8.561 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -7.422 -9.094 8.589 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -8.824 -8.105 8.168 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -11.054 -10.838 8.009 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -10.873 -9.089 7.841 1.00 0.00 H new ATOM 1695 N PHE A 110 -4.662 -13.735 5.750 1.00 0.00 N ATOM 1696 CA PHE A 110 -5.114 -13.725 4.363 1.00 0.00 C ATOM 1697 C PHE A 110 -4.719 -15.008 3.635 1.00 0.00 C ATOM 1698 O PHE A 110 -5.512 -15.562 2.875 1.00 0.00 O ATOM 1699 CB PHE A 110 -4.563 -12.504 3.624 1.00 0.00 C ATOM 1700 CG PHE A 110 -5.123 -11.198 4.120 1.00 0.00 C ATOM 1701 CD1 PHE A 110 -6.350 -11.154 4.764 1.00 0.00 C ATOM 1702 CD2 PHE A 110 -4.429 -10.014 3.934 1.00 0.00 C ATOM 1703 CE1 PHE A 110 -6.871 -9.956 5.213 1.00 0.00 C ATOM 1704 CE2 PHE A 110 -4.945 -8.814 4.381 1.00 0.00 C ATOM 1705 CZ PHE A 110 -6.169 -8.785 5.021 1.00 0.00 C ATOM 0 H PHE A 110 -3.944 -13.043 5.967 1.00 0.00 H new ATOM 0 HA PHE A 110 -6.202 -13.668 4.374 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -3.478 -12.487 3.726 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -4.782 -12.604 2.561 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -6.905 -12.068 4.917 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -3.472 -10.030 3.433 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -7.828 -9.937 5.714 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -4.392 -7.899 4.230 1.00 0.00 H new ATOM 0 HZ PHE A 110 -6.575 -7.847 5.370 1.00 0.00 H new ATOM 1715 N ARG A 111 -3.506 -15.485 3.882 1.00 0.00 N ATOM 1716 CA ARG A 111 -3.037 -16.721 3.265 1.00 0.00 C ATOM 1717 C ARG A 111 -3.846 -17.919 3.769 1.00 0.00 C ATOM 1718 O ARG A 111 -4.205 -18.807 2.996 1.00 0.00 O ATOM 1719 CB ARG A 111 -1.537 -16.919 3.537 1.00 0.00 C ATOM 1720 CG ARG A 111 -1.033 -18.322 3.233 1.00 0.00 C ATOM 1721 CD ARG A 111 -1.238 -18.704 1.774 1.00 0.00 C ATOM 1722 NE ARG A 111 -1.171 -20.153 1.590 1.00 0.00 N ATOM 1723 CZ ARG A 111 -1.944 -20.836 0.750 1.00 0.00 C ATOM 1724 NH1 ARG A 111 -2.728 -20.198 -0.111 1.00 0.00 N ATOM 1725 NH2 ARG A 111 -1.914 -22.162 0.756 1.00 0.00 N ATOM 0 H ARG A 111 -2.831 -15.038 4.502 1.00 0.00 H new ATOM 0 HA ARG A 111 -3.183 -16.647 2.187 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -0.972 -16.204 2.939 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -1.335 -16.690 4.583 1.00 0.00 H new ATOM 0 HG2 ARG A 111 0.027 -18.386 3.478 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -1.551 -19.038 3.870 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -2.205 -18.336 1.432 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -0.478 -18.222 1.159 1.00 0.00 H new ATOM 0 HE ARG A 111 -0.488 -20.673 2.141 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -2.740 -19.178 -0.131 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -3.318 -20.728 -0.752 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -1.299 -22.655 1.404 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -2.506 -22.688 0.113 1.00 0.00 H new ATOM 1739 N ASN A 112 -4.150 -17.921 5.058 1.00 0.00 N ATOM 1740 CA ASN A 112 -4.853 -19.042 5.673 1.00 0.00 C ATOM 1741 C ASN A 112 -6.335 -19.048 5.307 1.00 0.00 C ATOM 1742 O ASN A 112 -6.920 -20.108 5.085 1.00 0.00 O ATOM 1743 CB ASN A 112 -4.694 -18.994 7.191 1.00 0.00 C ATOM 1744 CG ASN A 112 -4.005 -20.225 7.741 1.00 0.00 C ATOM 1745 OD1 ASN A 112 -4.153 -21.332 7.215 1.00 0.00 O ATOM 1746 ND2 ASN A 112 -3.227 -20.037 8.793 1.00 0.00 N ATOM 0 H ASN A 112 -3.922 -17.161 5.699 1.00 0.00 H new ATOM 0 HA ASN A 112 -4.409 -19.960 5.289 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -4.121 -18.108 7.465 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -5.676 -18.894 7.653 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -2.721 -20.824 9.200 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -3.132 -19.105 9.197 1.00 0.00 H new ATOM 1753 N SER A 113 -6.938 -17.869 5.252 1.00 0.00 N ATOM 1754 CA SER A 113 -8.367 -17.759 4.993 1.00 0.00 C ATOM 1755 C SER A 113 -8.663 -17.757 3.493 1.00 0.00 C ATOM 1756 O SER A 113 -9.585 -18.431 3.032 1.00 0.00 O ATOM 1757 CB SER A 113 -8.920 -16.487 5.648 1.00 0.00 C ATOM 1758 OG SER A 113 -10.332 -16.410 5.538 1.00 0.00 O ATOM 0 H SER A 113 -6.461 -16.977 5.383 1.00 0.00 H new ATOM 0 HA SER A 113 -8.859 -18.629 5.427 1.00 0.00 H new ATOM 0 HB2 SER A 113 -8.636 -16.467 6.700 1.00 0.00 H new ATOM 0 HB3 SER A 113 -8.470 -15.612 5.179 1.00 0.00 H new ATOM 0 HG SER A 113 -10.649 -15.588 5.967 1.00 0.00 H new ATOM 1764 N GLY A 114 -7.875 -17.007 2.734 1.00 0.00 N ATOM 1765 CA GLY A 114 -8.129 -16.860 1.311 1.00 0.00 C ATOM 1766 C GLY A 114 -8.923 -15.603 1.030 1.00 0.00 C ATOM 1767 O GLY A 114 -8.863 -15.036 -0.065 1.00 0.00 O ATOM 0 H GLY A 114 -7.062 -16.496 3.078 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -7.183 -16.826 0.771 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -8.675 -17.729 0.943 1.00 0.00 H new ATOM 1771 N LYS A 115 -9.663 -15.174 2.041 1.00 0.00 N ATOM 1772 CA LYS A 115 -10.442 -13.958 1.986 1.00 0.00 C ATOM 1773 C LYS A 115 -9.582 -12.806 2.494 1.00 0.00 C ATOM 1774 O LYS A 115 -8.489 -13.027 3.021 1.00 0.00 O ATOM 1775 CB LYS A 115 -11.698 -14.143 2.854 1.00 0.00 C ATOM 1776 CG LYS A 115 -12.685 -12.980 2.850 1.00 0.00 C ATOM 1777 CD LYS A 115 -13.879 -13.282 3.747 1.00 0.00 C ATOM 1778 CE LYS A 115 -14.766 -12.063 3.958 1.00 0.00 C ATOM 1779 NZ LYS A 115 -15.382 -11.581 2.694 1.00 0.00 N ATOM 0 H LYS A 115 -9.737 -15.669 2.930 1.00 0.00 H new ATOM 0 HA LYS A 115 -10.754 -13.733 0.966 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -12.220 -15.039 2.518 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -11.383 -14.324 3.882 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -12.187 -12.073 3.193 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -13.027 -12.791 1.833 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -14.468 -14.085 3.305 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -13.523 -13.641 4.713 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -15.553 -12.309 4.671 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -14.176 -11.260 4.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -15.976 -10.750 2.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -14.634 -11.319 2.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -15.968 -12.336 2.284 1.00 0.00 H new ATOM 1793 N GLY A 116 -10.087 -11.600 2.369 1.00 0.00 N ATOM 1794 CA GLY A 116 -9.334 -10.434 2.773 1.00 0.00 C ATOM 1795 C GLY A 116 -8.578 -9.818 1.614 1.00 0.00 C ATOM 1796 O GLY A 116 -8.215 -10.507 0.660 1.00 0.00 O ATOM 0 H GLY A 116 -11.014 -11.401 1.992 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -10.012 -9.694 3.198 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -8.631 -10.711 3.559 1.00 0.00 H new ATOM 1800 N PHE A 117 -8.355 -8.520 1.685 1.00 0.00 N ATOM 1801 CA PHE A 117 -7.660 -7.802 0.629 1.00 0.00 C ATOM 1802 C PHE A 117 -6.520 -6.992 1.223 1.00 0.00 C ATOM 1803 O PHE A 117 -6.690 -6.338 2.253 1.00 0.00 O ATOM 1804 CB PHE A 117 -8.625 -6.876 -0.119 1.00 0.00 C ATOM 1805 CG PHE A 117 -9.698 -7.596 -0.893 1.00 0.00 C ATOM 1806 CD1 PHE A 117 -10.798 -8.137 -0.248 1.00 0.00 C ATOM 1807 CD2 PHE A 117 -9.602 -7.729 -2.268 1.00 0.00 C ATOM 1808 CE1 PHE A 117 -11.780 -8.798 -0.961 1.00 0.00 C ATOM 1809 CE2 PHE A 117 -10.580 -8.390 -2.985 1.00 0.00 C ATOM 1810 CZ PHE A 117 -11.672 -8.924 -2.330 1.00 0.00 C ATOM 0 H PHE A 117 -8.647 -7.936 2.468 1.00 0.00 H new ATOM 0 HA PHE A 117 -7.258 -8.526 -0.079 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -9.098 -6.207 0.599 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -8.053 -6.253 -0.807 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -10.889 -8.041 0.824 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -8.752 -7.311 -2.786 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -12.632 -9.216 -0.446 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -10.491 -8.489 -4.057 1.00 0.00 H new ATOM 0 HZ PHE A 117 -12.440 -9.439 -2.888 1.00 0.00 H new ATOM 1820 N LEU A 118 -5.363 -7.029 0.578 1.00 0.00 N ATOM 1821 CA LEU A 118 -4.198 -6.328 1.084 1.00 0.00 C ATOM 1822 C LEU A 118 -3.578 -5.463 0.000 1.00 0.00 C ATOM 1823 O LEU A 118 -3.421 -5.884 -1.146 1.00 0.00 O ATOM 1824 CB LEU A 118 -3.153 -7.316 1.595 1.00 0.00 C ATOM 1825 CG LEU A 118 -2.021 -6.707 2.430 1.00 0.00 C ATOM 1826 CD1 LEU A 118 -2.576 -6.021 3.666 1.00 0.00 C ATOM 1827 CD2 LEU A 118 -1.017 -7.778 2.826 1.00 0.00 C ATOM 0 H LEU A 118 -5.209 -7.536 -0.294 1.00 0.00 H new ATOM 0 HA LEU A 118 -4.526 -5.693 1.907 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -3.657 -8.073 2.196 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -2.714 -7.829 0.739 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.511 -5.960 1.821 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.756 -5.595 4.245 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -3.259 -5.226 3.365 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -3.112 -6.748 4.276 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -0.220 -7.328 3.418 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -1.518 -8.546 3.415 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -0.592 -8.228 1.929 1.00 0.00 H new ATOM 1839 N LEU A 119 -3.221 -4.261 0.384 1.00 0.00 N ATOM 1840 CA LEU A 119 -2.565 -3.325 -0.506 1.00 0.00 C ATOM 1841 C LEU A 119 -1.349 -2.751 0.199 1.00 0.00 C ATOM 1842 O LEU A 119 -1.474 -2.025 1.186 1.00 0.00 O ATOM 1843 CB LEU A 119 -3.524 -2.207 -0.920 1.00 0.00 C ATOM 1844 CG LEU A 119 -2.976 -1.225 -1.959 1.00 0.00 C ATOM 1845 CD1 LEU A 119 -2.634 -1.949 -3.254 1.00 0.00 C ATOM 1846 CD2 LEU A 119 -3.983 -0.113 -2.214 1.00 0.00 C ATOM 0 H LEU A 119 -3.377 -3.900 1.325 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.252 -3.844 -1.412 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -4.433 -2.659 -1.316 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -3.808 -1.647 -0.029 1.00 0.00 H new ATOM 0 HG LEU A 119 -2.061 -0.780 -1.568 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -2.246 -1.234 -3.979 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -1.880 -2.711 -3.057 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -3.531 -2.422 -3.654 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -3.581 0.579 -2.955 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -4.913 -0.543 -2.586 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -4.177 0.423 -1.285 1.00 0.00 H new ATOM 1858 N LEU A 120 -0.178 -3.103 -0.291 1.00 0.00 N ATOM 1859 CA LEU A 120 1.061 -2.703 0.350 1.00 0.00 C ATOM 1860 C LEU A 120 1.768 -1.639 -0.471 1.00 0.00 C ATOM 1861 O LEU A 120 1.901 -1.772 -1.688 1.00 0.00 O ATOM 1862 CB LEU A 120 1.974 -3.916 0.531 1.00 0.00 C ATOM 1863 CG LEU A 120 1.405 -5.035 1.403 1.00 0.00 C ATOM 1864 CD1 LEU A 120 2.325 -6.243 1.381 1.00 0.00 C ATOM 1865 CD2 LEU A 120 1.200 -4.549 2.831 1.00 0.00 C ATOM 0 H LEU A 120 -0.057 -3.666 -1.133 1.00 0.00 H new ATOM 0 HA LEU A 120 0.824 -2.286 1.329 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.206 -4.326 -0.452 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.915 -3.580 0.967 1.00 0.00 H new ATOM 0 HG LEU A 120 0.437 -5.329 0.998 1.00 0.00 H new ATOM 0 HD11 LEU A 120 1.906 -7.031 2.007 1.00 0.00 H new ATOM 0 HD12 LEU A 120 2.424 -6.606 0.358 1.00 0.00 H new ATOM 0 HD13 LEU A 120 3.306 -5.960 1.762 1.00 0.00 H new ATOM 0 HD21 LEU A 120 0.794 -5.360 3.436 1.00 0.00 H new ATOM 0 HD22 LEU A 120 2.155 -4.228 3.247 1.00 0.00 H new ATOM 0 HD23 LEU A 120 0.503 -3.711 2.834 1.00 0.00 H new ATOM 1877 N GLY A 121 2.211 -0.585 0.193 1.00 0.00 N ATOM 1878 CA GLY A 121 2.936 0.466 -0.483 1.00 0.00 C ATOM 1879 C GLY A 121 4.256 0.764 0.197 1.00 0.00 C ATOM 1880 O GLY A 121 4.379 0.610 1.412 1.00 0.00 O ATOM 0 H GLY A 121 2.080 -0.439 1.194 1.00 0.00 H new ATOM 0 HA2 GLY A 121 3.117 0.175 -1.518 1.00 0.00 H new ATOM 0 HA3 GLY A 121 2.327 1.370 -0.508 1.00 0.00 H new ATOM 1884 N SER A 122 5.244 1.168 -0.587 1.00 0.00 N ATOM 1885 CA SER A 122 6.548 1.538 -0.058 1.00 0.00 C ATOM 1886 C SER A 122 7.314 2.311 -1.128 1.00 0.00 C ATOM 1887 O SER A 122 6.830 2.458 -2.253 1.00 0.00 O ATOM 1888 CB SER A 122 7.320 0.286 0.375 1.00 0.00 C ATOM 1889 OG SER A 122 8.079 0.523 1.549 1.00 0.00 O ATOM 0 H SER A 122 5.166 1.248 -1.601 1.00 0.00 H new ATOM 0 HA SER A 122 6.425 2.172 0.820 1.00 0.00 H new ATOM 0 HB2 SER A 122 6.620 -0.531 0.552 1.00 0.00 H new ATOM 0 HB3 SER A 122 7.983 -0.030 -0.430 1.00 0.00 H new ATOM 0 HG SER A 122 9.002 0.741 1.303 1.00 0.00 H new ATOM 1895 N GLU A 123 8.488 2.815 -0.792 1.00 0.00 N ATOM 1896 CA GLU A 123 9.251 3.611 -1.735 1.00 0.00 C ATOM 1897 C GLU A 123 10.349 2.787 -2.405 1.00 0.00 C ATOM 1898 O GLU A 123 10.799 3.115 -3.504 1.00 0.00 O ATOM 1899 CB GLU A 123 9.851 4.836 -1.042 1.00 0.00 C ATOM 1900 CG GLU A 123 8.808 5.765 -0.434 1.00 0.00 C ATOM 1901 CD GLU A 123 8.611 5.555 1.058 1.00 0.00 C ATOM 1902 OE1 GLU A 123 7.994 4.548 1.455 1.00 0.00 O ATOM 1903 OE2 GLU A 123 9.070 6.416 1.844 1.00 0.00 O ATOM 0 H GLU A 123 8.930 2.689 0.118 1.00 0.00 H new ATOM 0 HA GLU A 123 8.566 3.948 -2.513 1.00 0.00 H new ATOM 0 HB2 GLU A 123 10.530 4.503 -0.257 1.00 0.00 H new ATOM 0 HB3 GLU A 123 10.447 5.395 -1.763 1.00 0.00 H new ATOM 0 HG2 GLU A 123 9.105 6.799 -0.612 1.00 0.00 H new ATOM 0 HG3 GLU A 123 7.856 5.614 -0.944 1.00 0.00 H new ATOM 1910 N TYR A 124 10.785 1.725 -1.745 1.00 0.00 N ATOM 1911 CA TYR A 124 11.819 0.859 -2.301 1.00 0.00 C ATOM 1912 C TYR A 124 11.254 -0.496 -2.715 1.00 0.00 C ATOM 1913 O TYR A 124 10.042 -0.708 -2.692 1.00 0.00 O ATOM 1914 CB TYR A 124 12.958 0.679 -1.297 1.00 0.00 C ATOM 1915 CG TYR A 124 13.776 1.934 -1.100 1.00 0.00 C ATOM 1916 CD1 TYR A 124 13.389 2.904 -0.186 1.00 0.00 C ATOM 1917 CD2 TYR A 124 14.926 2.155 -1.844 1.00 0.00 C ATOM 1918 CE1 TYR A 124 14.124 4.059 -0.020 1.00 0.00 C ATOM 1919 CE2 TYR A 124 15.670 3.304 -1.680 1.00 0.00 C ATOM 1920 CZ TYR A 124 15.263 4.254 -0.770 1.00 0.00 C ATOM 1921 OH TYR A 124 15.999 5.404 -0.609 1.00 0.00 O ATOM 0 H TYR A 124 10.442 1.441 -0.827 1.00 0.00 H new ATOM 0 HA TYR A 124 12.210 1.341 -3.197 1.00 0.00 H new ATOM 0 HB2 TYR A 124 12.544 0.368 -0.338 1.00 0.00 H new ATOM 0 HB3 TYR A 124 13.611 -0.124 -1.638 1.00 0.00 H new ATOM 0 HD1 TYR A 124 12.498 2.752 0.405 1.00 0.00 H new ATOM 0 HD2 TYR A 124 15.244 1.415 -2.563 1.00 0.00 H new ATOM 0 HE1 TYR A 124 13.809 4.806 0.693 1.00 0.00 H new ATOM 0 HE2 TYR A 124 16.567 3.458 -2.262 1.00 0.00 H new ATOM 0 HH TYR A 124 16.772 5.385 -1.212 1.00 0.00 H new ATOM 1931 N THR A 125 12.140 -1.403 -3.107 1.00 0.00 N ATOM 1932 CA THR A 125 11.736 -2.721 -3.569 1.00 0.00 C ATOM 1933 C THR A 125 11.797 -3.748 -2.433 1.00 0.00 C ATOM 1934 O THR A 125 12.586 -3.601 -1.496 1.00 0.00 O ATOM 1935 CB THR A 125 12.624 -3.168 -4.748 1.00 0.00 C ATOM 1936 OG1 THR A 125 13.990 -2.799 -4.506 1.00 0.00 O ATOM 1937 CG2 THR A 125 12.158 -2.534 -6.047 1.00 0.00 C ATOM 0 H THR A 125 13.148 -1.247 -3.113 1.00 0.00 H new ATOM 0 HA THR A 125 10.702 -2.659 -3.910 1.00 0.00 H new ATOM 0 HB THR A 125 12.547 -4.252 -4.835 1.00 0.00 H new ATOM 0 HG1 THR A 125 14.546 -3.089 -5.260 1.00 0.00 H new ATOM 0 HG21 THR A 125 12.800 -2.864 -6.864 1.00 0.00 H new ATOM 0 HG22 THR A 125 11.130 -2.833 -6.250 1.00 0.00 H new ATOM 0 HG23 THR A 125 12.210 -1.449 -5.961 1.00 0.00 H new ATOM 1945 N PRO A 126 10.982 -4.819 -2.519 1.00 0.00 N ATOM 1946 CA PRO A 126 10.796 -5.785 -1.422 1.00 0.00 C ATOM 1947 C PRO A 126 12.084 -6.473 -0.971 1.00 0.00 C ATOM 1948 O PRO A 126 12.236 -6.813 0.203 1.00 0.00 O ATOM 1949 CB PRO A 126 9.835 -6.823 -2.012 1.00 0.00 C ATOM 1950 CG PRO A 126 9.162 -6.133 -3.147 1.00 0.00 C ATOM 1951 CD PRO A 126 10.171 -5.169 -3.698 1.00 0.00 C ATOM 0 HA PRO A 126 10.430 -5.280 -0.528 1.00 0.00 H new ATOM 0 HB2 PRO A 126 10.372 -7.708 -2.352 1.00 0.00 H new ATOM 0 HB3 PRO A 126 9.111 -7.156 -1.269 1.00 0.00 H new ATOM 0 HG2 PRO A 126 8.848 -6.848 -3.908 1.00 0.00 H new ATOM 0 HG3 PRO A 126 8.266 -5.611 -2.811 1.00 0.00 H new ATOM 0 HD2 PRO A 126 10.776 -5.624 -4.482 1.00 0.00 H new ATOM 0 HD3 PRO A 126 9.693 -4.291 -4.133 1.00 0.00 H new ATOM 1959 N GLN A 127 13.014 -6.663 -1.891 1.00 0.00 N ATOM 1960 CA GLN A 127 14.217 -7.435 -1.607 1.00 0.00 C ATOM 1961 C GLN A 127 15.261 -6.605 -0.878 1.00 0.00 C ATOM 1962 O GLN A 127 16.287 -7.134 -0.455 1.00 0.00 O ATOM 1963 CB GLN A 127 14.817 -8.010 -2.888 1.00 0.00 C ATOM 1964 CG GLN A 127 13.943 -9.055 -3.556 1.00 0.00 C ATOM 1965 CD GLN A 127 14.568 -9.596 -4.826 1.00 0.00 C ATOM 1966 OE1 GLN A 127 15.311 -10.574 -4.793 1.00 0.00 O ATOM 1967 NE2 GLN A 127 14.272 -8.962 -5.948 1.00 0.00 N ATOM 0 H GLN A 127 12.962 -6.295 -2.841 1.00 0.00 H new ATOM 0 HA GLN A 127 13.918 -8.257 -0.956 1.00 0.00 H new ATOM 0 HB2 GLN A 127 14.997 -7.197 -3.591 1.00 0.00 H new ATOM 0 HB3 GLN A 127 15.786 -8.453 -2.658 1.00 0.00 H new ATOM 0 HG2 GLN A 127 13.766 -9.876 -2.862 1.00 0.00 H new ATOM 0 HG3 GLN A 127 12.971 -8.619 -3.788 1.00 0.00 H new ATOM 0 HE21 GLN A 127 13.650 -8.154 -5.928 1.00 0.00 H new ATOM 0 HE22 GLN A 127 14.666 -9.281 -6.833 1.00 0.00 H new ATOM 1976 N GLN A 128 15.011 -5.312 -0.727 1.00 0.00 N ATOM 1977 CA GLN A 128 15.943 -4.445 -0.017 1.00 0.00 C ATOM 1978 C GLN A 128 15.231 -3.646 1.069 1.00 0.00 C ATOM 1979 O GLN A 128 15.784 -2.688 1.610 1.00 0.00 O ATOM 1980 CB GLN A 128 16.660 -3.506 -0.992 1.00 0.00 C ATOM 1981 CG GLN A 128 15.743 -2.534 -1.711 1.00 0.00 C ATOM 1982 CD GLN A 128 16.493 -1.612 -2.654 1.00 0.00 C ATOM 1983 OE1 GLN A 128 16.092 -0.472 -2.870 1.00 0.00 O ATOM 1984 NE2 GLN A 128 17.586 -2.096 -3.225 1.00 0.00 N ATOM 0 H GLN A 128 14.178 -4.842 -1.083 1.00 0.00 H new ATOM 0 HA GLN A 128 16.689 -5.078 0.464 1.00 0.00 H new ATOM 0 HB2 GLN A 128 17.413 -2.939 -0.445 1.00 0.00 H new ATOM 0 HB3 GLN A 128 17.188 -4.105 -1.734 1.00 0.00 H new ATOM 0 HG2 GLN A 128 14.996 -3.094 -2.274 1.00 0.00 H new ATOM 0 HG3 GLN A 128 15.205 -1.936 -0.975 1.00 0.00 H new ATOM 0 HE21 GLN A 128 17.889 -3.048 -3.021 1.00 0.00 H new ATOM 0 HE22 GLN A 128 18.125 -1.516 -3.868 1.00 0.00 H new ATOM 1993 N LEU A 129 14.006 -4.047 1.385 1.00 0.00 N ATOM 1994 CA LEU A 129 13.264 -3.427 2.474 1.00 0.00 C ATOM 1995 C LEU A 129 13.873 -3.817 3.820 1.00 0.00 C ATOM 1996 O LEU A 129 14.521 -4.859 3.939 1.00 0.00 O ATOM 1997 CB LEU A 129 11.792 -3.843 2.436 1.00 0.00 C ATOM 1998 CG LEU A 129 11.006 -3.393 1.203 1.00 0.00 C ATOM 1999 CD1 LEU A 129 9.551 -3.826 1.318 1.00 0.00 C ATOM 2000 CD2 LEU A 129 11.098 -1.886 1.022 1.00 0.00 C ATOM 0 H LEU A 129 13.507 -4.796 0.904 1.00 0.00 H new ATOM 0 HA LEU A 129 13.325 -2.346 2.351 1.00 0.00 H new ATOM 0 HB2 LEU A 129 11.739 -4.930 2.501 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.299 -3.446 3.323 1.00 0.00 H new ATOM 0 HG LEU A 129 11.445 -3.868 0.326 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.003 -3.499 0.434 1.00 0.00 H new ATOM 0 HD12 LEU A 129 9.500 -4.912 1.396 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.107 -3.377 2.206 1.00 0.00 H new ATOM 0 HD21 LEU A 129 10.531 -1.590 0.139 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.687 -1.388 1.900 1.00 0.00 H new ATOM 0 HD23 LEU A 129 12.142 -1.598 0.897 1.00 0.00 H new ATOM 2012 N VAL A 130 13.672 -2.980 4.826 1.00 0.00 N ATOM 2013 CA VAL A 130 14.175 -3.259 6.163 1.00 0.00 C ATOM 2014 C VAL A 130 13.160 -4.084 6.943 1.00 0.00 C ATOM 2015 O VAL A 130 12.378 -3.553 7.732 1.00 0.00 O ATOM 2016 CB VAL A 130 14.488 -1.964 6.941 1.00 0.00 C ATOM 2017 CG1 VAL A 130 15.214 -2.275 8.242 1.00 0.00 C ATOM 2018 CG2 VAL A 130 15.307 -1.009 6.090 1.00 0.00 C ATOM 0 H VAL A 130 13.163 -2.100 4.742 1.00 0.00 H new ATOM 0 HA VAL A 130 15.103 -3.820 6.051 1.00 0.00 H new ATOM 0 HB VAL A 130 13.542 -1.481 7.185 1.00 0.00 H new ATOM 0 HG11 VAL A 130 15.424 -1.346 8.773 1.00 0.00 H new ATOM 0 HG12 VAL A 130 14.588 -2.915 8.864 1.00 0.00 H new ATOM 0 HG13 VAL A 130 16.151 -2.787 8.022 1.00 0.00 H new ATOM 0 HG21 VAL A 130 15.516 -0.103 6.659 1.00 0.00 H new ATOM 0 HG22 VAL A 130 16.246 -1.486 5.809 1.00 0.00 H new ATOM 0 HG23 VAL A 130 14.747 -0.752 5.191 1.00 0.00 H new ATOM 2028 N ILE A 131 13.152 -5.383 6.692 1.00 0.00 N ATOM 2029 CA ILE A 131 12.202 -6.283 7.328 1.00 0.00 C ATOM 2030 C ILE A 131 12.882 -7.585 7.726 1.00 0.00 C ATOM 2031 O ILE A 131 13.965 -7.905 7.231 1.00 0.00 O ATOM 2032 CB ILE A 131 11.000 -6.594 6.405 1.00 0.00 C ATOM 2033 CG1 ILE A 131 11.489 -7.028 5.016 1.00 0.00 C ATOM 2034 CG2 ILE A 131 10.076 -5.390 6.301 1.00 0.00 C ATOM 2035 CD1 ILE A 131 10.373 -7.278 4.027 1.00 0.00 C ATOM 0 H ILE A 131 13.797 -5.841 6.048 1.00 0.00 H new ATOM 0 HA ILE A 131 11.830 -5.778 8.219 1.00 0.00 H new ATOM 0 HB ILE A 131 10.434 -7.417 6.842 1.00 0.00 H new ATOM 0 HG12 ILE A 131 12.150 -6.259 4.617 1.00 0.00 H new ATOM 0 HG13 ILE A 131 12.082 -7.937 5.117 1.00 0.00 H new ATOM 0 HG21 ILE A 131 9.238 -5.630 5.647 1.00 0.00 H new ATOM 0 HG22 ILE A 131 9.702 -5.132 7.292 1.00 0.00 H new ATOM 0 HG23 ILE A 131 10.626 -4.544 5.889 1.00 0.00 H new ATOM 0 HD11 ILE A 131 10.797 -7.581 3.069 1.00 0.00 H new ATOM 0 HD12 ILE A 131 9.724 -8.069 4.403 1.00 0.00 H new ATOM 0 HD13 ILE A 131 9.793 -6.365 3.895 1.00 0.00 H new ATOM 2047 N ARG A 132 12.253 -8.329 8.630 1.00 0.00 N ATOM 2048 CA ARG A 132 12.805 -9.594 9.094 1.00 0.00 C ATOM 2049 C ARG A 132 12.521 -10.721 8.103 1.00 0.00 C ATOM 2050 O ARG A 132 11.711 -10.571 7.189 1.00 0.00 O ATOM 2051 CB ARG A 132 12.277 -9.948 10.491 1.00 0.00 C ATOM 2052 CG ARG A 132 12.745 -8.976 11.563 1.00 0.00 C ATOM 2053 CD ARG A 132 12.393 -9.455 12.965 1.00 0.00 C ATOM 2054 NE ARG A 132 12.855 -8.510 13.982 1.00 0.00 N ATOM 2055 CZ ARG A 132 13.129 -8.830 15.247 1.00 0.00 C ATOM 2056 NH1 ARG A 132 12.978 -10.075 15.682 1.00 0.00 N ATOM 2057 NH2 ARG A 132 13.557 -7.892 16.079 1.00 0.00 N ATOM 0 H ARG A 132 11.361 -8.077 9.055 1.00 0.00 H new ATOM 0 HA ARG A 132 13.886 -9.475 9.162 1.00 0.00 H new ATOM 0 HB2 ARG A 132 11.187 -9.961 10.470 1.00 0.00 H new ATOM 0 HB3 ARG A 132 12.603 -10.955 10.753 1.00 0.00 H new ATOM 0 HG2 ARG A 132 13.824 -8.844 11.486 1.00 0.00 H new ATOM 0 HG3 ARG A 132 12.292 -8.000 11.389 1.00 0.00 H new ATOM 0 HD2 ARG A 132 11.314 -9.582 13.048 1.00 0.00 H new ATOM 0 HD3 ARG A 132 12.844 -10.432 13.142 1.00 0.00 H new ATOM 0 HE ARG A 132 12.976 -7.536 13.703 1.00 0.00 H new ATOM 0 HH11 ARG A 132 12.649 -10.801 15.046 1.00 0.00 H new ATOM 0 HH12 ARG A 132 13.191 -10.306 16.652 1.00 0.00 H new ATOM 0 HH21 ARG A 132 13.675 -6.934 15.750 1.00 0.00 H new ATOM 0 HH22 ARG A 132 13.769 -8.128 17.048 1.00 0.00 H new ATOM 2071 N GLU A 133 13.183 -11.848 8.324 1.00 0.00 N ATOM 2072 CA GLU A 133 13.235 -12.952 7.368 1.00 0.00 C ATOM 2073 C GLU A 133 11.847 -13.464 6.967 1.00 0.00 C ATOM 2074 O GLU A 133 11.509 -13.492 5.781 1.00 0.00 O ATOM 2075 CB GLU A 133 14.067 -14.102 7.950 1.00 0.00 C ATOM 2076 CG GLU A 133 15.550 -13.778 8.144 1.00 0.00 C ATOM 2077 CD GLU A 133 15.805 -12.622 9.097 1.00 0.00 C ATOM 2078 OE1 GLU A 133 15.189 -12.585 10.181 1.00 0.00 O ATOM 2079 OE2 GLU A 133 16.599 -11.722 8.751 1.00 0.00 O ATOM 0 H GLU A 133 13.706 -12.026 9.181 1.00 0.00 H new ATOM 0 HA GLU A 133 13.703 -12.567 6.462 1.00 0.00 H new ATOM 0 HB2 GLU A 133 13.642 -14.390 8.912 1.00 0.00 H new ATOM 0 HB3 GLU A 133 13.980 -14.966 7.291 1.00 0.00 H new ATOM 0 HG2 GLU A 133 16.060 -14.665 8.519 1.00 0.00 H new ATOM 0 HG3 GLU A 133 15.991 -13.542 7.175 1.00 0.00 H new ATOM 2086 N ASP A 134 11.050 -13.871 7.947 1.00 0.00 N ATOM 2087 CA ASP A 134 9.734 -14.459 7.677 1.00 0.00 C ATOM 2088 C ASP A 134 8.834 -13.499 6.909 1.00 0.00 C ATOM 2089 O ASP A 134 8.110 -13.905 6.002 1.00 0.00 O ATOM 2090 CB ASP A 134 9.050 -14.863 8.982 1.00 0.00 C ATOM 2091 CG ASP A 134 9.806 -15.941 9.720 1.00 0.00 C ATOM 2092 OD1 ASP A 134 10.691 -15.596 10.526 1.00 0.00 O ATOM 2093 OD2 ASP A 134 9.522 -17.140 9.496 1.00 0.00 O ATOM 0 H ASP A 134 11.287 -13.807 8.937 1.00 0.00 H new ATOM 0 HA ASP A 134 9.897 -15.343 7.061 1.00 0.00 H new ATOM 0 HB2 ASP A 134 8.953 -13.987 9.624 1.00 0.00 H new ATOM 0 HB3 ASP A 134 8.041 -15.214 8.766 1.00 0.00 H new ATOM 2098 N LEU A 135 8.892 -12.226 7.266 1.00 0.00 N ATOM 2099 CA LEU A 135 8.070 -11.216 6.614 1.00 0.00 C ATOM 2100 C LEU A 135 8.576 -10.962 5.196 1.00 0.00 C ATOM 2101 O LEU A 135 7.795 -10.741 4.273 1.00 0.00 O ATOM 2102 CB LEU A 135 8.089 -9.919 7.430 1.00 0.00 C ATOM 2103 CG LEU A 135 7.147 -8.821 6.940 1.00 0.00 C ATOM 2104 CD1 LEU A 135 5.699 -9.265 7.063 1.00 0.00 C ATOM 2105 CD2 LEU A 135 7.378 -7.543 7.725 1.00 0.00 C ATOM 0 H LEU A 135 9.499 -11.867 8.003 1.00 0.00 H new ATOM 0 HA LEU A 135 7.043 -11.577 6.556 1.00 0.00 H new ATOM 0 HB2 LEU A 135 7.836 -10.156 8.463 1.00 0.00 H new ATOM 0 HB3 LEU A 135 9.106 -9.527 7.433 1.00 0.00 H new ATOM 0 HG LEU A 135 7.358 -8.628 5.888 1.00 0.00 H new ATOM 0 HD11 LEU A 135 5.043 -8.470 6.709 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.541 -10.160 6.462 1.00 0.00 H new ATOM 0 HD13 LEU A 135 5.473 -9.484 8.107 1.00 0.00 H new ATOM 0 HD21 LEU A 135 6.701 -6.768 7.366 1.00 0.00 H new ATOM 0 HD22 LEU A 135 7.191 -7.727 8.783 1.00 0.00 H new ATOM 0 HD23 LEU A 135 8.409 -7.215 7.590 1.00 0.00 H new ATOM 2117 N ARG A 136 9.892 -11.038 5.038 1.00 0.00 N ATOM 2118 CA ARG A 136 10.560 -10.753 3.772 1.00 0.00 C ATOM 2119 C ARG A 136 10.107 -11.715 2.674 1.00 0.00 C ATOM 2120 O ARG A 136 9.896 -11.309 1.530 1.00 0.00 O ATOM 2121 CB ARG A 136 12.074 -10.849 3.975 1.00 0.00 C ATOM 2122 CG ARG A 136 12.900 -10.166 2.901 1.00 0.00 C ATOM 2123 CD ARG A 136 14.381 -10.233 3.240 1.00 0.00 C ATOM 2124 NE ARG A 136 15.184 -9.348 2.398 1.00 0.00 N ATOM 2125 CZ ARG A 136 16.374 -8.864 2.756 1.00 0.00 C ATOM 2126 NH1 ARG A 136 16.905 -9.184 3.930 1.00 0.00 N ATOM 2127 NH2 ARG A 136 17.033 -8.059 1.936 1.00 0.00 N ATOM 0 H ARG A 136 10.530 -11.301 5.789 1.00 0.00 H new ATOM 0 HA ARG A 136 10.293 -9.746 3.452 1.00 0.00 H new ATOM 0 HB2 ARG A 136 12.326 -10.412 4.941 1.00 0.00 H new ATOM 0 HB3 ARG A 136 12.356 -11.901 4.017 1.00 0.00 H new ATOM 0 HG2 ARG A 136 12.720 -10.644 1.938 1.00 0.00 H new ATOM 0 HG3 ARG A 136 12.591 -9.125 2.804 1.00 0.00 H new ATOM 0 HD2 ARG A 136 14.524 -9.964 4.286 1.00 0.00 H new ATOM 0 HD3 ARG A 136 14.732 -11.258 3.124 1.00 0.00 H new ATOM 0 HE ARG A 136 14.813 -9.086 1.485 1.00 0.00 H new ATOM 0 HH11 ARG A 136 16.402 -9.804 4.565 1.00 0.00 H new ATOM 0 HH12 ARG A 136 17.816 -8.810 4.197 1.00 0.00 H new ATOM 0 HH21 ARG A 136 16.630 -7.810 1.033 1.00 0.00 H new ATOM 0 HH22 ARG A 136 17.943 -7.688 2.208 1.00 0.00 H new ATOM 2141 N THR A 137 9.947 -12.984 3.030 1.00 0.00 N ATOM 2142 CA THR A 137 9.511 -13.993 2.071 1.00 0.00 C ATOM 2143 C THR A 137 8.035 -13.815 1.727 1.00 0.00 C ATOM 2144 O THR A 137 7.630 -13.994 0.578 1.00 0.00 O ATOM 2145 CB THR A 137 9.755 -15.423 2.600 1.00 0.00 C ATOM 2146 OG1 THR A 137 9.202 -15.564 3.916 1.00 0.00 O ATOM 2147 CG2 THR A 137 11.241 -15.742 2.632 1.00 0.00 C ATOM 0 H THR A 137 10.112 -13.338 3.972 1.00 0.00 H new ATOM 0 HA THR A 137 10.106 -13.856 1.168 1.00 0.00 H new ATOM 0 HB THR A 137 9.263 -16.123 1.925 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.361 -16.475 4.242 1.00 0.00 H new ATOM 0 HG21 THR A 137 11.388 -16.754 3.008 1.00 0.00 H new ATOM 0 HG22 THR A 137 11.651 -15.666 1.625 1.00 0.00 H new ATOM 0 HG23 THR A 137 11.751 -15.035 3.286 1.00 0.00 H new ATOM 2155 N ARG A 138 7.237 -13.441 2.725 1.00 0.00 N ATOM 2156 CA ARG A 138 5.815 -13.185 2.523 1.00 0.00 C ATOM 2157 C ARG A 138 5.605 -12.011 1.576 1.00 0.00 C ATOM 2158 O ARG A 138 4.662 -12.000 0.784 1.00 0.00 O ATOM 2159 CB ARG A 138 5.144 -12.912 3.865 1.00 0.00 C ATOM 2160 CG ARG A 138 5.225 -14.095 4.812 1.00 0.00 C ATOM 2161 CD ARG A 138 4.296 -15.217 4.380 1.00 0.00 C ATOM 2162 NE ARG A 138 4.604 -16.478 5.051 1.00 0.00 N ATOM 2163 CZ ARG A 138 3.696 -17.258 5.641 1.00 0.00 C ATOM 2164 NH1 ARG A 138 2.425 -16.872 5.710 1.00 0.00 N ATOM 2165 NH2 ARG A 138 4.066 -18.416 6.170 1.00 0.00 N ATOM 0 H ARG A 138 7.554 -13.308 3.685 1.00 0.00 H new ATOM 0 HA ARG A 138 5.363 -14.068 2.071 1.00 0.00 H new ATOM 0 HB2 ARG A 138 5.613 -12.046 4.331 1.00 0.00 H new ATOM 0 HB3 ARG A 138 4.098 -12.657 3.698 1.00 0.00 H new ATOM 0 HG2 ARG A 138 6.250 -14.464 4.849 1.00 0.00 H new ATOM 0 HG3 ARG A 138 4.965 -13.774 5.821 1.00 0.00 H new ATOM 0 HD2 ARG A 138 3.265 -14.936 4.595 1.00 0.00 H new ATOM 0 HD3 ARG A 138 4.371 -15.354 3.301 1.00 0.00 H new ATOM 0 HE ARG A 138 5.577 -16.782 5.070 1.00 0.00 H new ATOM 0 HH11 ARG A 138 2.141 -15.977 5.311 1.00 0.00 H new ATOM 0 HH12 ARG A 138 1.734 -17.471 6.162 1.00 0.00 H new ATOM 0 HH21 ARG A 138 5.042 -18.708 6.125 1.00 0.00 H new ATOM 0 HH22 ARG A 138 3.374 -19.014 6.622 1.00 0.00 H new ATOM 2179 N MET A 139 6.508 -11.041 1.647 1.00 0.00 N ATOM 2180 CA MET A 139 6.460 -9.869 0.781 1.00 0.00 C ATOM 2181 C MET A 139 6.677 -10.252 -0.681 1.00 0.00 C ATOM 2182 O MET A 139 6.237 -9.551 -1.589 1.00 0.00 O ATOM 2183 CB MET A 139 7.518 -8.851 1.214 1.00 0.00 C ATOM 2184 CG MET A 139 7.203 -8.164 2.534 1.00 0.00 C ATOM 2185 SD MET A 139 5.717 -7.146 2.463 1.00 0.00 S ATOM 2186 CE MET A 139 6.188 -5.945 1.219 1.00 0.00 C ATOM 0 H MET A 139 7.290 -11.044 2.302 1.00 0.00 H new ATOM 0 HA MET A 139 5.470 -9.423 0.873 1.00 0.00 H new ATOM 0 HB2 MET A 139 8.481 -9.355 1.298 1.00 0.00 H new ATOM 0 HB3 MET A 139 7.621 -8.094 0.436 1.00 0.00 H new ATOM 0 HG2 MET A 139 7.082 -8.919 3.310 1.00 0.00 H new ATOM 0 HG3 MET A 139 8.049 -7.541 2.824 1.00 0.00 H new ATOM 0 HE1 MET A 139 5.543 -5.069 1.296 1.00 0.00 H new ATOM 0 HE2 MET A 139 7.225 -5.647 1.375 1.00 0.00 H new ATOM 0 HE3 MET A 139 6.082 -6.387 0.228 1.00 0.00 H new ATOM 2196 N ALA A 140 7.343 -11.379 -0.902 1.00 0.00 N ATOM 2197 CA ALA A 140 7.662 -11.826 -2.251 1.00 0.00 C ATOM 2198 C ALA A 140 6.498 -12.580 -2.887 1.00 0.00 C ATOM 2199 O ALA A 140 6.505 -12.838 -4.093 1.00 0.00 O ATOM 2200 CB ALA A 140 8.907 -12.694 -2.234 1.00 0.00 C ATOM 0 H ALA A 140 7.673 -12.000 -0.163 1.00 0.00 H new ATOM 0 HA ALA A 140 7.851 -10.941 -2.858 1.00 0.00 H new ATOM 0 HB1 ALA A 140 9.136 -13.022 -3.248 1.00 0.00 H new ATOM 0 HB2 ALA A 140 9.746 -12.120 -1.841 1.00 0.00 H new ATOM 0 HB3 ALA A 140 8.735 -13.565 -1.601 1.00 0.00 H new ATOM 2206 N TYR A 141 5.503 -12.937 -2.083 1.00 0.00 N ATOM 2207 CA TYR A 141 4.323 -13.625 -2.597 1.00 0.00 C ATOM 2208 C TYR A 141 3.354 -12.626 -3.216 1.00 0.00 C ATOM 2209 O TYR A 141 2.443 -12.999 -3.958 1.00 0.00 O ATOM 2210 CB TYR A 141 3.607 -14.391 -1.484 1.00 0.00 C ATOM 2211 CG TYR A 141 4.434 -15.472 -0.824 1.00 0.00 C ATOM 2212 CD1 TYR A 141 5.161 -16.389 -1.577 1.00 0.00 C ATOM 2213 CD2 TYR A 141 4.472 -15.586 0.560 1.00 0.00 C ATOM 2214 CE1 TYR A 141 5.905 -17.385 -0.967 1.00 0.00 C ATOM 2215 CE2 TYR A 141 5.212 -16.575 1.177 1.00 0.00 C ATOM 2216 CZ TYR A 141 5.925 -17.472 0.411 1.00 0.00 C ATOM 2217 OH TYR A 141 6.660 -18.460 1.028 1.00 0.00 O ATOM 0 H TYR A 141 5.489 -12.763 -1.078 1.00 0.00 H new ATOM 0 HA TYR A 141 4.657 -14.332 -3.357 1.00 0.00 H new ATOM 0 HB2 TYR A 141 3.287 -13.681 -0.721 1.00 0.00 H new ATOM 0 HB3 TYR A 141 2.705 -14.844 -1.896 1.00 0.00 H new ATOM 0 HD1 TYR A 141 5.145 -16.323 -2.655 1.00 0.00 H new ATOM 0 HD2 TYR A 141 3.912 -14.888 1.165 1.00 0.00 H new ATOM 0 HE1 TYR A 141 6.466 -18.089 -1.565 1.00 0.00 H new ATOM 0 HE2 TYR A 141 5.232 -16.645 2.255 1.00 0.00 H new ATOM 0 HH TYR A 141 6.566 -18.379 2.000 1.00 0.00 H new ATOM 2227 N CYS A 142 3.558 -11.361 -2.901 1.00 0.00 N ATOM 2228 CA CYS A 142 2.687 -10.302 -3.349 1.00 0.00 C ATOM 2229 C CYS A 142 3.187 -9.763 -4.678 1.00 0.00 C ATOM 2230 O CYS A 142 4.395 -9.707 -4.923 1.00 0.00 O ATOM 2231 CB CYS A 142 2.658 -9.195 -2.293 1.00 0.00 C ATOM 2232 SG CYS A 142 1.406 -7.922 -2.573 1.00 0.00 S ATOM 0 H CYS A 142 4.337 -11.042 -2.325 1.00 0.00 H new ATOM 0 HA CYS A 142 1.675 -10.683 -3.488 1.00 0.00 H new ATOM 0 HB2 CYS A 142 2.486 -9.647 -1.316 1.00 0.00 H new ATOM 0 HB3 CYS A 142 3.638 -8.720 -2.256 1.00 0.00 H new ATOM 0 HG CYS A 142 0.265 -8.322 -2.095 1.00 0.00 H new ATOM 2238 N LEU A 143 2.257 -9.396 -5.536 1.00 0.00 N ATOM 2239 CA LEU A 143 2.596 -8.826 -6.833 1.00 0.00 C ATOM 2240 C LEU A 143 3.261 -7.475 -6.673 1.00 0.00 C ATOM 2241 O LEU A 143 3.070 -6.789 -5.675 1.00 0.00 O ATOM 2242 CB LEU A 143 1.363 -8.690 -7.722 1.00 0.00 C ATOM 2243 CG LEU A 143 1.031 -9.926 -8.549 1.00 0.00 C ATOM 2244 CD1 LEU A 143 -0.437 -9.925 -8.946 1.00 0.00 C ATOM 2245 CD2 LEU A 143 1.915 -9.981 -9.786 1.00 0.00 C ATOM 0 H LEU A 143 1.256 -9.481 -5.362 1.00 0.00 H new ATOM 0 HA LEU A 143 3.295 -9.511 -7.313 1.00 0.00 H new ATOM 0 HB2 LEU A 143 0.505 -8.449 -7.094 1.00 0.00 H new ATOM 0 HB3 LEU A 143 1.511 -7.847 -8.397 1.00 0.00 H new ATOM 0 HG LEU A 143 1.221 -10.811 -7.942 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -0.655 -10.815 -9.536 1.00 0.00 H new ATOM 0 HD12 LEU A 143 -1.056 -9.923 -8.049 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -0.653 -9.036 -9.538 1.00 0.00 H new ATOM 0 HD21 LEU A 143 1.669 -10.868 -10.370 1.00 0.00 H new ATOM 0 HD22 LEU A 143 1.749 -9.090 -10.392 1.00 0.00 H new ATOM 0 HD23 LEU A 143 2.961 -10.024 -9.484 1.00 0.00 H new ATOM 2257 N VAL A 144 4.025 -7.100 -7.674 1.00 0.00 N ATOM 2258 CA VAL A 144 4.801 -5.869 -7.626 1.00 0.00 C ATOM 2259 C VAL A 144 4.456 -4.970 -8.804 1.00 0.00 C ATOM 2260 O VAL A 144 4.681 -5.329 -9.962 1.00 0.00 O ATOM 2261 CB VAL A 144 6.320 -6.150 -7.630 1.00 0.00 C ATOM 2262 CG1 VAL A 144 7.108 -4.851 -7.539 1.00 0.00 C ATOM 2263 CG2 VAL A 144 6.696 -7.080 -6.488 1.00 0.00 C ATOM 0 H VAL A 144 4.130 -7.630 -8.539 1.00 0.00 H new ATOM 0 HA VAL A 144 4.544 -5.366 -6.694 1.00 0.00 H new ATOM 0 HB VAL A 144 6.572 -6.640 -8.571 1.00 0.00 H new ATOM 0 HG11 VAL A 144 8.175 -5.072 -7.543 1.00 0.00 H new ATOM 0 HG12 VAL A 144 6.865 -4.218 -8.392 1.00 0.00 H new ATOM 0 HG13 VAL A 144 6.849 -4.332 -6.616 1.00 0.00 H new ATOM 0 HG21 VAL A 144 7.770 -7.265 -6.508 1.00 0.00 H new ATOM 0 HG22 VAL A 144 6.425 -6.618 -5.538 1.00 0.00 H new ATOM 0 HG23 VAL A 144 6.163 -8.024 -6.597 1.00 0.00 H new ATOM 2273 N TYR A 145 3.906 -3.805 -8.499 1.00 0.00 N ATOM 2274 CA TYR A 145 3.568 -2.822 -9.517 1.00 0.00 C ATOM 2275 C TYR A 145 4.095 -1.450 -9.128 1.00 0.00 C ATOM 2276 O TYR A 145 4.303 -1.164 -7.949 1.00 0.00 O ATOM 2277 CB TYR A 145 2.052 -2.760 -9.734 1.00 0.00 C ATOM 2278 CG TYR A 145 1.485 -3.980 -10.433 1.00 0.00 C ATOM 2279 CD1 TYR A 145 1.434 -4.047 -11.820 1.00 0.00 C ATOM 2280 CD2 TYR A 145 1.007 -5.064 -9.707 1.00 0.00 C ATOM 2281 CE1 TYR A 145 0.923 -5.159 -12.463 1.00 0.00 C ATOM 2282 CE2 TYR A 145 0.496 -6.179 -10.343 1.00 0.00 C ATOM 2283 CZ TYR A 145 0.457 -6.220 -11.720 1.00 0.00 C ATOM 2284 OH TYR A 145 -0.047 -7.328 -12.359 1.00 0.00 O ATOM 0 H TYR A 145 3.683 -3.515 -7.547 1.00 0.00 H new ATOM 0 HA TYR A 145 4.039 -3.129 -10.451 1.00 0.00 H new ATOM 0 HB2 TYR A 145 1.560 -2.645 -8.768 1.00 0.00 H new ATOM 0 HB3 TYR A 145 1.814 -1.873 -10.321 1.00 0.00 H new ATOM 0 HD1 TYR A 145 1.800 -3.216 -12.405 1.00 0.00 H new ATOM 0 HD2 TYR A 145 1.035 -5.034 -8.628 1.00 0.00 H new ATOM 0 HE1 TYR A 145 0.890 -5.195 -13.542 1.00 0.00 H new ATOM 0 HE2 TYR A 145 0.129 -7.014 -9.764 1.00 0.00 H new ATOM 0 HH TYR A 145 -0.333 -7.988 -11.693 1.00 0.00 H new ATOM 2294 N GLU A 146 4.305 -0.611 -10.124 1.00 0.00 N ATOM 2295 CA GLU A 146 4.859 0.716 -9.911 1.00 0.00 C ATOM 2296 C GLU A 146 4.089 1.744 -10.727 1.00 0.00 C ATOM 2297 O GLU A 146 3.542 1.424 -11.786 1.00 0.00 O ATOM 2298 CB GLU A 146 6.345 0.719 -10.270 1.00 0.00 C ATOM 2299 CG GLU A 146 6.659 -0.015 -11.561 1.00 0.00 C ATOM 2300 CD GLU A 146 8.081 -0.534 -11.607 1.00 0.00 C ATOM 2301 OE1 GLU A 146 8.343 -1.605 -11.015 1.00 0.00 O ATOM 2302 OE2 GLU A 146 8.937 0.105 -12.251 1.00 0.00 O ATOM 0 H GLU A 146 4.098 -0.826 -11.099 1.00 0.00 H new ATOM 0 HA GLU A 146 4.762 0.986 -8.859 1.00 0.00 H new ATOM 0 HB2 GLU A 146 6.688 1.750 -10.355 1.00 0.00 H new ATOM 0 HB3 GLU A 146 6.908 0.262 -9.456 1.00 0.00 H new ATOM 0 HG2 GLU A 146 5.968 -0.850 -11.677 1.00 0.00 H new ATOM 0 HG3 GLU A 146 6.494 0.655 -12.405 1.00 0.00 H new