USER MOD reduce.3.24.130724 H: found=0, std=0, add=974, rem=0, adj=30 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 69 THR OG1 : rot 69:sc= 1.13 USER MOD Set 1.2: A 137 THR OG1 : rot 180:sc= -0.55 USER MOD Set 1.3: A 138 ASN :FLIP amide:sc= -2.36 F(o=-8.1!,f=-1.8) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot -148:sc= 1.01 USER MOD Single : A 36 SER OG : rot 146:sc= -0.498! USER MOD Single : A 44 GLN : amide:sc= 1.15 K(o=1.1,f=-0.22) USER MOD Single : A 48 ASN : amide:sc= -1.31 K(o=-1.3,f=-3!) USER MOD Single : A 60 ASN :FLIP amide:sc= -2.12! C(o=-2.7!,f=-2.1!) USER MOD Single : A 66 TYR OH : rot 126:sc= -0.592 USER MOD Single : A 71 ASN :FLIP amide:sc= 0 F(o=-0.71,f=0) USER MOD Single : A 72 TYR OH : rot 130:sc= -1.27 USER MOD Single : A 75 ASN : amide:sc= 0 K(o=0,f=-3!) USER MOD Single : A 79 TYR OH : rot 180:sc= -5.12! USER MOD Single : A 84 SER OG : rot 13:sc= -8.11! USER MOD Single : A 91 ASN :FLIP amide:sc= -0.128 F(o=-0.85,f=-0.13) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 164:sc= -1.92 (180deg=-2.22!) USER MOD Single : A 99 LYS NZ :NH3+ 142:sc= -0.888 (180deg=-3.09!) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 152:sc= 1.19 (180deg=1.04) USER MOD Single : A 120 LYS NZ :NH3+ -171:sc= -1.52! (180deg=-1.98!) USER MOD Single : A 128 LYS NZ :NH3+ 164:sc= 0.674 (180deg=-0.402) USER MOD Single : A 132 SER OG : rot -66:sc= 1.12 USER MOD Single : A 133 ASN : amide:sc= -3.01! C(o=-3!,f=-7.5!) USER MOD Single : A 135 SER OG : rot 180:sc= -0.619 USER MOD Single : A 139 SER OG : rot 117:sc= 1.23 USER MOD Single : A 140 SER OG : rot 45:sc= 0.166 USER MOD Single : A 149 HIS : no HE2:sc= -2.43 K(o=-2.4,f=-3.3!) USER MOD Single : A 154 THR OG1 : rot -14:sc= 0.576 USER MOD Single : A 156 LYS NZ :NH3+ 150:sc= -1.44 (180deg=-2.96!) USER MOD Single : A 157 THR OG1 : rot 44:sc= 0.00113 USER MOD Single : A 159 ASN :FLIP amide:sc= -0.536 F(o=-2,f=-0.54) USER MOD ----------------------------------------------------------------- ATOM 431 N GLU A 30 -18.346 -9.997 18.942 1.00 0.00 N ATOM 432 CA GLU A 30 -18.661 -9.009 17.917 1.00 0.00 C ATOM 433 C GLU A 30 -17.640 -7.876 17.919 1.00 0.00 C ATOM 434 O GLU A 30 -17.696 -6.977 18.758 1.00 0.00 O ATOM 435 CB GLU A 30 -20.066 -8.445 18.137 1.00 0.00 C ATOM 436 CG GLU A 30 -20.234 -7.734 19.470 1.00 0.00 C ATOM 437 CD GLU A 30 -21.550 -8.066 20.147 1.00 0.00 C ATOM 438 OE1 GLU A 30 -21.938 -9.253 20.139 1.00 0.00 O ATOM 439 OE2 GLU A 30 -22.192 -7.139 20.685 1.00 0.00 O ATOM 0 HA GLU A 30 -18.623 -9.505 16.947 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -20.299 -7.749 17.331 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -20.789 -9.258 18.075 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -19.411 -8.008 20.130 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -20.172 -6.657 19.313 1.00 0.00 H new ATOM 446 N VAL A 31 -16.707 -7.925 16.972 1.00 0.00 N ATOM 447 CA VAL A 31 -15.672 -6.904 16.864 1.00 0.00 C ATOM 448 C VAL A 31 -16.288 -5.529 16.621 1.00 0.00 C ATOM 449 O VAL A 31 -17.394 -5.419 16.091 1.00 0.00 O ATOM 450 CB VAL A 31 -14.666 -7.248 15.737 1.00 0.00 C ATOM 451 CG1 VAL A 31 -13.838 -6.036 15.338 1.00 0.00 C ATOM 452 CG2 VAL A 31 -13.748 -8.381 16.165 1.00 0.00 C ATOM 0 H VAL A 31 -16.647 -8.661 16.269 1.00 0.00 H new ATOM 0 HA VAL A 31 -15.131 -6.879 17.810 1.00 0.00 H new ATOM 0 HB VAL A 31 -15.245 -7.565 14.870 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -13.144 -6.315 14.545 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -14.498 -5.246 14.981 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -13.278 -5.678 16.202 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -13.049 -8.607 15.360 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -13.193 -8.083 17.054 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -14.343 -9.267 16.389 1.00 0.00 H new ATOM 462 N THR A 32 -15.559 -4.483 17.000 1.00 0.00 N ATOM 463 CA THR A 32 -16.029 -3.121 16.810 1.00 0.00 C ATOM 464 C THR A 32 -15.754 -2.693 15.379 1.00 0.00 C ATOM 465 O THR A 32 -16.619 -2.145 14.696 1.00 0.00 O ATOM 466 CB THR A 32 -15.341 -2.175 17.801 1.00 0.00 C ATOM 467 OG1 THR A 32 -15.996 -0.919 17.835 1.00 0.00 O ATOM 468 CG2 THR A 32 -13.882 -1.923 17.489 1.00 0.00 C ATOM 0 H THR A 32 -14.642 -4.556 17.440 1.00 0.00 H new ATOM 0 HA THR A 32 -17.102 -3.078 16.996 1.00 0.00 H new ATOM 0 HB THR A 32 -15.403 -2.682 18.764 1.00 0.00 H new ATOM 0 HG1 THR A 32 -15.543 -0.331 18.474 1.00 0.00 H new ATOM 0 HG21 THR A 32 -13.463 -1.245 18.232 1.00 0.00 H new ATOM 0 HG22 THR A 32 -13.337 -2.867 17.510 1.00 0.00 H new ATOM 0 HG23 THR A 32 -13.794 -1.475 16.499 1.00 0.00 H new ATOM 476 N GLY A 33 -14.541 -2.979 14.930 1.00 0.00 N ATOM 477 CA GLY A 33 -14.146 -2.662 13.586 1.00 0.00 C ATOM 478 C GLY A 33 -13.886 -1.194 13.372 1.00 0.00 C ATOM 479 O GLY A 33 -14.791 -0.373 13.504 1.00 0.00 O ATOM 0 H GLY A 33 -13.817 -3.432 15.488 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -13.245 -3.223 13.337 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -14.926 -2.990 12.899 1.00 0.00 H new ATOM 483 N SER A 34 -12.647 -0.868 13.029 1.00 0.00 N ATOM 484 CA SER A 34 -12.269 0.515 12.766 1.00 0.00 C ATOM 485 C SER A 34 -10.949 0.598 12.016 1.00 0.00 C ATOM 486 O SER A 34 -9.996 -0.118 12.322 1.00 0.00 O ATOM 487 CB SER A 34 -12.197 1.318 14.064 1.00 0.00 C ATOM 488 OG SER A 34 -12.195 2.712 13.803 1.00 0.00 O ATOM 0 H SER A 34 -11.887 -1.541 12.926 1.00 0.00 H new ATOM 0 HA SER A 34 -13.043 0.950 12.133 1.00 0.00 H new ATOM 0 HB2 SER A 34 -13.046 1.065 14.699 1.00 0.00 H new ATOM 0 HB3 SER A 34 -11.296 1.047 14.614 1.00 0.00 H new ATOM 0 HG SER A 34 -11.661 3.172 14.484 1.00 0.00 H new ATOM 494 N VAL A 35 -10.913 1.477 11.019 1.00 0.00 N ATOM 495 CA VAL A 35 -9.728 1.662 10.202 1.00 0.00 C ATOM 496 C VAL A 35 -8.830 2.750 10.758 1.00 0.00 C ATOM 497 O VAL A 35 -9.290 3.829 11.135 1.00 0.00 O ATOM 498 CB VAL A 35 -10.090 2.032 8.752 1.00 0.00 C ATOM 499 CG1 VAL A 35 -10.897 0.925 8.109 1.00 0.00 C ATOM 500 CG2 VAL A 35 -10.853 3.349 8.709 1.00 0.00 C ATOM 0 H VAL A 35 -11.699 2.074 10.760 1.00 0.00 H new ATOM 0 HA VAL A 35 -9.200 0.708 10.216 1.00 0.00 H new ATOM 0 HB VAL A 35 -9.166 2.156 8.187 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -11.144 1.203 7.084 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -10.313 0.005 8.104 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -11.816 0.769 8.674 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -11.100 3.593 7.676 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -11.771 3.257 9.289 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -10.235 4.141 9.131 1.00 0.00 H new ATOM 510 N SER A 36 -7.542 2.466 10.770 1.00 0.00 N ATOM 511 CA SER A 36 -6.552 3.427 11.242 1.00 0.00 C ATOM 512 C SER A 36 -6.059 4.251 10.065 1.00 0.00 C ATOM 513 O SER A 36 -5.317 3.757 9.221 1.00 0.00 O ATOM 514 CB SER A 36 -5.372 2.712 11.905 1.00 0.00 C ATOM 515 OG SER A 36 -5.442 2.809 13.316 1.00 0.00 O ATOM 0 H SER A 36 -7.152 1.577 10.458 1.00 0.00 H new ATOM 0 HA SER A 36 -7.016 4.077 11.983 1.00 0.00 H new ATOM 0 HB2 SER A 36 -5.367 1.663 11.610 1.00 0.00 H new ATOM 0 HB3 SER A 36 -4.436 3.147 11.554 1.00 0.00 H new ATOM 0 HG SER A 36 -5.092 1.987 13.718 1.00 0.00 H new ATOM 521 N LEU A 37 -6.494 5.502 9.999 1.00 0.00 N ATOM 522 CA LEU A 37 -6.110 6.377 8.901 1.00 0.00 C ATOM 523 C LEU A 37 -5.208 7.516 9.372 1.00 0.00 C ATOM 524 O LEU A 37 -5.615 8.361 10.168 1.00 0.00 O ATOM 525 CB LEU A 37 -7.366 6.940 8.226 1.00 0.00 C ATOM 526 CG LEU A 37 -7.119 7.742 6.948 1.00 0.00 C ATOM 527 CD1 LEU A 37 -6.022 7.103 6.109 1.00 0.00 C ATOM 528 CD2 LEU A 37 -8.399 7.873 6.130 1.00 0.00 C ATOM 0 H LEU A 37 -7.110 5.932 10.689 1.00 0.00 H new ATOM 0 HA LEU A 37 -5.542 5.786 8.183 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -8.034 6.112 7.992 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -7.887 7.578 8.940 1.00 0.00 H new ATOM 0 HG LEU A 37 -6.793 8.740 7.241 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -5.865 7.692 5.205 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -5.097 7.068 6.685 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -6.317 6.090 5.835 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.196 8.448 5.226 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -8.759 6.881 5.856 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.158 8.384 6.722 1.00 0.00 H new ATOM 540 N GLU A 38 -3.981 7.527 8.860 1.00 0.00 N ATOM 541 CA GLU A 38 -3.007 8.556 9.208 1.00 0.00 C ATOM 542 C GLU A 38 -2.209 8.968 7.974 1.00 0.00 C ATOM 543 O GLU A 38 -1.380 8.203 7.478 1.00 0.00 O ATOM 544 CB GLU A 38 -2.064 8.048 10.300 1.00 0.00 C ATOM 545 CG GLU A 38 -0.971 9.037 10.672 1.00 0.00 C ATOM 546 CD GLU A 38 -1.521 10.312 11.283 1.00 0.00 C ATOM 547 OE1 GLU A 38 -1.959 11.194 10.518 1.00 0.00 O ATOM 548 OE2 GLU A 38 -1.513 10.424 12.526 1.00 0.00 O ATOM 0 H GLU A 38 -3.636 6.831 8.199 1.00 0.00 H new ATOM 0 HA GLU A 38 -3.542 9.427 9.586 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -2.647 7.812 11.190 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.603 7.119 9.966 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -0.285 8.567 11.377 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.392 9.285 9.782 1.00 0.00 H new ATOM 555 N ALA A 39 -2.467 10.174 7.476 1.00 0.00 N ATOM 556 CA ALA A 39 -1.772 10.671 6.293 1.00 0.00 C ATOM 557 C ALA A 39 -1.388 12.139 6.444 1.00 0.00 C ATOM 558 O ALA A 39 -1.938 12.853 7.283 1.00 0.00 O ATOM 559 CB ALA A 39 -2.646 10.486 5.062 1.00 0.00 C ATOM 0 H ALA A 39 -3.149 10.822 7.871 1.00 0.00 H new ATOM 0 HA ALA A 39 -0.853 10.096 6.178 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -2.120 10.859 4.183 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -2.868 9.427 4.929 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -3.577 11.039 5.190 1.00 0.00 H new ATOM 565 N LEU A 40 -0.447 12.584 5.614 1.00 0.00 N ATOM 566 CA LEU A 40 0.004 13.969 5.643 1.00 0.00 C ATOM 567 C LEU A 40 -1.108 14.899 5.173 1.00 0.00 C ATOM 568 O LEU A 40 -1.203 16.046 5.609 1.00 0.00 O ATOM 569 CB LEU A 40 1.242 14.145 4.762 1.00 0.00 C ATOM 570 CG LEU A 40 2.173 15.288 5.173 1.00 0.00 C ATOM 571 CD1 LEU A 40 3.181 14.810 6.205 1.00 0.00 C ATOM 572 CD2 LEU A 40 2.884 15.858 3.955 1.00 0.00 C ATOM 0 H LEU A 40 0.016 12.004 4.914 1.00 0.00 H new ATOM 0 HA LEU A 40 0.265 14.225 6.670 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.809 13.214 4.769 1.00 0.00 H new ATOM 0 HB3 LEU A 40 0.917 14.313 3.735 1.00 0.00 H new ATOM 0 HG LEU A 40 1.572 16.078 5.622 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.834 15.636 6.485 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.654 14.448 7.088 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.779 14.002 5.783 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.542 16.670 4.265 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.473 15.075 3.478 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.147 16.238 3.248 1.00 0.00 H new ATOM 584 N GLU A 41 -1.955 14.386 4.282 1.00 0.00 N ATOM 585 CA GLU A 41 -3.078 15.153 3.750 1.00 0.00 C ATOM 586 C GLU A 41 -2.608 16.285 2.841 1.00 0.00 C ATOM 587 O GLU A 41 -3.314 17.280 2.670 1.00 0.00 O ATOM 588 CB GLU A 41 -3.926 15.720 4.893 1.00 0.00 C ATOM 589 CG GLU A 41 -4.342 14.678 5.916 1.00 0.00 C ATOM 590 CD GLU A 41 -4.863 15.295 7.199 1.00 0.00 C ATOM 591 OE1 GLU A 41 -4.093 16.021 7.863 1.00 0.00 O ATOM 592 OE2 GLU A 41 -6.040 15.055 7.539 1.00 0.00 O ATOM 0 H GLU A 41 -1.883 13.438 3.913 1.00 0.00 H new ATOM 0 HA GLU A 41 -3.685 14.473 3.153 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -3.363 16.507 5.396 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -4.820 16.184 4.476 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -5.113 14.039 5.485 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -3.489 14.039 6.145 1.00 0.00 H new ATOM 599 N GLU A 42 -1.424 16.136 2.256 1.00 0.00 N ATOM 600 CA GLU A 42 -0.894 17.166 1.367 1.00 0.00 C ATOM 601 C GLU A 42 0.271 16.650 0.523 1.00 0.00 C ATOM 602 O GLU A 42 1.259 16.142 1.055 1.00 0.00 O ATOM 603 CB GLU A 42 -0.448 18.384 2.177 1.00 0.00 C ATOM 604 CG GLU A 42 -0.211 19.624 1.332 1.00 0.00 C ATOM 605 CD GLU A 42 0.050 20.860 2.172 1.00 0.00 C ATOM 606 OE1 GLU A 42 -0.920 21.410 2.735 1.00 0.00 O ATOM 607 OE2 GLU A 42 1.223 21.278 2.263 1.00 0.00 O ATOM 0 H GLU A 42 -0.819 15.324 2.378 1.00 0.00 H new ATOM 0 HA GLU A 42 -1.696 17.452 0.687 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -1.205 18.607 2.929 1.00 0.00 H new ATOM 0 HB3 GLU A 42 0.470 18.138 2.711 1.00 0.00 H new ATOM 0 HG2 GLU A 42 0.639 19.452 0.671 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -1.079 19.798 0.696 1.00 0.00 H new ATOM 614 N VAL A 43 0.153 16.802 -0.794 1.00 0.00 N ATOM 615 CA VAL A 43 1.196 16.377 -1.717 1.00 0.00 C ATOM 616 C VAL A 43 1.235 17.299 -2.936 1.00 0.00 C ATOM 617 O VAL A 43 0.350 17.252 -3.784 1.00 0.00 O ATOM 618 CB VAL A 43 0.978 14.919 -2.177 1.00 0.00 C ATOM 619 CG1 VAL A 43 -0.456 14.713 -2.649 1.00 0.00 C ATOM 620 CG2 VAL A 43 1.972 14.530 -3.266 1.00 0.00 C ATOM 0 H VAL A 43 -0.661 17.219 -1.246 1.00 0.00 H new ATOM 0 HA VAL A 43 2.148 16.433 -1.189 1.00 0.00 H new ATOM 0 HB VAL A 43 1.153 14.266 -1.322 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -0.589 13.679 -2.969 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.143 14.931 -1.831 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.663 15.381 -3.485 1.00 0.00 H new ATOM 0 HG21 VAL A 43 1.794 13.498 -3.570 1.00 0.00 H new ATOM 0 HG22 VAL A 43 1.846 15.188 -4.126 1.00 0.00 H new ATOM 0 HG23 VAL A 43 2.988 14.625 -2.882 1.00 0.00 H new ATOM 630 N GLN A 44 2.265 18.135 -3.009 1.00 0.00 N ATOM 631 CA GLN A 44 2.421 19.076 -4.116 1.00 0.00 C ATOM 632 C GLN A 44 2.714 18.341 -5.429 1.00 0.00 C ATOM 633 O GLN A 44 3.648 17.540 -5.493 1.00 0.00 O ATOM 634 CB GLN A 44 3.556 20.058 -3.798 1.00 0.00 C ATOM 635 CG GLN A 44 3.998 20.913 -4.979 1.00 0.00 C ATOM 636 CD GLN A 44 5.473 20.768 -5.285 1.00 0.00 C ATOM 637 OE1 GLN A 44 6.324 21.292 -4.566 1.00 0.00 O ATOM 638 NE2 GLN A 44 5.785 20.052 -6.359 1.00 0.00 N ATOM 0 H GLN A 44 3.008 18.181 -2.312 1.00 0.00 H new ATOM 0 HA GLN A 44 1.487 19.624 -4.239 1.00 0.00 H new ATOM 0 HB2 GLN A 44 3.236 20.715 -2.989 1.00 0.00 H new ATOM 0 HB3 GLN A 44 4.414 19.496 -3.431 1.00 0.00 H new ATOM 0 HG2 GLN A 44 3.419 20.635 -5.860 1.00 0.00 H new ATOM 0 HG3 GLN A 44 3.776 21.959 -4.768 1.00 0.00 H new ATOM 0 HE21 GLN A 44 5.047 19.636 -6.926 1.00 0.00 H new ATOM 0 HE22 GLN A 44 6.763 19.918 -6.616 1.00 0.00 H new ATOM 647 N VAL A 45 1.915 18.613 -6.473 1.00 0.00 N ATOM 648 CA VAL A 45 2.085 17.985 -7.775 1.00 0.00 C ATOM 649 C VAL A 45 3.529 17.610 -8.065 1.00 0.00 C ATOM 650 O VAL A 45 4.436 18.434 -7.970 1.00 0.00 O ATOM 651 CB VAL A 45 1.545 18.902 -8.897 1.00 0.00 C ATOM 652 CG1 VAL A 45 2.376 18.792 -10.172 1.00 0.00 C ATOM 653 CG2 VAL A 45 0.101 18.552 -9.170 1.00 0.00 C ATOM 0 H VAL A 45 1.139 19.273 -6.430 1.00 0.00 H new ATOM 0 HA VAL A 45 1.509 17.060 -7.749 1.00 0.00 H new ATOM 0 HB VAL A 45 1.617 19.937 -8.562 1.00 0.00 H new ATOM 0 HG11 VAL A 45 1.962 19.452 -10.934 1.00 0.00 H new ATOM 0 HG12 VAL A 45 3.406 19.081 -9.961 1.00 0.00 H new ATOM 0 HG13 VAL A 45 2.355 17.764 -10.533 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -0.286 19.195 -9.960 1.00 0.00 H new ATOM 0 HG22 VAL A 45 0.032 17.510 -9.483 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -0.486 18.698 -8.263 1.00 0.00 H new ATOM 663 N GLY A 46 3.716 16.354 -8.434 1.00 0.00 N ATOM 664 CA GLY A 46 5.030 15.865 -8.753 1.00 0.00 C ATOM 665 C GLY A 46 5.521 14.823 -7.765 1.00 0.00 C ATOM 666 O GLY A 46 6.376 14.000 -8.094 1.00 0.00 O ATOM 0 H GLY A 46 2.971 15.662 -8.517 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.020 15.435 -9.754 1.00 0.00 H new ATOM 0 HA3 GLY A 46 5.730 16.700 -8.772 1.00 0.00 H new ATOM 670 N GLU A 47 4.975 14.854 -6.553 1.00 0.00 N ATOM 671 CA GLU A 47 5.359 13.903 -5.514 1.00 0.00 C ATOM 672 C GLU A 47 4.230 12.912 -5.247 1.00 0.00 C ATOM 673 O GLU A 47 3.204 12.929 -5.925 1.00 0.00 O ATOM 674 CB GLU A 47 5.724 14.631 -4.213 1.00 0.00 C ATOM 675 CG GLU A 47 6.145 16.081 -4.408 1.00 0.00 C ATOM 676 CD GLU A 47 7.257 16.496 -3.465 1.00 0.00 C ATOM 677 OE1 GLU A 47 6.951 16.866 -2.313 1.00 0.00 O ATOM 678 OE2 GLU A 47 8.434 16.450 -3.881 1.00 0.00 O ATOM 0 H GLU A 47 4.265 15.528 -6.266 1.00 0.00 H new ATOM 0 HA GLU A 47 6.234 13.359 -5.869 1.00 0.00 H new ATOM 0 HB2 GLU A 47 4.867 14.600 -3.540 1.00 0.00 H new ATOM 0 HB3 GLU A 47 6.534 14.092 -3.723 1.00 0.00 H new ATOM 0 HG2 GLU A 47 6.474 16.225 -5.437 1.00 0.00 H new ATOM 0 HG3 GLU A 47 5.283 16.730 -4.255 1.00 0.00 H new ATOM 685 N ASN A 48 4.428 12.051 -4.256 1.00 0.00 N ATOM 686 CA ASN A 48 3.428 11.053 -3.901 1.00 0.00 C ATOM 687 C ASN A 48 3.163 11.056 -2.399 1.00 0.00 C ATOM 688 O ASN A 48 4.055 11.345 -1.601 1.00 0.00 O ATOM 689 CB ASN A 48 3.888 9.666 -4.348 1.00 0.00 C ATOM 690 CG ASN A 48 5.176 9.239 -3.672 1.00 0.00 C ATOM 691 OD1 ASN A 48 5.699 9.939 -2.807 1.00 0.00 O ATOM 692 ND2 ASN A 48 5.694 8.082 -4.068 1.00 0.00 N ATOM 0 H ASN A 48 5.272 12.024 -3.684 1.00 0.00 H new ATOM 0 HA ASN A 48 2.499 11.305 -4.413 1.00 0.00 H new ATOM 0 HB2 ASN A 48 3.107 8.939 -4.128 1.00 0.00 H new ATOM 0 HB3 ASN A 48 4.030 9.664 -5.429 1.00 0.00 H new ATOM 0 HD21 ASN A 48 6.560 7.742 -3.651 1.00 0.00 H new ATOM 0 HD22 ASN A 48 5.226 7.534 -4.789 1.00 0.00 H new ATOM 699 N LEU A 49 1.931 10.731 -2.020 1.00 0.00 N ATOM 700 CA LEU A 49 1.548 10.692 -0.613 1.00 0.00 C ATOM 701 C LEU A 49 1.625 9.268 -0.074 1.00 0.00 C ATOM 702 O LEU A 49 1.607 8.306 -0.841 1.00 0.00 O ATOM 703 CB LEU A 49 0.132 11.244 -0.433 1.00 0.00 C ATOM 704 CG LEU A 49 -0.976 10.394 -1.057 1.00 0.00 C ATOM 705 CD1 LEU A 49 -1.447 9.328 -0.080 1.00 0.00 C ATOM 706 CD2 LEU A 49 -2.140 11.274 -1.490 1.00 0.00 C ATOM 0 H LEU A 49 1.181 10.491 -2.668 1.00 0.00 H new ATOM 0 HA LEU A 49 2.245 11.314 -0.051 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.068 11.349 0.633 1.00 0.00 H new ATOM 0 HB3 LEU A 49 0.090 12.244 -0.866 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.573 9.896 -1.939 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.235 8.734 -0.542 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.611 8.680 0.183 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.833 9.805 0.821 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.920 10.654 -1.932 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -2.541 11.799 -0.623 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -1.793 12.000 -2.225 1.00 0.00 H new ATOM 718 N GLU A 50 1.709 9.138 1.245 1.00 0.00 N ATOM 719 CA GLU A 50 1.786 7.829 1.880 1.00 0.00 C ATOM 720 C GLU A 50 0.736 7.699 2.974 1.00 0.00 C ATOM 721 O GLU A 50 0.965 8.091 4.118 1.00 0.00 O ATOM 722 CB GLU A 50 3.181 7.602 2.464 1.00 0.00 C ATOM 723 CG GLU A 50 4.307 8.009 1.527 1.00 0.00 C ATOM 724 CD GLU A 50 5.497 7.074 1.605 1.00 0.00 C ATOM 725 OE1 GLU A 50 5.295 5.880 1.914 1.00 0.00 O ATOM 726 OE2 GLU A 50 6.632 7.534 1.357 1.00 0.00 O ATOM 0 H GLU A 50 1.725 9.924 1.895 1.00 0.00 H new ATOM 0 HA GLU A 50 1.593 7.071 1.121 1.00 0.00 H new ATOM 0 HB2 GLU A 50 3.272 8.164 3.394 1.00 0.00 H new ATOM 0 HB3 GLU A 50 3.293 6.548 2.716 1.00 0.00 H new ATOM 0 HG2 GLU A 50 3.933 8.030 0.503 1.00 0.00 H new ATOM 0 HG3 GLU A 50 4.629 9.022 1.770 1.00 0.00 H new ATOM 733 N VAL A 51 -0.419 7.149 2.615 1.00 0.00 N ATOM 734 CA VAL A 51 -1.505 6.971 3.568 1.00 0.00 C ATOM 735 C VAL A 51 -1.591 5.523 4.039 1.00 0.00 C ATOM 736 O VAL A 51 -2.165 4.671 3.362 1.00 0.00 O ATOM 737 CB VAL A 51 -2.856 7.393 2.955 1.00 0.00 C ATOM 738 CG1 VAL A 51 -3.171 6.567 1.718 1.00 0.00 C ATOM 739 CG2 VAL A 51 -3.970 7.276 3.984 1.00 0.00 C ATOM 0 H VAL A 51 -0.626 6.820 1.672 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.290 7.609 4.425 1.00 0.00 H new ATOM 0 HB VAL A 51 -2.782 8.437 2.651 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.128 6.883 1.304 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -2.388 6.713 0.974 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -3.223 5.512 1.988 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -4.915 7.578 3.533 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -4.044 6.243 4.324 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -3.750 7.923 4.833 1.00 0.00 H new ATOM 749 N GLY A 52 -1.016 5.253 5.207 1.00 0.00 N ATOM 750 CA GLY A 52 -1.036 3.912 5.751 1.00 0.00 C ATOM 751 C GLY A 52 -2.311 3.613 6.514 1.00 0.00 C ATOM 752 O GLY A 52 -2.331 3.664 7.744 1.00 0.00 O ATOM 0 H GLY A 52 -0.536 5.942 5.786 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -0.925 3.193 4.940 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.181 3.780 6.413 1.00 0.00 H new ATOM 756 N VAL A 53 -3.378 3.295 5.788 1.00 0.00 N ATOM 757 CA VAL A 53 -4.654 2.985 6.414 1.00 0.00 C ATOM 758 C VAL A 53 -4.652 1.563 6.967 1.00 0.00 C ATOM 759 O VAL A 53 -4.772 0.595 6.217 1.00 0.00 O ATOM 760 CB VAL A 53 -5.829 3.152 5.428 1.00 0.00 C ATOM 761 CG1 VAL A 53 -5.673 2.216 4.240 1.00 0.00 C ATOM 762 CG2 VAL A 53 -7.159 2.920 6.132 1.00 0.00 C ATOM 0 H VAL A 53 -3.383 3.246 4.769 1.00 0.00 H new ATOM 0 HA VAL A 53 -4.789 3.692 7.232 1.00 0.00 H new ATOM 0 HB VAL A 53 -5.818 4.176 5.054 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -6.512 2.351 3.558 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -4.742 2.441 3.719 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -5.652 1.184 4.590 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -7.974 3.043 5.419 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -7.183 1.910 6.541 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -7.273 3.641 6.941 1.00 0.00 H new ATOM 772 N GLY A 54 -4.499 1.445 8.282 1.00 0.00 N ATOM 773 CA GLY A 54 -4.467 0.137 8.909 1.00 0.00 C ATOM 774 C GLY A 54 -5.674 -0.132 9.785 1.00 0.00 C ATOM 775 O GLY A 54 -6.815 0.050 9.357 1.00 0.00 O ATOM 0 H GLY A 54 -4.397 2.231 8.924 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -4.409 -0.629 8.135 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -3.562 0.051 9.511 1.00 0.00 H new ATOM 779 N ILE A 55 -5.421 -0.577 11.011 1.00 0.00 N ATOM 780 CA ILE A 55 -6.497 -0.885 11.954 1.00 0.00 C ATOM 781 C ILE A 55 -6.558 0.133 13.090 1.00 0.00 C ATOM 782 O ILE A 55 -5.564 0.376 13.775 1.00 0.00 O ATOM 783 CB ILE A 55 -6.333 -2.311 12.547 1.00 0.00 C ATOM 784 CG1 ILE A 55 -7.393 -3.254 11.976 1.00 0.00 C ATOM 785 CG2 ILE A 55 -6.411 -2.300 14.071 1.00 0.00 C ATOM 786 CD1 ILE A 55 -6.823 -4.284 11.030 1.00 0.00 C ATOM 0 H ILE A 55 -4.482 -0.733 11.378 1.00 0.00 H new ATOM 0 HA ILE A 55 -7.430 -0.837 11.393 1.00 0.00 H new ATOM 0 HB ILE A 55 -5.344 -2.670 12.264 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -7.897 -3.763 12.797 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -8.148 -2.668 11.453 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -6.292 -3.316 14.449 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -5.618 -1.669 14.471 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -7.379 -1.908 14.383 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -7.626 -4.922 10.660 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -6.343 -3.781 10.191 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -6.088 -4.894 11.556 1.00 0.00 H new ATOM 798 N ASP A 56 -7.742 0.696 13.302 1.00 0.00 N ATOM 799 CA ASP A 56 -7.949 1.656 14.376 1.00 0.00 C ATOM 800 C ASP A 56 -8.532 0.938 15.586 1.00 0.00 C ATOM 801 O ASP A 56 -8.188 1.237 16.727 1.00 0.00 O ATOM 802 CB ASP A 56 -8.881 2.783 13.927 1.00 0.00 C ATOM 803 CG ASP A 56 -9.164 3.780 15.034 1.00 0.00 C ATOM 804 OD1 ASP A 56 -8.318 3.916 15.943 1.00 0.00 O ATOM 805 OD2 ASP A 56 -10.233 4.426 14.993 1.00 0.00 O ATOM 0 H ASP A 56 -8.573 0.503 12.743 1.00 0.00 H new ATOM 0 HA ASP A 56 -6.990 2.101 14.643 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -8.434 3.303 13.080 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -9.821 2.355 13.579 1.00 0.00 H new ATOM 810 N GLU A 57 -9.403 -0.029 15.312 1.00 0.00 N ATOM 811 CA GLU A 57 -10.032 -0.820 16.360 1.00 0.00 C ATOM 812 C GLU A 57 -10.622 -2.109 15.798 1.00 0.00 C ATOM 813 O GLU A 57 -11.348 -2.100 14.807 1.00 0.00 O ATOM 814 CB GLU A 57 -11.127 -0.031 17.075 1.00 0.00 C ATOM 815 CG GLU A 57 -10.605 1.057 18.001 1.00 0.00 C ATOM 816 CD GLU A 57 -10.565 2.419 17.338 1.00 0.00 C ATOM 817 OE1 GLU A 57 -11.282 2.611 16.332 1.00 0.00 O ATOM 818 OE2 GLU A 57 -9.818 3.294 17.824 1.00 0.00 O ATOM 0 H GLU A 57 -9.689 -0.283 14.367 1.00 0.00 H new ATOM 0 HA GLU A 57 -9.252 -1.069 17.080 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -11.778 0.424 16.329 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -11.739 -0.723 17.654 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -11.237 1.108 18.888 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -9.603 0.792 18.338 1.00 0.00 H new ATOM 825 N LEU A 58 -10.300 -3.208 16.454 1.00 0.00 N ATOM 826 CA LEU A 58 -10.778 -4.530 16.069 1.00 0.00 C ATOM 827 C LEU A 58 -10.686 -5.475 17.261 1.00 0.00 C ATOM 828 O LEU A 58 -9.649 -6.100 17.485 1.00 0.00 O ATOM 829 CB LEU A 58 -9.942 -5.077 14.908 1.00 0.00 C ATOM 830 CG LEU A 58 -10.697 -5.972 13.926 1.00 0.00 C ATOM 831 CD1 LEU A 58 -9.927 -6.096 12.620 1.00 0.00 C ATOM 832 CD2 LEU A 58 -10.938 -7.345 14.534 1.00 0.00 C ATOM 0 H LEU A 58 -9.695 -3.212 17.275 1.00 0.00 H new ATOM 0 HA LEU A 58 -11.817 -4.452 15.748 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -9.520 -4.236 14.358 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -9.105 -5.641 15.319 1.00 0.00 H new ATOM 0 HG LEU A 58 -11.663 -5.514 13.715 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -10.478 -6.737 11.932 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -9.803 -5.108 12.176 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -8.947 -6.532 12.815 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -11.477 -7.969 13.821 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -9.982 -7.810 14.773 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -11.529 -7.241 15.444 1.00 0.00 H new ATOM 844 N VAL A 59 -11.760 -5.562 18.047 1.00 0.00 N ATOM 845 CA VAL A 59 -11.755 -6.418 19.227 1.00 0.00 C ATOM 846 C VAL A 59 -12.804 -7.517 19.165 1.00 0.00 C ATOM 847 O VAL A 59 -13.984 -7.268 19.376 1.00 0.00 O ATOM 848 CB VAL A 59 -11.950 -5.594 20.518 1.00 0.00 C ATOM 849 CG1 VAL A 59 -13.327 -4.949 20.547 1.00 0.00 C ATOM 850 CG2 VAL A 59 -11.731 -6.463 21.747 1.00 0.00 C ATOM 0 H VAL A 59 -12.632 -5.057 17.889 1.00 0.00 H new ATOM 0 HA VAL A 59 -10.775 -6.894 19.244 1.00 0.00 H new ATOM 0 HB VAL A 59 -11.207 -4.797 20.529 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -13.440 -4.374 21.466 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -13.436 -4.286 19.689 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -14.093 -5.724 20.507 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -11.873 -5.864 22.646 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -12.446 -7.286 21.743 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -10.717 -6.863 21.734 1.00 0.00 H new ATOM 860 N ASN A 60 -12.329 -8.739 18.889 1.00 0.00 N ATOM 861 CA ASN A 60 -13.160 -9.955 18.793 1.00 0.00 C ATOM 862 C ASN A 60 -12.807 -10.779 17.555 1.00 0.00 C ATOM 863 O ASN A 60 -13.627 -11.558 17.069 1.00 0.00 O ATOM 864 CB ASN A 60 -14.666 -9.657 18.789 1.00 0.00 C ATOM 865 CG ASN A 60 -15.229 -9.503 20.184 1.00 0.00 C ATOM 866 OD1 ASN A 60 -15.875 -8.372 20.432 1.00 0.00 O flip ATOM 867 ND2 ASN A 60 -15.086 -10.387 21.028 1.00 0.00 N flip ATOM 0 H ASN A 60 -11.339 -8.917 18.722 1.00 0.00 H new ATOM 0 HA ASN A 60 -12.935 -10.530 19.691 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -14.851 -8.744 18.223 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -15.191 -10.462 18.275 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -14.581 -11.241 20.791 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -15.472 -10.266 21.964 1.00 0.00 H new ATOM 874 N ALA A 61 -11.588 -10.610 17.045 1.00 0.00 N ATOM 875 CA ALA A 61 -11.146 -11.346 15.869 1.00 0.00 C ATOM 876 C ALA A 61 -9.630 -11.516 15.876 1.00 0.00 C ATOM 877 O ALA A 61 -8.969 -11.208 16.867 1.00 0.00 O ATOM 878 CB ALA A 61 -11.599 -10.630 14.608 1.00 0.00 C ATOM 0 H ALA A 61 -10.892 -9.970 17.429 1.00 0.00 H new ATOM 0 HA ALA A 61 -11.596 -12.339 15.889 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -11.264 -11.187 13.733 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -12.687 -10.561 14.600 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -11.171 -9.628 14.585 1.00 0.00 H new ATOM 884 N GLU A 62 -9.083 -12.006 14.767 1.00 0.00 N ATOM 885 CA GLU A 62 -7.643 -12.210 14.659 1.00 0.00 C ATOM 886 C GLU A 62 -7.145 -11.806 13.277 1.00 0.00 C ATOM 887 O GLU A 62 -6.972 -12.649 12.397 1.00 0.00 O ATOM 888 CB GLU A 62 -7.290 -13.673 14.945 1.00 0.00 C ATOM 889 CG GLU A 62 -6.454 -13.863 16.200 1.00 0.00 C ATOM 890 CD GLU A 62 -5.634 -15.137 16.167 1.00 0.00 C ATOM 891 OE1 GLU A 62 -6.185 -16.188 15.776 1.00 0.00 O ATOM 892 OE2 GLU A 62 -4.442 -15.086 16.534 1.00 0.00 O ATOM 0 H GLU A 62 -9.612 -12.268 13.935 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.150 -11.580 15.399 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -8.211 -14.248 15.041 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -6.748 -14.081 14.092 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.787 -13.009 16.321 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -7.110 -13.880 17.070 1.00 0.00 H new ATOM 899 N ALA A 63 -6.920 -10.511 13.094 1.00 0.00 N ATOM 900 CA ALA A 63 -6.450 -9.995 11.817 1.00 0.00 C ATOM 901 C ALA A 63 -5.082 -10.563 11.461 1.00 0.00 C ATOM 902 O ALA A 63 -4.114 -10.395 12.203 1.00 0.00 O ATOM 903 CB ALA A 63 -6.401 -8.473 11.854 1.00 0.00 C ATOM 0 H ALA A 63 -7.055 -9.801 13.813 1.00 0.00 H new ATOM 0 HA ALA A 63 -7.152 -10.309 11.045 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -6.048 -8.097 10.894 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.399 -8.082 12.053 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -5.721 -8.150 12.642 1.00 0.00 H new ATOM 909 N PHE A 64 -5.013 -11.236 10.317 1.00 0.00 N ATOM 910 CA PHE A 64 -3.766 -11.834 9.852 1.00 0.00 C ATOM 911 C PHE A 64 -3.334 -11.214 8.527 1.00 0.00 C ATOM 912 O PHE A 64 -2.152 -10.951 8.308 1.00 0.00 O ATOM 913 CB PHE A 64 -3.929 -13.348 9.692 1.00 0.00 C ATOM 914 CG PHE A 64 -3.427 -14.134 10.869 1.00 0.00 C ATOM 915 CD1 PHE A 64 -4.255 -14.395 11.950 1.00 0.00 C ATOM 916 CD2 PHE A 64 -2.128 -14.615 10.894 1.00 0.00 C ATOM 917 CE1 PHE A 64 -3.796 -15.119 13.033 1.00 0.00 C ATOM 918 CE2 PHE A 64 -1.664 -15.339 11.975 1.00 0.00 C ATOM 919 CZ PHE A 64 -2.498 -15.593 13.046 1.00 0.00 C ATOM 0 H PHE A 64 -5.807 -11.381 9.694 1.00 0.00 H new ATOM 0 HA PHE A 64 -2.995 -11.638 10.597 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.983 -13.577 9.536 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.397 -13.670 8.797 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -5.271 -14.028 11.945 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -1.471 -14.422 10.059 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -4.451 -15.315 13.869 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.649 -15.707 11.983 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.137 -16.160 13.891 1.00 0.00 H new ATOM 929 N ALA A 65 -4.302 -10.983 7.645 1.00 0.00 N ATOM 930 CA ALA A 65 -4.025 -10.393 6.341 1.00 0.00 C ATOM 931 C ALA A 65 -5.000 -9.264 6.030 1.00 0.00 C ATOM 932 O ALA A 65 -6.194 -9.496 5.839 1.00 0.00 O ATOM 933 CB ALA A 65 -4.087 -11.458 5.259 1.00 0.00 C ATOM 0 H ALA A 65 -5.286 -11.196 7.811 1.00 0.00 H new ATOM 0 HA ALA A 65 -3.020 -9.972 6.366 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -3.878 -11.005 4.290 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -3.346 -12.230 5.466 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -5.081 -11.904 5.244 1.00 0.00 H new ATOM 939 N TYR A 66 -4.485 -8.040 5.987 1.00 0.00 N ATOM 940 CA TYR A 66 -5.301 -6.873 5.707 1.00 0.00 C ATOM 941 C TYR A 66 -5.439 -6.638 4.207 1.00 0.00 C ATOM 942 O TYR A 66 -4.463 -6.712 3.462 1.00 0.00 O ATOM 943 CB TYR A 66 -4.677 -5.644 6.364 1.00 0.00 C ATOM 944 CG TYR A 66 -5.673 -4.566 6.698 1.00 0.00 C ATOM 945 CD1 TYR A 66 -6.921 -4.884 7.211 1.00 0.00 C ATOM 946 CD2 TYR A 66 -5.366 -3.230 6.495 1.00 0.00 C ATOM 947 CE1 TYR A 66 -7.835 -3.900 7.516 1.00 0.00 C ATOM 948 CE2 TYR A 66 -6.273 -2.239 6.798 1.00 0.00 C ATOM 949 CZ TYR A 66 -7.508 -2.578 7.308 1.00 0.00 C ATOM 950 OH TYR A 66 -8.416 -1.591 7.611 1.00 0.00 O ATOM 0 H TYR A 66 -3.499 -7.834 6.144 1.00 0.00 H new ATOM 0 HA TYR A 66 -6.297 -7.048 6.115 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -4.167 -5.951 7.277 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -3.919 -5.232 5.698 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -7.181 -5.920 7.374 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -4.400 -2.962 6.093 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -8.803 -4.163 7.916 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -6.018 -1.202 6.637 1.00 0.00 H new ATOM 0 HH TYR A 66 -8.002 -0.941 8.216 1.00 0.00 H new ATOM 960 N ASP A 67 -6.660 -6.342 3.777 1.00 0.00 N ATOM 961 CA ASP A 67 -6.935 -6.080 2.372 1.00 0.00 C ATOM 962 C ASP A 67 -8.060 -5.060 2.237 1.00 0.00 C ATOM 963 O ASP A 67 -9.216 -5.356 2.536 1.00 0.00 O ATOM 964 CB ASP A 67 -7.313 -7.374 1.650 1.00 0.00 C ATOM 965 CG ASP A 67 -8.486 -8.080 2.305 1.00 0.00 C ATOM 966 OD1 ASP A 67 -8.266 -8.785 3.311 1.00 0.00 O ATOM 967 OD2 ASP A 67 -9.621 -7.926 1.810 1.00 0.00 O ATOM 0 H ASP A 67 -7.477 -6.278 4.385 1.00 0.00 H new ATOM 0 HA ASP A 67 -6.033 -5.675 1.913 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -7.561 -7.149 0.613 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -6.453 -8.043 1.634 1.00 0.00 H new ATOM 972 N PHE A 68 -7.715 -3.855 1.794 1.00 0.00 N ATOM 973 CA PHE A 68 -8.705 -2.797 1.632 1.00 0.00 C ATOM 974 C PHE A 68 -8.698 -2.236 0.214 1.00 0.00 C ATOM 975 O PHE A 68 -7.821 -2.555 -0.589 1.00 0.00 O ATOM 976 CB PHE A 68 -8.457 -1.673 2.642 1.00 0.00 C ATOM 977 CG PHE A 68 -7.170 -0.930 2.418 1.00 0.00 C ATOM 978 CD1 PHE A 68 -7.040 -0.044 1.362 1.00 0.00 C ATOM 979 CD2 PHE A 68 -6.091 -1.119 3.267 1.00 0.00 C ATOM 980 CE1 PHE A 68 -5.857 0.640 1.155 1.00 0.00 C ATOM 981 CE2 PHE A 68 -4.907 -0.437 3.067 1.00 0.00 C ATOM 982 CZ PHE A 68 -4.790 0.443 2.009 1.00 0.00 C ATOM 0 H PHE A 68 -6.763 -3.588 1.542 1.00 0.00 H new ATOM 0 HA PHE A 68 -9.686 -3.234 1.817 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -9.286 -0.967 2.597 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -8.452 -2.095 3.647 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.872 0.114 0.692 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -6.177 -1.808 4.095 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -5.767 1.327 0.327 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -4.074 -0.591 3.737 1.00 0.00 H new ATOM 0 HZ PHE A 68 -3.865 0.977 1.850 1.00 0.00 H new ATOM 992 N THR A 69 -9.683 -1.397 -0.082 1.00 0.00 N ATOM 993 CA THR A 69 -9.804 -0.783 -1.398 1.00 0.00 C ATOM 994 C THR A 69 -10.019 0.723 -1.268 1.00 0.00 C ATOM 995 O THR A 69 -11.109 1.174 -0.915 1.00 0.00 O ATOM 996 CB THR A 69 -10.962 -1.416 -2.174 1.00 0.00 C ATOM 997 OG1 THR A 69 -11.393 -2.610 -1.546 1.00 0.00 O ATOM 998 CG2 THR A 69 -10.612 -1.759 -3.605 1.00 0.00 C ATOM 0 H THR A 69 -10.413 -1.125 0.576 1.00 0.00 H new ATOM 0 HA THR A 69 -8.878 -0.955 -1.946 1.00 0.00 H new ATOM 0 HB THR A 69 -11.748 -0.661 -2.179 1.00 0.00 H new ATOM 0 HG1 THR A 69 -11.824 -2.394 -0.693 1.00 0.00 H new ATOM 0 HG21 THR A 69 -11.478 -2.204 -4.095 1.00 0.00 H new ATOM 0 HG22 THR A 69 -10.320 -0.853 -4.136 1.00 0.00 H new ATOM 0 HG23 THR A 69 -9.785 -2.468 -3.617 1.00 0.00 H new ATOM 1006 N LEU A 70 -8.973 1.493 -1.544 1.00 0.00 N ATOM 1007 CA LEU A 70 -9.047 2.948 -1.449 1.00 0.00 C ATOM 1008 C LEU A 70 -9.777 3.541 -2.649 1.00 0.00 C ATOM 1009 O LEU A 70 -9.794 2.957 -3.732 1.00 0.00 O ATOM 1010 CB LEU A 70 -7.642 3.544 -1.347 1.00 0.00 C ATOM 1011 CG LEU A 70 -7.583 4.975 -0.812 1.00 0.00 C ATOM 1012 CD1 LEU A 70 -6.317 5.189 0.003 1.00 0.00 C ATOM 1013 CD2 LEU A 70 -7.659 5.974 -1.957 1.00 0.00 C ATOM 0 H LEU A 70 -8.063 1.135 -1.835 1.00 0.00 H new ATOM 0 HA LEU A 70 -9.609 3.198 -0.549 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.039 2.906 -0.701 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -7.182 3.523 -2.335 1.00 0.00 H new ATOM 0 HG LEU A 70 -8.441 5.135 -0.159 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -6.293 6.213 0.375 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -6.305 4.496 0.845 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -5.445 5.011 -0.626 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -7.616 6.988 -1.559 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -6.821 5.814 -2.635 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -8.595 5.836 -2.498 1.00 0.00 H new ATOM 1025 N ASN A 71 -10.380 4.709 -2.447 1.00 0.00 N ATOM 1026 CA ASN A 71 -11.112 5.388 -3.508 1.00 0.00 C ATOM 1027 C ASN A 71 -10.633 6.828 -3.661 1.00 0.00 C ATOM 1028 O ASN A 71 -10.920 7.681 -2.823 1.00 0.00 O ATOM 1029 CB ASN A 71 -12.614 5.367 -3.217 1.00 0.00 C ATOM 1030 CG ASN A 71 -13.248 4.033 -3.557 1.00 0.00 C ATOM 1031 OD1 ASN A 71 -12.854 2.990 -2.836 1.00 0.00 O flip ATOM 1032 ND2 ASN A 71 -14.084 3.941 -4.456 1.00 0.00 N flip ATOM 0 H ASN A 71 -10.375 5.205 -1.556 1.00 0.00 H new ATOM 0 HA ASN A 71 -10.923 4.858 -4.442 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -12.780 5.587 -2.163 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -13.103 6.155 -3.789 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -14.357 4.769 -4.985 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -14.503 3.037 -4.672 1.00 0.00 H new ATOM 1039 N TYR A 72 -9.902 7.090 -4.740 1.00 0.00 N ATOM 1040 CA TYR A 72 -9.380 8.425 -5.005 1.00 0.00 C ATOM 1041 C TYR A 72 -9.856 8.936 -6.363 1.00 0.00 C ATOM 1042 O TYR A 72 -10.746 8.350 -6.978 1.00 0.00 O ATOM 1043 CB TYR A 72 -7.850 8.413 -4.955 1.00 0.00 C ATOM 1044 CG TYR A 72 -7.218 7.562 -6.033 1.00 0.00 C ATOM 1045 CD1 TYR A 72 -7.268 6.175 -5.966 1.00 0.00 C ATOM 1046 CD2 TYR A 72 -6.572 8.144 -7.114 1.00 0.00 C ATOM 1047 CE1 TYR A 72 -6.692 5.392 -6.949 1.00 0.00 C ATOM 1048 CE2 TYR A 72 -5.993 7.369 -8.102 1.00 0.00 C ATOM 1049 CZ TYR A 72 -6.056 5.994 -8.014 1.00 0.00 C ATOM 1050 OH TYR A 72 -5.483 5.218 -8.994 1.00 0.00 O ATOM 0 H TYR A 72 -9.658 6.395 -5.445 1.00 0.00 H new ATOM 0 HA TYR A 72 -9.756 9.098 -4.234 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -7.483 9.435 -5.049 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -7.529 8.047 -3.980 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -7.765 5.701 -5.132 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -6.520 9.220 -7.185 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -6.740 4.315 -6.883 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -5.494 7.838 -8.938 1.00 0.00 H new ATOM 0 HH TYR A 72 -5.782 5.529 -9.874 1.00 0.00 H new ATOM 1060 N ASP A 73 -9.263 10.034 -6.822 1.00 0.00 N ATOM 1061 CA ASP A 73 -9.630 10.621 -8.105 1.00 0.00 C ATOM 1062 C ASP A 73 -8.593 10.293 -9.175 1.00 0.00 C ATOM 1063 O ASP A 73 -7.390 10.307 -8.912 1.00 0.00 O ATOM 1064 CB ASP A 73 -9.780 12.137 -7.971 1.00 0.00 C ATOM 1065 CG ASP A 73 -10.787 12.527 -6.907 1.00 0.00 C ATOM 1066 OD1 ASP A 73 -10.809 11.874 -5.843 1.00 0.00 O ATOM 1067 OD2 ASP A 73 -11.554 13.486 -7.138 1.00 0.00 O ATOM 0 H ASP A 73 -8.527 10.535 -6.324 1.00 0.00 H new ATOM 0 HA ASP A 73 -10.585 10.193 -8.410 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -8.812 12.575 -7.729 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -10.088 12.555 -8.929 1.00 0.00 H new ATOM 1072 N GLU A 74 -9.065 10.000 -10.380 1.00 0.00 N ATOM 1073 CA GLU A 74 -8.179 9.669 -11.491 1.00 0.00 C ATOM 1074 C GLU A 74 -7.928 10.888 -12.373 1.00 0.00 C ATOM 1075 O GLU A 74 -6.911 10.967 -13.064 1.00 0.00 O ATOM 1076 CB GLU A 74 -8.779 8.538 -12.327 1.00 0.00 C ATOM 1077 CG GLU A 74 -10.081 8.918 -13.016 1.00 0.00 C ATOM 1078 CD GLU A 74 -10.061 8.629 -14.505 1.00 0.00 C ATOM 1079 OE1 GLU A 74 -9.069 8.996 -15.169 1.00 0.00 O ATOM 1080 OE2 GLU A 74 -11.037 8.034 -15.008 1.00 0.00 O ATOM 0 H GLU A 74 -10.058 9.985 -10.614 1.00 0.00 H new ATOM 0 HA GLU A 74 -7.226 9.342 -11.076 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.054 8.230 -13.081 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.956 7.676 -11.684 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -10.904 8.372 -12.555 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.275 9.979 -12.858 1.00 0.00 H new ATOM 1087 N ASN A 75 -8.861 11.834 -12.349 1.00 0.00 N ATOM 1088 CA ASN A 75 -8.741 13.047 -13.151 1.00 0.00 C ATOM 1089 C ASN A 75 -7.544 13.883 -12.714 1.00 0.00 C ATOM 1090 O ASN A 75 -6.962 14.616 -13.513 1.00 0.00 O ATOM 1091 CB ASN A 75 -10.022 13.878 -13.044 1.00 0.00 C ATOM 1092 CG ASN A 75 -11.150 13.312 -13.885 1.00 0.00 C ATOM 1093 OD1 ASN A 75 -11.338 12.098 -13.953 1.00 0.00 O ATOM 1094 ND2 ASN A 75 -11.906 14.192 -14.531 1.00 0.00 N ATOM 0 H ASN A 75 -9.708 11.784 -11.783 1.00 0.00 H new ATOM 0 HA ASN A 75 -8.588 12.749 -14.188 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -10.337 13.923 -12.001 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -9.816 14.901 -13.359 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -12.679 13.870 -15.113 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -11.713 15.190 -14.445 1.00 0.00 H new ATOM 1101 N ALA A 76 -7.177 13.772 -11.440 1.00 0.00 N ATOM 1102 CA ALA A 76 -6.050 14.525 -10.903 1.00 0.00 C ATOM 1103 C ALA A 76 -4.978 13.595 -10.343 1.00 0.00 C ATOM 1104 O ALA A 76 -3.787 13.791 -10.585 1.00 0.00 O ATOM 1105 CB ALA A 76 -6.524 15.490 -9.828 1.00 0.00 C ATOM 0 H ALA A 76 -7.643 13.169 -10.762 1.00 0.00 H new ATOM 0 HA ALA A 76 -5.607 15.094 -11.720 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -5.672 16.045 -9.436 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -7.245 16.186 -10.256 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -6.996 14.931 -9.020 1.00 0.00 H new ATOM 1111 N PHE A 77 -5.407 12.588 -9.591 1.00 0.00 N ATOM 1112 CA PHE A 77 -4.480 11.634 -8.995 1.00 0.00 C ATOM 1113 C PHE A 77 -4.295 10.414 -9.893 1.00 0.00 C ATOM 1114 O PHE A 77 -4.869 10.335 -10.980 1.00 0.00 O ATOM 1115 CB PHE A 77 -4.986 11.192 -7.620 1.00 0.00 C ATOM 1116 CG PHE A 77 -4.287 11.864 -6.472 1.00 0.00 C ATOM 1117 CD1 PHE A 77 -2.952 11.601 -6.207 1.00 0.00 C ATOM 1118 CD2 PHE A 77 -4.966 12.753 -5.654 1.00 0.00 C ATOM 1119 CE1 PHE A 77 -2.309 12.214 -5.149 1.00 0.00 C ATOM 1120 CE2 PHE A 77 -4.328 13.368 -4.595 1.00 0.00 C ATOM 1121 CZ PHE A 77 -2.997 13.098 -4.343 1.00 0.00 C ATOM 0 H PHE A 77 -6.389 12.411 -9.380 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.515 12.129 -8.882 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -6.054 11.397 -7.553 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -4.862 10.113 -7.527 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -2.409 10.910 -6.834 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -6.007 12.967 -5.847 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -1.268 12.002 -4.953 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -4.869 14.059 -3.965 1.00 0.00 H new ATOM 0 HZ PHE A 77 -2.495 13.578 -3.516 1.00 0.00 H new ATOM 1131 N GLU A 78 -3.493 9.467 -9.424 1.00 0.00 N ATOM 1132 CA GLU A 78 -3.225 8.243 -10.170 1.00 0.00 C ATOM 1133 C GLU A 78 -2.445 7.258 -9.307 1.00 0.00 C ATOM 1134 O GLU A 78 -1.311 7.525 -8.912 1.00 0.00 O ATOM 1135 CB GLU A 78 -2.445 8.553 -11.449 1.00 0.00 C ATOM 1136 CG GLU A 78 -2.622 7.506 -12.537 1.00 0.00 C ATOM 1137 CD GLU A 78 -2.723 8.115 -13.922 1.00 0.00 C ATOM 1138 OE1 GLU A 78 -3.838 8.526 -14.309 1.00 0.00 O ATOM 1139 OE2 GLU A 78 -1.689 8.181 -14.619 1.00 0.00 O ATOM 0 H GLU A 78 -3.014 9.523 -8.525 1.00 0.00 H new ATOM 0 HA GLU A 78 -4.179 7.792 -10.445 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.763 9.522 -11.833 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.386 8.639 -11.207 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.781 6.813 -12.509 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -3.521 6.924 -12.333 1.00 0.00 H new ATOM 1146 N TYR A 79 -3.066 6.121 -9.009 1.00 0.00 N ATOM 1147 CA TYR A 79 -2.438 5.096 -8.179 1.00 0.00 C ATOM 1148 C TYR A 79 -1.001 4.824 -8.618 1.00 0.00 C ATOM 1149 O TYR A 79 -0.718 4.685 -9.809 1.00 0.00 O ATOM 1150 CB TYR A 79 -3.258 3.803 -8.228 1.00 0.00 C ATOM 1151 CG TYR A 79 -2.551 2.606 -7.631 1.00 0.00 C ATOM 1152 CD1 TYR A 79 -2.222 2.569 -6.283 1.00 0.00 C ATOM 1153 CD2 TYR A 79 -2.209 1.517 -8.421 1.00 0.00 C ATOM 1154 CE1 TYR A 79 -1.573 1.478 -5.737 1.00 0.00 C ATOM 1155 CE2 TYR A 79 -1.560 0.423 -7.883 1.00 0.00 C ATOM 1156 CZ TYR A 79 -1.244 0.407 -6.541 1.00 0.00 C ATOM 1157 OH TYR A 79 -0.594 -0.679 -6.002 1.00 0.00 O ATOM 0 H TYR A 79 -4.005 5.885 -9.330 1.00 0.00 H new ATOM 0 HA TYR A 79 -2.410 5.466 -7.154 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -4.197 3.960 -7.698 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -3.510 3.583 -9.265 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -2.477 3.406 -5.651 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -2.454 1.525 -9.473 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -1.325 1.464 -4.686 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -1.301 -0.417 -8.511 1.00 0.00 H new ATOM 0 HH TYR A 79 -0.437 -1.347 -6.702 1.00 0.00 H new ATOM 1167 N VAL A 80 -0.101 4.751 -7.643 1.00 0.00 N ATOM 1168 CA VAL A 80 1.305 4.495 -7.917 1.00 0.00 C ATOM 1169 C VAL A 80 1.687 3.069 -7.518 1.00 0.00 C ATOM 1170 O VAL A 80 1.733 2.174 -8.360 1.00 0.00 O ATOM 1171 CB VAL A 80 2.213 5.501 -7.177 1.00 0.00 C ATOM 1172 CG1 VAL A 80 3.661 5.312 -7.586 1.00 0.00 C ATOM 1173 CG2 VAL A 80 1.758 6.927 -7.443 1.00 0.00 C ATOM 0 H VAL A 80 -0.323 4.866 -6.654 1.00 0.00 H new ATOM 0 HA VAL A 80 1.453 4.616 -8.990 1.00 0.00 H new ATOM 0 HB VAL A 80 2.135 5.313 -6.106 1.00 0.00 H new ATOM 0 HG11 VAL A 80 4.286 6.030 -7.054 1.00 0.00 H new ATOM 0 HG12 VAL A 80 3.980 4.300 -7.338 1.00 0.00 H new ATOM 0 HG13 VAL A 80 3.759 5.471 -8.660 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.410 7.622 -6.913 1.00 0.00 H new ATOM 0 HG22 VAL A 80 1.804 7.130 -8.513 1.00 0.00 H new ATOM 0 HG23 VAL A 80 0.733 7.053 -7.094 1.00 0.00 H new ATOM 1183 N GLU A 81 1.955 2.865 -6.230 1.00 0.00 N ATOM 1184 CA GLU A 81 2.327 1.550 -5.721 1.00 0.00 C ATOM 1185 C GLU A 81 2.149 1.489 -4.206 1.00 0.00 C ATOM 1186 O GLU A 81 2.503 2.428 -3.492 1.00 0.00 O ATOM 1187 CB GLU A 81 3.780 1.229 -6.086 1.00 0.00 C ATOM 1188 CG GLU A 81 3.930 0.459 -7.388 1.00 0.00 C ATOM 1189 CD GLU A 81 3.070 -0.790 -7.433 1.00 0.00 C ATOM 1190 OE1 GLU A 81 3.159 -1.606 -6.493 1.00 0.00 O ATOM 1191 OE2 GLU A 81 2.306 -0.949 -8.409 1.00 0.00 O ATOM 0 H GLU A 81 1.921 3.596 -5.520 1.00 0.00 H new ATOM 0 HA GLU A 81 1.672 0.810 -6.181 1.00 0.00 H new ATOM 0 HB2 GLU A 81 4.341 2.161 -6.159 1.00 0.00 H new ATOM 0 HB3 GLU A 81 4.228 0.650 -5.279 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.664 1.108 -8.222 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.975 0.180 -7.522 1.00 0.00 H new ATOM 1198 N ALA A 82 1.605 0.378 -3.719 1.00 0.00 N ATOM 1199 CA ALA A 82 1.388 0.197 -2.289 1.00 0.00 C ATOM 1200 C ALA A 82 2.630 -0.269 -1.606 1.00 0.00 C ATOM 1201 O ALA A 82 3.462 -0.974 -2.176 1.00 0.00 O ATOM 1202 CB ALA A 82 0.226 -0.748 -2.026 1.00 0.00 C ATOM 0 H ALA A 82 1.307 -0.410 -4.294 1.00 0.00 H new ATOM 0 HA ALA A 82 1.127 1.168 -1.869 1.00 0.00 H new ATOM 0 HB1 ALA A 82 0.088 -0.864 -0.951 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -0.683 -0.339 -2.467 1.00 0.00 H new ATOM 0 HB3 ALA A 82 0.439 -1.720 -2.471 1.00 0.00 H new ATOM 1208 N ILE A 83 2.761 0.190 -0.383 1.00 0.00 N ATOM 1209 CA ILE A 83 3.917 -0.107 0.401 1.00 0.00 C ATOM 1210 C ILE A 83 3.564 -0.678 1.758 1.00 0.00 C ATOM 1211 O ILE A 83 2.485 -0.442 2.302 1.00 0.00 O ATOM 1212 CB ILE A 83 4.790 1.148 0.584 1.00 0.00 C ATOM 1213 CG1 ILE A 83 4.176 2.368 -0.112 1.00 0.00 C ATOM 1214 CG2 ILE A 83 6.171 0.872 0.037 1.00 0.00 C ATOM 1215 CD1 ILE A 83 4.762 3.683 0.355 1.00 0.00 C ATOM 0 H ILE A 83 2.069 0.775 0.086 1.00 0.00 H new ATOM 0 HA ILE A 83 4.476 -0.866 -0.147 1.00 0.00 H new ATOM 0 HB ILE A 83 4.851 1.378 1.648 1.00 0.00 H new ATOM 0 HG12 ILE A 83 4.322 2.275 -1.188 1.00 0.00 H new ATOM 0 HG13 ILE A 83 3.100 2.375 0.064 1.00 0.00 H new ATOM 0 HG21 ILE A 83 6.796 1.756 0.163 1.00 0.00 H new ATOM 0 HG22 ILE A 83 6.615 0.035 0.575 1.00 0.00 H new ATOM 0 HG23 ILE A 83 6.100 0.626 -1.022 1.00 0.00 H new ATOM 0 HD11 ILE A 83 4.283 4.504 -0.178 1.00 0.00 H new ATOM 0 HD12 ILE A 83 4.593 3.797 1.426 1.00 0.00 H new ATOM 0 HD13 ILE A 83 5.833 3.696 0.154 1.00 0.00 H new ATOM 1227 N SER A 84 4.506 -1.432 2.286 1.00 0.00 N ATOM 1228 CA SER A 84 4.356 -2.069 3.589 1.00 0.00 C ATOM 1229 C SER A 84 5.371 -1.516 4.586 1.00 0.00 C ATOM 1230 O SER A 84 6.354 -0.885 4.199 1.00 0.00 O ATOM 1231 CB SER A 84 4.529 -3.584 3.460 1.00 0.00 C ATOM 1232 OG SER A 84 3.719 -4.274 4.396 1.00 0.00 O ATOM 0 H SER A 84 5.398 -1.624 1.829 1.00 0.00 H new ATOM 0 HA SER A 84 3.354 -1.852 3.959 1.00 0.00 H new ATOM 0 HB2 SER A 84 4.269 -3.898 2.449 1.00 0.00 H new ATOM 0 HB3 SER A 84 5.575 -3.848 3.616 1.00 0.00 H new ATOM 0 HG SER A 84 3.069 -3.653 4.787 1.00 0.00 H new ATOM 1238 N ASP A 85 5.126 -1.759 5.869 1.00 0.00 N ATOM 1239 CA ASP A 85 6.017 -1.289 6.923 1.00 0.00 C ATOM 1240 C ASP A 85 7.407 -1.908 6.775 1.00 0.00 C ATOM 1241 O ASP A 85 7.767 -2.392 5.704 1.00 0.00 O ATOM 1242 CB ASP A 85 5.430 -1.625 8.296 1.00 0.00 C ATOM 1243 CG ASP A 85 5.628 -0.504 9.299 1.00 0.00 C ATOM 1244 OD1 ASP A 85 5.024 0.572 9.113 1.00 0.00 O ATOM 1245 OD2 ASP A 85 6.387 -0.705 10.270 1.00 0.00 O ATOM 0 H ASP A 85 4.316 -2.280 6.204 1.00 0.00 H new ATOM 0 HA ASP A 85 6.115 -0.207 6.835 1.00 0.00 H new ATOM 0 HB2 ASP A 85 4.365 -1.832 8.192 1.00 0.00 H new ATOM 0 HB3 ASP A 85 5.896 -2.535 8.675 1.00 0.00 H new ATOM 1250 N ASP A 86 8.182 -1.891 7.858 1.00 0.00 N ATOM 1251 CA ASP A 86 9.529 -2.452 7.844 1.00 0.00 C ATOM 1252 C ASP A 86 9.522 -3.892 8.349 1.00 0.00 C ATOM 1253 O ASP A 86 10.442 -4.323 9.045 1.00 0.00 O ATOM 1254 CB ASP A 86 10.467 -1.602 8.702 1.00 0.00 C ATOM 1255 CG ASP A 86 11.881 -1.569 8.155 1.00 0.00 C ATOM 1256 OD1 ASP A 86 12.067 -1.072 7.024 1.00 0.00 O ATOM 1257 OD2 ASP A 86 12.800 -2.038 8.856 1.00 0.00 O ATOM 0 H ASP A 86 7.899 -1.495 8.755 1.00 0.00 H new ATOM 0 HA ASP A 86 9.888 -2.448 6.815 1.00 0.00 H new ATOM 0 HB2 ASP A 86 10.079 -0.585 8.761 1.00 0.00 H new ATOM 0 HB3 ASP A 86 10.483 -1.996 9.718 1.00 0.00 H new ATOM 1262 N GLY A 87 8.477 -4.630 7.991 1.00 0.00 N ATOM 1263 CA GLY A 87 8.361 -6.013 8.411 1.00 0.00 C ATOM 1264 C GLY A 87 7.278 -6.749 7.649 1.00 0.00 C ATOM 1265 O GLY A 87 7.450 -7.906 7.269 1.00 0.00 O ATOM 0 H GLY A 87 7.706 -4.293 7.415 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.315 -6.518 8.263 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.143 -6.051 9.478 1.00 0.00 H new ATOM 1269 N VAL A 88 6.158 -6.069 7.422 1.00 0.00 N ATOM 1270 CA VAL A 88 5.040 -6.658 6.697 1.00 0.00 C ATOM 1271 C VAL A 88 5.202 -6.461 5.192 1.00 0.00 C ATOM 1272 O VAL A 88 6.076 -5.718 4.746 1.00 0.00 O ATOM 1273 CB VAL A 88 3.696 -6.052 7.143 1.00 0.00 C ATOM 1274 CG1 VAL A 88 3.314 -6.555 8.526 1.00 0.00 C ATOM 1275 CG2 VAL A 88 3.762 -4.532 7.118 1.00 0.00 C ATOM 0 H VAL A 88 6.002 -5.109 7.730 1.00 0.00 H new ATOM 0 HA VAL A 88 5.039 -7.724 6.926 1.00 0.00 H new ATOM 0 HB VAL A 88 2.924 -6.371 6.442 1.00 0.00 H new ATOM 0 HG11 VAL A 88 2.362 -6.115 8.823 1.00 0.00 H new ATOM 0 HG12 VAL A 88 3.222 -7.641 8.506 1.00 0.00 H new ATOM 0 HG13 VAL A 88 4.084 -6.270 9.242 1.00 0.00 H new ATOM 0 HG21 VAL A 88 2.804 -4.121 7.436 1.00 0.00 H new ATOM 0 HG22 VAL A 88 4.546 -4.191 7.794 1.00 0.00 H new ATOM 0 HG23 VAL A 88 3.984 -4.194 6.106 1.00 0.00 H new ATOM 1285 N PHE A 89 4.358 -7.130 4.417 1.00 0.00 N ATOM 1286 CA PHE A 89 4.410 -7.029 2.963 1.00 0.00 C ATOM 1287 C PHE A 89 3.116 -6.445 2.409 1.00 0.00 C ATOM 1288 O PHE A 89 2.032 -6.709 2.931 1.00 0.00 O ATOM 1289 CB PHE A 89 4.669 -8.404 2.344 1.00 0.00 C ATOM 1290 CG PHE A 89 5.049 -8.348 0.893 1.00 0.00 C ATOM 1291 CD1 PHE A 89 6.366 -8.136 0.514 1.00 0.00 C ATOM 1292 CD2 PHE A 89 4.089 -8.506 -0.095 1.00 0.00 C ATOM 1293 CE1 PHE A 89 6.718 -8.083 -0.820 1.00 0.00 C ATOM 1294 CE2 PHE A 89 4.437 -8.453 -1.432 1.00 0.00 C ATOM 1295 CZ PHE A 89 5.752 -8.242 -1.795 1.00 0.00 C ATOM 0 H PHE A 89 3.628 -7.749 4.771 1.00 0.00 H new ATOM 0 HA PHE A 89 5.229 -6.359 2.701 1.00 0.00 H new ATOM 0 HB2 PHE A 89 5.465 -8.900 2.900 1.00 0.00 H new ATOM 0 HB3 PHE A 89 3.774 -9.017 2.453 1.00 0.00 H new ATOM 0 HD1 PHE A 89 7.126 -8.011 1.272 1.00 0.00 H new ATOM 0 HD2 PHE A 89 3.059 -8.672 0.183 1.00 0.00 H new ATOM 0 HE1 PHE A 89 7.748 -7.917 -1.101 1.00 0.00 H new ATOM 0 HE2 PHE A 89 3.680 -8.577 -2.192 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.025 -8.201 -2.839 1.00 0.00 H new ATOM 1305 N VAL A 90 3.235 -5.653 1.349 1.00 0.00 N ATOM 1306 CA VAL A 90 2.076 -5.032 0.723 1.00 0.00 C ATOM 1307 C VAL A 90 2.222 -5.005 -0.795 1.00 0.00 C ATOM 1308 O VAL A 90 3.306 -4.756 -1.322 1.00 0.00 O ATOM 1309 CB VAL A 90 1.853 -3.593 1.251 1.00 0.00 C ATOM 1310 CG1 VAL A 90 1.001 -2.771 0.291 1.00 0.00 C ATOM 1311 CG2 VAL A 90 1.213 -3.630 2.628 1.00 0.00 C ATOM 0 H VAL A 90 4.125 -5.426 0.905 1.00 0.00 H new ATOM 0 HA VAL A 90 1.207 -5.637 0.984 1.00 0.00 H new ATOM 0 HB VAL A 90 2.828 -3.111 1.326 1.00 0.00 H new ATOM 0 HG11 VAL A 90 0.865 -1.767 0.693 1.00 0.00 H new ATOM 0 HG12 VAL A 90 1.499 -2.710 -0.676 1.00 0.00 H new ATOM 0 HG13 VAL A 90 0.028 -3.248 0.168 1.00 0.00 H new ATOM 0 HG21 VAL A 90 1.062 -2.612 2.987 1.00 0.00 H new ATOM 0 HG22 VAL A 90 0.251 -4.140 2.569 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.865 -4.165 3.318 1.00 0.00 H new ATOM 1321 N ASN A 91 1.118 -5.258 -1.487 1.00 0.00 N ATOM 1322 CA ASN A 91 1.107 -5.259 -2.942 1.00 0.00 C ATOM 1323 C ASN A 91 -0.304 -5.009 -3.461 1.00 0.00 C ATOM 1324 O ASN A 91 -1.173 -5.874 -3.363 1.00 0.00 O ATOM 1325 CB ASN A 91 1.634 -6.589 -3.481 1.00 0.00 C ATOM 1326 CG ASN A 91 1.809 -6.573 -4.987 1.00 0.00 C ATOM 1327 OD1 ASN A 91 0.700 -6.660 -5.712 1.00 0.00 O flip ATOM 1328 ND2 ASN A 91 2.928 -6.481 -5.493 1.00 0.00 N flip ATOM 0 H ASN A 91 0.215 -5.466 -1.060 1.00 0.00 H new ATOM 0 HA ASN A 91 1.759 -4.458 -3.291 1.00 0.00 H new ATOM 0 HB2 ASN A 91 2.590 -6.816 -3.009 1.00 0.00 H new ATOM 0 HB3 ASN A 91 0.945 -7.388 -3.206 1.00 0.00 H new ATOM 0 HD21 ASN A 91 3.753 -6.416 -4.897 1.00 0.00 H new ATOM 0 HD22 ASN A 91 3.029 -6.469 -6.508 1.00 0.00 H new ATOM 1335 N ALA A 92 -0.529 -3.819 -4.006 1.00 0.00 N ATOM 1336 CA ALA A 92 -1.840 -3.459 -4.527 1.00 0.00 C ATOM 1337 C ALA A 92 -1.924 -3.691 -6.027 1.00 0.00 C ATOM 1338 O ALA A 92 -0.954 -4.113 -6.657 1.00 0.00 O ATOM 1339 CB ALA A 92 -2.163 -2.010 -4.192 1.00 0.00 C ATOM 0 H ALA A 92 0.178 -3.090 -4.098 1.00 0.00 H new ATOM 0 HA ALA A 92 -2.579 -4.103 -4.050 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -3.146 -1.755 -4.588 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -2.162 -1.878 -3.110 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -1.412 -1.357 -4.638 1.00 0.00 H new ATOM 1345 N LYS A 93 -3.096 -3.426 -6.595 1.00 0.00 N ATOM 1346 CA LYS A 93 -3.308 -3.621 -8.020 1.00 0.00 C ATOM 1347 C LYS A 93 -4.415 -2.718 -8.553 1.00 0.00 C ATOM 1348 O LYS A 93 -5.590 -2.899 -8.238 1.00 0.00 O ATOM 1349 CB LYS A 93 -3.648 -5.086 -8.304 1.00 0.00 C ATOM 1350 CG LYS A 93 -2.456 -5.909 -8.763 1.00 0.00 C ATOM 1351 CD LYS A 93 -2.539 -7.341 -8.258 1.00 0.00 C ATOM 1352 CE LYS A 93 -1.297 -8.135 -8.627 1.00 0.00 C ATOM 1353 NZ LYS A 93 -1.492 -8.924 -9.874 1.00 0.00 N ATOM 0 H LYS A 93 -3.910 -3.077 -6.090 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.384 -3.355 -8.533 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -4.063 -5.535 -7.402 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -4.424 -5.129 -9.068 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -2.410 -5.908 -9.852 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.535 -5.449 -8.405 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.662 -7.339 -7.175 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -3.420 -7.826 -8.679 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -0.456 -7.454 -8.756 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -1.040 -8.807 -7.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -0.622 -9.451 -10.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -2.278 -9.592 -9.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -1.712 -8.281 -10.661 1.00 0.00 H new ATOM 1367 N LYS A 94 -4.021 -1.746 -9.366 1.00 0.00 N ATOM 1368 CA LYS A 94 -4.953 -0.803 -9.960 1.00 0.00 C ATOM 1369 C LYS A 94 -6.071 -1.525 -10.696 1.00 0.00 C ATOM 1370 O LYS A 94 -5.934 -1.893 -11.861 1.00 0.00 O ATOM 1371 CB LYS A 94 -4.220 0.125 -10.930 1.00 0.00 C ATOM 1372 CG LYS A 94 -4.803 1.528 -10.986 1.00 0.00 C ATOM 1373 CD LYS A 94 -4.547 2.183 -12.334 1.00 0.00 C ATOM 1374 CE LYS A 94 -5.588 3.247 -12.642 1.00 0.00 C ATOM 1375 NZ LYS A 94 -6.723 2.700 -13.436 1.00 0.00 N ATOM 0 H LYS A 94 -3.048 -1.591 -9.630 1.00 0.00 H new ATOM 0 HA LYS A 94 -5.391 -0.215 -9.154 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -3.172 0.187 -10.638 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -4.248 -0.311 -11.928 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -5.876 1.485 -10.799 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -4.365 2.137 -10.195 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -3.554 2.632 -12.339 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -4.558 1.424 -13.117 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -5.966 3.666 -11.709 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -5.121 4.064 -13.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -7.525 3.361 -13.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -6.426 2.575 -14.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -7.012 1.782 -13.042 1.00 0.00 H new ATOM 1389 N ILE A 95 -7.180 -1.710 -9.998 1.00 0.00 N ATOM 1390 CA ILE A 95 -8.342 -2.376 -10.569 1.00 0.00 C ATOM 1391 C ILE A 95 -9.121 -1.423 -11.474 1.00 0.00 C ATOM 1392 O ILE A 95 -9.835 -1.853 -12.379 1.00 0.00 O ATOM 1393 CB ILE A 95 -9.275 -2.904 -9.462 1.00 0.00 C ATOM 1394 CG1 ILE A 95 -10.486 -3.617 -10.068 1.00 0.00 C ATOM 1395 CG2 ILE A 95 -9.716 -1.760 -8.566 1.00 0.00 C ATOM 1396 CD1 ILE A 95 -10.138 -4.922 -10.751 1.00 0.00 C ATOM 0 H ILE A 95 -7.301 -1.407 -9.031 1.00 0.00 H new ATOM 0 HA ILE A 95 -7.980 -3.218 -11.160 1.00 0.00 H new ATOM 0 HB ILE A 95 -8.727 -3.628 -8.859 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -11.215 -3.811 -9.281 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -10.964 -2.955 -10.789 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -10.375 -2.142 -7.786 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.841 -1.299 -8.108 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -10.249 -1.017 -9.160 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -11.043 -5.373 -11.157 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -9.432 -4.732 -11.560 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -9.687 -5.602 -10.028 1.00 0.00 H new ATOM 1408 N GLU A 96 -8.975 -0.125 -11.221 1.00 0.00 N ATOM 1409 CA GLU A 96 -9.660 0.893 -12.007 1.00 0.00 C ATOM 1410 C GLU A 96 -9.076 2.274 -11.729 1.00 0.00 C ATOM 1411 O GLU A 96 -8.008 2.397 -11.128 1.00 0.00 O ATOM 1412 CB GLU A 96 -11.158 0.884 -11.697 1.00 0.00 C ATOM 1413 CG GLU A 96 -12.035 1.110 -12.918 1.00 0.00 C ATOM 1414 CD GLU A 96 -13.285 1.905 -12.598 1.00 0.00 C ATOM 1415 OE1 GLU A 96 -14.157 1.375 -11.877 1.00 0.00 O ATOM 1416 OE2 GLU A 96 -13.393 3.056 -13.069 1.00 0.00 O ATOM 0 H GLU A 96 -8.386 0.246 -10.475 1.00 0.00 H new ATOM 0 HA GLU A 96 -9.516 0.663 -13.063 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -11.421 -0.072 -11.244 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -11.372 1.657 -10.959 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -11.461 1.635 -13.681 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -12.320 0.146 -13.340 1.00 0.00 H new ATOM 1423 N ASP A 97 -9.781 3.312 -12.169 1.00 0.00 N ATOM 1424 CA ASP A 97 -9.328 4.684 -11.966 1.00 0.00 C ATOM 1425 C ASP A 97 -9.819 5.225 -10.627 1.00 0.00 C ATOM 1426 O ASP A 97 -10.992 5.083 -10.280 1.00 0.00 O ATOM 1427 CB ASP A 97 -9.821 5.577 -13.107 1.00 0.00 C ATOM 1428 CG ASP A 97 -8.699 6.000 -14.035 1.00 0.00 C ATOM 1429 OD1 ASP A 97 -7.549 6.116 -13.561 1.00 0.00 O ATOM 1430 OD2 ASP A 97 -8.971 6.216 -15.235 1.00 0.00 O ATOM 0 H ASP A 97 -10.667 3.229 -12.668 1.00 0.00 H new ATOM 0 HA ASP A 97 -8.238 4.687 -11.958 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -10.581 5.045 -13.679 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -10.298 6.464 -12.690 1.00 0.00 H new ATOM 1435 N GLY A 98 -8.914 5.846 -9.875 1.00 0.00 N ATOM 1436 CA GLY A 98 -9.274 6.398 -8.582 1.00 0.00 C ATOM 1437 C GLY A 98 -9.817 5.346 -7.635 1.00 0.00 C ATOM 1438 O GLY A 98 -10.636 5.644 -6.766 1.00 0.00 O ATOM 0 H GLY A 98 -7.937 5.976 -10.139 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -8.399 6.869 -8.134 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -10.021 7.180 -8.719 1.00 0.00 H new ATOM 1442 N LYS A 99 -9.353 4.113 -7.801 1.00 0.00 N ATOM 1443 CA LYS A 99 -9.785 3.010 -6.958 1.00 0.00 C ATOM 1444 C LYS A 99 -8.979 1.773 -7.286 1.00 0.00 C ATOM 1445 O LYS A 99 -8.937 1.335 -8.436 1.00 0.00 O ATOM 1446 CB LYS A 99 -11.281 2.740 -7.131 1.00 0.00 C ATOM 1447 CG LYS A 99 -11.744 2.787 -8.576 1.00 0.00 C ATOM 1448 CD LYS A 99 -12.894 1.823 -8.825 1.00 0.00 C ATOM 1449 CE LYS A 99 -12.407 0.385 -8.898 1.00 0.00 C ATOM 1450 NZ LYS A 99 -12.451 -0.284 -7.568 1.00 0.00 N ATOM 0 H LYS A 99 -8.674 3.853 -8.516 1.00 0.00 H new ATOM 0 HA LYS A 99 -9.616 3.280 -5.916 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -11.515 1.760 -6.715 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -11.843 3.474 -6.554 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -12.057 3.801 -8.826 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -10.911 2.539 -9.234 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -13.630 1.919 -8.027 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -13.396 2.086 -9.756 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -13.023 -0.171 -9.605 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -11.386 0.366 -9.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -12.749 -1.273 -7.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -11.506 -0.257 -7.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -13.129 0.210 -6.953 1.00 0.00 H new ATOM 1464 N VAL A 100 -8.308 1.234 -6.285 1.00 0.00 N ATOM 1465 CA VAL A 100 -7.469 0.074 -6.497 1.00 0.00 C ATOM 1466 C VAL A 100 -7.403 -0.809 -5.256 1.00 0.00 C ATOM 1467 O VAL A 100 -7.630 -0.345 -4.138 1.00 0.00 O ATOM 1468 CB VAL A 100 -6.068 0.527 -6.933 1.00 0.00 C ATOM 1469 CG1 VAL A 100 -6.187 1.513 -8.086 1.00 0.00 C ATOM 1470 CG2 VAL A 100 -5.321 1.184 -5.795 1.00 0.00 C ATOM 0 H VAL A 100 -8.328 1.579 -5.325 1.00 0.00 H new ATOM 0 HA VAL A 100 -7.909 -0.532 -7.289 1.00 0.00 H new ATOM 0 HB VAL A 100 -5.511 -0.356 -7.246 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -5.192 1.834 -8.395 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -6.690 1.032 -8.925 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -6.765 2.380 -7.765 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -4.333 1.492 -6.138 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -5.875 2.058 -5.452 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -5.215 0.476 -4.973 1.00 0.00 H new ATOM 1480 N ARG A 101 -7.119 -2.092 -5.463 1.00 0.00 N ATOM 1481 CA ARG A 101 -7.058 -3.048 -4.359 1.00 0.00 C ATOM 1482 C ARG A 101 -5.645 -3.192 -3.807 1.00 0.00 C ATOM 1483 O ARG A 101 -4.662 -3.008 -4.523 1.00 0.00 O ATOM 1484 CB ARG A 101 -7.576 -4.413 -4.813 1.00 0.00 C ATOM 1485 CG ARG A 101 -7.589 -5.457 -3.708 1.00 0.00 C ATOM 1486 CD ARG A 101 -8.552 -5.077 -2.593 1.00 0.00 C ATOM 1487 NE ARG A 101 -9.947 -5.173 -3.017 1.00 0.00 N ATOM 1488 CZ ARG A 101 -10.570 -6.323 -3.262 1.00 0.00 C ATOM 1489 NH1 ARG A 101 -9.928 -7.477 -3.125 1.00 0.00 N ATOM 1490 NH2 ARG A 101 -11.840 -6.319 -3.644 1.00 0.00 N ATOM 0 H ARG A 101 -6.928 -2.493 -6.381 1.00 0.00 H new ATOM 0 HA ARG A 101 -7.691 -2.662 -3.560 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -8.587 -4.297 -5.204 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -6.956 -4.773 -5.634 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -7.874 -6.424 -4.123 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -6.584 -5.569 -3.300 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -8.388 -5.729 -1.735 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -8.342 -4.059 -2.264 1.00 0.00 H new ATOM 0 HE ARG A 101 -10.474 -4.307 -3.132 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -8.952 -7.486 -2.830 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -10.411 -8.355 -3.314 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -12.338 -5.435 -3.750 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -12.319 -7.200 -3.832 1.00 0.00 H new ATOM 1504 N VAL A 102 -5.560 -3.532 -2.523 1.00 0.00 N ATOM 1505 CA VAL A 102 -4.278 -3.717 -1.858 1.00 0.00 C ATOM 1506 C VAL A 102 -4.219 -5.072 -1.159 1.00 0.00 C ATOM 1507 O VAL A 102 -5.178 -5.491 -0.511 1.00 0.00 O ATOM 1508 CB VAL A 102 -4.009 -2.602 -0.829 1.00 0.00 C ATOM 1509 CG1 VAL A 102 -5.174 -2.475 0.137 1.00 0.00 C ATOM 1510 CG2 VAL A 102 -2.706 -2.859 -0.082 1.00 0.00 C ATOM 0 H VAL A 102 -6.370 -3.685 -1.922 1.00 0.00 H new ATOM 0 HA VAL A 102 -3.509 -3.674 -2.629 1.00 0.00 H new ATOM 0 HB VAL A 102 -3.908 -1.658 -1.364 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -4.966 -1.683 0.856 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -6.081 -2.233 -0.417 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -5.312 -3.418 0.666 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -2.536 -2.059 0.639 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -2.769 -3.813 0.442 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -1.879 -2.889 -0.792 1.00 0.00 H new ATOM 1520 N LEU A 103 -3.084 -5.749 -1.291 1.00 0.00 N ATOM 1521 CA LEU A 103 -2.894 -7.055 -0.669 1.00 0.00 C ATOM 1522 C LEU A 103 -1.723 -7.018 0.307 1.00 0.00 C ATOM 1523 O LEU A 103 -0.562 -7.034 -0.104 1.00 0.00 O ATOM 1524 CB LEU A 103 -2.652 -8.124 -1.737 1.00 0.00 C ATOM 1525 CG LEU A 103 -3.880 -8.493 -2.570 1.00 0.00 C ATOM 1526 CD1 LEU A 103 -3.459 -9.024 -3.933 1.00 0.00 C ATOM 1527 CD2 LEU A 103 -4.732 -9.519 -1.838 1.00 0.00 C ATOM 0 H LEU A 103 -2.281 -5.415 -1.823 1.00 0.00 H new ATOM 0 HA LEU A 103 -3.800 -7.306 -0.118 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.868 -7.775 -2.408 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -2.277 -9.025 -1.250 1.00 0.00 H new ATOM 0 HG LEU A 103 -4.478 -7.594 -2.720 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -4.345 -9.282 -4.513 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -2.890 -8.259 -4.461 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -2.840 -9.912 -3.802 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -5.602 -9.770 -2.446 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -4.144 -10.419 -1.658 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -5.062 -9.105 -0.885 1.00 0.00 H new ATOM 1539 N VAL A 104 -2.032 -6.957 1.596 1.00 0.00 N ATOM 1540 CA VAL A 104 -0.996 -6.907 2.624 1.00 0.00 C ATOM 1541 C VAL A 104 -0.909 -8.224 3.393 1.00 0.00 C ATOM 1542 O VAL A 104 -1.878 -8.979 3.471 1.00 0.00 O ATOM 1543 CB VAL A 104 -1.226 -5.732 3.616 1.00 0.00 C ATOM 1544 CG1 VAL A 104 -2.154 -4.685 3.015 1.00 0.00 C ATOM 1545 CG2 VAL A 104 -1.775 -6.219 4.952 1.00 0.00 C ATOM 0 H VAL A 104 -2.987 -6.941 1.955 1.00 0.00 H new ATOM 0 HA VAL A 104 -0.051 -6.741 2.107 1.00 0.00 H new ATOM 0 HB VAL A 104 -0.254 -5.274 3.801 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -2.298 -3.874 3.729 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -1.712 -4.289 2.101 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.117 -5.141 2.785 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -1.922 -5.368 5.617 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -2.728 -6.723 4.792 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -1.068 -6.915 5.404 1.00 0.00 H new ATOM 1555 N SER A 105 0.263 -8.485 3.963 1.00 0.00 N ATOM 1556 CA SER A 105 0.493 -9.699 4.737 1.00 0.00 C ATOM 1557 C SER A 105 1.757 -9.562 5.576 1.00 0.00 C ATOM 1558 O SER A 105 2.775 -9.057 5.104 1.00 0.00 O ATOM 1559 CB SER A 105 0.605 -10.911 3.813 1.00 0.00 C ATOM 1560 OG SER A 105 1.204 -10.560 2.577 1.00 0.00 O ATOM 0 H SER A 105 1.073 -7.868 3.902 1.00 0.00 H new ATOM 0 HA SER A 105 -0.357 -9.847 5.404 1.00 0.00 H new ATOM 0 HB2 SER A 105 1.195 -11.688 4.298 1.00 0.00 H new ATOM 0 HB3 SER A 105 -0.386 -11.328 3.634 1.00 0.00 H new ATOM 0 HG SER A 105 1.265 -11.354 2.006 1.00 0.00 H new ATOM 1566 N SER A 106 1.687 -10.008 6.825 1.00 0.00 N ATOM 1567 CA SER A 106 2.825 -9.923 7.728 1.00 0.00 C ATOM 1568 C SER A 106 3.871 -10.981 7.401 1.00 0.00 C ATOM 1569 O SER A 106 3.702 -12.158 7.718 1.00 0.00 O ATOM 1570 CB SER A 106 2.363 -10.081 9.177 1.00 0.00 C ATOM 1571 OG SER A 106 1.258 -9.239 9.455 1.00 0.00 O ATOM 0 H SER A 106 0.854 -10.432 7.234 1.00 0.00 H new ATOM 0 HA SER A 106 3.281 -8.941 7.599 1.00 0.00 H new ATOM 0 HB2 SER A 106 2.089 -11.119 9.363 1.00 0.00 H new ATOM 0 HB3 SER A 106 3.185 -9.842 9.852 1.00 0.00 H new ATOM 0 HG SER A 106 0.981 -9.360 10.387 1.00 0.00 H new ATOM 1577 N LEU A 107 4.965 -10.547 6.782 1.00 0.00 N ATOM 1578 CA LEU A 107 6.055 -11.446 6.429 1.00 0.00 C ATOM 1579 C LEU A 107 7.105 -11.456 7.534 1.00 0.00 C ATOM 1580 O LEU A 107 8.283 -11.717 7.289 1.00 0.00 O ATOM 1581 CB LEU A 107 6.692 -11.016 5.106 1.00 0.00 C ATOM 1582 CG LEU A 107 7.240 -12.156 4.247 1.00 0.00 C ATOM 1583 CD1 LEU A 107 7.231 -11.770 2.776 1.00 0.00 C ATOM 1584 CD2 LEU A 107 8.645 -12.532 4.693 1.00 0.00 C ATOM 0 H LEU A 107 5.119 -9.575 6.514 1.00 0.00 H new ATOM 0 HA LEU A 107 5.652 -12.452 6.313 1.00 0.00 H new ATOM 0 HB2 LEU A 107 5.950 -10.469 4.525 1.00 0.00 H new ATOM 0 HB3 LEU A 107 7.504 -10.321 5.321 1.00 0.00 H new ATOM 0 HG LEU A 107 6.594 -13.025 4.377 1.00 0.00 H new ATOM 0 HD11 LEU A 107 7.625 -12.594 2.181 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.210 -11.552 2.463 1.00 0.00 H new ATOM 0 HD13 LEU A 107 7.852 -10.887 2.628 1.00 0.00 H new ATOM 0 HD21 LEU A 107 9.019 -13.345 4.071 1.00 0.00 H new ATOM 0 HD22 LEU A 107 9.302 -11.668 4.594 1.00 0.00 H new ATOM 0 HD23 LEU A 107 8.622 -12.853 5.734 1.00 0.00 H new ATOM 1596 N THR A 108 6.666 -11.158 8.754 1.00 0.00 N ATOM 1597 CA THR A 108 7.549 -11.116 9.909 1.00 0.00 C ATOM 1598 C THR A 108 7.456 -12.407 10.715 1.00 0.00 C ATOM 1599 O THR A 108 8.429 -12.838 11.333 1.00 0.00 O ATOM 1600 CB THR A 108 7.176 -9.925 10.793 1.00 0.00 C ATOM 1601 OG1 THR A 108 5.928 -10.149 11.426 1.00 0.00 O ATOM 1602 CG2 THR A 108 7.070 -8.626 10.026 1.00 0.00 C ATOM 0 H THR A 108 5.692 -10.940 8.966 1.00 0.00 H new ATOM 0 HA THR A 108 8.575 -11.007 9.557 1.00 0.00 H new ATOM 0 HB THR A 108 7.982 -9.836 11.521 1.00 0.00 H new ATOM 0 HG1 THR A 108 5.704 -9.379 11.989 1.00 0.00 H new ATOM 0 HG21 THR A 108 6.803 -7.820 10.710 1.00 0.00 H new ATOM 0 HG22 THR A 108 8.028 -8.401 9.557 1.00 0.00 H new ATOM 0 HG23 THR A 108 6.303 -8.719 9.257 1.00 0.00 H new ATOM 1610 N GLY A 109 6.275 -13.015 10.705 1.00 0.00 N ATOM 1611 CA GLY A 109 6.064 -14.247 11.443 1.00 0.00 C ATOM 1612 C GLY A 109 4.868 -14.160 12.370 1.00 0.00 C ATOM 1613 O GLY A 109 4.260 -15.175 12.709 1.00 0.00 O ATOM 0 H GLY A 109 5.458 -12.676 10.198 1.00 0.00 H new ATOM 0 HA2 GLY A 109 5.919 -15.069 10.742 1.00 0.00 H new ATOM 0 HA3 GLY A 109 6.957 -14.478 12.025 1.00 0.00 H new ATOM 1617 N GLU A 110 4.530 -12.941 12.780 1.00 0.00 N ATOM 1618 CA GLU A 110 3.399 -12.717 13.672 1.00 0.00 C ATOM 1619 C GLU A 110 2.207 -12.151 12.901 1.00 0.00 C ATOM 1620 O GLU A 110 2.372 -11.579 11.823 1.00 0.00 O ATOM 1621 CB GLU A 110 3.793 -11.761 14.800 1.00 0.00 C ATOM 1622 CG GLU A 110 4.609 -10.567 14.331 1.00 0.00 C ATOM 1623 CD GLU A 110 4.876 -9.571 15.442 1.00 0.00 C ATOM 1624 OE1 GLU A 110 3.944 -9.291 16.226 1.00 0.00 O ATOM 1625 OE2 GLU A 110 6.016 -9.070 15.529 1.00 0.00 O ATOM 0 H GLU A 110 5.025 -12.092 12.507 1.00 0.00 H new ATOM 0 HA GLU A 110 3.110 -13.675 14.104 1.00 0.00 H new ATOM 0 HB2 GLU A 110 2.889 -11.402 15.292 1.00 0.00 H new ATOM 0 HB3 GLU A 110 4.366 -12.311 15.547 1.00 0.00 H new ATOM 0 HG2 GLU A 110 5.558 -10.917 13.926 1.00 0.00 H new ATOM 0 HG3 GLU A 110 4.081 -10.067 13.519 1.00 0.00 H new ATOM 1632 N PRO A 111 0.989 -12.305 13.443 1.00 0.00 N ATOM 1633 CA PRO A 111 -0.231 -11.806 12.798 1.00 0.00 C ATOM 1634 C PRO A 111 -0.263 -10.285 12.710 1.00 0.00 C ATOM 1635 O PRO A 111 0.698 -9.609 13.081 1.00 0.00 O ATOM 1636 CB PRO A 111 -1.355 -12.313 13.708 1.00 0.00 C ATOM 1637 CG PRO A 111 -0.705 -12.547 15.028 1.00 0.00 C ATOM 1638 CD PRO A 111 0.702 -12.976 14.724 1.00 0.00 C ATOM 0 HA PRO A 111 -0.312 -12.152 11.767 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -2.159 -11.581 13.788 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -1.796 -13.230 13.317 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -0.715 -11.641 15.634 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -1.234 -13.314 15.593 1.00 0.00 H new ATOM 0 HD2 PRO A 111 1.395 -12.665 15.506 1.00 0.00 H new ATOM 0 HD3 PRO A 111 0.783 -14.060 14.638 1.00 0.00 H new ATOM 1646 N LEU A 112 -1.378 -9.752 12.217 1.00 0.00 N ATOM 1647 CA LEU A 112 -1.545 -8.308 12.077 1.00 0.00 C ATOM 1648 C LEU A 112 -1.306 -7.598 13.411 1.00 0.00 C ATOM 1649 O LEU A 112 -2.067 -7.781 14.362 1.00 0.00 O ATOM 1650 CB LEU A 112 -2.951 -7.994 11.567 1.00 0.00 C ATOM 1651 CG LEU A 112 -3.083 -6.673 10.808 1.00 0.00 C ATOM 1652 CD1 LEU A 112 -3.924 -6.856 9.555 1.00 0.00 C ATOM 1653 CD2 LEU A 112 -3.682 -5.601 11.705 1.00 0.00 C ATOM 0 H LEU A 112 -2.181 -10.300 11.907 1.00 0.00 H new ATOM 0 HA LEU A 112 -0.809 -7.946 11.359 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -3.274 -8.805 10.914 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -3.634 -7.978 12.416 1.00 0.00 H new ATOM 0 HG LEU A 112 -2.087 -6.350 10.505 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -4.006 -5.905 9.029 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -3.451 -7.591 8.904 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -4.919 -7.204 9.832 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -3.769 -4.668 11.149 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -4.670 -5.917 12.040 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -3.037 -5.449 12.571 1.00 0.00 H new ATOM 1665 N PRO A 113 -0.246 -6.771 13.501 1.00 0.00 N ATOM 1666 CA PRO A 113 0.076 -6.036 14.729 1.00 0.00 C ATOM 1667 C PRO A 113 -1.006 -5.027 15.092 1.00 0.00 C ATOM 1668 O PRO A 113 -1.336 -4.848 16.265 1.00 0.00 O ATOM 1669 CB PRO A 113 1.388 -5.312 14.395 1.00 0.00 C ATOM 1670 CG PRO A 113 1.917 -5.992 13.177 1.00 0.00 C ATOM 1671 CD PRO A 113 0.715 -6.483 12.427 1.00 0.00 C ATOM 0 HA PRO A 113 0.155 -6.702 15.588 1.00 0.00 H new ATOM 0 HB2 PRO A 113 1.215 -4.252 14.209 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.096 -5.380 15.221 1.00 0.00 H new ATOM 0 HG2 PRO A 113 2.503 -5.303 12.568 1.00 0.00 H new ATOM 0 HG3 PRO A 113 2.575 -6.819 13.446 1.00 0.00 H new ATOM 0 HD2 PRO A 113 0.335 -5.731 11.736 1.00 0.00 H new ATOM 0 HD3 PRO A 113 0.941 -7.372 11.838 1.00 0.00 H new ATOM 1679 N ALA A 114 -1.557 -4.370 14.075 1.00 0.00 N ATOM 1680 CA ALA A 114 -2.604 -3.377 14.279 1.00 0.00 C ATOM 1681 C ALA A 114 -2.073 -2.173 15.045 1.00 0.00 C ATOM 1682 O ALA A 114 -0.970 -2.205 15.588 1.00 0.00 O ATOM 1683 CB ALA A 114 -3.783 -3.991 15.020 1.00 0.00 C ATOM 0 H ALA A 114 -1.294 -4.509 13.099 1.00 0.00 H new ATOM 0 HA ALA A 114 -2.941 -3.038 13.299 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -4.556 -3.236 15.164 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -4.188 -4.818 14.437 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -3.451 -4.360 15.990 1.00 0.00 H new ATOM 1689 N LYS A 115 -2.869 -1.109 15.086 1.00 0.00 N ATOM 1690 CA LYS A 115 -2.482 0.108 15.789 1.00 0.00 C ATOM 1691 C LYS A 115 -1.273 0.766 15.124 1.00 0.00 C ATOM 1692 O LYS A 115 -0.618 1.624 15.716 1.00 0.00 O ATOM 1693 CB LYS A 115 -2.174 -0.212 17.254 1.00 0.00 C ATOM 1694 CG LYS A 115 -3.128 0.451 18.232 1.00 0.00 C ATOM 1695 CD LYS A 115 -4.334 -0.431 18.518 1.00 0.00 C ATOM 1696 CE LYS A 115 -5.518 -0.054 17.643 1.00 0.00 C ATOM 1697 NZ LYS A 115 -6.814 -0.254 18.349 1.00 0.00 N ATOM 0 H LYS A 115 -3.786 -1.066 14.641 1.00 0.00 H new ATOM 0 HA LYS A 115 -3.314 0.811 15.744 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.212 -1.292 17.397 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.156 0.104 17.481 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.604 0.667 19.163 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -3.462 1.406 17.826 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -4.072 -1.475 18.347 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -4.612 -0.340 19.568 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -5.427 0.989 17.338 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -5.503 -0.654 16.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -7.521 0.409 17.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -7.142 -1.230 18.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -6.686 -0.080 19.366 1.00 0.00 H new ATOM 1711 N GLU A 116 -0.986 0.361 13.888 1.00 0.00 N ATOM 1712 CA GLU A 116 0.139 0.911 13.140 1.00 0.00 C ATOM 1713 C GLU A 116 -0.182 0.946 11.649 1.00 0.00 C ATOM 1714 O GLU A 116 -1.333 0.771 11.250 1.00 0.00 O ATOM 1715 CB GLU A 116 1.406 0.081 13.379 1.00 0.00 C ATOM 1716 CG GLU A 116 1.533 -0.462 14.793 1.00 0.00 C ATOM 1717 CD GLU A 116 2.971 -0.748 15.180 1.00 0.00 C ATOM 1718 OE1 GLU A 116 3.607 -1.594 14.515 1.00 0.00 O ATOM 1719 OE2 GLU A 116 3.462 -0.128 16.145 1.00 0.00 O ATOM 0 H GLU A 116 -1.519 -0.348 13.384 1.00 0.00 H new ATOM 0 HA GLU A 116 0.315 1.928 13.491 1.00 0.00 H new ATOM 0 HB2 GLU A 116 1.419 -0.754 12.678 1.00 0.00 H new ATOM 0 HB3 GLU A 116 2.278 0.696 13.158 1.00 0.00 H new ATOM 0 HG2 GLU A 116 1.108 0.256 15.494 1.00 0.00 H new ATOM 0 HG3 GLU A 116 0.948 -1.377 14.881 1.00 0.00 H new ATOM 1726 N VAL A 117 0.840 1.166 10.830 1.00 0.00 N ATOM 1727 CA VAL A 117 0.659 1.213 9.386 1.00 0.00 C ATOM 1728 C VAL A 117 0.549 -0.194 8.808 1.00 0.00 C ATOM 1729 O VAL A 117 1.544 -0.910 8.699 1.00 0.00 O ATOM 1730 CB VAL A 117 1.821 1.951 8.695 1.00 0.00 C ATOM 1731 CG1 VAL A 117 1.530 2.143 7.215 1.00 0.00 C ATOM 1732 CG2 VAL A 117 2.083 3.286 9.374 1.00 0.00 C ATOM 0 H VAL A 117 1.800 1.314 11.141 1.00 0.00 H new ATOM 0 HA VAL A 117 -0.266 1.758 9.198 1.00 0.00 H new ATOM 0 HB VAL A 117 2.720 1.341 8.786 1.00 0.00 H new ATOM 0 HG11 VAL A 117 2.363 2.666 6.745 1.00 0.00 H new ATOM 0 HG12 VAL A 117 1.399 1.170 6.741 1.00 0.00 H new ATOM 0 HG13 VAL A 117 0.619 2.730 7.096 1.00 0.00 H new ATOM 0 HG21 VAL A 117 2.907 3.794 8.873 1.00 0.00 H new ATOM 0 HG22 VAL A 117 1.187 3.905 9.318 1.00 0.00 H new ATOM 0 HG23 VAL A 117 2.343 3.118 10.419 1.00 0.00 H new ATOM 1742 N LEU A 118 -0.668 -0.587 8.445 1.00 0.00 N ATOM 1743 CA LEU A 118 -0.906 -1.912 7.886 1.00 0.00 C ATOM 1744 C LEU A 118 -0.688 -1.918 6.375 1.00 0.00 C ATOM 1745 O LEU A 118 -0.281 -2.931 5.805 1.00 0.00 O ATOM 1746 CB LEU A 118 -2.325 -2.385 8.214 1.00 0.00 C ATOM 1747 CG LEU A 118 -2.415 -3.723 8.954 1.00 0.00 C ATOM 1748 CD1 LEU A 118 -1.623 -4.802 8.228 1.00 0.00 C ATOM 1749 CD2 LEU A 118 -1.928 -3.574 10.386 1.00 0.00 C ATOM 0 H LEU A 118 -1.503 -0.007 8.528 1.00 0.00 H new ATOM 0 HA LEU A 118 -0.191 -2.599 8.338 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.814 -1.621 8.818 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -2.888 -2.465 7.284 1.00 0.00 H new ATOM 0 HG LEU A 118 -3.461 -4.029 8.975 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.703 -5.742 8.774 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.022 -4.932 7.222 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -0.576 -4.506 8.167 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -1.999 -4.535 10.896 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -0.890 -3.240 10.385 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -2.545 -2.841 10.906 1.00 0.00 H new ATOM 1761 N ALA A 119 -0.961 -0.788 5.727 1.00 0.00 N ATOM 1762 CA ALA A 119 -0.786 -0.689 4.279 1.00 0.00 C ATOM 1763 C ALA A 119 -0.901 0.750 3.802 1.00 0.00 C ATOM 1764 O ALA A 119 -1.798 1.483 4.217 1.00 0.00 O ATOM 1765 CB ALA A 119 -1.803 -1.564 3.563 1.00 0.00 C ATOM 0 H ALA A 119 -1.300 0.063 6.175 1.00 0.00 H new ATOM 0 HA ALA A 119 0.217 -1.041 4.040 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -1.661 -1.480 2.486 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -1.668 -2.602 3.867 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -2.810 -1.238 3.822 1.00 0.00 H new ATOM 1771 N LYS A 120 0.015 1.147 2.923 1.00 0.00 N ATOM 1772 CA LYS A 120 0.021 2.503 2.388 1.00 0.00 C ATOM 1773 C LYS A 120 -0.012 2.505 0.862 1.00 0.00 C ATOM 1774 O LYS A 120 0.955 2.113 0.211 1.00 0.00 O ATOM 1775 CB LYS A 120 1.260 3.263 2.868 1.00 0.00 C ATOM 1776 CG LYS A 120 1.592 3.043 4.338 1.00 0.00 C ATOM 1777 CD LYS A 120 3.086 2.851 4.551 1.00 0.00 C ATOM 1778 CE LYS A 120 3.568 1.537 3.963 1.00 0.00 C ATOM 1779 NZ LYS A 120 5.030 1.341 4.169 1.00 0.00 N ATOM 0 H LYS A 120 0.761 0.549 2.567 1.00 0.00 H new ATOM 0 HA LYS A 120 -0.878 2.999 2.754 1.00 0.00 H new ATOM 0 HB2 LYS A 120 2.115 2.961 2.264 1.00 0.00 H new ATOM 0 HB3 LYS A 120 1.109 4.329 2.696 1.00 0.00 H new ATOM 0 HG2 LYS A 120 1.247 3.897 4.921 1.00 0.00 H new ATOM 0 HG3 LYS A 120 1.056 2.168 4.706 1.00 0.00 H new ATOM 0 HD2 LYS A 120 3.629 3.677 4.092 1.00 0.00 H new ATOM 0 HD3 LYS A 120 3.309 2.877 5.618 1.00 0.00 H new ATOM 0 HE2 LYS A 120 3.023 0.712 4.422 1.00 0.00 H new ATOM 0 HE3 LYS A 120 3.345 1.513 2.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 5.349 0.514 3.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 5.543 2.186 3.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 5.220 1.186 5.180 1.00 0.00 H new ATOM 1793 N VAL A 121 -1.121 2.973 0.299 1.00 0.00 N ATOM 1794 CA VAL A 121 -1.265 3.057 -1.149 1.00 0.00 C ATOM 1795 C VAL A 121 -0.999 4.488 -1.605 1.00 0.00 C ATOM 1796 O VAL A 121 -1.880 5.345 -1.546 1.00 0.00 O ATOM 1797 CB VAL A 121 -2.670 2.611 -1.613 1.00 0.00 C ATOM 1798 CG1 VAL A 121 -2.948 3.062 -3.043 1.00 0.00 C ATOM 1799 CG2 VAL A 121 -2.819 1.101 -1.491 1.00 0.00 C ATOM 0 H VAL A 121 -1.933 3.300 0.823 1.00 0.00 H new ATOM 0 HA VAL A 121 -0.538 2.381 -1.599 1.00 0.00 H new ATOM 0 HB VAL A 121 -3.404 3.087 -0.963 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -3.944 2.734 -3.341 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -2.893 4.149 -3.099 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -2.207 2.626 -3.713 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -3.815 0.806 -1.822 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -2.070 0.610 -2.112 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -2.680 0.804 -0.451 1.00 0.00 H new ATOM 1809 N VAL A 122 0.230 4.744 -2.036 1.00 0.00 N ATOM 1810 CA VAL A 122 0.627 6.076 -2.473 1.00 0.00 C ATOM 1811 C VAL A 122 0.071 6.415 -3.852 1.00 0.00 C ATOM 1812 O VAL A 122 0.376 5.746 -4.839 1.00 0.00 O ATOM 1813 CB VAL A 122 2.164 6.214 -2.503 1.00 0.00 C ATOM 1814 CG1 VAL A 122 2.757 5.879 -1.141 1.00 0.00 C ATOM 1815 CG2 VAL A 122 2.767 5.327 -3.585 1.00 0.00 C ATOM 0 H VAL A 122 0.970 4.045 -2.092 1.00 0.00 H new ATOM 0 HA VAL A 122 0.210 6.776 -1.749 1.00 0.00 H new ATOM 0 HB VAL A 122 2.409 7.250 -2.740 1.00 0.00 H new ATOM 0 HG11 VAL A 122 3.841 5.982 -1.181 1.00 0.00 H new ATOM 0 HG12 VAL A 122 2.355 6.561 -0.392 1.00 0.00 H new ATOM 0 HG13 VAL A 122 2.499 4.854 -0.874 1.00 0.00 H new ATOM 0 HG21 VAL A 122 3.851 5.441 -3.587 1.00 0.00 H new ATOM 0 HG22 VAL A 122 2.512 4.286 -3.386 1.00 0.00 H new ATOM 0 HG23 VAL A 122 2.370 5.618 -4.557 1.00 0.00 H new ATOM 1825 N LEU A 123 -0.729 7.476 -3.915 1.00 0.00 N ATOM 1826 CA LEU A 123 -1.304 7.923 -5.177 1.00 0.00 C ATOM 1827 C LEU A 123 -0.329 8.870 -5.873 1.00 0.00 C ATOM 1828 O LEU A 123 0.672 9.274 -5.283 1.00 0.00 O ATOM 1829 CB LEU A 123 -2.653 8.612 -4.944 1.00 0.00 C ATOM 1830 CG LEU A 123 -3.805 7.683 -4.538 1.00 0.00 C ATOM 1831 CD1 LEU A 123 -3.857 6.451 -5.438 1.00 0.00 C ATOM 1832 CD2 LEU A 123 -3.669 7.272 -3.080 1.00 0.00 C ATOM 0 H LEU A 123 -0.993 8.040 -3.107 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.478 7.057 -5.815 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -2.527 9.367 -4.168 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -2.936 9.137 -5.856 1.00 0.00 H new ATOM 0 HG LEU A 123 -4.740 8.230 -4.659 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -4.682 5.809 -5.129 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -4.007 6.762 -6.472 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -2.919 5.901 -5.357 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -4.494 6.613 -2.809 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -2.724 6.748 -2.936 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -3.691 8.160 -2.448 1.00 0.00 H new ATOM 1844 N ARG A 124 -0.599 9.199 -7.131 1.00 0.00 N ATOM 1845 CA ARG A 124 0.293 10.074 -7.888 1.00 0.00 C ATOM 1846 C ARG A 124 -0.284 11.476 -8.081 1.00 0.00 C ATOM 1847 O ARG A 124 -1.326 11.653 -8.713 1.00 0.00 O ATOM 1848 CB ARG A 124 0.606 9.455 -9.252 1.00 0.00 C ATOM 1849 CG ARG A 124 1.572 10.281 -10.088 1.00 0.00 C ATOM 1850 CD ARG A 124 2.967 9.676 -10.091 1.00 0.00 C ATOM 1851 NE ARG A 124 3.717 10.026 -8.888 1.00 0.00 N ATOM 1852 CZ ARG A 124 4.982 9.672 -8.675 1.00 0.00 C ATOM 1853 NH1 ARG A 124 5.642 8.962 -9.581 1.00 0.00 N ATOM 1854 NH2 ARG A 124 5.591 10.031 -7.552 1.00 0.00 N ATOM 0 H ARG A 124 -1.419 8.878 -7.645 1.00 0.00 H new ATOM 0 HA ARG A 124 1.208 10.175 -7.305 1.00 0.00 H new ATOM 0 HB2 ARG A 124 1.027 8.461 -9.103 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -0.324 9.328 -9.806 1.00 0.00 H new ATOM 0 HG2 ARG A 124 1.202 10.350 -11.111 1.00 0.00 H new ATOM 0 HG3 ARG A 124 1.616 11.297 -9.696 1.00 0.00 H new ATOM 0 HD2 ARG A 124 2.892 8.591 -10.169 1.00 0.00 H new ATOM 0 HD3 ARG A 124 3.510 10.022 -10.970 1.00 0.00 H new ATOM 0 HE ARG A 124 3.244 10.574 -8.169 1.00 0.00 H new ATOM 0 HH11 ARG A 124 5.180 8.684 -10.447 1.00 0.00 H new ATOM 0 HH12 ARG A 124 6.611 8.694 -9.412 1.00 0.00 H new ATOM 0 HH21 ARG A 124 5.090 10.578 -6.852 1.00 0.00 H new ATOM 0 HH22 ARG A 124 6.561 9.760 -7.388 1.00 0.00 H new ATOM 1868 N ALA A 125 0.433 12.470 -7.562 1.00 0.00 N ATOM 1869 CA ALA A 125 0.038 13.870 -7.697 1.00 0.00 C ATOM 1870 C ALA A 125 0.631 14.443 -8.977 1.00 0.00 C ATOM 1871 O ALA A 125 1.503 15.306 -8.941 1.00 0.00 O ATOM 1872 CB ALA A 125 0.507 14.669 -6.490 1.00 0.00 C ATOM 0 H ALA A 125 1.298 12.330 -7.040 1.00 0.00 H new ATOM 0 HA ALA A 125 -1.049 13.934 -7.748 1.00 0.00 H new ATOM 0 HB1 ALA A 125 0.206 15.710 -6.604 1.00 0.00 H new ATOM 0 HB2 ALA A 125 0.059 14.258 -5.585 1.00 0.00 H new ATOM 0 HB3 ALA A 125 1.593 14.611 -6.415 1.00 0.00 H new ATOM 1878 N GLU A 126 0.143 13.962 -10.111 1.00 0.00 N ATOM 1879 CA GLU A 126 0.614 14.431 -11.408 1.00 0.00 C ATOM 1880 C GLU A 126 -0.196 15.643 -11.828 1.00 0.00 C ATOM 1881 O GLU A 126 0.102 16.297 -12.827 1.00 0.00 O ATOM 1882 CB GLU A 126 0.493 13.324 -12.456 1.00 0.00 C ATOM 1883 CG GLU A 126 1.737 12.458 -12.570 1.00 0.00 C ATOM 1884 CD GLU A 126 2.662 12.909 -13.683 1.00 0.00 C ATOM 1885 OE1 GLU A 126 2.471 12.461 -14.832 1.00 0.00 O ATOM 1886 OE2 GLU A 126 3.578 13.713 -13.405 1.00 0.00 O ATOM 0 H GLU A 126 -0.581 13.245 -10.160 1.00 0.00 H new ATOM 0 HA GLU A 126 1.665 14.708 -11.327 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -0.359 12.691 -12.208 1.00 0.00 H new ATOM 0 HB3 GLU A 126 0.283 13.774 -13.426 1.00 0.00 H new ATOM 0 HG2 GLU A 126 2.277 12.478 -11.623 1.00 0.00 H new ATOM 0 HG3 GLU A 126 1.440 11.424 -12.746 1.00 0.00 H new ATOM 1893 N ALA A 127 -1.215 15.938 -11.036 1.00 0.00 N ATOM 1894 CA ALA A 127 -2.077 17.066 -11.276 1.00 0.00 C ATOM 1895 C ALA A 127 -2.847 17.396 -10.018 1.00 0.00 C ATOM 1896 O ALA A 127 -3.521 16.548 -9.436 1.00 0.00 O ATOM 1897 CB ALA A 127 -3.021 16.810 -12.436 1.00 0.00 C ATOM 0 H ALA A 127 -1.461 15.395 -10.208 1.00 0.00 H new ATOM 0 HA ALA A 127 -1.457 17.920 -11.549 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -3.656 17.683 -12.588 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -2.443 16.620 -13.340 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -3.643 15.943 -12.214 1.00 0.00 H new ATOM 1903 N LYS A 128 -2.706 18.632 -9.598 1.00 0.00 N ATOM 1904 CA LYS A 128 -3.345 19.125 -8.388 1.00 0.00 C ATOM 1905 C LYS A 128 -4.777 18.609 -8.234 1.00 0.00 C ATOM 1906 O LYS A 128 -5.423 18.208 -9.202 1.00 0.00 O ATOM 1907 CB LYS A 128 -3.313 20.659 -8.372 1.00 0.00 C ATOM 1908 CG LYS A 128 -4.323 21.304 -7.433 1.00 0.00 C ATOM 1909 CD LYS A 128 -4.041 22.785 -7.246 1.00 0.00 C ATOM 1910 CE LYS A 128 -4.582 23.605 -8.406 1.00 0.00 C ATOM 1911 NZ LYS A 128 -5.898 24.225 -8.085 1.00 0.00 N ATOM 0 H LYS A 128 -2.144 19.331 -10.084 1.00 0.00 H new ATOM 0 HA LYS A 128 -2.783 18.743 -7.536 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -2.313 20.986 -8.088 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -3.492 21.024 -9.383 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -5.329 21.171 -7.832 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -4.295 20.802 -6.466 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -4.492 23.128 -6.315 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -2.966 22.944 -7.157 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -3.866 24.386 -8.663 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -4.686 22.967 -9.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -6.104 24.978 -8.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -6.643 23.501 -8.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -5.867 24.629 -7.127 1.00 0.00 H new ATOM 1925 N ALA A 129 -5.252 18.625 -6.991 1.00 0.00 N ATOM 1926 CA ALA A 129 -6.588 18.168 -6.652 1.00 0.00 C ATOM 1927 C ALA A 129 -6.895 18.508 -5.199 1.00 0.00 C ATOM 1928 O ALA A 129 -7.161 17.626 -4.381 1.00 0.00 O ATOM 1929 CB ALA A 129 -6.710 16.669 -6.887 1.00 0.00 C ATOM 0 H ALA A 129 -4.715 18.958 -6.190 1.00 0.00 H new ATOM 0 HA ALA A 129 -7.311 18.674 -7.292 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -7.717 16.341 -6.629 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -6.515 16.448 -7.936 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -5.986 16.143 -6.265 1.00 0.00 H new ATOM 1935 N GLU A 130 -6.833 19.795 -4.880 1.00 0.00 N ATOM 1936 CA GLU A 130 -7.079 20.261 -3.520 1.00 0.00 C ATOM 1937 C GLU A 130 -8.441 19.798 -3.016 1.00 0.00 C ATOM 1938 O GLU A 130 -9.480 20.162 -3.568 1.00 0.00 O ATOM 1939 CB GLU A 130 -6.994 21.787 -3.458 1.00 0.00 C ATOM 1940 CG GLU A 130 -7.849 22.487 -4.502 1.00 0.00 C ATOM 1941 CD GLU A 130 -7.036 22.997 -5.675 1.00 0.00 C ATOM 1942 OE1 GLU A 130 -6.415 24.072 -5.546 1.00 0.00 O ATOM 1943 OE2 GLU A 130 -7.019 22.319 -6.725 1.00 0.00 O ATOM 0 H GLU A 130 -6.614 20.536 -5.546 1.00 0.00 H new ATOM 0 HA GLU A 130 -6.311 19.832 -2.876 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -7.301 22.120 -2.466 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -5.955 22.090 -3.588 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -8.610 21.796 -4.865 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -8.372 23.322 -4.037 1.00 0.00 H new ATOM 1950 N GLY A 131 -8.421 18.986 -1.963 1.00 0.00 N ATOM 1951 CA GLY A 131 -9.651 18.472 -1.391 1.00 0.00 C ATOM 1952 C GLY A 131 -10.113 17.193 -2.063 1.00 0.00 C ATOM 1953 O GLY A 131 -11.286 16.831 -1.979 1.00 0.00 O ATOM 0 H GLY A 131 -7.570 18.674 -1.495 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -9.504 18.287 -0.327 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -10.432 19.227 -1.478 1.00 0.00 H new ATOM 1957 N SER A 132 -9.187 16.503 -2.725 1.00 0.00 N ATOM 1958 CA SER A 132 -9.510 15.254 -3.406 1.00 0.00 C ATOM 1959 C SER A 132 -9.775 14.149 -2.388 1.00 0.00 C ATOM 1960 O SER A 132 -9.024 13.178 -2.295 1.00 0.00 O ATOM 1961 CB SER A 132 -8.370 14.844 -4.341 1.00 0.00 C ATOM 1962 OG SER A 132 -8.473 13.479 -4.707 1.00 0.00 O ATOM 0 H SER A 132 -8.211 16.787 -2.804 1.00 0.00 H new ATOM 0 HA SER A 132 -10.411 15.409 -4.000 1.00 0.00 H new ATOM 0 HB2 SER A 132 -8.389 15.466 -5.236 1.00 0.00 H new ATOM 0 HB3 SER A 132 -7.413 15.020 -3.851 1.00 0.00 H new ATOM 0 HG SER A 132 -8.343 12.917 -3.915 1.00 0.00 H new ATOM 1968 N ASN A 133 -10.847 14.315 -1.619 1.00 0.00 N ATOM 1969 CA ASN A 133 -11.225 13.358 -0.590 1.00 0.00 C ATOM 1970 C ASN A 133 -11.101 11.911 -1.063 1.00 0.00 C ATOM 1971 O ASN A 133 -11.588 11.547 -2.133 1.00 0.00 O ATOM 1972 CB ASN A 133 -12.655 13.634 -0.140 1.00 0.00 C ATOM 1973 CG ASN A 133 -12.833 13.472 1.340 1.00 0.00 C ATOM 1974 OD1 ASN A 133 -12.650 12.390 1.897 1.00 0.00 O ATOM 1975 ND2 ASN A 133 -13.196 14.563 1.986 1.00 0.00 N ATOM 0 H ASN A 133 -11.475 15.115 -1.693 1.00 0.00 H new ATOM 0 HA ASN A 133 -10.535 13.484 0.244 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -12.933 14.648 -0.427 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -13.333 12.958 -0.660 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -13.338 14.534 2.996 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -13.335 15.435 1.476 1.00 0.00 H new ATOM 1982 N LEU A 134 -10.459 11.093 -0.236 1.00 0.00 N ATOM 1983 CA LEU A 134 -10.276 9.678 -0.531 1.00 0.00 C ATOM 1984 C LEU A 134 -11.093 8.845 0.448 1.00 0.00 C ATOM 1985 O LEU A 134 -11.320 9.261 1.584 1.00 0.00 O ATOM 1986 CB LEU A 134 -8.797 9.295 -0.441 1.00 0.00 C ATOM 1987 CG LEU A 134 -7.816 10.351 -0.956 1.00 0.00 C ATOM 1988 CD1 LEU A 134 -6.516 10.299 -0.169 1.00 0.00 C ATOM 1989 CD2 LEU A 134 -7.553 10.154 -2.439 1.00 0.00 C ATOM 0 H LEU A 134 -10.054 11.390 0.652 1.00 0.00 H new ATOM 0 HA LEU A 134 -10.618 9.482 -1.547 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -8.558 9.077 0.600 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -8.642 8.374 -1.003 1.00 0.00 H new ATOM 0 HG LEU A 134 -8.262 11.335 -0.815 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -5.830 11.056 -0.549 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -6.721 10.490 0.884 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -6.064 9.313 -0.278 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -6.853 10.913 -2.788 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -7.127 9.164 -2.605 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -8.490 10.243 -2.990 1.00 0.00 H new ATOM 2001 N SER A 135 -11.542 7.677 0.012 1.00 0.00 N ATOM 2002 CA SER A 135 -12.344 6.812 0.872 1.00 0.00 C ATOM 2003 C SER A 135 -11.868 5.368 0.815 1.00 0.00 C ATOM 2004 O SER A 135 -11.772 4.773 -0.259 1.00 0.00 O ATOM 2005 CB SER A 135 -13.819 6.891 0.470 1.00 0.00 C ATOM 2006 OG SER A 135 -13.958 7.129 -0.919 1.00 0.00 O ATOM 0 H SER A 135 -11.368 7.307 -0.922 1.00 0.00 H new ATOM 0 HA SER A 135 -12.227 7.164 1.897 1.00 0.00 H new ATOM 0 HB2 SER A 135 -14.321 5.960 0.734 1.00 0.00 H new ATOM 0 HB3 SER A 135 -14.309 7.688 1.029 1.00 0.00 H new ATOM 0 HG SER A 135 -14.909 7.173 -1.150 1.00 0.00 H new ATOM 2012 N VAL A 136 -11.582 4.806 1.985 1.00 0.00 N ATOM 2013 CA VAL A 136 -11.128 3.426 2.079 1.00 0.00 C ATOM 2014 C VAL A 136 -12.166 2.565 2.789 1.00 0.00 C ATOM 2015 O VAL A 136 -12.195 2.493 4.017 1.00 0.00 O ATOM 2016 CB VAL A 136 -9.788 3.323 2.832 1.00 0.00 C ATOM 2017 CG1 VAL A 136 -8.673 3.980 2.033 1.00 0.00 C ATOM 2018 CG2 VAL A 136 -9.903 3.945 4.218 1.00 0.00 C ATOM 0 H VAL A 136 -11.657 5.287 2.881 1.00 0.00 H new ATOM 0 HA VAL A 136 -10.987 3.064 1.060 1.00 0.00 H new ATOM 0 HB VAL A 136 -9.541 2.268 2.953 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -7.735 3.897 2.581 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -8.575 3.482 1.068 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -8.909 5.032 1.876 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -8.947 3.863 4.734 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -10.175 4.996 4.124 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -10.670 3.422 4.789 1.00 0.00 H new ATOM 2028 N THR A 137 -13.019 1.916 2.006 1.00 0.00 N ATOM 2029 CA THR A 137 -14.061 1.059 2.556 1.00 0.00 C ATOM 2030 C THR A 137 -13.658 -0.409 2.443 1.00 0.00 C ATOM 2031 O THR A 137 -12.476 -0.721 2.305 1.00 0.00 O ATOM 2032 CB THR A 137 -15.386 1.305 1.827 1.00 0.00 C ATOM 2033 OG1 THR A 137 -15.369 0.710 0.541 1.00 0.00 O ATOM 2034 CG2 THR A 137 -15.707 2.774 1.649 1.00 0.00 C ATOM 0 H THR A 137 -13.009 1.967 0.987 1.00 0.00 H new ATOM 0 HA THR A 137 -14.191 1.301 3.611 1.00 0.00 H new ATOM 0 HB THR A 137 -16.152 0.856 2.460 1.00 0.00 H new ATOM 0 HG1 THR A 137 -16.224 0.877 0.092 1.00 0.00 H new ATOM 0 HG21 THR A 137 -16.658 2.878 1.126 1.00 0.00 H new ATOM 0 HG22 THR A 137 -15.776 3.252 2.626 1.00 0.00 H new ATOM 0 HG23 THR A 137 -14.919 3.251 1.067 1.00 0.00 H new ATOM 2042 N ASN A 138 -14.644 -1.308 2.503 1.00 0.00 N ATOM 2043 CA ASN A 138 -14.396 -2.752 2.404 1.00 0.00 C ATOM 2044 C ASN A 138 -13.176 -3.181 3.220 1.00 0.00 C ATOM 2045 O ASN A 138 -12.576 -4.221 2.951 1.00 0.00 O ATOM 2046 CB ASN A 138 -14.221 -3.180 0.938 1.00 0.00 C ATOM 2047 CG ASN A 138 -14.136 -2.001 -0.011 1.00 0.00 C ATOM 2048 OD1 ASN A 138 -12.987 -1.342 -0.019 1.00 0.00 O flip ATOM 2049 ND2 ASN A 138 -15.089 -1.689 -0.726 1.00 0.00 N flip ATOM 0 H ASN A 138 -15.627 -1.061 2.620 1.00 0.00 H new ATOM 0 HA ASN A 138 -15.271 -3.252 2.819 1.00 0.00 H new ATOM 0 HB2 ASN A 138 -13.317 -3.781 0.845 1.00 0.00 H new ATOM 0 HB3 ASN A 138 -15.058 -3.815 0.647 1.00 0.00 H new ATOM 0 HD21 ASN A 138 -15.955 -2.227 -0.685 1.00 0.00 H new ATOM 0 HD22 ASN A 138 -15.013 -0.893 -1.359 1.00 0.00 H new ATOM 2056 N SER A 139 -12.817 -2.379 4.217 1.00 0.00 N ATOM 2057 CA SER A 139 -11.675 -2.680 5.070 1.00 0.00 C ATOM 2058 C SER A 139 -11.906 -3.984 5.827 1.00 0.00 C ATOM 2059 O SER A 139 -12.337 -3.977 6.981 1.00 0.00 O ATOM 2060 CB SER A 139 -11.433 -1.532 6.054 1.00 0.00 C ATOM 2061 OG SER A 139 -12.574 -0.697 6.155 1.00 0.00 O ATOM 0 H SER A 139 -13.302 -1.514 4.454 1.00 0.00 H new ATOM 0 HA SER A 139 -10.792 -2.795 4.441 1.00 0.00 H new ATOM 0 HB2 SER A 139 -11.186 -1.936 7.036 1.00 0.00 H new ATOM 0 HB3 SER A 139 -10.576 -0.944 5.727 1.00 0.00 H new ATOM 0 HG SER A 139 -12.922 -0.728 7.070 1.00 0.00 H new ATOM 2067 N SER A 140 -11.625 -5.099 5.164 1.00 0.00 N ATOM 2068 CA SER A 140 -11.809 -6.416 5.759 1.00 0.00 C ATOM 2069 C SER A 140 -10.468 -7.105 5.993 1.00 0.00 C ATOM 2070 O SER A 140 -9.557 -7.008 5.172 1.00 0.00 O ATOM 2071 CB SER A 140 -12.689 -7.276 4.854 1.00 0.00 C ATOM 2072 OG SER A 140 -13.294 -6.497 3.835 1.00 0.00 O ATOM 0 H SER A 140 -11.267 -5.117 4.209 1.00 0.00 H new ATOM 0 HA SER A 140 -12.298 -6.290 6.725 1.00 0.00 H new ATOM 0 HB2 SER A 140 -12.089 -8.066 4.403 1.00 0.00 H new ATOM 0 HB3 SER A 140 -13.461 -7.763 5.450 1.00 0.00 H new ATOM 0 HG SER A 140 -12.625 -5.900 3.439 1.00 0.00 H new ATOM 2078 N VAL A 141 -10.356 -7.804 7.119 1.00 0.00 N ATOM 2079 CA VAL A 141 -9.128 -8.511 7.460 1.00 0.00 C ATOM 2080 C VAL A 141 -9.372 -10.014 7.572 1.00 0.00 C ATOM 2081 O VAL A 141 -10.471 -10.450 7.913 1.00 0.00 O ATOM 2082 CB VAL A 141 -8.522 -7.987 8.780 1.00 0.00 C ATOM 2083 CG1 VAL A 141 -9.329 -8.462 9.982 1.00 0.00 C ATOM 2084 CG2 VAL A 141 -7.067 -8.414 8.896 1.00 0.00 C ATOM 0 H VAL A 141 -11.101 -7.895 7.810 1.00 0.00 H new ATOM 0 HA VAL A 141 -8.419 -8.325 6.653 1.00 0.00 H new ATOM 0 HB VAL A 141 -8.562 -6.898 8.768 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -8.879 -8.078 10.897 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -10.353 -8.097 9.900 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -9.333 -9.552 10.010 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -6.651 -8.038 9.831 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -7.005 -9.502 8.882 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -6.501 -8.008 8.058 1.00 0.00 H new ATOM 2094 N GLY A 142 -8.341 -10.799 7.279 1.00 0.00 N ATOM 2095 CA GLY A 142 -8.467 -12.243 7.348 1.00 0.00 C ATOM 2096 C GLY A 142 -8.249 -12.788 8.746 1.00 0.00 C ATOM 2097 O GLY A 142 -7.110 -12.954 9.183 1.00 0.00 O ATOM 0 H GLY A 142 -7.421 -10.462 6.995 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -9.459 -12.533 7.001 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -7.746 -12.698 6.669 1.00 0.00 H new ATOM 2101 N ASP A 143 -9.344 -13.075 9.448 1.00 0.00 N ATOM 2102 CA ASP A 143 -9.272 -13.612 10.803 1.00 0.00 C ATOM 2103 C ASP A 143 -8.328 -14.812 10.866 1.00 0.00 C ATOM 2104 O ASP A 143 -8.002 -15.412 9.842 1.00 0.00 O ATOM 2105 CB ASP A 143 -10.667 -14.022 11.282 1.00 0.00 C ATOM 2106 CG ASP A 143 -10.660 -14.570 12.695 1.00 0.00 C ATOM 2107 OD1 ASP A 143 -9.806 -14.138 13.496 1.00 0.00 O ATOM 2108 OD2 ASP A 143 -11.510 -15.433 13.002 1.00 0.00 O ATOM 0 H ASP A 143 -10.293 -12.944 9.098 1.00 0.00 H new ATOM 0 HA ASP A 143 -8.882 -12.832 11.457 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -11.332 -13.159 11.234 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -11.073 -14.775 10.606 1.00 0.00 H new ATOM 2113 N GLY A 144 -7.892 -15.153 12.074 1.00 0.00 N ATOM 2114 CA GLY A 144 -6.992 -16.278 12.246 1.00 0.00 C ATOM 2115 C GLY A 144 -7.587 -17.580 11.747 1.00 0.00 C ATOM 2116 O GLY A 144 -6.918 -18.352 11.060 1.00 0.00 O ATOM 0 H GLY A 144 -8.146 -14.671 12.936 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -6.062 -16.080 11.713 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -6.739 -16.379 13.302 1.00 0.00 H new ATOM 2120 N GLU A 145 -8.846 -17.825 12.093 1.00 0.00 N ATOM 2121 CA GLU A 145 -9.531 -19.042 11.676 1.00 0.00 C ATOM 2122 C GLU A 145 -9.704 -19.077 10.161 1.00 0.00 C ATOM 2123 O GLU A 145 -9.711 -20.147 9.551 1.00 0.00 O ATOM 2124 CB GLU A 145 -10.896 -19.144 12.360 1.00 0.00 C ATOM 2125 CG GLU A 145 -10.847 -18.892 13.857 1.00 0.00 C ATOM 2126 CD GLU A 145 -11.787 -19.793 14.633 1.00 0.00 C ATOM 2127 OE1 GLU A 145 -11.737 -21.023 14.423 1.00 0.00 O ATOM 2128 OE2 GLU A 145 -12.574 -19.269 15.448 1.00 0.00 O ATOM 0 H GLU A 145 -9.413 -17.196 12.662 1.00 0.00 H new ATOM 0 HA GLU A 145 -8.919 -19.894 11.973 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -11.577 -18.427 11.902 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -11.310 -20.136 12.181 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -9.828 -19.043 14.214 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -11.102 -17.851 14.055 1.00 0.00 H new ATOM 2135 N GLY A 146 -9.845 -17.899 9.560 1.00 0.00 N ATOM 2136 CA GLY A 146 -10.016 -17.818 8.121 1.00 0.00 C ATOM 2137 C GLY A 146 -11.113 -16.850 7.722 1.00 0.00 C ATOM 2138 O GLY A 146 -11.072 -16.268 6.638 1.00 0.00 O ATOM 0 H GLY A 146 -9.844 -17.001 10.043 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -9.077 -17.507 7.663 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -10.249 -18.808 7.729 1.00 0.00 H new ATOM 2142 N LEU A 147 -12.096 -16.678 8.599 1.00 0.00 N ATOM 2143 CA LEU A 147 -13.209 -15.774 8.333 1.00 0.00 C ATOM 2144 C LEU A 147 -12.728 -14.331 8.238 1.00 0.00 C ATOM 2145 O LEU A 147 -11.586 -14.023 8.580 1.00 0.00 O ATOM 2146 CB LEU A 147 -14.269 -15.901 9.429 1.00 0.00 C ATOM 2147 CG LEU A 147 -15.206 -17.101 9.288 1.00 0.00 C ATOM 2148 CD1 LEU A 147 -15.821 -17.459 10.633 1.00 0.00 C ATOM 2149 CD2 LEU A 147 -16.293 -16.811 8.264 1.00 0.00 C ATOM 0 H LEU A 147 -12.145 -17.153 9.500 1.00 0.00 H new ATOM 0 HA LEU A 147 -13.651 -16.053 7.376 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -13.766 -15.964 10.394 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -14.869 -14.991 9.441 1.00 0.00 H new ATOM 0 HG LEU A 147 -14.623 -17.954 8.939 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -16.485 -18.315 10.513 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -15.030 -17.709 11.340 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -16.389 -16.609 11.011 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -16.951 -17.676 8.177 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -16.873 -15.945 8.584 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -15.836 -16.604 7.297 1.00 0.00 H new ATOM 2161 N VAL A 148 -13.606 -13.449 7.772 1.00 0.00 N ATOM 2162 CA VAL A 148 -13.271 -12.036 7.631 1.00 0.00 C ATOM 2163 C VAL A 148 -14.244 -11.163 8.419 1.00 0.00 C ATOM 2164 O VAL A 148 -15.416 -11.508 8.572 1.00 0.00 O ATOM 2165 CB VAL A 148 -13.276 -11.608 6.150 1.00 0.00 C ATOM 2166 CG1 VAL A 148 -14.690 -11.620 5.586 1.00 0.00 C ATOM 2167 CG2 VAL A 148 -12.638 -10.238 5.982 1.00 0.00 C ATOM 0 H VAL A 148 -14.555 -13.688 7.485 1.00 0.00 H new ATOM 0 HA VAL A 148 -12.267 -11.899 8.032 1.00 0.00 H new ATOM 0 HB VAL A 148 -12.683 -12.329 5.588 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -14.667 -11.314 4.540 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -15.103 -12.626 5.661 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -15.314 -10.928 6.152 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -12.653 -9.957 4.929 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -13.196 -9.503 6.562 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -11.607 -10.271 6.335 1.00 0.00 H new ATOM 2177 N HIS A 149 -13.752 -10.034 8.920 1.00 0.00 N ATOM 2178 CA HIS A 149 -14.583 -9.119 9.694 1.00 0.00 C ATOM 2179 C HIS A 149 -14.542 -7.711 9.112 1.00 0.00 C ATOM 2180 O HIS A 149 -13.691 -6.902 9.483 1.00 0.00 O ATOM 2181 CB HIS A 149 -14.121 -9.089 11.153 1.00 0.00 C ATOM 2182 CG HIS A 149 -13.966 -10.448 11.756 1.00 0.00 C ATOM 2183 ND1 HIS A 149 -14.938 -11.044 12.535 1.00 0.00 N ATOM 2184 CD2 HIS A 149 -12.944 -11.335 11.693 1.00 0.00 C ATOM 2185 CE1 HIS A 149 -14.520 -12.235 12.923 1.00 0.00 C ATOM 2186 NE2 HIS A 149 -13.313 -12.435 12.426 1.00 0.00 N ATOM 0 H HIS A 149 -12.785 -9.732 8.804 1.00 0.00 H new ATOM 0 HA HIS A 149 -15.610 -9.480 9.648 1.00 0.00 H new ATOM 0 HB2 HIS A 149 -13.169 -8.562 11.214 1.00 0.00 H new ATOM 0 HB3 HIS A 149 -14.839 -8.518 11.742 1.00 0.00 H new ATOM 0 HD1 HIS A 149 -15.839 -10.629 12.774 1.00 0.00 H new ATOM 0 HD2 HIS A 149 -12.012 -11.201 11.164 1.00 0.00 H new ATOM 0 HE1 HIS A 149 -15.071 -12.928 13.542 1.00 0.00 H new ATOM 2195 N GLU A 150 -15.473 -7.417 8.207 1.00 0.00 N ATOM 2196 CA GLU A 150 -15.544 -6.095 7.592 1.00 0.00 C ATOM 2197 C GLU A 150 -15.634 -5.021 8.668 1.00 0.00 C ATOM 2198 O GLU A 150 -16.679 -4.842 9.293 1.00 0.00 O ATOM 2199 CB GLU A 150 -16.750 -6.005 6.656 1.00 0.00 C ATOM 2200 CG GLU A 150 -16.557 -6.742 5.341 1.00 0.00 C ATOM 2201 CD GLU A 150 -17.822 -7.435 4.870 1.00 0.00 C ATOM 2202 OE1 GLU A 150 -18.556 -7.973 5.724 1.00 0.00 O ATOM 2203 OE2 GLU A 150 -18.075 -7.439 3.647 1.00 0.00 O ATOM 0 H GLU A 150 -16.185 -8.073 7.885 1.00 0.00 H new ATOM 0 HA GLU A 150 -14.638 -5.935 7.007 1.00 0.00 H new ATOM 0 HB2 GLU A 150 -17.625 -6.410 7.165 1.00 0.00 H new ATOM 0 HB3 GLU A 150 -16.960 -4.956 6.447 1.00 0.00 H new ATOM 0 HG2 GLU A 150 -16.228 -6.036 4.578 1.00 0.00 H new ATOM 0 HG3 GLU A 150 -15.764 -7.481 5.456 1.00 0.00 H new ATOM 2210 N ILE A 151 -14.528 -4.323 8.898 1.00 0.00 N ATOM 2211 CA ILE A 151 -14.484 -3.287 9.921 1.00 0.00 C ATOM 2212 C ILE A 151 -15.005 -1.949 9.405 1.00 0.00 C ATOM 2213 O ILE A 151 -15.454 -1.834 8.266 1.00 0.00 O ATOM 2214 CB ILE A 151 -13.055 -3.103 10.487 1.00 0.00 C ATOM 2215 CG1 ILE A 151 -12.206 -2.210 9.564 1.00 0.00 C ATOM 2216 CG2 ILE A 151 -12.398 -4.462 10.706 1.00 0.00 C ATOM 2217 CD1 ILE A 151 -10.803 -2.728 9.312 1.00 0.00 C ATOM 0 H ILE A 151 -13.653 -4.455 8.391 1.00 0.00 H new ATOM 0 HA ILE A 151 -15.140 -3.625 10.723 1.00 0.00 H new ATOM 0 HB ILE A 151 -13.124 -2.599 11.451 1.00 0.00 H new ATOM 0 HG12 ILE A 151 -12.719 -2.104 8.608 1.00 0.00 H new ATOM 0 HG13 ILE A 151 -12.140 -1.214 10.002 1.00 0.00 H new ATOM 0 HG21 ILE A 151 -11.393 -4.320 11.104 1.00 0.00 H new ATOM 0 HG22 ILE A 151 -12.990 -5.043 11.413 1.00 0.00 H new ATOM 0 HG23 ILE A 151 -12.340 -4.995 9.757 1.00 0.00 H new ATOM 0 HD11 ILE A 151 -10.274 -2.040 8.653 1.00 0.00 H new ATOM 0 HD12 ILE A 151 -10.269 -2.807 10.259 1.00 0.00 H new ATOM 0 HD13 ILE A 151 -10.857 -3.711 8.843 1.00 0.00 H new ATOM 2229 N ALA A 152 -14.934 -0.948 10.270 1.00 0.00 N ATOM 2230 CA ALA A 152 -15.387 0.395 9.950 1.00 0.00 C ATOM 2231 C ALA A 152 -14.605 0.981 8.771 1.00 0.00 C ATOM 2232 O ALA A 152 -14.027 0.243 7.973 1.00 0.00 O ATOM 2233 CB ALA A 152 -15.254 1.274 11.187 1.00 0.00 C ATOM 0 H ALA A 152 -14.560 -1.045 11.214 1.00 0.00 H new ATOM 0 HA ALA A 152 -16.434 0.354 9.648 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -15.592 2.284 10.954 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -15.864 0.864 11.992 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -14.211 1.304 11.501 1.00 0.00 H new ATOM 2239 N GLY A 153 -14.595 2.308 8.667 1.00 0.00 N ATOM 2240 CA GLY A 153 -13.886 2.967 7.587 1.00 0.00 C ATOM 2241 C GLY A 153 -13.521 4.397 7.932 1.00 0.00 C ATOM 2242 O GLY A 153 -13.872 4.892 9.003 1.00 0.00 O ATOM 0 H GLY A 153 -15.067 2.939 9.315 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -12.979 2.408 7.355 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -14.504 2.958 6.689 1.00 0.00 H new ATOM 2246 N THR A 154 -12.809 5.061 7.028 1.00 0.00 N ATOM 2247 CA THR A 154 -12.393 6.442 7.250 1.00 0.00 C ATOM 2248 C THR A 154 -11.927 7.078 5.943 1.00 0.00 C ATOM 2249 O THR A 154 -11.351 6.409 5.087 1.00 0.00 O ATOM 2250 CB THR A 154 -11.278 6.486 8.299 1.00 0.00 C ATOM 2251 OG1 THR A 154 -11.759 6.039 9.555 1.00 0.00 O ATOM 2252 CG2 THR A 154 -10.690 7.868 8.504 1.00 0.00 C ATOM 0 H THR A 154 -12.508 4.667 6.137 1.00 0.00 H new ATOM 0 HA THR A 154 -13.245 7.013 7.618 1.00 0.00 H new ATOM 0 HB THR A 154 -10.496 5.833 7.912 1.00 0.00 H new ATOM 0 HG1 THR A 154 -12.739 6.013 9.540 1.00 0.00 H new ATOM 0 HG21 THR A 154 -9.907 7.822 9.261 1.00 0.00 H new ATOM 0 HG22 THR A 154 -10.267 8.226 7.565 1.00 0.00 H new ATOM 0 HG23 THR A 154 -11.473 8.551 8.833 1.00 0.00 H new ATOM 2260 N GLU A 155 -12.190 8.375 5.787 1.00 0.00 N ATOM 2261 CA GLU A 155 -11.806 9.088 4.573 1.00 0.00 C ATOM 2262 C GLU A 155 -10.624 10.025 4.818 1.00 0.00 C ATOM 2263 O GLU A 155 -10.301 10.359 5.959 1.00 0.00 O ATOM 2264 CB GLU A 155 -13.002 9.870 4.018 1.00 0.00 C ATOM 2265 CG GLU A 155 -13.203 11.234 4.659 1.00 0.00 C ATOM 2266 CD GLU A 155 -14.465 11.924 4.180 1.00 0.00 C ATOM 2267 OE1 GLU A 155 -15.473 11.224 3.947 1.00 0.00 O ATOM 2268 OE2 GLU A 155 -14.445 13.165 4.036 1.00 0.00 O ATOM 0 H GLU A 155 -12.665 8.950 6.483 1.00 0.00 H new ATOM 0 HA GLU A 155 -11.491 8.347 3.838 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -12.870 10.001 2.944 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -13.906 9.278 4.158 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -13.245 11.119 5.742 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -12.342 11.865 4.438 1.00 0.00 H new ATOM 2275 N LYS A 156 -9.991 10.449 3.728 1.00 0.00 N ATOM 2276 CA LYS A 156 -8.842 11.348 3.792 1.00 0.00 C ATOM 2277 C LYS A 156 -8.991 12.479 2.786 1.00 0.00 C ATOM 2278 O LYS A 156 -9.802 12.402 1.868 1.00 0.00 O ATOM 2279 CB LYS A 156 -7.554 10.580 3.498 1.00 0.00 C ATOM 2280 CG LYS A 156 -6.312 11.160 4.147 1.00 0.00 C ATOM 2281 CD LYS A 156 -6.103 10.576 5.529 1.00 0.00 C ATOM 2282 CE LYS A 156 -6.596 11.523 6.600 1.00 0.00 C ATOM 2283 NZ LYS A 156 -6.499 10.927 7.961 1.00 0.00 N ATOM 0 H LYS A 156 -10.258 10.181 2.781 1.00 0.00 H new ATOM 0 HA LYS A 156 -8.795 11.767 4.797 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -7.676 9.550 3.833 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -7.403 10.548 2.419 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -5.441 10.953 3.525 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -6.405 12.244 4.216 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -6.630 9.625 5.609 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -5.044 10.367 5.683 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -6.014 12.444 6.565 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -7.632 11.793 6.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -6.345 11.681 8.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -7.382 10.424 8.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -5.703 10.259 7.991 1.00 0.00 H new ATOM 2297 N THR A 157 -8.198 13.518 2.969 1.00 0.00 N ATOM 2298 CA THR A 157 -8.223 14.671 2.081 1.00 0.00 C ATOM 2299 C THR A 157 -6.812 15.212 1.877 1.00 0.00 C ATOM 2300 O THR A 157 -6.177 15.683 2.820 1.00 0.00 O ATOM 2301 CB THR A 157 -9.129 15.758 2.656 1.00 0.00 C ATOM 2302 OG1 THR A 157 -8.984 15.833 4.065 1.00 0.00 O ATOM 2303 CG2 THR A 157 -10.594 15.529 2.362 1.00 0.00 C ATOM 0 H THR A 157 -7.523 13.589 3.730 1.00 0.00 H new ATOM 0 HA THR A 157 -8.619 14.360 1.114 1.00 0.00 H new ATOM 0 HB THR A 157 -8.816 16.684 2.173 1.00 0.00 H new ATOM 0 HG1 THR A 157 -8.034 15.785 4.299 1.00 0.00 H new ATOM 0 HG21 THR A 157 -11.183 16.336 2.798 1.00 0.00 H new ATOM 0 HG22 THR A 157 -10.750 15.508 1.283 1.00 0.00 H new ATOM 0 HG23 THR A 157 -10.907 14.578 2.793 1.00 0.00 H new ATOM 2311 N VAL A 158 -6.320 15.138 0.646 1.00 0.00 N ATOM 2312 CA VAL A 158 -4.978 15.619 0.336 1.00 0.00 C ATOM 2313 C VAL A 158 -5.026 16.837 -0.577 1.00 0.00 C ATOM 2314 O VAL A 158 -5.678 16.818 -1.622 1.00 0.00 O ATOM 2315 CB VAL A 158 -4.113 14.529 -0.336 1.00 0.00 C ATOM 2316 CG1 VAL A 158 -3.284 13.794 0.704 1.00 0.00 C ATOM 2317 CG2 VAL A 158 -4.975 13.556 -1.127 1.00 0.00 C ATOM 0 H VAL A 158 -6.827 14.752 -0.151 1.00 0.00 H new ATOM 0 HA VAL A 158 -4.524 15.892 1.289 1.00 0.00 H new ATOM 0 HB VAL A 158 -3.435 15.017 -1.036 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -2.681 13.030 0.214 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -2.630 14.501 1.214 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -3.946 13.323 1.431 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -4.340 12.800 -1.589 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -5.686 13.073 -0.457 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -5.517 14.097 -1.902 1.00 0.00 H new ATOM 2327 N ASN A 159 -4.326 17.895 -0.182 1.00 0.00 N ATOM 2328 CA ASN A 159 -4.290 19.116 -0.977 1.00 0.00 C ATOM 2329 C ASN A 159 -3.036 19.168 -1.821 1.00 0.00 C ATOM 2330 O ASN A 159 -1.945 19.435 -1.316 1.00 0.00 O ATOM 2331 CB ASN A 159 -4.347 20.376 -0.100 1.00 0.00 C ATOM 2332 CG ASN A 159 -4.697 20.078 1.348 1.00 0.00 C ATOM 2333 OD1 ASN A 159 -3.683 19.791 2.155 1.00 0.00 O flip ATOM 2334 ND2 ASN A 159 -5.864 20.105 1.734 1.00 0.00 N flip ATOM 0 H ASN A 159 -3.779 17.932 0.678 1.00 0.00 H new ATOM 0 HA ASN A 159 -5.171 19.097 -1.618 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -3.382 20.882 -0.138 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -5.085 21.065 -0.512 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -6.613 20.331 1.079 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -6.083 19.902 2.709 1.00 0.00 H new ATOM 2341 N ILE A 160 -3.196 18.936 -3.109 1.00 0.00 N ATOM 2342 CA ILE A 160 -2.069 18.987 -4.011 1.00 0.00 C ATOM 2343 C ILE A 160 -1.807 20.418 -4.419 1.00 0.00 C ATOM 2344 O ILE A 160 -2.643 21.072 -5.043 1.00 0.00 O ATOM 2345 CB ILE A 160 -2.289 18.129 -5.257 1.00 0.00 C ATOM 2346 CG1 ILE A 160 -2.875 16.776 -4.870 1.00 0.00 C ATOM 2347 CG2 ILE A 160 -0.982 17.961 -6.014 1.00 0.00 C ATOM 2348 CD1 ILE A 160 -3.188 15.898 -6.062 1.00 0.00 C ATOM 0 H ILE A 160 -4.089 18.712 -3.549 1.00 0.00 H new ATOM 0 HA ILE A 160 -1.206 18.584 -3.481 1.00 0.00 H new ATOM 0 HB ILE A 160 -3.001 18.631 -5.913 1.00 0.00 H new ATOM 0 HG12 ILE A 160 -2.172 16.256 -4.219 1.00 0.00 H new ATOM 0 HG13 ILE A 160 -3.787 16.934 -4.294 1.00 0.00 H new ATOM 0 HG21 ILE A 160 -1.151 17.348 -6.900 1.00 0.00 H new ATOM 0 HG22 ILE A 160 -0.608 18.939 -6.316 1.00 0.00 H new ATOM 0 HG23 ILE A 160 -0.249 17.475 -5.371 1.00 0.00 H new ATOM 0 HD11 ILE A 160 -3.602 14.950 -5.717 1.00 0.00 H new ATOM 0 HD12 ILE A 160 -3.914 16.399 -6.703 1.00 0.00 H new ATOM 0 HD13 ILE A 160 -2.274 15.711 -6.626 1.00 0.00 H new ATOM 2360 N ILE A 161 -0.650 20.905 -4.032 1.00 0.00 N ATOM 2361 CA ILE A 161 -0.260 22.266 -4.314 1.00 0.00 C ATOM 2362 C ILE A 161 0.635 22.324 -5.543 1.00 0.00 C ATOM 2363 O ILE A 161 1.466 21.444 -5.756 1.00 0.00 O ATOM 2364 CB ILE A 161 0.469 22.893 -3.106 1.00 0.00 C ATOM 2365 CG1 ILE A 161 0.163 22.119 -1.810 1.00 0.00 C ATOM 2366 CG2 ILE A 161 0.074 24.353 -2.957 1.00 0.00 C ATOM 2367 CD1 ILE A 161 1.397 21.829 -0.984 1.00 0.00 C ATOM 0 H ILE A 161 0.046 20.369 -3.514 1.00 0.00 H new ATOM 0 HA ILE A 161 -1.167 22.838 -4.509 1.00 0.00 H new ATOM 0 HB ILE A 161 1.542 22.833 -3.287 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -0.542 22.694 -1.209 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -0.326 21.178 -2.063 1.00 0.00 H new ATOM 0 HG21 ILE A 161 0.594 24.785 -2.102 1.00 0.00 H new ATOM 0 HG22 ILE A 161 0.347 24.898 -3.861 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -1.002 24.425 -2.801 1.00 0.00 H new ATOM 0 HD11 ILE A 161 1.113 21.282 -0.085 1.00 0.00 H new ATOM 0 HD12 ILE A 161 2.094 21.229 -1.569 1.00 0.00 H new ATOM 0 HD13 ILE A 161 1.875 22.767 -0.702 1.00 0.00 H new ATOM 2379 N GLU A 162 0.454 23.355 -6.358 1.00 0.00 N ATOM 2380 CA GLU A 162 1.246 23.508 -7.571 1.00 0.00 C ATOM 2381 C GLU A 162 2.716 23.735 -7.239 1.00 0.00 C ATOM 2382 O GLU A 162 3.048 24.364 -6.234 1.00 0.00 O ATOM 2383 CB GLU A 162 0.714 24.663 -8.418 1.00 0.00 C ATOM 2384 CG GLU A 162 -0.030 24.206 -9.661 1.00 0.00 C ATOM 2385 CD GLU A 162 -0.424 25.360 -10.562 1.00 0.00 C ATOM 2386 OE1 GLU A 162 0.460 25.889 -11.270 1.00 0.00 O ATOM 2387 OE2 GLU A 162 -1.615 25.734 -10.563 1.00 0.00 O ATOM 0 H GLU A 162 -0.231 24.095 -6.202 1.00 0.00 H new ATOM 0 HA GLU A 162 1.162 22.584 -8.144 1.00 0.00 H new ATOM 0 HB2 GLU A 162 0.048 25.274 -7.809 1.00 0.00 H new ATOM 0 HB3 GLU A 162 1.547 25.300 -8.716 1.00 0.00 H new ATOM 0 HG2 GLU A 162 0.597 23.511 -10.220 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -0.925 23.660 -9.364 1.00 0.00 H new ATOM 2394 N GLY A 163 3.591 23.218 -8.094 1.00 0.00 N ATOM 2395 CA GLY A 163 5.019 23.371 -7.880 1.00 0.00 C ATOM 2396 C GLY A 163 5.717 24.009 -9.066 1.00 0.00 C ATOM 2397 O GLY A 163 5.139 24.849 -9.755 1.00 0.00 O ATOM 0 H GLY A 163 3.337 22.695 -8.932 1.00 0.00 H new ATOM 0 HA2 GLY A 163 5.187 23.980 -6.992 1.00 0.00 H new ATOM 0 HA3 GLY A 163 5.461 22.394 -7.684 1.00 0.00 H new