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= 0.486 K(o=1,f=-0.44) USER MOD Set 1.2: A 112 ASN : amide:sc= 0.54 K(o=1,f=0) USER MOD Set 2.1: A 40 TYR OH : rot 107:sc= 1.29 USER MOD Set 2.2: A 122 SER OG : rot 120:sc= 1.06 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 HIS : no HE2:sc= -1.01 K(o=-1,f=-2.6!) USER MOD Single : A 37 GLN : amide:sc= 0.981 K(o=0.98,f=-0.82) USER MOD Single : A 50 SER OG : rot 29:sc= 0.229 USER MOD Single : A 51 HIS : no HD1:sc= -0.138 X(o=-0.14,f=-0.14) USER MOD Single : A 54 GLN :FLIP amide:sc= 0 F(o=-0.97,f=0) USER MOD Single : A 59 GLN :FLIP amide:sc= -1.08 F(o=-2.8!,f=-1.1) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -1.04 K(o=-1,f=-5.2!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl -172:sc= -0.709 (180deg=-0.828) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= 0.624 K(o=0.62,f=-2.6!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN :FLIP amide:sc= 0 F(o=-0.65,f=0) USER MOD Single : A 100 GLN : amide:sc= -0.296 X(o=-0.3,f=-0.21) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 160:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 164:sc= 1.23 (180deg=1.11) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.301 USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 GLN : amide:sc= -0.168 X(o=-0.17,f=-0.37) USER MOD Single : A 137 THR OG1 : rot -85:sc= 1.12 USER MOD Single : A 139 MET CE :methyl -138:sc= -1.15 (180deg=-3.26!) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 142 CYS SG : rot 59:sc= -0.039 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 540 N LYS A 34 -10.662 0.508 -8.186 1.00 0.00 N ATOM 541 CA LYS A 34 -10.014 -0.549 -7.416 1.00 0.00 C ATOM 542 C LYS A 34 -8.936 -1.240 -8.251 1.00 0.00 C ATOM 543 O LYS A 34 -8.719 -0.889 -9.412 1.00 0.00 O ATOM 544 CB LYS A 34 -11.041 -1.577 -6.927 1.00 0.00 C ATOM 545 CG LYS A 34 -11.762 -2.311 -8.048 1.00 0.00 C ATOM 546 CD LYS A 34 -12.703 -3.371 -7.498 1.00 0.00 C ATOM 547 CE LYS A 34 -13.377 -4.154 -8.613 1.00 0.00 C ATOM 548 NZ LYS A 34 -14.264 -5.224 -8.085 1.00 0.00 N ATOM 0 HA LYS A 34 -9.543 -0.090 -6.546 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -10.536 -2.307 -6.294 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -11.779 -1.071 -6.304 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -12.326 -1.598 -8.649 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -11.032 -2.778 -8.709 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -12.147 -4.055 -6.857 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -13.462 -2.897 -6.875 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -13.960 -3.473 -9.233 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -12.616 -4.598 -9.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -14.704 -5.733 -8.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -13.704 -5.889 -7.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -15.006 -4.799 -7.493 1.00 0.00 H new ATOM 562 N HIS A 35 -8.272 -2.228 -7.661 1.00 0.00 N ATOM 563 CA HIS A 35 -7.184 -2.936 -8.334 1.00 0.00 C ATOM 564 C HIS A 35 -6.953 -4.306 -7.692 1.00 0.00 C ATOM 565 O HIS A 35 -7.803 -4.786 -6.944 1.00 0.00 O ATOM 566 CB HIS A 35 -5.895 -2.094 -8.324 1.00 0.00 C ATOM 567 CG HIS A 35 -5.537 -1.512 -6.990 1.00 0.00 C ATOM 568 ND1 HIS A 35 -5.608 -0.163 -6.723 1.00 0.00 N ATOM 569 CD2 HIS A 35 -5.094 -2.097 -5.852 1.00 0.00 C ATOM 570 CE1 HIS A 35 -5.224 0.059 -5.482 1.00 0.00 C ATOM 571 NE2 HIS A 35 -4.908 -1.099 -4.928 1.00 0.00 N ATOM 0 H HIS A 35 -8.467 -2.559 -6.716 1.00 0.00 H new ATOM 0 HA HIS A 35 -7.470 -3.095 -9.374 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -5.068 -2.716 -8.667 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -6.002 -1.281 -9.043 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -5.911 0.553 -7.383 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -4.920 -3.152 -5.700 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -5.176 1.024 -4.999 1.00 0.00 H new ATOM 580 N GLY A 36 -5.806 -4.920 -7.995 1.00 0.00 N ATOM 581 CA GLY A 36 -5.509 -6.270 -7.537 1.00 0.00 C ATOM 582 C GLY A 36 -5.559 -6.446 -6.028 1.00 0.00 C ATOM 583 O GLY A 36 -5.523 -5.473 -5.271 1.00 0.00 O ATOM 0 H GLY A 36 -5.068 -4.497 -8.558 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.218 -6.960 -7.995 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.517 -6.551 -7.891 1.00 0.00 H new ATOM 587 N GLN A 37 -5.609 -7.707 -5.608 1.00 0.00 N ATOM 588 CA GLN A 37 -5.773 -8.070 -4.203 1.00 0.00 C ATOM 589 C GLN A 37 -4.539 -7.697 -3.378 1.00 0.00 C ATOM 590 O GLN A 37 -4.644 -6.991 -2.376 1.00 0.00 O ATOM 591 CB GLN A 37 -6.049 -9.573 -4.098 1.00 0.00 C ATOM 592 CG GLN A 37 -6.521 -10.025 -2.726 1.00 0.00 C ATOM 593 CD GLN A 37 -6.868 -11.500 -2.687 1.00 0.00 C ATOM 594 OE1 GLN A 37 -7.257 -12.086 -3.696 1.00 0.00 O ATOM 595 NE2 GLN A 37 -6.744 -12.105 -1.518 1.00 0.00 N ATOM 0 H GLN A 37 -5.537 -8.509 -6.234 1.00 0.00 H new ATOM 0 HA GLN A 37 -6.617 -7.511 -3.798 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -6.803 -9.845 -4.837 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -5.140 -10.117 -4.355 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -5.742 -9.819 -1.992 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -7.395 -9.442 -2.436 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -6.418 -11.582 -0.705 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -6.975 -13.095 -1.429 1.00 0.00 H new ATOM 604 N PHE A 38 -3.378 -8.186 -3.796 1.00 0.00 N ATOM 605 CA PHE A 38 -2.125 -7.875 -3.119 1.00 0.00 C ATOM 606 C PHE A 38 -1.212 -7.096 -4.054 1.00 0.00 C ATOM 607 O PHE A 38 -0.607 -7.672 -4.960 1.00 0.00 O ATOM 608 CB PHE A 38 -1.408 -9.153 -2.670 1.00 0.00 C ATOM 609 CG PHE A 38 -2.188 -10.002 -1.705 1.00 0.00 C ATOM 610 CD1 PHE A 38 -2.397 -9.581 -0.402 1.00 0.00 C ATOM 611 CD2 PHE A 38 -2.707 -11.225 -2.100 1.00 0.00 C ATOM 612 CE1 PHE A 38 -3.106 -10.365 0.489 1.00 0.00 C ATOM 613 CE2 PHE A 38 -3.415 -12.013 -1.214 1.00 0.00 C ATOM 614 CZ PHE A 38 -3.616 -11.583 0.082 1.00 0.00 C ATOM 0 H PHE A 38 -3.278 -8.801 -4.603 1.00 0.00 H new ATOM 0 HA PHE A 38 -2.358 -7.276 -2.239 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.172 -9.750 -3.551 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -0.460 -8.879 -2.208 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -2.002 -8.629 -0.078 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -2.556 -11.566 -3.114 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -3.261 -10.026 1.503 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -3.811 -12.965 -1.535 1.00 0.00 H new ATOM 0 HZ PHE A 38 -4.170 -12.197 0.776 1.00 0.00 H new ATOM 624 N ILE A 39 -1.121 -5.793 -3.846 1.00 0.00 N ATOM 625 CA ILE A 39 -0.345 -4.941 -4.732 1.00 0.00 C ATOM 626 C ILE A 39 0.723 -4.168 -3.970 1.00 0.00 C ATOM 627 O ILE A 39 0.457 -3.565 -2.928 1.00 0.00 O ATOM 628 CB ILE A 39 -1.249 -3.951 -5.503 1.00 0.00 C ATOM 629 CG1 ILE A 39 -2.291 -4.709 -6.333 1.00 0.00 C ATOM 630 CG2 ILE A 39 -0.418 -3.041 -6.401 1.00 0.00 C ATOM 631 CD1 ILE A 39 -1.694 -5.663 -7.346 1.00 0.00 C ATOM 0 H ILE A 39 -1.573 -5.303 -3.074 1.00 0.00 H new ATOM 0 HA ILE A 39 0.144 -5.600 -5.449 1.00 0.00 H new ATOM 0 HB ILE A 39 -1.768 -3.330 -4.773 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.940 -5.269 -5.660 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.920 -3.988 -6.855 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.077 -2.354 -6.932 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.285 -2.472 -5.792 1.00 0.00 H new ATOM 0 HG23 ILE A 39 0.133 -3.645 -7.121 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -2.495 -6.161 -7.893 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -1.068 -5.107 -8.044 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -1.089 -6.409 -6.831 1.00 0.00 H new ATOM 643 N TYR A 40 1.935 -4.214 -4.495 1.00 0.00 N ATOM 644 CA TYR A 40 3.055 -3.474 -3.947 1.00 0.00 C ATOM 645 C TYR A 40 3.566 -2.484 -4.989 1.00 0.00 C ATOM 646 O TYR A 40 3.909 -2.874 -6.109 1.00 0.00 O ATOM 647 CB TYR A 40 4.165 -4.449 -3.540 1.00 0.00 C ATOM 648 CG TYR A 40 5.353 -3.808 -2.858 1.00 0.00 C ATOM 649 CD1 TYR A 40 6.373 -3.219 -3.596 1.00 0.00 C ATOM 650 CD2 TYR A 40 5.463 -3.812 -1.475 1.00 0.00 C ATOM 651 CE1 TYR A 40 7.464 -2.651 -2.973 1.00 0.00 C ATOM 652 CE2 TYR A 40 6.555 -3.250 -0.846 1.00 0.00 C ATOM 653 CZ TYR A 40 7.550 -2.672 -1.600 1.00 0.00 C ATOM 654 OH TYR A 40 8.643 -2.124 -0.978 1.00 0.00 O ATOM 0 H TYR A 40 2.170 -4.769 -5.318 1.00 0.00 H new ATOM 0 HA TYR A 40 2.736 -2.921 -3.063 1.00 0.00 H new ATOM 0 HB2 TYR A 40 3.743 -5.200 -2.873 1.00 0.00 H new ATOM 0 HB3 TYR A 40 4.514 -4.973 -4.430 1.00 0.00 H new ATOM 0 HD1 TYR A 40 6.310 -3.206 -4.674 1.00 0.00 H new ATOM 0 HD2 TYR A 40 4.681 -4.262 -0.881 1.00 0.00 H new ATOM 0 HE1 TYR A 40 8.246 -2.192 -3.559 1.00 0.00 H new ATOM 0 HE2 TYR A 40 6.628 -3.264 0.231 1.00 0.00 H new ATOM 0 HH TYR A 40 8.388 -1.278 -0.555 1.00 0.00 H new ATOM 664 N VAL A 41 3.596 -1.208 -4.630 1.00 0.00 N ATOM 665 CA VAL A 41 4.077 -0.171 -5.533 1.00 0.00 C ATOM 666 C VAL A 41 5.259 0.571 -4.920 1.00 0.00 C ATOM 667 O VAL A 41 5.401 0.634 -3.697 1.00 0.00 O ATOM 668 CB VAL A 41 2.964 0.841 -5.894 1.00 0.00 C ATOM 669 CG1 VAL A 41 1.859 0.160 -6.686 1.00 0.00 C ATOM 670 CG2 VAL A 41 2.395 1.494 -4.642 1.00 0.00 C ATOM 0 H VAL A 41 3.292 -0.866 -3.718 1.00 0.00 H new ATOM 0 HA VAL A 41 4.395 -0.669 -6.449 1.00 0.00 H new ATOM 0 HB VAL A 41 3.406 1.621 -6.514 1.00 0.00 H new ATOM 0 HG11 VAL A 41 1.085 0.888 -6.931 1.00 0.00 H new ATOM 0 HG12 VAL A 41 2.272 -0.253 -7.606 1.00 0.00 H new ATOM 0 HG13 VAL A 41 1.426 -0.643 -6.090 1.00 0.00 H new ATOM 0 HG21 VAL A 41 1.615 2.201 -4.923 1.00 0.00 H new ATOM 0 HG22 VAL A 41 1.973 0.728 -3.992 1.00 0.00 H new ATOM 0 HG23 VAL A 41 3.189 2.021 -4.114 1.00 0.00 H new ATOM 680 N TRP A 42 6.111 1.121 -5.770 1.00 0.00 N ATOM 681 CA TRP A 42 7.279 1.852 -5.308 1.00 0.00 C ATOM 682 C TRP A 42 7.565 3.045 -6.217 1.00 0.00 C ATOM 683 O TRP A 42 7.897 2.884 -7.388 1.00 0.00 O ATOM 684 CB TRP A 42 8.504 0.920 -5.217 1.00 0.00 C ATOM 685 CG TRP A 42 8.870 0.231 -6.502 1.00 0.00 C ATOM 686 CD1 TRP A 42 8.129 -0.693 -7.183 1.00 0.00 C ATOM 687 CD2 TRP A 42 10.081 0.400 -7.249 1.00 0.00 C ATOM 688 NE1 TRP A 42 8.796 -1.094 -8.314 1.00 0.00 N ATOM 689 CE2 TRP A 42 9.997 -0.439 -8.375 1.00 0.00 C ATOM 690 CE3 TRP A 42 11.225 1.189 -7.080 1.00 0.00 C ATOM 691 CZ2 TRP A 42 11.015 -0.519 -9.322 1.00 0.00 C ATOM 692 CZ3 TRP A 42 12.234 1.107 -8.023 1.00 0.00 C ATOM 693 CH2 TRP A 42 12.121 0.261 -9.131 1.00 0.00 C ATOM 0 H TRP A 42 6.015 1.075 -6.784 1.00 0.00 H new ATOM 0 HA TRP A 42 7.071 2.234 -4.308 1.00 0.00 H new ATOM 0 HB2 TRP A 42 9.361 1.502 -4.876 1.00 0.00 H new ATOM 0 HB3 TRP A 42 8.311 0.163 -4.457 1.00 0.00 H new ATOM 0 HD1 TRP A 42 7.159 -1.055 -6.876 1.00 0.00 H new ATOM 0 HE1 TRP A 42 8.453 -1.769 -8.997 1.00 0.00 H new ATOM 0 HE3 TRP A 42 11.318 1.849 -6.230 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 10.933 -1.174 -10.177 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 13.124 1.706 -7.901 1.00 0.00 H new ATOM 0 HH2 TRP A 42 12.925 0.223 -9.851 1.00 0.00 H new ATOM 787 N SER A 50 -0.130 8.431 -1.140 1.00 0.00 N ATOM 788 CA SER A 50 -1.116 7.472 -0.642 1.00 0.00 C ATOM 789 C SER A 50 -2.545 7.782 -1.104 1.00 0.00 C ATOM 790 O SER A 50 -3.507 7.240 -0.559 1.00 0.00 O ATOM 791 CB SER A 50 -1.065 7.437 0.888 1.00 0.00 C ATOM 792 OG SER A 50 0.275 7.391 1.352 1.00 0.00 O ATOM 0 HA SER A 50 -0.854 6.499 -1.059 1.00 0.00 H new ATOM 0 HB2 SER A 50 -1.563 8.318 1.292 1.00 0.00 H new ATOM 0 HB3 SER A 50 -1.610 6.567 1.254 1.00 0.00 H new ATOM 0 HG SER A 50 0.862 7.830 0.701 1.00 0.00 H new ATOM 798 N HIS A 51 -2.693 8.613 -2.129 1.00 0.00 N ATOM 799 CA HIS A 51 -4.023 8.995 -2.596 1.00 0.00 C ATOM 800 C HIS A 51 -4.713 7.820 -3.276 1.00 0.00 C ATOM 801 O HIS A 51 -5.927 7.664 -3.169 1.00 0.00 O ATOM 802 CB HIS A 51 -3.994 10.234 -3.511 1.00 0.00 C ATOM 803 CG HIS A 51 -2.943 10.221 -4.580 1.00 0.00 C ATOM 804 ND1 HIS A 51 -1.815 11.003 -4.518 1.00 0.00 N ATOM 805 CD2 HIS A 51 -2.863 9.542 -5.747 1.00 0.00 C ATOM 806 CE1 HIS A 51 -1.085 10.805 -5.598 1.00 0.00 C ATOM 807 NE2 HIS A 51 -1.694 9.919 -6.362 1.00 0.00 N ATOM 0 H HIS A 51 -1.921 9.031 -2.648 1.00 0.00 H new ATOM 0 HA HIS A 51 -4.604 9.274 -1.717 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -4.970 10.336 -3.986 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -3.847 11.119 -2.891 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -3.585 8.834 -6.126 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -0.145 11.288 -5.820 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -1.354 9.572 -7.259 1.00 0.00 H new ATOM 816 N LEU A 52 -3.939 6.980 -3.955 1.00 0.00 N ATOM 817 CA LEU A 52 -4.486 5.793 -4.577 1.00 0.00 C ATOM 818 C LEU A 52 -4.820 4.758 -3.507 1.00 0.00 C ATOM 819 O LEU A 52 -5.762 3.977 -3.649 1.00 0.00 O ATOM 820 CB LEU A 52 -3.487 5.231 -5.588 1.00 0.00 C ATOM 821 CG LEU A 52 -3.831 3.858 -6.137 1.00 0.00 C ATOM 822 CD1 LEU A 52 -5.090 3.914 -6.988 1.00 0.00 C ATOM 823 CD2 LEU A 52 -2.664 3.289 -6.927 1.00 0.00 C ATOM 0 H LEU A 52 -2.935 7.104 -4.085 1.00 0.00 H new ATOM 0 HA LEU A 52 -5.404 6.048 -5.107 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -3.406 5.929 -6.421 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -2.505 5.181 -5.117 1.00 0.00 H new ATOM 0 HG LEU A 52 -4.026 3.193 -5.295 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -5.316 2.918 -7.370 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -5.924 4.268 -6.381 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -4.934 4.596 -7.824 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -2.931 2.305 -7.312 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -2.430 3.953 -7.759 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.793 3.201 -6.277 1.00 0.00 H new ATOM 835 N LEU A 53 -4.050 4.777 -2.424 1.00 0.00 N ATOM 836 CA LEU A 53 -4.308 3.903 -1.288 1.00 0.00 C ATOM 837 C LEU A 53 -5.620 4.295 -0.623 1.00 0.00 C ATOM 838 O LEU A 53 -6.446 3.442 -0.314 1.00 0.00 O ATOM 839 CB LEU A 53 -3.165 3.960 -0.262 1.00 0.00 C ATOM 840 CG LEU A 53 -1.892 3.183 -0.627 1.00 0.00 C ATOM 841 CD1 LEU A 53 -1.177 3.810 -1.813 1.00 0.00 C ATOM 842 CD2 LEU A 53 -0.962 3.099 0.573 1.00 0.00 C ATOM 0 H LEU A 53 -3.242 5.389 -2.310 1.00 0.00 H new ATOM 0 HA LEU A 53 -4.375 2.880 -1.659 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.896 5.005 -0.105 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -3.538 3.580 0.689 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.188 2.174 -0.915 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.281 3.234 -2.043 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.840 3.811 -2.678 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.897 4.835 -1.569 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.064 2.545 0.299 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.686 4.105 0.890 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -1.469 2.587 1.391 1.00 0.00 H new ATOM 854 N GLN A 54 -5.812 5.596 -0.432 1.00 0.00 N ATOM 855 CA GLN A 54 -7.027 6.116 0.183 1.00 0.00 C ATOM 856 C GLN A 54 -8.233 5.843 -0.707 1.00 0.00 C ATOM 857 O GLN A 54 -9.314 5.523 -0.217 1.00 0.00 O ATOM 858 CB GLN A 54 -6.895 7.617 0.446 1.00 0.00 C ATOM 859 CG GLN A 54 -5.829 7.964 1.476 1.00 0.00 C ATOM 860 CD GLN A 54 -5.685 9.459 1.701 1.00 0.00 C ATOM 861 OE1 GLN A 54 -6.772 10.198 1.530 1.00 0.00 O flip ATOM 862 NE2 GLN A 54 -4.603 9.951 2.023 1.00 0.00 N flip ATOM 0 H GLN A 54 -5.137 6.313 -0.696 1.00 0.00 H new ATOM 0 HA GLN A 54 -7.173 5.607 1.136 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -6.661 8.122 -0.491 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -7.856 8.004 0.785 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -6.075 7.482 2.422 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -4.871 7.557 1.151 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -3.787 9.352 2.146 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -4.523 10.958 2.167 1.00 0.00 H new ATOM 871 N ALA A 55 -8.030 5.971 -2.016 1.00 0.00 N ATOM 872 CA ALA A 55 -9.067 5.663 -2.995 1.00 0.00 C ATOM 873 C ALA A 55 -9.544 4.232 -2.843 1.00 0.00 C ATOM 874 O ALA A 55 -10.742 3.956 -2.787 1.00 0.00 O ATOM 875 CB ALA A 55 -8.533 5.860 -4.402 1.00 0.00 C ATOM 0 H ALA A 55 -7.151 6.288 -2.424 1.00 0.00 H new ATOM 0 HA ALA A 55 -9.905 6.338 -2.821 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -9.316 5.627 -5.124 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -8.218 6.896 -4.530 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -7.682 5.199 -4.564 1.00 0.00 H new ATOM 881 N TRP A 56 -8.579 3.332 -2.773 1.00 0.00 N ATOM 882 CA TRP A 56 -8.846 1.908 -2.695 1.00 0.00 C ATOM 883 C TRP A 56 -9.532 1.557 -1.378 1.00 0.00 C ATOM 884 O TRP A 56 -10.438 0.726 -1.337 1.00 0.00 O ATOM 885 CB TRP A 56 -7.528 1.158 -2.850 1.00 0.00 C ATOM 886 CG TRP A 56 -7.661 -0.326 -2.900 1.00 0.00 C ATOM 887 CD1 TRP A 56 -8.228 -1.073 -3.890 1.00 0.00 C ATOM 888 CD2 TRP A 56 -7.181 -1.247 -1.922 1.00 0.00 C ATOM 889 NE1 TRP A 56 -8.127 -2.409 -3.587 1.00 0.00 N ATOM 890 CE2 TRP A 56 -7.492 -2.540 -2.379 1.00 0.00 C ATOM 891 CE3 TRP A 56 -6.521 -1.100 -0.701 1.00 0.00 C ATOM 892 CZ2 TRP A 56 -7.160 -3.677 -1.659 1.00 0.00 C ATOM 893 CZ3 TRP A 56 -6.194 -2.233 0.016 1.00 0.00 C ATOM 894 CH2 TRP A 56 -6.512 -3.506 -0.465 1.00 0.00 C ATOM 0 H TRP A 56 -7.587 3.569 -2.769 1.00 0.00 H new ATOM 0 HA TRP A 56 -9.524 1.614 -3.496 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -7.037 1.497 -3.763 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -6.874 1.423 -2.019 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -8.689 -0.673 -4.781 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -8.468 -3.177 -4.165 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -6.271 -0.119 -0.325 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -7.404 -4.663 -2.027 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -5.685 -2.134 0.963 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -6.241 -4.374 0.118 1.00 0.00 H new ATOM 905 N VAL A 57 -9.105 2.207 -0.311 1.00 0.00 N ATOM 906 CA VAL A 57 -9.724 2.025 0.991 1.00 0.00 C ATOM 907 C VAL A 57 -11.172 2.525 0.973 1.00 0.00 C ATOM 908 O VAL A 57 -12.083 1.852 1.459 1.00 0.00 O ATOM 909 CB VAL A 57 -8.922 2.761 2.092 1.00 0.00 C ATOM 910 CG1 VAL A 57 -9.673 2.771 3.413 1.00 0.00 C ATOM 911 CG2 VAL A 57 -7.553 2.116 2.265 1.00 0.00 C ATOM 0 H VAL A 57 -8.329 2.869 -0.320 1.00 0.00 H new ATOM 0 HA VAL A 57 -9.723 0.959 1.217 1.00 0.00 H new ATOM 0 HB VAL A 57 -8.790 3.796 1.777 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.082 3.295 4.164 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -10.629 3.279 3.284 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -9.848 1.746 3.740 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -6.998 2.642 3.042 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -7.676 1.072 2.552 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -7.003 2.172 1.326 1.00 0.00 H new ATOM 921 N ALA A 58 -11.378 3.689 0.372 1.00 0.00 N ATOM 922 CA ALA A 58 -12.692 4.321 0.340 1.00 0.00 C ATOM 923 C ALA A 58 -13.692 3.509 -0.479 1.00 0.00 C ATOM 924 O ALA A 58 -14.832 3.321 -0.056 1.00 0.00 O ATOM 925 CB ALA A 58 -12.591 5.738 -0.207 1.00 0.00 C ATOM 0 H ALA A 58 -10.647 4.219 -0.103 1.00 0.00 H new ATOM 0 HA ALA A 58 -13.058 4.361 1.366 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -13.581 6.193 -0.223 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -11.931 6.328 0.429 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -12.188 5.709 -1.219 1.00 0.00 H new ATOM 931 N GLN A 59 -13.269 3.013 -1.639 1.00 0.00 N ATOM 932 CA GLN A 59 -14.173 2.260 -2.507 1.00 0.00 C ATOM 933 C GLN A 59 -14.614 0.962 -1.834 1.00 0.00 C ATOM 934 O GLN A 59 -15.719 0.468 -2.081 1.00 0.00 O ATOM 935 CB GLN A 59 -13.538 1.998 -3.889 1.00 0.00 C ATOM 936 CG GLN A 59 -12.282 1.133 -3.883 1.00 0.00 C ATOM 937 CD GLN A 59 -12.570 -0.361 -3.875 1.00 0.00 C ATOM 938 OE1 GLN A 59 -13.686 -0.763 -4.468 1.00 0.00 O flip ATOM 939 NE2 GLN A 59 -11.793 -1.151 -3.344 1.00 0.00 N flip ATOM 0 H GLN A 59 -12.320 3.116 -1.997 1.00 0.00 H new ATOM 0 HA GLN A 59 -15.063 2.866 -2.674 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -14.283 1.522 -4.527 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -13.295 2.958 -4.345 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -11.681 1.374 -4.760 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -11.683 1.384 -3.008 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -10.943 -0.808 -2.897 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -11.998 -2.150 -3.351 1.00 0.00 H new ATOM 948 N ALA A 60 -13.763 0.428 -0.966 1.00 0.00 N ATOM 949 CA ALA A 60 -14.106 -0.759 -0.196 1.00 0.00 C ATOM 950 C ALA A 60 -15.079 -0.402 0.920 1.00 0.00 C ATOM 951 O ALA A 60 -16.032 -1.137 1.193 1.00 0.00 O ATOM 952 CB ALA A 60 -12.855 -1.402 0.378 1.00 0.00 C ATOM 0 H ALA A 60 -12.831 0.799 -0.779 1.00 0.00 H new ATOM 0 HA ALA A 60 -14.587 -1.476 -0.862 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -13.131 -2.288 0.950 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -12.188 -1.689 -0.435 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -12.348 -0.692 1.031 1.00 0.00 H new ATOM 958 N LEU A 61 -14.837 0.744 1.551 1.00 0.00 N ATOM 959 CA LEU A 61 -15.701 1.248 2.614 1.00 0.00 C ATOM 960 C LEU A 61 -17.124 1.474 2.109 1.00 0.00 C ATOM 961 O LEU A 61 -18.092 1.227 2.830 1.00 0.00 O ATOM 962 CB LEU A 61 -15.136 2.552 3.183 1.00 0.00 C ATOM 963 CG LEU A 61 -13.878 2.397 4.038 1.00 0.00 C ATOM 964 CD1 LEU A 61 -13.365 3.757 4.479 1.00 0.00 C ATOM 965 CD2 LEU A 61 -14.163 1.521 5.249 1.00 0.00 C ATOM 0 H LEU A 61 -14.041 1.346 1.341 1.00 0.00 H new ATOM 0 HA LEU A 61 -15.734 0.497 3.403 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -14.913 3.225 2.355 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -15.908 3.032 3.784 1.00 0.00 H new ATOM 0 HG LEU A 61 -13.108 1.915 3.435 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -12.469 3.628 5.087 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -13.125 4.357 3.601 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -14.132 4.262 5.066 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -13.257 1.421 5.847 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -14.947 1.978 5.852 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -14.489 0.535 4.917 1.00 0.00 H new ATOM 977 N GLU A 62 -17.243 1.925 0.863 1.00 0.00 N ATOM 978 CA GLU A 62 -18.546 2.175 0.247 1.00 0.00 C ATOM 979 C GLU A 62 -19.361 0.894 0.117 1.00 0.00 C ATOM 980 O GLU A 62 -20.591 0.933 0.079 1.00 0.00 O ATOM 981 CB GLU A 62 -18.381 2.786 -1.138 1.00 0.00 C ATOM 982 CG GLU A 62 -17.734 4.153 -1.141 1.00 0.00 C ATOM 983 CD GLU A 62 -17.679 4.734 -2.532 1.00 0.00 C ATOM 984 OE1 GLU A 62 -16.883 4.235 -3.354 1.00 0.00 O ATOM 985 OE2 GLU A 62 -18.465 5.662 -2.823 1.00 0.00 O ATOM 0 H GLU A 62 -16.448 2.126 0.256 1.00 0.00 H new ATOM 0 HA GLU A 62 -19.074 2.870 0.900 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -17.782 2.112 -1.751 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -19.361 2.860 -1.609 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -18.293 4.823 -0.487 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -16.725 4.080 -0.735 1.00 0.00 H new ATOM 992 N ALA A 63 -18.674 -0.236 0.030 1.00 0.00 N ATOM 993 CA ALA A 63 -19.340 -1.523 -0.121 1.00 0.00 C ATOM 994 C ALA A 63 -19.743 -2.085 1.235 1.00 0.00 C ATOM 995 O ALA A 63 -20.290 -3.185 1.329 1.00 0.00 O ATOM 996 CB ALA A 63 -18.438 -2.502 -0.858 1.00 0.00 C ATOM 0 H ALA A 63 -17.656 -0.288 0.061 1.00 0.00 H new ATOM 0 HA ALA A 63 -20.245 -1.374 -0.709 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -18.949 -3.459 -0.963 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -18.202 -2.106 -1.846 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -17.516 -2.643 -0.294 1.00 0.00 H new ATOM 1002 N GLY A 64 -19.467 -1.319 2.283 1.00 0.00 N ATOM 1003 CA GLY A 64 -19.796 -1.750 3.625 1.00 0.00 C ATOM 1004 C GLY A 64 -18.767 -2.706 4.178 1.00 0.00 C ATOM 1005 O GLY A 64 -19.015 -3.400 5.162 1.00 0.00 O ATOM 0 H GLY A 64 -19.020 -0.404 2.225 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -19.871 -0.880 4.277 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -20.774 -2.231 3.622 1.00 0.00 H new ATOM 1009 N LYS A 65 -17.605 -2.748 3.544 1.00 0.00 N ATOM 1010 CA LYS A 65 -16.542 -3.627 3.973 1.00 0.00 C ATOM 1011 C LYS A 65 -15.489 -2.823 4.704 1.00 0.00 C ATOM 1012 O LYS A 65 -15.330 -1.627 4.462 1.00 0.00 O ATOM 1013 CB LYS A 65 -15.917 -4.350 2.781 1.00 0.00 C ATOM 1014 CG LYS A 65 -16.931 -5.027 1.869 1.00 0.00 C ATOM 1015 CD LYS A 65 -17.815 -5.998 2.637 1.00 0.00 C ATOM 1016 CE LYS A 65 -18.846 -6.648 1.728 1.00 0.00 C ATOM 1017 NZ LYS A 65 -19.807 -7.493 2.485 1.00 0.00 N ATOM 0 H LYS A 65 -17.379 -2.179 2.728 1.00 0.00 H new ATOM 0 HA LYS A 65 -16.958 -4.379 4.643 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -15.339 -3.634 2.197 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -15.217 -5.100 3.150 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -17.552 -4.270 1.389 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -16.408 -5.560 1.075 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -17.197 -6.768 3.098 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -18.322 -5.470 3.445 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -19.392 -5.874 1.188 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -18.337 -7.258 0.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -20.491 -7.916 1.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -19.290 -8.248 2.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -20.312 -6.907 3.180 1.00 0.00 H new ATOM 1031 N ASN A 66 -14.778 -3.481 5.590 1.00 0.00 N ATOM 1032 CA ASN A 66 -13.800 -2.805 6.427 1.00 0.00 C ATOM 1033 C ASN A 66 -12.496 -2.601 5.673 1.00 0.00 C ATOM 1034 O ASN A 66 -11.977 -3.526 5.043 1.00 0.00 O ATOM 1035 CB ASN A 66 -13.546 -3.607 7.699 1.00 0.00 C ATOM 1036 CG ASN A 66 -13.038 -2.750 8.844 1.00 0.00 C ATOM 1037 OD1 ASN A 66 -12.348 -1.753 8.640 1.00 0.00 O ATOM 1038 ND2 ASN A 66 -13.384 -3.136 10.060 1.00 0.00 N ATOM 0 H ASN A 66 -14.855 -4.485 5.754 1.00 0.00 H new ATOM 0 HA ASN A 66 -14.201 -1.828 6.698 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -14.470 -4.100 8.002 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -12.820 -4.392 7.489 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -13.077 -2.600 10.872 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -13.958 -3.970 10.186 1.00 0.00 H new ATOM 1045 N ALA A 67 -11.965 -1.396 5.771 1.00 0.00 N ATOM 1046 CA ALA A 67 -10.753 -1.022 5.065 1.00 0.00 C ATOM 1047 C ALA A 67 -10.067 0.131 5.780 1.00 0.00 C ATOM 1048 O ALA A 67 -10.733 1.036 6.285 1.00 0.00 O ATOM 1049 CB ALA A 67 -11.074 -0.635 3.629 1.00 0.00 C ATOM 0 H ALA A 67 -12.361 -0.649 6.342 1.00 0.00 H new ATOM 0 HA ALA A 67 -10.079 -1.878 5.050 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -10.155 -0.357 3.113 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -11.535 -1.481 3.119 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -11.762 0.210 3.625 1.00 0.00 H new ATOM 1055 N ALA A 68 -8.745 0.100 5.825 1.00 0.00 N ATOM 1056 CA ALA A 68 -7.988 1.140 6.503 1.00 0.00 C ATOM 1057 C ALA A 68 -6.599 1.288 5.902 1.00 0.00 C ATOM 1058 O ALA A 68 -5.995 0.312 5.450 1.00 0.00 O ATOM 1059 CB ALA A 68 -7.891 0.837 7.991 1.00 0.00 C ATOM 0 H ALA A 68 -8.175 -0.632 5.401 1.00 0.00 H new ATOM 0 HA ALA A 68 -8.516 2.084 6.368 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.322 1.624 8.486 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -8.892 0.790 8.419 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.389 -0.120 8.136 1.00 0.00 H new ATOM 1065 N TYR A 69 -6.097 2.513 5.893 1.00 0.00 N ATOM 1066 CA TYR A 69 -4.753 2.775 5.433 1.00 0.00 C ATOM 1067 C TYR A 69 -3.933 3.313 6.596 1.00 0.00 C ATOM 1068 O TYR A 69 -4.420 4.126 7.382 1.00 0.00 O ATOM 1069 CB TYR A 69 -4.750 3.764 4.256 1.00 0.00 C ATOM 1070 CG TYR A 69 -5.029 5.205 4.635 1.00 0.00 C ATOM 1071 CD1 TYR A 69 -6.331 5.676 4.769 1.00 0.00 C ATOM 1072 CD2 TYR A 69 -3.983 6.096 4.854 1.00 0.00 C ATOM 1073 CE1 TYR A 69 -6.579 6.994 5.112 1.00 0.00 C ATOM 1074 CE2 TYR A 69 -4.224 7.412 5.196 1.00 0.00 C ATOM 1075 CZ TYR A 69 -5.521 7.856 5.325 1.00 0.00 C ATOM 1076 OH TYR A 69 -5.762 9.168 5.662 1.00 0.00 O ATOM 0 H TYR A 69 -6.607 3.341 6.201 1.00 0.00 H new ATOM 0 HA TYR A 69 -4.310 1.847 5.072 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -3.780 3.715 3.761 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -5.496 3.444 3.529 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -7.160 5.004 4.603 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -2.964 5.752 4.755 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -7.595 7.347 5.213 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -3.399 8.090 5.361 1.00 0.00 H new ATOM 0 HH TYR A 69 -4.910 9.638 5.777 1.00 0.00 H new ATOM 1086 N ILE A 70 -2.710 2.842 6.720 1.00 0.00 N ATOM 1087 CA ILE A 70 -1.856 3.231 7.831 1.00 0.00 C ATOM 1088 C ILE A 70 -0.502 3.725 7.333 1.00 0.00 C ATOM 1089 O ILE A 70 0.147 3.075 6.511 1.00 0.00 O ATOM 1090 CB ILE A 70 -1.649 2.055 8.817 1.00 0.00 C ATOM 1091 CG1 ILE A 70 -3.002 1.577 9.356 1.00 0.00 C ATOM 1092 CG2 ILE A 70 -0.732 2.466 9.966 1.00 0.00 C ATOM 1093 CD1 ILE A 70 -2.908 0.376 10.271 1.00 0.00 C ATOM 0 H ILE A 70 -2.281 2.188 6.066 1.00 0.00 H new ATOM 0 HA ILE A 70 -2.358 4.044 8.356 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.173 1.234 8.281 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.477 2.396 9.896 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -3.651 1.331 8.515 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -0.601 1.624 10.646 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.238 2.766 9.568 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -1.177 3.302 10.505 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.906 0.098 10.611 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.463 -0.459 9.730 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.287 0.622 11.132 1.00 0.00 H new ATOM 1105 N ASP A 71 -0.096 4.890 7.825 1.00 0.00 N ATOM 1106 CA ASP A 71 1.222 5.433 7.540 1.00 0.00 C ATOM 1107 C ASP A 71 2.241 4.752 8.429 1.00 0.00 C ATOM 1108 O ASP A 71 2.318 5.054 9.616 1.00 0.00 O ATOM 1109 CB ASP A 71 1.280 6.940 7.815 1.00 0.00 C ATOM 1110 CG ASP A 71 0.527 7.788 6.812 1.00 0.00 C ATOM 1111 OD1 ASP A 71 1.130 8.171 5.788 1.00 0.00 O ATOM 1112 OD2 ASP A 71 -0.651 8.117 7.071 1.00 0.00 O ATOM 0 H ASP A 71 -0.669 5.480 8.429 1.00 0.00 H new ATOM 0 HA ASP A 71 1.436 5.258 6.486 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.877 7.131 8.810 1.00 0.00 H new ATOM 0 HB3 ASP A 71 2.323 7.255 7.828 1.00 0.00 H new ATOM 1117 N ALA A 72 3.027 3.855 7.869 1.00 0.00 N ATOM 1118 CA ALA A 72 4.021 3.121 8.648 1.00 0.00 C ATOM 1119 C ALA A 72 5.169 4.027 9.097 1.00 0.00 C ATOM 1120 O ALA A 72 6.130 3.570 9.713 1.00 0.00 O ATOM 1121 CB ALA A 72 4.555 1.945 7.849 1.00 0.00 C ATOM 0 H ALA A 72 3.002 3.612 6.879 1.00 0.00 H new ATOM 0 HA ALA A 72 3.528 2.746 9.545 1.00 0.00 H new ATOM 0 HB1 ALA A 72 5.295 1.408 8.443 1.00 0.00 H new ATOM 0 HB2 ALA A 72 3.734 1.273 7.597 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.020 2.309 6.933 1.00 0.00 H new ATOM 1127 N ALA A 73 5.061 5.313 8.781 1.00 0.00 N ATOM 1128 CA ALA A 73 6.059 6.291 9.186 1.00 0.00 C ATOM 1129 C ALA A 73 5.416 7.449 9.949 1.00 0.00 C ATOM 1130 O ALA A 73 6.069 8.452 10.246 1.00 0.00 O ATOM 1131 CB ALA A 73 6.807 6.803 7.962 1.00 0.00 C ATOM 0 H ALA A 73 4.287 5.702 8.243 1.00 0.00 H new ATOM 0 HA ALA A 73 6.768 5.806 9.857 1.00 0.00 H new ATOM 0 HB1 ALA A 73 7.553 7.535 8.271 1.00 0.00 H new ATOM 0 HB2 ALA A 73 7.302 5.970 7.463 1.00 0.00 H new ATOM 0 HB3 ALA A 73 6.103 7.271 7.275 1.00 0.00 H new ATOM 1137 N SER A 74 4.144 7.296 10.283 1.00 0.00 N ATOM 1138 CA SER A 74 3.403 8.348 10.970 1.00 0.00 C ATOM 1139 C SER A 74 2.457 7.766 12.023 1.00 0.00 C ATOM 1140 O SER A 74 2.181 8.401 13.041 1.00 0.00 O ATOM 1141 CB SER A 74 2.628 9.185 9.943 1.00 0.00 C ATOM 1142 OG SER A 74 1.800 10.154 10.559 1.00 0.00 O ATOM 0 H SER A 74 3.601 6.454 10.090 1.00 0.00 H new ATOM 0 HA SER A 74 4.113 8.990 11.492 1.00 0.00 H new ATOM 0 HB2 SER A 74 3.332 9.682 9.276 1.00 0.00 H new ATOM 0 HB3 SER A 74 2.017 8.526 9.327 1.00 0.00 H new ATOM 0 HG SER A 74 1.326 10.665 9.870 1.00 0.00 H new ATOM 1148 N MET A 75 1.980 6.553 11.785 1.00 0.00 N ATOM 1149 CA MET A 75 1.032 5.907 12.681 1.00 0.00 C ATOM 1150 C MET A 75 1.475 4.480 12.981 1.00 0.00 C ATOM 1151 O MET A 75 2.029 3.806 12.118 1.00 0.00 O ATOM 1152 CB MET A 75 -0.372 5.901 12.062 1.00 0.00 C ATOM 1153 CG MET A 75 -1.007 7.280 11.966 1.00 0.00 C ATOM 1154 SD MET A 75 -2.732 7.226 11.437 1.00 0.00 S ATOM 1155 CE MET A 75 -2.576 6.541 9.790 1.00 0.00 C ATOM 0 H MET A 75 2.236 5.993 10.972 1.00 0.00 H new ATOM 0 HA MET A 75 1.001 6.470 13.614 1.00 0.00 H new ATOM 0 HB2 MET A 75 -0.317 5.466 11.064 1.00 0.00 H new ATOM 0 HB3 MET A 75 -1.018 5.254 12.656 1.00 0.00 H new ATOM 0 HG2 MET A 75 -0.946 7.771 12.937 1.00 0.00 H new ATOM 0 HG3 MET A 75 -0.436 7.889 11.265 1.00 0.00 H new ATOM 0 HE1 MET A 75 -3.542 6.581 9.286 1.00 0.00 H new ATOM 0 HE2 MET A 75 -1.846 7.119 9.223 1.00 0.00 H new ATOM 0 HE3 MET A 75 -2.245 5.505 9.857 1.00 0.00 H new ATOM 1165 N PRO A 76 1.244 4.006 14.210 1.00 0.00 N ATOM 1166 CA PRO A 76 1.610 2.651 14.607 1.00 0.00 C ATOM 1167 C PRO A 76 0.561 1.624 14.202 1.00 0.00 C ATOM 1168 O PRO A 76 -0.593 1.965 13.940 1.00 0.00 O ATOM 1169 CB PRO A 76 1.691 2.754 16.125 1.00 0.00 C ATOM 1170 CG PRO A 76 0.687 3.795 16.484 1.00 0.00 C ATOM 1171 CD PRO A 76 0.622 4.754 15.319 1.00 0.00 C ATOM 0 HA PRO A 76 2.532 2.316 14.131 1.00 0.00 H new ATOM 0 HB2 PRO A 76 1.461 1.800 16.600 1.00 0.00 H new ATOM 0 HB3 PRO A 76 2.692 3.039 16.450 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -0.288 3.345 16.670 1.00 0.00 H new ATOM 0 HG3 PRO A 76 0.977 4.314 17.397 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -0.406 5.032 15.087 1.00 0.00 H new ATOM 0 HD3 PRO A 76 1.161 5.677 15.531 1.00 0.00 H new ATOM 1179 N LEU A 77 0.966 0.367 14.153 1.00 0.00 N ATOM 1180 CA LEU A 77 0.049 -0.710 13.830 1.00 0.00 C ATOM 1181 C LEU A 77 -0.564 -1.268 15.110 1.00 0.00 C ATOM 1182 O LEU A 77 0.091 -1.321 16.153 1.00 0.00 O ATOM 1183 CB LEU A 77 0.772 -1.815 13.050 1.00 0.00 C ATOM 1184 CG LEU A 77 -0.114 -2.968 12.575 1.00 0.00 C ATOM 1185 CD1 LEU A 77 -1.207 -2.462 11.647 1.00 0.00 C ATOM 1186 CD2 LEU A 77 0.721 -4.025 11.876 1.00 0.00 C ATOM 0 H LEU A 77 1.924 0.068 14.333 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.750 -0.318 13.200 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.254 -1.367 12.181 1.00 0.00 H new ATOM 0 HB3 LEU A 77 1.564 -2.222 13.679 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.586 -3.416 13.449 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.825 -3.299 11.322 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.827 -1.738 12.176 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.754 -1.986 10.777 1.00 0.00 H new ATOM 0 HD21 LEU A 77 0.075 -4.838 11.544 1.00 0.00 H new ATOM 0 HD22 LEU A 77 1.220 -3.583 11.014 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.468 -4.414 12.567 1.00 0.00 H new ATOM 1198 N THR A 78 -1.822 -1.670 15.031 1.00 0.00 N ATOM 1199 CA THR A 78 -2.540 -2.172 16.185 1.00 0.00 C ATOM 1200 C THR A 78 -3.241 -3.481 15.848 1.00 0.00 C ATOM 1201 O THR A 78 -3.399 -3.825 14.675 1.00 0.00 O ATOM 1202 CB THR A 78 -3.585 -1.148 16.673 1.00 0.00 C ATOM 1203 OG1 THR A 78 -4.416 -0.746 15.576 1.00 0.00 O ATOM 1204 CG2 THR A 78 -2.911 0.075 17.283 1.00 0.00 C ATOM 0 H THR A 78 -2.369 -1.657 14.170 1.00 0.00 H new ATOM 0 HA THR A 78 -1.813 -2.343 16.979 1.00 0.00 H new ATOM 0 HB THR A 78 -4.195 -1.621 17.442 1.00 0.00 H new ATOM 0 HG1 THR A 78 -5.080 -0.097 15.889 1.00 0.00 H new ATOM 0 HG21 THR A 78 -3.671 0.780 17.618 1.00 0.00 H new ATOM 0 HG22 THR A 78 -2.301 -0.232 18.132 1.00 0.00 H new ATOM 0 HG23 THR A 78 -2.278 0.553 16.535 1.00 0.00 H new ATOM 1212 N ASP A 79 -3.669 -4.199 16.877 1.00 0.00 N ATOM 1213 CA ASP A 79 -4.402 -5.451 16.704 1.00 0.00 C ATOM 1214 C ASP A 79 -5.778 -5.183 16.102 1.00 0.00 C ATOM 1215 O ASP A 79 -6.393 -6.061 15.498 1.00 0.00 O ATOM 1216 CB ASP A 79 -4.544 -6.173 18.049 1.00 0.00 C ATOM 1217 CG ASP A 79 -5.302 -5.355 19.080 1.00 0.00 C ATOM 1218 OD1 ASP A 79 -4.705 -4.416 19.656 1.00 0.00 O ATOM 1219 OD2 ASP A 79 -6.493 -5.643 19.317 1.00 0.00 O ATOM 0 H ASP A 79 -3.520 -3.934 17.851 1.00 0.00 H new ATOM 0 HA ASP A 79 -3.842 -6.089 16.021 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -5.059 -7.121 17.894 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -3.553 -6.408 18.436 1.00 0.00 H new ATOM 1224 N ALA A 80 -6.235 -3.945 16.255 1.00 0.00 N ATOM 1225 CA ALA A 80 -7.505 -3.502 15.700 1.00 0.00 C ATOM 1226 C ALA A 80 -7.525 -3.638 14.178 1.00 0.00 C ATOM 1227 O ALA A 80 -8.588 -3.730 13.567 1.00 0.00 O ATOM 1228 CB ALA A 80 -7.778 -2.064 16.112 1.00 0.00 C ATOM 0 H ALA A 80 -5.733 -3.221 16.768 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.293 -4.142 16.098 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -8.730 -1.740 15.693 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.819 -1.999 17.199 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -6.980 -1.421 15.740 1.00 0.00 H new ATOM 1234 N ALA A 81 -6.340 -3.633 13.570 1.00 0.00 N ATOM 1235 CA ALA A 81 -6.213 -3.739 12.120 1.00 0.00 C ATOM 1236 C ALA A 81 -6.812 -5.041 11.586 1.00 0.00 C ATOM 1237 O ALA A 81 -7.170 -5.123 10.413 1.00 0.00 O ATOM 1238 CB ALA A 81 -4.755 -3.626 11.711 1.00 0.00 C ATOM 0 H ALA A 81 -5.451 -3.556 14.063 1.00 0.00 H new ATOM 0 HA ALA A 81 -6.776 -2.915 11.681 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -4.674 -3.707 10.627 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.360 -2.663 12.034 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.183 -4.428 12.178 1.00 0.00 H new ATOM 1244 N PHE A 82 -6.943 -6.046 12.450 1.00 0.00 N ATOM 1245 CA PHE A 82 -7.497 -7.338 12.047 1.00 0.00 C ATOM 1246 C PHE A 82 -8.987 -7.246 11.729 1.00 0.00 C ATOM 1247 O PHE A 82 -9.564 -8.176 11.165 1.00 0.00 O ATOM 1248 CB PHE A 82 -7.269 -8.391 13.130 1.00 0.00 C ATOM 1249 CG PHE A 82 -5.891 -8.986 13.119 1.00 0.00 C ATOM 1250 CD1 PHE A 82 -5.531 -9.905 12.146 1.00 0.00 C ATOM 1251 CD2 PHE A 82 -4.962 -8.636 14.081 1.00 0.00 C ATOM 1252 CE1 PHE A 82 -4.269 -10.464 12.134 1.00 0.00 C ATOM 1253 CE2 PHE A 82 -3.697 -9.191 14.075 1.00 0.00 C ATOM 1254 CZ PHE A 82 -3.350 -10.106 13.099 1.00 0.00 C ATOM 0 H PHE A 82 -6.674 -5.991 13.432 1.00 0.00 H new ATOM 0 HA PHE A 82 -6.973 -7.636 11.139 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -7.452 -7.940 14.105 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -8.000 -9.190 13.006 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -6.247 -10.187 11.388 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.228 -7.921 14.845 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -4.001 -11.180 11.371 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -2.980 -8.910 14.832 1.00 0.00 H new ATOM 0 HZ PHE A 82 -2.361 -10.540 13.092 1.00 0.00 H new ATOM 1264 N GLU A 83 -9.611 -6.135 12.106 1.00 0.00 N ATOM 1265 CA GLU A 83 -11.013 -5.907 11.790 1.00 0.00 C ATOM 1266 C GLU A 83 -11.177 -5.616 10.306 1.00 0.00 C ATOM 1267 O GLU A 83 -12.210 -5.916 9.708 1.00 0.00 O ATOM 1268 CB GLU A 83 -11.565 -4.737 12.600 1.00 0.00 C ATOM 1269 CG GLU A 83 -11.527 -4.954 14.099 1.00 0.00 C ATOM 1270 CD GLU A 83 -12.215 -3.837 14.851 1.00 0.00 C ATOM 1271 OE1 GLU A 83 -11.562 -2.816 15.153 1.00 0.00 O ATOM 1272 OE2 GLU A 83 -13.428 -3.960 15.121 1.00 0.00 O ATOM 0 H GLU A 83 -9.167 -5.381 12.630 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.569 -6.809 12.046 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -10.995 -3.840 12.358 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -12.595 -4.552 12.296 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -12.007 -5.903 14.340 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -10.491 -5.028 14.428 1.00 0.00 H new ATOM 1279 N ALA A 84 -10.137 -5.042 9.720 1.00 0.00 N ATOM 1280 CA ALA A 84 -10.180 -4.607 8.339 1.00 0.00 C ATOM 1281 C ALA A 84 -9.873 -5.757 7.397 1.00 0.00 C ATOM 1282 O ALA A 84 -9.002 -6.581 7.666 1.00 0.00 O ATOM 1283 CB ALA A 84 -9.212 -3.457 8.114 1.00 0.00 C ATOM 0 H ALA A 84 -9.247 -4.867 10.187 1.00 0.00 H new ATOM 0 HA ALA A 84 -11.190 -4.257 8.124 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.257 -3.142 7.071 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.485 -2.621 8.758 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -8.199 -3.782 8.352 1.00 0.00 H new ATOM 1289 N GLU A 85 -10.620 -5.821 6.310 1.00 0.00 N ATOM 1290 CA GLU A 85 -10.380 -6.821 5.276 1.00 0.00 C ATOM 1291 C GLU A 85 -9.436 -6.251 4.216 1.00 0.00 C ATOM 1292 O GLU A 85 -8.650 -6.974 3.601 1.00 0.00 O ATOM 1293 CB GLU A 85 -11.706 -7.246 4.637 1.00 0.00 C ATOM 1294 CG GLU A 85 -11.632 -8.548 3.849 1.00 0.00 C ATOM 1295 CD GLU A 85 -11.157 -9.721 4.689 1.00 0.00 C ATOM 1296 OE1 GLU A 85 -11.723 -9.955 5.782 1.00 0.00 O ATOM 1297 OE2 GLU A 85 -10.216 -10.420 4.264 1.00 0.00 O ATOM 0 H GLU A 85 -11.400 -5.193 6.117 1.00 0.00 H new ATOM 0 HA GLU A 85 -9.916 -7.698 5.727 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.456 -7.351 5.420 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -12.047 -6.452 3.973 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -12.616 -8.776 3.440 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -10.958 -8.417 3.003 1.00 0.00 H new ATOM 1304 N TYR A 86 -9.527 -4.944 4.012 1.00 0.00 N ATOM 1305 CA TYR A 86 -8.668 -4.246 3.063 1.00 0.00 C ATOM 1306 C TYR A 86 -7.664 -3.368 3.813 1.00 0.00 C ATOM 1307 O TYR A 86 -8.048 -2.396 4.465 1.00 0.00 O ATOM 1308 CB TYR A 86 -9.506 -3.369 2.121 1.00 0.00 C ATOM 1309 CG TYR A 86 -10.564 -4.107 1.320 1.00 0.00 C ATOM 1310 CD1 TYR A 86 -11.716 -4.598 1.928 1.00 0.00 C ATOM 1311 CD2 TYR A 86 -10.422 -4.292 -0.049 1.00 0.00 C ATOM 1312 CE1 TYR A 86 -12.688 -5.257 1.197 1.00 0.00 C ATOM 1313 CE2 TYR A 86 -11.389 -4.950 -0.788 1.00 0.00 C ATOM 1314 CZ TYR A 86 -12.520 -5.431 -0.161 1.00 0.00 C ATOM 1315 OH TYR A 86 -13.483 -6.092 -0.895 1.00 0.00 O ATOM 0 H TYR A 86 -10.193 -4.341 4.495 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.133 -4.990 2.473 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -9.995 -2.594 2.711 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -8.834 -2.864 1.427 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -11.853 -4.462 2.991 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -9.540 -3.915 -0.546 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -13.574 -5.633 1.687 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -11.259 -5.087 -1.851 1.00 0.00 H new ATOM 0 HH TYR A 86 -13.210 -6.127 -1.836 1.00 0.00 H new ATOM 1325 N LEU A 87 -6.387 -3.714 3.728 1.00 0.00 N ATOM 1326 CA LEU A 87 -5.345 -2.960 4.420 1.00 0.00 C ATOM 1327 C LEU A 87 -4.406 -2.279 3.429 1.00 0.00 C ATOM 1328 O LEU A 87 -3.985 -2.880 2.441 1.00 0.00 O ATOM 1329 CB LEU A 87 -4.522 -3.866 5.352 1.00 0.00 C ATOM 1330 CG LEU A 87 -5.182 -4.255 6.681 1.00 0.00 C ATOM 1331 CD1 LEU A 87 -5.666 -3.021 7.422 1.00 0.00 C ATOM 1332 CD2 LEU A 87 -6.320 -5.236 6.458 1.00 0.00 C ATOM 0 H LEU A 87 -6.046 -4.510 3.189 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.849 -2.200 5.017 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.277 -4.780 4.811 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.580 -3.364 5.572 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.432 -4.749 7.299 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -6.131 -3.320 8.362 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -4.820 -2.365 7.628 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.395 -2.491 6.809 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -6.770 -5.495 7.416 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -7.073 -4.780 5.815 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.935 -6.138 5.983 1.00 0.00 H new ATOM 1344 N ALA A 88 -4.081 -1.024 3.703 1.00 0.00 N ATOM 1345 CA ALA A 88 -3.122 -0.282 2.898 1.00 0.00 C ATOM 1346 C ALA A 88 -2.025 0.295 3.790 1.00 0.00 C ATOM 1347 O ALA A 88 -2.311 0.996 4.758 1.00 0.00 O ATOM 1348 CB ALA A 88 -3.820 0.823 2.120 1.00 0.00 C ATOM 0 H ALA A 88 -4.471 -0.495 4.483 1.00 0.00 H new ATOM 0 HA ALA A 88 -2.664 -0.963 2.181 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.087 1.367 1.524 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.571 0.386 1.462 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.303 1.509 2.816 1.00 0.00 H new ATOM 1354 N VAL A 89 -0.776 -0.007 3.468 1.00 0.00 N ATOM 1355 CA VAL A 89 0.353 0.426 4.285 1.00 0.00 C ATOM 1356 C VAL A 89 1.365 1.205 3.447 1.00 0.00 C ATOM 1357 O VAL A 89 1.991 0.655 2.538 1.00 0.00 O ATOM 1358 CB VAL A 89 1.066 -0.773 4.954 1.00 0.00 C ATOM 1359 CG1 VAL A 89 2.207 -0.297 5.843 1.00 0.00 C ATOM 1360 CG2 VAL A 89 0.082 -1.612 5.758 1.00 0.00 C ATOM 0 H VAL A 89 -0.516 -0.551 2.645 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.050 1.073 5.064 1.00 0.00 H new ATOM 0 HB VAL A 89 1.482 -1.397 4.163 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.693 -1.157 6.303 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.932 0.252 5.242 1.00 0.00 H new ATOM 0 HG13 VAL A 89 1.813 0.356 6.622 1.00 0.00 H new ATOM 0 HG21 VAL A 89 0.608 -2.448 6.218 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -0.371 -0.996 6.535 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -0.697 -1.993 5.097 1.00 0.00 H new ATOM 1370 N ASP A 90 1.521 2.481 3.760 1.00 0.00 N ATOM 1371 CA ASP A 90 2.462 3.339 3.049 1.00 0.00 C ATOM 1372 C ASP A 90 3.661 3.624 3.947 1.00 0.00 C ATOM 1373 O ASP A 90 3.524 3.627 5.173 1.00 0.00 O ATOM 1374 CB ASP A 90 1.776 4.651 2.643 1.00 0.00 C ATOM 1375 CG ASP A 90 2.560 5.445 1.609 1.00 0.00 C ATOM 1376 OD1 ASP A 90 3.604 6.026 1.963 1.00 0.00 O ATOM 1377 OD2 ASP A 90 2.111 5.513 0.444 1.00 0.00 O ATOM 0 H ASP A 90 1.006 2.950 4.505 1.00 0.00 H new ATOM 0 HA ASP A 90 2.802 2.834 2.145 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.786 4.427 2.245 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.631 5.267 3.531 1.00 0.00 H new ATOM 1382 N GLN A 91 4.826 3.844 3.337 1.00 0.00 N ATOM 1383 CA GLN A 91 6.064 4.137 4.069 1.00 0.00 C ATOM 1384 C GLN A 91 6.523 2.935 4.891 1.00 0.00 C ATOM 1385 O GLN A 91 7.128 3.092 5.954 1.00 0.00 O ATOM 1386 CB GLN A 91 5.883 5.355 4.984 1.00 0.00 C ATOM 1387 CG GLN A 91 5.686 6.664 4.239 1.00 0.00 C ATOM 1388 CD GLN A 91 4.636 7.535 4.891 1.00 0.00 C ATOM 1389 OE1 GLN A 91 4.931 8.370 5.750 1.00 0.00 O ATOM 1390 NE2 GLN A 91 3.401 7.340 4.480 1.00 0.00 N ATOM 0 H GLN A 91 4.941 3.825 2.324 1.00 0.00 H new ATOM 0 HA GLN A 91 6.832 4.361 3.329 1.00 0.00 H new ATOM 0 HB2 GLN A 91 5.023 5.185 5.632 1.00 0.00 H new ATOM 0 HB3 GLN A 91 6.757 5.444 5.630 1.00 0.00 H new ATOM 0 HG2 GLN A 91 6.632 7.204 4.200 1.00 0.00 H new ATOM 0 HG3 GLN A 91 5.395 6.455 3.210 1.00 0.00 H new ATOM 0 HE21 GLN A 91 3.206 6.637 3.767 1.00 0.00 H new ATOM 0 HE22 GLN A 91 2.639 7.891 4.875 1.00 0.00 H new ATOM 1399 N VAL A 92 6.254 1.735 4.392 1.00 0.00 N ATOM 1400 CA VAL A 92 6.690 0.526 5.079 1.00 0.00 C ATOM 1401 C VAL A 92 8.203 0.369 4.966 1.00 0.00 C ATOM 1402 O VAL A 92 8.760 0.269 3.872 1.00 0.00 O ATOM 1403 CB VAL A 92 5.971 -0.731 4.525 1.00 0.00 C ATOM 1404 CG1 VAL A 92 6.101 -0.823 3.010 1.00 0.00 C ATOM 1405 CG2 VAL A 92 6.496 -1.996 5.182 1.00 0.00 C ATOM 0 H VAL A 92 5.742 1.573 3.525 1.00 0.00 H new ATOM 0 HA VAL A 92 6.423 0.624 6.131 1.00 0.00 H new ATOM 0 HB VAL A 92 4.913 -0.634 4.767 1.00 0.00 H new ATOM 0 HG11 VAL A 92 5.586 -1.715 2.654 1.00 0.00 H new ATOM 0 HG12 VAL A 92 5.655 0.060 2.552 1.00 0.00 H new ATOM 0 HG13 VAL A 92 7.155 -0.880 2.738 1.00 0.00 H new ATOM 0 HG21 VAL A 92 5.974 -2.861 4.774 1.00 0.00 H new ATOM 0 HG22 VAL A 92 7.564 -2.091 4.986 1.00 0.00 H new ATOM 0 HG23 VAL A 92 6.327 -1.944 6.258 1.00 0.00 H new ATOM 1415 N GLU A 93 8.838 0.350 6.130 1.00 0.00 N ATOM 1416 CA GLU A 93 10.286 0.224 6.266 1.00 0.00 C ATOM 1417 C GLU A 93 10.643 0.420 7.731 1.00 0.00 C ATOM 1418 O GLU A 93 11.569 -0.196 8.260 1.00 0.00 O ATOM 1419 CB GLU A 93 11.043 1.254 5.404 1.00 0.00 C ATOM 1420 CG GLU A 93 10.660 2.700 5.685 1.00 0.00 C ATOM 1421 CD GLU A 93 11.551 3.695 4.969 1.00 0.00 C ATOM 1422 OE1 GLU A 93 11.287 4.003 3.790 1.00 0.00 O ATOM 1423 OE2 GLU A 93 12.521 4.182 5.592 1.00 0.00 O ATOM 0 H GLU A 93 8.353 0.423 7.024 1.00 0.00 H new ATOM 0 HA GLU A 93 10.584 -0.765 5.918 1.00 0.00 H new ATOM 0 HB2 GLU A 93 12.114 1.134 5.570 1.00 0.00 H new ATOM 0 HB3 GLU A 93 10.857 1.038 4.352 1.00 0.00 H new ATOM 0 HG2 GLU A 93 9.626 2.862 5.382 1.00 0.00 H new ATOM 0 HG3 GLU A 93 10.710 2.882 6.759 1.00 0.00 H new ATOM 1430 N LYS A 94 9.864 1.277 8.386 1.00 0.00 N ATOM 1431 CA LYS A 94 10.091 1.632 9.776 1.00 0.00 C ATOM 1432 C LYS A 94 9.373 0.685 10.730 1.00 0.00 C ATOM 1433 O LYS A 94 9.222 0.992 11.914 1.00 0.00 O ATOM 1434 CB LYS A 94 9.634 3.068 10.022 1.00 0.00 C ATOM 1435 CG LYS A 94 10.471 4.103 9.289 1.00 0.00 C ATOM 1436 CD LYS A 94 11.909 4.106 9.785 1.00 0.00 C ATOM 1437 CE LYS A 94 12.003 4.624 11.211 1.00 0.00 C ATOM 1438 NZ LYS A 94 13.356 4.418 11.788 1.00 0.00 N ATOM 0 H LYS A 94 9.060 1.742 7.965 1.00 0.00 H new ATOM 0 HA LYS A 94 11.160 1.546 9.972 1.00 0.00 H new ATOM 0 HB2 LYS A 94 8.594 3.168 9.713 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.670 3.274 11.092 1.00 0.00 H new ATOM 0 HG2 LYS A 94 10.454 3.895 8.219 1.00 0.00 H new ATOM 0 HG3 LYS A 94 10.034 5.092 9.429 1.00 0.00 H new ATOM 0 HD2 LYS A 94 12.314 3.095 9.736 1.00 0.00 H new ATOM 0 HD3 LYS A 94 12.520 4.727 9.130 1.00 0.00 H new ATOM 0 HE2 LYS A 94 11.759 5.686 11.228 1.00 0.00 H new ATOM 0 HE3 LYS A 94 11.263 4.117 11.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 13.378 4.785 12.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 13.579 3.402 11.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 14.060 4.923 11.212 1.00 0.00 H new ATOM 1452 N LEU A 95 8.915 -0.457 10.222 1.00 0.00 N ATOM 1453 CA LEU A 95 8.340 -1.478 11.085 1.00 0.00 C ATOM 1454 C LEU A 95 9.390 -1.945 12.090 1.00 0.00 C ATOM 1455 O LEU A 95 10.538 -2.204 11.723 1.00 0.00 O ATOM 1456 CB LEU A 95 7.832 -2.660 10.254 1.00 0.00 C ATOM 1457 CG LEU A 95 6.700 -2.336 9.273 1.00 0.00 C ATOM 1458 CD1 LEU A 95 6.293 -3.585 8.507 1.00 0.00 C ATOM 1459 CD2 LEU A 95 5.501 -1.754 10.010 1.00 0.00 C ATOM 0 H LEU A 95 8.931 -0.694 9.230 1.00 0.00 H new ATOM 0 HA LEU A 95 7.493 -1.054 11.623 1.00 0.00 H new ATOM 0 HB2 LEU A 95 8.669 -3.074 9.692 1.00 0.00 H new ATOM 0 HB3 LEU A 95 7.488 -3.439 10.934 1.00 0.00 H new ATOM 0 HG LEU A 95 7.062 -1.592 8.563 1.00 0.00 H new ATOM 0 HD11 LEU A 95 5.488 -3.341 7.814 1.00 0.00 H new ATOM 0 HD12 LEU A 95 7.149 -3.965 7.950 1.00 0.00 H new ATOM 0 HD13 LEU A 95 5.950 -4.346 9.208 1.00 0.00 H new ATOM 0 HD21 LEU A 95 4.708 -1.531 9.296 1.00 0.00 H new ATOM 0 HD22 LEU A 95 5.138 -2.476 10.741 1.00 0.00 H new ATOM 0 HD23 LEU A 95 5.798 -0.838 10.521 1.00 0.00 H new ATOM 1471 N GLY A 96 9.000 -2.038 13.354 1.00 0.00 N ATOM 1472 CA GLY A 96 9.951 -2.361 14.394 1.00 0.00 C ATOM 1473 C GLY A 96 9.956 -3.825 14.767 1.00 0.00 C ATOM 1474 O GLY A 96 10.765 -4.602 14.253 1.00 0.00 O ATOM 0 H GLY A 96 8.043 -1.895 13.676 1.00 0.00 H new ATOM 0 HA2 GLY A 96 10.950 -2.074 14.065 1.00 0.00 H new ATOM 0 HA3 GLY A 96 9.725 -1.768 15.280 1.00 0.00 H new ATOM 1478 N ASN A 97 9.052 -4.212 15.653 1.00 0.00 N ATOM 1479 CA ASN A 97 9.059 -5.563 16.194 1.00 0.00 C ATOM 1480 C ASN A 97 7.645 -6.118 16.315 1.00 0.00 C ATOM 1481 O ASN A 97 7.242 -6.981 15.533 1.00 0.00 O ATOM 1482 CB ASN A 97 9.741 -5.576 17.564 1.00 0.00 C ATOM 1483 CG ASN A 97 9.878 -6.970 18.148 1.00 0.00 C ATOM 1484 OD1 ASN A 97 10.152 -7.956 17.304 1.00 0.00 O flip ATOM 1485 ND2 ASN A 97 9.770 -7.153 19.359 1.00 0.00 N flip ATOM 0 H ASN A 97 8.308 -3.614 16.012 1.00 0.00 H new ATOM 0 HA ASN A 97 9.616 -6.198 15.505 1.00 0.00 H new ATOM 0 HB2 ASN A 97 10.730 -5.127 17.475 1.00 0.00 H new ATOM 0 HB3 ASN A 97 9.170 -4.954 18.253 1.00 0.00 H new ATOM 0 HD21 ASN A 97 9.558 -6.369 19.976 1.00 0.00 H new ATOM 0 HD22 ASN A 97 9.892 -8.089 19.746 1.00 0.00 H new ATOM 1492 N GLU A 98 6.889 -5.607 17.280 1.00 0.00 N ATOM 1493 CA GLU A 98 5.540 -6.103 17.539 1.00 0.00 C ATOM 1494 C GLU A 98 4.636 -5.851 16.341 1.00 0.00 C ATOM 1495 O GLU A 98 3.878 -6.725 15.927 1.00 0.00 O ATOM 1496 CB GLU A 98 4.944 -5.434 18.778 1.00 0.00 C ATOM 1497 CG GLU A 98 3.552 -5.942 19.124 1.00 0.00 C ATOM 1498 CD GLU A 98 2.958 -5.263 20.338 1.00 0.00 C ATOM 1499 OE1 GLU A 98 2.429 -4.144 20.199 1.00 0.00 O ATOM 1500 OE2 GLU A 98 3.001 -5.856 21.436 1.00 0.00 O ATOM 0 H GLU A 98 7.186 -4.850 17.896 1.00 0.00 H new ATOM 0 HA GLU A 98 5.608 -7.177 17.715 1.00 0.00 H new ATOM 0 HB2 GLU A 98 5.606 -5.602 19.627 1.00 0.00 H new ATOM 0 HB3 GLU A 98 4.901 -4.357 18.616 1.00 0.00 H new ATOM 0 HG2 GLU A 98 2.893 -5.788 18.270 1.00 0.00 H new ATOM 0 HG3 GLU A 98 3.597 -7.016 19.302 1.00 0.00 H new ATOM 1507 N GLU A 99 4.741 -4.657 15.781 1.00 0.00 N ATOM 1508 CA GLU A 99 3.919 -4.267 14.644 1.00 0.00 C ATOM 1509 C GLU A 99 4.279 -5.108 13.430 1.00 0.00 C ATOM 1510 O GLU A 99 3.433 -5.412 12.595 1.00 0.00 O ATOM 1511 CB GLU A 99 4.095 -2.779 14.307 1.00 0.00 C ATOM 1512 CG GLU A 99 4.670 -1.939 15.438 1.00 0.00 C ATOM 1513 CD GLU A 99 6.184 -2.013 15.506 1.00 0.00 C ATOM 1514 OE1 GLU A 99 6.849 -1.218 14.815 1.00 0.00 O ATOM 1515 OE2 GLU A 99 6.713 -2.875 16.237 1.00 0.00 O ATOM 0 H GLU A 99 5.391 -3.937 16.096 1.00 0.00 H new ATOM 0 HA GLU A 99 2.876 -4.435 14.914 1.00 0.00 H new ATOM 0 HB2 GLU A 99 4.747 -2.691 13.438 1.00 0.00 H new ATOM 0 HB3 GLU A 99 3.127 -2.367 14.022 1.00 0.00 H new ATOM 0 HG2 GLU A 99 4.366 -0.901 15.306 1.00 0.00 H new ATOM 0 HG3 GLU A 99 4.250 -2.276 16.386 1.00 0.00 H new ATOM 1522 N GLN A 100 5.543 -5.491 13.347 1.00 0.00 N ATOM 1523 CA GLN A 100 6.022 -6.289 12.234 1.00 0.00 C ATOM 1524 C GLN A 100 5.501 -7.718 12.349 1.00 0.00 C ATOM 1525 O GLN A 100 5.065 -8.308 11.362 1.00 0.00 O ATOM 1526 CB GLN A 100 7.548 -6.271 12.196 1.00 0.00 C ATOM 1527 CG GLN A 100 8.135 -6.859 10.927 1.00 0.00 C ATOM 1528 CD GLN A 100 9.625 -6.624 10.826 1.00 0.00 C ATOM 1529 OE1 GLN A 100 10.070 -5.613 10.285 1.00 0.00 O ATOM 1530 NE2 GLN A 100 10.408 -7.557 11.338 1.00 0.00 N ATOM 0 H GLN A 100 6.256 -5.261 14.039 1.00 0.00 H new ATOM 0 HA GLN A 100 5.649 -5.862 11.303 1.00 0.00 H new ATOM 0 HB2 GLN A 100 7.893 -5.242 12.302 1.00 0.00 H new ATOM 0 HB3 GLN A 100 7.930 -6.825 13.053 1.00 0.00 H new ATOM 0 HG2 GLN A 100 7.935 -7.930 10.898 1.00 0.00 H new ATOM 0 HG3 GLN A 100 7.640 -6.419 10.061 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.999 -8.381 11.778 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.422 -7.453 11.293 1.00 0.00 H new ATOM 1539 N ALA A 101 5.528 -8.258 13.563 1.00 0.00 N ATOM 1540 CA ALA A 101 4.977 -9.583 13.823 1.00 0.00 C ATOM 1541 C ALA A 101 3.459 -9.565 13.660 1.00 0.00 C ATOM 1542 O ALA A 101 2.858 -10.537 13.200 1.00 0.00 O ATOM 1543 CB ALA A 101 5.356 -10.050 15.221 1.00 0.00 C ATOM 0 H ALA A 101 5.926 -7.798 14.382 1.00 0.00 H new ATOM 0 HA ALA A 101 5.396 -10.283 13.100 1.00 0.00 H new ATOM 0 HB1 ALA A 101 4.937 -11.040 15.400 1.00 0.00 H new ATOM 0 HB2 ALA A 101 6.442 -10.094 15.308 1.00 0.00 H new ATOM 0 HB3 ALA A 101 4.961 -9.351 15.958 1.00 0.00 H new ATOM 1549 N LEU A 102 2.852 -8.446 14.048 1.00 0.00 N ATOM 1550 CA LEU A 102 1.421 -8.230 13.868 1.00 0.00 C ATOM 1551 C LEU A 102 1.089 -8.273 12.379 1.00 0.00 C ATOM 1552 O LEU A 102 0.175 -8.978 11.953 1.00 0.00 O ATOM 1553 CB LEU A 102 1.026 -6.871 14.482 1.00 0.00 C ATOM 1554 CG LEU A 102 -0.444 -6.696 14.886 1.00 0.00 C ATOM 1555 CD1 LEU A 102 -1.351 -6.635 13.669 1.00 0.00 C ATOM 1556 CD2 LEU A 102 -0.875 -7.816 15.819 1.00 0.00 C ATOM 0 H LEU A 102 3.337 -7.667 14.494 1.00 0.00 H new ATOM 0 HA LEU A 102 0.856 -9.014 14.373 1.00 0.00 H new ATOM 0 HB2 LEU A 102 1.643 -6.705 15.365 1.00 0.00 H new ATOM 0 HB3 LEU A 102 1.277 -6.089 13.766 1.00 0.00 H new ATOM 0 HG LEU A 102 -0.535 -5.747 15.414 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -2.385 -6.511 13.992 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.063 -5.791 13.042 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -1.257 -7.559 13.099 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -1.920 -7.677 16.096 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -0.758 -8.775 15.315 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -0.257 -7.800 16.716 1.00 0.00 H new ATOM 1568 N LEU A 103 1.859 -7.523 11.598 1.00 0.00 N ATOM 1569 CA LEU A 103 1.713 -7.494 10.146 1.00 0.00 C ATOM 1570 C LEU A 103 1.885 -8.903 9.574 1.00 0.00 C ATOM 1571 O LEU A 103 1.111 -9.338 8.721 1.00 0.00 O ATOM 1572 CB LEU A 103 2.755 -6.536 9.549 1.00 0.00 C ATOM 1573 CG LEU A 103 2.417 -5.918 8.185 1.00 0.00 C ATOM 1574 CD1 LEU A 103 2.414 -6.961 7.081 1.00 0.00 C ATOM 1575 CD2 LEU A 103 1.077 -5.196 8.237 1.00 0.00 C ATOM 0 H LEU A 103 2.601 -6.919 11.952 1.00 0.00 H new ATOM 0 HA LEU A 103 0.716 -7.139 9.886 1.00 0.00 H new ATOM 0 HB2 LEU A 103 2.919 -5.726 10.259 1.00 0.00 H new ATOM 0 HB3 LEU A 103 3.698 -7.074 9.455 1.00 0.00 H new ATOM 0 HG LEU A 103 3.197 -5.193 7.954 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.171 -6.485 6.131 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.399 -7.422 7.014 1.00 0.00 H new ATOM 0 HD13 LEU A 103 1.670 -7.725 7.305 1.00 0.00 H new ATOM 0 HD21 LEU A 103 0.857 -4.766 7.260 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.293 -5.903 8.507 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.120 -4.401 8.982 1.00 0.00 H new ATOM 1587 N PHE A 104 2.905 -9.606 10.055 1.00 0.00 N ATOM 1588 CA PHE A 104 3.145 -10.997 9.671 1.00 0.00 C ATOM 1589 C PHE A 104 1.905 -11.856 9.920 1.00 0.00 C ATOM 1590 O PHE A 104 1.498 -12.646 9.063 1.00 0.00 O ATOM 1591 CB PHE A 104 4.335 -11.562 10.454 1.00 0.00 C ATOM 1592 CG PHE A 104 4.617 -13.012 10.171 1.00 0.00 C ATOM 1593 CD1 PHE A 104 5.316 -13.389 9.036 1.00 0.00 C ATOM 1594 CD2 PHE A 104 4.179 -13.999 11.041 1.00 0.00 C ATOM 1595 CE1 PHE A 104 5.572 -14.721 8.774 1.00 0.00 C ATOM 1596 CE2 PHE A 104 4.432 -15.332 10.782 1.00 0.00 C ATOM 1597 CZ PHE A 104 5.129 -15.693 9.646 1.00 0.00 C ATOM 0 H PHE A 104 3.585 -9.233 10.717 1.00 0.00 H new ATOM 0 HA PHE A 104 3.371 -11.020 8.605 1.00 0.00 H new ATOM 0 HB2 PHE A 104 5.224 -10.976 10.218 1.00 0.00 H new ATOM 0 HB3 PHE A 104 4.147 -11.440 11.521 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.665 -12.633 8.348 1.00 0.00 H new ATOM 0 HD2 PHE A 104 3.634 -13.722 11.931 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.119 -15.001 7.886 1.00 0.00 H new ATOM 0 HE2 PHE A 104 4.085 -16.091 11.467 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.327 -16.735 9.441 1.00 0.00 H new ATOM 1607 N SER A 105 1.314 -11.695 11.096 1.00 0.00 N ATOM 1608 CA SER A 105 0.107 -12.427 11.459 1.00 0.00 C ATOM 1609 C SER A 105 -1.037 -12.069 10.510 1.00 0.00 C ATOM 1610 O SER A 105 -1.842 -12.925 10.136 1.00 0.00 O ATOM 1611 CB SER A 105 -0.282 -12.121 12.909 1.00 0.00 C ATOM 1612 OG SER A 105 -1.233 -13.057 13.395 1.00 0.00 O ATOM 0 H SER A 105 1.653 -11.060 11.819 1.00 0.00 H new ATOM 0 HA SER A 105 0.306 -13.495 11.372 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.607 -12.142 13.539 1.00 0.00 H new ATOM 0 HB3 SER A 105 -0.694 -11.114 12.973 1.00 0.00 H new ATOM 0 HG SER A 105 -1.462 -12.839 14.322 1.00 0.00 H new ATOM 1618 N ILE A 106 -1.095 -10.799 10.119 1.00 0.00 N ATOM 1619 CA ILE A 106 -2.070 -10.341 9.136 1.00 0.00 C ATOM 1620 C ILE A 106 -1.901 -11.110 7.825 1.00 0.00 C ATOM 1621 O ILE A 106 -2.879 -11.595 7.252 1.00 0.00 O ATOM 1622 CB ILE A 106 -1.943 -8.820 8.875 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -2.257 -8.033 10.151 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -2.868 -8.389 7.747 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -2.107 -6.533 9.997 1.00 0.00 C ATOM 0 H ILE A 106 -0.476 -10.068 10.469 1.00 0.00 H new ATOM 0 HA ILE A 106 -3.063 -10.532 9.542 1.00 0.00 H new ATOM 0 HB ILE A 106 -0.916 -8.608 8.577 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -3.277 -8.257 10.463 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -1.598 -8.375 10.949 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -2.763 -7.317 7.580 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -2.605 -8.926 6.836 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -3.900 -8.615 8.016 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -2.346 -6.045 10.942 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -1.081 -6.297 9.716 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -2.786 -6.177 9.222 1.00 0.00 H new ATOM 1637 N PHE A 107 -0.654 -11.237 7.373 1.00 0.00 N ATOM 1638 CA PHE A 107 -0.340 -12.014 6.175 1.00 0.00 C ATOM 1639 C PHE A 107 -0.839 -13.448 6.305 1.00 0.00 C ATOM 1640 O PHE A 107 -1.405 -14.004 5.362 1.00 0.00 O ATOM 1641 CB PHE A 107 1.169 -12.030 5.912 1.00 0.00 C ATOM 1642 CG PHE A 107 1.628 -11.035 4.885 1.00 0.00 C ATOM 1643 CD1 PHE A 107 1.264 -11.181 3.556 1.00 0.00 C ATOM 1644 CD2 PHE A 107 2.437 -9.971 5.240 1.00 0.00 C ATOM 1645 CE1 PHE A 107 1.699 -10.283 2.602 1.00 0.00 C ATOM 1646 CE2 PHE A 107 2.874 -9.068 4.290 1.00 0.00 C ATOM 1647 CZ PHE A 107 2.505 -9.225 2.970 1.00 0.00 C ATOM 0 H PHE A 107 0.157 -10.810 7.820 1.00 0.00 H new ATOM 0 HA PHE A 107 -0.846 -11.534 5.337 1.00 0.00 H new ATOM 0 HB2 PHE A 107 1.691 -11.835 6.849 1.00 0.00 H new ATOM 0 HB3 PHE A 107 1.459 -13.029 5.588 1.00 0.00 H new ATOM 0 HD1 PHE A 107 0.633 -12.007 3.263 1.00 0.00 H new ATOM 0 HD2 PHE A 107 2.731 -9.845 6.272 1.00 0.00 H new ATOM 0 HE1 PHE A 107 1.409 -10.408 1.569 1.00 0.00 H new ATOM 0 HE2 PHE A 107 3.504 -8.240 4.580 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.846 -8.521 2.226 1.00 0.00 H new ATOM 1657 N ASN A 108 -0.623 -14.041 7.473 1.00 0.00 N ATOM 1658 CA ASN A 108 -1.066 -15.404 7.728 1.00 0.00 C ATOM 1659 C ASN A 108 -2.586 -15.491 7.663 1.00 0.00 C ATOM 1660 O ASN A 108 -3.129 -16.363 6.996 1.00 0.00 O ATOM 1661 CB ASN A 108 -0.572 -15.895 9.089 1.00 0.00 C ATOM 1662 CG ASN A 108 -0.900 -17.357 9.329 1.00 0.00 C ATOM 1663 OD1 ASN A 108 -0.949 -18.159 8.395 1.00 0.00 O ATOM 1664 ND2 ASN A 108 -1.130 -17.713 10.582 1.00 0.00 N ATOM 0 H ASN A 108 -0.144 -13.599 8.257 1.00 0.00 H new ATOM 0 HA ASN A 108 -0.641 -16.045 6.956 1.00 0.00 H new ATOM 0 HB2 ASN A 108 0.507 -15.752 9.155 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -1.022 -15.290 9.876 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -1.358 -18.682 10.803 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -1.080 -17.018 11.327 1.00 0.00 H new ATOM 1671 N ARG A 109 -3.267 -14.563 8.331 1.00 0.00 N ATOM 1672 CA ARG A 109 -4.729 -14.550 8.352 1.00 0.00 C ATOM 1673 C ARG A 109 -5.282 -14.401 6.935 1.00 0.00 C ATOM 1674 O ARG A 109 -6.346 -14.931 6.612 1.00 0.00 O ATOM 1675 CB ARG A 109 -5.243 -13.411 9.245 1.00 0.00 C ATOM 1676 CG ARG A 109 -6.707 -13.554 9.654 1.00 0.00 C ATOM 1677 CD ARG A 109 -7.588 -12.458 9.066 1.00 0.00 C ATOM 1678 NE ARG A 109 -7.695 -12.552 7.611 1.00 0.00 N ATOM 1679 CZ ARG A 109 -8.533 -11.825 6.869 1.00 0.00 C ATOM 1680 NH1 ARG A 109 -9.410 -11.008 7.435 1.00 0.00 N ATOM 1681 NH2 ARG A 109 -8.516 -11.942 5.550 1.00 0.00 N ATOM 0 H ARG A 109 -2.831 -13.811 8.865 1.00 0.00 H new ATOM 0 HA ARG A 109 -5.075 -15.498 8.763 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -4.628 -13.363 10.144 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -5.114 -12.465 8.719 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -7.078 -14.526 9.330 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -6.781 -13.531 10.741 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -8.583 -12.520 9.506 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -7.181 -11.484 9.336 1.00 0.00 H new ATOM 0 HE ARG A 109 -7.089 -13.217 7.131 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -9.451 -10.928 8.451 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -10.044 -10.459 6.854 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -7.864 -12.587 5.104 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -9.155 -11.388 4.981 1.00 0.00 H new ATOM 1695 N PHE A 110 -4.564 -13.664 6.097 1.00 0.00 N ATOM 1696 CA PHE A 110 -4.954 -13.493 4.702 1.00 0.00 C ATOM 1697 C PHE A 110 -4.790 -14.800 3.928 1.00 0.00 C ATOM 1698 O PHE A 110 -5.750 -15.323 3.355 1.00 0.00 O ATOM 1699 CB PHE A 110 -4.116 -12.391 4.041 1.00 0.00 C ATOM 1700 CG PHE A 110 -4.482 -10.987 4.455 1.00 0.00 C ATOM 1701 CD1 PHE A 110 -5.431 -10.753 5.440 1.00 0.00 C ATOM 1702 CD2 PHE A 110 -3.879 -9.898 3.845 1.00 0.00 C ATOM 1703 CE1 PHE A 110 -5.769 -9.463 5.806 1.00 0.00 C ATOM 1704 CE2 PHE A 110 -4.212 -8.607 4.208 1.00 0.00 C ATOM 1705 CZ PHE A 110 -5.159 -8.389 5.189 1.00 0.00 C ATOM 0 H PHE A 110 -3.708 -13.175 6.359 1.00 0.00 H new ATOM 0 HA PHE A 110 -6.004 -13.203 4.680 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -3.065 -12.562 4.276 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -4.219 -12.475 2.959 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -5.912 -11.589 5.927 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -3.139 -10.061 3.076 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -6.510 -9.296 6.574 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -3.732 -7.769 3.725 1.00 0.00 H new ATOM 0 HZ PHE A 110 -5.422 -7.381 5.473 1.00 0.00 H new ATOM 1715 N ARG A 111 -3.579 -15.343 3.960 1.00 0.00 N ATOM 1716 CA ARG A 111 -3.240 -16.536 3.189 1.00 0.00 C ATOM 1717 C ARG A 111 -4.002 -17.761 3.701 1.00 0.00 C ATOM 1718 O ARG A 111 -4.371 -18.645 2.928 1.00 0.00 O ATOM 1719 CB ARG A 111 -1.729 -16.783 3.258 1.00 0.00 C ATOM 1720 CG ARG A 111 -1.246 -17.951 2.410 1.00 0.00 C ATOM 1721 CD ARG A 111 -1.497 -17.720 0.926 1.00 0.00 C ATOM 1722 NE ARG A 111 -0.916 -18.783 0.106 1.00 0.00 N ATOM 1723 CZ ARG A 111 -0.932 -18.800 -1.228 1.00 0.00 C ATOM 1724 NH1 ARG A 111 -1.497 -17.810 -1.911 1.00 0.00 N ATOM 1725 NH2 ARG A 111 -0.381 -19.812 -1.883 1.00 0.00 N ATOM 0 H ARG A 111 -2.808 -14.973 4.516 1.00 0.00 H new ATOM 0 HA ARG A 111 -3.533 -16.371 2.152 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -1.210 -15.879 2.940 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -1.449 -16.963 4.296 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -0.180 -18.105 2.578 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -1.753 -18.863 2.726 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -2.570 -17.665 0.743 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -1.073 -16.760 0.631 1.00 0.00 H new ATOM 0 HE ARG A 111 -0.469 -19.564 0.586 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -1.924 -17.027 -1.416 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -1.504 -17.833 -2.931 1.00 0.00 H new ATOM 0 HH21 ARG A 111 0.055 -20.577 -1.367 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -0.393 -19.826 -2.903 1.00 0.00 H new ATOM 1739 N ASN A 112 -4.234 -17.800 5.005 1.00 0.00 N ATOM 1740 CA ASN A 112 -4.936 -18.913 5.636 1.00 0.00 C ATOM 1741 C ASN A 112 -6.389 -18.965 5.184 1.00 0.00 C ATOM 1742 O ASN A 112 -6.878 -20.002 4.744 1.00 0.00 O ATOM 1743 CB ASN A 112 -4.888 -18.770 7.158 1.00 0.00 C ATOM 1744 CG ASN A 112 -4.393 -20.021 7.851 1.00 0.00 C ATOM 1745 OD1 ASN A 112 -5.170 -20.921 8.168 1.00 0.00 O ATOM 1746 ND2 ASN A 112 -3.097 -20.075 8.112 1.00 0.00 N ATOM 0 H ASN A 112 -3.944 -17.068 5.653 1.00 0.00 H new ATOM 0 HA ASN A 112 -4.440 -19.836 5.337 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -4.238 -17.935 7.419 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -5.884 -18.526 7.527 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -2.707 -20.885 8.594 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -2.488 -19.306 7.831 1.00 0.00 H new ATOM 1753 N SER A 113 -7.064 -17.827 5.283 1.00 0.00 N ATOM 1754 CA SER A 113 -8.488 -17.745 4.989 1.00 0.00 C ATOM 1755 C SER A 113 -8.758 -17.799 3.486 1.00 0.00 C ATOM 1756 O SER A 113 -9.810 -18.272 3.053 1.00 0.00 O ATOM 1757 CB SER A 113 -9.056 -16.453 5.590 1.00 0.00 C ATOM 1758 OG SER A 113 -10.426 -16.276 5.273 1.00 0.00 O ATOM 0 H SER A 113 -6.644 -16.942 5.567 1.00 0.00 H new ATOM 0 HA SER A 113 -8.983 -18.607 5.437 1.00 0.00 H new ATOM 0 HB2 SER A 113 -8.934 -16.473 6.673 1.00 0.00 H new ATOM 0 HB3 SER A 113 -8.486 -15.601 5.221 1.00 0.00 H new ATOM 0 HG SER A 113 -10.830 -15.649 5.908 1.00 0.00 H new ATOM 1764 N GLY A 114 -7.810 -17.322 2.693 1.00 0.00 N ATOM 1765 CA GLY A 114 -8.041 -17.208 1.266 1.00 0.00 C ATOM 1766 C GLY A 114 -8.682 -15.877 0.967 1.00 0.00 C ATOM 1767 O GLY A 114 -9.391 -15.703 -0.025 1.00 0.00 O ATOM 0 H GLY A 114 -6.890 -17.013 3.008 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -7.099 -17.300 0.726 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -8.685 -18.019 0.925 1.00 0.00 H new ATOM 1771 N LYS A 115 -8.424 -14.945 1.868 1.00 0.00 N ATOM 1772 CA LYS A 115 -8.988 -13.618 1.827 1.00 0.00 C ATOM 1773 C LYS A 115 -7.882 -12.596 2.012 1.00 0.00 C ATOM 1774 O LYS A 115 -6.700 -12.917 1.890 1.00 0.00 O ATOM 1775 CB LYS A 115 -9.998 -13.456 2.957 1.00 0.00 C ATOM 1776 CG LYS A 115 -11.451 -13.623 2.547 1.00 0.00 C ATOM 1777 CD LYS A 115 -12.381 -12.945 3.544 1.00 0.00 C ATOM 1778 CE LYS A 115 -12.115 -13.402 4.971 1.00 0.00 C ATOM 1779 NZ LYS A 115 -12.761 -12.509 5.969 1.00 0.00 N ATOM 0 H LYS A 115 -7.803 -15.098 2.663 1.00 0.00 H new ATOM 0 HA LYS A 115 -9.481 -13.467 0.866 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -9.770 -14.184 3.736 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -9.872 -12.467 3.398 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -11.604 -13.198 1.555 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -11.694 -14.683 2.481 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -12.256 -11.864 3.480 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -13.416 -13.162 3.280 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -12.484 -14.419 5.101 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -11.040 -13.428 5.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -12.792 -12.986 6.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -12.214 -11.628 6.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -13.729 -12.287 5.661 1.00 0.00 H new ATOM 1793 N GLY A 116 -8.269 -11.375 2.322 1.00 0.00 N ATOM 1794 CA GLY A 116 -7.300 -10.359 2.642 1.00 0.00 C ATOM 1795 C GLY A 116 -6.866 -9.564 1.440 1.00 0.00 C ATOM 1796 O GLY A 116 -6.428 -10.122 0.434 1.00 0.00 O ATOM 0 H GLY A 116 -9.241 -11.068 2.358 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -7.722 -9.683 3.385 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -6.427 -10.827 3.096 1.00 0.00 H new ATOM 1800 N PHE A 117 -6.998 -8.262 1.543 1.00 0.00 N ATOM 1801 CA PHE A 117 -6.572 -7.363 0.497 1.00 0.00 C ATOM 1802 C PHE A 117 -5.505 -6.436 1.053 1.00 0.00 C ATOM 1803 O PHE A 117 -5.679 -5.865 2.130 1.00 0.00 O ATOM 1804 CB PHE A 117 -7.766 -6.566 -0.026 1.00 0.00 C ATOM 1805 CG PHE A 117 -8.804 -7.402 -0.716 1.00 0.00 C ATOM 1806 CD1 PHE A 117 -9.752 -8.099 0.017 1.00 0.00 C ATOM 1807 CD2 PHE A 117 -8.839 -7.481 -2.098 1.00 0.00 C ATOM 1808 CE1 PHE A 117 -10.711 -8.862 -0.616 1.00 0.00 C ATOM 1809 CE2 PHE A 117 -9.796 -8.244 -2.738 1.00 0.00 C ATOM 1810 CZ PHE A 117 -10.735 -8.934 -1.996 1.00 0.00 C ATOM 0 H PHE A 117 -7.404 -7.796 2.355 1.00 0.00 H new ATOM 0 HA PHE A 117 -6.156 -7.930 -0.336 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -8.233 -6.041 0.808 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -7.406 -5.806 -0.720 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -9.740 -8.044 1.096 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -8.110 -6.940 -2.682 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -11.442 -9.403 -0.034 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -9.810 -8.301 -3.816 1.00 0.00 H new ATOM 0 HZ PHE A 117 -11.487 -9.529 -2.494 1.00 0.00 H new ATOM 1820 N LEU A 118 -4.403 -6.292 0.335 1.00 0.00 N ATOM 1821 CA LEU A 118 -3.272 -5.540 0.848 1.00 0.00 C ATOM 1822 C LEU A 118 -2.649 -4.673 -0.240 1.00 0.00 C ATOM 1823 O LEU A 118 -2.541 -5.075 -1.401 1.00 0.00 O ATOM 1824 CB LEU A 118 -2.225 -6.495 1.423 1.00 0.00 C ATOM 1825 CG LEU A 118 -1.153 -5.853 2.305 1.00 0.00 C ATOM 1826 CD1 LEU A 118 -1.784 -5.142 3.492 1.00 0.00 C ATOM 1827 CD2 LEU A 118 -0.168 -6.907 2.784 1.00 0.00 C ATOM 0 H LEU A 118 -4.269 -6.683 -0.597 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.632 -4.883 1.640 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.739 -7.259 2.006 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -1.731 -7.004 0.595 1.00 0.00 H new ATOM 0 HG LEU A 118 -0.617 -5.113 1.710 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.002 -4.693 4.105 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.457 -4.363 3.134 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -2.346 -5.860 4.089 1.00 0.00 H new ATOM 0 HD21 LEU A 118 0.590 -6.438 3.411 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -0.698 -7.665 3.361 1.00 0.00 H new ATOM 0 HD23 LEU A 118 0.311 -7.375 1.924 1.00 0.00 H new ATOM 1839 N LEU A 119 -2.247 -3.483 0.157 1.00 0.00 N ATOM 1840 CA LEU A 119 -1.628 -2.527 -0.744 1.00 0.00 C ATOM 1841 C LEU A 119 -0.503 -1.801 -0.015 1.00 0.00 C ATOM 1842 O LEU A 119 -0.748 -1.105 0.969 1.00 0.00 O ATOM 1843 CB LEU A 119 -2.673 -1.524 -1.248 1.00 0.00 C ATOM 1844 CG LEU A 119 -2.140 -0.411 -2.155 1.00 0.00 C ATOM 1845 CD1 LEU A 119 -1.543 -0.989 -3.427 1.00 0.00 C ATOM 1846 CD2 LEU A 119 -3.250 0.570 -2.492 1.00 0.00 C ATOM 0 H LEU A 119 -2.340 -3.149 1.116 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.215 -3.054 -1.604 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.444 -2.072 -1.790 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -3.155 -1.065 -0.385 1.00 0.00 H new ATOM 0 HG LEU A 119 -1.353 0.119 -1.619 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.171 -0.179 -4.055 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -0.721 -1.657 -3.172 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.308 -1.546 -3.968 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -2.857 1.356 -3.137 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -4.055 0.046 -3.007 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.635 1.013 -1.574 1.00 0.00 H new ATOM 1858 N LEU A 120 0.726 -1.979 -0.476 1.00 0.00 N ATOM 1859 CA LEU A 120 1.875 -1.372 0.188 1.00 0.00 C ATOM 1860 C LEU A 120 2.633 -0.463 -0.767 1.00 0.00 C ATOM 1861 O LEU A 120 2.682 -0.716 -1.973 1.00 0.00 O ATOM 1862 CB LEU A 120 2.832 -2.437 0.736 1.00 0.00 C ATOM 1863 CG LEU A 120 2.191 -3.534 1.588 1.00 0.00 C ATOM 1864 CD1 LEU A 120 1.765 -4.711 0.720 1.00 0.00 C ATOM 1865 CD2 LEU A 120 3.146 -3.985 2.682 1.00 0.00 C ATOM 0 H LEU A 120 0.955 -2.534 -1.301 1.00 0.00 H new ATOM 0 HA LEU A 120 1.490 -0.783 1.021 1.00 0.00 H new ATOM 0 HB2 LEU A 120 3.342 -2.908 -0.105 1.00 0.00 H new ATOM 0 HB3 LEU A 120 3.596 -1.939 1.333 1.00 0.00 H new ATOM 0 HG LEU A 120 1.299 -3.125 2.062 1.00 0.00 H new ATOM 0 HD11 LEU A 120 1.312 -5.480 1.346 1.00 0.00 H new ATOM 0 HD12 LEU A 120 1.041 -4.373 -0.021 1.00 0.00 H new ATOM 0 HD13 LEU A 120 2.637 -5.124 0.213 1.00 0.00 H new ATOM 0 HD21 LEU A 120 2.674 -4.766 3.278 1.00 0.00 H new ATOM 0 HD22 LEU A 120 4.058 -4.375 2.231 1.00 0.00 H new ATOM 0 HD23 LEU A 120 3.392 -3.138 3.322 1.00 0.00 H new ATOM 1877 N GLY A 121 3.227 0.587 -0.223 1.00 0.00 N ATOM 1878 CA GLY A 121 4.010 1.494 -1.030 1.00 0.00 C ATOM 1879 C GLY A 121 5.238 1.996 -0.299 1.00 0.00 C ATOM 1880 O GLY A 121 5.164 2.341 0.882 1.00 0.00 O ATOM 0 H GLY A 121 3.180 0.827 0.767 1.00 0.00 H new ATOM 0 HA2 GLY A 121 4.316 0.990 -1.947 1.00 0.00 H new ATOM 0 HA3 GLY A 121 3.392 2.342 -1.323 1.00 0.00 H new ATOM 1884 N SER A 122 6.369 2.018 -0.991 1.00 0.00 N ATOM 1885 CA SER A 122 7.606 2.549 -0.433 1.00 0.00 C ATOM 1886 C SER A 122 8.539 2.991 -1.561 1.00 0.00 C ATOM 1887 O SER A 122 8.124 3.068 -2.718 1.00 0.00 O ATOM 1888 CB SER A 122 8.290 1.508 0.457 1.00 0.00 C ATOM 1889 OG SER A 122 8.614 0.343 -0.273 1.00 0.00 O ATOM 0 H SER A 122 6.456 1.672 -1.947 1.00 0.00 H new ATOM 0 HA SER A 122 7.368 3.415 0.185 1.00 0.00 H new ATOM 0 HB2 SER A 122 9.196 1.934 0.888 1.00 0.00 H new ATOM 0 HB3 SER A 122 7.634 1.249 1.288 1.00 0.00 H new ATOM 0 HG SER A 122 9.583 0.198 -0.244 1.00 0.00 H new ATOM 1895 N GLU A 123 9.794 3.264 -1.231 1.00 0.00 N ATOM 1896 CA GLU A 123 10.727 3.831 -2.196 1.00 0.00 C ATOM 1897 C GLU A 123 11.739 2.812 -2.716 1.00 0.00 C ATOM 1898 O GLU A 123 12.531 3.135 -3.602 1.00 0.00 O ATOM 1899 CB GLU A 123 11.489 4.992 -1.558 1.00 0.00 C ATOM 1900 CG GLU A 123 10.615 6.164 -1.146 1.00 0.00 C ATOM 1901 CD GLU A 123 11.409 7.240 -0.442 1.00 0.00 C ATOM 1902 OE1 GLU A 123 12.281 7.860 -1.087 1.00 0.00 O ATOM 1903 OE2 GLU A 123 11.173 7.469 0.759 1.00 0.00 O ATOM 0 H GLU A 123 10.189 3.103 -0.305 1.00 0.00 H new ATOM 0 HA GLU A 123 10.130 4.171 -3.043 1.00 0.00 H new ATOM 0 HB2 GLU A 123 12.020 4.624 -0.680 1.00 0.00 H new ATOM 0 HB3 GLU A 123 12.243 5.346 -2.261 1.00 0.00 H new ATOM 0 HG2 GLU A 123 10.135 6.586 -2.029 1.00 0.00 H new ATOM 0 HG3 GLU A 123 9.820 5.811 -0.489 1.00 0.00 H new ATOM 1910 N TYR A 124 11.742 1.595 -2.181 1.00 0.00 N ATOM 1911 CA TYR A 124 12.812 0.662 -2.524 1.00 0.00 C ATOM 1912 C TYR A 124 12.290 -0.638 -3.141 1.00 0.00 C ATOM 1913 O TYR A 124 12.162 -0.731 -4.357 1.00 0.00 O ATOM 1914 CB TYR A 124 13.661 0.364 -1.282 1.00 0.00 C ATOM 1915 CG TYR A 124 14.186 1.613 -0.598 1.00 0.00 C ATOM 1916 CD1 TYR A 124 15.361 2.221 -1.020 1.00 0.00 C ATOM 1917 CD2 TYR A 124 13.495 2.190 0.463 1.00 0.00 C ATOM 1918 CE1 TYR A 124 15.834 3.366 -0.404 1.00 0.00 C ATOM 1919 CE2 TYR A 124 13.962 3.332 1.083 1.00 0.00 C ATOM 1920 CZ TYR A 124 15.130 3.918 0.646 1.00 0.00 C ATOM 1921 OH TYR A 124 15.595 5.059 1.264 1.00 0.00 O ATOM 0 H TYR A 124 11.042 1.239 -1.530 1.00 0.00 H new ATOM 0 HA TYR A 124 13.428 1.142 -3.284 1.00 0.00 H new ATOM 0 HB2 TYR A 124 13.064 -0.207 -0.571 1.00 0.00 H new ATOM 0 HB3 TYR A 124 14.503 -0.266 -1.569 1.00 0.00 H new ATOM 0 HD1 TYR A 124 15.915 1.793 -1.843 1.00 0.00 H new ATOM 0 HD2 TYR A 124 12.577 1.737 0.808 1.00 0.00 H new ATOM 0 HE1 TYR A 124 16.750 3.826 -0.744 1.00 0.00 H new ATOM 0 HE2 TYR A 124 13.414 3.764 1.907 1.00 0.00 H new ATOM 0 HH TYR A 124 14.980 5.315 1.983 1.00 0.00 H new ATOM 1931 N THR A 125 11.984 -1.625 -2.299 1.00 0.00 N ATOM 1932 CA THR A 125 11.497 -2.940 -2.747 1.00 0.00 C ATOM 1933 C THR A 125 11.276 -3.860 -1.543 1.00 0.00 C ATOM 1934 O THR A 125 11.936 -3.706 -0.517 1.00 0.00 O ATOM 1935 CB THR A 125 12.470 -3.646 -3.728 1.00 0.00 C ATOM 1936 OG1 THR A 125 13.775 -3.058 -3.661 1.00 0.00 O ATOM 1937 CG2 THR A 125 11.951 -3.596 -5.160 1.00 0.00 C ATOM 0 H THR A 125 12.065 -1.540 -1.286 1.00 0.00 H new ATOM 0 HA THR A 125 10.561 -2.753 -3.274 1.00 0.00 H new ATOM 0 HB THR A 125 12.536 -4.691 -3.425 1.00 0.00 H new ATOM 0 HG1 THR A 125 14.374 -3.518 -4.286 1.00 0.00 H new ATOM 0 HG21 THR A 125 12.657 -4.100 -5.821 1.00 0.00 H new ATOM 0 HG22 THR A 125 10.984 -4.095 -5.214 1.00 0.00 H new ATOM 0 HG23 THR A 125 11.841 -2.557 -5.471 1.00 0.00 H new ATOM 1945 N PRO A 126 10.377 -4.856 -1.663 1.00 0.00 N ATOM 1946 CA PRO A 126 9.970 -5.691 -0.524 1.00 0.00 C ATOM 1947 C PRO A 126 11.068 -6.639 -0.050 1.00 0.00 C ATOM 1948 O PRO A 126 11.128 -6.995 1.124 1.00 0.00 O ATOM 1949 CB PRO A 126 8.782 -6.484 -1.070 1.00 0.00 C ATOM 1950 CG PRO A 126 8.994 -6.533 -2.543 1.00 0.00 C ATOM 1951 CD PRO A 126 9.694 -5.253 -2.910 1.00 0.00 C ATOM 0 HA PRO A 126 9.736 -5.083 0.350 1.00 0.00 H new ATOM 0 HB2 PRO A 126 8.747 -7.486 -0.643 1.00 0.00 H new ATOM 0 HB3 PRO A 126 7.837 -5.999 -0.823 1.00 0.00 H new ATOM 0 HG2 PRO A 126 9.595 -7.399 -2.821 1.00 0.00 H new ATOM 0 HG3 PRO A 126 8.044 -6.622 -3.070 1.00 0.00 H new ATOM 0 HD2 PRO A 126 10.403 -5.404 -3.724 1.00 0.00 H new ATOM 0 HD3 PRO A 126 8.988 -4.491 -3.240 1.00 0.00 H new ATOM 1959 N GLN A 127 11.940 -7.037 -0.963 1.00 0.00 N ATOM 1960 CA GLN A 127 12.993 -7.991 -0.640 1.00 0.00 C ATOM 1961 C GLN A 127 14.320 -7.281 -0.411 1.00 0.00 C ATOM 1962 O GLN A 127 15.342 -7.924 -0.194 1.00 0.00 O ATOM 1963 CB GLN A 127 13.143 -9.040 -1.749 1.00 0.00 C ATOM 1964 CG GLN A 127 11.898 -9.891 -1.959 1.00 0.00 C ATOM 1965 CD GLN A 127 12.145 -11.074 -2.877 1.00 0.00 C ATOM 1966 OE1 GLN A 127 12.500 -12.163 -2.423 1.00 0.00 O ATOM 1967 NE2 GLN A 127 11.957 -10.873 -4.172 1.00 0.00 N ATOM 0 H GLN A 127 11.941 -6.716 -1.931 1.00 0.00 H new ATOM 0 HA GLN A 127 12.707 -8.498 0.281 1.00 0.00 H new ATOM 0 HB2 GLN A 127 13.389 -8.535 -2.683 1.00 0.00 H new ATOM 0 HB3 GLN A 127 13.982 -9.693 -1.508 1.00 0.00 H new ATOM 0 HG2 GLN A 127 11.543 -10.253 -0.994 1.00 0.00 H new ATOM 0 HG3 GLN A 127 11.105 -9.271 -2.378 1.00 0.00 H new ATOM 0 HE21 GLN A 127 11.663 -9.956 -4.508 1.00 0.00 H new ATOM 0 HE22 GLN A 127 12.106 -11.635 -4.833 1.00 0.00 H new ATOM 1976 N GLN A 128 14.298 -5.955 -0.448 1.00 0.00 N ATOM 1977 CA GLN A 128 15.514 -5.176 -0.256 1.00 0.00 C ATOM 1978 C GLN A 128 15.415 -4.334 1.016 1.00 0.00 C ATOM 1979 O GLN A 128 16.419 -3.841 1.531 1.00 0.00 O ATOM 1980 CB GLN A 128 15.761 -4.279 -1.475 1.00 0.00 C ATOM 1981 CG GLN A 128 17.156 -3.683 -1.538 1.00 0.00 C ATOM 1982 CD GLN A 128 18.235 -4.744 -1.661 1.00 0.00 C ATOM 1983 OE1 GLN A 128 18.761 -5.228 -0.660 1.00 0.00 O ATOM 1984 NE2 GLN A 128 18.570 -5.114 -2.888 1.00 0.00 N ATOM 0 H GLN A 128 13.458 -5.400 -0.608 1.00 0.00 H new ATOM 0 HA GLN A 128 16.355 -5.861 -0.148 1.00 0.00 H new ATOM 0 HB2 GLN A 128 15.585 -4.860 -2.381 1.00 0.00 H new ATOM 0 HB3 GLN A 128 15.032 -3.469 -1.469 1.00 0.00 H new ATOM 0 HG2 GLN A 128 17.220 -3.004 -2.388 1.00 0.00 H new ATOM 0 HG3 GLN A 128 17.335 -3.089 -0.642 1.00 0.00 H new ATOM 0 HE21 GLN A 128 18.110 -4.688 -3.693 1.00 0.00 H new ATOM 0 HE22 GLN A 128 19.288 -5.825 -3.028 1.00 0.00 H new ATOM 1993 N LEU A 129 14.194 -4.176 1.518 1.00 0.00 N ATOM 1994 CA LEU A 129 13.961 -3.413 2.739 1.00 0.00 C ATOM 1995 C LEU A 129 14.487 -4.153 3.962 1.00 0.00 C ATOM 1996 O LEU A 129 14.543 -5.386 3.981 1.00 0.00 O ATOM 1997 CB LEU A 129 12.469 -3.126 2.921 1.00 0.00 C ATOM 1998 CG LEU A 129 11.882 -2.072 1.983 1.00 0.00 C ATOM 1999 CD1 LEU A 129 10.372 -2.009 2.145 1.00 0.00 C ATOM 2000 CD2 LEU A 129 12.508 -0.710 2.257 1.00 0.00 C ATOM 0 H LEU A 129 13.351 -4.566 1.098 1.00 0.00 H new ATOM 0 HA LEU A 129 14.500 -2.471 2.642 1.00 0.00 H new ATOM 0 HB2 LEU A 129 11.918 -4.057 2.783 1.00 0.00 H new ATOM 0 HB3 LEU A 129 12.301 -2.806 3.949 1.00 0.00 H new ATOM 0 HG LEU A 129 12.109 -2.353 0.954 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.965 -1.255 1.472 1.00 0.00 H new ATOM 0 HD12 LEU A 129 9.940 -2.980 1.905 1.00 0.00 H new ATOM 0 HD13 LEU A 129 10.127 -1.747 3.174 1.00 0.00 H new ATOM 0 HD21 LEU A 129 12.080 0.030 1.581 1.00 0.00 H new ATOM 0 HD22 LEU A 129 12.308 -0.418 3.288 1.00 0.00 H new ATOM 0 HD23 LEU A 129 13.585 -0.766 2.098 1.00 0.00 H new ATOM 2012 N VAL A 130 14.861 -3.394 4.983 1.00 0.00 N ATOM 2013 CA VAL A 130 15.372 -3.970 6.217 1.00 0.00 C ATOM 2014 C VAL A 130 14.226 -4.527 7.048 1.00 0.00 C ATOM 2015 O VAL A 130 13.583 -3.805 7.810 1.00 0.00 O ATOM 2016 CB VAL A 130 16.154 -2.937 7.061 1.00 0.00 C ATOM 2017 CG1 VAL A 130 16.796 -3.607 8.278 1.00 0.00 C ATOM 2018 CG2 VAL A 130 17.201 -2.224 6.209 1.00 0.00 C ATOM 0 H VAL A 130 14.819 -2.375 4.980 1.00 0.00 H new ATOM 0 HA VAL A 130 16.058 -4.770 5.938 1.00 0.00 H new ATOM 0 HB VAL A 130 15.450 -2.187 7.423 1.00 0.00 H new ATOM 0 HG11 VAL A 130 17.341 -2.862 8.858 1.00 0.00 H new ATOM 0 HG12 VAL A 130 16.020 -4.054 8.899 1.00 0.00 H new ATOM 0 HG13 VAL A 130 17.485 -4.383 7.945 1.00 0.00 H new ATOM 0 HG21 VAL A 130 17.739 -1.502 6.823 1.00 0.00 H new ATOM 0 HG22 VAL A 130 17.904 -2.955 5.809 1.00 0.00 H new ATOM 0 HG23 VAL A 130 16.709 -1.705 5.386 1.00 0.00 H new ATOM 2028 N ILE A 131 13.954 -5.803 6.856 1.00 0.00 N ATOM 2029 CA ILE A 131 12.918 -6.503 7.597 1.00 0.00 C ATOM 2030 C ILE A 131 13.400 -7.906 7.923 1.00 0.00 C ATOM 2031 O ILE A 131 14.442 -8.331 7.426 1.00 0.00 O ATOM 2032 CB ILE A 131 11.589 -6.590 6.806 1.00 0.00 C ATOM 2033 CG1 ILE A 131 11.827 -7.166 5.399 1.00 0.00 C ATOM 2034 CG2 ILE A 131 10.924 -5.222 6.730 1.00 0.00 C ATOM 2035 CD1 ILE A 131 10.568 -7.281 4.562 1.00 0.00 C ATOM 0 H ILE A 131 14.446 -6.387 6.180 1.00 0.00 H new ATOM 0 HA ILE A 131 12.723 -5.939 8.509 1.00 0.00 H new ATOM 0 HB ILE A 131 10.917 -7.266 7.335 1.00 0.00 H new ATOM 0 HG12 ILE A 131 12.544 -6.534 4.875 1.00 0.00 H new ATOM 0 HG13 ILE A 131 12.281 -8.153 5.493 1.00 0.00 H new ATOM 0 HG21 ILE A 131 9.992 -5.301 6.171 1.00 0.00 H new ATOM 0 HG22 ILE A 131 10.714 -4.863 7.738 1.00 0.00 H new ATOM 0 HG23 ILE A 131 11.590 -4.521 6.227 1.00 0.00 H new ATOM 0 HD11 ILE A 131 10.817 -7.695 3.585 1.00 0.00 H new ATOM 0 HD12 ILE A 131 9.857 -7.937 5.063 1.00 0.00 H new ATOM 0 HD13 ILE A 131 10.124 -6.294 4.435 1.00 0.00 H new ATOM 2047 N ARG A 132 12.647 -8.618 8.744 1.00 0.00 N ATOM 2048 CA ARG A 132 13.013 -9.974 9.126 1.00 0.00 C ATOM 2049 C ARG A 132 12.649 -10.936 7.996 1.00 0.00 C ATOM 2050 O ARG A 132 11.777 -10.634 7.177 1.00 0.00 O ATOM 2051 CB ARG A 132 12.302 -10.349 10.429 1.00 0.00 C ATOM 2052 CG ARG A 132 13.092 -11.299 11.314 1.00 0.00 C ATOM 2053 CD ARG A 132 14.446 -10.713 11.691 1.00 0.00 C ATOM 2054 NE ARG A 132 15.088 -11.470 12.764 1.00 0.00 N ATOM 2055 CZ ARG A 132 16.335 -11.265 13.184 1.00 0.00 C ATOM 2056 NH1 ARG A 132 17.118 -10.400 12.558 1.00 0.00 N ATOM 2057 NH2 ARG A 132 16.806 -11.944 14.225 1.00 0.00 N ATOM 0 H ARG A 132 11.779 -8.281 9.159 1.00 0.00 H new ATOM 0 HA ARG A 132 14.088 -10.038 9.296 1.00 0.00 H new ATOM 0 HB2 ARG A 132 12.090 -9.439 10.990 1.00 0.00 H new ATOM 0 HB3 ARG A 132 11.342 -10.807 10.188 1.00 0.00 H new ATOM 0 HG2 ARG A 132 12.523 -11.514 12.218 1.00 0.00 H new ATOM 0 HG3 ARG A 132 13.236 -12.247 10.795 1.00 0.00 H new ATOM 0 HD2 ARG A 132 15.094 -10.704 10.815 1.00 0.00 H new ATOM 0 HD3 ARG A 132 14.319 -9.677 12.004 1.00 0.00 H new ATOM 0 HE ARG A 132 14.546 -12.203 13.221 1.00 0.00 H new ATOM 0 HH11 ARG A 132 16.767 -9.887 11.750 1.00 0.00 H new ATOM 0 HH12 ARG A 132 18.072 -10.247 12.884 1.00 0.00 H new ATOM 0 HH21 ARG A 132 16.212 -12.622 14.702 1.00 0.00 H new ATOM 0 HH22 ARG A 132 17.761 -11.787 14.546 1.00 0.00 H new ATOM 2071 N GLU A 133 13.316 -12.084 7.942 1.00 0.00 N ATOM 2072 CA GLU A 133 13.135 -13.013 6.829 1.00 0.00 C ATOM 2073 C GLU A 133 11.745 -13.646 6.840 1.00 0.00 C ATOM 2074 O GLU A 133 11.244 -14.081 5.798 1.00 0.00 O ATOM 2075 CB GLU A 133 14.217 -14.105 6.821 1.00 0.00 C ATOM 2076 CG GLU A 133 14.365 -14.871 8.128 1.00 0.00 C ATOM 2077 CD GLU A 133 15.253 -14.158 9.129 1.00 0.00 C ATOM 2078 OE1 GLU A 133 16.488 -14.320 9.051 1.00 0.00 O ATOM 2079 OE2 GLU A 133 14.727 -13.432 9.988 1.00 0.00 O ATOM 0 H GLU A 133 13.982 -12.393 8.650 1.00 0.00 H new ATOM 0 HA GLU A 133 13.234 -12.428 5.915 1.00 0.00 H new ATOM 0 HB2 GLU A 133 13.991 -14.814 6.025 1.00 0.00 H new ATOM 0 HB3 GLU A 133 15.174 -13.645 6.576 1.00 0.00 H new ATOM 0 HG2 GLU A 133 13.379 -15.024 8.568 1.00 0.00 H new ATOM 0 HG3 GLU A 133 14.778 -15.858 7.921 1.00 0.00 H new ATOM 2086 N ASP A 134 11.114 -13.674 8.007 1.00 0.00 N ATOM 2087 CA ASP A 134 9.784 -14.260 8.141 1.00 0.00 C ATOM 2088 C ASP A 134 8.750 -13.387 7.435 1.00 0.00 C ATOM 2089 O ASP A 134 7.836 -13.891 6.781 1.00 0.00 O ATOM 2090 CB ASP A 134 9.416 -14.455 9.622 1.00 0.00 C ATOM 2091 CG ASP A 134 9.216 -13.151 10.375 1.00 0.00 C ATOM 2092 OD1 ASP A 134 10.006 -12.207 10.162 1.00 0.00 O ATOM 2093 OD2 ASP A 134 8.268 -13.067 11.182 1.00 0.00 O ATOM 0 H ASP A 134 11.500 -13.299 8.874 1.00 0.00 H new ATOM 0 HA ASP A 134 9.790 -15.242 7.668 1.00 0.00 H new ATOM 0 HB2 ASP A 134 8.502 -15.046 9.686 1.00 0.00 H new ATOM 0 HB3 ASP A 134 10.202 -15.030 10.111 1.00 0.00 H new ATOM 2098 N LEU A 135 8.921 -12.076 7.542 1.00 0.00 N ATOM 2099 CA LEU A 135 8.031 -11.134 6.881 1.00 0.00 C ATOM 2100 C LEU A 135 8.387 -11.006 5.405 1.00 0.00 C ATOM 2101 O LEU A 135 7.506 -10.939 4.549 1.00 0.00 O ATOM 2102 CB LEU A 135 8.113 -9.757 7.544 1.00 0.00 C ATOM 2103 CG LEU A 135 7.129 -8.719 6.997 1.00 0.00 C ATOM 2104 CD1 LEU A 135 5.708 -9.046 7.431 1.00 0.00 C ATOM 2105 CD2 LEU A 135 7.520 -7.321 7.444 1.00 0.00 C ATOM 0 H LEU A 135 9.670 -11.641 8.082 1.00 0.00 H new ATOM 0 HA LEU A 135 7.014 -11.514 6.973 1.00 0.00 H new ATOM 0 HB2 LEU A 135 7.938 -9.874 8.614 1.00 0.00 H new ATOM 0 HB3 LEU A 135 9.126 -9.373 7.427 1.00 0.00 H new ATOM 0 HG LEU A 135 7.169 -8.751 5.908 1.00 0.00 H new ATOM 0 HD11 LEU A 135 5.024 -8.297 7.032 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.429 -10.030 7.053 1.00 0.00 H new ATOM 0 HD13 LEU A 135 5.651 -9.046 8.520 1.00 0.00 H new ATOM 0 HD21 LEU A 135 6.808 -6.599 7.045 1.00 0.00 H new ATOM 0 HD22 LEU A 135 7.514 -7.272 8.533 1.00 0.00 H new ATOM 0 HD23 LEU A 135 8.519 -7.087 7.076 1.00 0.00 H new ATOM 2117 N ARG A 136 9.687 -10.987 5.113 1.00 0.00 N ATOM 2118 CA ARG A 136 10.165 -10.787 3.746 1.00 0.00 C ATOM 2119 C ARG A 136 9.650 -11.876 2.807 1.00 0.00 C ATOM 2120 O ARG A 136 9.324 -11.603 1.652 1.00 0.00 O ATOM 2121 CB ARG A 136 11.695 -10.734 3.703 1.00 0.00 C ATOM 2122 CG ARG A 136 12.250 -10.520 2.304 1.00 0.00 C ATOM 2123 CD ARG A 136 13.763 -10.415 2.310 1.00 0.00 C ATOM 2124 NE ARG A 136 14.237 -9.174 2.923 1.00 0.00 N ATOM 2125 CZ ARG A 136 15.513 -8.946 3.242 1.00 0.00 C ATOM 2126 NH1 ARG A 136 16.427 -9.884 3.041 1.00 0.00 N ATOM 2127 NH2 ARG A 136 15.883 -7.776 3.747 1.00 0.00 N ATOM 0 H ARG A 136 10.427 -11.108 5.804 1.00 0.00 H new ATOM 0 HA ARG A 136 9.772 -9.830 3.403 1.00 0.00 H new ATOM 0 HB2 ARG A 136 12.042 -9.929 4.351 1.00 0.00 H new ATOM 0 HB3 ARG A 136 12.095 -11.664 4.107 1.00 0.00 H new ATOM 0 HG2 ARG A 136 11.945 -11.346 1.661 1.00 0.00 H new ATOM 0 HG3 ARG A 136 11.824 -9.611 1.879 1.00 0.00 H new ATOM 0 HD2 ARG A 136 14.181 -11.265 2.849 1.00 0.00 H new ATOM 0 HD3 ARG A 136 14.132 -10.475 1.286 1.00 0.00 H new ATOM 0 HE ARG A 136 13.554 -8.442 3.118 1.00 0.00 H new ATOM 0 HH11 ARG A 136 16.156 -10.783 2.642 1.00 0.00 H new ATOM 0 HH12 ARG A 136 17.401 -9.707 3.286 1.00 0.00 H new ATOM 0 HH21 ARG A 136 15.190 -7.042 3.894 1.00 0.00 H new ATOM 0 HH22 ARG A 136 16.860 -7.611 3.988 1.00 0.00 H new ATOM 2141 N THR A 137 9.563 -13.101 3.308 1.00 0.00 N ATOM 2142 CA THR A 137 9.061 -14.212 2.514 1.00 0.00 C ATOM 2143 C THR A 137 7.573 -14.038 2.200 1.00 0.00 C ATOM 2144 O THR A 137 7.101 -14.434 1.134 1.00 0.00 O ATOM 2145 CB THR A 137 9.304 -15.557 3.229 1.00 0.00 C ATOM 2146 OG1 THR A 137 9.093 -15.407 4.641 1.00 0.00 O ATOM 2147 CG2 THR A 137 10.718 -16.056 2.968 1.00 0.00 C ATOM 0 H THR A 137 9.833 -13.349 4.260 1.00 0.00 H new ATOM 0 HA THR A 137 9.611 -14.218 1.573 1.00 0.00 H new ATOM 0 HB THR A 137 8.599 -16.289 2.835 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.913 -15.072 5.061 1.00 0.00 H new ATOM 0 HG21 THR A 137 10.869 -17.006 3.481 1.00 0.00 H new ATOM 0 HG22 THR A 137 10.863 -16.195 1.897 1.00 0.00 H new ATOM 0 HG23 THR A 137 11.436 -15.325 3.339 1.00 0.00 H new ATOM 2155 N ARG A 138 6.847 -13.416 3.122 1.00 0.00 N ATOM 2156 CA ARG A 138 5.428 -13.144 2.934 1.00 0.00 C ATOM 2157 C ARG A 138 5.214 -12.018 1.931 1.00 0.00 C ATOM 2158 O ARG A 138 4.191 -11.967 1.250 1.00 0.00 O ATOM 2159 CB ARG A 138 4.800 -12.782 4.273 1.00 0.00 C ATOM 2160 CG ARG A 138 4.914 -13.897 5.286 1.00 0.00 C ATOM 2161 CD ARG A 138 3.963 -15.034 4.958 1.00 0.00 C ATOM 2162 NE ARG A 138 4.298 -16.254 5.680 1.00 0.00 N ATOM 2163 CZ ARG A 138 3.403 -17.143 6.091 1.00 0.00 C ATOM 2164 NH1 ARG A 138 2.106 -16.908 5.932 1.00 0.00 N ATOM 2165 NH2 ARG A 138 3.805 -18.266 6.665 1.00 0.00 N ATOM 0 H ARG A 138 7.221 -13.089 4.013 1.00 0.00 H new ATOM 0 HA ARG A 138 4.951 -14.040 2.537 1.00 0.00 H new ATOM 0 HB2 ARG A 138 5.282 -11.887 4.667 1.00 0.00 H new ATOM 0 HB3 ARG A 138 3.748 -12.538 4.123 1.00 0.00 H new ATOM 0 HG2 ARG A 138 5.938 -14.270 5.307 1.00 0.00 H new ATOM 0 HG3 ARG A 138 4.695 -13.511 6.282 1.00 0.00 H new ATOM 0 HD2 ARG A 138 2.944 -14.736 5.204 1.00 0.00 H new ATOM 0 HD3 ARG A 138 3.988 -15.229 3.886 1.00 0.00 H new ATOM 0 HE ARG A 138 5.281 -16.436 5.882 1.00 0.00 H new ATOM 0 HH11 ARG A 138 1.795 -16.042 5.493 1.00 0.00 H new ATOM 0 HH12 ARG A 138 1.421 -17.594 6.249 1.00 0.00 H new ATOM 0 HH21 ARG A 138 4.801 -18.446 6.791 1.00 0.00 H new ATOM 0 HH22 ARG A 138 3.119 -18.951 6.982 1.00 0.00 H new ATOM 2179 N MET A 139 6.196 -11.131 1.829 1.00 0.00 N ATOM 2180 CA MET A 139 6.127 -10.005 0.905 1.00 0.00 C ATOM 2181 C MET A 139 6.101 -10.488 -0.543 1.00 0.00 C ATOM 2182 O MET A 139 5.708 -9.754 -1.450 1.00 0.00 O ATOM 2183 CB MET A 139 7.319 -9.075 1.119 1.00 0.00 C ATOM 2184 CG MET A 139 7.363 -8.447 2.500 1.00 0.00 C ATOM 2185 SD MET A 139 5.952 -7.374 2.828 1.00 0.00 S ATOM 2186 CE MET A 139 6.177 -6.129 1.561 1.00 0.00 C ATOM 0 H MET A 139 7.055 -11.170 2.378 1.00 0.00 H new ATOM 0 HA MET A 139 5.204 -9.460 1.104 1.00 0.00 H new ATOM 0 HB2 MET A 139 8.240 -9.635 0.955 1.00 0.00 H new ATOM 0 HB3 MET A 139 7.290 -8.283 0.370 1.00 0.00 H new ATOM 0 HG2 MET A 139 7.396 -9.236 3.251 1.00 0.00 H new ATOM 0 HG3 MET A 139 8.283 -7.871 2.603 1.00 0.00 H new ATOM 0 HE1 MET A 139 5.980 -5.143 1.981 1.00 0.00 H new ATOM 0 HE2 MET A 139 7.202 -6.167 1.191 1.00 0.00 H new ATOM 0 HE3 MET A 139 5.487 -6.318 0.739 1.00 0.00 H new ATOM 2196 N ALA A 140 6.520 -11.733 -0.751 1.00 0.00 N ATOM 2197 CA ALA A 140 6.555 -12.324 -2.083 1.00 0.00 C ATOM 2198 C ALA A 140 5.150 -12.664 -2.581 1.00 0.00 C ATOM 2199 O ALA A 140 4.945 -12.885 -3.775 1.00 0.00 O ATOM 2200 CB ALA A 140 7.434 -13.567 -2.086 1.00 0.00 C ATOM 0 H ALA A 140 6.842 -12.354 -0.009 1.00 0.00 H new ATOM 0 HA ALA A 140 6.980 -11.587 -2.765 1.00 0.00 H new ATOM 0 HB1 ALA A 140 7.451 -13.998 -3.087 1.00 0.00 H new ATOM 0 HB2 ALA A 140 8.448 -13.297 -1.790 1.00 0.00 H new ATOM 0 HB3 ALA A 140 7.034 -14.298 -1.383 1.00 0.00 H new ATOM 2206 N TYR A 141 4.183 -12.696 -1.665 1.00 0.00 N ATOM 2207 CA TYR A 141 2.802 -13.006 -2.021 1.00 0.00 C ATOM 2208 C TYR A 141 2.105 -11.789 -2.621 1.00 0.00 C ATOM 2209 O TYR A 141 1.012 -11.897 -3.175 1.00 0.00 O ATOM 2210 CB TYR A 141 2.023 -13.492 -0.797 1.00 0.00 C ATOM 2211 CG TYR A 141 2.470 -14.839 -0.275 1.00 0.00 C ATOM 2212 CD1 TYR A 141 2.272 -15.994 -1.020 1.00 0.00 C ATOM 2213 CD2 TYR A 141 3.078 -14.957 0.968 1.00 0.00 C ATOM 2214 CE1 TYR A 141 2.667 -17.227 -0.540 1.00 0.00 C ATOM 2215 CE2 TYR A 141 3.479 -16.186 1.453 1.00 0.00 C ATOM 2216 CZ TYR A 141 3.272 -17.318 0.696 1.00 0.00 C ATOM 2217 OH TYR A 141 3.663 -18.546 1.179 1.00 0.00 O ATOM 0 H TYR A 141 4.331 -12.511 -0.673 1.00 0.00 H new ATOM 0 HA TYR A 141 2.825 -13.800 -2.767 1.00 0.00 H new ATOM 0 HB2 TYR A 141 2.122 -12.755 -0.000 1.00 0.00 H new ATOM 0 HB3 TYR A 141 0.964 -13.546 -1.051 1.00 0.00 H new ATOM 0 HD1 TYR A 141 1.802 -15.927 -1.990 1.00 0.00 H new ATOM 0 HD2 TYR A 141 3.240 -14.072 1.566 1.00 0.00 H new ATOM 0 HE1 TYR A 141 2.503 -18.117 -1.130 1.00 0.00 H new ATOM 0 HE2 TYR A 141 3.953 -16.259 2.421 1.00 0.00 H new ATOM 0 HH TYR A 141 4.074 -18.435 2.062 1.00 0.00 H new ATOM 2227 N CYS A 142 2.742 -10.631 -2.504 1.00 0.00 N ATOM 2228 CA CYS A 142 2.211 -9.408 -3.063 1.00 0.00 C ATOM 2229 C CYS A 142 2.812 -9.176 -4.435 1.00 0.00 C ATOM 2230 O CYS A 142 4.000 -9.422 -4.656 1.00 0.00 O ATOM 2231 CB CYS A 142 2.513 -8.219 -2.147 1.00 0.00 C ATOM 2232 SG CYS A 142 1.831 -8.389 -0.484 1.00 0.00 S ATOM 0 H CYS A 142 3.634 -10.520 -2.022 1.00 0.00 H new ATOM 0 HA CYS A 142 1.129 -9.502 -3.153 1.00 0.00 H new ATOM 0 HB2 CYS A 142 3.593 -8.093 -2.075 1.00 0.00 H new ATOM 0 HB3 CYS A 142 2.115 -7.312 -2.602 1.00 0.00 H new ATOM 0 HG CYS A 142 2.304 -9.465 0.071 1.00 0.00 H new ATOM 2238 N LEU A 143 1.986 -8.732 -5.355 1.00 0.00 N ATOM 2239 CA LEU A 143 2.435 -8.451 -6.707 1.00 0.00 C ATOM 2240 C LEU A 143 3.141 -7.122 -6.781 1.00 0.00 C ATOM 2241 O LEU A 143 2.896 -6.224 -5.981 1.00 0.00 O ATOM 2242 CB LEU A 143 1.269 -8.455 -7.687 1.00 0.00 C ATOM 2243 CG LEU A 143 0.848 -9.839 -8.156 1.00 0.00 C ATOM 2244 CD1 LEU A 143 -0.619 -9.851 -8.559 1.00 0.00 C ATOM 2245 CD2 LEU A 143 1.723 -10.295 -9.315 1.00 0.00 C ATOM 0 H LEU A 143 0.994 -8.556 -5.194 1.00 0.00 H new ATOM 0 HA LEU A 143 3.133 -9.241 -6.982 1.00 0.00 H new ATOM 0 HB2 LEU A 143 0.414 -7.968 -7.218 1.00 0.00 H new ATOM 0 HB3 LEU A 143 1.539 -7.856 -8.557 1.00 0.00 H new ATOM 0 HG LEU A 143 0.978 -10.535 -7.327 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -0.897 -10.851 -8.891 1.00 0.00 H new ATOM 0 HD12 LEU A 143 -1.233 -9.568 -7.704 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -0.779 -9.142 -9.371 1.00 0.00 H new ATOM 0 HD21 LEU A 143 1.409 -11.287 -9.639 1.00 0.00 H new ATOM 0 HD22 LEU A 143 1.624 -9.594 -10.144 1.00 0.00 H new ATOM 0 HD23 LEU A 143 2.764 -10.331 -8.993 1.00 0.00 H new ATOM 2257 N VAL A 144 3.998 -7.010 -7.761 1.00 0.00 N ATOM 2258 CA VAL A 144 4.735 -5.787 -7.996 1.00 0.00 C ATOM 2259 C VAL A 144 4.187 -5.109 -9.238 1.00 0.00 C ATOM 2260 O VAL A 144 4.290 -5.635 -10.347 1.00 0.00 O ATOM 2261 CB VAL A 144 6.249 -6.048 -8.169 1.00 0.00 C ATOM 2262 CG1 VAL A 144 7.000 -4.743 -8.396 1.00 0.00 C ATOM 2263 CG2 VAL A 144 6.809 -6.782 -6.960 1.00 0.00 C ATOM 0 H VAL A 144 4.208 -7.760 -8.420 1.00 0.00 H new ATOM 0 HA VAL A 144 4.612 -5.144 -7.125 1.00 0.00 H new ATOM 0 HB VAL A 144 6.386 -6.678 -9.048 1.00 0.00 H new ATOM 0 HG11 VAL A 144 8.063 -4.951 -8.515 1.00 0.00 H new ATOM 0 HG12 VAL A 144 6.622 -4.258 -9.296 1.00 0.00 H new ATOM 0 HG13 VAL A 144 6.853 -4.085 -7.540 1.00 0.00 H new ATOM 0 HG21 VAL A 144 7.876 -6.956 -7.102 1.00 0.00 H new ATOM 0 HG22 VAL A 144 6.656 -6.179 -6.065 1.00 0.00 H new ATOM 0 HG23 VAL A 144 6.298 -7.738 -6.846 1.00 0.00 H new ATOM 2273 N TYR A 145 3.603 -3.945 -9.048 1.00 0.00 N ATOM 2274 CA TYR A 145 2.978 -3.227 -10.142 1.00 0.00 C ATOM 2275 C TYR A 145 3.587 -1.853 -10.333 1.00 0.00 C ATOM 2276 O TYR A 145 3.614 -1.030 -9.420 1.00 0.00 O ATOM 2277 CB TYR A 145 1.470 -3.105 -9.923 1.00 0.00 C ATOM 2278 CG TYR A 145 0.666 -4.144 -10.667 1.00 0.00 C ATOM 2279 CD1 TYR A 145 0.497 -5.427 -10.160 1.00 0.00 C ATOM 2280 CD2 TYR A 145 0.074 -3.835 -11.885 1.00 0.00 C ATOM 2281 CE1 TYR A 145 -0.243 -6.373 -10.847 1.00 0.00 C ATOM 2282 CE2 TYR A 145 -0.665 -4.773 -12.576 1.00 0.00 C ATOM 2283 CZ TYR A 145 -0.821 -6.040 -12.055 1.00 0.00 C ATOM 2284 OH TYR A 145 -1.558 -6.973 -12.745 1.00 0.00 O ATOM 0 H TYR A 145 3.547 -3.474 -8.145 1.00 0.00 H new ATOM 0 HA TYR A 145 3.158 -3.805 -11.049 1.00 0.00 H new ATOM 0 HB2 TYR A 145 1.258 -3.188 -8.857 1.00 0.00 H new ATOM 0 HB3 TYR A 145 1.145 -2.113 -10.236 1.00 0.00 H new ATOM 0 HD1 TYR A 145 0.950 -5.690 -9.215 1.00 0.00 H new ATOM 0 HD2 TYR A 145 0.194 -2.844 -12.298 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -0.367 -7.366 -10.440 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -1.120 -4.516 -13.521 1.00 0.00 H new ATOM 0 HH TYR A 145 -1.895 -6.575 -13.575 1.00 0.00 H new ATOM 2294 N GLU A 146 4.083 -1.632 -11.531 1.00 0.00 N ATOM 2295 CA GLU A 146 4.567 -0.330 -11.936 1.00 0.00 C ATOM 2296 C GLU A 146 3.615 0.226 -12.984 1.00 0.00 C ATOM 2297 O GLU A 146 3.242 -0.485 -13.917 1.00 0.00 O ATOM 2298 CB GLU A 146 5.985 -0.434 -12.504 1.00 0.00 C ATOM 2299 CG GLU A 146 7.005 -0.980 -11.514 1.00 0.00 C ATOM 2300 CD GLU A 146 8.399 -1.067 -12.100 1.00 0.00 C ATOM 2301 OE1 GLU A 146 8.988 -0.007 -12.389 1.00 0.00 O ATOM 2302 OE2 GLU A 146 8.906 -2.200 -12.275 1.00 0.00 O ATOM 0 H GLU A 146 4.162 -2.350 -12.252 1.00 0.00 H new ATOM 0 HA GLU A 146 4.605 0.336 -11.074 1.00 0.00 H new ATOM 0 HB2 GLU A 146 5.967 -1.076 -13.385 1.00 0.00 H new ATOM 0 HB3 GLU A 146 6.307 0.553 -12.836 1.00 0.00 H new ATOM 0 HG2 GLU A 146 7.026 -0.342 -10.631 1.00 0.00 H new ATOM 0 HG3 GLU A 146 6.691 -1.970 -11.184 1.00 0.00 H new