USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=22 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 108 ASN : amide:sc= -0.123 K(o=0.86,f=-0.81) USER MOD Set 1.2: A 112 ASN : amide:sc= 0.987 K(o=0.86,f=-0.069) USER MOD Single : A 34 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.082) USER MOD Single : A 35 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 37 GLN :FLIP amide:sc= -0.0218 F(o=-0.6,f=-0.022) USER MOD Single : A 40 TYR OH : rot -169:sc= 0.309 USER MOD Single : A 50 SER OG : rot -50:sc= 1.24 USER MOD Single : A 51 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 GLN : amide:sc= -0.763 K(o=-0.76,f=-1.9) USER MOD Single : A 65 LYS NZ :NH3+ 178:sc= 0.951 (180deg=0.946) USER MOD Single : A 66 ASN : amide:sc= -1.73! C(o=-1.7!,f=-3.2!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot -33:sc= 0.187 USER MOD Single : A 75 MET CE :methyl -130:sc= -2.09! (180deg=-2.79!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 64:sc= 0.183 USER MOD Single : A 91 GLN : amide:sc= 1.21 K(o=1.2,f=-0.16) USER MOD Single : A 94 LYS NZ :NH3+ 170:sc= 1.21 (180deg=1.15) USER MOD Single : A 97 ASN : amide:sc= -0.0856 X(o=-0.086,f=0) USER MOD Single : A 100 GLN :FLIP amide:sc= -0.0177 F(o=-1.2!,f=-0.018) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 73:sc= 1.06 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= -0.189 (180deg=-0.189) USER MOD Single : A 122 SER OG : rot 1:sc= 0.481 USER MOD Single : A 124 TYR OH : rot 44:sc= 1.25 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0.0282 USER MOD Single : A 127 GLN : amide:sc= -2! C(o=-2!,f=-12!) USER MOD Single : A 128 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0.00234 USER MOD Single : A 139 MET CE :methyl 171:sc= 0 (180deg=-0.0918) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 142 CYS SG : rot -55:sc= -1.13! USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 540 N LYS A 34 -9.596 0.895 -8.274 1.00 0.00 N ATOM 541 CA LYS A 34 -8.865 0.056 -7.326 1.00 0.00 C ATOM 542 C LYS A 34 -7.959 -0.961 -8.031 1.00 0.00 C ATOM 543 O LYS A 34 -7.844 -0.969 -9.257 1.00 0.00 O ATOM 544 CB LYS A 34 -9.846 -0.654 -6.372 1.00 0.00 C ATOM 545 CG LYS A 34 -10.997 -1.398 -7.054 1.00 0.00 C ATOM 546 CD LYS A 34 -10.547 -2.682 -7.744 1.00 0.00 C ATOM 547 CE LYS A 34 -11.728 -3.441 -8.337 1.00 0.00 C ATOM 548 NZ LYS A 34 -12.601 -4.031 -7.286 1.00 0.00 N ATOM 0 HA LYS A 34 -8.216 0.710 -6.744 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -9.286 -1.364 -5.764 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -10.266 0.087 -5.692 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -11.758 -1.638 -6.312 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -11.463 -0.741 -7.788 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -9.834 -2.442 -8.533 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -10.027 -3.318 -7.028 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -12.316 -2.766 -8.959 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -11.359 -4.234 -8.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -13.300 -4.661 -7.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -12.020 -4.574 -6.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -13.095 -3.270 -6.777 1.00 0.00 H new ATOM 562 N HIS A 35 -7.317 -1.813 -7.239 1.00 0.00 N ATOM 563 CA HIS A 35 -6.437 -2.854 -7.763 1.00 0.00 C ATOM 564 C HIS A 35 -6.716 -4.193 -7.077 1.00 0.00 C ATOM 565 O HIS A 35 -7.709 -4.328 -6.359 1.00 0.00 O ATOM 566 CB HIS A 35 -4.966 -2.458 -7.586 1.00 0.00 C ATOM 567 CG HIS A 35 -4.434 -1.597 -8.693 1.00 0.00 C ATOM 568 ND1 HIS A 35 -3.856 -2.116 -9.830 1.00 0.00 N ATOM 569 CD2 HIS A 35 -4.386 -0.250 -8.833 1.00 0.00 C ATOM 570 CE1 HIS A 35 -3.473 -1.130 -10.620 1.00 0.00 C ATOM 571 NE2 HIS A 35 -3.782 0.014 -10.040 1.00 0.00 N ATOM 0 H HIS A 35 -7.390 -1.803 -6.222 1.00 0.00 H new ATOM 0 HA HIS A 35 -6.638 -2.965 -8.829 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -4.853 -1.928 -6.640 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -4.361 -3.362 -7.519 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -4.754 0.481 -8.128 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -2.989 -1.241 -11.579 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -3.602 0.942 -10.424 1.00 0.00 H new ATOM 580 N GLY A 36 -5.835 -5.169 -7.304 1.00 0.00 N ATOM 581 CA GLY A 36 -6.039 -6.518 -6.791 1.00 0.00 C ATOM 582 C GLY A 36 -5.849 -6.640 -5.286 1.00 0.00 C ATOM 583 O GLY A 36 -5.784 -5.639 -4.574 1.00 0.00 O ATOM 0 H GLY A 36 -4.975 -5.047 -7.839 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.046 -6.846 -7.048 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -5.346 -7.195 -7.291 1.00 0.00 H new ATOM 587 N GLN A 37 -5.743 -7.880 -4.811 1.00 0.00 N ATOM 588 CA GLN A 37 -5.683 -8.158 -3.378 1.00 0.00 C ATOM 589 C GLN A 37 -4.347 -7.737 -2.780 1.00 0.00 C ATOM 590 O GLN A 37 -4.269 -6.756 -2.050 1.00 0.00 O ATOM 591 CB GLN A 37 -5.928 -9.644 -3.101 1.00 0.00 C ATOM 592 CG GLN A 37 -7.242 -10.161 -3.660 1.00 0.00 C ATOM 593 CD GLN A 37 -7.531 -11.601 -3.269 1.00 0.00 C ATOM 594 OE1 GLN A 37 -7.122 -11.997 -2.069 1.00 0.00 O flip ATOM 595 NE2 GLN A 37 -8.140 -12.345 -4.034 1.00 0.00 N flip ATOM 0 H GLN A 37 -5.697 -8.711 -5.401 1.00 0.00 H new ATOM 0 HA GLN A 37 -6.470 -7.572 -2.904 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -5.109 -10.224 -3.527 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -5.911 -9.811 -2.024 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -8.055 -9.525 -3.308 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -7.223 -10.083 -4.747 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -8.438 -12.004 -4.948 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -8.348 -13.304 -3.755 1.00 0.00 H new ATOM 604 N PHE A 38 -3.299 -8.488 -3.084 1.00 0.00 N ATOM 605 CA PHE A 38 -1.980 -8.197 -2.545 1.00 0.00 C ATOM 606 C PHE A 38 -1.163 -7.429 -3.575 1.00 0.00 C ATOM 607 O PHE A 38 -0.655 -8.009 -4.537 1.00 0.00 O ATOM 608 CB PHE A 38 -1.259 -9.488 -2.148 1.00 0.00 C ATOM 609 CG PHE A 38 -2.022 -10.327 -1.161 1.00 0.00 C ATOM 610 CD1 PHE A 38 -2.113 -9.945 0.168 1.00 0.00 C ATOM 611 CD2 PHE A 38 -2.651 -11.494 -1.564 1.00 0.00 C ATOM 612 CE1 PHE A 38 -2.815 -10.712 1.078 1.00 0.00 C ATOM 613 CE2 PHE A 38 -3.355 -12.265 -0.659 1.00 0.00 C ATOM 614 CZ PHE A 38 -3.437 -11.873 0.665 1.00 0.00 C ATOM 0 H PHE A 38 -3.336 -9.301 -3.699 1.00 0.00 H new ATOM 0 HA PHE A 38 -2.094 -7.585 -1.650 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.070 -10.079 -3.044 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -0.288 -9.235 -1.723 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -1.629 -9.037 0.496 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -2.590 -11.804 -2.597 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -2.877 -10.404 2.111 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -3.841 -13.173 -0.985 1.00 0.00 H new ATOM 0 HZ PHE A 38 -3.987 -12.474 1.374 1.00 0.00 H new ATOM 624 N ILE A 39 -1.057 -6.123 -3.385 1.00 0.00 N ATOM 625 CA ILE A 39 -0.393 -5.262 -4.353 1.00 0.00 C ATOM 626 C ILE A 39 0.763 -4.503 -3.709 1.00 0.00 C ATOM 627 O ILE A 39 0.602 -3.880 -2.657 1.00 0.00 O ATOM 628 CB ILE A 39 -1.383 -4.244 -4.969 1.00 0.00 C ATOM 629 CG1 ILE A 39 -2.599 -4.957 -5.577 1.00 0.00 C ATOM 630 CG2 ILE A 39 -0.693 -3.386 -6.021 1.00 0.00 C ATOM 631 CD1 ILE A 39 -2.250 -5.957 -6.658 1.00 0.00 C ATOM 0 H ILE A 39 -1.423 -5.635 -2.568 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.006 -5.907 -5.142 1.00 0.00 H new ATOM 0 HB ILE A 39 -1.733 -3.594 -4.167 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.141 -5.471 -4.783 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.275 -4.210 -5.992 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.408 -2.678 -6.440 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.131 -2.840 -5.562 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.307 -4.025 -6.815 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.163 -6.417 -7.036 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -1.736 -5.447 -7.473 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -1.600 -6.728 -6.244 1.00 0.00 H new ATOM 643 N TYR A 40 1.924 -4.573 -4.342 1.00 0.00 N ATOM 644 CA TYR A 40 3.095 -3.835 -3.899 1.00 0.00 C ATOM 645 C TYR A 40 3.486 -2.825 -4.969 1.00 0.00 C ATOM 646 O TYR A 40 3.649 -3.179 -6.141 1.00 0.00 O ATOM 647 CB TYR A 40 4.256 -4.797 -3.629 1.00 0.00 C ATOM 648 CG TYR A 40 5.422 -4.179 -2.887 1.00 0.00 C ATOM 649 CD1 TYR A 40 5.416 -4.104 -1.501 1.00 0.00 C ATOM 650 CD2 TYR A 40 6.535 -3.690 -3.567 1.00 0.00 C ATOM 651 CE1 TYR A 40 6.480 -3.559 -0.811 1.00 0.00 C ATOM 652 CE2 TYR A 40 7.602 -3.140 -2.882 1.00 0.00 C ATOM 653 CZ TYR A 40 7.569 -3.079 -1.505 1.00 0.00 C ATOM 654 OH TYR A 40 8.636 -2.551 -0.817 1.00 0.00 O ATOM 0 H TYR A 40 2.080 -5.141 -5.175 1.00 0.00 H new ATOM 0 HA TYR A 40 2.862 -3.309 -2.973 1.00 0.00 H new ATOM 0 HB2 TYR A 40 3.883 -5.644 -3.054 1.00 0.00 H new ATOM 0 HB3 TYR A 40 4.614 -5.191 -4.580 1.00 0.00 H new ATOM 0 HD1 TYR A 40 4.564 -4.479 -0.953 1.00 0.00 H new ATOM 0 HD2 TYR A 40 6.565 -3.741 -4.645 1.00 0.00 H new ATOM 0 HE1 TYR A 40 6.459 -3.509 0.268 1.00 0.00 H new ATOM 0 HE2 TYR A 40 8.457 -2.760 -3.422 1.00 0.00 H new ATOM 0 HH TYR A 40 9.240 -2.101 -1.445 1.00 0.00 H new ATOM 664 N VAL A 41 3.618 -1.573 -4.574 1.00 0.00 N ATOM 665 CA VAL A 41 3.915 -0.507 -5.516 1.00 0.00 C ATOM 666 C VAL A 41 5.157 0.270 -5.098 1.00 0.00 C ATOM 667 O VAL A 41 5.354 0.553 -3.914 1.00 0.00 O ATOM 668 CB VAL A 41 2.719 0.456 -5.651 1.00 0.00 C ATOM 669 CG1 VAL A 41 1.602 -0.182 -6.461 1.00 0.00 C ATOM 670 CG2 VAL A 41 2.204 0.868 -4.280 1.00 0.00 C ATOM 0 H VAL A 41 3.524 -1.267 -3.605 1.00 0.00 H new ATOM 0 HA VAL A 41 4.106 -0.972 -6.483 1.00 0.00 H new ATOM 0 HB VAL A 41 3.062 1.347 -6.176 1.00 0.00 H new ATOM 0 HG11 VAL A 41 0.768 0.515 -6.543 1.00 0.00 H new ATOM 0 HG12 VAL A 41 1.970 -0.428 -7.457 1.00 0.00 H new ATOM 0 HG13 VAL A 41 1.266 -1.092 -5.964 1.00 0.00 H new ATOM 0 HG21 VAL A 41 1.360 1.548 -4.398 1.00 0.00 H new ATOM 0 HG22 VAL A 41 1.883 -0.017 -3.731 1.00 0.00 H new ATOM 0 HG23 VAL A 41 2.999 1.369 -3.728 1.00 0.00 H new ATOM 680 N TRP A 42 5.996 0.600 -6.074 1.00 0.00 N ATOM 681 CA TRP A 42 7.221 1.344 -5.813 1.00 0.00 C ATOM 682 C TRP A 42 7.537 2.272 -6.981 1.00 0.00 C ATOM 683 O TRP A 42 7.214 1.968 -8.135 1.00 0.00 O ATOM 684 CB TRP A 42 8.395 0.384 -5.560 1.00 0.00 C ATOM 685 CG TRP A 42 8.847 -0.368 -6.781 1.00 0.00 C ATOM 686 CD1 TRP A 42 8.153 -1.329 -7.456 1.00 0.00 C ATOM 687 CD2 TRP A 42 10.101 -0.226 -7.462 1.00 0.00 C ATOM 688 NE1 TRP A 42 8.893 -1.783 -8.523 1.00 0.00 N ATOM 689 CE2 TRP A 42 10.093 -1.123 -8.546 1.00 0.00 C ATOM 690 CE3 TRP A 42 11.227 0.577 -7.262 1.00 0.00 C ATOM 691 CZ2 TRP A 42 11.170 -1.240 -9.426 1.00 0.00 C ATOM 692 CZ3 TRP A 42 12.294 0.460 -8.134 1.00 0.00 C ATOM 693 CH2 TRP A 42 12.259 -0.440 -9.205 1.00 0.00 C ATOM 0 H TRP A 42 5.849 0.363 -7.055 1.00 0.00 H new ATOM 0 HA TRP A 42 7.072 1.948 -4.918 1.00 0.00 H new ATOM 0 HB2 TRP A 42 9.237 0.953 -5.164 1.00 0.00 H new ATOM 0 HB3 TRP A 42 8.105 -0.333 -4.792 1.00 0.00 H new ATOM 0 HD1 TRP A 42 7.167 -1.682 -7.191 1.00 0.00 H new ATOM 0 HE1 TRP A 42 8.596 -2.496 -9.189 1.00 0.00 H new ATOM 0 HE3 TRP A 42 11.263 1.277 -6.440 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 11.145 -1.936 -10.251 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 13.170 1.074 -7.986 1.00 0.00 H new ATOM 0 HH2 TRP A 42 13.107 -0.505 -9.870 1.00 0.00 H new ATOM 787 N SER A 50 1.690 7.360 -1.087 1.00 0.00 N ATOM 788 CA SER A 50 0.425 7.207 -0.370 1.00 0.00 C ATOM 789 C SER A 50 -0.787 7.727 -1.161 1.00 0.00 C ATOM 790 O SER A 50 -1.852 7.961 -0.588 1.00 0.00 O ATOM 791 CB SER A 50 0.538 7.959 0.955 1.00 0.00 C ATOM 792 OG SER A 50 1.897 8.072 1.345 1.00 0.00 O ATOM 0 HA SER A 50 0.253 6.142 -0.213 1.00 0.00 H new ATOM 0 HB2 SER A 50 0.098 8.951 0.856 1.00 0.00 H new ATOM 0 HB3 SER A 50 -0.026 7.435 1.727 1.00 0.00 H new ATOM 0 HG SER A 50 2.326 7.192 1.294 1.00 0.00 H new ATOM 798 N HIS A 51 -0.640 7.875 -2.473 1.00 0.00 N ATOM 799 CA HIS A 51 -1.717 8.399 -3.308 1.00 0.00 C ATOM 800 C HIS A 51 -2.826 7.368 -3.492 1.00 0.00 C ATOM 801 O HIS A 51 -3.981 7.619 -3.153 1.00 0.00 O ATOM 802 CB HIS A 51 -1.184 8.839 -4.673 1.00 0.00 C ATOM 803 CG HIS A 51 -0.374 10.096 -4.625 1.00 0.00 C ATOM 804 ND1 HIS A 51 -0.939 11.348 -4.558 1.00 0.00 N ATOM 805 CD2 HIS A 51 0.967 10.291 -4.635 1.00 0.00 C ATOM 806 CE1 HIS A 51 0.013 12.258 -4.531 1.00 0.00 C ATOM 807 NE2 HIS A 51 1.179 11.643 -4.576 1.00 0.00 N ATOM 0 H HIS A 51 0.212 7.640 -2.981 1.00 0.00 H new ATOM 0 HA HIS A 51 -2.134 9.266 -2.796 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -0.572 8.039 -5.090 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -2.024 8.984 -5.352 1.00 0.00 H new ATOM 0 HD2 HIS A 51 1.726 9.524 -4.681 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -0.136 13.326 -4.481 1.00 0.00 H new ATOM 0 HE2 HIS A 51 2.091 12.100 -4.568 1.00 0.00 H new ATOM 816 N LEU A 52 -2.467 6.202 -4.015 1.00 0.00 N ATOM 817 CA LEU A 52 -3.441 5.144 -4.264 1.00 0.00 C ATOM 818 C LEU A 52 -3.933 4.545 -2.954 1.00 0.00 C ATOM 819 O LEU A 52 -5.040 4.023 -2.876 1.00 0.00 O ATOM 820 CB LEU A 52 -2.831 4.043 -5.134 1.00 0.00 C ATOM 821 CG LEU A 52 -2.484 4.452 -6.567 1.00 0.00 C ATOM 822 CD1 LEU A 52 -1.899 3.270 -7.324 1.00 0.00 C ATOM 823 CD2 LEU A 52 -3.718 4.982 -7.280 1.00 0.00 C ATOM 0 H LEU A 52 -1.510 5.964 -4.275 1.00 0.00 H new ATOM 0 HA LEU A 52 -4.287 5.586 -4.791 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -1.925 3.681 -4.649 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -3.528 3.206 -5.172 1.00 0.00 H new ATOM 0 HG LEU A 52 -1.738 5.246 -6.533 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.656 3.574 -8.342 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -0.994 2.928 -6.822 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -2.627 2.459 -7.351 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -3.455 5.269 -8.298 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -4.483 4.206 -7.308 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -4.102 5.851 -6.746 1.00 0.00 H new ATOM 835 N LEU A 53 -3.094 4.640 -1.932 1.00 0.00 N ATOM 836 CA LEU A 53 -3.366 4.043 -0.632 1.00 0.00 C ATOM 837 C LEU A 53 -4.714 4.506 -0.074 1.00 0.00 C ATOM 838 O LEU A 53 -5.557 3.693 0.299 1.00 0.00 O ATOM 839 CB LEU A 53 -2.246 4.414 0.338 1.00 0.00 C ATOM 840 CG LEU A 53 -1.948 3.375 1.414 1.00 0.00 C ATOM 841 CD1 LEU A 53 -1.261 2.165 0.804 1.00 0.00 C ATOM 842 CD2 LEU A 53 -1.090 3.979 2.502 1.00 0.00 C ATOM 0 H LEU A 53 -2.203 5.135 -1.981 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.411 2.961 -0.753 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -1.336 4.592 -0.234 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -2.505 5.354 0.825 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.890 3.050 1.856 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.055 1.432 1.584 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.910 1.720 0.050 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.325 2.474 0.340 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.885 3.227 3.263 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.150 4.327 2.073 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -1.615 4.820 2.955 1.00 0.00 H new ATOM 854 N GLN A 54 -4.908 5.817 -0.030 1.00 0.00 N ATOM 855 CA GLN A 54 -6.133 6.394 0.516 1.00 0.00 C ATOM 856 C GLN A 54 -7.304 6.209 -0.444 1.00 0.00 C ATOM 857 O GLN A 54 -8.423 5.900 -0.026 1.00 0.00 O ATOM 858 CB GLN A 54 -5.925 7.876 0.827 1.00 0.00 C ATOM 859 CG GLN A 54 -5.449 8.706 -0.357 1.00 0.00 C ATOM 860 CD GLN A 54 -5.280 10.172 -0.015 1.00 0.00 C ATOM 861 OE1 GLN A 54 -6.209 10.964 -0.165 1.00 0.00 O ATOM 862 NE2 GLN A 54 -4.095 10.541 0.441 1.00 0.00 N ATOM 0 H GLN A 54 -4.233 6.504 -0.366 1.00 0.00 H new ATOM 0 HA GLN A 54 -6.373 5.870 1.441 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -6.863 8.293 1.194 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -5.198 7.967 1.634 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -4.499 8.309 -0.715 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -6.163 8.608 -1.174 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -3.353 9.850 0.550 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -3.923 11.517 0.684 1.00 0.00 H new ATOM 871 N ALA A 55 -7.021 6.395 -1.725 1.00 0.00 N ATOM 872 CA ALA A 55 -8.022 6.256 -2.778 1.00 0.00 C ATOM 873 C ALA A 55 -8.664 4.871 -2.753 1.00 0.00 C ATOM 874 O ALA A 55 -9.888 4.732 -2.823 1.00 0.00 O ATOM 875 CB ALA A 55 -7.381 6.514 -4.136 1.00 0.00 C ATOM 0 H ALA A 55 -6.093 6.646 -2.066 1.00 0.00 H new ATOM 0 HA ALA A 55 -8.807 6.991 -2.602 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -8.132 6.409 -4.919 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -6.972 7.524 -4.159 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -6.580 5.794 -4.303 1.00 0.00 H new ATOM 881 N TRP A 56 -7.818 3.863 -2.626 1.00 0.00 N ATOM 882 CA TRP A 56 -8.240 2.471 -2.644 1.00 0.00 C ATOM 883 C TRP A 56 -9.147 2.155 -1.455 1.00 0.00 C ATOM 884 O TRP A 56 -10.155 1.460 -1.593 1.00 0.00 O ATOM 885 CB TRP A 56 -6.989 1.592 -2.625 1.00 0.00 C ATOM 886 CG TRP A 56 -7.248 0.122 -2.620 1.00 0.00 C ATOM 887 CD1 TRP A 56 -7.749 -0.630 -3.640 1.00 0.00 C ATOM 888 CD2 TRP A 56 -6.990 -0.778 -1.544 1.00 0.00 C ATOM 889 NE1 TRP A 56 -7.825 -1.947 -3.258 1.00 0.00 N ATOM 890 CE2 TRP A 56 -7.364 -2.060 -1.974 1.00 0.00 C ATOM 891 CE3 TRP A 56 -6.483 -0.618 -0.251 1.00 0.00 C ATOM 892 CZ2 TRP A 56 -7.238 -3.179 -1.162 1.00 0.00 C ATOM 893 CZ3 TRP A 56 -6.358 -1.731 0.557 1.00 0.00 C ATOM 894 CH2 TRP A 56 -6.736 -2.997 0.099 1.00 0.00 C ATOM 0 H TRP A 56 -6.813 3.987 -2.507 1.00 0.00 H new ATOM 0 HA TRP A 56 -8.819 2.274 -3.546 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -6.380 1.835 -3.496 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -6.400 1.844 -1.743 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -8.043 -0.247 -4.606 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -8.168 -2.714 -3.836 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -6.194 0.358 0.109 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -7.526 -4.159 -1.513 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -5.963 -1.622 1.556 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -6.630 -3.849 0.754 1.00 0.00 H new ATOM 905 N VAL A 57 -8.790 2.688 -0.293 1.00 0.00 N ATOM 906 CA VAL A 57 -9.541 2.431 0.932 1.00 0.00 C ATOM 907 C VAL A 57 -10.928 3.066 0.889 1.00 0.00 C ATOM 908 O VAL A 57 -11.921 2.415 1.215 1.00 0.00 O ATOM 909 CB VAL A 57 -8.771 2.931 2.177 1.00 0.00 C ATOM 910 CG1 VAL A 57 -9.644 2.891 3.422 1.00 0.00 C ATOM 911 CG2 VAL A 57 -7.525 2.091 2.382 1.00 0.00 C ATOM 0 H VAL A 57 -7.984 3.302 -0.172 1.00 0.00 H new ATOM 0 HA VAL A 57 -9.663 1.350 1.006 1.00 0.00 H new ATOM 0 HB VAL A 57 -8.484 3.968 2.006 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.073 3.249 4.279 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -10.516 3.529 3.276 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -9.970 1.867 3.605 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -6.986 2.447 3.260 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -7.809 1.049 2.529 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -6.883 2.172 1.505 1.00 0.00 H new ATOM 921 N ALA A 58 -11.000 4.325 0.473 1.00 0.00 N ATOM 922 CA ALA A 58 -12.274 5.041 0.434 1.00 0.00 C ATOM 923 C ALA A 58 -13.248 4.386 -0.541 1.00 0.00 C ATOM 924 O ALA A 58 -14.457 4.344 -0.289 1.00 0.00 O ATOM 925 CB ALA A 58 -12.050 6.498 0.065 1.00 0.00 C ATOM 0 H ALA A 58 -10.197 4.871 0.159 1.00 0.00 H new ATOM 0 HA ALA A 58 -12.717 4.995 1.429 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -13.007 7.018 0.040 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -11.402 6.966 0.806 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -11.579 6.557 -0.916 1.00 0.00 H new ATOM 931 N GLN A 59 -12.714 3.872 -1.645 1.00 0.00 N ATOM 932 CA GLN A 59 -13.521 3.165 -2.630 1.00 0.00 C ATOM 933 C GLN A 59 -14.159 1.938 -1.979 1.00 0.00 C ATOM 934 O GLN A 59 -15.367 1.718 -2.082 1.00 0.00 O ATOM 935 CB GLN A 59 -12.641 2.758 -3.825 1.00 0.00 C ATOM 936 CG GLN A 59 -13.408 2.257 -5.046 1.00 0.00 C ATOM 937 CD GLN A 59 -13.922 0.834 -4.905 1.00 0.00 C ATOM 938 OE1 GLN A 59 -13.323 0.003 -4.222 1.00 0.00 O ATOM 939 NE2 GLN A 59 -15.031 0.539 -5.563 1.00 0.00 N ATOM 0 H GLN A 59 -11.723 3.933 -1.879 1.00 0.00 H new ATOM 0 HA GLN A 59 -14.315 3.817 -2.995 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -12.036 3.615 -4.121 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -11.952 1.978 -3.501 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -14.252 2.922 -5.231 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -12.759 2.314 -5.920 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -15.500 1.254 -6.119 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -15.417 -0.404 -5.514 1.00 0.00 H new ATOM 948 N ALA A 60 -13.337 1.168 -1.275 1.00 0.00 N ATOM 949 CA ALA A 60 -13.788 -0.050 -0.614 1.00 0.00 C ATOM 950 C ALA A 60 -14.773 0.256 0.516 1.00 0.00 C ATOM 951 O ALA A 60 -15.689 -0.524 0.784 1.00 0.00 O ATOM 952 CB ALA A 60 -12.593 -0.819 -0.077 1.00 0.00 C ATOM 0 H ALA A 60 -12.345 1.369 -1.147 1.00 0.00 H new ATOM 0 HA ALA A 60 -14.310 -0.661 -1.351 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -12.937 -1.728 0.416 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -11.929 -1.082 -0.901 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -12.054 -0.200 0.640 1.00 0.00 H new ATOM 958 N LEU A 61 -14.582 1.398 1.169 1.00 0.00 N ATOM 959 CA LEU A 61 -15.457 1.818 2.261 1.00 0.00 C ATOM 960 C LEU A 61 -16.884 2.038 1.771 1.00 0.00 C ATOM 961 O LEU A 61 -17.846 1.616 2.419 1.00 0.00 O ATOM 962 CB LEU A 61 -14.921 3.094 2.919 1.00 0.00 C ATOM 963 CG LEU A 61 -13.648 2.913 3.746 1.00 0.00 C ATOM 964 CD1 LEU A 61 -13.199 4.246 4.321 1.00 0.00 C ATOM 965 CD2 LEU A 61 -13.871 1.902 4.862 1.00 0.00 C ATOM 0 H LEU A 61 -13.827 2.052 0.961 1.00 0.00 H new ATOM 0 HA LEU A 61 -15.472 1.019 3.002 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -14.728 3.832 2.140 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -15.698 3.506 3.563 1.00 0.00 H new ATOM 0 HG LEU A 61 -12.864 2.533 3.091 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -12.292 4.102 4.908 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -12.999 4.944 3.508 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -13.984 4.649 4.960 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -12.953 1.788 5.438 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -14.669 2.253 5.516 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -14.151 0.941 4.431 1.00 0.00 H new ATOM 977 N GLU A 62 -17.022 2.675 0.615 1.00 0.00 N ATOM 978 CA GLU A 62 -18.343 2.939 0.050 1.00 0.00 C ATOM 979 C GLU A 62 -18.928 1.681 -0.585 1.00 0.00 C ATOM 980 O GLU A 62 -20.088 1.656 -0.999 1.00 0.00 O ATOM 981 CB GLU A 62 -18.284 4.081 -0.960 1.00 0.00 C ATOM 982 CG GLU A 62 -17.863 5.392 -0.325 1.00 0.00 C ATOM 983 CD GLU A 62 -17.990 6.580 -1.259 1.00 0.00 C ATOM 984 OE1 GLU A 62 -18.950 6.612 -2.061 1.00 0.00 O ATOM 985 OE2 GLU A 62 -17.159 7.508 -1.164 1.00 0.00 O ATOM 0 H GLU A 62 -16.243 3.017 0.052 1.00 0.00 H new ATOM 0 HA GLU A 62 -19.002 3.241 0.864 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -17.584 3.824 -1.755 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -19.263 4.203 -1.424 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -18.471 5.570 0.562 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -16.829 5.310 0.009 1.00 0.00 H new ATOM 992 N ALA A 63 -18.118 0.638 -0.650 1.00 0.00 N ATOM 993 CA ALA A 63 -18.586 -0.670 -1.090 1.00 0.00 C ATOM 994 C ALA A 63 -19.192 -1.433 0.084 1.00 0.00 C ATOM 995 O ALA A 63 -19.621 -2.577 -0.061 1.00 0.00 O ATOM 996 CB ALA A 63 -17.452 -1.468 -1.718 1.00 0.00 C ATOM 0 H ALA A 63 -17.129 0.670 -0.403 1.00 0.00 H new ATOM 0 HA ALA A 63 -19.356 -0.524 -1.848 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -17.826 -2.441 -2.039 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -17.061 -0.928 -2.580 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -16.657 -1.608 -0.986 1.00 0.00 H new ATOM 1002 N GLY A 64 -19.206 -0.795 1.253 1.00 0.00 N ATOM 1003 CA GLY A 64 -19.797 -1.410 2.426 1.00 0.00 C ATOM 1004 C GLY A 64 -18.872 -2.417 3.069 1.00 0.00 C ATOM 1005 O GLY A 64 -19.294 -3.238 3.884 1.00 0.00 O ATOM 0 H GLY A 64 -18.818 0.136 1.406 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -20.050 -0.637 3.151 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -20.729 -1.902 2.146 1.00 0.00 H new ATOM 1009 N LYS A 65 -17.604 -2.350 2.702 1.00 0.00 N ATOM 1010 CA LYS A 65 -16.610 -3.274 3.197 1.00 0.00 C ATOM 1011 C LYS A 65 -15.708 -2.550 4.175 1.00 0.00 C ATOM 1012 O LYS A 65 -15.760 -1.322 4.279 1.00 0.00 O ATOM 1013 CB LYS A 65 -15.795 -3.833 2.032 1.00 0.00 C ATOM 1014 CG LYS A 65 -16.644 -4.450 0.930 1.00 0.00 C ATOM 1015 CD LYS A 65 -17.383 -5.688 1.414 1.00 0.00 C ATOM 1016 CE LYS A 65 -18.347 -6.206 0.358 1.00 0.00 C ATOM 1017 NZ LYS A 65 -19.523 -5.312 0.186 1.00 0.00 N ATOM 0 H LYS A 65 -17.239 -1.653 2.053 1.00 0.00 H new ATOM 0 HA LYS A 65 -17.098 -4.106 3.705 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -15.190 -3.032 1.607 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -15.105 -4.587 2.412 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -17.363 -3.714 0.570 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -16.008 -4.713 0.085 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -16.664 -6.467 1.666 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -17.932 -5.453 2.326 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -17.824 -6.303 -0.593 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -18.688 -7.203 0.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -20.136 -5.686 -0.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -20.057 -5.266 1.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -19.199 -4.358 -0.073 1.00 0.00 H new ATOM 1031 N ASN A 66 -14.890 -3.290 4.893 1.00 0.00 N ATOM 1032 CA ASN A 66 -14.026 -2.674 5.886 1.00 0.00 C ATOM 1033 C ASN A 66 -12.610 -2.533 5.360 1.00 0.00 C ATOM 1034 O ASN A 66 -12.030 -3.479 4.826 1.00 0.00 O ATOM 1035 CB ASN A 66 -14.020 -3.473 7.188 1.00 0.00 C ATOM 1036 CG ASN A 66 -13.629 -2.607 8.373 1.00 0.00 C ATOM 1037 OD1 ASN A 66 -13.796 -1.387 8.346 1.00 0.00 O ATOM 1038 ND2 ASN A 66 -13.129 -3.223 9.428 1.00 0.00 N ATOM 0 H ASN A 66 -14.803 -4.303 4.813 1.00 0.00 H new ATOM 0 HA ASN A 66 -14.425 -1.681 6.093 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -15.009 -3.899 7.359 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -13.324 -4.307 7.101 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -12.867 -2.687 10.255 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -13.004 -4.235 9.416 1.00 0.00 H new ATOM 1045 N ALA A 67 -12.051 -1.354 5.554 1.00 0.00 N ATOM 1046 CA ALA A 67 -10.726 -1.036 5.060 1.00 0.00 C ATOM 1047 C ALA A 67 -10.095 0.049 5.917 1.00 0.00 C ATOM 1048 O ALA A 67 -10.796 0.761 6.637 1.00 0.00 O ATOM 1049 CB ALA A 67 -10.800 -0.585 3.609 1.00 0.00 C ATOM 0 H ALA A 67 -12.502 -0.591 6.058 1.00 0.00 H new ATOM 0 HA ALA A 67 -10.106 -1.931 5.116 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -9.798 -0.349 3.250 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -11.225 -1.384 3.001 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -11.430 0.301 3.535 1.00 0.00 H new ATOM 1055 N ALA A 68 -8.780 0.167 5.846 1.00 0.00 N ATOM 1056 CA ALA A 68 -8.063 1.179 6.604 1.00 0.00 C ATOM 1057 C ALA A 68 -6.687 1.426 6.001 1.00 0.00 C ATOM 1058 O ALA A 68 -5.956 0.480 5.707 1.00 0.00 O ATOM 1059 CB ALA A 68 -7.931 0.759 8.063 1.00 0.00 C ATOM 0 H ALA A 68 -8.185 -0.428 5.269 1.00 0.00 H new ATOM 0 HA ALA A 68 -8.633 2.107 6.558 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.392 1.528 8.616 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -8.923 0.630 8.496 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.384 -0.182 8.123 1.00 0.00 H new ATOM 1065 N TYR A 69 -6.347 2.694 5.806 1.00 0.00 N ATOM 1066 CA TYR A 69 -5.022 3.061 5.333 1.00 0.00 C ATOM 1067 C TYR A 69 -4.213 3.627 6.491 1.00 0.00 C ATOM 1068 O TYR A 69 -4.651 4.549 7.181 1.00 0.00 O ATOM 1069 CB TYR A 69 -5.093 4.068 4.169 1.00 0.00 C ATOM 1070 CG TYR A 69 -5.597 5.454 4.541 1.00 0.00 C ATOM 1071 CD1 TYR A 69 -6.936 5.681 4.855 1.00 0.00 C ATOM 1072 CD2 TYR A 69 -4.728 6.540 4.572 1.00 0.00 C ATOM 1073 CE1 TYR A 69 -7.385 6.945 5.188 1.00 0.00 C ATOM 1074 CE2 TYR A 69 -5.174 7.804 4.906 1.00 0.00 C ATOM 1075 CZ TYR A 69 -6.501 8.000 5.212 1.00 0.00 C ATOM 1076 OH TYR A 69 -6.945 9.257 5.549 1.00 0.00 O ATOM 0 H TYR A 69 -6.972 3.484 5.969 1.00 0.00 H new ATOM 0 HA TYR A 69 -4.530 2.167 4.950 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -4.099 4.165 3.733 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -5.742 3.659 3.395 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -7.633 4.856 4.838 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -3.686 6.392 4.331 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -8.426 7.104 5.429 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -4.484 8.635 4.927 1.00 0.00 H new ATOM 0 HH TYR A 69 -6.195 9.888 5.519 1.00 0.00 H new ATOM 1086 N ILE A 70 -3.055 3.041 6.720 1.00 0.00 N ATOM 1087 CA ILE A 70 -2.195 3.442 7.817 1.00 0.00 C ATOM 1088 C ILE A 70 -0.811 3.813 7.305 1.00 0.00 C ATOM 1089 O ILE A 70 -0.116 2.995 6.698 1.00 0.00 O ATOM 1090 CB ILE A 70 -2.082 2.324 8.878 1.00 0.00 C ATOM 1091 CG1 ILE A 70 -3.463 2.014 9.467 1.00 0.00 C ATOM 1092 CG2 ILE A 70 -1.113 2.731 9.979 1.00 0.00 C ATOM 1093 CD1 ILE A 70 -3.452 0.903 10.495 1.00 0.00 C ATOM 0 H ILE A 70 -2.684 2.277 6.155 1.00 0.00 H new ATOM 0 HA ILE A 70 -2.646 4.316 8.287 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.697 1.424 8.398 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.863 2.918 9.926 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.140 1.741 8.658 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.045 1.932 10.718 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -0.128 2.911 9.548 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -1.471 3.641 10.460 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.464 0.741 10.866 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.083 -0.014 10.036 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.801 1.181 11.324 1.00 0.00 H new ATOM 1105 N ASP A 71 -0.435 5.057 7.533 1.00 0.00 N ATOM 1106 CA ASP A 71 0.879 5.536 7.167 1.00 0.00 C ATOM 1107 C ASP A 71 1.804 5.432 8.364 1.00 0.00 C ATOM 1108 O ASP A 71 1.614 6.106 9.371 1.00 0.00 O ATOM 1109 CB ASP A 71 0.820 6.980 6.647 1.00 0.00 C ATOM 1110 CG ASP A 71 0.088 7.925 7.583 1.00 0.00 C ATOM 1111 OD1 ASP A 71 -1.162 7.959 7.539 1.00 0.00 O ATOM 1112 OD2 ASP A 71 0.752 8.639 8.362 1.00 0.00 O ATOM 0 H ASP A 71 -1.030 5.758 7.975 1.00 0.00 H new ATOM 0 HA ASP A 71 1.266 4.916 6.359 1.00 0.00 H new ATOM 0 HB2 ASP A 71 1.835 7.346 6.494 1.00 0.00 H new ATOM 0 HB3 ASP A 71 0.328 6.989 5.675 1.00 0.00 H new ATOM 1117 N ALA A 72 2.803 4.573 8.248 1.00 0.00 N ATOM 1118 CA ALA A 72 3.723 4.292 9.351 1.00 0.00 C ATOM 1119 C ALA A 72 4.470 5.544 9.806 1.00 0.00 C ATOM 1120 O ALA A 72 5.030 5.581 10.904 1.00 0.00 O ATOM 1121 CB ALA A 72 4.713 3.211 8.949 1.00 0.00 C ATOM 0 H ALA A 72 3.003 4.051 7.395 1.00 0.00 H new ATOM 0 HA ALA A 72 3.125 3.941 10.192 1.00 0.00 H new ATOM 0 HB1 ALA A 72 5.391 3.012 9.779 1.00 0.00 H new ATOM 0 HB2 ALA A 72 4.173 2.299 8.695 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.286 3.546 8.084 1.00 0.00 H new ATOM 1127 N ALA A 73 4.488 6.559 8.956 1.00 0.00 N ATOM 1128 CA ALA A 73 5.145 7.816 9.279 1.00 0.00 C ATOM 1129 C ALA A 73 4.435 8.569 10.403 1.00 0.00 C ATOM 1130 O ALA A 73 5.082 9.267 11.186 1.00 0.00 O ATOM 1131 CB ALA A 73 5.257 8.692 8.040 1.00 0.00 C ATOM 0 H ALA A 73 4.053 6.536 8.034 1.00 0.00 H new ATOM 0 HA ALA A 73 6.146 7.573 9.636 1.00 0.00 H new ATOM 0 HB1 ALA A 73 5.751 9.628 8.300 1.00 0.00 H new ATOM 0 HB2 ALA A 73 5.840 8.173 7.279 1.00 0.00 H new ATOM 0 HB3 ALA A 73 4.260 8.903 7.652 1.00 0.00 H new ATOM 1137 N SER A 74 3.119 8.430 10.493 1.00 0.00 N ATOM 1138 CA SER A 74 2.365 9.149 11.514 1.00 0.00 C ATOM 1139 C SER A 74 1.469 8.212 12.330 1.00 0.00 C ATOM 1140 O SER A 74 0.931 8.606 13.370 1.00 0.00 O ATOM 1141 CB SER A 74 1.524 10.257 10.865 1.00 0.00 C ATOM 1142 OG SER A 74 0.918 11.093 11.844 1.00 0.00 O ATOM 0 H SER A 74 2.558 7.836 9.883 1.00 0.00 H new ATOM 0 HA SER A 74 3.083 9.595 12.202 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.155 10.859 10.212 1.00 0.00 H new ATOM 0 HB3 SER A 74 0.752 9.810 10.239 1.00 0.00 H new ATOM 0 HG SER A 74 0.696 10.561 12.636 1.00 0.00 H new ATOM 1148 N MET A 75 1.311 6.978 11.873 1.00 0.00 N ATOM 1149 CA MET A 75 0.416 6.027 12.529 1.00 0.00 C ATOM 1150 C MET A 75 1.026 4.626 12.583 1.00 0.00 C ATOM 1151 O MET A 75 1.718 4.206 11.660 1.00 0.00 O ATOM 1152 CB MET A 75 -0.932 5.969 11.795 1.00 0.00 C ATOM 1153 CG MET A 75 -1.764 7.236 11.918 1.00 0.00 C ATOM 1154 SD MET A 75 -3.469 7.011 11.370 1.00 0.00 S ATOM 1155 CE MET A 75 -3.215 6.491 9.675 1.00 0.00 C ATOM 0 H MET A 75 1.789 6.609 11.051 1.00 0.00 H new ATOM 0 HA MET A 75 0.263 6.375 13.551 1.00 0.00 H new ATOM 0 HB2 MET A 75 -0.750 5.769 10.739 1.00 0.00 H new ATOM 0 HB3 MET A 75 -1.509 5.130 12.184 1.00 0.00 H new ATOM 0 HG2 MET A 75 -1.762 7.567 12.957 1.00 0.00 H new ATOM 0 HG3 MET A 75 -1.300 8.028 11.330 1.00 0.00 H new ATOM 0 HE1 MET A 75 -3.841 7.090 9.013 1.00 0.00 H new ATOM 0 HE2 MET A 75 -2.168 6.627 9.406 1.00 0.00 H new ATOM 0 HE3 MET A 75 -3.482 5.439 9.573 1.00 0.00 H new ATOM 1165 N PRO A 76 0.785 3.893 13.680 1.00 0.00 N ATOM 1166 CA PRO A 76 1.196 2.505 13.819 1.00 0.00 C ATOM 1167 C PRO A 76 0.064 1.526 13.491 1.00 0.00 C ATOM 1168 O PRO A 76 -1.093 1.924 13.337 1.00 0.00 O ATOM 1169 CB PRO A 76 1.554 2.435 15.303 1.00 0.00 C ATOM 1170 CG PRO A 76 0.631 3.410 15.972 1.00 0.00 C ATOM 1171 CD PRO A 76 0.135 4.369 14.908 1.00 0.00 C ATOM 0 HA PRO A 76 2.003 2.228 13.141 1.00 0.00 H new ATOM 0 HB2 PRO A 76 1.415 1.428 15.695 1.00 0.00 H new ATOM 0 HB3 PRO A 76 2.598 2.701 15.470 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -0.205 2.889 16.439 1.00 0.00 H new ATOM 0 HG3 PRO A 76 1.151 3.950 16.763 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -0.951 4.344 14.822 1.00 0.00 H new ATOM 0 HD3 PRO A 76 0.413 5.398 15.135 1.00 0.00 H new ATOM 1179 N LEU A 77 0.403 0.248 13.388 1.00 0.00 N ATOM 1180 CA LEU A 77 -0.590 -0.788 13.137 1.00 0.00 C ATOM 1181 C LEU A 77 -1.038 -1.397 14.462 1.00 0.00 C ATOM 1182 O LEU A 77 -0.232 -1.541 15.380 1.00 0.00 O ATOM 1183 CB LEU A 77 -0.006 -1.868 12.217 1.00 0.00 C ATOM 1184 CG LEU A 77 -0.970 -2.990 11.821 1.00 0.00 C ATOM 1185 CD1 LEU A 77 -2.178 -2.436 11.082 1.00 0.00 C ATOM 1186 CD2 LEU A 77 -0.257 -4.015 10.960 1.00 0.00 C ATOM 0 H LEU A 77 1.359 -0.097 13.474 1.00 0.00 H new ATOM 0 HA LEU A 77 -1.455 -0.347 12.641 1.00 0.00 H new ATOM 0 HB2 LEU A 77 0.358 -1.388 11.308 1.00 0.00 H new ATOM 0 HB3 LEU A 77 0.858 -2.313 12.711 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.320 -3.473 12.733 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -2.846 -3.254 10.812 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.707 -1.732 11.725 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.848 -1.924 10.178 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.953 -4.807 10.685 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.119 -3.534 10.057 1.00 0.00 H new ATOM 0 HD23 LEU A 77 0.577 -4.442 11.518 1.00 0.00 H new ATOM 1198 N THR A 78 -2.313 -1.750 14.560 1.00 0.00 N ATOM 1199 CA THR A 78 -2.873 -2.252 15.802 1.00 0.00 C ATOM 1200 C THR A 78 -3.829 -3.410 15.544 1.00 0.00 C ATOM 1201 O THR A 78 -4.215 -3.671 14.403 1.00 0.00 O ATOM 1202 CB THR A 78 -3.631 -1.142 16.556 1.00 0.00 C ATOM 1203 OG1 THR A 78 -4.485 -0.433 15.645 1.00 0.00 O ATOM 1204 CG2 THR A 78 -2.673 -0.168 17.226 1.00 0.00 C ATOM 0 H THR A 78 -2.979 -1.697 13.789 1.00 0.00 H new ATOM 0 HA THR A 78 -2.039 -2.600 16.411 1.00 0.00 H new ATOM 0 HB THR A 78 -4.231 -1.613 17.334 1.00 0.00 H new ATOM 0 HG1 THR A 78 -4.966 0.271 16.128 1.00 0.00 H new ATOM 0 HG21 THR A 78 -3.242 0.601 17.748 1.00 0.00 H new ATOM 0 HG22 THR A 78 -2.049 -0.705 17.940 1.00 0.00 H new ATOM 0 HG23 THR A 78 -2.041 0.299 16.470 1.00 0.00 H new ATOM 1212 N ASP A 79 -4.212 -4.090 16.615 1.00 0.00 N ATOM 1213 CA ASP A 79 -5.193 -5.168 16.541 1.00 0.00 C ATOM 1214 C ASP A 79 -6.583 -4.599 16.264 1.00 0.00 C ATOM 1215 O ASP A 79 -7.453 -5.278 15.721 1.00 0.00 O ATOM 1216 CB ASP A 79 -5.193 -5.975 17.843 1.00 0.00 C ATOM 1217 CG ASP A 79 -6.235 -7.081 17.861 1.00 0.00 C ATOM 1218 OD1 ASP A 79 -6.027 -8.122 17.199 1.00 0.00 O ATOM 1219 OD2 ASP A 79 -7.255 -6.926 18.564 1.00 0.00 O ATOM 0 H ASP A 79 -3.856 -3.913 17.554 1.00 0.00 H new ATOM 0 HA ASP A 79 -4.922 -5.834 15.722 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -4.206 -6.412 17.992 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -5.373 -5.301 18.681 1.00 0.00 H new ATOM 1224 N ALA A 80 -6.781 -3.339 16.625 1.00 0.00 N ATOM 1225 CA ALA A 80 -8.014 -2.636 16.300 1.00 0.00 C ATOM 1226 C ALA A 80 -8.158 -2.481 14.788 1.00 0.00 C ATOM 1227 O ALA A 80 -9.266 -2.367 14.262 1.00 0.00 O ATOM 1228 CB ALA A 80 -8.050 -1.280 16.984 1.00 0.00 C ATOM 0 H ALA A 80 -6.102 -2.782 17.144 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.855 -3.226 16.666 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -8.979 -0.769 16.730 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.994 -1.416 18.064 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -7.203 -0.681 16.650 1.00 0.00 H new ATOM 1234 N ALA A 81 -7.027 -2.482 14.091 1.00 0.00 N ATOM 1235 CA ALA A 81 -7.019 -2.377 12.638 1.00 0.00 C ATOM 1236 C ALA A 81 -7.184 -3.753 11.998 1.00 0.00 C ATOM 1237 O ALA A 81 -7.396 -3.865 10.792 1.00 0.00 O ATOM 1238 CB ALA A 81 -5.734 -1.715 12.163 1.00 0.00 C ATOM 0 H ALA A 81 -6.101 -2.555 14.512 1.00 0.00 H new ATOM 0 HA ALA A 81 -7.861 -1.757 12.332 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -5.742 -1.643 11.075 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -5.659 -0.716 12.592 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.879 -2.311 12.481 1.00 0.00 H new ATOM 1244 N PHE A 82 -7.116 -4.793 12.823 1.00 0.00 N ATOM 1245 CA PHE A 82 -7.240 -6.170 12.350 1.00 0.00 C ATOM 1246 C PHE A 82 -8.678 -6.442 11.906 1.00 0.00 C ATOM 1247 O PHE A 82 -8.955 -7.408 11.195 1.00 0.00 O ATOM 1248 CB PHE A 82 -6.839 -7.142 13.470 1.00 0.00 C ATOM 1249 CG PHE A 82 -6.324 -8.473 12.998 1.00 0.00 C ATOM 1250 CD1 PHE A 82 -7.188 -9.458 12.552 1.00 0.00 C ATOM 1251 CD2 PHE A 82 -4.966 -8.741 13.019 1.00 0.00 C ATOM 1252 CE1 PHE A 82 -6.707 -10.684 12.134 1.00 0.00 C ATOM 1253 CE2 PHE A 82 -4.478 -9.963 12.601 1.00 0.00 C ATOM 1254 CZ PHE A 82 -5.348 -10.936 12.158 1.00 0.00 C ATOM 0 H PHE A 82 -6.975 -4.708 13.830 1.00 0.00 H new ATOM 0 HA PHE A 82 -6.576 -6.317 11.498 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -6.073 -6.669 14.084 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -7.704 -7.310 14.112 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -8.251 -9.266 12.530 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -4.279 -7.984 13.367 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -7.392 -11.444 11.789 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.416 -10.156 12.621 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.969 -11.893 11.830 1.00 0.00 H new ATOM 1264 N GLU A 83 -9.593 -5.576 12.334 1.00 0.00 N ATOM 1265 CA GLU A 83 -10.998 -5.692 11.969 1.00 0.00 C ATOM 1266 C GLU A 83 -11.208 -5.412 10.486 1.00 0.00 C ATOM 1267 O GLU A 83 -12.205 -5.830 9.891 1.00 0.00 O ATOM 1268 CB GLU A 83 -11.837 -4.720 12.787 1.00 0.00 C ATOM 1269 CG GLU A 83 -11.784 -4.972 14.278 1.00 0.00 C ATOM 1270 CD GLU A 83 -12.813 -4.158 15.032 1.00 0.00 C ATOM 1271 OE1 GLU A 83 -13.955 -4.645 15.194 1.00 0.00 O ATOM 1272 OE2 GLU A 83 -12.502 -3.026 15.451 1.00 0.00 O ATOM 0 H GLU A 83 -9.382 -4.782 12.938 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.311 -6.715 12.179 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.497 -3.704 12.587 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -12.873 -4.780 12.454 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -11.949 -6.032 14.472 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -10.788 -4.731 14.650 1.00 0.00 H new ATOM 1279 N ALA A 84 -10.274 -4.683 9.899 1.00 0.00 N ATOM 1280 CA ALA A 84 -10.355 -4.310 8.501 1.00 0.00 C ATOM 1281 C ALA A 84 -10.029 -5.488 7.605 1.00 0.00 C ATOM 1282 O ALA A 84 -9.136 -6.283 7.896 1.00 0.00 O ATOM 1283 CB ALA A 84 -9.431 -3.142 8.207 1.00 0.00 C ATOM 0 H ALA A 84 -9.443 -4.335 10.377 1.00 0.00 H new ATOM 0 HA ALA A 84 -11.379 -4.001 8.292 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.505 -2.876 7.153 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.720 -2.287 8.818 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -8.404 -3.423 8.439 1.00 0.00 H new ATOM 1289 N GLU A 85 -10.784 -5.610 6.534 1.00 0.00 N ATOM 1290 CA GLU A 85 -10.547 -6.655 5.550 1.00 0.00 C ATOM 1291 C GLU A 85 -9.513 -6.196 4.534 1.00 0.00 C ATOM 1292 O GLU A 85 -8.730 -6.990 4.010 1.00 0.00 O ATOM 1293 CB GLU A 85 -11.853 -7.007 4.849 1.00 0.00 C ATOM 1294 CG GLU A 85 -11.761 -8.220 3.943 1.00 0.00 C ATOM 1295 CD GLU A 85 -13.113 -8.649 3.424 1.00 0.00 C ATOM 1296 OE1 GLU A 85 -13.604 -8.038 2.454 1.00 0.00 O ATOM 1297 OE2 GLU A 85 -13.695 -9.599 3.986 1.00 0.00 O ATOM 0 H GLU A 85 -11.571 -4.998 6.318 1.00 0.00 H new ATOM 0 HA GLU A 85 -10.165 -7.541 6.057 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.620 -7.186 5.602 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -12.179 -6.150 4.259 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -11.106 -7.994 3.102 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -11.305 -9.046 4.489 1.00 0.00 H new ATOM 1304 N TYR A 86 -9.524 -4.907 4.253 1.00 0.00 N ATOM 1305 CA TYR A 86 -8.584 -4.327 3.308 1.00 0.00 C ATOM 1306 C TYR A 86 -7.605 -3.411 4.030 1.00 0.00 C ATOM 1307 O TYR A 86 -7.979 -2.330 4.495 1.00 0.00 O ATOM 1308 CB TYR A 86 -9.335 -3.540 2.232 1.00 0.00 C ATOM 1309 CG TYR A 86 -10.504 -4.287 1.623 1.00 0.00 C ATOM 1310 CD1 TYR A 86 -10.385 -5.612 1.235 1.00 0.00 C ATOM 1311 CD2 TYR A 86 -11.726 -3.662 1.439 1.00 0.00 C ATOM 1312 CE1 TYR A 86 -11.450 -6.293 0.680 1.00 0.00 C ATOM 1313 CE2 TYR A 86 -12.796 -4.336 0.884 1.00 0.00 C ATOM 1314 CZ TYR A 86 -12.654 -5.651 0.509 1.00 0.00 C ATOM 1315 OH TYR A 86 -13.718 -6.329 -0.039 1.00 0.00 O ATOM 0 H TYR A 86 -10.175 -4.239 4.666 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.027 -5.135 2.834 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -9.699 -2.609 2.666 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -8.637 -3.271 1.439 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -9.442 -6.121 1.369 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -11.844 -2.630 1.735 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -11.338 -7.325 0.382 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -13.741 -3.832 0.745 1.00 0.00 H new ATOM 0 HH TYR A 86 -13.982 -7.061 0.557 1.00 0.00 H new ATOM 1325 N LEU A 87 -6.360 -3.844 4.136 1.00 0.00 N ATOM 1326 CA LEU A 87 -5.338 -3.058 4.817 1.00 0.00 C ATOM 1327 C LEU A 87 -4.423 -2.375 3.815 1.00 0.00 C ATOM 1328 O LEU A 87 -3.923 -3.003 2.880 1.00 0.00 O ATOM 1329 CB LEU A 87 -4.500 -3.926 5.768 1.00 0.00 C ATOM 1330 CG LEU A 87 -5.167 -4.317 7.093 1.00 0.00 C ATOM 1331 CD1 LEU A 87 -5.697 -3.085 7.813 1.00 0.00 C ATOM 1332 CD2 LEU A 87 -6.278 -5.331 6.868 1.00 0.00 C ATOM 0 H LEU A 87 -6.030 -4.733 3.761 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.856 -2.300 5.405 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.221 -4.839 5.242 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.576 -3.393 5.994 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.411 -4.783 7.725 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -6.166 -3.385 8.750 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -4.873 -2.403 8.022 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.432 -2.584 7.183 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -6.733 -5.590 7.824 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -7.034 -4.902 6.210 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.864 -6.228 6.408 1.00 0.00 H new ATOM 1344 N ALA A 88 -4.213 -1.086 4.016 1.00 0.00 N ATOM 1345 CA ALA A 88 -3.292 -0.319 3.201 1.00 0.00 C ATOM 1346 C ALA A 88 -2.192 0.255 4.080 1.00 0.00 C ATOM 1347 O ALA A 88 -2.461 1.058 4.973 1.00 0.00 O ATOM 1348 CB ALA A 88 -4.034 0.782 2.468 1.00 0.00 C ATOM 0 H ALA A 88 -4.675 -0.544 4.747 1.00 0.00 H new ATOM 0 HA ALA A 88 -2.837 -0.971 2.455 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.332 1.351 1.859 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.797 0.342 1.826 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.508 1.446 3.191 1.00 0.00 H new ATOM 1354 N VAL A 89 -0.958 -0.168 3.845 1.00 0.00 N ATOM 1355 CA VAL A 89 0.148 0.215 4.712 1.00 0.00 C ATOM 1356 C VAL A 89 1.170 1.068 3.970 1.00 0.00 C ATOM 1357 O VAL A 89 1.720 0.650 2.949 1.00 0.00 O ATOM 1358 CB VAL A 89 0.858 -1.022 5.305 1.00 0.00 C ATOM 1359 CG1 VAL A 89 1.944 -0.602 6.286 1.00 0.00 C ATOM 1360 CG2 VAL A 89 -0.143 -1.943 5.983 1.00 0.00 C ATOM 0 H VAL A 89 -0.698 -0.773 3.066 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.283 0.801 5.524 1.00 0.00 H new ATOM 0 HB VAL A 89 1.327 -1.567 4.486 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.431 -1.489 6.691 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.682 0.013 5.771 1.00 0.00 H new ATOM 0 HG13 VAL A 89 1.498 -0.029 7.099 1.00 0.00 H new ATOM 0 HG21 VAL A 89 0.378 -2.808 6.394 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -0.645 -1.406 6.788 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -0.882 -2.277 5.254 1.00 0.00 H new ATOM 1370 N ASP A 90 1.414 2.257 4.492 1.00 0.00 N ATOM 1371 CA ASP A 90 2.406 3.163 3.928 1.00 0.00 C ATOM 1372 C ASP A 90 3.709 3.062 4.703 1.00 0.00 C ATOM 1373 O ASP A 90 3.711 3.180 5.930 1.00 0.00 O ATOM 1374 CB ASP A 90 1.903 4.609 3.972 1.00 0.00 C ATOM 1375 CG ASP A 90 2.876 5.593 3.352 1.00 0.00 C ATOM 1376 OD1 ASP A 90 2.830 5.777 2.117 1.00 0.00 O ATOM 1377 OD2 ASP A 90 3.672 6.199 4.100 1.00 0.00 O ATOM 0 H ASP A 90 0.934 2.623 5.314 1.00 0.00 H new ATOM 0 HA ASP A 90 2.576 2.876 2.890 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.948 4.672 3.450 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.719 4.893 5.008 1.00 0.00 H new ATOM 1382 N GLN A 91 4.805 2.821 3.984 1.00 0.00 N ATOM 1383 CA GLN A 91 6.136 2.781 4.585 1.00 0.00 C ATOM 1384 C GLN A 91 6.231 1.721 5.682 1.00 0.00 C ATOM 1385 O GLN A 91 6.679 1.999 6.795 1.00 0.00 O ATOM 1386 CB GLN A 91 6.505 4.167 5.126 1.00 0.00 C ATOM 1387 CG GLN A 91 6.801 5.170 4.024 1.00 0.00 C ATOM 1388 CD GLN A 91 7.061 6.565 4.550 1.00 0.00 C ATOM 1389 OE1 GLN A 91 8.200 6.928 4.844 1.00 0.00 O ATOM 1390 NE2 GLN A 91 6.010 7.357 4.666 1.00 0.00 N ATOM 0 H GLN A 91 4.796 2.650 2.979 1.00 0.00 H new ATOM 0 HA GLN A 91 6.850 2.501 3.811 1.00 0.00 H new ATOM 0 HB2 GLN A 91 5.687 4.541 5.741 1.00 0.00 H new ATOM 0 HB3 GLN A 91 7.377 4.079 5.774 1.00 0.00 H new ATOM 0 HG2 GLN A 91 7.669 4.833 3.457 1.00 0.00 H new ATOM 0 HG3 GLN A 91 5.960 5.199 3.331 1.00 0.00 H new ATOM 0 HE21 GLN A 91 5.083 7.015 4.411 1.00 0.00 H new ATOM 0 HE22 GLN A 91 6.125 8.310 5.011 1.00 0.00 H new ATOM 1399 N VAL A 92 5.844 0.493 5.333 1.00 0.00 N ATOM 1400 CA VAL A 92 5.840 -0.634 6.271 1.00 0.00 C ATOM 1401 C VAL A 92 7.237 -0.889 6.856 1.00 0.00 C ATOM 1402 O VAL A 92 7.382 -1.468 7.934 1.00 0.00 O ATOM 1403 CB VAL A 92 5.312 -1.919 5.576 1.00 0.00 C ATOM 1404 CG1 VAL A 92 6.220 -2.334 4.425 1.00 0.00 C ATOM 1405 CG2 VAL A 92 5.146 -3.057 6.572 1.00 0.00 C ATOM 0 H VAL A 92 5.525 0.251 4.395 1.00 0.00 H new ATOM 0 HA VAL A 92 5.174 -0.373 7.093 1.00 0.00 H new ATOM 0 HB VAL A 92 4.329 -1.689 5.164 1.00 0.00 H new ATOM 0 HG11 VAL A 92 5.826 -3.236 3.957 1.00 0.00 H new ATOM 0 HG12 VAL A 92 6.263 -1.532 3.688 1.00 0.00 H new ATOM 0 HG13 VAL A 92 7.222 -2.531 4.805 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.775 -3.942 6.055 1.00 0.00 H new ATOM 0 HG22 VAL A 92 6.109 -3.282 7.031 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.435 -2.764 7.344 1.00 0.00 H new ATOM 1415 N GLU A 93 8.256 -0.425 6.146 1.00 0.00 N ATOM 1416 CA GLU A 93 9.640 -0.583 6.572 1.00 0.00 C ATOM 1417 C GLU A 93 9.924 0.207 7.853 1.00 0.00 C ATOM 1418 O GLU A 93 10.798 -0.160 8.635 1.00 0.00 O ATOM 1419 CB GLU A 93 10.573 -0.133 5.436 1.00 0.00 C ATOM 1420 CG GLU A 93 12.055 -0.155 5.783 1.00 0.00 C ATOM 1421 CD GLU A 93 12.614 1.234 6.029 1.00 0.00 C ATOM 1422 OE1 GLU A 93 12.578 2.060 5.097 1.00 0.00 O ATOM 1423 OE2 GLU A 93 13.100 1.500 7.148 1.00 0.00 O ATOM 0 H GLU A 93 8.147 0.070 5.261 1.00 0.00 H new ATOM 0 HA GLU A 93 9.821 -1.634 6.796 1.00 0.00 H new ATOM 0 HB2 GLU A 93 10.407 -0.776 4.572 1.00 0.00 H new ATOM 0 HB3 GLU A 93 10.299 0.879 5.138 1.00 0.00 H new ATOM 0 HG2 GLU A 93 12.208 -0.767 6.672 1.00 0.00 H new ATOM 0 HG3 GLU A 93 12.608 -0.627 4.971 1.00 0.00 H new ATOM 1430 N LYS A 94 9.156 1.266 8.087 1.00 0.00 N ATOM 1431 CA LYS A 94 9.439 2.172 9.192 1.00 0.00 C ATOM 1432 C LYS A 94 8.853 1.653 10.505 1.00 0.00 C ATOM 1433 O LYS A 94 9.029 2.270 11.558 1.00 0.00 O ATOM 1434 CB LYS A 94 8.892 3.570 8.901 1.00 0.00 C ATOM 1435 CG LYS A 94 9.228 4.090 7.510 1.00 0.00 C ATOM 1436 CD LYS A 94 10.654 3.760 7.095 1.00 0.00 C ATOM 1437 CE LYS A 94 11.696 4.487 7.925 1.00 0.00 C ATOM 1438 NZ LYS A 94 13.070 4.190 7.436 1.00 0.00 N ATOM 0 H LYS A 94 8.339 1.516 7.530 1.00 0.00 H new ATOM 0 HA LYS A 94 10.523 2.227 9.296 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.809 3.557 9.021 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.287 4.265 9.642 1.00 0.00 H new ATOM 0 HG2 LYS A 94 8.534 3.661 6.787 1.00 0.00 H new ATOM 0 HG3 LYS A 94 9.086 5.170 7.485 1.00 0.00 H new ATOM 0 HD2 LYS A 94 10.813 2.685 7.183 1.00 0.00 H new ATOM 0 HD3 LYS A 94 10.790 4.017 6.045 1.00 0.00 H new ATOM 0 HE2 LYS A 94 11.515 5.561 7.882 1.00 0.00 H new ATOM 0 HE3 LYS A 94 11.606 4.190 8.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 13.749 4.823 7.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 13.310 3.202 7.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 13.112 4.337 6.407 1.00 0.00 H new ATOM 1452 N LEU A 95 8.160 0.520 10.439 1.00 0.00 N ATOM 1453 CA LEU A 95 7.509 -0.050 11.612 1.00 0.00 C ATOM 1454 C LEU A 95 8.535 -0.631 12.584 1.00 0.00 C ATOM 1455 O LEU A 95 9.583 -1.135 12.173 1.00 0.00 O ATOM 1456 CB LEU A 95 6.512 -1.131 11.193 1.00 0.00 C ATOM 1457 CG LEU A 95 5.354 -0.648 10.314 1.00 0.00 C ATOM 1458 CD1 LEU A 95 4.451 -1.808 9.926 1.00 0.00 C ATOM 1459 CD2 LEU A 95 4.555 0.431 11.029 1.00 0.00 C ATOM 0 H LEU A 95 8.035 -0.022 9.584 1.00 0.00 H new ATOM 0 HA LEU A 95 6.973 0.751 12.121 1.00 0.00 H new ATOM 0 HB2 LEU A 95 7.052 -1.912 10.657 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.098 -1.588 12.092 1.00 0.00 H new ATOM 0 HG LEU A 95 5.774 -0.222 9.403 1.00 0.00 H new ATOM 0 HD11 LEU A 95 3.636 -1.442 9.302 1.00 0.00 H new ATOM 0 HD12 LEU A 95 5.028 -2.548 9.372 1.00 0.00 H new ATOM 0 HD13 LEU A 95 4.041 -2.267 10.826 1.00 0.00 H new ATOM 0 HD21 LEU A 95 3.737 0.762 10.389 1.00 0.00 H new ATOM 0 HD22 LEU A 95 4.150 0.029 11.958 1.00 0.00 H new ATOM 0 HD23 LEU A 95 5.205 1.277 11.253 1.00 0.00 H new ATOM 1471 N GLY A 96 8.223 -0.572 13.872 1.00 0.00 N ATOM 1472 CA GLY A 96 9.165 -1.001 14.887 1.00 0.00 C ATOM 1473 C GLY A 96 8.869 -2.385 15.432 1.00 0.00 C ATOM 1474 O GLY A 96 8.449 -2.523 16.581 1.00 0.00 O ATOM 0 H GLY A 96 7.331 -0.233 14.233 1.00 0.00 H new ATOM 0 HA2 GLY A 96 10.171 -0.991 14.467 1.00 0.00 H new ATOM 0 HA3 GLY A 96 9.155 -0.285 15.708 1.00 0.00 H new ATOM 1478 N ASN A 97 9.085 -3.404 14.597 1.00 0.00 N ATOM 1479 CA ASN A 97 8.942 -4.816 14.993 1.00 0.00 C ATOM 1480 C ASN A 97 7.484 -5.208 15.247 1.00 0.00 C ATOM 1481 O ASN A 97 6.929 -6.033 14.531 1.00 0.00 O ATOM 1482 CB ASN A 97 9.796 -5.137 16.231 1.00 0.00 C ATOM 1483 CG ASN A 97 9.582 -6.556 16.741 1.00 0.00 C ATOM 1484 OD1 ASN A 97 10.234 -7.496 16.292 1.00 0.00 O ATOM 1485 ND2 ASN A 97 8.682 -6.717 17.701 1.00 0.00 N ATOM 0 H ASN A 97 9.365 -3.278 13.624 1.00 0.00 H new ATOM 0 HA ASN A 97 9.302 -5.408 14.151 1.00 0.00 H new ATOM 0 HB2 ASN A 97 10.849 -4.998 15.987 1.00 0.00 H new ATOM 0 HB3 ASN A 97 9.557 -4.430 17.025 1.00 0.00 H new ATOM 0 HD21 ASN A 97 8.513 -7.644 18.091 1.00 0.00 H new ATOM 0 HD22 ASN A 97 8.159 -5.914 18.050 1.00 0.00 H new ATOM 1492 N GLU A 98 6.867 -4.601 16.252 1.00 0.00 N ATOM 1493 CA GLU A 98 5.545 -5.012 16.709 1.00 0.00 C ATOM 1494 C GLU A 98 4.499 -4.858 15.607 1.00 0.00 C ATOM 1495 O GLU A 98 3.756 -5.795 15.312 1.00 0.00 O ATOM 1496 CB GLU A 98 5.150 -4.200 17.943 1.00 0.00 C ATOM 1497 CG GLU A 98 3.869 -4.674 18.607 1.00 0.00 C ATOM 1498 CD GLU A 98 3.573 -3.926 19.889 1.00 0.00 C ATOM 1499 OE1 GLU A 98 4.167 -4.268 20.934 1.00 0.00 O ATOM 1500 OE2 GLU A 98 2.746 -2.990 19.860 1.00 0.00 O ATOM 0 H GLU A 98 7.264 -3.817 16.770 1.00 0.00 H new ATOM 0 HA GLU A 98 5.587 -6.069 16.973 1.00 0.00 H new ATOM 0 HB2 GLU A 98 5.962 -4.243 18.669 1.00 0.00 H new ATOM 0 HB3 GLU A 98 5.034 -3.155 17.656 1.00 0.00 H new ATOM 0 HG2 GLU A 98 3.036 -4.548 17.915 1.00 0.00 H new ATOM 0 HG3 GLU A 98 3.947 -5.740 18.821 1.00 0.00 H new ATOM 1507 N GLU A 99 4.457 -3.682 14.993 1.00 0.00 N ATOM 1508 CA GLU A 99 3.490 -3.402 13.935 1.00 0.00 C ATOM 1509 C GLU A 99 3.656 -4.364 12.760 1.00 0.00 C ATOM 1510 O GLU A 99 2.673 -4.865 12.217 1.00 0.00 O ATOM 1511 CB GLU A 99 3.613 -1.962 13.425 1.00 0.00 C ATOM 1512 CG GLU A 99 3.569 -0.895 14.508 1.00 0.00 C ATOM 1513 CD GLU A 99 4.913 -0.676 15.166 1.00 0.00 C ATOM 1514 OE1 GLU A 99 5.699 0.151 14.657 1.00 0.00 O ATOM 1515 OE2 GLU A 99 5.197 -1.342 16.181 1.00 0.00 O ATOM 0 H GLU A 99 5.082 -2.905 15.209 1.00 0.00 H new ATOM 0 HA GLU A 99 2.502 -3.539 14.373 1.00 0.00 H new ATOM 0 HB2 GLU A 99 4.550 -1.865 12.877 1.00 0.00 H new ATOM 0 HB3 GLU A 99 2.807 -1.773 12.716 1.00 0.00 H new ATOM 0 HG2 GLU A 99 3.224 0.044 14.074 1.00 0.00 H new ATOM 0 HG3 GLU A 99 2.840 -1.182 15.266 1.00 0.00 H new ATOM 1522 N GLN A 100 4.899 -4.628 12.366 1.00 0.00 N ATOM 1523 CA GLN A 100 5.152 -5.487 11.214 1.00 0.00 C ATOM 1524 C GLN A 100 4.923 -6.955 11.564 1.00 0.00 C ATOM 1525 O GLN A 100 4.604 -7.764 10.695 1.00 0.00 O ATOM 1526 CB GLN A 100 6.565 -5.266 10.660 1.00 0.00 C ATOM 1527 CG GLN A 100 7.681 -5.623 11.627 1.00 0.00 C ATOM 1528 CD GLN A 100 9.060 -5.289 11.088 1.00 0.00 C ATOM 1529 OE1 GLN A 100 9.149 -4.242 10.279 1.00 0.00 O flip ATOM 1530 NE2 GLN A 100 10.039 -5.961 11.405 1.00 0.00 N flip ATOM 0 H GLN A 100 5.737 -4.265 12.821 1.00 0.00 H new ATOM 0 HA GLN A 100 4.442 -5.215 10.433 1.00 0.00 H new ATOM 0 HB2 GLN A 100 6.683 -5.859 9.753 1.00 0.00 H new ATOM 0 HB3 GLN A 100 6.670 -4.220 10.373 1.00 0.00 H new ATOM 0 HG2 GLN A 100 7.525 -5.092 12.566 1.00 0.00 H new ATOM 0 HG3 GLN A 100 7.633 -6.688 11.852 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.929 -6.759 12.030 1.00 0.00 H new ATOM 0 HE22 GLN A 100 10.962 -5.720 11.043 1.00 0.00 H new ATOM 1539 N ALA A 101 5.069 -7.291 12.841 1.00 0.00 N ATOM 1540 CA ALA A 101 4.745 -8.629 13.315 1.00 0.00 C ATOM 1541 C ALA A 101 3.239 -8.841 13.258 1.00 0.00 C ATOM 1542 O ALA A 101 2.757 -9.924 12.917 1.00 0.00 O ATOM 1543 CB ALA A 101 5.265 -8.842 14.730 1.00 0.00 C ATOM 0 H ALA A 101 5.409 -6.656 13.564 1.00 0.00 H new ATOM 0 HA ALA A 101 5.231 -9.360 12.668 1.00 0.00 H new ATOM 0 HB1 ALA A 101 5.011 -9.848 15.063 1.00 0.00 H new ATOM 0 HB2 ALA A 101 6.348 -8.718 14.742 1.00 0.00 H new ATOM 0 HB3 ALA A 101 4.809 -8.112 15.399 1.00 0.00 H new ATOM 1549 N LEU A 102 2.503 -7.786 13.591 1.00 0.00 N ATOM 1550 CA LEU A 102 1.050 -7.782 13.484 1.00 0.00 C ATOM 1551 C LEU A 102 0.654 -7.934 12.015 1.00 0.00 C ATOM 1552 O LEU A 102 -0.201 -8.750 11.669 1.00 0.00 O ATOM 1553 CB LEU A 102 0.506 -6.468 14.068 1.00 0.00 C ATOM 1554 CG LEU A 102 -0.936 -6.489 14.588 1.00 0.00 C ATOM 1555 CD1 LEU A 102 -1.935 -6.681 13.460 1.00 0.00 C ATOM 1556 CD2 LEU A 102 -1.111 -7.573 15.639 1.00 0.00 C ATOM 0 H LEU A 102 2.896 -6.913 13.942 1.00 0.00 H new ATOM 0 HA LEU A 102 0.625 -8.614 14.045 1.00 0.00 H new ATOM 0 HB2 LEU A 102 1.158 -6.164 14.887 1.00 0.00 H new ATOM 0 HB3 LEU A 102 0.579 -5.698 13.300 1.00 0.00 H new ATOM 0 HG LEU A 102 -1.133 -5.520 15.046 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -2.946 -6.691 13.867 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.839 -5.863 12.746 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -1.738 -7.627 12.956 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -2.141 -7.571 15.995 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -0.880 -8.544 15.202 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -0.438 -7.382 16.475 1.00 0.00 H new ATOM 1568 N LEU A 103 1.308 -7.147 11.163 1.00 0.00 N ATOM 1569 CA LEU A 103 1.101 -7.209 9.718 1.00 0.00 C ATOM 1570 C LEU A 103 1.316 -8.633 9.212 1.00 0.00 C ATOM 1571 O LEU A 103 0.524 -9.138 8.416 1.00 0.00 O ATOM 1572 CB LEU A 103 2.054 -6.220 9.015 1.00 0.00 C ATOM 1573 CG LEU A 103 1.882 -6.048 7.492 1.00 0.00 C ATOM 1574 CD1 LEU A 103 2.557 -7.175 6.722 1.00 0.00 C ATOM 1575 CD2 LEU A 103 0.408 -5.956 7.114 1.00 0.00 C ATOM 0 H LEU A 103 1.994 -6.451 11.454 1.00 0.00 H new ATOM 0 HA LEU A 103 0.074 -6.924 9.488 1.00 0.00 H new ATOM 0 HB2 LEU A 103 1.934 -5.243 9.482 1.00 0.00 H new ATOM 0 HB3 LEU A 103 3.078 -6.541 9.207 1.00 0.00 H new ATOM 0 HG LEU A 103 2.369 -5.113 7.216 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.415 -7.021 5.652 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.623 -7.183 6.949 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.117 -8.129 7.013 1.00 0.00 H new ATOM 0 HD21 LEU A 103 0.316 -5.835 6.035 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.104 -6.868 7.422 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.043 -5.099 7.615 1.00 0.00 H new ATOM 1587 N PHE A 104 2.386 -9.269 9.683 1.00 0.00 N ATOM 1588 CA PHE A 104 2.682 -10.655 9.328 1.00 0.00 C ATOM 1589 C PHE A 104 1.473 -11.550 9.582 1.00 0.00 C ATOM 1590 O PHE A 104 1.104 -12.363 8.736 1.00 0.00 O ATOM 1591 CB PHE A 104 3.880 -11.170 10.133 1.00 0.00 C ATOM 1592 CG PHE A 104 4.251 -12.596 9.827 1.00 0.00 C ATOM 1593 CD1 PHE A 104 5.091 -12.897 8.767 1.00 0.00 C ATOM 1594 CD2 PHE A 104 3.756 -13.638 10.599 1.00 0.00 C ATOM 1595 CE1 PHE A 104 5.429 -14.204 8.483 1.00 0.00 C ATOM 1596 CE2 PHE A 104 4.092 -14.948 10.318 1.00 0.00 C ATOM 1597 CZ PHE A 104 4.930 -15.231 9.257 1.00 0.00 C ATOM 0 H PHE A 104 3.065 -8.844 10.314 1.00 0.00 H new ATOM 0 HA PHE A 104 2.924 -10.684 8.266 1.00 0.00 H new ATOM 0 HB2 PHE A 104 4.740 -10.530 9.935 1.00 0.00 H new ATOM 0 HB3 PHE A 104 3.656 -11.083 11.196 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.486 -12.099 8.156 1.00 0.00 H new ATOM 0 HD2 PHE A 104 3.100 -13.422 11.429 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.085 -14.423 7.654 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.700 -15.749 10.927 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.194 -16.254 9.034 1.00 0.00 H new ATOM 1607 N SER A 105 0.863 -11.386 10.746 1.00 0.00 N ATOM 1608 CA SER A 105 -0.292 -12.185 11.124 1.00 0.00 C ATOM 1609 C SER A 105 -1.457 -11.930 10.169 1.00 0.00 C ATOM 1610 O SER A 105 -2.104 -12.871 9.703 1.00 0.00 O ATOM 1611 CB SER A 105 -0.697 -11.875 12.571 1.00 0.00 C ATOM 1612 OG SER A 105 -1.654 -12.804 13.051 1.00 0.00 O ATOM 0 H SER A 105 1.150 -10.704 11.448 1.00 0.00 H new ATOM 0 HA SER A 105 -0.025 -13.240 11.057 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.186 -11.897 13.210 1.00 0.00 H new ATOM 0 HB3 SER A 105 -1.107 -10.866 12.628 1.00 0.00 H new ATOM 0 HG SER A 105 -1.891 -12.581 13.975 1.00 0.00 H new ATOM 1618 N ILE A 106 -1.700 -10.658 9.867 1.00 0.00 N ATOM 1619 CA ILE A 106 -2.752 -10.277 8.929 1.00 0.00 C ATOM 1620 C ILE A 106 -2.508 -10.917 7.566 1.00 0.00 C ATOM 1621 O ILE A 106 -3.384 -11.582 7.007 1.00 0.00 O ATOM 1622 CB ILE A 106 -2.825 -8.744 8.744 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -3.062 -8.045 10.082 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -3.924 -8.377 7.754 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -3.112 -6.536 9.977 1.00 0.00 C ATOM 0 H ILE A 106 -1.182 -9.872 10.259 1.00 0.00 H new ATOM 0 HA ILE A 106 -3.695 -10.629 9.348 1.00 0.00 H new ATOM 0 HB ILE A 106 -1.869 -8.406 8.345 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -3.999 -8.402 10.508 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -2.269 -8.327 10.775 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -3.961 -7.294 7.636 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -3.714 -8.840 6.790 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -4.884 -8.734 8.127 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -3.283 -6.108 10.965 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -2.166 -6.167 9.581 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -3.923 -6.244 9.310 1.00 0.00 H new ATOM 1637 N PHE A 107 -1.295 -10.735 7.064 1.00 0.00 N ATOM 1638 CA PHE A 107 -0.925 -11.193 5.732 1.00 0.00 C ATOM 1639 C PHE A 107 -1.019 -12.714 5.642 1.00 0.00 C ATOM 1640 O PHE A 107 -1.517 -13.264 4.658 1.00 0.00 O ATOM 1641 CB PHE A 107 0.503 -10.739 5.410 1.00 0.00 C ATOM 1642 CG PHE A 107 0.751 -10.469 3.953 1.00 0.00 C ATOM 1643 CD1 PHE A 107 0.983 -11.506 3.064 1.00 0.00 C ATOM 1644 CD2 PHE A 107 0.767 -9.170 3.477 1.00 0.00 C ATOM 1645 CE1 PHE A 107 1.224 -11.251 1.728 1.00 0.00 C ATOM 1646 CE2 PHE A 107 1.004 -8.906 2.142 1.00 0.00 C ATOM 1647 CZ PHE A 107 1.234 -9.947 1.266 1.00 0.00 C ATOM 0 H PHE A 107 -0.541 -10.267 7.567 1.00 0.00 H new ATOM 0 HA PHE A 107 -1.616 -10.761 5.008 1.00 0.00 H new ATOM 0 HB2 PHE A 107 0.721 -9.834 5.978 1.00 0.00 H new ATOM 0 HB3 PHE A 107 1.201 -11.504 5.750 1.00 0.00 H new ATOM 0 HD1 PHE A 107 0.975 -12.526 3.420 1.00 0.00 H new ATOM 0 HD2 PHE A 107 0.592 -8.351 4.159 1.00 0.00 H new ATOM 0 HE1 PHE A 107 1.404 -12.068 1.045 1.00 0.00 H new ATOM 0 HE2 PHE A 107 1.009 -7.887 1.785 1.00 0.00 H new ATOM 0 HZ PHE A 107 1.421 -9.744 0.222 1.00 0.00 H new ATOM 1657 N ASN A 108 -0.548 -13.384 6.685 1.00 0.00 N ATOM 1658 CA ASN A 108 -0.541 -14.840 6.729 1.00 0.00 C ATOM 1659 C ASN A 108 -1.961 -15.398 6.697 1.00 0.00 C ATOM 1660 O ASN A 108 -2.281 -16.271 5.888 1.00 0.00 O ATOM 1661 CB ASN A 108 0.180 -15.324 7.991 1.00 0.00 C ATOM 1662 CG ASN A 108 0.288 -16.837 8.063 1.00 0.00 C ATOM 1663 OD1 ASN A 108 0.404 -17.513 7.042 1.00 0.00 O ATOM 1664 ND2 ASN A 108 0.249 -17.379 9.270 1.00 0.00 N ATOM 0 H ASN A 108 -0.163 -12.938 7.518 1.00 0.00 H new ATOM 0 HA ASN A 108 -0.011 -15.202 5.848 1.00 0.00 H new ATOM 0 HB2 ASN A 108 1.180 -14.891 8.021 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -0.352 -14.960 8.870 1.00 0.00 H new ATOM 0 HD21 ASN A 108 0.316 -18.391 9.377 1.00 0.00 H new ATOM 0 HD22 ASN A 108 0.152 -16.784 10.093 1.00 0.00 H new ATOM 1671 N ARG A 109 -2.817 -14.873 7.567 1.00 0.00 N ATOM 1672 CA ARG A 109 -4.183 -15.374 7.693 1.00 0.00 C ATOM 1673 C ARG A 109 -5.001 -15.102 6.438 1.00 0.00 C ATOM 1674 O ARG A 109 -5.832 -15.922 6.049 1.00 0.00 O ATOM 1675 CB ARG A 109 -4.879 -14.762 8.907 1.00 0.00 C ATOM 1676 CG ARG A 109 -4.290 -15.201 10.233 1.00 0.00 C ATOM 1677 CD ARG A 109 -5.095 -14.657 11.399 1.00 0.00 C ATOM 1678 NE ARG A 109 -4.535 -15.059 12.688 1.00 0.00 N ATOM 1679 CZ ARG A 109 -5.149 -14.875 13.855 1.00 0.00 C ATOM 1680 NH1 ARG A 109 -6.350 -14.308 13.892 1.00 0.00 N ATOM 1681 NH2 ARG A 109 -4.567 -15.263 14.983 1.00 0.00 N ATOM 0 H ARG A 109 -2.591 -14.102 8.195 1.00 0.00 H new ATOM 0 HA ARG A 109 -4.116 -16.453 7.828 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -4.824 -13.676 8.837 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -5.935 -15.030 8.882 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -4.266 -16.290 10.281 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -3.259 -14.856 10.308 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -5.126 -13.569 11.341 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -6.124 -15.010 11.325 1.00 0.00 H new ATOM 0 HE ARG A 109 -3.619 -15.507 12.694 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -6.802 -14.014 13.026 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -6.820 -14.167 14.786 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -3.647 -15.703 14.957 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -5.039 -15.121 15.876 1.00 0.00 H new ATOM 1695 N PHE A 110 -4.766 -13.959 5.802 1.00 0.00 N ATOM 1696 CA PHE A 110 -5.491 -13.602 4.585 1.00 0.00 C ATOM 1697 C PHE A 110 -5.229 -14.613 3.474 1.00 0.00 C ATOM 1698 O PHE A 110 -6.164 -15.149 2.876 1.00 0.00 O ATOM 1699 CB PHE A 110 -5.113 -12.190 4.119 1.00 0.00 C ATOM 1700 CG PHE A 110 -5.826 -11.092 4.860 1.00 0.00 C ATOM 1701 CD1 PHE A 110 -6.696 -11.383 5.900 1.00 0.00 C ATOM 1702 CD2 PHE A 110 -5.630 -9.766 4.509 1.00 0.00 C ATOM 1703 CE1 PHE A 110 -7.358 -10.374 6.573 1.00 0.00 C ATOM 1704 CE2 PHE A 110 -6.290 -8.753 5.180 1.00 0.00 C ATOM 1705 CZ PHE A 110 -7.154 -9.056 6.213 1.00 0.00 C ATOM 0 H PHE A 110 -4.082 -13.266 6.106 1.00 0.00 H new ATOM 0 HA PHE A 110 -6.556 -13.617 4.817 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -4.038 -12.055 4.236 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -5.332 -12.098 3.055 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -6.858 -12.411 6.188 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -4.955 -9.521 3.703 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -8.034 -10.616 7.380 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -6.129 -7.724 4.896 1.00 0.00 H new ATOM 0 HZ PHE A 110 -7.669 -8.265 6.738 1.00 0.00 H new ATOM 1715 N ARG A 111 -3.959 -14.901 3.221 1.00 0.00 N ATOM 1716 CA ARG A 111 -3.595 -15.827 2.157 1.00 0.00 C ATOM 1717 C ARG A 111 -4.047 -17.250 2.501 1.00 0.00 C ATOM 1718 O ARG A 111 -4.326 -18.056 1.613 1.00 0.00 O ATOM 1719 CB ARG A 111 -2.085 -15.793 1.901 1.00 0.00 C ATOM 1720 CG ARG A 111 -1.718 -15.703 0.426 1.00 0.00 C ATOM 1721 CD ARG A 111 -2.200 -16.920 -0.350 1.00 0.00 C ATOM 1722 NE ARG A 111 -2.153 -16.711 -1.796 1.00 0.00 N ATOM 1723 CZ ARG A 111 -2.771 -17.494 -2.678 1.00 0.00 C ATOM 1724 NH1 ARG A 111 -3.400 -18.593 -2.270 1.00 0.00 N ATOM 1725 NH2 ARG A 111 -2.725 -17.191 -3.968 1.00 0.00 N ATOM 0 H ARG A 111 -3.169 -14.510 3.734 1.00 0.00 H new ATOM 0 HA ARG A 111 -4.105 -15.514 1.246 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -1.655 -14.940 2.426 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -1.633 -16.690 2.325 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -2.155 -14.801 -0.003 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -0.636 -15.612 0.325 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -1.585 -17.781 -0.090 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -3.222 -17.157 -0.052 1.00 0.00 H new ATOM 0 HE ARG A 111 -1.616 -15.920 -2.150 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -3.410 -18.837 -1.280 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -3.873 -19.191 -2.947 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -2.218 -16.362 -4.279 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -3.196 -17.787 -4.649 1.00 0.00 H new ATOM 1739 N ASN A 112 -4.127 -17.551 3.793 1.00 0.00 N ATOM 1740 CA ASN A 112 -4.589 -18.858 4.241 1.00 0.00 C ATOM 1741 C ASN A 112 -6.099 -18.983 4.090 1.00 0.00 C ATOM 1742 O ASN A 112 -6.598 -20.020 3.655 1.00 0.00 O ATOM 1743 CB ASN A 112 -4.179 -19.117 5.694 1.00 0.00 C ATOM 1744 CG ASN A 112 -2.810 -19.757 5.804 1.00 0.00 C ATOM 1745 OD1 ASN A 112 -2.680 -20.980 5.780 1.00 0.00 O ATOM 1746 ND2 ASN A 112 -1.780 -18.943 5.928 1.00 0.00 N ATOM 0 H ASN A 112 -3.878 -16.909 4.546 1.00 0.00 H new ATOM 0 HA ASN A 112 -4.115 -19.610 3.610 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -4.182 -18.175 6.243 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -4.918 -19.763 6.167 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -0.837 -19.323 6.008 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -1.927 -17.934 5.944 1.00 0.00 H new ATOM 1753 N SER A 113 -6.820 -17.922 4.438 1.00 0.00 N ATOM 1754 CA SER A 113 -8.273 -17.904 4.304 1.00 0.00 C ATOM 1755 C SER A 113 -8.676 -17.933 2.830 1.00 0.00 C ATOM 1756 O SER A 113 -9.599 -18.647 2.436 1.00 0.00 O ATOM 1757 CB SER A 113 -8.857 -16.660 4.980 1.00 0.00 C ATOM 1758 OG SER A 113 -8.510 -16.611 6.353 1.00 0.00 O ATOM 0 H SER A 113 -6.421 -17.062 4.815 1.00 0.00 H new ATOM 0 HA SER A 113 -8.672 -18.792 4.794 1.00 0.00 H new ATOM 0 HB2 SER A 113 -8.491 -15.765 4.478 1.00 0.00 H new ATOM 0 HB3 SER A 113 -9.942 -16.662 4.877 1.00 0.00 H new ATOM 0 HG SER A 113 -7.563 -16.375 6.443 1.00 0.00 H new ATOM 1764 N GLY A 114 -7.978 -17.148 2.024 1.00 0.00 N ATOM 1765 CA GLY A 114 -8.241 -17.121 0.602 1.00 0.00 C ATOM 1766 C GLY A 114 -8.557 -15.727 0.120 1.00 0.00 C ATOM 1767 O GLY A 114 -8.190 -15.346 -0.990 1.00 0.00 O ATOM 0 H GLY A 114 -7.230 -16.526 2.332 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -7.374 -17.504 0.064 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.076 -17.783 0.374 1.00 0.00 H new ATOM 1771 N LYS A 115 -9.226 -14.961 0.967 1.00 0.00 N ATOM 1772 CA LYS A 115 -9.612 -13.610 0.634 1.00 0.00 C ATOM 1773 C LYS A 115 -8.872 -12.634 1.541 1.00 0.00 C ATOM 1774 O LYS A 115 -8.194 -13.044 2.482 1.00 0.00 O ATOM 1775 CB LYS A 115 -11.135 -13.478 0.775 1.00 0.00 C ATOM 1776 CG LYS A 115 -11.712 -12.164 0.265 1.00 0.00 C ATOM 1777 CD LYS A 115 -13.189 -12.296 -0.079 1.00 0.00 C ATOM 1778 CE LYS A 115 -14.025 -12.741 1.113 1.00 0.00 C ATOM 1779 NZ LYS A 115 -14.149 -11.681 2.147 1.00 0.00 N ATOM 0 H LYS A 115 -9.513 -15.261 1.899 1.00 0.00 H new ATOM 0 HA LYS A 115 -9.343 -13.375 -0.396 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -11.608 -14.299 0.237 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -11.400 -13.591 1.826 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -11.582 -11.391 1.022 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -11.160 -11.842 -0.618 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -13.561 -11.339 -0.443 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -13.307 -13.014 -0.891 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -15.019 -13.027 0.769 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -13.574 -13.628 1.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -14.727 -12.033 2.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -13.204 -11.425 2.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -14.604 -10.843 1.732 1.00 0.00 H new ATOM 1793 N GLY A 116 -9.015 -11.355 1.267 1.00 0.00 N ATOM 1794 CA GLY A 116 -8.277 -10.352 2.001 1.00 0.00 C ATOM 1795 C GLY A 116 -7.392 -9.544 1.083 1.00 0.00 C ATOM 1796 O GLY A 116 -6.774 -10.090 0.165 1.00 0.00 O ATOM 0 H GLY A 116 -9.633 -10.987 0.544 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.973 -9.689 2.516 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -7.668 -10.833 2.767 1.00 0.00 H new ATOM 1800 N PHE A 117 -7.345 -8.244 1.305 1.00 0.00 N ATOM 1801 CA PHE A 117 -6.587 -7.354 0.443 1.00 0.00 C ATOM 1802 C PHE A 117 -5.526 -6.610 1.244 1.00 0.00 C ATOM 1803 O PHE A 117 -5.776 -6.175 2.371 1.00 0.00 O ATOM 1804 CB PHE A 117 -7.513 -6.346 -0.242 1.00 0.00 C ATOM 1805 CG PHE A 117 -8.393 -6.908 -1.335 1.00 0.00 C ATOM 1806 CD1 PHE A 117 -9.216 -8.001 -1.106 1.00 0.00 C ATOM 1807 CD2 PHE A 117 -8.407 -6.322 -2.592 1.00 0.00 C ATOM 1808 CE1 PHE A 117 -10.028 -8.500 -2.107 1.00 0.00 C ATOM 1809 CE2 PHE A 117 -9.217 -6.819 -3.596 1.00 0.00 C ATOM 1810 CZ PHE A 117 -10.029 -7.909 -3.352 1.00 0.00 C ATOM 0 H PHE A 117 -7.824 -7.779 2.076 1.00 0.00 H new ATOM 0 HA PHE A 117 -6.098 -7.960 -0.320 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -8.151 -5.892 0.516 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -6.903 -5.548 -0.665 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -9.222 -8.468 -0.132 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -7.777 -5.467 -2.789 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -10.662 -9.353 -1.914 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -9.215 -6.355 -4.571 1.00 0.00 H new ATOM 0 HZ PHE A 117 -10.663 -8.297 -4.135 1.00 0.00 H new ATOM 1820 N LEU A 118 -4.355 -6.460 0.651 1.00 0.00 N ATOM 1821 CA LEU A 118 -3.243 -5.782 1.294 1.00 0.00 C ATOM 1822 C LEU A 118 -2.521 -4.901 0.285 1.00 0.00 C ATOM 1823 O LEU A 118 -1.965 -5.390 -0.700 1.00 0.00 O ATOM 1824 CB LEU A 118 -2.254 -6.792 1.878 1.00 0.00 C ATOM 1825 CG LEU A 118 -1.912 -6.612 3.362 1.00 0.00 C ATOM 1826 CD1 LEU A 118 -1.379 -5.213 3.631 1.00 0.00 C ATOM 1827 CD2 LEU A 118 -3.125 -6.903 4.231 1.00 0.00 C ATOM 0 H LEU A 118 -4.148 -6.803 -0.287 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.640 -5.169 2.103 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.661 -7.793 1.738 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -1.329 -6.740 1.303 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.129 -7.326 3.618 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.144 -5.111 4.690 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -0.477 -5.048 3.042 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -2.133 -4.477 3.354 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -2.861 -6.770 5.280 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -3.932 -6.219 3.970 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -3.452 -7.930 4.067 1.00 0.00 H new ATOM 1839 N LEU A 119 -2.532 -3.609 0.536 1.00 0.00 N ATOM 1840 CA LEU A 119 -1.863 -2.656 -0.329 1.00 0.00 C ATOM 1841 C LEU A 119 -0.602 -2.145 0.353 1.00 0.00 C ATOM 1842 O LEU A 119 -0.669 -1.420 1.348 1.00 0.00 O ATOM 1843 CB LEU A 119 -2.800 -1.492 -0.675 1.00 0.00 C ATOM 1844 CG LEU A 119 -2.254 -0.493 -1.698 1.00 0.00 C ATOM 1845 CD1 LEU A 119 -1.945 -1.187 -3.016 1.00 0.00 C ATOM 1846 CD2 LEU A 119 -3.249 0.635 -1.917 1.00 0.00 C ATOM 0 H LEU A 119 -3.001 -3.190 1.339 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.586 -3.153 -1.259 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.736 -1.902 -1.056 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -3.038 -0.954 0.243 1.00 0.00 H new ATOM 0 HG LEU A 119 -1.328 -0.073 -1.306 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.558 -0.459 -3.729 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -1.200 -1.965 -2.852 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.856 -1.635 -3.413 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -2.847 1.338 -2.647 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -4.189 0.225 -2.287 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.426 1.153 -0.974 1.00 0.00 H new ATOM 1858 N LEU A 120 0.543 -2.543 -0.171 1.00 0.00 N ATOM 1859 CA LEU A 120 1.818 -2.191 0.431 1.00 0.00 C ATOM 1860 C LEU A 120 2.496 -1.069 -0.344 1.00 0.00 C ATOM 1861 O LEU A 120 2.887 -1.241 -1.502 1.00 0.00 O ATOM 1862 CB LEU A 120 2.734 -3.414 0.489 1.00 0.00 C ATOM 1863 CG LEU A 120 2.223 -4.573 1.347 1.00 0.00 C ATOM 1864 CD1 LEU A 120 3.131 -5.782 1.198 1.00 0.00 C ATOM 1865 CD2 LEU A 120 2.139 -4.153 2.808 1.00 0.00 C ATOM 0 H LEU A 120 0.617 -3.112 -1.014 1.00 0.00 H new ATOM 0 HA LEU A 120 1.627 -1.841 1.445 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.892 -3.777 -0.526 1.00 0.00 H new ATOM 0 HB3 LEU A 120 3.706 -3.102 0.871 1.00 0.00 H new ATOM 0 HG LEU A 120 1.224 -4.844 1.004 1.00 0.00 H new ATOM 0 HD11 LEU A 120 2.754 -6.598 1.814 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.151 -6.095 0.154 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.140 -5.521 1.518 1.00 0.00 H new ATOM 0 HD21 LEU A 120 1.774 -4.988 3.406 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.128 -3.860 3.160 1.00 0.00 H new ATOM 0 HD23 LEU A 120 1.455 -3.310 2.906 1.00 0.00 H new ATOM 1877 N GLY A 121 2.627 0.077 0.302 1.00 0.00 N ATOM 1878 CA GLY A 121 3.299 1.201 -0.309 1.00 0.00 C ATOM 1879 C GLY A 121 4.690 1.401 0.255 1.00 0.00 C ATOM 1880 O GLY A 121 4.850 1.714 1.434 1.00 0.00 O ATOM 0 H GLY A 121 2.277 0.249 1.245 1.00 0.00 H new ATOM 0 HA2 GLY A 121 3.363 1.044 -1.386 1.00 0.00 H new ATOM 0 HA3 GLY A 121 2.710 2.105 -0.153 1.00 0.00 H new ATOM 1884 N SER A 122 5.696 1.180 -0.574 1.00 0.00 N ATOM 1885 CA SER A 122 7.083 1.380 -0.180 1.00 0.00 C ATOM 1886 C SER A 122 7.919 1.713 -1.409 1.00 0.00 C ATOM 1887 O SER A 122 7.815 1.048 -2.434 1.00 0.00 O ATOM 1888 CB SER A 122 7.627 0.140 0.539 1.00 0.00 C ATOM 1889 OG SER A 122 6.908 -0.098 1.741 1.00 0.00 O ATOM 0 H SER A 122 5.577 0.858 -1.535 1.00 0.00 H new ATOM 0 HA SER A 122 7.139 2.215 0.518 1.00 0.00 H new ATOM 0 HB2 SER A 122 7.550 -0.729 -0.115 1.00 0.00 H new ATOM 0 HB3 SER A 122 8.685 0.278 0.763 1.00 0.00 H new ATOM 0 HG SER A 122 6.202 0.575 1.839 1.00 0.00 H new ATOM 1895 N GLU A 123 8.743 2.745 -1.293 1.00 0.00 N ATOM 1896 CA GLU A 123 9.412 3.330 -2.449 1.00 0.00 C ATOM 1897 C GLU A 123 10.469 2.410 -3.058 1.00 0.00 C ATOM 1898 O GLU A 123 10.743 2.493 -4.254 1.00 0.00 O ATOM 1899 CB GLU A 123 10.025 4.673 -2.068 1.00 0.00 C ATOM 1900 CG GLU A 123 9.001 5.652 -1.518 1.00 0.00 C ATOM 1901 CD GLU A 123 9.537 7.061 -1.408 1.00 0.00 C ATOM 1902 OE1 GLU A 123 9.451 7.803 -2.408 1.00 0.00 O ATOM 1903 OE2 GLU A 123 10.025 7.440 -0.326 1.00 0.00 O ATOM 0 H GLU A 123 8.966 3.197 -0.406 1.00 0.00 H new ATOM 0 HA GLU A 123 8.654 3.476 -3.218 1.00 0.00 H new ATOM 0 HB2 GLU A 123 10.805 4.513 -1.323 1.00 0.00 H new ATOM 0 HB3 GLU A 123 10.505 5.110 -2.944 1.00 0.00 H new ATOM 0 HG2 GLU A 123 8.122 5.652 -2.163 1.00 0.00 H new ATOM 0 HG3 GLU A 123 8.675 5.315 -0.534 1.00 0.00 H new ATOM 1910 N TYR A 124 11.064 1.541 -2.254 1.00 0.00 N ATOM 1911 CA TYR A 124 12.031 0.590 -2.783 1.00 0.00 C ATOM 1912 C TYR A 124 11.612 -0.842 -2.472 1.00 0.00 C ATOM 1913 O TYR A 124 10.665 -1.063 -1.719 1.00 0.00 O ATOM 1914 CB TYR A 124 13.463 0.892 -2.300 1.00 0.00 C ATOM 1915 CG TYR A 124 13.664 0.992 -0.797 1.00 0.00 C ATOM 1916 CD1 TYR A 124 13.200 2.091 -0.079 1.00 0.00 C ATOM 1917 CD2 TYR A 124 14.353 0.003 -0.103 1.00 0.00 C ATOM 1918 CE1 TYR A 124 13.411 2.196 1.283 1.00 0.00 C ATOM 1919 CE2 TYR A 124 14.574 0.106 1.258 1.00 0.00 C ATOM 1920 CZ TYR A 124 14.100 1.203 1.947 1.00 0.00 C ATOM 1921 OH TYR A 124 14.331 1.309 3.302 1.00 0.00 O ATOM 0 H TYR A 124 10.899 1.474 -1.250 1.00 0.00 H new ATOM 0 HA TYR A 124 12.043 0.701 -3.867 1.00 0.00 H new ATOM 0 HB2 TYR A 124 14.123 0.113 -2.682 1.00 0.00 H new ATOM 0 HB3 TYR A 124 13.784 1.831 -2.751 1.00 0.00 H new ATOM 0 HD1 TYR A 124 12.666 2.875 -0.595 1.00 0.00 H new ATOM 0 HD2 TYR A 124 14.722 -0.861 -0.637 1.00 0.00 H new ATOM 0 HE1 TYR A 124 13.038 3.052 1.825 1.00 0.00 H new ATOM 0 HE2 TYR A 124 15.116 -0.669 1.780 1.00 0.00 H new ATOM 0 HH TYR A 124 13.513 1.610 3.751 1.00 0.00 H new ATOM 1931 N THR A 125 12.319 -1.801 -3.058 1.00 0.00 N ATOM 1932 CA THR A 125 11.903 -3.198 -3.044 1.00 0.00 C ATOM 1933 C THR A 125 12.087 -3.859 -1.676 1.00 0.00 C ATOM 1934 O THR A 125 12.949 -3.458 -0.892 1.00 0.00 O ATOM 1935 CB THR A 125 12.688 -3.984 -4.110 1.00 0.00 C ATOM 1936 OG1 THR A 125 14.073 -3.609 -4.069 1.00 0.00 O ATOM 1937 CG2 THR A 125 12.127 -3.720 -5.496 1.00 0.00 C ATOM 0 H THR A 125 13.194 -1.633 -3.555 1.00 0.00 H new ATOM 0 HA THR A 125 10.836 -3.217 -3.268 1.00 0.00 H new ATOM 0 HB THR A 125 12.592 -5.048 -3.894 1.00 0.00 H new ATOM 0 HG1 THR A 125 14.569 -4.113 -4.748 1.00 0.00 H new ATOM 0 HG21 THR A 125 12.697 -4.286 -6.233 1.00 0.00 H new ATOM 0 HG22 THR A 125 11.082 -4.029 -5.530 1.00 0.00 H new ATOM 0 HG23 THR A 125 12.198 -2.656 -5.721 1.00 0.00 H new ATOM 1945 N PRO A 126 11.284 -4.909 -1.392 1.00 0.00 N ATOM 1946 CA PRO A 126 11.322 -5.629 -0.111 1.00 0.00 C ATOM 1947 C PRO A 126 12.635 -6.371 0.102 1.00 0.00 C ATOM 1948 O PRO A 126 13.031 -6.643 1.234 1.00 0.00 O ATOM 1949 CB PRO A 126 10.165 -6.633 -0.213 1.00 0.00 C ATOM 1950 CG PRO A 126 9.329 -6.164 -1.355 1.00 0.00 C ATOM 1951 CD PRO A 126 10.267 -5.469 -2.293 1.00 0.00 C ATOM 0 HA PRO A 126 11.235 -4.942 0.731 1.00 0.00 H new ATOM 0 HB2 PRO A 126 10.536 -7.643 -0.387 1.00 0.00 H new ATOM 0 HB3 PRO A 126 9.587 -6.661 0.711 1.00 0.00 H new ATOM 0 HG2 PRO A 126 8.834 -7.002 -1.847 1.00 0.00 H new ATOM 0 HG3 PRO A 126 8.546 -5.487 -1.013 1.00 0.00 H new ATOM 0 HD2 PRO A 126 10.703 -6.161 -3.013 1.00 0.00 H new ATOM 0 HD3 PRO A 126 9.762 -4.690 -2.865 1.00 0.00 H new ATOM 1959 N GLN A 127 13.303 -6.695 -0.994 1.00 0.00 N ATOM 1960 CA GLN A 127 14.581 -7.389 -0.940 1.00 0.00 C ATOM 1961 C GLN A 127 15.651 -6.496 -0.325 1.00 0.00 C ATOM 1962 O GLN A 127 16.637 -6.979 0.232 1.00 0.00 O ATOM 1963 CB GLN A 127 15.015 -7.845 -2.334 1.00 0.00 C ATOM 1964 CG GLN A 127 14.095 -8.889 -2.948 1.00 0.00 C ATOM 1965 CD GLN A 127 12.999 -8.285 -3.810 1.00 0.00 C ATOM 1966 OE1 GLN A 127 12.554 -7.162 -3.580 1.00 0.00 O ATOM 1967 NE2 GLN A 127 12.553 -9.030 -4.808 1.00 0.00 N ATOM 0 H GLN A 127 12.979 -6.487 -1.938 1.00 0.00 H new ATOM 0 HA GLN A 127 14.457 -8.271 -0.312 1.00 0.00 H new ATOM 0 HB2 GLN A 127 15.058 -6.978 -2.993 1.00 0.00 H new ATOM 0 HB3 GLN A 127 16.025 -8.252 -2.276 1.00 0.00 H new ATOM 0 HG2 GLN A 127 14.687 -9.576 -3.552 1.00 0.00 H new ATOM 0 HG3 GLN A 127 13.640 -9.477 -2.151 1.00 0.00 H new ATOM 0 HE21 GLN A 127 12.947 -9.957 -4.968 1.00 0.00 H new ATOM 0 HE22 GLN A 127 11.815 -8.677 -5.418 1.00 0.00 H new ATOM 1976 N GLN A 128 15.446 -5.189 -0.416 1.00 0.00 N ATOM 1977 CA GLN A 128 16.390 -4.234 0.141 1.00 0.00 C ATOM 1978 C GLN A 128 15.913 -3.718 1.492 1.00 0.00 C ATOM 1979 O GLN A 128 16.535 -2.833 2.085 1.00 0.00 O ATOM 1980 CB GLN A 128 16.612 -3.073 -0.828 1.00 0.00 C ATOM 1981 CG GLN A 128 17.362 -3.480 -2.086 1.00 0.00 C ATOM 1982 CD GLN A 128 17.642 -2.314 -3.013 1.00 0.00 C ATOM 1983 OE1 GLN A 128 17.778 -1.170 -2.576 1.00 0.00 O ATOM 1984 NE2 GLN A 128 17.756 -2.603 -4.297 1.00 0.00 N ATOM 0 H GLN A 128 14.635 -4.768 -0.870 1.00 0.00 H new ATOM 0 HA GLN A 128 17.340 -4.747 0.292 1.00 0.00 H new ATOM 0 HB2 GLN A 128 15.646 -2.652 -1.108 1.00 0.00 H new ATOM 0 HB3 GLN A 128 17.168 -2.285 -0.320 1.00 0.00 H new ATOM 0 HG2 GLN A 128 18.305 -3.948 -1.804 1.00 0.00 H new ATOM 0 HG3 GLN A 128 16.781 -4.231 -2.621 1.00 0.00 H new ATOM 0 HE21 GLN A 128 17.636 -3.564 -4.616 1.00 0.00 H new ATOM 0 HE22 GLN A 128 17.964 -1.865 -4.969 1.00 0.00 H new ATOM 1993 N LEU A 129 14.813 -4.276 1.983 1.00 0.00 N ATOM 1994 CA LEU A 129 14.315 -3.933 3.304 1.00 0.00 C ATOM 1995 C LEU A 129 15.012 -4.789 4.354 1.00 0.00 C ATOM 1996 O LEU A 129 15.130 -6.007 4.194 1.00 0.00 O ATOM 1997 CB LEU A 129 12.799 -4.156 3.384 1.00 0.00 C ATOM 1998 CG LEU A 129 11.950 -3.326 2.419 1.00 0.00 C ATOM 1999 CD1 LEU A 129 10.474 -3.634 2.617 1.00 0.00 C ATOM 2000 CD2 LEU A 129 12.210 -1.843 2.616 1.00 0.00 C ATOM 0 H LEU A 129 14.251 -4.967 1.485 1.00 0.00 H new ATOM 0 HA LEU A 129 14.525 -2.880 3.491 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.596 -5.211 3.200 1.00 0.00 H new ATOM 0 HB3 LEU A 129 12.473 -3.941 4.402 1.00 0.00 H new ATOM 0 HG LEU A 129 12.230 -3.591 1.399 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.882 -3.037 1.924 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.295 -4.692 2.428 1.00 0.00 H new ATOM 0 HD13 LEU A 129 10.186 -3.394 3.641 1.00 0.00 H new ATOM 0 HD21 LEU A 129 11.597 -1.270 1.920 1.00 0.00 H new ATOM 0 HD22 LEU A 129 11.957 -1.562 3.638 1.00 0.00 H new ATOM 0 HD23 LEU A 129 13.263 -1.630 2.431 1.00 0.00 H new ATOM 2012 N VAL A 130 15.466 -4.164 5.430 1.00 0.00 N ATOM 2013 CA VAL A 130 16.125 -4.899 6.498 1.00 0.00 C ATOM 2014 C VAL A 130 15.095 -5.342 7.529 1.00 0.00 C ATOM 2015 O VAL A 130 15.016 -4.805 8.636 1.00 0.00 O ATOM 2016 CB VAL A 130 17.242 -4.075 7.178 1.00 0.00 C ATOM 2017 CG1 VAL A 130 18.053 -4.949 8.129 1.00 0.00 C ATOM 2018 CG2 VAL A 130 18.142 -3.429 6.131 1.00 0.00 C ATOM 0 H VAL A 130 15.391 -3.159 5.586 1.00 0.00 H new ATOM 0 HA VAL A 130 16.600 -5.772 6.051 1.00 0.00 H new ATOM 0 HB VAL A 130 16.777 -3.281 7.763 1.00 0.00 H new ATOM 0 HG11 VAL A 130 18.834 -4.350 8.597 1.00 0.00 H new ATOM 0 HG12 VAL A 130 17.397 -5.355 8.899 1.00 0.00 H new ATOM 0 HG13 VAL A 130 18.509 -5.767 7.572 1.00 0.00 H new ATOM 0 HG21 VAL A 130 18.923 -2.853 6.628 1.00 0.00 H new ATOM 0 HG22 VAL A 130 18.599 -4.204 5.516 1.00 0.00 H new ATOM 0 HG23 VAL A 130 17.549 -2.767 5.500 1.00 0.00 H new ATOM 2028 N ILE A 131 14.277 -6.300 7.127 1.00 0.00 N ATOM 2029 CA ILE A 131 13.223 -6.825 7.981 1.00 0.00 C ATOM 2030 C ILE A 131 13.431 -8.313 8.225 1.00 0.00 C ATOM 2031 O ILE A 131 14.362 -8.912 7.677 1.00 0.00 O ATOM 2032 CB ILE A 131 11.824 -6.611 7.355 1.00 0.00 C ATOM 2033 CG1 ILE A 131 11.755 -7.269 5.968 1.00 0.00 C ATOM 2034 CG2 ILE A 131 11.505 -5.125 7.263 1.00 0.00 C ATOM 2035 CD1 ILE A 131 10.406 -7.139 5.289 1.00 0.00 C ATOM 0 H ILE A 131 14.323 -6.734 6.205 1.00 0.00 H new ATOM 0 HA ILE A 131 13.272 -6.282 8.925 1.00 0.00 H new ATOM 0 HB ILE A 131 11.078 -7.081 7.996 1.00 0.00 H new ATOM 0 HG12 ILE A 131 12.517 -6.824 5.328 1.00 0.00 H new ATOM 0 HG13 ILE A 131 12.000 -8.327 6.067 1.00 0.00 H new ATOM 0 HG21 ILE A 131 10.518 -4.991 6.821 1.00 0.00 H new ATOM 0 HG22 ILE A 131 11.517 -4.688 8.261 1.00 0.00 H new ATOM 0 HG23 ILE A 131 12.251 -4.631 6.641 1.00 0.00 H new ATOM 0 HD11 ILE A 131 10.440 -7.629 4.316 1.00 0.00 H new ATOM 0 HD12 ILE A 131 9.641 -7.610 5.906 1.00 0.00 H new ATOM 0 HD13 ILE A 131 10.166 -6.084 5.156 1.00 0.00 H new ATOM 2047 N ARG A 132 12.560 -8.898 9.042 1.00 0.00 N ATOM 2048 CA ARG A 132 12.599 -10.329 9.324 1.00 0.00 C ATOM 2049 C ARG A 132 12.547 -11.129 8.025 1.00 0.00 C ATOM 2050 O ARG A 132 11.796 -10.789 7.109 1.00 0.00 O ATOM 2051 CB ARG A 132 11.425 -10.724 10.224 1.00 0.00 C ATOM 2052 CG ARG A 132 11.423 -10.026 11.577 1.00 0.00 C ATOM 2053 CD ARG A 132 12.610 -10.452 12.427 1.00 0.00 C ATOM 2054 NE ARG A 132 12.562 -11.876 12.758 1.00 0.00 N ATOM 2055 CZ ARG A 132 13.568 -12.541 13.321 1.00 0.00 C ATOM 2056 NH1 ARG A 132 14.701 -11.913 13.611 1.00 0.00 N ATOM 2057 NH2 ARG A 132 13.444 -13.832 13.597 1.00 0.00 N ATOM 0 H ARG A 132 11.813 -8.398 9.524 1.00 0.00 H new ATOM 0 HA ARG A 132 13.533 -10.553 9.839 1.00 0.00 H new ATOM 0 HB2 ARG A 132 10.492 -10.497 9.708 1.00 0.00 H new ATOM 0 HB3 ARG A 132 11.448 -11.802 10.382 1.00 0.00 H new ATOM 0 HG2 ARG A 132 11.448 -8.946 11.430 1.00 0.00 H new ATOM 0 HG3 ARG A 132 10.497 -10.254 12.104 1.00 0.00 H new ATOM 0 HD2 ARG A 132 13.535 -10.235 11.893 1.00 0.00 H new ATOM 0 HD3 ARG A 132 12.627 -9.866 13.346 1.00 0.00 H new ATOM 0 HE ARG A 132 11.707 -12.390 12.545 1.00 0.00 H new ATOM 0 HH11 ARG A 132 14.801 -10.920 13.402 1.00 0.00 H new ATOM 0 HH12 ARG A 132 15.471 -12.424 14.043 1.00 0.00 H new ATOM 0 HH21 ARG A 132 12.575 -14.319 13.378 1.00 0.00 H new ATOM 0 HH22 ARG A 132 14.218 -14.338 14.028 1.00 0.00 H new ATOM 2071 N GLU A 133 13.341 -12.184 7.946 1.00 0.00 N ATOM 2072 CA GLU A 133 13.409 -12.997 6.740 1.00 0.00 C ATOM 2073 C GLU A 133 12.119 -13.794 6.558 1.00 0.00 C ATOM 2074 O GLU A 133 11.672 -14.022 5.435 1.00 0.00 O ATOM 2075 CB GLU A 133 14.628 -13.936 6.772 1.00 0.00 C ATOM 2076 CG GLU A 133 14.576 -15.030 7.837 1.00 0.00 C ATOM 2077 CD GLU A 133 14.541 -14.488 9.251 1.00 0.00 C ATOM 2078 OE1 GLU A 133 15.620 -14.222 9.816 1.00 0.00 O ATOM 2079 OE2 GLU A 133 13.429 -14.305 9.789 1.00 0.00 O ATOM 0 H GLU A 133 13.948 -12.499 8.703 1.00 0.00 H new ATOM 0 HA GLU A 133 13.525 -12.327 5.888 1.00 0.00 H new ATOM 0 HB2 GLU A 133 14.730 -14.407 5.794 1.00 0.00 H new ATOM 0 HB3 GLU A 133 15.524 -13.337 6.932 1.00 0.00 H new ATOM 0 HG2 GLU A 133 13.694 -15.648 7.670 1.00 0.00 H new ATOM 0 HG3 GLU A 133 15.445 -15.678 7.725 1.00 0.00 H new ATOM 2086 N ASP A 134 11.522 -14.194 7.676 1.00 0.00 N ATOM 2087 CA ASP A 134 10.255 -14.919 7.664 1.00 0.00 C ATOM 2088 C ASP A 134 9.125 -14.012 7.179 1.00 0.00 C ATOM 2089 O ASP A 134 8.144 -14.468 6.597 1.00 0.00 O ATOM 2090 CB ASP A 134 9.949 -15.455 9.066 1.00 0.00 C ATOM 2091 CG ASP A 134 8.758 -16.390 9.089 1.00 0.00 C ATOM 2092 OD1 ASP A 134 8.687 -17.290 8.226 1.00 0.00 O ATOM 2093 OD2 ASP A 134 7.896 -16.241 9.980 1.00 0.00 O ATOM 0 H ASP A 134 11.898 -14.027 8.609 1.00 0.00 H new ATOM 0 HA ASP A 134 10.336 -15.760 6.975 1.00 0.00 H new ATOM 0 HB2 ASP A 134 10.825 -15.980 9.449 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.761 -14.617 9.737 1.00 0.00 H new ATOM 2098 N LEU A 135 9.284 -12.718 7.415 1.00 0.00 N ATOM 2099 CA LEU A 135 8.329 -11.724 6.943 1.00 0.00 C ATOM 2100 C LEU A 135 8.600 -11.395 5.474 1.00 0.00 C ATOM 2101 O LEU A 135 7.679 -11.194 4.683 1.00 0.00 O ATOM 2102 CB LEU A 135 8.436 -10.457 7.799 1.00 0.00 C ATOM 2103 CG LEU A 135 7.537 -9.290 7.378 1.00 0.00 C ATOM 2104 CD1 LEU A 135 6.069 -9.636 7.577 1.00 0.00 C ATOM 2105 CD2 LEU A 135 7.899 -8.034 8.158 1.00 0.00 C ATOM 0 H LEU A 135 10.071 -12.329 7.934 1.00 0.00 H new ATOM 0 HA LEU A 135 7.320 -12.126 7.030 1.00 0.00 H new ATOM 0 HB2 LEU A 135 8.201 -10.718 8.831 1.00 0.00 H new ATOM 0 HB3 LEU A 135 9.472 -10.117 7.784 1.00 0.00 H new ATOM 0 HG LEU A 135 7.699 -9.100 6.317 1.00 0.00 H new ATOM 0 HD11 LEU A 135 5.451 -8.792 7.271 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.816 -10.508 6.974 1.00 0.00 H new ATOM 0 HD13 LEU A 135 5.887 -9.857 8.629 1.00 0.00 H new ATOM 0 HD21 LEU A 135 7.252 -7.214 7.848 1.00 0.00 H new ATOM 0 HD22 LEU A 135 7.767 -8.217 9.224 1.00 0.00 H new ATOM 0 HD23 LEU A 135 8.938 -7.770 7.961 1.00 0.00 H new ATOM 2117 N ARG A 136 9.881 -11.362 5.127 1.00 0.00 N ATOM 2118 CA ARG A 136 10.331 -11.007 3.784 1.00 0.00 C ATOM 2119 C ARG A 136 9.805 -11.993 2.743 1.00 0.00 C ATOM 2120 O ARG A 136 9.427 -11.596 1.641 1.00 0.00 O ATOM 2121 CB ARG A 136 11.858 -10.980 3.761 1.00 0.00 C ATOM 2122 CG ARG A 136 12.457 -10.237 2.581 1.00 0.00 C ATOM 2123 CD ARG A 136 13.978 -10.267 2.642 1.00 0.00 C ATOM 2124 NE ARG A 136 14.480 -9.882 3.964 1.00 0.00 N ATOM 2125 CZ ARG A 136 15.711 -10.153 4.403 1.00 0.00 C ATOM 2126 NH1 ARG A 136 16.585 -10.770 3.615 1.00 0.00 N ATOM 2127 NH2 ARG A 136 16.071 -9.822 5.638 1.00 0.00 N ATOM 0 H ARG A 136 10.641 -11.581 5.771 1.00 0.00 H new ATOM 0 HA ARG A 136 9.938 -10.022 3.532 1.00 0.00 H new ATOM 0 HB2 ARG A 136 12.214 -10.520 4.683 1.00 0.00 H new ATOM 0 HB3 ARG A 136 12.227 -12.006 3.753 1.00 0.00 H new ATOM 0 HG2 ARG A 136 12.116 -10.689 1.649 1.00 0.00 H new ATOM 0 HG3 ARG A 136 12.108 -9.204 2.580 1.00 0.00 H new ATOM 0 HD2 ARG A 136 14.331 -11.269 2.397 1.00 0.00 H new ATOM 0 HD3 ARG A 136 14.385 -9.592 1.889 1.00 0.00 H new ATOM 0 HE ARG A 136 13.850 -9.376 4.587 1.00 0.00 H new ATOM 0 HH11 ARG A 136 16.317 -11.039 2.669 1.00 0.00 H new ATOM 0 HH12 ARG A 136 17.524 -10.974 3.957 1.00 0.00 H new ATOM 0 HH21 ARG A 136 15.405 -9.358 6.256 1.00 0.00 H new ATOM 0 HH22 ARG A 136 17.013 -10.032 5.968 1.00 0.00 H new ATOM 2141 N THR A 137 9.773 -13.269 3.098 1.00 0.00 N ATOM 2142 CA THR A 137 9.288 -14.302 2.193 1.00 0.00 C ATOM 2143 C THR A 137 7.804 -14.111 1.882 1.00 0.00 C ATOM 2144 O THR A 137 7.362 -14.332 0.756 1.00 0.00 O ATOM 2145 CB THR A 137 9.508 -15.705 2.783 1.00 0.00 C ATOM 2146 OG1 THR A 137 9.018 -15.744 4.129 1.00 0.00 O ATOM 2147 CG2 THR A 137 10.983 -16.079 2.762 1.00 0.00 C ATOM 0 H THR A 137 10.078 -13.615 4.008 1.00 0.00 H new ATOM 0 HA THR A 137 9.859 -14.212 1.269 1.00 0.00 H new ATOM 0 HB THR A 137 8.963 -16.425 2.173 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.158 -16.639 4.502 1.00 0.00 H new ATOM 0 HG21 THR A 137 11.112 -17.075 3.185 1.00 0.00 H new ATOM 0 HG22 THR A 137 11.346 -16.071 1.734 1.00 0.00 H new ATOM 0 HG23 THR A 137 11.549 -15.359 3.352 1.00 0.00 H new ATOM 2155 N ARG A 138 7.045 -13.682 2.887 1.00 0.00 N ATOM 2156 CA ARG A 138 5.615 -13.447 2.734 1.00 0.00 C ATOM 2157 C ARG A 138 5.345 -12.233 1.849 1.00 0.00 C ATOM 2158 O ARG A 138 4.255 -12.083 1.300 1.00 0.00 O ATOM 2159 CB ARG A 138 4.982 -13.245 4.106 1.00 0.00 C ATOM 2160 CG ARG A 138 5.178 -14.432 5.033 1.00 0.00 C ATOM 2161 CD ARG A 138 4.346 -15.630 4.598 1.00 0.00 C ATOM 2162 NE ARG A 138 4.530 -16.776 5.487 1.00 0.00 N ATOM 2163 CZ ARG A 138 3.670 -17.791 5.589 1.00 0.00 C ATOM 2164 NH1 ARG A 138 2.569 -17.821 4.846 1.00 0.00 N ATOM 2165 NH2 ARG A 138 3.924 -18.777 6.434 1.00 0.00 N ATOM 0 H ARG A 138 7.402 -13.489 3.823 1.00 0.00 H new ATOM 0 HA ARG A 138 5.173 -14.318 2.251 1.00 0.00 H new ATOM 0 HB2 ARG A 138 5.409 -12.355 4.569 1.00 0.00 H new ATOM 0 HB3 ARG A 138 3.915 -13.060 3.983 1.00 0.00 H new ATOM 0 HG2 ARG A 138 6.232 -14.709 5.052 1.00 0.00 H new ATOM 0 HG3 ARG A 138 4.905 -14.149 6.049 1.00 0.00 H new ATOM 0 HD2 ARG A 138 3.292 -15.352 4.578 1.00 0.00 H new ATOM 0 HD3 ARG A 138 4.620 -15.912 3.581 1.00 0.00 H new ATOM 0 HE ARG A 138 5.369 -16.801 6.066 1.00 0.00 H new ATOM 0 HH11 ARG A 138 2.375 -17.064 4.191 1.00 0.00 H new ATOM 0 HH12 ARG A 138 1.917 -18.601 4.931 1.00 0.00 H new ATOM 0 HH21 ARG A 138 4.772 -18.757 7.001 1.00 0.00 H new ATOM 0 HH22 ARG A 138 3.272 -19.557 6.518 1.00 0.00 H new ATOM 2179 N MET A 139 6.348 -11.381 1.705 1.00 0.00 N ATOM 2180 CA MET A 139 6.229 -10.186 0.878 1.00 0.00 C ATOM 2181 C MET A 139 6.170 -10.547 -0.604 1.00 0.00 C ATOM 2182 O MET A 139 5.702 -9.765 -1.426 1.00 0.00 O ATOM 2183 CB MET A 139 7.405 -9.243 1.137 1.00 0.00 C ATOM 2184 CG MET A 139 7.402 -8.618 2.519 1.00 0.00 C ATOM 2185 SD MET A 139 5.997 -7.521 2.781 1.00 0.00 S ATOM 2186 CE MET A 139 6.357 -6.899 4.421 1.00 0.00 C ATOM 0 H MET A 139 7.258 -11.494 2.151 1.00 0.00 H new ATOM 0 HA MET A 139 5.300 -9.683 1.146 1.00 0.00 H new ATOM 0 HB2 MET A 139 8.336 -9.794 1.001 1.00 0.00 H new ATOM 0 HB3 MET A 139 7.392 -8.449 0.390 1.00 0.00 H new ATOM 0 HG2 MET A 139 7.387 -9.407 3.271 1.00 0.00 H new ATOM 0 HG3 MET A 139 8.327 -8.059 2.663 1.00 0.00 H new ATOM 0 HE1 MET A 139 5.668 -6.089 4.662 1.00 0.00 H new ATOM 0 HE2 MET A 139 6.241 -7.703 5.148 1.00 0.00 H new ATOM 0 HE3 MET A 139 7.381 -6.526 4.452 1.00 0.00 H new ATOM 2196 N ALA A 140 6.626 -11.747 -0.933 1.00 0.00 N ATOM 2197 CA ALA A 140 6.666 -12.198 -2.320 1.00 0.00 C ATOM 2198 C ALA A 140 5.333 -12.810 -2.757 1.00 0.00 C ATOM 2199 O ALA A 140 5.234 -13.403 -3.833 1.00 0.00 O ATOM 2200 CB ALA A 140 7.791 -13.202 -2.508 1.00 0.00 C ATOM 0 H ALA A 140 6.974 -12.428 -0.258 1.00 0.00 H new ATOM 0 HA ALA A 140 6.849 -11.326 -2.948 1.00 0.00 H new ATOM 0 HB1 ALA A 140 7.813 -13.533 -3.546 1.00 0.00 H new ATOM 0 HB2 ALA A 140 8.742 -12.734 -2.256 1.00 0.00 H new ATOM 0 HB3 ALA A 140 7.625 -14.060 -1.857 1.00 0.00 H new ATOM 2206 N TYR A 141 4.308 -12.664 -1.924 1.00 0.00 N ATOM 2207 CA TYR A 141 2.986 -13.200 -2.229 1.00 0.00 C ATOM 2208 C TYR A 141 2.101 -12.146 -2.889 1.00 0.00 C ATOM 2209 O TYR A 141 0.895 -12.343 -3.038 1.00 0.00 O ATOM 2210 CB TYR A 141 2.311 -13.713 -0.954 1.00 0.00 C ATOM 2211 CG TYR A 141 2.872 -15.019 -0.436 1.00 0.00 C ATOM 2212 CD1 TYR A 141 4.118 -15.071 0.176 1.00 0.00 C ATOM 2213 CD2 TYR A 141 2.151 -16.199 -0.554 1.00 0.00 C ATOM 2214 CE1 TYR A 141 4.630 -16.260 0.653 1.00 0.00 C ATOM 2215 CE2 TYR A 141 2.657 -17.393 -0.076 1.00 0.00 C ATOM 2216 CZ TYR A 141 3.896 -17.417 0.526 1.00 0.00 C ATOM 2217 OH TYR A 141 4.406 -18.601 1.006 1.00 0.00 O ATOM 0 H TYR A 141 4.368 -12.177 -1.030 1.00 0.00 H new ATOM 0 HA TYR A 141 3.117 -14.027 -2.926 1.00 0.00 H new ATOM 0 HB2 TYR A 141 2.407 -12.956 -0.176 1.00 0.00 H new ATOM 0 HB3 TYR A 141 1.246 -13.839 -1.146 1.00 0.00 H new ATOM 0 HD1 TYR A 141 4.696 -14.165 0.280 1.00 0.00 H new ATOM 0 HD2 TYR A 141 1.180 -16.184 -1.026 1.00 0.00 H new ATOM 0 HE1 TYR A 141 5.602 -16.283 1.124 1.00 0.00 H new ATOM 0 HE2 TYR A 141 2.084 -18.303 -0.174 1.00 0.00 H new ATOM 0 HH TYR A 141 3.766 -19.324 0.840 1.00 0.00 H new ATOM 2227 N CYS A 142 2.703 -11.035 -3.294 1.00 0.00 N ATOM 2228 CA CYS A 142 1.959 -9.946 -3.898 1.00 0.00 C ATOM 2229 C CYS A 142 2.407 -9.727 -5.340 1.00 0.00 C ATOM 2230 O CYS A 142 3.184 -10.513 -5.888 1.00 0.00 O ATOM 2231 CB CYS A 142 2.163 -8.665 -3.084 1.00 0.00 C ATOM 2232 SG CYS A 142 3.880 -8.108 -3.009 1.00 0.00 S ATOM 0 H CYS A 142 3.706 -10.868 -3.213 1.00 0.00 H new ATOM 0 HA CYS A 142 0.900 -10.204 -3.901 1.00 0.00 H new ATOM 0 HB2 CYS A 142 1.553 -7.871 -3.515 1.00 0.00 H new ATOM 0 HB3 CYS A 142 1.801 -8.830 -2.069 1.00 0.00 H new ATOM 0 HG CYS A 142 4.629 -9.070 -2.559 1.00 0.00 H new ATOM 2238 N LEU A 143 1.894 -8.677 -5.954 1.00 0.00 N ATOM 2239 CA LEU A 143 2.332 -8.267 -7.284 1.00 0.00 C ATOM 2240 C LEU A 143 3.129 -6.978 -7.169 1.00 0.00 C ATOM 2241 O LEU A 143 2.914 -6.201 -6.246 1.00 0.00 O ATOM 2242 CB LEU A 143 1.141 -8.055 -8.227 1.00 0.00 C ATOM 2243 CG LEU A 143 0.371 -9.312 -8.630 1.00 0.00 C ATOM 2244 CD1 LEU A 143 -0.523 -9.802 -7.502 1.00 0.00 C ATOM 2245 CD2 LEU A 143 -0.452 -9.052 -9.880 1.00 0.00 C ATOM 0 H LEU A 143 1.167 -8.085 -5.552 1.00 0.00 H new ATOM 0 HA LEU A 143 2.953 -9.059 -7.702 1.00 0.00 H new ATOM 0 HB2 LEU A 143 0.445 -7.364 -7.751 1.00 0.00 H new ATOM 0 HB3 LEU A 143 1.503 -7.569 -9.133 1.00 0.00 H new ATOM 0 HG LEU A 143 1.100 -10.094 -8.843 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -1.056 -10.697 -7.823 1.00 0.00 H new ATOM 0 HD12 LEU A 143 0.087 -10.036 -6.630 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -1.242 -9.025 -7.244 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -0.994 -9.957 -10.153 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -1.162 -8.248 -9.687 1.00 0.00 H new ATOM 0 HD23 LEU A 143 0.209 -8.764 -10.697 1.00 0.00 H new ATOM 2257 N VAL A 144 4.026 -6.738 -8.107 1.00 0.00 N ATOM 2258 CA VAL A 144 4.882 -5.568 -8.043 1.00 0.00 C ATOM 2259 C VAL A 144 4.641 -4.657 -9.239 1.00 0.00 C ATOM 2260 O VAL A 144 4.876 -5.038 -10.386 1.00 0.00 O ATOM 2261 CB VAL A 144 6.375 -5.964 -7.980 1.00 0.00 C ATOM 2262 CG1 VAL A 144 7.260 -4.728 -7.963 1.00 0.00 C ATOM 2263 CG2 VAL A 144 6.651 -6.832 -6.758 1.00 0.00 C ATOM 0 H VAL A 144 4.181 -7.335 -8.919 1.00 0.00 H new ATOM 0 HA VAL A 144 4.630 -5.030 -7.129 1.00 0.00 H new ATOM 0 HB VAL A 144 6.609 -6.542 -8.874 1.00 0.00 H new ATOM 0 HG11 VAL A 144 8.306 -5.030 -7.918 1.00 0.00 H new ATOM 0 HG12 VAL A 144 7.089 -4.145 -8.868 1.00 0.00 H new ATOM 0 HG13 VAL A 144 7.020 -4.121 -7.090 1.00 0.00 H new ATOM 0 HG21 VAL A 144 7.707 -7.099 -6.733 1.00 0.00 H new ATOM 0 HG22 VAL A 144 6.395 -6.280 -5.854 1.00 0.00 H new ATOM 0 HG23 VAL A 144 6.048 -7.739 -6.812 1.00 0.00 H new ATOM 2273 N TYR A 145 4.156 -3.459 -8.959 1.00 0.00 N ATOM 2274 CA TYR A 145 3.926 -2.465 -9.996 1.00 0.00 C ATOM 2275 C TYR A 145 4.957 -1.348 -9.903 1.00 0.00 C ATOM 2276 O TYR A 145 5.190 -0.786 -8.831 1.00 0.00 O ATOM 2277 CB TYR A 145 2.510 -1.890 -9.905 1.00 0.00 C ATOM 2278 CG TYR A 145 1.427 -2.881 -10.273 1.00 0.00 C ATOM 2279 CD1 TYR A 145 1.096 -3.119 -11.604 1.00 0.00 C ATOM 2280 CD2 TYR A 145 0.738 -3.579 -9.293 1.00 0.00 C ATOM 2281 CE1 TYR A 145 0.107 -4.023 -11.944 1.00 0.00 C ATOM 2282 CE2 TYR A 145 -0.252 -4.485 -9.625 1.00 0.00 C ATOM 2283 CZ TYR A 145 -0.566 -4.703 -10.949 1.00 0.00 C ATOM 2284 OH TYR A 145 -1.558 -5.604 -11.276 1.00 0.00 O ATOM 0 H TYR A 145 3.913 -3.149 -8.018 1.00 0.00 H new ATOM 0 HA TYR A 145 4.030 -2.959 -10.962 1.00 0.00 H new ATOM 0 HB2 TYR A 145 2.336 -1.535 -8.889 1.00 0.00 H new ATOM 0 HB3 TYR A 145 2.436 -1.024 -10.562 1.00 0.00 H new ATOM 0 HD1 TYR A 145 1.621 -2.588 -12.384 1.00 0.00 H new ATOM 0 HD2 TYR A 145 0.979 -3.412 -8.253 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -0.138 -4.196 -12.982 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -0.778 -5.021 -8.849 1.00 0.00 H new ATOM 0 HH TYR A 145 -1.928 -5.995 -10.457 1.00 0.00 H new ATOM 2294 N GLU A 146 5.566 -1.040 -11.036 1.00 0.00 N ATOM 2295 CA GLU A 146 6.618 -0.033 -11.109 1.00 0.00 C ATOM 2296 C GLU A 146 6.056 1.287 -11.627 1.00 0.00 C ATOM 2297 O GLU A 146 5.058 1.301 -12.349 1.00 0.00 O ATOM 2298 CB GLU A 146 7.738 -0.533 -12.030 1.00 0.00 C ATOM 2299 CG GLU A 146 7.242 -0.934 -13.412 1.00 0.00 C ATOM 2300 CD GLU A 146 8.281 -1.662 -14.240 1.00 0.00 C ATOM 2301 OE1 GLU A 146 8.591 -2.825 -13.911 1.00 0.00 O ATOM 2302 OE2 GLU A 146 8.772 -1.088 -15.233 1.00 0.00 O ATOM 0 H GLU A 146 5.348 -1.478 -11.931 1.00 0.00 H new ATOM 0 HA GLU A 146 7.021 0.137 -10.111 1.00 0.00 H new ATOM 0 HB2 GLU A 146 8.491 0.248 -12.134 1.00 0.00 H new ATOM 0 HB3 GLU A 146 8.228 -1.388 -11.564 1.00 0.00 H new ATOM 0 HG2 GLU A 146 6.364 -1.571 -13.303 1.00 0.00 H new ATOM 0 HG3 GLU A 146 6.923 -0.040 -13.948 1.00 0.00 H new