USER MOD reduce.3.24.130724 H: found=0, std=0, add=974, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 975 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 66 TYR OH : rot 121:sc= -2.61! USER MOD Set 1.2: A 139 SER OG : rot -130:sc= -0.208 USER MOD Set 2.1: A 69 THR OG1 : rot 71:sc= 1.13 USER MOD Set 2.2: A 137 THR OG1 : rot 180:sc= -0.402 USER MOD Set 2.3: A 138 ASN :FLIP amide:sc= -2.11 F(o=-7.8!,f=-1.4) USER MOD Set 3.1: A 106 SER OG : rot -92:sc= 0.781 USER MOD Set 3.2: A 108 THR OG1 : rot 180:sc= 0.712 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot -152:sc= 0.891 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -0.492 X(o=-0.49,f=-0.023) USER MOD Single : A 48 ASN : amide:sc= -1.15 K(o=-1.2,f=-2.9!) USER MOD Single : A 60 ASN : amide:sc= -2.54! C(o=-2.5!,f=-2.3!) USER MOD Single : A 71 ASN :FLIP amide:sc= 0 F(o=-0.74,f=0) USER MOD Single : A 72 TYR OH : rot 150:sc= -0.947 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 TYR OH : rot -130:sc= -4.68! USER MOD Single : A 84 SER OG : rot 37:sc= -0.937 USER MOD Single : A 91 ASN :FLIP amide:sc= -0.126 F(o=-0.65,f=-0.13) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -119:sc= 0.203 (180deg=-0.0185) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot 180:sc= -0.761 USER MOD Single : A 115 LYS NZ :NH3+ 150:sc= 0.114 (180deg=-2.24!) USER MOD Single : A 120 LYS NZ :NH3+ -149:sc= -0.198 (180deg=-2.62!) USER MOD Single : A 128 LYS NZ :NH3+ -154:sc= 0.344 (180deg=-1.85!) USER MOD Single : A 132 SER OG : rot 30:sc= -4.97! USER MOD Single : A 133 ASN : amide:sc= -4.52! C(o=-4.5!,f=-5.2!) USER MOD Single : A 135 SER OG : rot 180:sc=-0.00371 USER MOD Single : A 140 SER OG : rot 180:sc= -2.83! USER MOD Single : A 149 HIS : no HD1:sc= -3.89 X(o=-3.9,f=-3.7!) USER MOD Single : A 154 THR OG1 : rot -26:sc= -0.714 USER MOD Single : A 156 LYS NZ :NH3+ -101:sc= -0.845 (180deg=-3.09!) USER MOD Single : A 157 THR OG1 : rot 180:sc= 0 USER MOD Single : A 159 ASN : amide:sc= -0.724 K(o=-0.72,f=-2.1!) USER MOD ----------------------------------------------------------------- ATOM 431 N GLU A 30 -18.641 -9.927 18.707 1.00 0.00 N ATOM 432 CA GLU A 30 -18.375 -9.341 17.399 1.00 0.00 C ATOM 433 C GLU A 30 -17.373 -8.194 17.504 1.00 0.00 C ATOM 434 O GLU A 30 -17.496 -7.324 18.365 1.00 0.00 O ATOM 435 CB GLU A 30 -19.674 -8.840 16.768 1.00 0.00 C ATOM 436 CG GLU A 30 -20.520 -9.946 16.156 1.00 0.00 C ATOM 437 CD GLU A 30 -21.981 -9.562 16.030 1.00 0.00 C ATOM 438 OE1 GLU A 30 -22.619 -9.307 17.074 1.00 0.00 O ATOM 439 OE2 GLU A 30 -22.485 -9.515 14.889 1.00 0.00 O ATOM 0 HA GLU A 30 -17.944 -10.116 16.765 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -20.261 -8.323 17.527 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -19.435 -8.108 15.997 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -20.127 -10.195 15.170 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -20.436 -10.844 16.769 1.00 0.00 H new ATOM 446 N VAL A 31 -16.387 -8.198 16.614 1.00 0.00 N ATOM 447 CA VAL A 31 -15.364 -7.161 16.593 1.00 0.00 C ATOM 448 C VAL A 31 -15.991 -5.788 16.351 1.00 0.00 C ATOM 449 O VAL A 31 -17.076 -5.686 15.778 1.00 0.00 O ATOM 450 CB VAL A 31 -14.287 -7.458 15.519 1.00 0.00 C ATOM 451 CG1 VAL A 31 -13.486 -6.216 15.167 1.00 0.00 C ATOM 452 CG2 VAL A 31 -13.354 -8.561 15.990 1.00 0.00 C ATOM 0 H VAL A 31 -16.275 -8.912 15.894 1.00 0.00 H new ATOM 0 HA VAL A 31 -14.878 -7.155 17.568 1.00 0.00 H new ATOM 0 HB VAL A 31 -14.807 -7.788 14.620 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -12.741 -6.465 14.411 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -14.156 -5.449 14.778 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -12.985 -5.841 16.060 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -12.605 -8.756 15.223 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -12.859 -8.251 16.910 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -13.928 -9.469 16.175 1.00 0.00 H new ATOM 462 N THR A 32 -15.301 -4.735 16.784 1.00 0.00 N ATOM 463 CA THR A 32 -15.792 -3.379 16.603 1.00 0.00 C ATOM 464 C THR A 32 -15.554 -2.950 15.168 1.00 0.00 C ATOM 465 O THR A 32 -16.445 -2.426 14.499 1.00 0.00 O ATOM 466 CB THR A 32 -15.094 -2.425 17.576 1.00 0.00 C ATOM 467 OG1 THR A 32 -15.635 -1.119 17.474 1.00 0.00 O ATOM 468 CG2 THR A 32 -13.602 -2.324 17.349 1.00 0.00 C ATOM 0 H THR A 32 -14.402 -4.799 17.261 1.00 0.00 H new ATOM 0 HA THR A 32 -16.861 -3.349 16.812 1.00 0.00 H new ATOM 0 HB THR A 32 -15.266 -2.847 18.566 1.00 0.00 H new ATOM 0 HG1 THR A 32 -15.177 -0.525 18.105 1.00 0.00 H new ATOM 0 HG21 THR A 32 -13.170 -1.632 18.072 1.00 0.00 H new ATOM 0 HG22 THR A 32 -13.148 -3.307 17.472 1.00 0.00 H new ATOM 0 HG23 THR A 32 -13.411 -1.960 16.340 1.00 0.00 H new ATOM 476 N GLY A 33 -14.343 -3.206 14.698 1.00 0.00 N ATOM 477 CA GLY A 33 -13.982 -2.883 13.347 1.00 0.00 C ATOM 478 C GLY A 33 -13.839 -1.405 13.109 1.00 0.00 C ATOM 479 O GLY A 33 -14.817 -0.663 13.178 1.00 0.00 O ATOM 0 H GLY A 33 -13.598 -3.639 15.244 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -13.042 -3.377 13.101 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -14.738 -3.282 12.671 1.00 0.00 H new ATOM 483 N SER A 34 -12.619 -0.980 12.817 1.00 0.00 N ATOM 484 CA SER A 34 -12.346 0.426 12.540 1.00 0.00 C ATOM 485 C SER A 34 -11.017 0.606 11.819 1.00 0.00 C ATOM 486 O SER A 34 -10.016 -0.024 12.162 1.00 0.00 O ATOM 487 CB SER A 34 -12.374 1.252 13.823 1.00 0.00 C ATOM 488 OG SER A 34 -12.504 2.634 13.540 1.00 0.00 O ATOM 0 H SER A 34 -11.801 -1.587 12.765 1.00 0.00 H new ATOM 0 HA SER A 34 -13.136 0.786 11.881 1.00 0.00 H new ATOM 0 HB2 SER A 34 -13.204 0.927 14.450 1.00 0.00 H new ATOM 0 HB3 SER A 34 -11.459 1.079 14.390 1.00 0.00 H new ATOM 0 HG SER A 34 -12.089 3.156 14.259 1.00 0.00 H new ATOM 494 N VAL A 35 -11.027 1.470 10.808 1.00 0.00 N ATOM 495 CA VAL A 35 -9.840 1.742 10.014 1.00 0.00 C ATOM 496 C VAL A 35 -9.047 2.912 10.577 1.00 0.00 C ATOM 497 O VAL A 35 -9.604 3.960 10.907 1.00 0.00 O ATOM 498 CB VAL A 35 -10.210 2.046 8.549 1.00 0.00 C ATOM 499 CG1 VAL A 35 -11.140 0.981 8.011 1.00 0.00 C ATOM 500 CG2 VAL A 35 -10.846 3.421 8.426 1.00 0.00 C ATOM 0 H VAL A 35 -11.852 1.996 10.520 1.00 0.00 H new ATOM 0 HA VAL A 35 -9.223 0.844 10.054 1.00 0.00 H new ATOM 0 HB VAL A 35 -9.295 2.042 7.956 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -11.393 1.208 6.975 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -10.648 0.010 8.059 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -12.050 0.956 8.610 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -11.098 3.613 7.383 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -11.752 3.458 9.031 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -10.145 4.179 8.775 1.00 0.00 H new ATOM 510 N SER A 36 -7.742 2.726 10.668 1.00 0.00 N ATOM 511 CA SER A 36 -6.851 3.764 11.174 1.00 0.00 C ATOM 512 C SER A 36 -6.238 4.547 10.017 1.00 0.00 C ATOM 513 O SER A 36 -5.378 4.039 9.301 1.00 0.00 O ATOM 514 CB SER A 36 -5.744 3.145 12.031 1.00 0.00 C ATOM 515 OG SER A 36 -4.653 4.038 12.179 1.00 0.00 O ATOM 0 H SER A 36 -7.271 1.863 10.398 1.00 0.00 H new ATOM 0 HA SER A 36 -7.434 4.447 11.792 1.00 0.00 H new ATOM 0 HB2 SER A 36 -6.142 2.886 13.012 1.00 0.00 H new ATOM 0 HB3 SER A 36 -5.400 2.218 11.572 1.00 0.00 H new ATOM 0 HG SER A 36 -3.960 3.619 12.732 1.00 0.00 H new ATOM 521 N LEU A 37 -6.692 5.785 9.835 1.00 0.00 N ATOM 522 CA LEU A 37 -6.192 6.630 8.754 1.00 0.00 C ATOM 523 C LEU A 37 -5.101 7.575 9.250 1.00 0.00 C ATOM 524 O LEU A 37 -5.346 8.430 10.102 1.00 0.00 O ATOM 525 CB LEU A 37 -7.340 7.438 8.138 1.00 0.00 C ATOM 526 CG LEU A 37 -7.780 6.985 6.742 1.00 0.00 C ATOM 527 CD1 LEU A 37 -8.800 7.953 6.161 1.00 0.00 C ATOM 528 CD2 LEU A 37 -6.579 6.859 5.816 1.00 0.00 C ATOM 0 H LEU A 37 -7.403 6.224 10.420 1.00 0.00 H new ATOM 0 HA LEU A 37 -5.760 5.979 7.993 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -8.199 7.387 8.807 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -7.039 8.484 8.085 1.00 0.00 H new ATOM 0 HG LEU A 37 -8.249 6.005 6.833 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.100 7.614 5.169 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.674 7.993 6.811 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.357 8.946 6.086 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -6.912 6.536 4.830 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.081 7.825 5.733 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -5.882 6.125 6.222 1.00 0.00 H new ATOM 540 N GLU A 38 -3.898 7.418 8.708 1.00 0.00 N ATOM 541 CA GLU A 38 -2.769 8.259 9.087 1.00 0.00 C ATOM 542 C GLU A 38 -1.922 8.615 7.868 1.00 0.00 C ATOM 543 O GLU A 38 -1.126 7.805 7.396 1.00 0.00 O ATOM 544 CB GLU A 38 -1.906 7.550 10.131 1.00 0.00 C ATOM 545 CG GLU A 38 -0.741 8.388 10.631 1.00 0.00 C ATOM 546 CD GLU A 38 0.345 7.553 11.278 1.00 0.00 C ATOM 547 OE1 GLU A 38 0.049 6.864 12.276 1.00 0.00 O ATOM 548 OE2 GLU A 38 1.493 7.587 10.789 1.00 0.00 O ATOM 0 H GLU A 38 -3.680 6.714 8.003 1.00 0.00 H new ATOM 0 HA GLU A 38 -3.163 9.181 9.516 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -2.532 7.272 10.979 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.520 6.625 9.703 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -0.316 8.946 9.797 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.108 9.120 11.350 1.00 0.00 H new ATOM 555 N ALA A 39 -2.100 9.831 7.359 1.00 0.00 N ATOM 556 CA ALA A 39 -1.350 10.288 6.194 1.00 0.00 C ATOM 557 C ALA A 39 -1.013 11.771 6.301 1.00 0.00 C ATOM 558 O ALA A 39 -1.645 12.510 7.056 1.00 0.00 O ATOM 559 CB ALA A 39 -2.142 10.017 4.921 1.00 0.00 C ATOM 0 H ALA A 39 -2.756 10.516 7.734 1.00 0.00 H new ATOM 0 HA ALA A 39 -0.413 9.733 6.156 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -1.573 10.362 4.058 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -2.328 8.947 4.829 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -3.093 10.548 4.964 1.00 0.00 H new ATOM 565 N LEU A 40 -0.013 12.203 5.536 1.00 0.00 N ATOM 566 CA LEU A 40 0.406 13.601 5.540 1.00 0.00 C ATOM 567 C LEU A 40 -0.750 14.511 5.144 1.00 0.00 C ATOM 568 O LEU A 40 -0.849 15.647 5.606 1.00 0.00 O ATOM 569 CB LEU A 40 1.584 13.805 4.587 1.00 0.00 C ATOM 570 CG LEU A 40 2.563 14.908 4.994 1.00 0.00 C ATOM 571 CD1 LEU A 40 3.973 14.566 4.538 1.00 0.00 C ATOM 572 CD2 LEU A 40 2.125 16.246 4.421 1.00 0.00 C ATOM 0 H LEU A 40 0.521 11.605 4.906 1.00 0.00 H new ATOM 0 HA LEU A 40 0.720 13.860 6.551 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.132 12.866 4.505 1.00 0.00 H new ATOM 0 HB3 LEU A 40 1.194 14.034 3.595 1.00 0.00 H new ATOM 0 HG LEU A 40 2.564 14.984 6.081 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.655 15.362 4.836 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.287 13.628 4.997 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.989 14.462 3.453 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.833 17.019 4.720 1.00 0.00 H new ATOM 0 HD22 LEU A 40 2.094 16.184 3.333 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.133 16.496 4.798 1.00 0.00 H new ATOM 584 N GLU A 41 -1.627 13.997 4.287 1.00 0.00 N ATOM 585 CA GLU A 41 -2.789 14.751 3.825 1.00 0.00 C ATOM 586 C GLU A 41 -2.381 15.904 2.914 1.00 0.00 C ATOM 587 O GLU A 41 -3.111 16.888 2.783 1.00 0.00 O ATOM 588 CB GLU A 41 -3.587 15.288 5.016 1.00 0.00 C ATOM 589 CG GLU A 41 -3.779 14.270 6.130 1.00 0.00 C ATOM 590 CD GLU A 41 -5.046 14.510 6.927 1.00 0.00 C ATOM 591 OE1 GLU A 41 -5.577 15.639 6.874 1.00 0.00 O ATOM 592 OE2 GLU A 41 -5.506 13.568 7.605 1.00 0.00 O ATOM 0 H GLU A 41 -1.555 13.057 3.897 1.00 0.00 H new ATOM 0 HA GLU A 41 -3.415 14.069 3.251 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -3.077 16.163 5.419 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -4.565 15.621 4.667 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -3.808 13.268 5.701 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -2.920 14.304 6.801 1.00 0.00 H new ATOM 599 N GLU A 42 -1.216 15.786 2.282 1.00 0.00 N ATOM 600 CA GLU A 42 -0.738 16.831 1.384 1.00 0.00 C ATOM 601 C GLU A 42 0.409 16.337 0.504 1.00 0.00 C ATOM 602 O GLU A 42 1.442 15.893 1.005 1.00 0.00 O ATOM 603 CB GLU A 42 -0.289 18.054 2.185 1.00 0.00 C ATOM 604 CG GLU A 42 -0.608 19.375 1.507 1.00 0.00 C ATOM 605 CD GLU A 42 -0.336 20.570 2.401 1.00 0.00 C ATOM 606 OE1 GLU A 42 -1.063 20.741 3.401 1.00 0.00 O ATOM 607 OE2 GLU A 42 0.606 21.334 2.100 1.00 0.00 O ATOM 0 H GLU A 42 -0.591 14.985 2.374 1.00 0.00 H new ATOM 0 HA GLU A 42 -1.567 17.109 0.732 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -0.768 18.033 3.164 1.00 0.00 H new ATOM 0 HB3 GLU A 42 0.786 17.992 2.355 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -0.015 19.464 0.597 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -1.656 19.381 1.207 1.00 0.00 H new ATOM 614 N VAL A 43 0.225 16.434 -0.811 1.00 0.00 N ATOM 615 CA VAL A 43 1.247 16.014 -1.762 1.00 0.00 C ATOM 616 C VAL A 43 1.270 16.949 -2.968 1.00 0.00 C ATOM 617 O VAL A 43 0.371 16.917 -3.801 1.00 0.00 O ATOM 618 CB VAL A 43 1.002 14.566 -2.238 1.00 0.00 C ATOM 619 CG1 VAL A 43 -0.439 14.388 -2.700 1.00 0.00 C ATOM 620 CG2 VAL A 43 1.977 14.180 -3.342 1.00 0.00 C ATOM 0 H VAL A 43 -0.624 16.801 -1.241 1.00 0.00 H new ATOM 0 HA VAL A 43 2.210 16.056 -1.253 1.00 0.00 H new ATOM 0 HB VAL A 43 1.174 13.900 -1.393 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -0.591 13.361 -3.031 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.116 14.606 -1.874 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.643 15.069 -3.526 1.00 0.00 H new ATOM 0 HG21 VAL A 43 1.782 13.155 -3.658 1.00 0.00 H new ATOM 0 HG22 VAL A 43 1.850 14.852 -4.191 1.00 0.00 H new ATOM 0 HG23 VAL A 43 2.998 14.256 -2.969 1.00 0.00 H new ATOM 630 N GLN A 44 2.305 17.782 -3.052 1.00 0.00 N ATOM 631 CA GLN A 44 2.442 18.733 -4.150 1.00 0.00 C ATOM 632 C GLN A 44 2.694 18.015 -5.482 1.00 0.00 C ATOM 633 O GLN A 44 3.549 17.132 -5.558 1.00 0.00 O ATOM 634 CB GLN A 44 3.592 19.700 -3.836 1.00 0.00 C ATOM 635 CG GLN A 44 4.489 20.026 -5.023 1.00 0.00 C ATOM 636 CD GLN A 44 5.473 21.132 -4.713 1.00 0.00 C ATOM 637 OE1 GLN A 44 6.672 21.001 -4.961 1.00 0.00 O ATOM 638 NE2 GLN A 44 4.970 22.232 -4.167 1.00 0.00 N ATOM 0 H GLN A 44 3.063 17.817 -2.370 1.00 0.00 H new ATOM 0 HA GLN A 44 1.510 19.290 -4.251 1.00 0.00 H new ATOM 0 HB2 GLN A 44 3.173 20.629 -3.449 1.00 0.00 H new ATOM 0 HB3 GLN A 44 4.204 19.271 -3.042 1.00 0.00 H new ATOM 0 HG2 GLN A 44 5.034 19.130 -5.320 1.00 0.00 H new ATOM 0 HG3 GLN A 44 3.872 20.319 -5.872 1.00 0.00 H new ATOM 0 HE21 GLN A 44 3.970 22.296 -3.979 1.00 0.00 H new ATOM 0 HE22 GLN A 44 5.584 23.013 -3.935 1.00 0.00 H new ATOM 647 N VAL A 45 1.949 18.400 -6.530 1.00 0.00 N ATOM 648 CA VAL A 45 2.089 17.805 -7.851 1.00 0.00 C ATOM 649 C VAL A 45 3.514 17.377 -8.155 1.00 0.00 C ATOM 650 O VAL A 45 4.468 18.126 -7.952 1.00 0.00 O ATOM 651 CB VAL A 45 1.590 18.774 -8.946 1.00 0.00 C ATOM 652 CG1 VAL A 45 2.370 18.615 -10.246 1.00 0.00 C ATOM 653 CG2 VAL A 45 0.116 18.537 -9.175 1.00 0.00 C ATOM 0 H VAL A 45 1.238 19.130 -6.477 1.00 0.00 H new ATOM 0 HA VAL A 45 1.471 16.907 -7.849 1.00 0.00 H new ATOM 0 HB VAL A 45 1.753 19.797 -8.606 1.00 0.00 H new ATOM 0 HG11 VAL A 45 1.987 19.315 -10.988 1.00 0.00 H new ATOM 0 HG12 VAL A 45 3.425 18.820 -10.065 1.00 0.00 H new ATOM 0 HG13 VAL A 45 2.257 17.596 -10.616 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -0.246 19.216 -9.947 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -0.041 17.507 -9.495 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -0.430 18.716 -8.249 1.00 0.00 H new ATOM 663 N GLY A 46 3.631 16.161 -8.658 1.00 0.00 N ATOM 664 CA GLY A 46 4.917 15.624 -9.008 1.00 0.00 C ATOM 665 C GLY A 46 5.454 14.670 -7.958 1.00 0.00 C ATOM 666 O GLY A 46 6.262 13.793 -8.261 1.00 0.00 O ATOM 0 H GLY A 46 2.846 15.533 -8.830 1.00 0.00 H new ATOM 0 HA2 GLY A 46 4.842 15.103 -9.963 1.00 0.00 H new ATOM 0 HA3 GLY A 46 5.624 16.442 -9.146 1.00 0.00 H new ATOM 670 N GLU A 47 4.996 14.840 -6.721 1.00 0.00 N ATOM 671 CA GLU A 47 5.428 13.985 -5.622 1.00 0.00 C ATOM 672 C GLU A 47 4.414 12.872 -5.375 1.00 0.00 C ATOM 673 O GLU A 47 3.329 12.869 -5.956 1.00 0.00 O ATOM 674 CB GLU A 47 5.615 14.813 -4.348 1.00 0.00 C ATOM 675 CG GLU A 47 6.559 14.177 -3.341 1.00 0.00 C ATOM 676 CD GLU A 47 7.502 15.183 -2.710 1.00 0.00 C ATOM 677 OE1 GLU A 47 7.118 15.803 -1.696 1.00 0.00 O ATOM 678 OE2 GLU A 47 8.626 15.352 -3.229 1.00 0.00 O ATOM 0 H GLU A 47 4.326 15.562 -6.456 1.00 0.00 H new ATOM 0 HA GLU A 47 6.381 13.533 -5.895 1.00 0.00 H new ATOM 0 HB2 GLU A 47 5.995 15.798 -4.618 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.644 14.964 -3.877 1.00 0.00 H new ATOM 0 HG2 GLU A 47 5.976 13.691 -2.559 1.00 0.00 H new ATOM 0 HG3 GLU A 47 7.141 13.399 -3.835 1.00 0.00 H new ATOM 685 N ASN A 48 4.774 11.929 -4.511 1.00 0.00 N ATOM 686 CA ASN A 48 3.893 10.812 -4.190 1.00 0.00 C ATOM 687 C ASN A 48 3.488 10.839 -2.721 1.00 0.00 C ATOM 688 O ASN A 48 4.233 11.323 -1.870 1.00 0.00 O ATOM 689 CB ASN A 48 4.579 9.485 -4.519 1.00 0.00 C ATOM 690 CG ASN A 48 5.857 9.285 -3.728 1.00 0.00 C ATOM 691 OD1 ASN A 48 6.155 10.044 -2.806 1.00 0.00 O ATOM 692 ND2 ASN A 48 6.619 8.258 -4.085 1.00 0.00 N ATOM 0 H ASN A 48 5.668 11.916 -4.021 1.00 0.00 H new ATOM 0 HA ASN A 48 2.992 10.908 -4.796 1.00 0.00 H new ATOM 0 HB2 ASN A 48 3.894 8.663 -4.311 1.00 0.00 H new ATOM 0 HB3 ASN A 48 4.805 9.450 -5.585 1.00 0.00 H new ATOM 0 HD21 ASN A 48 7.490 8.073 -3.588 1.00 0.00 H new ATOM 0 HD22 ASN A 48 6.333 7.654 -4.856 1.00 0.00 H new ATOM 699 N LEU A 49 2.303 10.313 -2.429 1.00 0.00 N ATOM 700 CA LEU A 49 1.798 10.275 -1.063 1.00 0.00 C ATOM 701 C LEU A 49 1.313 8.876 -0.702 1.00 0.00 C ATOM 702 O LEU A 49 0.727 8.180 -1.531 1.00 0.00 O ATOM 703 CB LEU A 49 0.660 11.281 -0.885 1.00 0.00 C ATOM 704 CG LEU A 49 0.636 11.996 0.467 1.00 0.00 C ATOM 705 CD1 LEU A 49 1.946 12.733 0.705 1.00 0.00 C ATOM 706 CD2 LEU A 49 -0.545 12.954 0.545 1.00 0.00 C ATOM 0 H LEU A 49 1.674 9.907 -3.122 1.00 0.00 H new ATOM 0 HA LEU A 49 2.616 10.543 -0.395 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.730 12.030 -1.674 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -0.289 10.762 -1.022 1.00 0.00 H new ATOM 0 HG LEU A 49 0.519 11.247 1.251 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.910 13.236 1.672 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.771 12.021 0.697 1.00 0.00 H new ATOM 0 HD13 LEU A 49 2.096 13.471 -0.083 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -0.545 13.453 1.514 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.462 13.699 -0.247 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -1.474 12.397 0.424 1.00 0.00 H new ATOM 718 N GLU A 50 1.561 8.471 0.538 1.00 0.00 N ATOM 719 CA GLU A 50 1.152 7.151 1.007 1.00 0.00 C ATOM 720 C GLU A 50 0.266 7.264 2.244 1.00 0.00 C ATOM 721 O GLU A 50 0.702 7.745 3.289 1.00 0.00 O ATOM 722 CB GLU A 50 2.379 6.292 1.324 1.00 0.00 C ATOM 723 CG GLU A 50 3.565 6.555 0.407 1.00 0.00 C ATOM 724 CD GLU A 50 4.679 7.315 1.097 1.00 0.00 C ATOM 725 OE1 GLU A 50 4.840 7.151 2.325 1.00 0.00 O ATOM 726 OE2 GLU A 50 5.392 8.078 0.410 1.00 0.00 O ATOM 0 H GLU A 50 2.043 9.037 1.237 1.00 0.00 H new ATOM 0 HA GLU A 50 0.580 6.674 0.211 1.00 0.00 H new ATOM 0 HB2 GLU A 50 2.682 6.473 2.355 1.00 0.00 H new ATOM 0 HB3 GLU A 50 2.103 5.240 1.253 1.00 0.00 H new ATOM 0 HG2 GLU A 50 3.952 5.605 0.039 1.00 0.00 H new ATOM 0 HG3 GLU A 50 3.229 7.120 -0.462 1.00 0.00 H new ATOM 733 N VAL A 51 -0.978 6.813 2.117 1.00 0.00 N ATOM 734 CA VAL A 51 -1.924 6.861 3.226 1.00 0.00 C ATOM 735 C VAL A 51 -1.914 5.551 4.008 1.00 0.00 C ATOM 736 O VAL A 51 -2.543 4.571 3.610 1.00 0.00 O ATOM 737 CB VAL A 51 -3.355 7.152 2.728 1.00 0.00 C ATOM 738 CG1 VAL A 51 -3.804 6.092 1.730 1.00 0.00 C ATOM 739 CG2 VAL A 51 -4.323 7.244 3.898 1.00 0.00 C ATOM 0 H VAL A 51 -1.354 6.411 1.258 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.610 7.671 3.884 1.00 0.00 H new ATOM 0 HB VAL A 51 -3.351 8.115 2.217 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.816 6.316 1.392 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.128 6.088 0.875 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -3.790 5.113 2.208 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -5.326 7.450 3.525 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -4.325 6.300 4.444 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -4.012 8.048 4.565 1.00 0.00 H new ATOM 749 N GLY A 52 -1.189 5.541 5.122 1.00 0.00 N ATOM 750 CA GLY A 52 -1.101 4.350 5.943 1.00 0.00 C ATOM 751 C GLY A 52 -2.405 4.019 6.642 1.00 0.00 C ATOM 752 O GLY A 52 -2.507 4.140 7.863 1.00 0.00 O ATOM 0 H GLY A 52 -0.660 6.340 5.471 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -0.804 3.506 5.320 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.319 4.486 6.690 1.00 0.00 H new ATOM 756 N VAL A 53 -3.402 3.594 5.873 1.00 0.00 N ATOM 757 CA VAL A 53 -4.696 3.239 6.441 1.00 0.00 C ATOM 758 C VAL A 53 -4.641 1.852 7.074 1.00 0.00 C ATOM 759 O VAL A 53 -4.803 0.838 6.394 1.00 0.00 O ATOM 760 CB VAL A 53 -5.815 3.275 5.379 1.00 0.00 C ATOM 761 CG1 VAL A 53 -5.514 2.305 4.245 1.00 0.00 C ATOM 762 CG2 VAL A 53 -7.168 2.967 6.011 1.00 0.00 C ATOM 0 H VAL A 53 -3.339 3.488 4.861 1.00 0.00 H new ATOM 0 HA VAL A 53 -4.926 3.980 7.206 1.00 0.00 H new ATOM 0 HB VAL A 53 -5.856 4.281 4.962 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -6.316 2.347 3.508 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -4.571 2.580 3.772 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -5.439 1.293 4.642 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -7.943 2.998 5.245 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -7.142 1.975 6.461 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -7.388 3.708 6.779 1.00 0.00 H new ATOM 772 N GLY A 54 -4.399 1.814 8.379 1.00 0.00 N ATOM 773 CA GLY A 54 -4.316 0.549 9.081 1.00 0.00 C ATOM 774 C GLY A 54 -5.561 0.242 9.887 1.00 0.00 C ATOM 775 O GLY A 54 -6.680 0.408 9.402 1.00 0.00 O ATOM 0 H GLY A 54 -4.259 2.638 8.963 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -4.149 -0.251 8.360 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -3.453 0.564 9.746 1.00 0.00 H new ATOM 779 N ILE A 55 -5.365 -0.213 11.119 1.00 0.00 N ATOM 780 CA ILE A 55 -6.480 -0.551 11.997 1.00 0.00 C ATOM 781 C ILE A 55 -6.647 0.477 13.112 1.00 0.00 C ATOM 782 O ILE A 55 -5.706 0.766 13.850 1.00 0.00 O ATOM 783 CB ILE A 55 -6.303 -1.966 12.615 1.00 0.00 C ATOM 784 CG1 ILE A 55 -7.303 -2.949 12.004 1.00 0.00 C ATOM 785 CG2 ILE A 55 -6.456 -1.941 14.133 1.00 0.00 C ATOM 786 CD1 ILE A 55 -6.661 -3.959 11.082 1.00 0.00 C ATOM 0 H ILE A 55 -4.444 -0.357 11.533 1.00 0.00 H new ATOM 0 HA ILE A 55 -7.379 -0.545 11.381 1.00 0.00 H new ATOM 0 HB ILE A 55 -5.291 -2.297 12.384 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -7.820 -3.476 12.806 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -8.059 -2.391 11.451 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -6.326 -2.948 14.528 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -5.702 -1.282 14.564 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -7.449 -1.575 14.393 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -7.426 -4.625 10.683 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -6.168 -3.440 10.260 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -5.925 -4.542 11.636 1.00 0.00 H new ATOM 798 N ASP A 56 -7.860 0.999 13.247 1.00 0.00 N ATOM 799 CA ASP A 56 -8.162 1.964 14.294 1.00 0.00 C ATOM 800 C ASP A 56 -8.730 1.232 15.502 1.00 0.00 C ATOM 801 O ASP A 56 -8.435 1.570 16.648 1.00 0.00 O ATOM 802 CB ASP A 56 -9.161 3.011 13.794 1.00 0.00 C ATOM 803 CG ASP A 56 -9.485 4.051 14.849 1.00 0.00 C ATOM 804 OD1 ASP A 56 -8.619 4.316 15.707 1.00 0.00 O ATOM 805 OD2 ASP A 56 -10.606 4.601 14.816 1.00 0.00 O ATOM 0 H ASP A 56 -8.650 0.769 12.644 1.00 0.00 H new ATOM 0 HA ASP A 56 -7.244 2.480 14.577 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -8.754 3.506 12.913 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -10.080 2.513 13.484 1.00 0.00 H new ATOM 810 N GLU A 57 -9.530 0.207 15.222 1.00 0.00 N ATOM 811 CA GLU A 57 -10.137 -0.611 16.262 1.00 0.00 C ATOM 812 C GLU A 57 -10.600 -1.948 15.692 1.00 0.00 C ATOM 813 O GLU A 57 -11.253 -2.006 14.652 1.00 0.00 O ATOM 814 CB GLU A 57 -11.319 0.108 16.912 1.00 0.00 C ATOM 815 CG GLU A 57 -10.920 1.283 17.790 1.00 0.00 C ATOM 816 CD GLU A 57 -10.928 2.601 17.040 1.00 0.00 C ATOM 817 OE1 GLU A 57 -11.663 2.707 16.036 1.00 0.00 O ATOM 818 OE2 GLU A 57 -10.199 3.525 17.456 1.00 0.00 O ATOM 0 H GLU A 57 -9.773 -0.077 14.273 1.00 0.00 H new ATOM 0 HA GLU A 57 -9.378 -0.790 17.024 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -11.990 0.463 16.130 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -11.881 -0.607 17.513 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -11.603 1.347 18.637 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -9.924 1.106 18.196 1.00 0.00 H new ATOM 825 N LEU A 58 -10.250 -3.016 16.386 1.00 0.00 N ATOM 826 CA LEU A 58 -10.611 -4.372 15.979 1.00 0.00 C ATOM 827 C LEU A 58 -10.460 -5.329 17.154 1.00 0.00 C ATOM 828 O LEU A 58 -9.379 -5.869 17.385 1.00 0.00 O ATOM 829 CB LEU A 58 -9.717 -4.829 14.823 1.00 0.00 C ATOM 830 CG LEU A 58 -10.395 -5.730 13.791 1.00 0.00 C ATOM 831 CD1 LEU A 58 -9.670 -5.649 12.457 1.00 0.00 C ATOM 832 CD2 LEU A 58 -10.441 -7.167 14.290 1.00 0.00 C ATOM 0 H LEU A 58 -9.707 -2.973 17.249 1.00 0.00 H new ATOM 0 HA LEU A 58 -11.650 -4.373 15.649 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -9.331 -3.946 14.313 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -8.859 -5.359 15.236 1.00 0.00 H new ATOM 0 HG LEU A 58 -11.418 -5.383 13.647 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -10.166 -6.296 11.734 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -9.687 -4.621 12.095 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -8.637 -5.972 12.584 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -10.927 -7.796 13.544 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -9.426 -7.525 14.461 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -11.003 -7.210 15.223 1.00 0.00 H new ATOM 844 N VAL A 59 -11.536 -5.527 17.912 1.00 0.00 N ATOM 845 CA VAL A 59 -11.479 -6.410 19.071 1.00 0.00 C ATOM 846 C VAL A 59 -12.476 -7.555 18.990 1.00 0.00 C ATOM 847 O VAL A 59 -13.676 -7.350 19.124 1.00 0.00 O ATOM 848 CB VAL A 59 -11.701 -5.628 20.382 1.00 0.00 C ATOM 849 CG1 VAL A 59 -13.117 -5.072 20.448 1.00 0.00 C ATOM 850 CG2 VAL A 59 -11.411 -6.510 21.587 1.00 0.00 C ATOM 0 H VAL A 59 -12.445 -5.094 17.747 1.00 0.00 H new ATOM 0 HA VAL A 59 -10.477 -6.839 19.069 1.00 0.00 H new ATOM 0 HB VAL A 59 -11.007 -4.787 20.399 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -13.250 -4.525 21.381 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -13.284 -4.400 19.606 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -13.833 -5.893 20.404 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -11.573 -5.941 22.502 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -12.076 -7.374 21.574 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -10.376 -6.849 21.549 1.00 0.00 H new ATOM 860 N ASN A 60 -11.933 -8.764 18.783 1.00 0.00 N ATOM 861 CA ASN A 60 -12.703 -10.019 18.683 1.00 0.00 C ATOM 862 C ASN A 60 -12.307 -10.825 17.447 1.00 0.00 C ATOM 863 O ASN A 60 -13.047 -11.707 17.013 1.00 0.00 O ATOM 864 CB ASN A 60 -14.223 -9.800 18.681 1.00 0.00 C ATOM 865 CG ASN A 60 -14.776 -9.553 20.067 1.00 0.00 C ATOM 866 OD1 ASN A 60 -14.477 -10.287 21.010 1.00 0.00 O ATOM 867 ND2 ASN A 60 -15.587 -8.513 20.196 1.00 0.00 N ATOM 0 H ASN A 60 -10.928 -8.902 18.678 1.00 0.00 H new ATOM 0 HA ASN A 60 -12.450 -10.582 19.581 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -14.463 -8.951 18.041 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -14.712 -10.673 18.249 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -15.992 -8.292 21.106 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -15.806 -7.933 19.386 1.00 0.00 H new ATOM 874 N ALA A 61 -11.140 -10.525 16.885 1.00 0.00 N ATOM 875 CA ALA A 61 -10.659 -11.233 15.706 1.00 0.00 C ATOM 876 C ALA A 61 -9.136 -11.273 15.677 1.00 0.00 C ATOM 877 O ALA A 61 -8.476 -10.760 16.582 1.00 0.00 O ATOM 878 CB ALA A 61 -11.200 -10.577 14.447 1.00 0.00 C ATOM 0 H ALA A 61 -10.512 -9.798 17.227 1.00 0.00 H new ATOM 0 HA ALA A 61 -11.020 -12.261 15.750 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.835 -11.114 13.571 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -12.290 -10.605 14.461 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.864 -9.541 14.404 1.00 0.00 H new ATOM 884 N GLU A 62 -8.580 -11.881 14.634 1.00 0.00 N ATOM 885 CA GLU A 62 -7.131 -11.982 14.494 1.00 0.00 C ATOM 886 C GLU A 62 -6.686 -11.454 13.135 1.00 0.00 C ATOM 887 O GLU A 62 -6.526 -12.217 12.183 1.00 0.00 O ATOM 888 CB GLU A 62 -6.678 -13.433 14.673 1.00 0.00 C ATOM 889 CG GLU A 62 -5.553 -13.598 15.681 1.00 0.00 C ATOM 890 CD GLU A 62 -5.734 -14.819 16.561 1.00 0.00 C ATOM 891 OE1 GLU A 62 -5.922 -15.923 16.013 1.00 0.00 O ATOM 892 OE2 GLU A 62 -5.687 -14.667 17.801 1.00 0.00 O ATOM 0 H GLU A 62 -9.109 -12.310 13.875 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.668 -11.373 15.270 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.530 -14.035 14.990 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -6.352 -13.825 13.710 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.603 -13.674 15.151 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.498 -12.708 16.308 1.00 0.00 H new ATOM 899 N ALA A 63 -6.490 -10.143 13.051 1.00 0.00 N ATOM 900 CA ALA A 63 -6.070 -9.516 11.806 1.00 0.00 C ATOM 901 C ALA A 63 -4.700 -10.024 11.369 1.00 0.00 C ATOM 902 O ALA A 63 -3.688 -9.748 12.012 1.00 0.00 O ATOM 903 CB ALA A 63 -6.057 -8.002 11.958 1.00 0.00 C ATOM 0 H ALA A 63 -6.615 -9.496 13.829 1.00 0.00 H new ATOM 0 HA ALA A 63 -6.787 -9.784 11.030 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -5.741 -7.545 11.020 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.058 -7.653 12.213 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -5.363 -7.722 12.750 1.00 0.00 H new ATOM 909 N PHE A 64 -4.678 -10.770 10.267 1.00 0.00 N ATOM 910 CA PHE A 64 -3.437 -11.321 9.736 1.00 0.00 C ATOM 911 C PHE A 64 -3.119 -10.725 8.368 1.00 0.00 C ATOM 912 O PHE A 64 -2.003 -10.273 8.121 1.00 0.00 O ATOM 913 CB PHE A 64 -3.537 -12.845 9.630 1.00 0.00 C ATOM 914 CG PHE A 64 -2.927 -13.570 10.798 1.00 0.00 C ATOM 915 CD1 PHE A 64 -1.557 -13.771 10.868 1.00 0.00 C ATOM 916 CD2 PHE A 64 -3.725 -14.052 11.823 1.00 0.00 C ATOM 917 CE1 PHE A 64 -0.995 -14.438 11.938 1.00 0.00 C ATOM 918 CE2 PHE A 64 -3.168 -14.720 12.897 1.00 0.00 C ATOM 919 CZ PHE A 64 -1.802 -14.913 12.955 1.00 0.00 C ATOM 0 H PHE A 64 -5.509 -11.006 9.724 1.00 0.00 H new ATOM 0 HA PHE A 64 -2.630 -11.062 10.422 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.586 -13.127 9.546 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.045 -13.170 8.714 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.922 -13.401 10.076 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -4.794 -13.904 11.782 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.074 -14.589 11.981 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -3.800 -15.091 13.690 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.365 -15.434 13.794 1.00 0.00 H new ATOM 929 N ALA A 65 -4.112 -10.728 7.483 1.00 0.00 N ATOM 930 CA ALA A 65 -3.940 -10.186 6.141 1.00 0.00 C ATOM 931 C ALA A 65 -4.955 -9.084 5.863 1.00 0.00 C ATOM 932 O ALA A 65 -6.156 -9.342 5.772 1.00 0.00 O ATOM 933 CB ALA A 65 -4.063 -11.294 5.105 1.00 0.00 C ATOM 0 H ALA A 65 -5.043 -11.100 7.672 1.00 0.00 H new ATOM 0 HA ALA A 65 -2.943 -9.752 6.075 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -3.932 -10.875 4.107 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -3.296 -12.048 5.285 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -5.048 -11.754 5.179 1.00 0.00 H new ATOM 939 N TYR A 66 -4.467 -7.855 5.735 1.00 0.00 N ATOM 940 CA TYR A 66 -5.323 -6.712 5.480 1.00 0.00 C ATOM 941 C TYR A 66 -5.592 -6.538 3.988 1.00 0.00 C ATOM 942 O TYR A 66 -4.686 -6.648 3.162 1.00 0.00 O ATOM 943 CB TYR A 66 -4.673 -5.448 6.037 1.00 0.00 C ATOM 944 CG TYR A 66 -5.667 -4.403 6.465 1.00 0.00 C ATOM 945 CD1 TYR A 66 -6.781 -4.750 7.211 1.00 0.00 C ATOM 946 CD2 TYR A 66 -5.493 -3.072 6.117 1.00 0.00 C ATOM 947 CE1 TYR A 66 -7.698 -3.799 7.602 1.00 0.00 C ATOM 948 CE2 TYR A 66 -6.404 -2.112 6.504 1.00 0.00 C ATOM 949 CZ TYR A 66 -7.505 -2.480 7.247 1.00 0.00 C ATOM 950 OH TYR A 66 -8.418 -1.525 7.634 1.00 0.00 O ATOM 0 H TYR A 66 -3.475 -7.628 5.805 1.00 0.00 H new ATOM 0 HA TYR A 66 -6.277 -6.887 5.977 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -4.048 -5.715 6.889 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -4.014 -5.023 5.280 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -6.933 -5.782 7.491 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -4.631 -2.783 5.534 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -8.563 -4.084 8.183 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -6.256 -1.079 6.227 1.00 0.00 H new ATOM 0 HH TYR A 66 -7.968 -0.843 8.175 1.00 0.00 H new ATOM 960 N ASP A 67 -6.844 -6.258 3.655 1.00 0.00 N ATOM 961 CA ASP A 67 -7.242 -6.054 2.269 1.00 0.00 C ATOM 962 C ASP A 67 -8.374 -5.037 2.189 1.00 0.00 C ATOM 963 O ASP A 67 -9.502 -5.315 2.596 1.00 0.00 O ATOM 964 CB ASP A 67 -7.682 -7.378 1.640 1.00 0.00 C ATOM 965 CG ASP A 67 -6.694 -8.498 1.902 1.00 0.00 C ATOM 966 OD1 ASP A 67 -5.534 -8.383 1.453 1.00 0.00 O ATOM 967 OD2 ASP A 67 -7.080 -9.489 2.555 1.00 0.00 O ATOM 0 H ASP A 67 -7.605 -6.167 4.329 1.00 0.00 H new ATOM 0 HA ASP A 67 -6.384 -5.671 1.716 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -8.658 -7.658 2.035 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -7.800 -7.245 0.565 1.00 0.00 H new ATOM 972 N PHE A 68 -8.067 -3.855 1.666 1.00 0.00 N ATOM 973 CA PHE A 68 -9.065 -2.799 1.543 1.00 0.00 C ATOM 974 C PHE A 68 -9.082 -2.212 0.136 1.00 0.00 C ATOM 975 O PHE A 68 -8.218 -2.514 -0.686 1.00 0.00 O ATOM 976 CB PHE A 68 -8.801 -1.694 2.568 1.00 0.00 C ATOM 977 CG PHE A 68 -7.464 -1.027 2.405 1.00 0.00 C ATOM 978 CD1 PHE A 68 -7.270 -0.066 1.427 1.00 0.00 C ATOM 979 CD2 PHE A 68 -6.404 -1.362 3.231 1.00 0.00 C ATOM 980 CE1 PHE A 68 -6.041 0.551 1.276 1.00 0.00 C ATOM 981 CE2 PHE A 68 -5.174 -0.751 3.084 1.00 0.00 C ATOM 982 CZ PHE A 68 -4.993 0.207 2.107 1.00 0.00 C ATOM 0 H PHE A 68 -7.140 -3.605 1.322 1.00 0.00 H new ATOM 0 HA PHE A 68 -10.042 -3.241 1.738 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -9.585 -0.941 2.488 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -8.867 -2.117 3.570 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -8.087 0.205 0.775 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -6.541 -2.109 3.999 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -5.902 1.300 0.510 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -4.355 -1.023 3.733 1.00 0.00 H new ATOM 0 HZ PHE A 68 -4.032 0.687 1.992 1.00 0.00 H new ATOM 992 N THR A 69 -10.074 -1.372 -0.129 1.00 0.00 N ATOM 993 CA THR A 69 -10.215 -0.734 -1.432 1.00 0.00 C ATOM 994 C THR A 69 -10.268 0.782 -1.283 1.00 0.00 C ATOM 995 O THR A 69 -11.281 1.339 -0.857 1.00 0.00 O ATOM 996 CB THR A 69 -11.477 -1.241 -2.133 1.00 0.00 C ATOM 997 OG1 THR A 69 -11.931 -2.446 -1.541 1.00 0.00 O ATOM 998 CG2 THR A 69 -11.283 -1.507 -3.608 1.00 0.00 C ATOM 0 H THR A 69 -10.796 -1.116 0.544 1.00 0.00 H new ATOM 0 HA THR A 69 -9.347 -0.991 -2.039 1.00 0.00 H new ATOM 0 HB THR A 69 -12.207 -0.440 -2.018 1.00 0.00 H new ATOM 0 HG1 THR A 69 -12.302 -2.255 -0.654 1.00 0.00 H new ATOM 0 HG21 THR A 69 -12.218 -1.864 -4.039 1.00 0.00 H new ATOM 0 HG22 THR A 69 -10.981 -0.586 -4.107 1.00 0.00 H new ATOM 0 HG23 THR A 69 -10.510 -2.263 -3.743 1.00 0.00 H new ATOM 1006 N LEU A 70 -9.169 1.445 -1.628 1.00 0.00 N ATOM 1007 CA LEU A 70 -9.091 2.899 -1.522 1.00 0.00 C ATOM 1008 C LEU A 70 -9.833 3.574 -2.670 1.00 0.00 C ATOM 1009 O LEU A 70 -9.917 3.034 -3.773 1.00 0.00 O ATOM 1010 CB LEU A 70 -7.629 3.351 -1.508 1.00 0.00 C ATOM 1011 CG LEU A 70 -6.865 3.120 -2.815 1.00 0.00 C ATOM 1012 CD1 LEU A 70 -5.978 4.312 -3.134 1.00 0.00 C ATOM 1013 CD2 LEU A 70 -6.038 1.844 -2.730 1.00 0.00 C ATOM 0 H LEU A 70 -8.322 1.001 -1.982 1.00 0.00 H new ATOM 0 HA LEU A 70 -9.567 3.194 -0.587 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.596 4.414 -1.269 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -7.111 2.827 -0.705 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.589 3.008 -3.622 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -5.444 4.129 -4.066 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -6.593 5.206 -3.238 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -5.260 4.458 -2.327 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.502 1.695 -3.667 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -5.323 1.928 -1.912 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -6.697 0.995 -2.550 1.00 0.00 H new ATOM 1025 N ASN A 71 -10.369 4.761 -2.401 1.00 0.00 N ATOM 1026 CA ASN A 71 -11.105 5.516 -3.407 1.00 0.00 C ATOM 1027 C ASN A 71 -10.525 6.918 -3.565 1.00 0.00 C ATOM 1028 O ASN A 71 -10.737 7.786 -2.720 1.00 0.00 O ATOM 1029 CB ASN A 71 -12.585 5.604 -3.031 1.00 0.00 C ATOM 1030 CG ASN A 71 -13.337 4.324 -3.342 1.00 0.00 C ATOM 1031 OD1 ASN A 71 -12.961 3.241 -2.674 1.00 0.00 O flip ATOM 1032 ND2 ASN A 71 -14.245 4.311 -4.173 1.00 0.00 N flip ATOM 0 H ASN A 71 -10.307 5.221 -1.493 1.00 0.00 H new ATOM 0 HA ASN A 71 -11.011 4.992 -4.358 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -12.674 5.826 -1.968 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -13.045 6.433 -3.569 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -14.500 5.168 -4.663 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -14.742 3.443 -4.372 1.00 0.00 H new ATOM 1039 N TYR A 72 -9.792 7.130 -4.652 1.00 0.00 N ATOM 1040 CA TYR A 72 -9.178 8.424 -4.923 1.00 0.00 C ATOM 1041 C TYR A 72 -9.659 8.985 -6.257 1.00 0.00 C ATOM 1042 O TYR A 72 -10.591 8.456 -6.864 1.00 0.00 O ATOM 1043 CB TYR A 72 -7.654 8.292 -4.929 1.00 0.00 C ATOM 1044 CG TYR A 72 -7.128 7.392 -6.024 1.00 0.00 C ATOM 1045 CD1 TYR A 72 -7.266 6.013 -5.941 1.00 0.00 C ATOM 1046 CD2 TYR A 72 -6.493 7.923 -7.139 1.00 0.00 C ATOM 1047 CE1 TYR A 72 -6.788 5.187 -6.939 1.00 0.00 C ATOM 1048 CE2 TYR A 72 -6.011 7.103 -8.143 1.00 0.00 C ATOM 1049 CZ TYR A 72 -6.161 5.736 -8.038 1.00 0.00 C ATOM 1050 OH TYR A 72 -5.682 4.917 -9.033 1.00 0.00 O ATOM 0 H TYR A 72 -9.608 6.420 -5.361 1.00 0.00 H new ATOM 0 HA TYR A 72 -9.474 9.115 -4.133 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -7.212 9.282 -5.041 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -7.328 7.905 -3.964 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -7.755 5.579 -5.082 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -6.374 8.993 -7.223 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -6.905 4.116 -6.859 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -5.520 7.531 -9.005 1.00 0.00 H new ATOM 0 HH TYR A 72 -5.715 5.390 -9.890 1.00 0.00 H new ATOM 1060 N ASP A 73 -9.020 10.060 -6.712 1.00 0.00 N ATOM 1061 CA ASP A 73 -9.384 10.690 -7.975 1.00 0.00 C ATOM 1062 C ASP A 73 -8.467 10.222 -9.101 1.00 0.00 C ATOM 1063 O ASP A 73 -7.252 10.127 -8.927 1.00 0.00 O ATOM 1064 CB ASP A 73 -9.317 12.213 -7.847 1.00 0.00 C ATOM 1065 CG ASP A 73 -10.269 12.915 -8.795 1.00 0.00 C ATOM 1066 OD1 ASP A 73 -10.523 12.372 -9.892 1.00 0.00 O ATOM 1067 OD2 ASP A 73 -10.760 14.008 -8.443 1.00 0.00 O ATOM 0 H ASP A 73 -8.247 10.512 -6.223 1.00 0.00 H new ATOM 0 HA ASP A 73 -10.406 10.397 -8.217 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -9.552 12.499 -6.822 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -8.299 12.547 -8.046 1.00 0.00 H new ATOM 1072 N GLU A 74 -9.056 9.930 -10.254 1.00 0.00 N ATOM 1073 CA GLU A 74 -8.292 9.472 -11.410 1.00 0.00 C ATOM 1074 C GLU A 74 -7.915 10.638 -12.318 1.00 0.00 C ATOM 1075 O GLU A 74 -6.917 10.582 -13.035 1.00 0.00 O ATOM 1076 CB GLU A 74 -9.095 8.437 -12.199 1.00 0.00 C ATOM 1077 CG GLU A 74 -10.375 8.991 -12.801 1.00 0.00 C ATOM 1078 CD GLU A 74 -11.576 8.801 -11.894 1.00 0.00 C ATOM 1079 OE1 GLU A 74 -11.524 7.912 -11.018 1.00 0.00 O ATOM 1080 OE2 GLU A 74 -12.566 9.543 -12.057 1.00 0.00 O ATOM 0 H GLU A 74 -10.061 10.002 -10.415 1.00 0.00 H new ATOM 0 HA GLU A 74 -7.374 9.012 -11.044 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.471 8.037 -12.998 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -9.343 7.604 -11.542 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -10.245 10.053 -13.008 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.565 8.501 -13.756 1.00 0.00 H new ATOM 1087 N ASN A 75 -8.722 11.694 -12.285 1.00 0.00 N ATOM 1088 CA ASN A 75 -8.475 12.871 -13.109 1.00 0.00 C ATOM 1089 C ASN A 75 -7.349 13.721 -12.529 1.00 0.00 C ATOM 1090 O ASN A 75 -6.629 14.400 -13.263 1.00 0.00 O ATOM 1091 CB ASN A 75 -9.748 13.709 -13.234 1.00 0.00 C ATOM 1092 CG ASN A 75 -10.811 13.026 -14.072 1.00 0.00 C ATOM 1093 OD1 ASN A 75 -10.762 13.055 -15.301 1.00 0.00 O ATOM 1094 ND2 ASN A 75 -11.778 12.405 -13.408 1.00 0.00 N ATOM 0 H ASN A 75 -9.552 11.758 -11.696 1.00 0.00 H new ATOM 0 HA ASN A 75 -8.173 12.530 -14.099 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -10.147 13.909 -12.240 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -9.503 14.673 -13.679 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -12.520 11.926 -13.918 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -11.779 12.407 -12.388 1.00 0.00 H new ATOM 1101 N ALA A 76 -7.201 13.683 -11.208 1.00 0.00 N ATOM 1102 CA ALA A 76 -6.162 14.454 -10.536 1.00 0.00 C ATOM 1103 C ALA A 76 -5.058 13.549 -10.002 1.00 0.00 C ATOM 1104 O ALA A 76 -3.874 13.800 -10.229 1.00 0.00 O ATOM 1105 CB ALA A 76 -6.765 15.273 -9.404 1.00 0.00 C ATOM 0 H ALA A 76 -7.786 13.128 -10.584 1.00 0.00 H new ATOM 0 HA ALA A 76 -5.718 15.129 -11.268 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -5.979 15.844 -8.910 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -7.512 15.957 -9.807 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -7.236 14.605 -8.683 1.00 0.00 H new ATOM 1111 N PHE A 77 -5.449 12.497 -9.292 1.00 0.00 N ATOM 1112 CA PHE A 77 -4.487 11.557 -8.726 1.00 0.00 C ATOM 1113 C PHE A 77 -4.251 10.383 -9.670 1.00 0.00 C ATOM 1114 O PHE A 77 -4.793 10.341 -10.775 1.00 0.00 O ATOM 1115 CB PHE A 77 -4.975 11.050 -7.368 1.00 0.00 C ATOM 1116 CG PHE A 77 -4.427 11.828 -6.205 1.00 0.00 C ATOM 1117 CD1 PHE A 77 -3.121 11.639 -5.783 1.00 0.00 C ATOM 1118 CD2 PHE A 77 -5.219 12.746 -5.534 1.00 0.00 C ATOM 1119 CE1 PHE A 77 -2.615 12.355 -4.714 1.00 0.00 C ATOM 1120 CE2 PHE A 77 -4.718 13.463 -4.464 1.00 0.00 C ATOM 1121 CZ PHE A 77 -3.413 13.267 -4.054 1.00 0.00 C ATOM 0 H PHE A 77 -6.424 12.273 -9.094 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.542 12.082 -8.589 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -6.064 11.093 -7.343 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -4.695 10.002 -7.258 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -2.492 10.925 -6.294 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -6.239 12.903 -5.851 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -1.595 12.200 -4.395 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -5.345 14.175 -3.949 1.00 0.00 H new ATOM 0 HZ PHE A 77 -3.018 13.826 -3.219 1.00 0.00 H new ATOM 1131 N GLU A 78 -3.435 9.431 -9.228 1.00 0.00 N ATOM 1132 CA GLU A 78 -3.121 8.256 -10.032 1.00 0.00 C ATOM 1133 C GLU A 78 -2.364 7.222 -9.201 1.00 0.00 C ATOM 1134 O GLU A 78 -1.202 7.420 -8.857 1.00 0.00 O ATOM 1135 CB GLU A 78 -2.294 8.668 -11.256 1.00 0.00 C ATOM 1136 CG GLU A 78 -1.617 7.507 -11.971 1.00 0.00 C ATOM 1137 CD GLU A 78 -1.851 7.529 -13.470 1.00 0.00 C ATOM 1138 OE1 GLU A 78 -1.560 8.567 -14.100 1.00 0.00 O ATOM 1139 OE2 GLU A 78 -2.323 6.507 -14.012 1.00 0.00 O ATOM 0 H GLU A 78 -2.979 9.451 -8.316 1.00 0.00 H new ATOM 0 HA GLU A 78 -4.053 7.804 -10.370 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.944 9.186 -11.962 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.532 9.381 -10.942 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.545 7.539 -11.774 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -1.989 6.567 -11.563 1.00 0.00 H new ATOM 1146 N TYR A 79 -3.032 6.117 -8.882 1.00 0.00 N ATOM 1147 CA TYR A 79 -2.419 5.054 -8.089 1.00 0.00 C ATOM 1148 C TYR A 79 -1.031 4.702 -8.620 1.00 0.00 C ATOM 1149 O TYR A 79 -0.745 4.872 -9.805 1.00 0.00 O ATOM 1150 CB TYR A 79 -3.313 3.809 -8.086 1.00 0.00 C ATOM 1151 CG TYR A 79 -2.628 2.566 -7.557 1.00 0.00 C ATOM 1152 CD1 TYR A 79 -2.254 2.470 -6.222 1.00 0.00 C ATOM 1153 CD2 TYR A 79 -2.352 1.495 -8.394 1.00 0.00 C ATOM 1154 CE1 TYR A 79 -1.624 1.339 -5.738 1.00 0.00 C ATOM 1155 CE2 TYR A 79 -1.724 0.361 -7.918 1.00 0.00 C ATOM 1156 CZ TYR A 79 -1.362 0.287 -6.589 1.00 0.00 C ATOM 1157 OH TYR A 79 -0.735 -0.840 -6.113 1.00 0.00 O ATOM 0 H TYR A 79 -3.996 5.934 -9.160 1.00 0.00 H new ATOM 0 HA TYR A 79 -2.311 5.417 -7.067 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -4.198 4.010 -7.482 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -3.658 3.618 -9.102 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -2.459 3.292 -5.552 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -2.633 1.549 -9.435 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -1.338 1.280 -4.698 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -1.517 -0.464 -8.583 1.00 0.00 H new ATOM 0 HH TYR A 79 0.017 -1.068 -6.699 1.00 0.00 H new ATOM 1167 N VAL A 80 -0.175 4.209 -7.730 1.00 0.00 N ATOM 1168 CA VAL A 80 1.182 3.830 -8.101 1.00 0.00 C ATOM 1169 C VAL A 80 1.550 2.472 -7.508 1.00 0.00 C ATOM 1170 O VAL A 80 1.522 1.454 -8.201 1.00 0.00 O ATOM 1171 CB VAL A 80 2.202 4.892 -7.640 1.00 0.00 C ATOM 1172 CG1 VAL A 80 3.616 4.496 -8.036 1.00 0.00 C ATOM 1173 CG2 VAL A 80 1.844 6.256 -8.212 1.00 0.00 C ATOM 0 H VAL A 80 -0.399 4.063 -6.746 1.00 0.00 H new ATOM 0 HA VAL A 80 1.216 3.762 -9.188 1.00 0.00 H new ATOM 0 HB VAL A 80 2.163 4.953 -6.552 1.00 0.00 H new ATOM 0 HG11 VAL A 80 4.316 5.261 -7.700 1.00 0.00 H new ATOM 0 HG12 VAL A 80 3.870 3.543 -7.573 1.00 0.00 H new ATOM 0 HG13 VAL A 80 3.677 4.400 -9.120 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.573 6.994 -7.877 1.00 0.00 H new ATOM 0 HG22 VAL A 80 1.851 6.207 -9.301 1.00 0.00 H new ATOM 0 HG23 VAL A 80 0.851 6.546 -7.868 1.00 0.00 H new ATOM 1183 N GLU A 81 1.889 2.458 -6.221 1.00 0.00 N ATOM 1184 CA GLU A 81 2.257 1.220 -5.542 1.00 0.00 C ATOM 1185 C GLU A 81 1.969 1.312 -4.046 1.00 0.00 C ATOM 1186 O GLU A 81 2.048 2.387 -3.454 1.00 0.00 O ATOM 1187 CB GLU A 81 3.737 0.910 -5.770 1.00 0.00 C ATOM 1188 CG GLU A 81 4.002 0.107 -7.033 1.00 0.00 C ATOM 1189 CD GLU A 81 5.060 -0.962 -6.833 1.00 0.00 C ATOM 1190 OE1 GLU A 81 5.919 -0.788 -5.944 1.00 0.00 O ATOM 1191 OE2 GLU A 81 5.030 -1.971 -7.568 1.00 0.00 O ATOM 0 H GLU A 81 1.916 3.288 -5.629 1.00 0.00 H new ATOM 0 HA GLU A 81 1.655 0.413 -5.960 1.00 0.00 H new ATOM 0 HB2 GLU A 81 4.292 1.847 -5.822 1.00 0.00 H new ATOM 0 HB3 GLU A 81 4.121 0.359 -4.912 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.075 -0.362 -7.362 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.318 0.782 -7.829 1.00 0.00 H new ATOM 1198 N ALA A 82 1.637 0.176 -3.440 1.00 0.00 N ATOM 1199 CA ALA A 82 1.340 0.130 -2.012 1.00 0.00 C ATOM 1200 C ALA A 82 2.486 -0.418 -1.229 1.00 0.00 C ATOM 1201 O ALA A 82 3.279 -1.229 -1.707 1.00 0.00 O ATOM 1202 CB ALA A 82 0.063 -0.651 -1.743 1.00 0.00 C ATOM 0 H ALA A 82 1.567 -0.724 -3.915 1.00 0.00 H new ATOM 0 HA ALA A 82 1.181 1.155 -1.678 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -0.134 -0.669 -0.671 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -0.771 -0.173 -2.257 1.00 0.00 H new ATOM 0 HB3 ALA A 82 0.177 -1.672 -2.108 1.00 0.00 H new ATOM 1208 N ILE A 83 2.584 0.097 -0.026 1.00 0.00 N ATOM 1209 CA ILE A 83 3.649 -0.257 0.856 1.00 0.00 C ATOM 1210 C ILE A 83 3.154 -0.561 2.253 1.00 0.00 C ATOM 1211 O ILE A 83 1.978 -0.399 2.576 1.00 0.00 O ATOM 1212 CB ILE A 83 4.694 0.872 0.926 1.00 0.00 C ATOM 1213 CG1 ILE A 83 4.258 2.092 0.108 1.00 0.00 C ATOM 1214 CG2 ILE A 83 6.029 0.358 0.439 1.00 0.00 C ATOM 1215 CD1 ILE A 83 4.931 3.377 0.539 1.00 0.00 C ATOM 0 H ILE A 83 1.924 0.772 0.360 1.00 0.00 H new ATOM 0 HA ILE A 83 4.106 -1.160 0.450 1.00 0.00 H new ATOM 0 HB ILE A 83 4.786 1.191 1.964 1.00 0.00 H new ATOM 0 HG12 ILE A 83 4.477 1.911 -0.944 1.00 0.00 H new ATOM 0 HG13 ILE A 83 3.178 2.210 0.193 1.00 0.00 H new ATOM 0 HG21 ILE A 83 6.767 1.158 0.489 1.00 0.00 H new ATOM 0 HG22 ILE A 83 6.351 -0.472 1.068 1.00 0.00 H new ATOM 0 HG23 ILE A 83 5.933 0.017 -0.592 1.00 0.00 H new ATOM 0 HD11 ILE A 83 4.576 4.200 -0.082 1.00 0.00 H new ATOM 0 HD12 ILE A 83 4.692 3.581 1.583 1.00 0.00 H new ATOM 0 HD13 ILE A 83 6.011 3.278 0.427 1.00 0.00 H new ATOM 1227 N SER A 84 4.087 -0.999 3.067 1.00 0.00 N ATOM 1228 CA SER A 84 3.811 -1.343 4.458 1.00 0.00 C ATOM 1229 C SER A 84 5.011 -1.027 5.344 1.00 0.00 C ATOM 1230 O SER A 84 6.022 -0.504 4.876 1.00 0.00 O ATOM 1231 CB SER A 84 3.447 -2.825 4.577 1.00 0.00 C ATOM 1232 OG SER A 84 2.251 -2.998 5.316 1.00 0.00 O ATOM 0 H SER A 84 5.060 -1.130 2.791 1.00 0.00 H new ATOM 0 HA SER A 84 2.966 -0.742 4.795 1.00 0.00 H new ATOM 0 HB2 SER A 84 3.329 -3.255 3.582 1.00 0.00 H new ATOM 0 HB3 SER A 84 4.260 -3.365 5.063 1.00 0.00 H new ATOM 0 HG SER A 84 1.628 -2.271 5.106 1.00 0.00 H new ATOM 1238 N ASP A 85 4.894 -1.352 6.627 1.00 0.00 N ATOM 1239 CA ASP A 85 5.969 -1.106 7.583 1.00 0.00 C ATOM 1240 C ASP A 85 7.223 -1.893 7.201 1.00 0.00 C ATOM 1241 O ASP A 85 7.364 -2.335 6.062 1.00 0.00 O ATOM 1242 CB ASP A 85 5.510 -1.479 8.996 1.00 0.00 C ATOM 1243 CG ASP A 85 5.300 -2.972 9.165 1.00 0.00 C ATOM 1244 OD1 ASP A 85 4.948 -3.639 8.170 1.00 0.00 O ATOM 1245 OD2 ASP A 85 5.486 -3.474 10.294 1.00 0.00 O ATOM 0 H ASP A 85 4.064 -1.787 7.030 1.00 0.00 H new ATOM 0 HA ASP A 85 6.216 -0.045 7.563 1.00 0.00 H new ATOM 0 HB2 ASP A 85 6.252 -1.136 9.718 1.00 0.00 H new ATOM 0 HB3 ASP A 85 4.580 -0.957 9.222 1.00 0.00 H new ATOM 1250 N ASP A 86 8.132 -2.067 8.159 1.00 0.00 N ATOM 1251 CA ASP A 86 9.368 -2.803 7.917 1.00 0.00 C ATOM 1252 C ASP A 86 9.215 -4.270 8.309 1.00 0.00 C ATOM 1253 O ASP A 86 10.149 -4.887 8.822 1.00 0.00 O ATOM 1254 CB ASP A 86 10.523 -2.172 8.695 1.00 0.00 C ATOM 1255 CG ASP A 86 11.212 -1.070 7.915 1.00 0.00 C ATOM 1256 OD1 ASP A 86 10.729 0.081 7.959 1.00 0.00 O ATOM 1257 OD2 ASP A 86 12.237 -1.357 7.260 1.00 0.00 O ATOM 0 H ASP A 86 8.034 -1.708 9.109 1.00 0.00 H new ATOM 0 HA ASP A 86 9.588 -2.753 6.851 1.00 0.00 H new ATOM 0 HB2 ASP A 86 10.146 -1.767 9.634 1.00 0.00 H new ATOM 0 HB3 ASP A 86 11.250 -2.943 8.949 1.00 0.00 H new ATOM 1262 N GLY A 87 8.032 -4.821 8.063 1.00 0.00 N ATOM 1263 CA GLY A 87 7.772 -6.210 8.393 1.00 0.00 C ATOM 1264 C GLY A 87 6.666 -6.804 7.545 1.00 0.00 C ATOM 1265 O GLY A 87 6.759 -7.950 7.103 1.00 0.00 O ATOM 0 H GLY A 87 7.246 -4.329 7.639 1.00 0.00 H new ATOM 0 HA2 GLY A 87 8.684 -6.791 8.256 1.00 0.00 H new ATOM 0 HA3 GLY A 87 7.501 -6.287 9.446 1.00 0.00 H new ATOM 1269 N VAL A 88 5.616 -6.021 7.313 1.00 0.00 N ATOM 1270 CA VAL A 88 4.487 -6.470 6.510 1.00 0.00 C ATOM 1271 C VAL A 88 4.730 -6.203 5.029 1.00 0.00 C ATOM 1272 O VAL A 88 5.378 -5.221 4.663 1.00 0.00 O ATOM 1273 CB VAL A 88 3.181 -5.774 6.940 1.00 0.00 C ATOM 1274 CG1 VAL A 88 1.980 -6.423 6.270 1.00 0.00 C ATOM 1275 CG2 VAL A 88 3.034 -5.798 8.454 1.00 0.00 C ATOM 0 H VAL A 88 5.525 -5.070 7.672 1.00 0.00 H new ATOM 0 HA VAL A 88 4.387 -7.543 6.672 1.00 0.00 H new ATOM 0 HB VAL A 88 3.226 -4.733 6.619 1.00 0.00 H new ATOM 0 HG11 VAL A 88 1.069 -5.916 6.587 1.00 0.00 H new ATOM 0 HG12 VAL A 88 2.081 -6.344 5.188 1.00 0.00 H new ATOM 0 HG13 VAL A 88 1.929 -7.474 6.554 1.00 0.00 H new ATOM 0 HG21 VAL A 88 2.106 -5.302 8.737 1.00 0.00 H new ATOM 0 HG22 VAL A 88 3.014 -6.831 8.801 1.00 0.00 H new ATOM 0 HG23 VAL A 88 3.877 -5.278 8.910 1.00 0.00 H new ATOM 1285 N PHE A 89 4.211 -7.083 4.178 1.00 0.00 N ATOM 1286 CA PHE A 89 4.377 -6.938 2.738 1.00 0.00 C ATOM 1287 C PHE A 89 3.065 -6.529 2.073 1.00 0.00 C ATOM 1288 O PHE A 89 2.171 -7.352 1.879 1.00 0.00 O ATOM 1289 CB PHE A 89 4.881 -8.250 2.128 1.00 0.00 C ATOM 1290 CG PHE A 89 5.383 -8.103 0.720 1.00 0.00 C ATOM 1291 CD1 PHE A 89 6.711 -7.799 0.472 1.00 0.00 C ATOM 1292 CD2 PHE A 89 4.524 -8.269 -0.355 1.00 0.00 C ATOM 1293 CE1 PHE A 89 7.175 -7.664 -0.822 1.00 0.00 C ATOM 1294 CE2 PHE A 89 4.984 -8.134 -1.652 1.00 0.00 C ATOM 1295 CZ PHE A 89 6.311 -7.832 -1.886 1.00 0.00 C ATOM 0 H PHE A 89 3.673 -7.902 4.461 1.00 0.00 H new ATOM 0 HA PHE A 89 5.112 -6.153 2.561 1.00 0.00 H new ATOM 0 HB2 PHE A 89 5.682 -8.647 2.751 1.00 0.00 H new ATOM 0 HB3 PHE A 89 4.073 -8.982 2.143 1.00 0.00 H new ATOM 0 HD1 PHE A 89 7.392 -7.666 1.300 1.00 0.00 H new ATOM 0 HD2 PHE A 89 3.485 -8.506 -0.178 1.00 0.00 H new ATOM 0 HE1 PHE A 89 8.213 -7.427 -1.002 1.00 0.00 H new ATOM 0 HE2 PHE A 89 4.305 -8.265 -2.482 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.672 -7.727 -2.898 1.00 0.00 H new ATOM 1305 N VAL A 90 2.961 -5.251 1.723 1.00 0.00 N ATOM 1306 CA VAL A 90 1.762 -4.731 1.076 1.00 0.00 C ATOM 1307 C VAL A 90 1.988 -4.568 -0.425 1.00 0.00 C ATOM 1308 O VAL A 90 2.995 -4.009 -0.856 1.00 0.00 O ATOM 1309 CB VAL A 90 1.332 -3.378 1.698 1.00 0.00 C ATOM 1310 CG1 VAL A 90 0.552 -2.525 0.704 1.00 0.00 C ATOM 1311 CG2 VAL A 90 0.507 -3.612 2.951 1.00 0.00 C ATOM 0 H VAL A 90 3.692 -4.557 1.877 1.00 0.00 H new ATOM 0 HA VAL A 90 0.960 -5.452 1.236 1.00 0.00 H new ATOM 0 HB VAL A 90 2.238 -2.833 1.964 1.00 0.00 H new ATOM 0 HG11 VAL A 90 0.268 -1.585 1.176 1.00 0.00 H new ATOM 0 HG12 VAL A 90 1.175 -2.320 -0.167 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -0.345 -3.060 0.391 1.00 0.00 H new ATOM 0 HG21 VAL A 90 0.212 -2.653 3.377 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.384 -4.186 2.698 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.100 -4.165 3.679 1.00 0.00 H new ATOM 1321 N ASN A 91 1.039 -5.059 -1.214 1.00 0.00 N ATOM 1322 CA ASN A 91 1.126 -4.970 -2.664 1.00 0.00 C ATOM 1323 C ASN A 91 -0.256 -4.780 -3.277 1.00 0.00 C ATOM 1324 O ASN A 91 -1.081 -5.692 -3.266 1.00 0.00 O ATOM 1325 CB ASN A 91 1.780 -6.230 -3.236 1.00 0.00 C ATOM 1326 CG ASN A 91 1.959 -6.159 -4.740 1.00 0.00 C ATOM 1327 OD1 ASN A 91 0.885 -6.418 -5.476 1.00 0.00 O flip ATOM 1328 ND2 ASN A 91 3.050 -5.872 -5.235 1.00 0.00 N flip ATOM 0 H ASN A 91 0.198 -5.524 -0.871 1.00 0.00 H new ATOM 0 HA ASN A 91 1.740 -4.105 -2.915 1.00 0.00 H new ATOM 0 HB2 ASN A 91 2.751 -6.377 -2.764 1.00 0.00 H new ATOM 0 HB3 ASN A 91 1.169 -7.098 -2.986 1.00 0.00 H new ATOM 0 HD21 ASN A 91 3.849 -5.680 -4.631 1.00 0.00 H new ATOM 0 HD22 ASN A 91 3.154 -5.826 -6.249 1.00 0.00 H new ATOM 1335 N ALA A 92 -0.507 -3.586 -3.806 1.00 0.00 N ATOM 1336 CA ALA A 92 -1.794 -3.281 -4.415 1.00 0.00 C ATOM 1337 C ALA A 92 -1.748 -3.459 -5.925 1.00 0.00 C ATOM 1338 O ALA A 92 -0.720 -3.840 -6.486 1.00 0.00 O ATOM 1339 CB ALA A 92 -2.225 -1.867 -4.057 1.00 0.00 C ATOM 0 H ALA A 92 0.163 -2.817 -3.824 1.00 0.00 H new ATOM 0 HA ALA A 92 -2.528 -3.983 -4.020 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -3.189 -1.652 -4.519 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -2.313 -1.777 -2.974 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -1.482 -1.157 -4.421 1.00 0.00 H new ATOM 1345 N LYS A 93 -2.873 -3.189 -6.581 1.00 0.00 N ATOM 1346 CA LYS A 93 -2.957 -3.332 -8.028 1.00 0.00 C ATOM 1347 C LYS A 93 -4.138 -2.550 -8.597 1.00 0.00 C ATOM 1348 O LYS A 93 -5.294 -2.823 -8.274 1.00 0.00 O ATOM 1349 CB LYS A 93 -3.081 -4.809 -8.406 1.00 0.00 C ATOM 1350 CG LYS A 93 -2.342 -5.173 -9.683 1.00 0.00 C ATOM 1351 CD LYS A 93 -2.852 -6.481 -10.266 1.00 0.00 C ATOM 1352 CE LYS A 93 -2.313 -6.713 -11.670 1.00 0.00 C ATOM 1353 NZ LYS A 93 -3.285 -7.448 -12.524 1.00 0.00 N ATOM 0 H LYS A 93 -3.734 -2.872 -6.135 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.042 -2.924 -8.457 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -2.698 -5.419 -7.588 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -4.136 -5.059 -8.522 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -2.463 -4.375 -10.415 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.275 -5.257 -9.476 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.557 -7.308 -9.620 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -3.942 -6.469 -10.291 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -2.077 -5.754 -12.131 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -1.382 -7.276 -11.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -2.880 -7.586 -13.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -3.491 -8.374 -12.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -4.165 -6.899 -12.600 1.00 0.00 H new ATOM 1367 N LYS A 94 -3.828 -1.581 -9.445 1.00 0.00 N ATOM 1368 CA LYS A 94 -4.837 -0.745 -10.075 1.00 0.00 C ATOM 1369 C LYS A 94 -5.888 -1.584 -10.785 1.00 0.00 C ATOM 1370 O LYS A 94 -5.605 -2.256 -11.776 1.00 0.00 O ATOM 1371 CB LYS A 94 -4.183 0.213 -11.073 1.00 0.00 C ATOM 1372 CG LYS A 94 -4.800 1.602 -11.079 1.00 0.00 C ATOM 1373 CD LYS A 94 -4.755 2.225 -12.465 1.00 0.00 C ATOM 1374 CE LYS A 94 -5.051 3.715 -12.416 1.00 0.00 C ATOM 1375 NZ LYS A 94 -4.322 4.462 -13.477 1.00 0.00 N ATOM 0 H LYS A 94 -2.871 -1.353 -9.715 1.00 0.00 H new ATOM 0 HA LYS A 94 -5.330 -0.172 -9.290 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -3.121 0.297 -10.840 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -4.257 -0.212 -12.074 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -5.834 1.544 -10.738 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -4.268 2.241 -10.374 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -3.772 2.063 -12.906 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -5.480 1.730 -13.111 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -6.123 3.876 -12.530 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -4.772 4.108 -11.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -3.685 5.156 -13.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -3.766 3.796 -14.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -5.005 4.956 -14.085 1.00 0.00 H new ATOM 1389 N ILE A 95 -7.107 -1.532 -10.264 1.00 0.00 N ATOM 1390 CA ILE A 95 -8.219 -2.278 -10.836 1.00 0.00 C ATOM 1391 C ILE A 95 -9.219 -1.337 -11.507 1.00 0.00 C ATOM 1392 O ILE A 95 -9.988 -1.748 -12.376 1.00 0.00 O ATOM 1393 CB ILE A 95 -8.935 -3.115 -9.756 1.00 0.00 C ATOM 1394 CG1 ILE A 95 -10.103 -3.899 -10.358 1.00 0.00 C ATOM 1395 CG2 ILE A 95 -9.412 -2.222 -8.623 1.00 0.00 C ATOM 1396 CD1 ILE A 95 -9.667 -5.029 -11.263 1.00 0.00 C ATOM 0 H ILE A 95 -7.351 -0.978 -9.443 1.00 0.00 H new ATOM 0 HA ILE A 95 -7.811 -2.952 -11.589 1.00 0.00 H new ATOM 0 HB ILE A 95 -8.222 -3.834 -9.352 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -10.712 -4.305 -9.551 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -10.737 -3.215 -10.923 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -9.915 -2.828 -7.869 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.557 -1.718 -8.172 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -10.107 -1.478 -9.014 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -10.546 -5.541 -11.654 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -9.082 -4.627 -12.091 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -9.058 -5.734 -10.697 1.00 0.00 H new ATOM 1408 N GLU A 96 -9.200 -0.068 -11.103 1.00 0.00 N ATOM 1409 CA GLU A 96 -10.100 0.930 -11.669 1.00 0.00 C ATOM 1410 C GLU A 96 -9.551 2.339 -11.457 1.00 0.00 C ATOM 1411 O GLU A 96 -8.552 2.528 -10.766 1.00 0.00 O ATOM 1412 CB GLU A 96 -11.490 0.808 -11.041 1.00 0.00 C ATOM 1413 CG GLU A 96 -12.498 0.098 -11.930 1.00 0.00 C ATOM 1414 CD GLU A 96 -13.755 -0.301 -11.182 1.00 0.00 C ATOM 1415 OE1 GLU A 96 -13.689 -1.247 -10.370 1.00 0.00 O ATOM 1416 OE2 GLU A 96 -14.808 0.333 -11.409 1.00 0.00 O ATOM 0 H GLU A 96 -8.570 0.292 -10.386 1.00 0.00 H new ATOM 0 HA GLU A 96 -10.178 0.749 -12.741 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -11.407 0.269 -10.097 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -11.863 1.805 -10.807 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -12.766 0.750 -12.762 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -12.036 -0.792 -12.358 1.00 0.00 H new ATOM 1423 N ASP A 97 -10.212 3.324 -12.058 1.00 0.00 N ATOM 1424 CA ASP A 97 -9.790 4.715 -11.935 1.00 0.00 C ATOM 1425 C ASP A 97 -10.146 5.272 -10.560 1.00 0.00 C ATOM 1426 O ASP A 97 -11.272 5.113 -10.088 1.00 0.00 O ATOM 1427 CB ASP A 97 -10.442 5.566 -13.027 1.00 0.00 C ATOM 1428 CG ASP A 97 -9.524 5.782 -14.216 1.00 0.00 C ATOM 1429 OD1 ASP A 97 -8.305 5.944 -14.001 1.00 0.00 O ATOM 1430 OD2 ASP A 97 -10.026 5.789 -15.359 1.00 0.00 O ATOM 0 H ASP A 97 -11.042 3.185 -12.635 1.00 0.00 H new ATOM 0 HA ASP A 97 -8.707 4.752 -12.053 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -11.359 5.082 -13.362 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -10.726 6.532 -12.610 1.00 0.00 H new ATOM 1435 N GLY A 98 -9.180 5.923 -9.918 1.00 0.00 N ATOM 1436 CA GLY A 98 -9.414 6.488 -8.600 1.00 0.00 C ATOM 1437 C GLY A 98 -9.845 5.438 -7.596 1.00 0.00 C ATOM 1438 O GLY A 98 -10.575 5.731 -6.651 1.00 0.00 O ATOM 0 H GLY A 98 -8.240 6.069 -10.286 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -8.504 6.973 -8.248 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -10.181 7.260 -8.668 1.00 0.00 H new ATOM 1442 N LYS A 99 -9.388 4.208 -7.807 1.00 0.00 N ATOM 1443 CA LYS A 99 -9.713 3.100 -6.925 1.00 0.00 C ATOM 1444 C LYS A 99 -8.922 1.880 -7.338 1.00 0.00 C ATOM 1445 O LYS A 99 -8.878 1.528 -8.517 1.00 0.00 O ATOM 1446 CB LYS A 99 -11.215 2.804 -6.947 1.00 0.00 C ATOM 1447 CG LYS A 99 -11.736 2.389 -8.314 1.00 0.00 C ATOM 1448 CD LYS A 99 -13.137 1.807 -8.222 1.00 0.00 C ATOM 1449 CE LYS A 99 -13.123 0.423 -7.594 1.00 0.00 C ATOM 1450 NZ LYS A 99 -14.324 0.185 -6.747 1.00 0.00 N ATOM 0 H LYS A 99 -8.786 3.955 -8.590 1.00 0.00 H new ATOM 0 HA LYS A 99 -9.446 3.372 -5.904 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -11.431 2.012 -6.230 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -11.756 3.690 -6.615 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -11.742 3.252 -8.980 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -11.063 1.653 -8.753 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -13.770 2.470 -7.632 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -13.576 1.752 -9.218 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -13.077 -0.331 -8.379 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -12.224 0.308 -6.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -14.276 -0.770 -6.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -14.354 0.889 -5.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -15.182 0.269 -7.329 1.00 0.00 H new ATOM 1464 N VAL A 100 -8.263 1.257 -6.379 1.00 0.00 N ATOM 1465 CA VAL A 100 -7.439 0.103 -6.677 1.00 0.00 C ATOM 1466 C VAL A 100 -7.372 -0.867 -5.503 1.00 0.00 C ATOM 1467 O VAL A 100 -7.590 -0.485 -4.353 1.00 0.00 O ATOM 1468 CB VAL A 100 -6.038 0.569 -7.087 1.00 0.00 C ATOM 1469 CG1 VAL A 100 -6.144 1.542 -8.253 1.00 0.00 C ATOM 1470 CG2 VAL A 100 -5.331 1.244 -5.934 1.00 0.00 C ATOM 0 H VAL A 100 -8.282 1.528 -5.396 1.00 0.00 H new ATOM 0 HA VAL A 100 -7.895 -0.440 -7.505 1.00 0.00 H new ATOM 0 HB VAL A 100 -5.460 -0.306 -7.383 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -5.147 1.872 -8.543 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -6.622 1.047 -9.098 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -6.739 2.405 -7.954 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -4.339 1.565 -6.253 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -5.907 2.112 -5.612 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -5.237 0.543 -5.105 1.00 0.00 H new ATOM 1480 N ARG A 101 -7.096 -2.134 -5.804 1.00 0.00 N ATOM 1481 CA ARG A 101 -7.033 -3.170 -4.776 1.00 0.00 C ATOM 1482 C ARG A 101 -5.674 -3.206 -4.082 1.00 0.00 C ATOM 1483 O ARG A 101 -4.643 -2.933 -4.695 1.00 0.00 O ATOM 1484 CB ARG A 101 -7.336 -4.538 -5.388 1.00 0.00 C ATOM 1485 CG ARG A 101 -7.889 -5.542 -4.391 1.00 0.00 C ATOM 1486 CD ARG A 101 -9.365 -5.301 -4.116 1.00 0.00 C ATOM 1487 NE ARG A 101 -9.703 -5.522 -2.712 1.00 0.00 N ATOM 1488 CZ ARG A 101 -9.858 -6.728 -2.168 1.00 0.00 C ATOM 1489 NH1 ARG A 101 -9.704 -7.821 -2.905 1.00 0.00 N ATOM 1490 NH2 ARG A 101 -10.166 -6.841 -0.883 1.00 0.00 N ATOM 0 H ARG A 101 -6.913 -2.468 -6.750 1.00 0.00 H new ATOM 0 HA ARG A 101 -7.784 -2.928 -4.024 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -8.052 -4.413 -6.200 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -6.423 -4.940 -5.827 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -7.750 -6.552 -4.776 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -7.329 -5.476 -3.458 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -9.624 -4.280 -4.395 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -9.963 -5.963 -4.742 1.00 0.00 H new ATOM 0 HE ARG A 101 -9.828 -4.705 -2.114 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -9.466 -7.740 -3.893 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -9.824 -8.742 -2.483 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -10.284 -6.005 -0.311 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -10.285 -7.764 -0.466 1.00 0.00 H new ATOM 1504 N VAL A 102 -5.689 -3.559 -2.798 1.00 0.00 N ATOM 1505 CA VAL A 102 -4.467 -3.648 -2.008 1.00 0.00 C ATOM 1506 C VAL A 102 -4.400 -4.975 -1.254 1.00 0.00 C ATOM 1507 O VAL A 102 -5.352 -5.365 -0.578 1.00 0.00 O ATOM 1508 CB VAL A 102 -4.356 -2.489 -0.999 1.00 0.00 C ATOM 1509 CG1 VAL A 102 -5.553 -2.477 -0.061 1.00 0.00 C ATOM 1510 CG2 VAL A 102 -3.053 -2.583 -0.218 1.00 0.00 C ATOM 0 H VAL A 102 -6.539 -3.789 -2.283 1.00 0.00 H new ATOM 0 HA VAL A 102 -3.634 -3.584 -2.708 1.00 0.00 H new ATOM 0 HB VAL A 102 -4.352 -1.550 -1.552 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -5.455 -1.651 0.643 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -6.468 -2.353 -0.640 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -5.595 -3.418 0.487 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -2.992 -1.756 0.490 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -3.021 -3.528 0.324 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -2.211 -2.532 -0.908 1.00 0.00 H new ATOM 1520 N LEU A 103 -3.270 -5.663 -1.375 1.00 0.00 N ATOM 1521 CA LEU A 103 -3.078 -6.943 -0.704 1.00 0.00 C ATOM 1522 C LEU A 103 -2.039 -6.823 0.406 1.00 0.00 C ATOM 1523 O LEU A 103 -0.850 -6.651 0.139 1.00 0.00 O ATOM 1524 CB LEU A 103 -2.643 -8.011 -1.712 1.00 0.00 C ATOM 1525 CG LEU A 103 -3.734 -8.464 -2.684 1.00 0.00 C ATOM 1526 CD1 LEU A 103 -3.204 -9.548 -3.611 1.00 0.00 C ATOM 1527 CD2 LEU A 103 -4.953 -8.961 -1.923 1.00 0.00 C ATOM 0 H LEU A 103 -2.473 -5.355 -1.932 1.00 0.00 H new ATOM 0 HA LEU A 103 -4.028 -7.239 -0.259 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.802 -7.625 -2.288 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -2.281 -8.881 -1.164 1.00 0.00 H new ATOM 0 HG LEU A 103 -4.033 -7.609 -3.290 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -3.993 -9.859 -4.296 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -2.361 -9.159 -4.182 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -2.878 -10.404 -3.021 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -5.719 -9.279 -2.630 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -4.669 -9.803 -1.292 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -5.346 -8.157 -1.300 1.00 0.00 H new ATOM 1539 N VAL A 104 -2.497 -6.910 1.651 1.00 0.00 N ATOM 1540 CA VAL A 104 -1.603 -6.805 2.799 1.00 0.00 C ATOM 1541 C VAL A 104 -1.378 -8.161 3.458 1.00 0.00 C ATOM 1542 O VAL A 104 -2.285 -8.993 3.523 1.00 0.00 O ATOM 1543 CB VAL A 104 -2.152 -5.827 3.858 1.00 0.00 C ATOM 1544 CG1 VAL A 104 -1.060 -5.436 4.843 1.00 0.00 C ATOM 1545 CG2 VAL A 104 -2.754 -4.595 3.193 1.00 0.00 C ATOM 0 H VAL A 104 -3.478 -7.052 1.890 1.00 0.00 H new ATOM 0 HA VAL A 104 -0.655 -6.427 2.416 1.00 0.00 H new ATOM 0 HB VAL A 104 -2.944 -6.330 4.413 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -1.467 -4.746 5.582 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -0.687 -6.328 5.346 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -0.243 -4.954 4.307 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -3.135 -3.918 3.958 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -1.988 -4.086 2.608 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -3.570 -4.898 2.537 1.00 0.00 H new ATOM 1555 N SER A 105 -0.163 -8.373 3.952 1.00 0.00 N ATOM 1556 CA SER A 105 0.193 -9.620 4.617 1.00 0.00 C ATOM 1557 C SER A 105 1.485 -9.448 5.407 1.00 0.00 C ATOM 1558 O SER A 105 2.419 -8.791 4.951 1.00 0.00 O ATOM 1559 CB SER A 105 0.349 -10.749 3.597 1.00 0.00 C ATOM 1560 OG SER A 105 -0.255 -10.408 2.360 1.00 0.00 O ATOM 0 H SER A 105 0.595 -7.693 3.904 1.00 0.00 H new ATOM 0 HA SER A 105 -0.610 -9.882 5.306 1.00 0.00 H new ATOM 0 HB2 SER A 105 1.407 -10.960 3.442 1.00 0.00 H new ATOM 0 HB3 SER A 105 -0.104 -11.661 3.987 1.00 0.00 H new ATOM 0 HG SER A 105 -0.140 -11.146 1.725 1.00 0.00 H new ATOM 1566 N SER A 106 1.532 -10.035 6.598 1.00 0.00 N ATOM 1567 CA SER A 106 2.709 -9.933 7.449 1.00 0.00 C ATOM 1568 C SER A 106 3.704 -11.048 7.146 1.00 0.00 C ATOM 1569 O SER A 106 3.507 -12.194 7.547 1.00 0.00 O ATOM 1570 CB SER A 106 2.306 -9.981 8.922 1.00 0.00 C ATOM 1571 OG SER A 106 3.237 -9.285 9.730 1.00 0.00 O ATOM 0 H SER A 106 0.770 -10.585 6.994 1.00 0.00 H new ATOM 0 HA SER A 106 3.191 -8.977 7.241 1.00 0.00 H new ATOM 0 HB2 SER A 106 1.315 -9.544 9.045 1.00 0.00 H new ATOM 0 HB3 SER A 106 2.240 -11.018 9.250 1.00 0.00 H new ATOM 0 HG SER A 106 3.919 -9.909 10.055 1.00 0.00 H new ATOM 1577 N LEU A 107 4.780 -10.701 6.449 1.00 0.00 N ATOM 1578 CA LEU A 107 5.813 -11.670 6.108 1.00 0.00 C ATOM 1579 C LEU A 107 6.550 -12.129 7.364 1.00 0.00 C ATOM 1580 O LEU A 107 7.223 -13.158 7.363 1.00 0.00 O ATOM 1581 CB LEU A 107 6.803 -11.066 5.110 1.00 0.00 C ATOM 1582 CG LEU A 107 7.395 -12.054 4.105 1.00 0.00 C ATOM 1583 CD1 LEU A 107 7.712 -11.355 2.791 1.00 0.00 C ATOM 1584 CD2 LEU A 107 8.644 -12.711 4.676 1.00 0.00 C ATOM 0 H LEU A 107 4.959 -9.756 6.109 1.00 0.00 H new ATOM 0 HA LEU A 107 5.334 -12.534 5.648 1.00 0.00 H new ATOM 0 HB2 LEU A 107 6.301 -10.270 4.560 1.00 0.00 H new ATOM 0 HB3 LEU A 107 7.619 -10.604 5.666 1.00 0.00 H new ATOM 0 HG LEU A 107 6.656 -12.831 3.910 1.00 0.00 H new ATOM 0 HD11 LEU A 107 8.133 -12.074 2.088 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.798 -10.932 2.374 1.00 0.00 H new ATOM 0 HD13 LEU A 107 8.433 -10.557 2.968 1.00 0.00 H new ATOM 0 HD21 LEU A 107 9.052 -13.411 3.947 1.00 0.00 H new ATOM 0 HD22 LEU A 107 9.387 -11.946 4.900 1.00 0.00 H new ATOM 0 HD23 LEU A 107 8.388 -13.247 5.590 1.00 0.00 H new ATOM 1596 N THR A 108 6.415 -11.350 8.435 1.00 0.00 N ATOM 1597 CA THR A 108 7.059 -11.664 9.703 1.00 0.00 C ATOM 1598 C THR A 108 6.496 -12.949 10.297 1.00 0.00 C ATOM 1599 O THR A 108 7.215 -13.718 10.935 1.00 0.00 O ATOM 1600 CB THR A 108 6.861 -10.510 10.685 1.00 0.00 C ATOM 1601 OG1 THR A 108 5.493 -10.379 11.030 1.00 0.00 O ATOM 1602 CG2 THR A 108 7.326 -9.178 10.142 1.00 0.00 C ATOM 0 H THR A 108 5.862 -10.493 8.447 1.00 0.00 H new ATOM 0 HA THR A 108 8.124 -11.808 9.520 1.00 0.00 H new ATOM 0 HB THR A 108 7.467 -10.761 11.555 1.00 0.00 H new ATOM 0 HG1 THR A 108 5.384 -9.637 11.660 1.00 0.00 H new ATOM 0 HG21 THR A 108 7.157 -8.402 10.888 1.00 0.00 H new ATOM 0 HG22 THR A 108 8.389 -9.232 9.908 1.00 0.00 H new ATOM 0 HG23 THR A 108 6.767 -8.939 9.237 1.00 0.00 H new ATOM 1610 N GLY A 109 5.203 -13.172 10.088 1.00 0.00 N ATOM 1611 CA GLY A 109 4.560 -14.361 10.612 1.00 0.00 C ATOM 1612 C GLY A 109 3.610 -14.049 11.753 1.00 0.00 C ATOM 1613 O GLY A 109 2.726 -14.845 12.069 1.00 0.00 O ATOM 0 H GLY A 109 4.589 -12.549 9.564 1.00 0.00 H new ATOM 0 HA2 GLY A 109 4.011 -14.857 9.811 1.00 0.00 H new ATOM 0 HA3 GLY A 109 5.321 -15.060 10.958 1.00 0.00 H new ATOM 1617 N GLU A 110 3.792 -12.885 12.372 1.00 0.00 N ATOM 1618 CA GLU A 110 2.944 -12.470 13.484 1.00 0.00 C ATOM 1619 C GLU A 110 1.755 -11.651 12.985 1.00 0.00 C ATOM 1620 O GLU A 110 1.825 -11.018 11.930 1.00 0.00 O ATOM 1621 CB GLU A 110 3.753 -11.652 14.492 1.00 0.00 C ATOM 1622 CG GLU A 110 5.090 -12.278 14.851 1.00 0.00 C ATOM 1623 CD GLU A 110 4.966 -13.347 15.919 1.00 0.00 C ATOM 1624 OE1 GLU A 110 3.877 -13.949 16.034 1.00 0.00 O ATOM 1625 OE2 GLU A 110 5.957 -13.581 16.643 1.00 0.00 O ATOM 0 H GLU A 110 4.518 -12.214 12.122 1.00 0.00 H new ATOM 0 HA GLU A 110 2.566 -13.367 13.974 1.00 0.00 H new ATOM 0 HB2 GLU A 110 3.926 -10.656 14.084 1.00 0.00 H new ATOM 0 HB3 GLU A 110 3.165 -11.526 15.401 1.00 0.00 H new ATOM 0 HG2 GLU A 110 5.535 -12.714 13.956 1.00 0.00 H new ATOM 0 HG3 GLU A 110 5.770 -11.500 15.198 1.00 0.00 H new ATOM 1632 N PRO A 111 0.642 -11.654 13.738 1.00 0.00 N ATOM 1633 CA PRO A 111 -0.566 -10.909 13.367 1.00 0.00 C ATOM 1634 C PRO A 111 -0.295 -9.421 13.171 1.00 0.00 C ATOM 1635 O PRO A 111 0.747 -8.910 13.583 1.00 0.00 O ATOM 1636 CB PRO A 111 -1.506 -11.124 14.559 1.00 0.00 C ATOM 1637 CG PRO A 111 -1.013 -12.365 15.219 1.00 0.00 C ATOM 1638 CD PRO A 111 0.474 -12.382 15.009 1.00 0.00 C ATOM 0 HA PRO A 111 -0.975 -11.254 12.417 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -1.477 -10.275 15.242 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -2.540 -11.235 14.232 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -1.257 -12.365 16.281 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -1.479 -13.250 14.784 1.00 0.00 H new ATOM 0 HD2 PRO A 111 1.002 -11.892 15.827 1.00 0.00 H new ATOM 0 HD3 PRO A 111 0.860 -13.399 14.945 1.00 0.00 H new ATOM 1646 N LEU A 112 -1.241 -8.733 12.539 1.00 0.00 N ATOM 1647 CA LEU A 112 -1.111 -7.302 12.288 1.00 0.00 C ATOM 1648 C LEU A 112 -0.958 -6.534 13.600 1.00 0.00 C ATOM 1649 O LEU A 112 -1.768 -6.691 14.515 1.00 0.00 O ATOM 1650 CB LEU A 112 -2.332 -6.792 11.519 1.00 0.00 C ATOM 1651 CG LEU A 112 -2.182 -6.774 9.994 1.00 0.00 C ATOM 1652 CD1 LEU A 112 -1.414 -7.996 9.510 1.00 0.00 C ATOM 1653 CD2 LEU A 112 -3.546 -6.704 9.327 1.00 0.00 C ATOM 0 H LEU A 112 -2.107 -9.144 12.191 1.00 0.00 H new ATOM 0 HA LEU A 112 -0.217 -7.137 11.687 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -3.189 -7.414 11.776 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -2.558 -5.781 11.858 1.00 0.00 H new ATOM 0 HG LEU A 112 -1.614 -5.885 9.718 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -1.321 -7.961 8.425 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -0.421 -8.003 9.960 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -1.950 -8.900 9.799 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -3.421 -6.692 8.244 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -4.137 -7.574 9.615 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -4.059 -5.796 9.643 1.00 0.00 H new ATOM 1665 N PRO A 113 0.084 -5.690 13.716 1.00 0.00 N ATOM 1666 CA PRO A 113 0.328 -4.905 14.930 1.00 0.00 C ATOM 1667 C PRO A 113 -0.847 -3.995 15.270 1.00 0.00 C ATOM 1668 O PRO A 113 -1.120 -3.726 16.440 1.00 0.00 O ATOM 1669 CB PRO A 113 1.566 -4.071 14.586 1.00 0.00 C ATOM 1670 CG PRO A 113 2.218 -4.796 13.459 1.00 0.00 C ATOM 1671 CD PRO A 113 1.103 -5.435 12.684 1.00 0.00 C ATOM 0 HA PRO A 113 0.464 -5.543 15.803 1.00 0.00 H new ATOM 0 HB2 PRO A 113 1.291 -3.057 14.296 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.236 -3.987 15.442 1.00 0.00 H new ATOM 0 HG2 PRO A 113 2.788 -4.111 12.831 1.00 0.00 H new ATOM 0 HG3 PRO A 113 2.917 -5.546 13.829 1.00 0.00 H new ATOM 0 HD2 PRO A 113 0.728 -4.777 11.900 1.00 0.00 H new ATOM 0 HD3 PRO A 113 1.425 -6.356 12.199 1.00 0.00 H new ATOM 1679 N ALA A 114 -1.539 -3.522 14.237 1.00 0.00 N ATOM 1680 CA ALA A 114 -2.682 -2.639 14.423 1.00 0.00 C ATOM 1681 C ALA A 114 -2.282 -1.379 15.178 1.00 0.00 C ATOM 1682 O ALA A 114 -1.230 -1.333 15.814 1.00 0.00 O ATOM 1683 CB ALA A 114 -3.796 -3.364 15.162 1.00 0.00 C ATOM 0 H ALA A 114 -1.326 -3.737 13.263 1.00 0.00 H new ATOM 0 HA ALA A 114 -3.045 -2.345 13.438 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -4.643 -2.691 15.294 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -4.110 -4.234 14.585 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -3.435 -3.687 16.138 1.00 0.00 H new ATOM 1689 N LYS A 115 -3.126 -0.357 15.105 1.00 0.00 N ATOM 1690 CA LYS A 115 -2.856 0.905 15.784 1.00 0.00 C ATOM 1691 C LYS A 115 -1.627 1.594 15.190 1.00 0.00 C ATOM 1692 O LYS A 115 -1.073 2.519 15.783 1.00 0.00 O ATOM 1693 CB LYS A 115 -2.654 0.657 17.281 1.00 0.00 C ATOM 1694 CG LYS A 115 -3.743 1.261 18.150 1.00 0.00 C ATOM 1695 CD LYS A 115 -4.824 0.242 18.473 1.00 0.00 C ATOM 1696 CE LYS A 115 -6.028 0.396 17.559 1.00 0.00 C ATOM 1697 NZ LYS A 115 -7.261 -0.181 18.161 1.00 0.00 N ATOM 0 H LYS A 115 -4.002 -0.377 14.583 1.00 0.00 H new ATOM 0 HA LYS A 115 -3.713 1.564 15.643 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.612 -0.417 17.460 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.691 1.068 17.582 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -3.306 1.636 19.076 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -4.187 2.115 17.638 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -4.417 -0.764 18.374 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -5.137 0.359 19.511 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -6.189 1.453 17.346 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -5.826 -0.094 16.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -8.092 0.343 17.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -7.345 -1.181 17.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -7.208 -0.108 19.197 1.00 0.00 H new ATOM 1711 N GLU A 116 -1.209 1.137 14.011 1.00 0.00 N ATOM 1712 CA GLU A 116 -0.053 1.704 13.328 1.00 0.00 C ATOM 1713 C GLU A 116 -0.269 1.681 11.819 1.00 0.00 C ATOM 1714 O GLU A 116 -1.392 1.496 11.349 1.00 0.00 O ATOM 1715 CB GLU A 116 1.218 0.925 13.682 1.00 0.00 C ATOM 1716 CG GLU A 116 1.314 0.540 15.148 1.00 0.00 C ATOM 1717 CD GLU A 116 1.739 1.697 16.031 1.00 0.00 C ATOM 1718 OE1 GLU A 116 1.551 2.860 15.614 1.00 0.00 O ATOM 1719 OE2 GLU A 116 2.259 1.442 17.137 1.00 0.00 O ATOM 0 H GLU A 116 -1.658 0.371 13.508 1.00 0.00 H new ATOM 0 HA GLU A 116 0.066 2.737 13.656 1.00 0.00 H new ATOM 0 HB2 GLU A 116 1.259 0.020 13.075 1.00 0.00 H new ATOM 0 HB3 GLU A 116 2.087 1.527 13.417 1.00 0.00 H new ATOM 0 HG2 GLU A 116 0.347 0.167 15.485 1.00 0.00 H new ATOM 0 HG3 GLU A 116 2.027 -0.277 15.259 1.00 0.00 H new ATOM 1726 N VAL A 117 0.807 1.855 11.061 1.00 0.00 N ATOM 1727 CA VAL A 117 0.719 1.838 9.609 1.00 0.00 C ATOM 1728 C VAL A 117 0.643 0.406 9.094 1.00 0.00 C ATOM 1729 O VAL A 117 1.643 -0.311 9.076 1.00 0.00 O ATOM 1730 CB VAL A 117 1.927 2.543 8.962 1.00 0.00 C ATOM 1731 CG1 VAL A 117 1.745 2.648 7.455 1.00 0.00 C ATOM 1732 CG2 VAL A 117 2.137 3.916 9.580 1.00 0.00 C ATOM 0 H VAL A 117 1.746 2.009 11.427 1.00 0.00 H new ATOM 0 HA VAL A 117 -0.189 2.376 9.335 1.00 0.00 H new ATOM 0 HB VAL A 117 2.818 1.944 9.153 1.00 0.00 H new ATOM 0 HG11 VAL A 117 2.609 3.149 7.018 1.00 0.00 H new ATOM 0 HG12 VAL A 117 1.651 1.649 7.029 1.00 0.00 H new ATOM 0 HG13 VAL A 117 0.844 3.222 7.236 1.00 0.00 H new ATOM 0 HG21 VAL A 117 2.994 4.399 9.111 1.00 0.00 H new ATOM 0 HG22 VAL A 117 1.247 4.525 9.424 1.00 0.00 H new ATOM 0 HG23 VAL A 117 2.321 3.810 10.649 1.00 0.00 H new ATOM 1742 N LEU A 118 -0.551 -0.008 8.681 1.00 0.00 N ATOM 1743 CA LEU A 118 -0.754 -1.358 8.173 1.00 0.00 C ATOM 1744 C LEU A 118 -0.496 -1.420 6.672 1.00 0.00 C ATOM 1745 O LEU A 118 -0.018 -2.431 6.155 1.00 0.00 O ATOM 1746 CB LEU A 118 -2.175 -1.837 8.483 1.00 0.00 C ATOM 1747 CG LEU A 118 -2.286 -3.302 8.916 1.00 0.00 C ATOM 1748 CD1 LEU A 118 -1.592 -4.209 7.910 1.00 0.00 C ATOM 1749 CD2 LEU A 118 -1.701 -3.496 10.311 1.00 0.00 C ATOM 0 H LEU A 118 -1.390 0.572 8.689 1.00 0.00 H new ATOM 0 HA LEU A 118 -0.042 -2.017 8.671 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.590 -1.209 9.271 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -2.793 -1.688 7.598 1.00 0.00 H new ATOM 0 HG LEU A 118 -3.341 -3.572 8.950 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.681 -5.246 8.233 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.059 -4.093 6.932 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -0.538 -3.939 7.843 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -1.789 -4.543 10.600 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -0.650 -3.208 10.308 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -2.245 -2.876 11.023 1.00 0.00 H new ATOM 1761 N ALA A 119 -0.811 -0.333 5.974 1.00 0.00 N ATOM 1762 CA ALA A 119 -0.605 -0.274 4.530 1.00 0.00 C ATOM 1763 C ALA A 119 -0.775 1.145 4.004 1.00 0.00 C ATOM 1764 O ALA A 119 -1.739 1.832 4.340 1.00 0.00 O ATOM 1765 CB ALA A 119 -1.558 -1.217 3.815 1.00 0.00 C ATOM 0 H ALA A 119 -1.207 0.514 6.381 1.00 0.00 H new ATOM 0 HA ALA A 119 0.419 -0.589 4.328 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -1.389 -1.159 2.740 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -1.383 -2.238 4.155 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -2.586 -0.932 4.037 1.00 0.00 H new ATOM 1771 N LYS A 120 0.169 1.575 3.174 1.00 0.00 N ATOM 1772 CA LYS A 120 0.131 2.914 2.596 1.00 0.00 C ATOM 1773 C LYS A 120 0.150 2.854 1.075 1.00 0.00 C ATOM 1774 O LYS A 120 1.202 2.675 0.467 1.00 0.00 O ATOM 1775 CB LYS A 120 1.319 3.745 3.091 1.00 0.00 C ATOM 1776 CG LYS A 120 1.610 3.585 4.576 1.00 0.00 C ATOM 1777 CD LYS A 120 3.102 3.468 4.841 1.00 0.00 C ATOM 1778 CE LYS A 120 3.594 2.044 4.637 1.00 0.00 C ATOM 1779 NZ LYS A 120 5.001 1.872 5.092 1.00 0.00 N ATOM 0 H LYS A 120 0.971 1.015 2.886 1.00 0.00 H new ATOM 0 HA LYS A 120 -0.798 3.387 2.915 1.00 0.00 H new ATOM 0 HB2 LYS A 120 2.207 3.464 2.525 1.00 0.00 H new ATOM 0 HB3 LYS A 120 1.126 4.797 2.880 1.00 0.00 H new ATOM 0 HG2 LYS A 120 1.208 4.439 5.121 1.00 0.00 H new ATOM 0 HG3 LYS A 120 1.101 2.698 4.954 1.00 0.00 H new ATOM 0 HD2 LYS A 120 3.644 4.140 4.176 1.00 0.00 H new ATOM 0 HD3 LYS A 120 3.317 3.786 5.861 1.00 0.00 H new ATOM 0 HE2 LYS A 120 2.949 1.355 5.183 1.00 0.00 H new ATOM 0 HE3 LYS A 120 3.519 1.782 3.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 5.467 1.146 4.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 5.510 2.773 4.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 5.010 1.577 6.089 1.00 0.00 H new ATOM 1793 N VAL A 121 -1.015 3.013 0.458 1.00 0.00 N ATOM 1794 CA VAL A 121 -1.108 2.985 -0.995 1.00 0.00 C ATOM 1795 C VAL A 121 -0.553 4.275 -1.589 1.00 0.00 C ATOM 1796 O VAL A 121 -1.136 5.348 -1.426 1.00 0.00 O ATOM 1797 CB VAL A 121 -2.563 2.785 -1.469 1.00 0.00 C ATOM 1798 CG1 VAL A 121 -3.442 3.937 -1.004 1.00 0.00 C ATOM 1799 CG2 VAL A 121 -2.618 2.637 -2.981 1.00 0.00 C ATOM 0 H VAL A 121 -1.903 3.162 0.938 1.00 0.00 H new ATOM 0 HA VAL A 121 -0.515 2.138 -1.341 1.00 0.00 H new ATOM 0 HB VAL A 121 -2.946 1.866 -1.024 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -4.464 3.777 -1.348 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -3.430 3.988 0.085 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -3.063 4.873 -1.415 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -3.652 2.497 -3.295 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -2.215 3.535 -3.449 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -2.027 1.773 -3.284 1.00 0.00 H new ATOM 1809 N VAL A 122 0.586 4.168 -2.264 1.00 0.00 N ATOM 1810 CA VAL A 122 1.226 5.328 -2.865 1.00 0.00 C ATOM 1811 C VAL A 122 0.510 5.775 -4.134 1.00 0.00 C ATOM 1812 O VAL A 122 0.483 5.055 -5.132 1.00 0.00 O ATOM 1813 CB VAL A 122 2.704 5.049 -3.203 1.00 0.00 C ATOM 1814 CG1 VAL A 122 3.415 6.337 -3.588 1.00 0.00 C ATOM 1815 CG2 VAL A 122 3.405 4.372 -2.033 1.00 0.00 C ATOM 0 H VAL A 122 1.084 3.289 -2.408 1.00 0.00 H new ATOM 0 HA VAL A 122 1.169 6.124 -2.123 1.00 0.00 H new ATOM 0 HB VAL A 122 2.740 4.371 -4.056 1.00 0.00 H new ATOM 0 HG11 VAL A 122 4.457 6.121 -3.823 1.00 0.00 H new ATOM 0 HG12 VAL A 122 2.929 6.774 -4.460 1.00 0.00 H new ATOM 0 HG13 VAL A 122 3.369 7.040 -2.757 1.00 0.00 H new ATOM 0 HG21 VAL A 122 4.447 4.184 -2.292 1.00 0.00 H new ATOM 0 HG22 VAL A 122 3.360 5.020 -1.158 1.00 0.00 H new ATOM 0 HG23 VAL A 122 2.910 3.427 -1.810 1.00 0.00 H new ATOM 1825 N LEU A 123 -0.054 6.978 -4.092 1.00 0.00 N ATOM 1826 CA LEU A 123 -0.753 7.536 -5.242 1.00 0.00 C ATOM 1827 C LEU A 123 0.140 8.560 -5.938 1.00 0.00 C ATOM 1828 O LEU A 123 1.191 8.928 -5.414 1.00 0.00 O ATOM 1829 CB LEU A 123 -2.079 8.167 -4.810 1.00 0.00 C ATOM 1830 CG LEU A 123 -3.082 7.193 -4.182 1.00 0.00 C ATOM 1831 CD1 LEU A 123 -4.063 7.938 -3.287 1.00 0.00 C ATOM 1832 CD2 LEU A 123 -3.824 6.410 -5.262 1.00 0.00 C ATOM 0 H LEU A 123 -0.040 7.585 -3.272 1.00 0.00 H new ATOM 0 HA LEU A 123 -0.980 6.735 -5.946 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -1.870 8.962 -4.095 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -2.543 8.634 -5.679 1.00 0.00 H new ATOM 0 HG LEU A 123 -2.529 6.483 -3.567 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -4.767 7.230 -2.850 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -3.517 8.444 -2.491 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -4.608 8.674 -3.878 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -4.531 5.725 -4.794 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -4.364 7.103 -5.908 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -3.108 5.843 -5.857 1.00 0.00 H new ATOM 1844 N ARG A 124 -0.256 8.999 -7.128 1.00 0.00 N ATOM 1845 CA ARG A 124 0.549 9.955 -7.884 1.00 0.00 C ATOM 1846 C ARG A 124 -0.155 11.300 -8.069 1.00 0.00 C ATOM 1847 O ARG A 124 -1.263 11.372 -8.596 1.00 0.00 O ATOM 1848 CB ARG A 124 0.913 9.364 -9.251 1.00 0.00 C ATOM 1849 CG ARG A 124 1.593 10.346 -10.190 1.00 0.00 C ATOM 1850 CD ARG A 124 2.846 10.940 -9.568 1.00 0.00 C ATOM 1851 NE ARG A 124 3.867 9.927 -9.318 1.00 0.00 N ATOM 1852 CZ ARG A 124 5.155 10.202 -9.131 1.00 0.00 C ATOM 1853 NH1 ARG A 124 5.585 11.457 -9.163 1.00 0.00 N ATOM 1854 NH2 ARG A 124 6.017 9.219 -8.908 1.00 0.00 N ATOM 0 H ARG A 124 -1.120 8.712 -7.587 1.00 0.00 H new ATOM 0 HA ARG A 124 1.454 10.143 -7.305 1.00 0.00 H new ATOM 0 HB2 ARG A 124 1.570 8.507 -9.101 1.00 0.00 H new ATOM 0 HB3 ARG A 124 0.006 8.991 -9.727 1.00 0.00 H new ATOM 0 HG2 ARG A 124 1.853 9.840 -11.120 1.00 0.00 H new ATOM 0 HG3 ARG A 124 0.899 11.146 -10.445 1.00 0.00 H new ATOM 0 HD2 ARG A 124 3.250 11.706 -10.229 1.00 0.00 H new ATOM 0 HD3 ARG A 124 2.587 11.432 -8.631 1.00 0.00 H new ATOM 0 HE ARG A 124 3.575 8.950 -9.285 1.00 0.00 H new ATOM 0 HH11 ARG A 124 4.927 12.218 -9.332 1.00 0.00 H new ATOM 0 HH12 ARG A 124 6.574 11.661 -9.019 1.00 0.00 H new ATOM 0 HH21 ARG A 124 5.692 8.252 -8.880 1.00 0.00 H new ATOM 0 HH22 ARG A 124 7.005 9.430 -8.765 1.00 0.00 H new ATOM 1868 N ALA A 125 0.530 12.363 -7.654 1.00 0.00 N ATOM 1869 CA ALA A 125 0.023 13.724 -7.790 1.00 0.00 C ATOM 1870 C ALA A 125 0.511 14.321 -9.105 1.00 0.00 C ATOM 1871 O ALA A 125 1.383 15.184 -9.120 1.00 0.00 O ATOM 1872 CB ALA A 125 0.483 14.574 -6.615 1.00 0.00 C ATOM 0 H ALA A 125 1.449 12.305 -7.216 1.00 0.00 H new ATOM 0 HA ALA A 125 -1.067 13.705 -7.793 1.00 0.00 H new ATOM 0 HB1 ALA A 125 0.099 15.588 -6.727 1.00 0.00 H new ATOM 0 HB2 ALA A 125 0.108 14.144 -5.686 1.00 0.00 H new ATOM 0 HB3 ALA A 125 1.572 14.600 -6.589 1.00 0.00 H new ATOM 1878 N GLU A 126 -0.063 13.858 -10.205 1.00 0.00 N ATOM 1879 CA GLU A 126 0.306 14.348 -11.525 1.00 0.00 C ATOM 1880 C GLU A 126 -0.529 15.568 -11.868 1.00 0.00 C ATOM 1881 O GLU A 126 -0.318 16.224 -12.887 1.00 0.00 O ATOM 1882 CB GLU A 126 0.106 13.257 -12.579 1.00 0.00 C ATOM 1883 CG GLU A 126 1.341 12.402 -12.812 1.00 0.00 C ATOM 1884 CD GLU A 126 1.016 11.079 -13.477 1.00 0.00 C ATOM 1885 OE1 GLU A 126 0.188 10.324 -12.924 1.00 0.00 O ATOM 1886 OE2 GLU A 126 1.589 10.796 -14.550 1.00 0.00 O ATOM 0 H GLU A 126 -0.789 13.141 -10.210 1.00 0.00 H new ATOM 0 HA GLU A 126 1.360 14.625 -11.516 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -0.718 12.614 -12.272 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -0.186 13.722 -13.520 1.00 0.00 H new ATOM 0 HG2 GLU A 126 2.048 12.953 -13.433 1.00 0.00 H new ATOM 0 HG3 GLU A 126 1.834 12.214 -11.858 1.00 0.00 H new ATOM 1893 N ALA A 127 -1.466 15.868 -10.983 1.00 0.00 N ATOM 1894 CA ALA A 127 -2.335 17.007 -11.139 1.00 0.00 C ATOM 1895 C ALA A 127 -2.977 17.338 -9.814 1.00 0.00 C ATOM 1896 O ALA A 127 -3.610 16.497 -9.176 1.00 0.00 O ATOM 1897 CB ALA A 127 -3.387 16.764 -12.203 1.00 0.00 C ATOM 0 H ALA A 127 -1.640 15.324 -10.138 1.00 0.00 H new ATOM 0 HA ALA A 127 -1.736 17.856 -11.469 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -4.024 17.644 -12.293 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -2.900 16.570 -13.159 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -3.995 15.903 -11.924 1.00 0.00 H new ATOM 1903 N LYS A 128 -2.773 18.562 -9.401 1.00 0.00 N ATOM 1904 CA LYS A 128 -3.286 19.046 -8.132 1.00 0.00 C ATOM 1905 C LYS A 128 -4.773 18.735 -7.954 1.00 0.00 C ATOM 1906 O LYS A 128 -5.584 18.946 -8.855 1.00 0.00 O ATOM 1907 CB LYS A 128 -3.017 20.554 -8.005 1.00 0.00 C ATOM 1908 CG LYS A 128 -4.031 21.315 -7.157 1.00 0.00 C ATOM 1909 CD LYS A 128 -3.772 22.813 -7.193 1.00 0.00 C ATOM 1910 CE LYS A 128 -2.509 23.182 -6.433 1.00 0.00 C ATOM 1911 NZ LYS A 128 -2.796 23.544 -5.019 1.00 0.00 N ATOM 0 H LYS A 128 -2.247 19.257 -9.931 1.00 0.00 H new ATOM 0 HA LYS A 128 -2.761 18.521 -7.334 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -2.025 20.697 -7.576 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -2.998 20.991 -9.003 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -5.038 21.110 -7.520 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -3.985 20.961 -6.127 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -3.683 23.142 -8.228 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -4.623 23.340 -6.762 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -1.812 22.344 -6.459 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -2.019 24.019 -6.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -2.055 24.184 -4.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -3.719 24.019 -4.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -2.814 22.682 -4.437 1.00 0.00 H new ATOM 1925 N ALA A 129 -5.110 18.238 -6.767 1.00 0.00 N ATOM 1926 CA ALA A 129 -6.477 17.896 -6.417 1.00 0.00 C ATOM 1927 C ALA A 129 -6.774 18.335 -4.987 1.00 0.00 C ATOM 1928 O ALA A 129 -7.015 17.508 -4.107 1.00 0.00 O ATOM 1929 CB ALA A 129 -6.694 16.400 -6.569 1.00 0.00 C ATOM 0 H ALA A 129 -4.437 18.062 -6.021 1.00 0.00 H new ATOM 0 HA ALA A 129 -7.158 18.416 -7.090 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -7.722 16.153 -6.304 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -6.505 16.108 -7.602 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -6.011 15.864 -5.910 1.00 0.00 H new ATOM 1935 N GLU A 130 -6.738 19.642 -4.758 1.00 0.00 N ATOM 1936 CA GLU A 130 -6.985 20.191 -3.428 1.00 0.00 C ATOM 1937 C GLU A 130 -8.341 19.747 -2.893 1.00 0.00 C ATOM 1938 O GLU A 130 -9.386 20.109 -3.433 1.00 0.00 O ATOM 1939 CB GLU A 130 -6.915 21.720 -3.465 1.00 0.00 C ATOM 1940 CG GLU A 130 -6.306 22.332 -2.214 1.00 0.00 C ATOM 1941 CD GLU A 130 -6.419 23.842 -2.190 1.00 0.00 C ATOM 1942 OE1 GLU A 130 -6.034 24.482 -3.192 1.00 0.00 O ATOM 1943 OE2 GLU A 130 -6.893 24.387 -1.171 1.00 0.00 O ATOM 0 H GLU A 130 -6.541 20.341 -5.474 1.00 0.00 H new ATOM 0 HA GLU A 130 -6.212 19.812 -2.759 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -6.330 22.028 -4.332 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.920 22.118 -3.602 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.801 21.920 -1.335 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -5.255 22.049 -2.150 1.00 0.00 H new ATOM 1950 N GLY A 131 -8.311 18.955 -1.824 1.00 0.00 N ATOM 1951 CA GLY A 131 -9.538 18.466 -1.223 1.00 0.00 C ATOM 1952 C GLY A 131 -10.036 17.190 -1.873 1.00 0.00 C ATOM 1953 O GLY A 131 -11.217 16.855 -1.766 1.00 0.00 O ATOM 0 H GLY A 131 -7.456 18.643 -1.363 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -9.372 18.288 -0.161 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -10.308 19.234 -1.301 1.00 0.00 H new ATOM 1957 N SER A 132 -9.141 16.469 -2.544 1.00 0.00 N ATOM 1958 CA SER A 132 -9.507 15.221 -3.201 1.00 0.00 C ATOM 1959 C SER A 132 -9.782 14.134 -2.167 1.00 0.00 C ATOM 1960 O SER A 132 -9.050 13.149 -2.071 1.00 0.00 O ATOM 1961 CB SER A 132 -8.398 14.774 -4.157 1.00 0.00 C ATOM 1962 OG SER A 132 -8.768 15.001 -5.505 1.00 0.00 O ATOM 0 H SER A 132 -8.160 16.728 -2.646 1.00 0.00 H new ATOM 0 HA SER A 132 -10.416 15.390 -3.778 1.00 0.00 H new ATOM 0 HB2 SER A 132 -7.479 15.315 -3.932 1.00 0.00 H new ATOM 0 HB3 SER A 132 -8.189 13.715 -4.007 1.00 0.00 H new ATOM 0 HG SER A 132 -9.369 15.774 -5.554 1.00 0.00 H new ATOM 1968 N ASN A 133 -10.842 14.326 -1.388 1.00 0.00 N ATOM 1969 CA ASN A 133 -11.219 13.376 -0.353 1.00 0.00 C ATOM 1970 C ASN A 133 -11.207 11.941 -0.868 1.00 0.00 C ATOM 1971 O ASN A 133 -11.582 11.669 -2.008 1.00 0.00 O ATOM 1972 CB ASN A 133 -12.604 13.724 0.189 1.00 0.00 C ATOM 1973 CG ASN A 133 -12.652 13.729 1.690 1.00 0.00 C ATOM 1974 OD1 ASN A 133 -12.256 12.766 2.346 1.00 0.00 O ATOM 1975 ND2 ASN A 133 -13.144 14.822 2.238 1.00 0.00 N ATOM 0 H ASN A 133 -11.457 15.137 -1.457 1.00 0.00 H new ATOM 0 HA ASN A 133 -10.482 13.445 0.447 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -12.900 14.705 -0.184 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -13.330 13.006 -0.192 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -13.210 14.898 3.253 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -13.458 15.592 1.647 1.00 0.00 H new ATOM 1982 N LEU A 134 -10.777 11.029 -0.006 1.00 0.00 N ATOM 1983 CA LEU A 134 -10.714 9.614 -0.341 1.00 0.00 C ATOM 1984 C LEU A 134 -11.562 8.814 0.638 1.00 0.00 C ATOM 1985 O LEU A 134 -11.947 9.323 1.689 1.00 0.00 O ATOM 1986 CB LEU A 134 -9.266 9.115 -0.309 1.00 0.00 C ATOM 1987 CG LEU A 134 -8.220 10.116 -0.813 1.00 0.00 C ATOM 1988 CD1 LEU A 134 -7.158 10.363 0.249 1.00 0.00 C ATOM 1989 CD2 LEU A 134 -7.579 9.619 -2.101 1.00 0.00 C ATOM 0 H LEU A 134 -10.464 11.248 0.940 1.00 0.00 H new ATOM 0 HA LEU A 134 -11.103 9.478 -1.350 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -9.017 8.838 0.715 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -9.197 8.208 -0.910 1.00 0.00 H new ATOM 0 HG LEU A 134 -8.724 11.060 -1.021 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -6.425 11.076 -0.128 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -7.628 10.766 1.146 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -6.660 9.424 0.491 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -6.840 10.343 -2.443 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -7.092 8.661 -1.919 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -8.346 9.496 -2.865 1.00 0.00 H new ATOM 2001 N SER A 135 -11.856 7.568 0.297 1.00 0.00 N ATOM 2002 CA SER A 135 -12.668 6.726 1.168 1.00 0.00 C ATOM 2003 C SER A 135 -12.255 5.263 1.073 1.00 0.00 C ATOM 2004 O SER A 135 -12.548 4.585 0.089 1.00 0.00 O ATOM 2005 CB SER A 135 -14.150 6.875 0.819 1.00 0.00 C ATOM 2006 OG SER A 135 -14.323 7.159 -0.558 1.00 0.00 O ATOM 0 H SER A 135 -11.549 7.120 -0.566 1.00 0.00 H new ATOM 0 HA SER A 135 -12.505 7.056 2.194 1.00 0.00 H new ATOM 0 HB2 SER A 135 -14.681 5.958 1.074 1.00 0.00 H new ATOM 0 HB3 SER A 135 -14.589 7.674 1.416 1.00 0.00 H new ATOM 0 HG SER A 135 -15.279 7.248 -0.756 1.00 0.00 H new ATOM 2012 N VAL A 136 -11.581 4.780 2.112 1.00 0.00 N ATOM 2013 CA VAL A 136 -11.138 3.394 2.155 1.00 0.00 C ATOM 2014 C VAL A 136 -12.130 2.538 2.933 1.00 0.00 C ATOM 2015 O VAL A 136 -12.069 2.457 4.160 1.00 0.00 O ATOM 2016 CB VAL A 136 -9.747 3.266 2.803 1.00 0.00 C ATOM 2017 CG1 VAL A 136 -9.221 1.845 2.666 1.00 0.00 C ATOM 2018 CG2 VAL A 136 -8.778 4.262 2.185 1.00 0.00 C ATOM 0 H VAL A 136 -11.331 5.329 2.934 1.00 0.00 H new ATOM 0 HA VAL A 136 -11.079 3.043 1.125 1.00 0.00 H new ATOM 0 HB VAL A 136 -9.839 3.493 3.865 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -8.237 1.775 3.130 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -9.905 1.155 3.160 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -9.143 1.586 1.610 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -7.800 4.158 2.655 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -8.690 4.068 1.116 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -9.149 5.275 2.341 1.00 0.00 H new ATOM 2028 N THR A 137 -13.049 1.905 2.212 1.00 0.00 N ATOM 2029 CA THR A 137 -14.060 1.059 2.832 1.00 0.00 C ATOM 2030 C THR A 137 -13.715 -0.417 2.649 1.00 0.00 C ATOM 2031 O THR A 137 -12.566 -0.762 2.374 1.00 0.00 O ATOM 2032 CB THR A 137 -15.437 1.360 2.233 1.00 0.00 C ATOM 2033 OG1 THR A 137 -15.558 0.793 0.942 1.00 0.00 O ATOM 2034 CG2 THR A 137 -15.728 2.841 2.114 1.00 0.00 C ATOM 0 H THR A 137 -13.114 1.963 1.196 1.00 0.00 H new ATOM 0 HA THR A 137 -14.084 1.275 3.900 1.00 0.00 H new ATOM 0 HB THR A 137 -16.155 0.920 2.926 1.00 0.00 H new ATOM 0 HG1 THR A 137 -16.445 0.995 0.578 1.00 0.00 H new ATOM 0 HG21 THR A 137 -16.719 2.984 1.683 1.00 0.00 H new ATOM 0 HG22 THR A 137 -15.693 3.299 3.102 1.00 0.00 H new ATOM 0 HG23 THR A 137 -14.982 3.308 1.471 1.00 0.00 H new ATOM 2042 N ASN A 138 -14.717 -1.285 2.807 1.00 0.00 N ATOM 2043 CA ASN A 138 -14.532 -2.734 2.658 1.00 0.00 C ATOM 2044 C ASN A 138 -13.270 -3.226 3.367 1.00 0.00 C ATOM 2045 O ASN A 138 -12.762 -4.307 3.066 1.00 0.00 O ATOM 2046 CB ASN A 138 -14.489 -3.137 1.176 1.00 0.00 C ATOM 2047 CG ASN A 138 -14.568 -1.947 0.242 1.00 0.00 C ATOM 2048 OD1 ASN A 138 -13.455 -1.241 0.103 1.00 0.00 O flip ATOM 2049 ND2 ASN A 138 -15.611 -1.668 -0.347 1.00 0.00 N flip ATOM 0 H ASN A 138 -15.671 -1.009 3.040 1.00 0.00 H new ATOM 0 HA ASN A 138 -15.392 -3.210 3.130 1.00 0.00 H new ATOM 0 HB2 ASN A 138 -13.568 -3.686 0.980 1.00 0.00 H new ATOM 0 HB3 ASN A 138 -15.316 -3.815 0.964 1.00 0.00 H new ATOM 0 HD21 ASN A 138 -16.444 -2.241 -0.209 1.00 0.00 H new ATOM 0 HD22 ASN A 138 -15.643 -0.864 -0.974 1.00 0.00 H new ATOM 2056 N SER A 139 -12.774 -2.436 4.308 1.00 0.00 N ATOM 2057 CA SER A 139 -11.580 -2.802 5.060 1.00 0.00 C ATOM 2058 C SER A 139 -11.810 -4.112 5.804 1.00 0.00 C ATOM 2059 O SER A 139 -12.280 -4.121 6.941 1.00 0.00 O ATOM 2060 CB SER A 139 -11.208 -1.693 6.046 1.00 0.00 C ATOM 2061 OG SER A 139 -10.819 -0.513 5.364 1.00 0.00 O ATOM 0 H SER A 139 -13.179 -1.537 4.570 1.00 0.00 H new ATOM 0 HA SER A 139 -10.755 -2.934 4.360 1.00 0.00 H new ATOM 0 HB2 SER A 139 -12.058 -1.479 6.694 1.00 0.00 H new ATOM 0 HB3 SER A 139 -10.394 -2.031 6.688 1.00 0.00 H new ATOM 0 HG SER A 139 -9.967 -0.192 5.726 1.00 0.00 H new ATOM 2067 N SER A 140 -11.486 -5.218 5.147 1.00 0.00 N ATOM 2068 CA SER A 140 -11.668 -6.540 5.731 1.00 0.00 C ATOM 2069 C SER A 140 -10.330 -7.252 5.914 1.00 0.00 C ATOM 2070 O SER A 140 -9.462 -7.198 5.042 1.00 0.00 O ATOM 2071 CB SER A 140 -12.589 -7.374 4.842 1.00 0.00 C ATOM 2072 OG SER A 140 -13.708 -7.854 5.568 1.00 0.00 O ATOM 0 H SER A 140 -11.094 -5.225 4.205 1.00 0.00 H new ATOM 0 HA SER A 140 -12.122 -6.421 6.715 1.00 0.00 H new ATOM 0 HB2 SER A 140 -12.930 -6.771 4.001 1.00 0.00 H new ATOM 0 HB3 SER A 140 -12.034 -8.215 4.427 1.00 0.00 H new ATOM 0 HG SER A 140 -14.281 -8.383 4.974 1.00 0.00 H new ATOM 2078 N VAL A 141 -10.174 -7.922 7.051 1.00 0.00 N ATOM 2079 CA VAL A 141 -8.944 -8.648 7.347 1.00 0.00 C ATOM 2080 C VAL A 141 -9.202 -10.149 7.432 1.00 0.00 C ATOM 2081 O VAL A 141 -10.310 -10.582 7.749 1.00 0.00 O ATOM 2082 CB VAL A 141 -8.302 -8.168 8.663 1.00 0.00 C ATOM 2083 CG1 VAL A 141 -9.169 -8.540 9.860 1.00 0.00 C ATOM 2084 CG2 VAL A 141 -6.903 -8.743 8.806 1.00 0.00 C ATOM 0 H VAL A 141 -10.883 -7.977 7.782 1.00 0.00 H new ATOM 0 HA VAL A 141 -8.254 -8.445 6.528 1.00 0.00 H new ATOM 0 HB VAL A 141 -8.227 -7.081 8.633 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -8.694 -8.190 10.776 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -10.149 -8.074 9.758 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -9.285 -9.623 9.902 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -6.461 -8.396 9.740 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -6.956 -9.832 8.812 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -6.287 -8.414 7.969 1.00 0.00 H new ATOM 2094 N GLY A 142 -8.172 -10.941 7.149 1.00 0.00 N ATOM 2095 CA GLY A 142 -8.312 -12.383 7.199 1.00 0.00 C ATOM 2096 C GLY A 142 -7.967 -12.960 8.559 1.00 0.00 C ATOM 2097 O GLY A 142 -6.793 -13.134 8.886 1.00 0.00 O ATOM 0 H GLY A 142 -7.244 -10.609 6.886 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -9.337 -12.653 6.944 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -7.667 -12.833 6.444 1.00 0.00 H new ATOM 2101 N ASP A 143 -8.992 -13.259 9.353 1.00 0.00 N ATOM 2102 CA ASP A 143 -8.793 -13.823 10.685 1.00 0.00 C ATOM 2103 C ASP A 143 -7.894 -15.055 10.632 1.00 0.00 C ATOM 2104 O ASP A 143 -7.700 -15.648 9.571 1.00 0.00 O ATOM 2105 CB ASP A 143 -10.141 -14.190 11.309 1.00 0.00 C ATOM 2106 CG ASP A 143 -10.005 -14.670 12.740 1.00 0.00 C ATOM 2107 OD1 ASP A 143 -9.144 -14.131 13.468 1.00 0.00 O ATOM 2108 OD2 ASP A 143 -10.759 -15.585 13.134 1.00 0.00 O ATOM 0 H ASP A 143 -9.969 -13.120 9.097 1.00 0.00 H new ATOM 0 HA ASP A 143 -8.304 -13.068 11.301 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -10.799 -13.322 11.281 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -10.615 -14.969 10.711 1.00 0.00 H new ATOM 2113 N GLY A 144 -7.346 -15.433 11.783 1.00 0.00 N ATOM 2114 CA GLY A 144 -6.474 -16.591 11.844 1.00 0.00 C ATOM 2115 C GLY A 144 -7.156 -17.858 11.367 1.00 0.00 C ATOM 2116 O GLY A 144 -6.571 -18.642 10.619 1.00 0.00 O ATOM 0 H GLY A 144 -7.491 -14.958 12.674 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -5.589 -16.408 11.235 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -6.132 -16.730 12.870 1.00 0.00 H new ATOM 2120 N GLU A 145 -8.396 -18.059 11.800 1.00 0.00 N ATOM 2121 CA GLU A 145 -9.158 -19.239 11.412 1.00 0.00 C ATOM 2122 C GLU A 145 -9.400 -19.260 9.906 1.00 0.00 C ATOM 2123 O GLU A 145 -9.491 -20.326 9.296 1.00 0.00 O ATOM 2124 CB GLU A 145 -10.496 -19.276 12.155 1.00 0.00 C ATOM 2125 CG GLU A 145 -10.363 -19.077 13.656 1.00 0.00 C ATOM 2126 CD GLU A 145 -10.471 -20.377 14.427 1.00 0.00 C ATOM 2127 OE1 GLU A 145 -10.232 -21.447 13.827 1.00 0.00 O ATOM 2128 OE2 GLU A 145 -10.795 -20.328 15.633 1.00 0.00 O ATOM 0 H GLU A 145 -8.894 -17.420 12.420 1.00 0.00 H new ATOM 0 HA GLU A 145 -8.576 -20.120 11.681 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -11.148 -18.502 11.751 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -10.981 -20.233 11.965 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -9.403 -18.609 13.873 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -11.137 -18.390 13.998 1.00 0.00 H new ATOM 2135 N GLY A 146 -9.503 -18.076 9.312 1.00 0.00 N ATOM 2136 CA GLY A 146 -9.732 -17.980 7.883 1.00 0.00 C ATOM 2137 C GLY A 146 -10.848 -17.014 7.537 1.00 0.00 C ATOM 2138 O GLY A 146 -10.856 -16.425 6.455 1.00 0.00 O ATOM 0 H GLY A 146 -9.432 -17.181 9.795 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -8.813 -17.659 7.392 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -9.976 -18.967 7.490 1.00 0.00 H new ATOM 2142 N LEU A 147 -11.792 -16.849 8.458 1.00 0.00 N ATOM 2143 CA LEU A 147 -12.919 -15.948 8.244 1.00 0.00 C ATOM 2144 C LEU A 147 -12.457 -14.495 8.231 1.00 0.00 C ATOM 2145 O LEU A 147 -11.426 -14.154 8.809 1.00 0.00 O ATOM 2146 CB LEU A 147 -13.974 -16.150 9.334 1.00 0.00 C ATOM 2147 CG LEU A 147 -14.638 -17.528 9.344 1.00 0.00 C ATOM 2148 CD1 LEU A 147 -15.187 -17.846 10.725 1.00 0.00 C ATOM 2149 CD2 LEU A 147 -15.744 -17.592 8.301 1.00 0.00 C ATOM 0 H LEU A 147 -11.799 -17.327 9.359 1.00 0.00 H new ATOM 0 HA LEU A 147 -13.359 -16.180 7.274 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -13.508 -15.981 10.305 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -14.748 -15.391 9.215 1.00 0.00 H new ATOM 0 HG LEU A 147 -13.885 -18.276 9.095 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -15.656 -18.830 10.713 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -14.373 -17.841 11.450 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -15.927 -17.096 11.004 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -16.206 -18.579 8.321 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -16.496 -16.834 8.521 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -15.323 -17.409 7.312 1.00 0.00 H new ATOM 2161 N VAL A 148 -13.230 -13.641 7.567 1.00 0.00 N ATOM 2162 CA VAL A 148 -12.903 -12.222 7.477 1.00 0.00 C ATOM 2163 C VAL A 148 -13.944 -11.374 8.201 1.00 0.00 C ATOM 2164 O VAL A 148 -15.145 -11.635 8.108 1.00 0.00 O ATOM 2165 CB VAL A 148 -12.802 -11.763 6.009 1.00 0.00 C ATOM 2166 CG1 VAL A 148 -14.135 -11.938 5.298 1.00 0.00 C ATOM 2167 CG2 VAL A 148 -12.330 -10.319 5.925 1.00 0.00 C ATOM 0 H VAL A 148 -14.088 -13.907 7.083 1.00 0.00 H new ATOM 0 HA VAL A 148 -11.934 -12.085 7.956 1.00 0.00 H new ATOM 0 HB VAL A 148 -12.064 -12.389 5.507 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -14.042 -11.608 4.263 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -14.423 -12.989 5.319 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -14.897 -11.343 5.801 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -12.266 -10.017 4.880 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -13.037 -9.674 6.446 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -11.348 -10.230 6.389 1.00 0.00 H new ATOM 2177 N HIS A 149 -13.478 -10.362 8.922 1.00 0.00 N ATOM 2178 CA HIS A 149 -14.371 -9.478 9.663 1.00 0.00 C ATOM 2179 C HIS A 149 -14.406 -8.086 9.043 1.00 0.00 C ATOM 2180 O HIS A 149 -13.542 -7.253 9.320 1.00 0.00 O ATOM 2181 CB HIS A 149 -13.929 -9.382 11.125 1.00 0.00 C ATOM 2182 CG HIS A 149 -13.803 -10.711 11.802 1.00 0.00 C ATOM 2183 ND1 HIS A 149 -12.604 -11.382 11.927 1.00 0.00 N ATOM 2184 CD2 HIS A 149 -14.735 -11.495 12.394 1.00 0.00 C ATOM 2185 CE1 HIS A 149 -12.805 -12.521 12.567 1.00 0.00 C ATOM 2186 NE2 HIS A 149 -14.089 -12.612 12.861 1.00 0.00 N ATOM 0 H HIS A 149 -12.488 -10.133 9.010 1.00 0.00 H new ATOM 0 HA HIS A 149 -15.375 -9.901 9.617 1.00 0.00 H new ATOM 0 HB2 HIS A 149 -12.969 -8.867 11.173 1.00 0.00 H new ATOM 0 HB3 HIS A 149 -14.646 -8.771 11.673 1.00 0.00 H new ATOM 0 HD2 HIS A 149 -15.790 -11.281 12.482 1.00 0.00 H new ATOM 0 HE1 HIS A 149 -12.048 -13.253 12.808 1.00 0.00 H new ATOM 0 HE2 HIS A 149 -14.530 -13.388 13.356 1.00 0.00 H new ATOM 2195 N GLU A 150 -15.413 -7.833 8.212 1.00 0.00 N ATOM 2196 CA GLU A 150 -15.559 -6.532 7.567 1.00 0.00 C ATOM 2197 C GLU A 150 -15.597 -5.427 8.616 1.00 0.00 C ATOM 2198 O GLU A 150 -16.596 -5.256 9.316 1.00 0.00 O ATOM 2199 CB GLU A 150 -16.833 -6.494 6.719 1.00 0.00 C ATOM 2200 CG GLU A 150 -16.832 -5.396 5.670 1.00 0.00 C ATOM 2201 CD GLU A 150 -17.620 -4.175 6.102 1.00 0.00 C ATOM 2202 OE1 GLU A 150 -17.804 -3.992 7.325 1.00 0.00 O ATOM 2203 OE2 GLU A 150 -18.052 -3.403 5.221 1.00 0.00 O ATOM 0 H GLU A 150 -16.138 -8.509 7.970 1.00 0.00 H new ATOM 0 HA GLU A 150 -14.701 -6.372 6.914 1.00 0.00 H new ATOM 0 HB2 GLU A 150 -16.959 -7.457 6.225 1.00 0.00 H new ATOM 0 HB3 GLU A 150 -17.692 -6.357 7.375 1.00 0.00 H new ATOM 0 HG2 GLU A 150 -15.804 -5.103 5.457 1.00 0.00 H new ATOM 0 HG3 GLU A 150 -17.252 -5.785 4.742 1.00 0.00 H new ATOM 2210 N ILE A 151 -14.498 -4.692 8.737 1.00 0.00 N ATOM 2211 CA ILE A 151 -14.406 -3.621 9.721 1.00 0.00 C ATOM 2212 C ILE A 151 -15.005 -2.319 9.201 1.00 0.00 C ATOM 2213 O ILE A 151 -15.555 -2.262 8.100 1.00 0.00 O ATOM 2214 CB ILE A 151 -12.944 -3.382 10.178 1.00 0.00 C ATOM 2215 CG1 ILE A 151 -12.235 -2.363 9.269 1.00 0.00 C ATOM 2216 CG2 ILE A 151 -12.184 -4.703 10.228 1.00 0.00 C ATOM 2217 CD1 ILE A 151 -10.763 -2.648 9.040 1.00 0.00 C ATOM 0 H ILE A 151 -13.661 -4.817 8.168 1.00 0.00 H new ATOM 0 HA ILE A 151 -14.988 -3.947 10.583 1.00 0.00 H new ATOM 0 HB ILE A 151 -12.963 -2.960 11.183 1.00 0.00 H new ATOM 0 HG12 ILE A 151 -12.743 -2.339 8.305 1.00 0.00 H new ATOM 0 HG13 ILE A 151 -12.337 -1.370 9.707 1.00 0.00 H new ATOM 0 HG21 ILE A 151 -11.159 -4.521 10.550 1.00 0.00 H new ATOM 0 HG22 ILE A 151 -12.672 -5.377 10.932 1.00 0.00 H new ATOM 0 HG23 ILE A 151 -12.178 -5.157 9.237 1.00 0.00 H new ATOM 0 HD11 ILE A 151 -10.341 -1.882 8.389 1.00 0.00 H new ATOM 0 HD12 ILE A 151 -10.238 -2.641 9.995 1.00 0.00 H new ATOM 0 HD13 ILE A 151 -10.650 -3.625 8.571 1.00 0.00 H new ATOM 2229 N ALA A 152 -14.897 -1.281 10.017 1.00 0.00 N ATOM 2230 CA ALA A 152 -15.421 0.034 9.685 1.00 0.00 C ATOM 2231 C ALA A 152 -14.644 0.675 8.533 1.00 0.00 C ATOM 2232 O ALA A 152 -13.994 -0.017 7.748 1.00 0.00 O ATOM 2233 CB ALA A 152 -15.380 0.915 10.927 1.00 0.00 C ATOM 0 H ALA A 152 -14.443 -1.328 10.929 1.00 0.00 H new ATOM 0 HA ALA A 152 -16.453 -0.073 9.350 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -15.772 1.903 10.685 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -15.988 0.466 11.712 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -14.351 1.008 11.274 1.00 0.00 H new ATOM 2239 N GLY A 153 -14.720 2.001 8.439 1.00 0.00 N ATOM 2240 CA GLY A 153 -14.029 2.722 7.389 1.00 0.00 C ATOM 2241 C GLY A 153 -13.736 4.154 7.791 1.00 0.00 C ATOM 2242 O GLY A 153 -14.148 4.598 8.862 1.00 0.00 O ATOM 0 H GLY A 153 -15.253 2.590 9.078 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -13.095 2.212 7.151 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -14.635 2.715 6.483 1.00 0.00 H new ATOM 2246 N THR A 154 -13.021 4.877 6.939 1.00 0.00 N ATOM 2247 CA THR A 154 -12.674 6.263 7.227 1.00 0.00 C ATOM 2248 C THR A 154 -12.206 6.981 5.965 1.00 0.00 C ATOM 2249 O THR A 154 -11.590 6.376 5.087 1.00 0.00 O ATOM 2250 CB THR A 154 -11.584 6.316 8.299 1.00 0.00 C ATOM 2251 OG1 THR A 154 -12.016 5.669 9.483 1.00 0.00 O ATOM 2252 CG2 THR A 154 -11.169 7.722 8.673 1.00 0.00 C ATOM 0 H THR A 154 -12.671 4.529 6.046 1.00 0.00 H new ATOM 0 HA THR A 154 -13.565 6.771 7.597 1.00 0.00 H new ATOM 0 HB THR A 154 -10.725 5.810 7.857 1.00 0.00 H new ATOM 0 HG1 THR A 154 -12.994 5.695 9.531 1.00 0.00 H new ATOM 0 HG21 THR A 154 -10.393 7.681 9.438 1.00 0.00 H new ATOM 0 HG22 THR A 154 -10.783 8.234 7.792 1.00 0.00 H new ATOM 0 HG23 THR A 154 -12.031 8.265 9.059 1.00 0.00 H new ATOM 2260 N GLU A 155 -12.505 8.274 5.880 1.00 0.00 N ATOM 2261 CA GLU A 155 -12.117 9.071 4.723 1.00 0.00 C ATOM 2262 C GLU A 155 -10.888 9.925 5.033 1.00 0.00 C ATOM 2263 O GLU A 155 -10.499 10.078 6.191 1.00 0.00 O ATOM 2264 CB GLU A 155 -13.283 9.960 4.277 1.00 0.00 C ATOM 2265 CG GLU A 155 -13.451 11.222 5.106 1.00 0.00 C ATOM 2266 CD GLU A 155 -14.721 11.979 4.770 1.00 0.00 C ATOM 2267 OE1 GLU A 155 -14.864 12.410 3.606 1.00 0.00 O ATOM 2268 OE2 GLU A 155 -15.572 12.139 5.669 1.00 0.00 O ATOM 0 H GLU A 155 -13.014 8.790 6.598 1.00 0.00 H new ATOM 0 HA GLU A 155 -11.861 8.390 3.911 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -13.135 10.240 3.234 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -14.206 9.382 4.324 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -13.459 10.958 6.164 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -12.592 11.873 4.947 1.00 0.00 H new ATOM 2275 N LYS A 156 -10.284 10.478 3.988 1.00 0.00 N ATOM 2276 CA LYS A 156 -9.099 11.318 4.134 1.00 0.00 C ATOM 2277 C LYS A 156 -9.007 12.323 3.004 1.00 0.00 C ATOM 2278 O LYS A 156 -9.549 12.116 1.922 1.00 0.00 O ATOM 2279 CB LYS A 156 -7.839 10.458 4.202 1.00 0.00 C ATOM 2280 CG LYS A 156 -6.994 10.749 5.440 1.00 0.00 C ATOM 2281 CD LYS A 156 -5.942 11.838 5.231 1.00 0.00 C ATOM 2282 CE LYS A 156 -5.634 12.097 3.768 1.00 0.00 C ATOM 2283 NZ LYS A 156 -4.972 10.930 3.122 1.00 0.00 N ATOM 0 H LYS A 156 -10.597 10.359 3.024 1.00 0.00 H new ATOM 0 HA LYS A 156 -9.185 11.872 5.069 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -8.122 9.405 4.199 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -7.238 10.629 3.309 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -7.653 11.046 6.256 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -6.495 9.831 5.751 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -6.289 12.763 5.692 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -5.024 11.551 5.744 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -6.558 12.328 3.238 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -4.990 12.972 3.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -3.949 11.105 3.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -5.140 10.076 3.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -5.364 10.792 2.169 1.00 0.00 H new ATOM 2297 N THR A 157 -8.331 13.424 3.280 1.00 0.00 N ATOM 2298 CA THR A 157 -8.179 14.491 2.299 1.00 0.00 C ATOM 2299 C THR A 157 -6.713 14.863 2.096 1.00 0.00 C ATOM 2300 O THR A 157 -5.923 14.862 3.040 1.00 0.00 O ATOM 2301 CB THR A 157 -8.975 15.715 2.745 1.00 0.00 C ATOM 2302 OG1 THR A 157 -8.858 15.900 4.146 1.00 0.00 O ATOM 2303 CG2 THR A 157 -10.447 15.619 2.421 1.00 0.00 C ATOM 0 H THR A 157 -7.877 13.605 4.175 1.00 0.00 H new ATOM 0 HA THR A 157 -8.563 14.132 1.344 1.00 0.00 H new ATOM 0 HB THR A 157 -8.551 16.555 2.195 1.00 0.00 H new ATOM 0 HG1 THR A 157 -9.372 16.689 4.416 1.00 0.00 H new ATOM 0 HG21 THR A 157 -10.955 16.520 2.764 1.00 0.00 H new ATOM 0 HG22 THR A 157 -10.577 15.518 1.343 1.00 0.00 H new ATOM 0 HG23 THR A 157 -10.874 14.750 2.921 1.00 0.00 H new ATOM 2311 N VAL A 158 -6.364 15.186 0.856 1.00 0.00 N ATOM 2312 CA VAL A 158 -4.998 15.569 0.514 1.00 0.00 C ATOM 2313 C VAL A 158 -4.989 16.803 -0.379 1.00 0.00 C ATOM 2314 O VAL A 158 -5.693 16.857 -1.386 1.00 0.00 O ATOM 2315 CB VAL A 158 -4.244 14.431 -0.207 1.00 0.00 C ATOM 2316 CG1 VAL A 158 -3.458 13.597 0.789 1.00 0.00 C ATOM 2317 CG2 VAL A 158 -5.202 13.560 -1.007 1.00 0.00 C ATOM 0 H VAL A 158 -7.011 15.190 0.067 1.00 0.00 H new ATOM 0 HA VAL A 158 -4.491 15.786 1.454 1.00 0.00 H new ATOM 0 HB VAL A 158 -3.541 14.882 -0.907 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -2.933 12.800 0.262 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -2.734 14.230 1.303 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -4.141 13.161 1.518 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -4.644 12.767 -1.504 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -5.939 13.119 -0.336 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -5.710 14.169 -1.754 1.00 0.00 H new ATOM 2327 N ASN A 159 -4.185 17.795 -0.008 1.00 0.00 N ATOM 2328 CA ASN A 159 -4.091 19.022 -0.790 1.00 0.00 C ATOM 2329 C ASN A 159 -2.828 19.039 -1.623 1.00 0.00 C ATOM 2330 O ASN A 159 -1.733 19.259 -1.107 1.00 0.00 O ATOM 2331 CB ASN A 159 -4.101 20.270 0.105 1.00 0.00 C ATOM 2332 CG ASN A 159 -4.637 19.995 1.499 1.00 0.00 C ATOM 2333 OD1 ASN A 159 -5.558 19.201 1.677 1.00 0.00 O ATOM 2334 ND2 ASN A 159 -4.061 20.658 2.495 1.00 0.00 N ATOM 0 H ASN A 159 -3.594 17.774 0.823 1.00 0.00 H new ATOM 0 HA ASN A 159 -4.965 19.042 -1.441 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -3.087 20.663 0.182 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -4.708 21.043 -0.366 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -4.381 20.517 3.453 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -3.299 21.308 2.302 1.00 0.00 H new ATOM 2341 N ILE A 160 -2.987 18.834 -2.915 1.00 0.00 N ATOM 2342 CA ILE A 160 -1.854 18.859 -3.810 1.00 0.00 C ATOM 2343 C ILE A 160 -1.497 20.290 -4.129 1.00 0.00 C ATOM 2344 O ILE A 160 -2.283 21.033 -4.714 1.00 0.00 O ATOM 2345 CB ILE A 160 -2.130 18.099 -5.105 1.00 0.00 C ATOM 2346 CG1 ILE A 160 -2.773 16.749 -4.792 1.00 0.00 C ATOM 2347 CG2 ILE A 160 -0.845 17.925 -5.898 1.00 0.00 C ATOM 2348 CD1 ILE A 160 -3.164 15.963 -6.024 1.00 0.00 C ATOM 0 H ILE A 160 -3.884 18.650 -3.364 1.00 0.00 H new ATOM 0 HA ILE A 160 -1.022 18.365 -3.308 1.00 0.00 H new ATOM 0 HB ILE A 160 -2.826 18.674 -5.716 1.00 0.00 H new ATOM 0 HG12 ILE A 160 -2.079 16.155 -4.198 1.00 0.00 H new ATOM 0 HG13 ILE A 160 -3.659 16.912 -4.179 1.00 0.00 H new ATOM 0 HG21 ILE A 160 -1.056 17.381 -6.819 1.00 0.00 H new ATOM 0 HG22 ILE A 160 -0.432 18.904 -6.141 1.00 0.00 H new ATOM 0 HG23 ILE A 160 -0.124 17.364 -5.303 1.00 0.00 H new ATOM 0 HD11 ILE A 160 -3.614 15.017 -5.724 1.00 0.00 H new ATOM 0 HD12 ILE A 160 -3.883 16.537 -6.609 1.00 0.00 H new ATOM 0 HD13 ILE A 160 -2.278 15.768 -6.628 1.00 0.00 H new ATOM 2360 N ILE A 161 -0.318 20.674 -3.699 1.00 0.00 N ATOM 2361 CA ILE A 161 0.160 22.024 -3.887 1.00 0.00 C ATOM 2362 C ILE A 161 1.065 22.120 -5.105 1.00 0.00 C ATOM 2363 O ILE A 161 2.007 21.345 -5.255 1.00 0.00 O ATOM 2364 CB ILE A 161 0.916 22.515 -2.635 1.00 0.00 C ATOM 2365 CG1 ILE A 161 0.609 21.625 -1.417 1.00 0.00 C ATOM 2366 CG2 ILE A 161 0.555 23.963 -2.343 1.00 0.00 C ATOM 2367 CD1 ILE A 161 1.850 21.095 -0.737 1.00 0.00 C ATOM 0 H ILE A 161 0.335 20.062 -3.210 1.00 0.00 H new ATOM 0 HA ILE A 161 -0.709 22.661 -4.049 1.00 0.00 H new ATOM 0 HB ILE A 161 1.986 22.451 -2.833 1.00 0.00 H new ATOM 0 HG12 ILE A 161 0.024 22.196 -0.696 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -0.009 20.786 -1.735 1.00 0.00 H new ATOM 0 HG21 ILE A 161 1.093 24.301 -1.458 1.00 0.00 H new ATOM 0 HG22 ILE A 161 0.830 24.585 -3.194 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -0.518 24.042 -2.167 1.00 0.00 H new ATOM 0 HD11 ILE A 161 1.563 20.476 0.113 1.00 0.00 H new ATOM 0 HD12 ILE A 161 2.425 20.497 -1.444 1.00 0.00 H new ATOM 0 HD13 ILE A 161 2.459 21.930 -0.389 1.00 0.00 H new ATOM 2379 N GLU A 162 0.767 23.073 -5.979 1.00 0.00 N ATOM 2380 CA GLU A 162 1.554 23.263 -7.191 1.00 0.00 C ATOM 2381 C GLU A 162 3.022 23.504 -6.860 1.00 0.00 C ATOM 2382 O GLU A 162 3.351 24.118 -5.846 1.00 0.00 O ATOM 2383 CB GLU A 162 1.004 24.430 -8.011 1.00 0.00 C ATOM 2384 CG GLU A 162 0.264 23.991 -9.263 1.00 0.00 C ATOM 2385 CD GLU A 162 0.033 25.134 -10.235 1.00 0.00 C ATOM 2386 OE1 GLU A 162 -0.494 26.180 -9.805 1.00 0.00 O ATOM 2387 OE2 GLU A 162 0.382 24.980 -11.424 1.00 0.00 O ATOM 0 H GLU A 162 -0.011 23.724 -5.872 1.00 0.00 H new ATOM 0 HA GLU A 162 1.481 22.350 -7.782 1.00 0.00 H new ATOM 0 HB2 GLU A 162 0.331 25.018 -7.387 1.00 0.00 H new ATOM 0 HB3 GLU A 162 1.828 25.085 -8.295 1.00 0.00 H new ATOM 0 HG2 GLU A 162 0.833 23.205 -9.760 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -0.696 23.559 -8.981 1.00 0.00 H new ATOM 2394 N GLY A 163 3.899 23.014 -7.728 1.00 0.00 N ATOM 2395 CA GLY A 163 5.324 23.181 -7.518 1.00 0.00 C ATOM 2396 C GLY A 163 5.918 24.262 -8.399 1.00 0.00 C ATOM 2397 O GLY A 163 5.536 25.430 -8.303 1.00 0.00 O ATOM 0 H GLY A 163 3.648 22.503 -8.575 1.00 0.00 H new ATOM 0 HA2 GLY A 163 5.507 23.428 -6.472 1.00 0.00 H new ATOM 0 HA3 GLY A 163 5.830 22.236 -7.716 1.00 0.00 H new