USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 761 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 99 SER OG : rot 92:sc= 1.26 USER MOD Set 1.2: A 125 CYS SG : rot 72:sc= -1.69! USER MOD Single : A 36 LYS NZ :NH3+ -168:sc=-0.00549 (180deg=-0.152) USER MOD Single : A 38 SER OG : rot 61:sc= 0.547 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 CYS SG : rot -163:sc= 1.56 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot -83:sc= 0.395 USER MOD Single : A 54 THR OG1 : rot -13:sc= 0.986 USER MOD Single : A 59 ASN : amide:sc= -1.9 K(o=-1.9,f=-5.8!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= -0.703 K(o=-0.7,f=-3!) USER MOD Single : A 65 THR OG1 : rot 76:sc= 0.402 USER MOD Single : A 67 HIS : no HD1:sc= -1.36 K(o=-1.4,f=-2.4) USER MOD Single : A 68 GLN : amide:sc= -1.68 K(o=-1.7,f=-0.007) USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 CYS SG : rot 81:sc= 0.357 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 CYS SG : rot 81:sc=0.000352 USER MOD Single : A 82 GLN : amide:sc= -1.21 K(o=-1.2,f=-5.7!) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0.779 K(o=0.78,f=-0.77) USER MOD Single : A 86 LYS NZ :NH3+ 166:sc= 0.0116 (180deg=0.00193) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ -165:sc= -0.0513 (180deg=-0.297) USER MOD Single : A 101 GLN : amide:sc= -0.71 X(o=-0.71,f=-0.86) USER MOD Single : A 104 GLN : amide:sc= -1.41 K(o=-1.4,f=-0.55) USER MOD Single : A 106 SER OG : rot -39:sc= 0.743 USER MOD Single : A 107 SER OG : rot 180:sc= -0.126 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= -2.82! K(o=-2.8!,f=-0.83) USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 121 ASN : amide:sc= -0.273 K(o=-0.27,f=-3.2!) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 130 SER OG : rot -74:sc= 0.438 USER MOD Single : A 134 GLN : amide:sc= 0 K(o=0,f=-0.5) USER MOD ----------------------------------------------------------------- ATOM 528 N LYS A 36 -7.034 -13.360 -10.536 1.00 42.30 N ATOM 529 CA LYS A 36 -6.129 -12.892 -11.591 1.00 22.32 C ATOM 530 C LYS A 36 -5.018 -12.000 -11.005 1.00 12.23 C ATOM 531 O LYS A 36 -3.889 -11.985 -11.506 1.00 54.10 O ATOM 532 CB LYS A 36 -6.948 -12.143 -12.666 1.00 72.23 C ATOM 533 CG LYS A 36 -6.143 -11.606 -13.857 1.00 31.32 C ATOM 534 CD LYS A 36 -5.544 -10.225 -13.587 1.00 71.54 C ATOM 535 CE LYS A 36 -4.728 -9.716 -14.771 1.00 70.34 C ATOM 536 NZ LYS A 36 -3.560 -10.589 -15.066 1.00 21.14 N ATOM 0 HA LYS A 36 -5.639 -13.748 -12.055 1.00 22.32 H new ATOM 0 HB2 LYS A 36 -7.718 -12.815 -13.044 1.00 72.23 H new ATOM 0 HB3 LYS A 36 -7.460 -11.307 -12.190 1.00 72.23 H new ATOM 0 HG2 LYS A 36 -5.341 -12.306 -14.094 1.00 31.32 H new ATOM 0 HG3 LYS A 36 -6.789 -11.553 -14.733 1.00 31.32 H new ATOM 0 HD2 LYS A 36 -6.345 -9.519 -13.368 1.00 71.54 H new ATOM 0 HD3 LYS A 36 -4.909 -10.272 -12.702 1.00 71.54 H new ATOM 0 HE2 LYS A 36 -5.367 -9.657 -15.652 1.00 70.34 H new ATOM 0 HE3 LYS A 36 -4.380 -8.705 -14.562 1.00 70.34 H new ATOM 0 HZ1 LYS A 36 -2.926 -10.106 -15.734 1.00 21.14 H new ATOM 0 HZ2 LYS A 36 -3.046 -10.790 -14.185 1.00 21.14 H new ATOM 0 HZ3 LYS A 36 -3.891 -11.481 -15.485 1.00 21.14 H new ATOM 550 N ILE A 37 -5.342 -11.264 -9.939 1.00 20.40 N ATOM 551 CA ILE A 37 -4.362 -10.395 -9.275 1.00 61.51 C ATOM 552 C ILE A 37 -3.158 -11.209 -8.782 1.00 53.32 C ATOM 553 O ILE A 37 -3.251 -11.947 -7.803 1.00 4.51 O ATOM 554 CB ILE A 37 -4.980 -9.628 -8.072 1.00 21.54 C ATOM 555 CG1 ILE A 37 -6.237 -8.854 -8.506 1.00 21.33 C ATOM 556 CG2 ILE A 37 -3.952 -8.677 -7.451 1.00 72.31 C ATOM 557 CD1 ILE A 37 -6.016 -7.909 -9.671 1.00 4.53 C ATOM 0 H ILE A 37 -6.271 -11.251 -9.517 1.00 20.40 H new ATOM 0 HA ILE A 37 -4.038 -9.667 -10.019 1.00 61.51 H new ATOM 0 HB ILE A 37 -5.272 -10.359 -7.318 1.00 21.54 H new ATOM 0 HG12 ILE A 37 -7.015 -9.569 -8.775 1.00 21.33 H new ATOM 0 HG13 ILE A 37 -6.610 -8.283 -7.656 1.00 21.33 H new ATOM 0 HG21 ILE A 37 -4.405 -8.150 -6.611 1.00 72.31 H new ATOM 0 HG22 ILE A 37 -3.093 -9.249 -7.100 1.00 72.31 H new ATOM 0 HG23 ILE A 37 -3.626 -7.955 -8.199 1.00 72.31 H new ATOM 0 HD11 ILE A 37 -6.951 -7.404 -9.912 1.00 4.53 H new ATOM 0 HD12 ILE A 37 -5.263 -7.169 -9.401 1.00 4.53 H new ATOM 0 HD13 ILE A 37 -5.674 -8.474 -10.538 1.00 4.53 H new ATOM 569 N SER A 38 -2.034 -11.084 -9.480 1.00 10.21 N ATOM 570 CA SER A 38 -0.832 -11.872 -9.167 1.00 44.40 C ATOM 571 C SER A 38 0.300 -10.999 -8.615 1.00 53.32 C ATOM 572 O SER A 38 0.153 -9.780 -8.476 1.00 72.23 O ATOM 573 CB SER A 38 -0.357 -12.612 -10.425 1.00 33.43 C ATOM 574 OG SER A 38 -1.381 -13.452 -10.942 1.00 25.30 O ATOM 0 H SER A 38 -1.924 -10.446 -10.268 1.00 10.21 H new ATOM 0 HA SER A 38 -1.098 -12.591 -8.392 1.00 44.40 H new ATOM 0 HB2 SER A 38 -0.057 -11.890 -11.184 1.00 33.43 H new ATOM 0 HB3 SER A 38 0.523 -13.210 -10.188 1.00 33.43 H new ATOM 0 HG SER A 38 -2.159 -12.908 -11.184 1.00 25.30 H new ATOM 580 N LYS A 39 1.431 -11.640 -8.305 1.00 52.21 N ATOM 581 CA LYS A 39 2.626 -10.958 -7.784 1.00 42.35 C ATOM 582 C LYS A 39 2.957 -9.690 -8.588 1.00 64.15 C ATOM 583 O LYS A 39 3.091 -8.602 -8.023 1.00 10.44 O ATOM 584 CB LYS A 39 3.810 -11.951 -7.784 1.00 44.21 C ATOM 585 CG LYS A 39 5.175 -11.360 -7.410 1.00 75.30 C ATOM 586 CD LYS A 39 5.935 -10.845 -8.635 1.00 55.21 C ATOM 587 CE LYS A 39 7.358 -10.424 -8.297 1.00 20.44 C ATOM 588 NZ LYS A 39 8.077 -9.902 -9.488 1.00 71.30 N ATOM 0 H LYS A 39 1.547 -12.648 -8.407 1.00 52.21 H new ATOM 0 HA LYS A 39 2.429 -10.630 -6.763 1.00 42.35 H new ATOM 0 HB2 LYS A 39 3.582 -12.759 -7.089 1.00 44.21 H new ATOM 0 HB3 LYS A 39 3.887 -12.396 -8.776 1.00 44.21 H new ATOM 0 HG2 LYS A 39 5.034 -10.544 -6.702 1.00 75.30 H new ATOM 0 HG3 LYS A 39 5.773 -12.120 -6.906 1.00 75.30 H new ATOM 0 HD2 LYS A 39 5.960 -11.623 -9.398 1.00 55.21 H new ATOM 0 HD3 LYS A 39 5.399 -9.997 -9.062 1.00 55.21 H new ATOM 0 HE2 LYS A 39 7.336 -9.658 -7.521 1.00 20.44 H new ATOM 0 HE3 LYS A 39 7.902 -11.276 -7.889 1.00 20.44 H new ATOM 0 HZ1 LYS A 39 9.042 -9.626 -9.217 1.00 71.30 H new ATOM 0 HZ2 LYS A 39 8.120 -10.641 -10.219 1.00 71.30 H new ATOM 0 HZ3 LYS A 39 7.572 -9.074 -9.863 1.00 71.30 H new ATOM 602 N GLU A 40 3.077 -9.834 -9.908 1.00 73.22 N ATOM 603 CA GLU A 40 3.383 -8.694 -10.781 1.00 60.32 C ATOM 604 C GLU A 40 2.319 -7.585 -10.668 1.00 51.11 C ATOM 605 O GLU A 40 2.649 -6.419 -10.460 1.00 33.13 O ATOM 606 CB GLU A 40 3.511 -9.152 -12.245 1.00 3.22 C ATOM 607 CG GLU A 40 2.267 -9.846 -12.794 1.00 31.23 C ATOM 608 CD GLU A 40 2.384 -10.187 -14.273 1.00 60.01 C ATOM 609 OE1 GLU A 40 3.193 -11.074 -14.620 1.00 65.33 O ATOM 610 OE2 GLU A 40 1.672 -9.567 -15.093 1.00 44.55 O ATOM 0 H GLU A 40 2.968 -10.723 -10.397 1.00 73.22 H new ATOM 0 HA GLU A 40 4.336 -8.280 -10.450 1.00 60.32 H new ATOM 0 HB2 GLU A 40 3.734 -8.285 -12.867 1.00 3.22 H new ATOM 0 HB3 GLU A 40 4.359 -9.831 -12.329 1.00 3.22 H new ATOM 0 HG2 GLU A 40 2.088 -10.760 -12.228 1.00 31.23 H new ATOM 0 HG3 GLU A 40 1.401 -9.202 -12.642 1.00 31.23 H new ATOM 617 N ALA A 41 1.046 -7.966 -10.774 1.00 45.32 N ATOM 618 CA ALA A 41 -0.065 -7.004 -10.791 1.00 2.03 C ATOM 619 C ALA A 41 -0.036 -6.062 -9.578 1.00 71.05 C ATOM 620 O ALA A 41 -0.237 -4.850 -9.711 1.00 65.43 O ATOM 621 CB ALA A 41 -1.395 -7.747 -10.852 1.00 25.05 C ATOM 0 H ALA A 41 0.753 -8.940 -10.850 1.00 45.32 H new ATOM 0 HA ALA A 41 0.049 -6.386 -11.681 1.00 2.03 H new ATOM 0 HB1 ALA A 41 -2.214 -7.027 -10.864 1.00 25.05 H new ATOM 0 HB2 ALA A 41 -1.432 -8.354 -11.757 1.00 25.05 H new ATOM 0 HB3 ALA A 41 -1.492 -8.392 -9.979 1.00 25.05 H new ATOM 627 N LEU A 42 0.220 -6.623 -8.398 1.00 72.43 N ATOM 628 CA LEU A 42 0.279 -5.839 -7.162 1.00 62.43 C ATOM 629 C LEU A 42 1.480 -4.878 -7.172 1.00 63.41 C ATOM 630 O LEU A 42 1.333 -3.681 -6.915 1.00 22.02 O ATOM 631 CB LEU A 42 0.334 -6.783 -5.945 1.00 51.15 C ATOM 632 CG LEU A 42 0.211 -6.114 -4.559 1.00 41.53 C ATOM 633 CD1 LEU A 42 -0.341 -7.103 -3.540 1.00 63.51 C ATOM 634 CD2 LEU A 42 1.558 -5.566 -4.079 1.00 43.12 C ATOM 0 H LEU A 42 0.391 -7.620 -8.270 1.00 72.43 H new ATOM 0 HA LEU A 42 -0.623 -5.231 -7.092 1.00 62.43 H new ATOM 0 HB2 LEU A 42 -0.466 -7.517 -6.044 1.00 51.15 H new ATOM 0 HB3 LEU A 42 1.275 -7.331 -5.979 1.00 51.15 H new ATOM 0 HG LEU A 42 -0.479 -5.276 -4.657 1.00 41.53 H new ATOM 0 HD11 LEU A 42 -0.422 -6.617 -2.568 1.00 63.51 H new ATOM 0 HD12 LEU A 42 -1.326 -7.442 -3.859 1.00 63.51 H new ATOM 0 HD13 LEU A 42 0.330 -7.959 -3.463 1.00 63.51 H new ATOM 0 HD21 LEU A 42 1.434 -5.102 -3.100 1.00 43.12 H new ATOM 0 HD22 LEU A 42 2.277 -6.382 -4.005 1.00 43.12 H new ATOM 0 HD23 LEU A 42 1.923 -4.824 -4.789 1.00 43.12 H new ATOM 646 N LEU A 43 2.663 -5.404 -7.486 1.00 15.23 N ATOM 647 CA LEU A 43 3.891 -4.599 -7.473 1.00 34.32 C ATOM 648 C LEU A 43 3.838 -3.449 -8.492 1.00 4.34 C ATOM 649 O LEU A 43 4.230 -2.324 -8.180 1.00 33.41 O ATOM 650 CB LEU A 43 5.124 -5.476 -7.734 1.00 73.43 C ATOM 651 CG LEU A 43 5.371 -6.593 -6.704 1.00 75.23 C ATOM 652 CD1 LEU A 43 6.716 -7.267 -6.951 1.00 21.22 C ATOM 653 CD2 LEU A 43 5.294 -6.054 -5.278 1.00 73.43 C ATOM 0 H LEU A 43 2.801 -6.379 -7.752 1.00 15.23 H new ATOM 0 HA LEU A 43 3.971 -4.160 -6.478 1.00 34.32 H new ATOM 0 HB2 LEU A 43 5.023 -5.930 -8.720 1.00 73.43 H new ATOM 0 HB3 LEU A 43 6.005 -4.834 -7.767 1.00 73.43 H new ATOM 0 HG LEU A 43 4.585 -7.338 -6.825 1.00 75.23 H new ATOM 0 HD11 LEU A 43 6.870 -8.053 -6.212 1.00 21.22 H new ATOM 0 HD12 LEU A 43 6.727 -7.702 -7.951 1.00 21.22 H new ATOM 0 HD13 LEU A 43 7.514 -6.529 -6.867 1.00 21.22 H new ATOM 0 HD21 LEU A 43 5.472 -6.865 -4.572 1.00 73.43 H new ATOM 0 HD22 LEU A 43 6.049 -5.280 -5.140 1.00 73.43 H new ATOM 0 HD23 LEU A 43 4.305 -5.631 -5.102 1.00 73.43 H new ATOM 665 N GLU A 44 3.348 -3.730 -9.704 1.00 13.21 N ATOM 666 CA GLU A 44 3.200 -2.696 -10.740 1.00 34.33 C ATOM 667 C GLU A 44 2.375 -1.504 -10.219 1.00 75.34 C ATOM 668 O GLU A 44 2.734 -0.341 -10.422 1.00 23.34 O ATOM 669 CB GLU A 44 2.518 -3.274 -11.994 1.00 24.03 C ATOM 670 CG GLU A 44 3.263 -4.435 -12.649 1.00 43.51 C ATOM 671 CD GLU A 44 4.631 -4.047 -13.188 1.00 62.01 C ATOM 672 OE1 GLU A 44 4.694 -3.322 -14.202 1.00 35.34 O ATOM 673 OE2 GLU A 44 5.649 -4.486 -12.620 1.00 11.02 O ATOM 0 H GLU A 44 3.047 -4.661 -9.993 1.00 13.21 H new ATOM 0 HA GLU A 44 4.200 -2.349 -11.000 1.00 34.33 H new ATOM 0 HB2 GLU A 44 1.517 -3.609 -11.724 1.00 24.03 H new ATOM 0 HB3 GLU A 44 2.400 -2.476 -12.727 1.00 24.03 H new ATOM 0 HG2 GLU A 44 3.382 -5.238 -11.921 1.00 43.51 H new ATOM 0 HG3 GLU A 44 2.658 -4.831 -13.465 1.00 43.51 H new ATOM 680 N CYS A 45 1.268 -1.811 -9.541 1.00 24.10 N ATOM 681 CA CYS A 45 0.373 -0.779 -8.994 1.00 63.54 C ATOM 682 C CYS A 45 0.995 -0.064 -7.785 1.00 74.33 C ATOM 683 O CYS A 45 0.926 1.159 -7.670 1.00 74.14 O ATOM 684 CB CYS A 45 -0.969 -1.402 -8.589 1.00 40.12 C ATOM 685 SG CYS A 45 -1.857 -2.201 -9.948 1.00 51.33 S ATOM 0 H CYS A 45 0.966 -2.767 -9.355 1.00 24.10 H new ATOM 0 HA CYS A 45 0.213 -0.038 -9.778 1.00 63.54 H new ATOM 0 HB2 CYS A 45 -0.793 -2.137 -7.803 1.00 40.12 H new ATOM 0 HB3 CYS A 45 -1.603 -0.625 -8.163 1.00 40.12 H new ATOM 0 HG CYS A 45 -3.101 -2.374 -9.612 1.00 51.33 H new ATOM 691 N ALA A 46 1.602 -0.835 -6.884 1.00 2.31 N ATOM 692 CA ALA A 46 2.239 -0.275 -5.687 1.00 10.03 C ATOM 693 C ALA A 46 3.408 0.651 -6.049 1.00 70.13 C ATOM 694 O ALA A 46 3.618 1.686 -5.412 1.00 32.02 O ATOM 695 CB ALA A 46 2.713 -1.397 -4.771 1.00 0.20 C ATOM 0 H ALA A 46 1.668 -1.850 -6.958 1.00 2.31 H new ATOM 0 HA ALA A 46 1.495 0.324 -5.162 1.00 10.03 H new ATOM 0 HB1 ALA A 46 3.184 -0.970 -3.886 1.00 0.20 H new ATOM 0 HB2 ALA A 46 1.860 -2.006 -4.470 1.00 0.20 H new ATOM 0 HB3 ALA A 46 3.434 -2.019 -5.301 1.00 0.20 H new ATOM 701 N ASP A 47 4.157 0.278 -7.083 1.00 40.14 N ATOM 702 CA ASP A 47 5.293 1.075 -7.549 1.00 73.20 C ATOM 703 C ASP A 47 4.860 2.503 -7.934 1.00 65.14 C ATOM 704 O ASP A 47 5.643 3.449 -7.830 1.00 41.33 O ATOM 705 CB ASP A 47 5.961 0.380 -8.736 1.00 20.03 C ATOM 706 CG ASP A 47 7.222 1.091 -9.189 1.00 34.23 C ATOM 707 OD1 ASP A 47 8.293 0.832 -8.603 1.00 44.44 O ATOM 708 OD2 ASP A 47 7.146 1.914 -10.123 1.00 64.25 O ATOM 0 H ASP A 47 3.998 -0.576 -7.618 1.00 40.14 H new ATOM 0 HA ASP A 47 6.009 1.159 -6.732 1.00 73.20 H new ATOM 0 HB2 ASP A 47 6.205 -0.647 -8.462 1.00 20.03 H new ATOM 0 HB3 ASP A 47 5.257 0.330 -9.567 1.00 20.03 H new ATOM 713 N LEU A 48 3.605 2.652 -8.366 1.00 51.24 N ATOM 714 CA LEU A 48 3.053 3.971 -8.703 1.00 63.51 C ATOM 715 C LEU A 48 3.155 4.945 -7.522 1.00 44.35 C ATOM 716 O LEU A 48 3.421 6.128 -7.714 1.00 1.12 O ATOM 717 CB LEU A 48 1.592 3.847 -9.159 1.00 30.23 C ATOM 718 CG LEU A 48 1.396 3.221 -10.548 1.00 71.12 C ATOM 719 CD1 LEU A 48 -0.088 3.041 -10.857 1.00 3.12 C ATOM 720 CD2 LEU A 48 2.072 4.084 -11.613 1.00 51.14 C ATOM 0 H LEU A 48 2.952 1.879 -8.491 1.00 51.24 H new ATOM 0 HA LEU A 48 3.648 4.373 -9.523 1.00 63.51 H new ATOM 0 HB2 LEU A 48 1.048 3.249 -8.428 1.00 30.23 H new ATOM 0 HB3 LEU A 48 1.141 4.839 -9.157 1.00 30.23 H new ATOM 0 HG LEU A 48 1.860 2.235 -10.554 1.00 71.12 H new ATOM 0 HD11 LEU A 48 -0.202 2.596 -11.846 1.00 3.12 H new ATOM 0 HD12 LEU A 48 -0.538 2.387 -10.110 1.00 3.12 H new ATOM 0 HD13 LEU A 48 -0.584 4.011 -10.836 1.00 3.12 H new ATOM 0 HD21 LEU A 48 1.927 3.631 -12.594 1.00 51.14 H new ATOM 0 HD22 LEU A 48 1.633 5.082 -11.605 1.00 51.14 H new ATOM 0 HD23 LEU A 48 3.139 4.155 -11.400 1.00 51.14 H new ATOM 732 N LEU A 49 2.949 4.444 -6.305 1.00 33.22 N ATOM 733 CA LEU A 49 3.088 5.275 -5.105 1.00 44.32 C ATOM 734 C LEU A 49 4.567 5.574 -4.827 1.00 31.35 C ATOM 735 O LEU A 49 4.920 6.682 -4.427 1.00 65.10 O ATOM 736 CB LEU A 49 2.440 4.603 -3.883 1.00 30.41 C ATOM 737 CG LEU A 49 0.902 4.475 -3.931 1.00 2.40 C ATOM 738 CD1 LEU A 49 0.466 3.467 -4.992 1.00 40.24 C ATOM 739 CD2 LEU A 49 0.345 4.092 -2.562 1.00 63.45 C ATOM 0 H LEU A 49 2.687 3.475 -6.122 1.00 33.22 H new ATOM 0 HA LEU A 49 2.568 6.215 -5.288 1.00 44.32 H new ATOM 0 HB2 LEU A 49 2.866 3.606 -3.770 1.00 30.41 H new ATOM 0 HB3 LEU A 49 2.712 5.169 -2.992 1.00 30.41 H new ATOM 0 HG LEU A 49 0.495 5.449 -4.205 1.00 2.40 H new ATOM 0 HD11 LEU A 49 -0.622 3.398 -5.003 1.00 40.24 H new ATOM 0 HD12 LEU A 49 0.819 3.793 -5.970 1.00 40.24 H new ATOM 0 HD13 LEU A 49 0.889 2.490 -4.761 1.00 40.24 H new ATOM 0 HD21 LEU A 49 -0.740 4.008 -2.621 1.00 63.45 H new ATOM 0 HD22 LEU A 49 0.767 3.136 -2.252 1.00 63.45 H new ATOM 0 HD23 LEU A 49 0.610 4.859 -1.834 1.00 63.45 H new ATOM 751 N SER A 50 5.427 4.581 -5.056 1.00 72.33 N ATOM 752 CA SER A 50 6.883 4.767 -4.926 1.00 33.44 C ATOM 753 C SER A 50 7.363 5.926 -5.810 1.00 32.14 C ATOM 754 O SER A 50 8.051 6.837 -5.344 1.00 4.13 O ATOM 755 CB SER A 50 7.632 3.477 -5.304 1.00 3.42 C ATOM 756 OG SER A 50 9.040 3.639 -5.191 1.00 25.42 O ATOM 0 H SER A 50 5.147 3.640 -5.332 1.00 72.33 H new ATOM 0 HA SER A 50 7.099 5.007 -3.885 1.00 33.44 H new ATOM 0 HB2 SER A 50 7.305 2.663 -4.657 1.00 3.42 H new ATOM 0 HB3 SER A 50 7.378 3.194 -6.326 1.00 3.42 H new ATOM 0 HG SER A 50 9.486 2.802 -5.436 1.00 25.42 H new ATOM 762 N SER A 51 6.975 5.897 -7.088 1.00 11.54 N ATOM 763 CA SER A 51 7.308 6.981 -8.025 1.00 63.42 C ATOM 764 C SER A 51 6.620 8.287 -7.630 1.00 11.14 C ATOM 765 O SER A 51 7.250 9.338 -7.583 1.00 21.34 O ATOM 766 CB SER A 51 6.905 6.617 -9.460 1.00 74.41 C ATOM 767 OG SER A 51 7.334 7.612 -10.384 1.00 12.14 O ATOM 0 H SER A 51 6.431 5.138 -7.500 1.00 11.54 H new ATOM 0 HA SER A 51 8.388 7.118 -7.979 1.00 63.42 H new ATOM 0 HB2 SER A 51 7.340 5.655 -9.730 1.00 74.41 H new ATOM 0 HB3 SER A 51 5.822 6.505 -9.519 1.00 74.41 H new ATOM 0 HG SER A 51 6.679 8.341 -10.408 1.00 12.14 H new ATOM 773 N ALA A 52 5.324 8.209 -7.334 1.00 45.13 N ATOM 774 CA ALA A 52 4.533 9.392 -6.974 1.00 43.02 C ATOM 775 C ALA A 52 5.086 10.109 -5.728 1.00 34.43 C ATOM 776 O ALA A 52 4.763 11.266 -5.479 1.00 75.42 O ATOM 777 CB ALA A 52 3.073 9.002 -6.763 1.00 31.34 C ATOM 0 H ALA A 52 4.795 7.337 -7.336 1.00 45.13 H new ATOM 0 HA ALA A 52 4.603 10.096 -7.803 1.00 43.02 H new ATOM 0 HB1 ALA A 52 2.495 9.887 -6.496 1.00 31.34 H new ATOM 0 HB2 ALA A 52 2.675 8.572 -7.682 1.00 31.34 H new ATOM 0 HB3 ALA A 52 3.005 8.268 -5.960 1.00 31.34 H new ATOM 783 N LEU A 53 5.904 9.414 -4.938 1.00 31.11 N ATOM 784 CA LEU A 53 6.552 10.021 -3.768 1.00 23.52 C ATOM 785 C LEU A 53 7.980 10.503 -4.086 1.00 5.05 C ATOM 786 O LEU A 53 8.553 11.307 -3.345 1.00 12.52 O ATOM 787 CB LEU A 53 6.558 9.023 -2.601 1.00 14.33 C ATOM 788 CG LEU A 53 5.170 8.708 -2.019 1.00 12.33 C ATOM 789 CD1 LEU A 53 5.251 7.580 -0.999 1.00 43.55 C ATOM 790 CD2 LEU A 53 4.551 9.957 -1.391 1.00 23.20 C ATOM 0 H LEU A 53 6.136 8.431 -5.084 1.00 31.11 H new ATOM 0 HA LEU A 53 5.977 10.902 -3.483 1.00 23.52 H new ATOM 0 HB2 LEU A 53 7.015 8.093 -2.938 1.00 14.33 H new ATOM 0 HB3 LEU A 53 7.190 9.419 -1.805 1.00 14.33 H new ATOM 0 HG LEU A 53 4.528 8.381 -2.837 1.00 12.33 H new ATOM 0 HD11 LEU A 53 4.256 7.376 -0.602 1.00 43.55 H new ATOM 0 HD12 LEU A 53 5.641 6.683 -1.479 1.00 43.55 H new ATOM 0 HD13 LEU A 53 5.914 7.873 -0.185 1.00 43.55 H new ATOM 0 HD21 LEU A 53 3.569 9.712 -0.985 1.00 23.20 H new ATOM 0 HD22 LEU A 53 5.195 10.318 -0.589 1.00 23.20 H new ATOM 0 HD23 LEU A 53 4.447 10.732 -2.150 1.00 23.20 H new ATOM 802 N THR A 54 8.559 10.004 -5.180 1.00 73.30 N ATOM 803 CA THR A 54 9.871 10.484 -5.651 1.00 23.01 C ATOM 804 C THR A 54 9.710 11.704 -6.570 1.00 21.24 C ATOM 805 O THR A 54 10.629 12.512 -6.719 1.00 60.02 O ATOM 806 CB THR A 54 10.670 9.385 -6.402 1.00 33.34 C ATOM 807 OG1 THR A 54 9.944 8.928 -7.554 1.00 20.23 O ATOM 808 CG2 THR A 54 10.967 8.201 -5.487 1.00 1.34 C ATOM 0 H THR A 54 8.147 9.271 -5.758 1.00 73.30 H new ATOM 0 HA THR A 54 10.432 10.764 -4.759 1.00 23.01 H new ATOM 0 HB THR A 54 11.613 9.827 -6.724 1.00 33.34 H new ATOM 0 HG1 THR A 54 9.022 9.256 -7.511 1.00 20.23 H new ATOM 0 HG21 THR A 54 11.527 7.446 -6.039 1.00 1.34 H new ATOM 0 HG22 THR A 54 11.556 8.539 -4.634 1.00 1.34 H new ATOM 0 HG23 THR A 54 10.030 7.771 -5.133 1.00 1.34 H new ATOM 816 N GLU A 55 8.533 11.827 -7.182 1.00 22.11 N ATOM 817 CA GLU A 55 8.181 12.998 -7.996 1.00 43.21 C ATOM 818 C GLU A 55 7.141 13.862 -7.260 1.00 53.13 C ATOM 819 O GLU A 55 6.352 13.344 -6.473 1.00 75.42 O ATOM 820 CB GLU A 55 7.626 12.550 -9.359 1.00 64.13 C ATOM 821 CG GLU A 55 6.308 11.781 -9.267 1.00 60.31 C ATOM 822 CD GLU A 55 5.779 11.347 -10.623 1.00 45.24 C ATOM 823 OE1 GLU A 55 5.122 12.172 -11.298 1.00 62.41 O ATOM 824 OE2 GLU A 55 6.021 10.187 -11.027 1.00 75.12 O ATOM 0 H GLU A 55 7.797 11.123 -7.130 1.00 22.11 H new ATOM 0 HA GLU A 55 9.080 13.593 -8.161 1.00 43.21 H new ATOM 0 HB2 GLU A 55 7.480 13.428 -9.988 1.00 64.13 H new ATOM 0 HB3 GLU A 55 8.368 11.923 -9.854 1.00 64.13 H new ATOM 0 HG2 GLU A 55 6.450 10.901 -8.640 1.00 60.31 H new ATOM 0 HG3 GLU A 55 5.563 12.406 -8.775 1.00 60.31 H new ATOM 831 N PRO A 56 7.117 15.191 -7.485 1.00 61.33 N ATOM 832 CA PRO A 56 6.128 16.071 -6.835 1.00 3.22 C ATOM 833 C PRO A 56 4.693 15.822 -7.340 1.00 31.32 C ATOM 834 O PRO A 56 4.413 15.940 -8.539 1.00 32.31 O ATOM 835 CB PRO A 56 6.597 17.490 -7.220 1.00 54.05 C ATOM 836 CG PRO A 56 7.986 17.321 -7.755 1.00 63.44 C ATOM 837 CD PRO A 56 8.037 15.943 -8.351 1.00 30.02 C ATOM 0 HA PRO A 56 6.082 15.901 -5.759 1.00 3.22 H new ATOM 0 HB2 PRO A 56 5.939 17.931 -7.969 1.00 54.05 H new ATOM 0 HB3 PRO A 56 6.587 18.154 -6.356 1.00 54.05 H new ATOM 0 HG2 PRO A 56 8.210 18.079 -8.506 1.00 63.44 H new ATOM 0 HG3 PRO A 56 8.725 17.430 -6.962 1.00 63.44 H new ATOM 0 HD2 PRO A 56 7.711 15.938 -9.391 1.00 30.02 H new ATOM 0 HD3 PRO A 56 9.045 15.528 -8.330 1.00 30.02 H new ATOM 845 N VAL A 57 3.784 15.495 -6.418 1.00 72.12 N ATOM 846 CA VAL A 57 2.373 15.236 -6.749 1.00 15.13 C ATOM 847 C VAL A 57 1.431 15.783 -5.655 1.00 51.31 C ATOM 848 O VAL A 57 1.846 15.970 -4.510 1.00 52.45 O ATOM 849 CB VAL A 57 2.091 13.717 -6.925 1.00 54.13 C ATOM 850 CG1 VAL A 57 2.940 13.114 -8.043 1.00 73.13 C ATOM 851 CG2 VAL A 57 2.308 12.970 -5.614 1.00 62.10 C ATOM 0 H VAL A 57 4.000 15.402 -5.425 1.00 72.12 H new ATOM 0 HA VAL A 57 2.181 15.749 -7.691 1.00 15.13 H new ATOM 0 HB VAL A 57 1.045 13.607 -7.212 1.00 54.13 H new ATOM 0 HG11 VAL A 57 2.716 12.051 -8.137 1.00 73.13 H new ATOM 0 HG12 VAL A 57 2.714 13.617 -8.983 1.00 73.13 H new ATOM 0 HG13 VAL A 57 3.996 13.243 -7.807 1.00 73.13 H new ATOM 0 HG21 VAL A 57 2.105 11.909 -5.762 1.00 62.10 H new ATOM 0 HG22 VAL A 57 3.340 13.100 -5.288 1.00 62.10 H new ATOM 0 HG23 VAL A 57 1.635 13.366 -4.854 1.00 62.10 H new ATOM 861 N PRO A 58 0.150 16.048 -5.987 1.00 41.43 N ATOM 862 CA PRO A 58 -0.849 16.467 -4.989 1.00 74.42 C ATOM 863 C PRO A 58 -1.229 15.330 -4.020 1.00 13.21 C ATOM 864 O PRO A 58 -1.266 14.153 -4.401 1.00 63.43 O ATOM 865 CB PRO A 58 -2.071 16.881 -5.831 1.00 31.22 C ATOM 866 CG PRO A 58 -1.593 16.938 -7.247 1.00 23.13 C ATOM 867 CD PRO A 58 -0.427 15.989 -7.339 1.00 60.41 C ATOM 0 HA PRO A 58 -0.465 17.267 -4.356 1.00 74.42 H new ATOM 0 HB2 PRO A 58 -2.883 16.162 -5.721 1.00 31.22 H new ATOM 0 HB3 PRO A 58 -2.457 17.848 -5.510 1.00 31.22 H new ATOM 0 HG2 PRO A 58 -2.386 16.648 -7.937 1.00 23.13 H new ATOM 0 HG3 PRO A 58 -1.292 17.951 -7.515 1.00 23.13 H new ATOM 0 HD2 PRO A 58 -0.747 14.980 -7.598 1.00 60.41 H new ATOM 0 HD3 PRO A 58 0.290 16.302 -8.098 1.00 60.41 H new ATOM 875 N ASN A 59 -1.540 15.687 -2.771 1.00 42.33 N ATOM 876 CA ASN A 59 -1.914 14.693 -1.754 1.00 25.40 C ATOM 877 C ASN A 59 -3.162 13.900 -2.180 1.00 64.23 C ATOM 878 O ASN A 59 -3.309 12.722 -1.846 1.00 43.22 O ATOM 879 CB ASN A 59 -2.159 15.372 -0.399 1.00 73.11 C ATOM 880 CG ASN A 59 -0.936 16.109 0.131 1.00 34.22 C ATOM 881 OD1 ASN A 59 -1.056 17.090 0.854 1.00 73.31 O ATOM 882 ND2 ASN A 59 0.250 15.650 -0.216 1.00 63.33 N ATOM 0 H ASN A 59 -1.541 16.651 -2.438 1.00 42.33 H new ATOM 0 HA ASN A 59 -1.084 13.994 -1.654 1.00 25.40 H new ATOM 0 HB2 ASN A 59 -2.986 16.076 -0.496 1.00 73.11 H new ATOM 0 HB3 ASN A 59 -2.465 14.619 0.328 1.00 73.11 H new ATOM 0 HD21 ASN A 59 1.094 16.114 0.119 1.00 63.33 H new ATOM 0 HD22 ASN A 59 0.323 14.831 -0.819 1.00 63.33 H new ATOM 889 N SER A 60 -4.048 14.551 -2.931 1.00 30.31 N ATOM 890 CA SER A 60 -5.267 13.902 -3.433 1.00 50.52 C ATOM 891 C SER A 60 -4.923 12.770 -4.404 1.00 12.21 C ATOM 892 O SER A 60 -5.564 11.720 -4.398 1.00 44.22 O ATOM 893 CB SER A 60 -6.174 14.927 -4.129 1.00 65.32 C ATOM 894 OG SER A 60 -7.378 14.331 -4.603 1.00 14.14 O ATOM 0 H SER A 60 -3.949 15.528 -3.208 1.00 30.31 H new ATOM 0 HA SER A 60 -5.797 13.479 -2.580 1.00 50.52 H new ATOM 0 HB2 SER A 60 -6.415 15.731 -3.433 1.00 65.32 H new ATOM 0 HB3 SER A 60 -5.638 15.379 -4.964 1.00 65.32 H new ATOM 0 HG SER A 60 -7.931 15.013 -5.039 1.00 14.14 H new ATOM 900 N GLN A 61 -3.894 12.988 -5.224 1.00 13.52 N ATOM 901 CA GLN A 61 -3.421 11.967 -6.167 1.00 22.31 C ATOM 902 C GLN A 61 -2.907 10.728 -5.417 1.00 33.14 C ATOM 903 O GLN A 61 -3.205 9.591 -5.789 1.00 4.50 O ATOM 904 CB GLN A 61 -2.311 12.545 -7.061 1.00 54.05 C ATOM 905 CG GLN A 61 -1.782 11.565 -8.107 1.00 43.32 C ATOM 906 CD GLN A 61 -0.657 12.143 -8.954 1.00 53.15 C ATOM 907 OE1 GLN A 61 -0.590 13.345 -9.195 1.00 41.20 O ATOM 908 NE2 GLN A 61 0.236 11.289 -9.415 1.00 52.32 N ATOM 0 H GLN A 61 -3.370 13.863 -5.256 1.00 13.52 H new ATOM 0 HA GLN A 61 -4.259 11.664 -6.794 1.00 22.31 H new ATOM 0 HB2 GLN A 61 -2.692 13.431 -7.568 1.00 54.05 H new ATOM 0 HB3 GLN A 61 -1.483 12.870 -6.431 1.00 54.05 H new ATOM 0 HG2 GLN A 61 -1.425 10.665 -7.605 1.00 43.32 H new ATOM 0 HG3 GLN A 61 -2.601 11.263 -8.760 1.00 43.32 H new ATOM 0 HE21 GLN A 61 0.152 10.296 -9.197 1.00 52.32 H new ATOM 0 HE22 GLN A 61 1.010 11.621 -9.990 1.00 52.32 H new ATOM 917 N LEU A 62 -2.136 10.965 -4.354 1.00 2.02 N ATOM 918 CA LEU A 62 -1.627 9.879 -3.501 1.00 54.32 C ATOM 919 C LEU A 62 -2.773 9.043 -2.908 1.00 11.11 C ATOM 920 O LEU A 62 -2.793 7.815 -3.034 1.00 3.22 O ATOM 921 CB LEU A 62 -0.766 10.457 -2.367 1.00 24.11 C ATOM 922 CG LEU A 62 0.521 11.165 -2.817 1.00 51.32 C ATOM 923 CD1 LEU A 62 1.237 11.791 -1.623 1.00 40.32 C ATOM 924 CD2 LEU A 62 1.442 10.191 -3.553 1.00 21.34 C ATOM 0 H LEU A 62 -1.848 11.898 -4.060 1.00 2.02 H new ATOM 0 HA LEU A 62 -1.018 9.225 -4.125 1.00 54.32 H new ATOM 0 HB2 LEU A 62 -1.370 11.164 -1.798 1.00 24.11 H new ATOM 0 HB3 LEU A 62 -0.498 9.648 -1.688 1.00 24.11 H new ATOM 0 HG LEU A 62 0.250 11.964 -3.507 1.00 51.32 H new ATOM 0 HD11 LEU A 62 2.146 12.287 -1.963 1.00 40.32 H new ATOM 0 HD12 LEU A 62 0.582 12.520 -1.147 1.00 40.32 H new ATOM 0 HD13 LEU A 62 1.496 11.013 -0.905 1.00 40.32 H new ATOM 0 HD21 LEU A 62 2.348 10.711 -3.864 1.00 21.34 H new ATOM 0 HD22 LEU A 62 1.706 9.368 -2.889 1.00 21.34 H new ATOM 0 HD23 LEU A 62 0.929 9.799 -4.431 1.00 21.34 H new ATOM 936 N VAL A 63 -3.728 9.715 -2.267 1.00 3.14 N ATOM 937 CA VAL A 63 -4.874 9.034 -1.653 1.00 35.42 C ATOM 938 C VAL A 63 -5.715 8.289 -2.707 1.00 23.25 C ATOM 939 O VAL A 63 -6.113 7.135 -2.507 1.00 42.44 O ATOM 940 CB VAL A 63 -5.778 10.031 -0.876 1.00 11.33 C ATOM 941 CG1 VAL A 63 -6.952 9.308 -0.213 1.00 21.22 C ATOM 942 CG2 VAL A 63 -4.960 10.802 0.161 1.00 52.04 C ATOM 0 H VAL A 63 -3.734 10.729 -2.158 1.00 3.14 H new ATOM 0 HA VAL A 63 -4.469 8.307 -0.949 1.00 35.42 H new ATOM 0 HB VAL A 63 -6.187 10.745 -1.591 1.00 11.33 H new ATOM 0 HG11 VAL A 63 -7.568 10.030 0.324 1.00 21.22 H new ATOM 0 HG12 VAL A 63 -7.553 8.815 -0.976 1.00 21.22 H new ATOM 0 HG13 VAL A 63 -6.572 8.564 0.487 1.00 21.22 H new ATOM 0 HG21 VAL A 63 -5.610 11.495 0.695 1.00 52.04 H new ATOM 0 HG22 VAL A 63 -4.517 10.102 0.869 1.00 52.04 H new ATOM 0 HG23 VAL A 63 -4.169 11.360 -0.341 1.00 52.04 H new ATOM 952 N ASP A 64 -5.968 8.953 -3.835 1.00 14.44 N ATOM 953 CA ASP A 64 -6.736 8.356 -4.930 1.00 54.12 C ATOM 954 C ASP A 64 -6.066 7.070 -5.446 1.00 31.05 C ATOM 955 O ASP A 64 -6.697 6.016 -5.501 1.00 15.42 O ATOM 956 CB ASP A 64 -6.908 9.368 -6.071 1.00 31.34 C ATOM 957 CG ASP A 64 -7.713 8.812 -7.236 1.00 74.04 C ATOM 958 OD1 ASP A 64 -8.771 8.196 -6.995 1.00 63.13 O ATOM 959 OD2 ASP A 64 -7.297 8.994 -8.398 1.00 35.52 O ATOM 0 H ASP A 64 -5.652 9.906 -4.015 1.00 14.44 H new ATOM 0 HA ASP A 64 -7.720 8.087 -4.546 1.00 54.12 H new ATOM 0 HB2 ASP A 64 -7.402 10.261 -5.687 1.00 31.34 H new ATOM 0 HB3 ASP A 64 -5.925 9.676 -6.428 1.00 31.34 H new ATOM 964 N THR A 65 -4.781 7.159 -5.800 1.00 35.25 N ATOM 965 CA THR A 65 -4.025 5.990 -6.283 1.00 44.40 C ATOM 966 C THR A 65 -3.967 4.887 -5.215 1.00 2.25 C ATOM 967 O THR A 65 -4.070 3.697 -5.522 1.00 71.13 O ATOM 968 CB THR A 65 -2.576 6.371 -6.693 1.00 72.21 C ATOM 969 OG1 THR A 65 -2.588 7.392 -7.706 1.00 63.13 O ATOM 970 CG2 THR A 65 -1.813 5.158 -7.220 1.00 32.44 C ATOM 0 H THR A 65 -4.240 8.023 -5.763 1.00 35.25 H new ATOM 0 HA THR A 65 -4.554 5.619 -7.161 1.00 44.40 H new ATOM 0 HB THR A 65 -2.075 6.746 -5.801 1.00 72.21 H new ATOM 0 HG1 THR A 65 -2.799 8.257 -7.296 1.00 63.13 H new ATOM 0 HG21 THR A 65 -0.802 5.457 -7.499 1.00 32.44 H new ATOM 0 HG22 THR A 65 -1.765 4.394 -6.445 1.00 32.44 H new ATOM 0 HG23 THR A 65 -2.327 4.757 -8.094 1.00 32.44 H new ATOM 978 N GLY A 66 -3.820 5.294 -3.956 1.00 61.41 N ATOM 979 CA GLY A 66 -3.769 4.343 -2.851 1.00 43.15 C ATOM 980 C GLY A 66 -5.049 3.521 -2.693 1.00 75.13 C ATOM 981 O GLY A 66 -5.009 2.392 -2.200 1.00 22.54 O ATOM 0 H GLY A 66 -3.735 6.272 -3.678 1.00 61.41 H new ATOM 0 HA2 GLY A 66 -2.929 3.666 -3.003 1.00 43.15 H new ATOM 0 HA3 GLY A 66 -3.578 4.885 -1.925 1.00 43.15 H new ATOM 985 N HIS A 67 -6.188 4.082 -3.110 1.00 61.33 N ATOM 986 CA HIS A 67 -7.477 3.378 -3.009 1.00 4.44 C ATOM 987 C HIS A 67 -7.468 2.025 -3.750 1.00 62.25 C ATOM 988 O HIS A 67 -7.820 0.996 -3.166 1.00 35.20 O ATOM 989 CB HIS A 67 -8.627 4.253 -3.529 1.00 14.21 C ATOM 990 CG HIS A 67 -8.904 5.457 -2.679 1.00 34.23 C ATOM 991 ND1 HIS A 67 -9.262 6.677 -3.203 1.00 74.33 N ATOM 992 CD2 HIS A 67 -8.900 5.617 -1.334 1.00 31.10 C ATOM 993 CE1 HIS A 67 -9.462 7.535 -2.224 1.00 3.32 C ATOM 994 NE2 HIS A 67 -9.251 6.920 -1.079 1.00 43.20 N ATOM 0 H HIS A 67 -6.248 5.015 -3.518 1.00 61.33 H new ATOM 0 HA HIS A 67 -7.635 3.174 -1.950 1.00 4.44 H new ATOM 0 HB2 HIS A 67 -8.392 4.581 -4.542 1.00 14.21 H new ATOM 0 HB3 HIS A 67 -9.532 3.648 -3.592 1.00 14.21 H new ATOM 0 HD2 HIS A 67 -8.665 4.861 -0.599 1.00 31.10 H new ATOM 0 HE1 HIS A 67 -9.751 8.569 -2.341 1.00 3.32 H new ATOM 0 HE2 HIS A 67 -9.335 7.342 -0.154 1.00 43.20 H new ATOM 1003 N GLN A 68 -7.070 2.015 -5.027 1.00 62.02 N ATOM 1004 CA GLN A 68 -7.044 0.768 -5.808 1.00 23.51 C ATOM 1005 C GLN A 68 -6.071 -0.258 -5.209 1.00 63.54 C ATOM 1006 O GLN A 68 -6.247 -1.462 -5.382 1.00 32.04 O ATOM 1007 CB GLN A 68 -6.693 1.029 -7.282 1.00 51.34 C ATOM 1008 CG GLN A 68 -5.297 1.604 -7.511 1.00 2.13 C ATOM 1009 CD GLN A 68 -4.958 1.767 -8.987 1.00 53.24 C ATOM 1010 OE1 GLN A 68 -4.235 2.679 -9.376 1.00 34.20 O ATOM 1011 NE2 GLN A 68 -5.470 0.879 -9.822 1.00 72.22 N ATOM 0 H GLN A 68 -6.765 2.843 -5.538 1.00 62.02 H new ATOM 0 HA GLN A 68 -8.050 0.352 -5.763 1.00 23.51 H new ATOM 0 HB2 GLN A 68 -6.781 0.093 -7.834 1.00 51.34 H new ATOM 0 HB3 GLN A 68 -7.428 1.717 -7.701 1.00 51.34 H new ATOM 0 HG2 GLN A 68 -5.223 2.573 -7.017 1.00 2.13 H new ATOM 0 HG3 GLN A 68 -4.560 0.951 -7.044 1.00 2.13 H new ATOM 0 HE21 GLN A 68 -6.068 0.132 -9.468 1.00 72.22 H new ATOM 0 HE22 GLN A 68 -5.267 0.941 -10.820 1.00 72.22 H new ATOM 1020 N LEU A 69 -5.049 0.216 -4.496 1.00 63.24 N ATOM 1021 CA LEU A 69 -4.128 -0.687 -3.794 1.00 22.24 C ATOM 1022 C LEU A 69 -4.881 -1.561 -2.781 1.00 53.43 C ATOM 1023 O LEU A 69 -4.581 -2.742 -2.630 1.00 22.54 O ATOM 1024 CB LEU A 69 -3.000 0.098 -3.101 1.00 25.20 C ATOM 1025 CG LEU A 69 -1.717 0.276 -3.932 1.00 71.53 C ATOM 1026 CD1 LEU A 69 -1.073 -1.080 -4.218 1.00 60.12 C ATOM 1027 CD2 LEU A 69 -2.006 1.015 -5.238 1.00 1.15 C ATOM 0 H LEU A 69 -4.837 1.208 -4.388 1.00 63.24 H new ATOM 0 HA LEU A 69 -3.675 -1.342 -4.538 1.00 22.24 H new ATOM 0 HB2 LEU A 69 -3.378 1.084 -2.831 1.00 25.20 H new ATOM 0 HB3 LEU A 69 -2.744 -0.410 -2.171 1.00 25.20 H new ATOM 0 HG LEU A 69 -1.020 0.878 -3.350 1.00 71.53 H new ATOM 0 HD11 LEU A 69 -0.167 -0.936 -4.807 1.00 60.12 H new ATOM 0 HD12 LEU A 69 -0.820 -1.569 -3.277 1.00 60.12 H new ATOM 0 HD13 LEU A 69 -1.772 -1.704 -4.775 1.00 60.12 H new ATOM 0 HD21 LEU A 69 -1.082 1.127 -5.805 1.00 1.15 H new ATOM 0 HD22 LEU A 69 -2.726 0.446 -5.826 1.00 1.15 H new ATOM 0 HD23 LEU A 69 -2.417 2.000 -5.016 1.00 1.15 H new ATOM 1039 N LEU A 70 -5.869 -0.979 -2.104 1.00 44.12 N ATOM 1040 CA LEU A 70 -6.735 -1.739 -1.190 1.00 43.22 C ATOM 1041 C LEU A 70 -7.534 -2.818 -1.950 1.00 10.34 C ATOM 1042 O LEU A 70 -7.861 -3.874 -1.399 1.00 10.25 O ATOM 1043 CB LEU A 70 -7.684 -0.784 -0.437 1.00 3.03 C ATOM 1044 CG LEU A 70 -7.094 -0.095 0.814 1.00 32.54 C ATOM 1045 CD1 LEU A 70 -6.830 -1.114 1.920 1.00 54.01 C ATOM 1046 CD2 LEU A 70 -5.813 0.671 0.475 1.00 73.31 C ATOM 0 H LEU A 70 -6.094 0.014 -2.167 1.00 44.12 H new ATOM 0 HA LEU A 70 -6.102 -2.247 -0.462 1.00 43.22 H new ATOM 0 HB2 LEU A 70 -8.017 -0.012 -1.131 1.00 3.03 H new ATOM 0 HB3 LEU A 70 -8.569 -1.345 -0.136 1.00 3.03 H new ATOM 0 HG LEU A 70 -7.830 0.624 1.174 1.00 32.54 H new ATOM 0 HD11 LEU A 70 -6.415 -0.607 2.791 1.00 54.01 H new ATOM 0 HD12 LEU A 70 -7.765 -1.602 2.196 1.00 54.01 H new ATOM 0 HD13 LEU A 70 -6.122 -1.862 1.564 1.00 54.01 H new ATOM 0 HD21 LEU A 70 -5.423 1.144 1.376 1.00 73.31 H new ATOM 0 HD22 LEU A 70 -5.070 -0.020 0.077 1.00 73.31 H new ATOM 0 HD23 LEU A 70 -6.033 1.435 -0.270 1.00 73.31 H new ATOM 1058 N ASP A 71 -7.836 -2.551 -3.220 1.00 22.02 N ATOM 1059 CA ASP A 71 -8.510 -3.528 -4.084 1.00 53.32 C ATOM 1060 C ASP A 71 -7.555 -4.685 -4.440 1.00 55.21 C ATOM 1061 O ASP A 71 -7.851 -5.853 -4.179 1.00 11.12 O ATOM 1062 CB ASP A 71 -9.012 -2.834 -5.360 1.00 4.32 C ATOM 1063 CG ASP A 71 -9.921 -3.715 -6.210 1.00 74.13 C ATOM 1064 OD1 ASP A 71 -9.429 -4.697 -6.802 1.00 30.25 O ATOM 1065 OD2 ASP A 71 -11.135 -3.425 -6.288 1.00 61.34 O ATOM 0 H ASP A 71 -7.625 -1.664 -3.677 1.00 22.02 H new ATOM 0 HA ASP A 71 -9.363 -3.944 -3.548 1.00 53.32 H new ATOM 0 HB2 ASP A 71 -9.551 -1.928 -5.084 1.00 4.32 H new ATOM 0 HB3 ASP A 71 -8.155 -2.525 -5.958 1.00 4.32 H new ATOM 1070 N TYR A 72 -6.403 -4.342 -5.024 1.00 1.32 N ATOM 1071 CA TYR A 72 -5.389 -5.338 -5.408 1.00 50.35 C ATOM 1072 C TYR A 72 -4.906 -6.160 -4.202 1.00 1.34 C ATOM 1073 O TYR A 72 -4.738 -7.374 -4.296 1.00 64.21 O ATOM 1074 CB TYR A 72 -4.191 -4.653 -6.088 1.00 21.03 C ATOM 1075 CG TYR A 72 -4.480 -4.174 -7.501 1.00 55.23 C ATOM 1076 CD1 TYR A 72 -4.978 -2.898 -7.744 1.00 3.12 C ATOM 1077 CD2 TYR A 72 -4.258 -5.006 -8.592 1.00 74.53 C ATOM 1078 CE1 TYR A 72 -5.250 -2.471 -9.032 1.00 52.42 C ATOM 1079 CE2 TYR A 72 -4.524 -4.585 -9.879 1.00 41.25 C ATOM 1080 CZ TYR A 72 -5.017 -3.316 -10.094 1.00 3.13 C ATOM 1081 OH TYR A 72 -5.289 -2.899 -11.378 1.00 23.11 O ATOM 0 H TYR A 72 -6.146 -3.380 -5.243 1.00 1.32 H new ATOM 0 HA TYR A 72 -5.861 -6.023 -6.112 1.00 50.35 H new ATOM 0 HB2 TYR A 72 -3.879 -3.802 -5.482 1.00 21.03 H new ATOM 0 HB3 TYR A 72 -3.353 -5.350 -6.115 1.00 21.03 H new ATOM 0 HD1 TYR A 72 -5.155 -2.230 -6.914 1.00 3.12 H new ATOM 0 HD2 TYR A 72 -3.870 -6.001 -8.429 1.00 74.53 H new ATOM 0 HE1 TYR A 72 -5.643 -1.480 -9.203 1.00 52.42 H new ATOM 0 HE2 TYR A 72 -4.347 -5.247 -10.714 1.00 41.25 H new ATOM 0 HH TYR A 72 -5.067 -3.615 -12.009 1.00 23.11 H new ATOM 1091 N CYS A 73 -4.685 -5.492 -3.071 1.00 43.32 N ATOM 1092 CA CYS A 73 -4.248 -6.170 -1.843 1.00 64.45 C ATOM 1093 C CYS A 73 -5.281 -7.201 -1.371 1.00 75.00 C ATOM 1094 O CYS A 73 -4.938 -8.351 -1.090 1.00 34.23 O ATOM 1095 CB CYS A 73 -3.977 -5.152 -0.726 1.00 51.34 C ATOM 1096 SG CYS A 73 -2.545 -4.085 -1.023 1.00 51.32 S ATOM 0 H CYS A 73 -4.800 -4.483 -2.975 1.00 43.32 H new ATOM 0 HA CYS A 73 -3.323 -6.697 -2.075 1.00 64.45 H new ATOM 0 HB2 CYS A 73 -4.861 -4.527 -0.598 1.00 51.34 H new ATOM 0 HB3 CYS A 73 -3.827 -5.689 0.211 1.00 51.34 H new ATOM 0 HG CYS A 73 -2.884 -3.117 -1.821 1.00 51.32 H new ATOM 1102 N SER A 74 -6.547 -6.788 -1.295 1.00 2.10 N ATOM 1103 CA SER A 74 -7.633 -7.690 -0.879 1.00 11.04 C ATOM 1104 C SER A 74 -7.808 -8.852 -1.871 1.00 22.42 C ATOM 1105 O SER A 74 -8.055 -9.993 -1.476 1.00 21.33 O ATOM 1106 CB SER A 74 -8.954 -6.921 -0.744 1.00 32.20 C ATOM 1107 OG SER A 74 -10.027 -7.784 -0.392 1.00 41.50 O ATOM 0 H SER A 74 -6.850 -5.839 -1.514 1.00 2.10 H new ATOM 0 HA SER A 74 -7.359 -8.104 0.091 1.00 11.04 H new ATOM 0 HB2 SER A 74 -8.848 -6.144 0.013 1.00 32.20 H new ATOM 0 HB3 SER A 74 -9.182 -6.420 -1.685 1.00 32.20 H new ATOM 0 HG SER A 74 -10.853 -7.263 -0.312 1.00 41.50 H new ATOM 1113 N GLY A 75 -7.671 -8.555 -3.161 1.00 24.35 N ATOM 1114 CA GLY A 75 -7.763 -9.590 -4.185 1.00 43.33 C ATOM 1115 C GLY A 75 -6.616 -10.599 -4.124 1.00 43.12 C ATOM 1116 O GLY A 75 -6.835 -11.809 -4.205 1.00 52.25 O ATOM 0 H GLY A 75 -7.498 -7.616 -3.519 1.00 24.35 H new ATOM 0 HA2 GLY A 75 -8.710 -10.119 -4.075 1.00 43.33 H new ATOM 0 HA3 GLY A 75 -7.773 -9.120 -5.168 1.00 43.33 H new ATOM 1120 N TYR A 76 -5.392 -10.101 -3.962 1.00 74.23 N ATOM 1121 CA TYR A 76 -4.205 -10.959 -3.945 1.00 42.24 C ATOM 1122 C TYR A 76 -4.104 -11.773 -2.646 1.00 62.44 C ATOM 1123 O TYR A 76 -3.736 -12.947 -2.675 1.00 1.44 O ATOM 1124 CB TYR A 76 -2.931 -10.123 -4.139 1.00 53.15 C ATOM 1125 CG TYR A 76 -1.678 -10.958 -4.346 1.00 4.33 C ATOM 1126 CD1 TYR A 76 -1.676 -12.015 -5.248 1.00 63.21 C ATOM 1127 CD2 TYR A 76 -0.505 -10.698 -3.641 1.00 53.04 C ATOM 1128 CE1 TYR A 76 -0.549 -12.784 -5.447 1.00 54.04 C ATOM 1129 CE2 TYR A 76 0.630 -11.464 -3.839 1.00 74.24 C ATOM 1130 CZ TYR A 76 0.600 -12.508 -4.743 1.00 34.44 C ATOM 1131 OH TYR A 76 1.726 -13.275 -4.951 1.00 35.41 O ATOM 0 H TYR A 76 -5.194 -9.108 -3.840 1.00 74.23 H new ATOM 0 HA TYR A 76 -4.304 -11.661 -4.773 1.00 42.24 H new ATOM 0 HB2 TYR A 76 -3.065 -9.466 -4.999 1.00 53.15 H new ATOM 0 HB3 TYR A 76 -2.791 -9.483 -3.268 1.00 53.15 H new ATOM 0 HD1 TYR A 76 -2.575 -12.238 -5.804 1.00 63.21 H new ATOM 0 HD2 TYR A 76 -0.481 -9.886 -2.929 1.00 53.04 H new ATOM 0 HE1 TYR A 76 -0.568 -13.601 -6.154 1.00 54.04 H new ATOM 0 HE2 TYR A 76 1.534 -11.247 -3.290 1.00 74.24 H new ATOM 0 HH TYR A 76 2.453 -12.951 -4.378 1.00 35.41 H new ATOM 1141 N VAL A 77 -4.429 -11.155 -1.506 1.00 12.02 N ATOM 1142 CA VAL A 77 -4.332 -11.844 -0.210 1.00 62.53 C ATOM 1143 C VAL A 77 -5.230 -13.093 -0.173 1.00 50.55 C ATOM 1144 O VAL A 77 -4.887 -14.103 0.441 1.00 34.22 O ATOM 1145 CB VAL A 77 -4.682 -10.907 0.977 1.00 73.32 C ATOM 1146 CG1 VAL A 77 -6.171 -10.575 1.015 1.00 70.40 C ATOM 1147 CG2 VAL A 77 -4.226 -11.516 2.297 1.00 43.24 C ATOM 0 H VAL A 77 -4.758 -10.191 -1.451 1.00 12.02 H new ATOM 0 HA VAL A 77 -3.293 -12.153 -0.100 1.00 62.53 H new ATOM 0 HB VAL A 77 -4.145 -9.971 0.826 1.00 73.32 H new ATOM 0 HG11 VAL A 77 -6.376 -9.917 1.860 1.00 70.40 H new ATOM 0 HG12 VAL A 77 -6.456 -10.076 0.089 1.00 70.40 H new ATOM 0 HG13 VAL A 77 -6.746 -11.495 1.123 1.00 70.40 H new ATOM 0 HG21 VAL A 77 -4.481 -10.843 3.116 1.00 43.24 H new ATOM 0 HG22 VAL A 77 -4.723 -12.474 2.447 1.00 43.24 H new ATOM 0 HG23 VAL A 77 -3.147 -11.667 2.274 1.00 43.24 H new ATOM 1157 N ASP A 78 -6.367 -13.015 -0.862 1.00 14.31 N ATOM 1158 CA ASP A 78 -7.285 -14.151 -1.000 1.00 60.23 C ATOM 1159 C ASP A 78 -6.593 -15.330 -1.715 1.00 73.44 C ATOM 1160 O ASP A 78 -6.957 -16.493 -1.526 1.00 70.21 O ATOM 1161 CB ASP A 78 -8.525 -13.690 -1.785 1.00 73.21 C ATOM 1162 CG ASP A 78 -9.607 -14.756 -1.901 1.00 45.11 C ATOM 1163 OD1 ASP A 78 -10.469 -14.837 -0.999 1.00 61.32 O ATOM 1164 OD2 ASP A 78 -9.619 -15.500 -2.901 1.00 13.35 O ATOM 0 H ASP A 78 -6.679 -12.169 -1.339 1.00 14.31 H new ATOM 0 HA ASP A 78 -7.586 -14.499 -0.012 1.00 60.23 H new ATOM 0 HB2 ASP A 78 -8.945 -12.810 -1.299 1.00 73.21 H new ATOM 0 HB3 ASP A 78 -8.218 -13.386 -2.786 1.00 73.21 H new ATOM 1169 N CYS A 79 -5.573 -15.014 -2.513 1.00 15.15 N ATOM 1170 CA CYS A 79 -4.867 -16.012 -3.328 1.00 63.43 C ATOM 1171 C CYS A 79 -3.443 -16.321 -2.821 1.00 34.31 C ATOM 1172 O CYS A 79 -2.747 -17.146 -3.418 1.00 1.21 O ATOM 1173 CB CYS A 79 -4.793 -15.521 -4.778 1.00 30.45 C ATOM 1174 SG CYS A 79 -6.406 -15.180 -5.520 1.00 52.43 S ATOM 0 H CYS A 79 -5.212 -14.066 -2.615 1.00 15.15 H new ATOM 0 HA CYS A 79 -5.436 -16.939 -3.255 1.00 63.43 H new ATOM 0 HB2 CYS A 79 -4.189 -14.615 -4.814 1.00 30.45 H new ATOM 0 HB3 CYS A 79 -4.279 -16.271 -5.379 1.00 30.45 H new ATOM 0 HG CYS A 79 -6.814 -14.003 -5.149 1.00 52.43 H new ATOM 1180 N ILE A 80 -3.004 -15.669 -1.736 1.00 1.45 N ATOM 1181 CA ILE A 80 -1.639 -15.879 -1.208 1.00 61.35 C ATOM 1182 C ILE A 80 -1.496 -17.231 -0.478 1.00 14.53 C ATOM 1183 O ILE A 80 -2.176 -17.483 0.522 1.00 13.31 O ATOM 1184 CB ILE A 80 -1.202 -14.736 -0.246 1.00 54.44 C ATOM 1185 CG1 ILE A 80 -1.104 -13.397 -1.000 1.00 73.55 C ATOM 1186 CG2 ILE A 80 0.134 -15.071 0.427 1.00 13.43 C ATOM 1187 CD1 ILE A 80 -0.642 -12.236 -0.138 1.00 74.32 C ATOM 0 H ILE A 80 -3.563 -14.998 -1.208 1.00 1.45 H new ATOM 0 HA ILE A 80 -0.986 -15.879 -2.080 1.00 61.35 H new ATOM 0 HB ILE A 80 -1.961 -14.639 0.530 1.00 54.44 H new ATOM 0 HG12 ILE A 80 -0.415 -13.512 -1.836 1.00 73.55 H new ATOM 0 HG13 ILE A 80 -2.080 -13.157 -1.422 1.00 73.55 H new ATOM 0 HG21 ILE A 80 0.419 -14.258 1.095 1.00 13.43 H new ATOM 0 HG22 ILE A 80 0.032 -15.992 1.000 1.00 13.43 H new ATOM 0 HG23 ILE A 80 0.903 -15.201 -0.335 1.00 13.43 H new ATOM 0 HD11 ILE A 80 -0.599 -11.329 -0.742 1.00 74.32 H new ATOM 0 HD12 ILE A 80 -1.343 -12.092 0.684 1.00 74.32 H new ATOM 0 HD13 ILE A 80 0.348 -12.452 0.263 1.00 74.32 H new ATOM 1199 N PRO A 81 -0.592 -18.114 -0.967 1.00 55.51 N ATOM 1200 CA PRO A 81 -0.321 -19.418 -0.337 1.00 41.22 C ATOM 1201 C PRO A 81 0.481 -19.302 0.973 1.00 30.20 C ATOM 1202 O PRO A 81 0.150 -19.942 1.974 1.00 35.25 O ATOM 1203 CB PRO A 81 0.499 -20.180 -1.404 1.00 25.34 C ATOM 1204 CG PRO A 81 0.427 -19.347 -2.644 1.00 0.44 C ATOM 1205 CD PRO A 81 0.215 -17.933 -2.183 1.00 51.44 C ATOM 0 HA PRO A 81 -1.247 -19.917 -0.052 1.00 41.22 H new ATOM 0 HB2 PRO A 81 1.532 -20.313 -1.082 1.00 25.34 H new ATOM 0 HB3 PRO A 81 0.088 -21.175 -1.577 1.00 25.34 H new ATOM 0 HG2 PRO A 81 1.345 -19.434 -3.226 1.00 0.44 H new ATOM 0 HG3 PRO A 81 -0.390 -19.674 -3.287 1.00 0.44 H new ATOM 0 HD2 PRO A 81 1.158 -17.429 -1.973 1.00 51.44 H new ATOM 0 HD3 PRO A 81 -0.306 -17.336 -2.931 1.00 51.44 H new ATOM 1213 N GLN A 82 1.539 -18.487 0.966 1.00 50.22 N ATOM 1214 CA GLN A 82 2.400 -18.335 2.147 1.00 3.23 C ATOM 1215 C GLN A 82 1.677 -17.571 3.264 1.00 42.34 C ATOM 1216 O GLN A 82 1.699 -16.340 3.306 1.00 12.32 O ATOM 1217 CB GLN A 82 3.714 -17.616 1.792 1.00 12.20 C ATOM 1218 CG GLN A 82 4.567 -18.325 0.740 1.00 23.24 C ATOM 1219 CD GLN A 82 3.978 -18.249 -0.659 1.00 63.33 C ATOM 1220 OE1 GLN A 82 3.283 -17.296 -0.999 1.00 20.02 O ATOM 1221 NE2 GLN A 82 4.239 -19.246 -1.477 1.00 1.34 N ATOM 0 H GLN A 82 1.821 -17.925 0.163 1.00 50.22 H new ATOM 0 HA GLN A 82 2.637 -19.337 2.503 1.00 3.23 H new ATOM 0 HB2 GLN A 82 3.478 -16.614 1.434 1.00 12.20 H new ATOM 0 HB3 GLN A 82 4.305 -17.499 2.700 1.00 12.20 H new ATOM 0 HG2 GLN A 82 5.564 -17.884 0.732 1.00 23.24 H new ATOM 0 HG3 GLN A 82 4.684 -19.371 1.022 1.00 23.24 H new ATOM 0 HE21 GLN A 82 4.820 -20.024 -1.164 1.00 1.34 H new ATOM 0 HE22 GLN A 82 3.860 -19.241 -2.424 1.00 1.34 H new ATOM 1230 N THR A 83 1.030 -18.309 4.164 1.00 73.25 N ATOM 1231 CA THR A 83 0.263 -17.707 5.267 1.00 32.33 C ATOM 1232 C THR A 83 1.128 -16.770 6.126 1.00 70.42 C ATOM 1233 O THR A 83 0.646 -15.747 6.616 1.00 61.15 O ATOM 1234 CB THR A 83 -0.370 -18.785 6.176 1.00 1.32 C ATOM 1235 OG1 THR A 83 -1.110 -19.721 5.379 1.00 54.20 O ATOM 1236 CG2 THR A 83 -1.303 -18.150 7.204 1.00 41.03 C ATOM 0 H THR A 83 1.018 -19.329 4.156 1.00 73.25 H new ATOM 0 HA THR A 83 -0.530 -17.123 4.800 1.00 32.33 H new ATOM 0 HB THR A 83 0.433 -19.301 6.702 1.00 1.32 H new ATOM 0 HG1 THR A 83 -1.508 -20.403 5.960 1.00 54.20 H new ATOM 0 HG21 THR A 83 -1.736 -18.928 7.832 1.00 41.03 H new ATOM 0 HG22 THR A 83 -0.740 -17.454 7.826 1.00 41.03 H new ATOM 0 HG23 THR A 83 -2.100 -17.613 6.689 1.00 41.03 H new ATOM 1244 N ARG A 84 2.404 -17.117 6.300 1.00 14.25 N ATOM 1245 CA ARG A 84 3.346 -16.256 7.035 1.00 12.34 C ATOM 1246 C ARG A 84 3.390 -14.843 6.428 1.00 51.43 C ATOM 1247 O ARG A 84 3.258 -13.844 7.135 1.00 32.43 O ATOM 1248 CB ARG A 84 4.751 -16.872 7.035 1.00 45.10 C ATOM 1249 CG ARG A 84 4.838 -18.224 7.743 1.00 54.52 C ATOM 1250 CD ARG A 84 4.573 -18.112 9.244 1.00 20.23 C ATOM 1251 NE ARG A 84 4.710 -19.404 9.919 1.00 25.22 N ATOM 1252 CZ ARG A 84 5.081 -19.555 11.164 1.00 11.23 C ATOM 1253 NH1 ARG A 84 5.338 -18.534 11.914 1.00 30.35 N ATOM 1254 NH2 ARG A 84 5.182 -20.740 11.666 1.00 14.23 N ATOM 0 H ARG A 84 2.812 -17.982 5.946 1.00 14.25 H new ATOM 0 HA ARG A 84 2.995 -16.178 8.064 1.00 12.34 H new ATOM 0 HB2 ARG A 84 5.084 -16.991 6.004 1.00 45.10 H new ATOM 0 HB3 ARG A 84 5.441 -16.177 7.514 1.00 45.10 H new ATOM 0 HG2 ARG A 84 4.117 -18.911 7.299 1.00 54.52 H new ATOM 0 HG3 ARG A 84 5.827 -18.653 7.582 1.00 54.52 H new ATOM 0 HD2 ARG A 84 5.269 -17.397 9.683 1.00 20.23 H new ATOM 0 HD3 ARG A 84 3.569 -17.721 9.407 1.00 20.23 H new ATOM 0 HE ARG A 84 4.502 -20.245 9.381 1.00 25.22 H new ATOM 0 HH11 ARG A 84 5.253 -17.590 11.537 1.00 30.35 H new ATOM 0 HH12 ARG A 84 5.626 -18.672 12.883 1.00 30.35 H new ATOM 0 HH21 ARG A 84 4.973 -21.557 11.092 1.00 14.23 H new ATOM 0 HH22 ARG A 84 5.471 -20.860 12.637 1.00 14.23 H new ATOM 1268 N ASN A 85 3.566 -14.770 5.108 1.00 44.34 N ATOM 1269 CA ASN A 85 3.528 -13.488 4.394 1.00 40.23 C ATOM 1270 C ASN A 85 2.110 -12.898 4.396 1.00 61.41 C ATOM 1271 O ASN A 85 1.935 -11.690 4.493 1.00 64.10 O ATOM 1272 CB ASN A 85 4.007 -13.658 2.944 1.00 3.13 C ATOM 1273 CG ASN A 85 5.453 -14.103 2.846 1.00 33.31 C ATOM 1274 OD1 ASN A 85 6.261 -13.836 3.730 1.00 20.24 O ATOM 1275 ND2 ASN A 85 5.797 -14.772 1.762 1.00 10.42 N ATOM 0 H ASN A 85 3.736 -15.579 4.511 1.00 44.34 H new ATOM 0 HA ASN A 85 4.197 -12.803 4.915 1.00 40.23 H new ATOM 0 HB2 ASN A 85 3.373 -14.388 2.441 1.00 3.13 H new ATOM 0 HB3 ASN A 85 3.887 -12.713 2.414 1.00 3.13 H new ATOM 0 HD21 ASN A 85 6.760 -15.084 1.640 1.00 10.42 H new ATOM 0 HD22 ASN A 85 5.100 -14.977 1.046 1.00 10.42 H new ATOM 1282 N LYS A 86 1.109 -13.768 4.298 1.00 73.12 N ATOM 1283 CA LYS A 86 -0.295 -13.348 4.215 1.00 10.40 C ATOM 1284 C LYS A 86 -0.748 -12.591 5.479 1.00 22.43 C ATOM 1285 O LYS A 86 -1.510 -11.625 5.393 1.00 43.32 O ATOM 1286 CB LYS A 86 -1.177 -14.582 3.962 1.00 74.13 C ATOM 1287 CG LYS A 86 -2.646 -14.270 3.693 1.00 3.12 C ATOM 1288 CD LYS A 86 -3.375 -15.464 3.076 1.00 22.33 C ATOM 1289 CE LYS A 86 -3.364 -16.682 3.990 1.00 12.33 C ATOM 1290 NZ LYS A 86 -3.932 -17.885 3.326 1.00 1.24 N ATOM 0 H LYS A 86 1.242 -14.779 4.274 1.00 73.12 H new ATOM 0 HA LYS A 86 -0.399 -12.651 3.384 1.00 10.40 H new ATOM 0 HB2 LYS A 86 -0.774 -15.131 3.111 1.00 74.13 H new ATOM 0 HB3 LYS A 86 -1.112 -15.242 4.827 1.00 74.13 H new ATOM 0 HG2 LYS A 86 -3.135 -13.988 4.626 1.00 3.12 H new ATOM 0 HG3 LYS A 86 -2.719 -13.413 3.023 1.00 3.12 H new ATOM 0 HD2 LYS A 86 -4.406 -15.185 2.859 1.00 22.33 H new ATOM 0 HD3 LYS A 86 -2.907 -15.721 2.126 1.00 22.33 H new ATOM 0 HE2 LYS A 86 -2.341 -16.890 4.303 1.00 12.33 H new ATOM 0 HE3 LYS A 86 -3.935 -16.463 4.892 1.00 12.33 H new ATOM 0 HZ1 LYS A 86 -3.694 -18.732 3.880 1.00 1.24 H new ATOM 0 HZ2 LYS A 86 -4.966 -17.791 3.264 1.00 1.24 H new ATOM 0 HZ3 LYS A 86 -3.534 -17.974 2.369 1.00 1.24 H new ATOM 1304 N PHE A 87 -0.271 -13.020 6.650 1.00 32.15 N ATOM 1305 CA PHE A 87 -0.581 -12.322 7.907 1.00 2.04 C ATOM 1306 C PHE A 87 0.103 -10.946 7.942 1.00 45.24 C ATOM 1307 O PHE A 87 -0.539 -9.919 8.185 1.00 75.52 O ATOM 1308 CB PHE A 87 -0.131 -13.161 9.112 1.00 11.34 C ATOM 1309 CG PHE A 87 -0.736 -12.724 10.425 1.00 44.42 C ATOM 1310 CD1 PHE A 87 -2.014 -13.133 10.780 1.00 75.02 C ATOM 1311 CD2 PHE A 87 -0.032 -11.908 11.302 1.00 64.33 C ATOM 1312 CE1 PHE A 87 -2.577 -12.740 11.979 1.00 33.24 C ATOM 1313 CE2 PHE A 87 -0.591 -11.511 12.503 1.00 2.30 C ATOM 1314 CZ PHE A 87 -1.865 -11.928 12.841 1.00 41.44 C ATOM 0 H PHE A 87 0.326 -13.840 6.758 1.00 32.15 H new ATOM 0 HA PHE A 87 -1.660 -12.179 7.961 1.00 2.04 H new ATOM 0 HB2 PHE A 87 -0.392 -14.204 8.933 1.00 11.34 H new ATOM 0 HB3 PHE A 87 0.955 -13.113 9.190 1.00 11.34 H new ATOM 0 HD1 PHE A 87 -2.576 -13.767 10.110 1.00 75.02 H new ATOM 0 HD2 PHE A 87 0.964 -11.580 11.043 1.00 64.33 H new ATOM 0 HE1 PHE A 87 -3.572 -13.067 12.242 1.00 33.24 H new ATOM 0 HE2 PHE A 87 -0.033 -10.876 13.176 1.00 2.30 H new ATOM 0 HZ PHE A 87 -2.304 -11.619 13.778 1.00 41.44 H new ATOM 1324 N ALA A 88 1.414 -10.939 7.690 1.00 11.02 N ATOM 1325 CA ALA A 88 2.193 -9.698 7.616 1.00 2.22 C ATOM 1326 C ALA A 88 1.636 -8.756 6.541 1.00 15.02 C ATOM 1327 O ALA A 88 1.668 -7.535 6.681 1.00 34.52 O ATOM 1328 CB ALA A 88 3.657 -10.014 7.331 1.00 15.54 C ATOM 0 H ALA A 88 1.963 -11.784 7.533 1.00 11.02 H new ATOM 0 HA ALA A 88 2.117 -9.193 8.579 1.00 2.22 H new ATOM 0 HB1 ALA A 88 4.226 -9.086 7.278 1.00 15.54 H new ATOM 0 HB2 ALA A 88 4.056 -10.639 8.129 1.00 15.54 H new ATOM 0 HB3 ALA A 88 3.737 -10.543 6.381 1.00 15.54 H new ATOM 1334 N PHE A 89 1.115 -9.343 5.471 1.00 41.02 N ATOM 1335 CA PHE A 89 0.500 -8.585 4.384 1.00 44.42 C ATOM 1336 C PHE A 89 -0.722 -7.802 4.888 1.00 42.54 C ATOM 1337 O PHE A 89 -0.858 -6.609 4.622 1.00 33.34 O ATOM 1338 CB PHE A 89 0.097 -9.543 3.253 1.00 41.12 C ATOM 1339 CG PHE A 89 -0.409 -8.855 2.014 1.00 75.24 C ATOM 1340 CD1 PHE A 89 0.477 -8.387 1.056 1.00 35.33 C ATOM 1341 CD2 PHE A 89 -1.769 -8.679 1.807 1.00 62.02 C ATOM 1342 CE1 PHE A 89 0.017 -7.758 -0.080 1.00 41.12 C ATOM 1343 CE2 PHE A 89 -2.233 -8.050 0.672 1.00 13.11 C ATOM 1344 CZ PHE A 89 -1.340 -7.590 -0.273 1.00 33.03 C ATOM 0 H PHE A 89 1.106 -10.353 5.331 1.00 41.02 H new ATOM 0 HA PHE A 89 1.224 -7.865 4.002 1.00 44.42 H new ATOM 0 HB2 PHE A 89 0.958 -10.157 2.988 1.00 41.12 H new ATOM 0 HB3 PHE A 89 -0.675 -10.218 3.622 1.00 41.12 H new ATOM 0 HD1 PHE A 89 1.539 -8.517 1.202 1.00 35.33 H new ATOM 0 HD2 PHE A 89 -2.472 -9.039 2.543 1.00 62.02 H new ATOM 0 HE1 PHE A 89 0.717 -7.397 -0.819 1.00 41.12 H new ATOM 0 HE2 PHE A 89 -3.294 -7.917 0.523 1.00 13.11 H new ATOM 0 HZ PHE A 89 -1.702 -7.098 -1.164 1.00 33.03 H new ATOM 1354 N ARG A 90 -1.599 -8.480 5.630 1.00 13.40 N ATOM 1355 CA ARG A 90 -2.789 -7.836 6.200 1.00 33.42 C ATOM 1356 C ARG A 90 -2.416 -6.678 7.139 1.00 33.31 C ATOM 1357 O ARG A 90 -2.932 -5.565 7.001 1.00 31.35 O ATOM 1358 CB ARG A 90 -3.655 -8.855 6.957 1.00 24.24 C ATOM 1359 CG ARG A 90 -4.316 -9.908 6.068 1.00 34.44 C ATOM 1360 CD ARG A 90 -5.107 -9.282 4.918 1.00 23.41 C ATOM 1361 NE ARG A 90 -6.010 -8.218 5.358 1.00 62.31 N ATOM 1362 CZ ARG A 90 -7.137 -7.917 4.775 1.00 31.35 C ATOM 1363 NH1 ARG A 90 -7.629 -8.673 3.845 1.00 3.21 N ATOM 1364 NH2 ARG A 90 -7.803 -6.879 5.157 1.00 3.11 N ATOM 0 H ARG A 90 -1.510 -9.472 5.851 1.00 13.40 H new ATOM 0 HA ARG A 90 -3.360 -7.430 5.365 1.00 33.42 H new ATOM 0 HB2 ARG A 90 -3.035 -9.360 7.698 1.00 24.24 H new ATOM 0 HB3 ARG A 90 -4.431 -8.319 7.503 1.00 24.24 H new ATOM 0 HG2 ARG A 90 -3.551 -10.570 5.662 1.00 34.44 H new ATOM 0 HG3 ARG A 90 -4.983 -10.524 6.672 1.00 34.44 H new ATOM 0 HD2 ARG A 90 -4.411 -8.879 4.182 1.00 23.41 H new ATOM 0 HD3 ARG A 90 -5.686 -10.058 4.417 1.00 23.41 H new ATOM 0 HE ARG A 90 -5.739 -7.674 6.177 1.00 62.31 H new ATOM 0 HH11 ARG A 90 -7.134 -9.518 3.559 1.00 3.21 H new ATOM 0 HH12 ARG A 90 -8.512 -8.424 3.399 1.00 3.21 H new ATOM 0 HH21 ARG A 90 -7.448 -6.295 5.914 1.00 3.11 H new ATOM 0 HH22 ARG A 90 -8.685 -6.643 4.702 1.00 3.11 H new ATOM 1378 N GLU A 91 -1.518 -6.939 8.088 1.00 52.13 N ATOM 1379 CA GLU A 91 -1.108 -5.912 9.053 1.00 12.32 C ATOM 1380 C GLU A 91 -0.428 -4.729 8.341 1.00 54.31 C ATOM 1381 O GLU A 91 -0.624 -3.576 8.719 1.00 13.12 O ATOM 1382 CB GLU A 91 -0.188 -6.506 10.140 1.00 22.20 C ATOM 1383 CG GLU A 91 1.194 -6.917 9.650 1.00 73.51 C ATOM 1384 CD GLU A 91 2.065 -7.488 10.760 1.00 63.34 C ATOM 1385 OE1 GLU A 91 1.860 -8.660 11.145 1.00 41.23 O ATOM 1386 OE2 GLU A 91 2.948 -6.760 11.267 1.00 22.32 O ATOM 0 H GLU A 91 -1.062 -7.843 8.212 1.00 52.13 H new ATOM 0 HA GLU A 91 -2.006 -5.538 9.545 1.00 12.32 H new ATOM 0 HB2 GLU A 91 -0.072 -5.773 10.939 1.00 22.20 H new ATOM 0 HB3 GLU A 91 -0.678 -7.377 10.575 1.00 22.20 H new ATOM 0 HG2 GLU A 91 1.089 -7.659 8.858 1.00 73.51 H new ATOM 0 HG3 GLU A 91 1.692 -6.052 9.212 1.00 73.51 H new ATOM 1393 N ALA A 92 0.343 -5.017 7.293 1.00 4.13 N ATOM 1394 CA ALA A 92 0.988 -3.967 6.493 1.00 65.22 C ATOM 1395 C ALA A 92 -0.053 -3.094 5.768 1.00 3.11 C ATOM 1396 O ALA A 92 0.027 -1.862 5.786 1.00 63.21 O ATOM 1397 CB ALA A 92 1.954 -4.590 5.494 1.00 11.12 C ATOM 0 H ALA A 92 0.538 -5.966 6.975 1.00 4.13 H new ATOM 0 HA ALA A 92 1.546 -3.320 7.169 1.00 65.22 H new ATOM 0 HB1 ALA A 92 2.427 -3.803 4.906 1.00 11.12 H new ATOM 0 HB2 ALA A 92 2.719 -5.152 6.030 1.00 11.12 H new ATOM 0 HB3 ALA A 92 1.409 -5.261 4.830 1.00 11.12 H new ATOM 1403 N VAL A 93 -1.035 -3.742 5.136 1.00 14.10 N ATOM 1404 CA VAL A 93 -2.136 -3.030 4.470 1.00 42.42 C ATOM 1405 C VAL A 93 -2.897 -2.132 5.461 1.00 2.22 C ATOM 1406 O VAL A 93 -3.346 -1.038 5.108 1.00 2.20 O ATOM 1407 CB VAL A 93 -3.118 -4.027 3.798 1.00 54.01 C ATOM 1408 CG1 VAL A 93 -4.353 -3.316 3.247 1.00 24.51 C ATOM 1409 CG2 VAL A 93 -2.412 -4.801 2.689 1.00 63.11 C ATOM 0 H VAL A 93 -1.093 -4.758 5.070 1.00 14.10 H new ATOM 0 HA VAL A 93 -1.696 -2.399 3.698 1.00 42.42 H new ATOM 0 HB VAL A 93 -3.453 -4.728 4.563 1.00 54.01 H new ATOM 0 HG11 VAL A 93 -5.017 -4.046 2.784 1.00 24.51 H new ATOM 0 HG12 VAL A 93 -4.877 -2.813 4.060 1.00 24.51 H new ATOM 0 HG13 VAL A 93 -4.048 -2.580 2.503 1.00 24.51 H new ATOM 0 HG21 VAL A 93 -3.113 -5.496 2.227 1.00 63.11 H new ATOM 0 HG22 VAL A 93 -2.043 -4.104 1.937 1.00 63.11 H new ATOM 0 HG23 VAL A 93 -1.574 -5.357 3.110 1.00 63.11 H new ATOM 1419 N SER A 94 -3.019 -2.597 6.706 1.00 20.35 N ATOM 1420 CA SER A 94 -3.655 -1.807 7.772 1.00 32.42 C ATOM 1421 C SER A 94 -2.944 -0.458 7.970 1.00 14.31 C ATOM 1422 O SER A 94 -3.583 0.563 8.227 1.00 20.13 O ATOM 1423 CB SER A 94 -3.667 -2.589 9.094 1.00 13.52 C ATOM 1424 OG SER A 94 -4.296 -1.848 10.132 1.00 52.12 O ATOM 0 H SER A 94 -2.688 -3.514 7.004 1.00 20.35 H new ATOM 0 HA SER A 94 -4.682 -1.612 7.465 1.00 32.42 H new ATOM 0 HB2 SER A 94 -4.189 -3.535 8.953 1.00 13.52 H new ATOM 0 HB3 SER A 94 -2.644 -2.829 9.385 1.00 13.52 H new ATOM 0 HG SER A 94 -4.289 -2.373 10.959 1.00 52.12 H new ATOM 1430 N LYS A 95 -1.616 -0.452 7.843 1.00 75.53 N ATOM 1431 CA LYS A 95 -0.843 0.795 7.923 1.00 52.24 C ATOM 1432 C LYS A 95 -1.127 1.703 6.715 1.00 44.30 C ATOM 1433 O LYS A 95 -1.241 2.922 6.855 1.00 54.42 O ATOM 1434 CB LYS A 95 0.666 0.502 8.012 1.00 53.33 C ATOM 1435 CG LYS A 95 1.161 0.104 9.405 1.00 31.22 C ATOM 1436 CD LYS A 95 0.496 -1.169 9.919 1.00 23.34 C ATOM 1437 CE LYS A 95 1.077 -1.612 11.256 1.00 21.02 C ATOM 1438 NZ LYS A 95 2.521 -1.950 11.149 1.00 65.25 N ATOM 0 H LYS A 95 -1.054 -1.288 7.685 1.00 75.53 H new ATOM 0 HA LYS A 95 -1.155 1.314 8.829 1.00 52.24 H new ATOM 0 HB2 LYS A 95 0.908 -0.299 7.313 1.00 53.33 H new ATOM 0 HB3 LYS A 95 1.214 1.386 7.686 1.00 53.33 H new ATOM 0 HG2 LYS A 95 2.241 -0.040 9.376 1.00 31.22 H new ATOM 0 HG3 LYS A 95 0.967 0.919 10.103 1.00 31.22 H new ATOM 0 HD2 LYS A 95 -0.576 -1.001 10.026 1.00 23.34 H new ATOM 0 HD3 LYS A 95 0.622 -1.966 9.186 1.00 23.34 H new ATOM 0 HE2 LYS A 95 0.944 -0.818 11.991 1.00 21.02 H new ATOM 0 HE3 LYS A 95 0.527 -2.480 11.621 1.00 21.02 H new ATOM 0 HZ1 LYS A 95 2.817 -2.480 11.994 1.00 65.25 H new ATOM 0 HZ2 LYS A 95 2.679 -2.532 10.302 1.00 65.25 H new ATOM 0 HZ3 LYS A 95 3.078 -1.075 11.077 1.00 65.25 H new ATOM 1452 N LEU A 96 -1.250 1.101 5.529 1.00 10.43 N ATOM 1453 CA LEU A 96 -1.507 1.862 4.299 1.00 51.20 C ATOM 1454 C LEU A 96 -2.855 2.603 4.363 1.00 3.34 C ATOM 1455 O LEU A 96 -2.917 3.816 4.149 1.00 71.21 O ATOM 1456 CB LEU A 96 -1.480 0.924 3.081 1.00 13.32 C ATOM 1457 CG LEU A 96 -1.704 1.603 1.717 1.00 33.05 C ATOM 1458 CD1 LEU A 96 -0.611 2.634 1.434 1.00 50.12 C ATOM 1459 CD2 LEU A 96 -1.766 0.563 0.599 1.00 12.25 C ATOM 0 H LEU A 96 -1.176 0.093 5.392 1.00 10.43 H new ATOM 0 HA LEU A 96 -0.719 2.608 4.199 1.00 51.20 H new ATOM 0 HB2 LEU A 96 -0.518 0.413 3.059 1.00 13.32 H new ATOM 0 HB3 LEU A 96 -2.244 0.159 3.216 1.00 13.32 H new ATOM 0 HG LEU A 96 -2.660 2.125 1.753 1.00 33.05 H new ATOM 0 HD11 LEU A 96 -0.792 3.099 0.465 1.00 50.12 H new ATOM 0 HD12 LEU A 96 -0.622 3.398 2.211 1.00 50.12 H new ATOM 0 HD13 LEU A 96 0.361 2.140 1.424 1.00 50.12 H new ATOM 0 HD21 LEU A 96 -1.925 1.064 -0.356 1.00 12.25 H new ATOM 0 HD22 LEU A 96 -0.828 0.008 0.566 1.00 12.25 H new ATOM 0 HD23 LEU A 96 -2.589 -0.126 0.788 1.00 12.25 H new ATOM 1471 N GLU A 97 -3.925 1.874 4.685 1.00 52.25 N ATOM 1472 CA GLU A 97 -5.273 2.459 4.746 1.00 43.21 C ATOM 1473 C GLU A 97 -5.372 3.570 5.813 1.00 4.03 C ATOM 1474 O GLU A 97 -5.930 4.644 5.557 1.00 24.32 O ATOM 1475 CB GLU A 97 -6.327 1.371 5.014 1.00 30.24 C ATOM 1476 CG GLU A 97 -6.105 0.586 6.303 1.00 42.33 C ATOM 1477 CD GLU A 97 -7.294 -0.286 6.677 1.00 74.50 C ATOM 1478 OE1 GLU A 97 -8.217 0.221 7.352 1.00 2.22 O ATOM 1479 OE2 GLU A 97 -7.318 -1.477 6.301 1.00 52.31 O ATOM 0 H GLU A 97 -3.888 0.879 4.908 1.00 52.25 H new ATOM 0 HA GLU A 97 -5.470 2.913 3.775 1.00 43.21 H new ATOM 0 HB2 GLU A 97 -7.312 1.837 5.051 1.00 30.24 H new ATOM 0 HB3 GLU A 97 -6.335 0.675 4.175 1.00 30.24 H new ATOM 0 HG2 GLU A 97 -5.221 -0.042 6.192 1.00 42.33 H new ATOM 0 HG3 GLU A 97 -5.902 1.283 7.116 1.00 42.33 H new ATOM 1486 N LEU A 98 -4.828 3.315 7.006 1.00 45.21 N ATOM 1487 CA LEU A 98 -4.813 4.317 8.082 1.00 31.30 C ATOM 1488 C LEU A 98 -4.039 5.579 7.666 1.00 11.44 C ATOM 1489 O LEU A 98 -4.525 6.700 7.830 1.00 20.23 O ATOM 1490 CB LEU A 98 -4.218 3.723 9.374 1.00 2.41 C ATOM 1491 CG LEU A 98 -5.228 3.069 10.335 1.00 41.24 C ATOM 1492 CD1 LEU A 98 -6.209 4.108 10.875 1.00 12.32 C ATOM 1493 CD2 LEU A 98 -5.975 1.926 9.655 1.00 12.02 C ATOM 0 H LEU A 98 -4.393 2.426 7.254 1.00 45.21 H new ATOM 0 HA LEU A 98 -5.846 4.606 8.275 1.00 31.30 H new ATOM 0 HB2 LEU A 98 -3.471 2.978 9.099 1.00 2.41 H new ATOM 0 HB3 LEU A 98 -3.696 4.516 9.910 1.00 2.41 H new ATOM 0 HG LEU A 98 -4.670 2.653 11.174 1.00 41.24 H new ATOM 0 HD11 LEU A 98 -6.914 3.625 11.552 1.00 12.32 H new ATOM 0 HD12 LEU A 98 -5.661 4.881 11.413 1.00 12.32 H new ATOM 0 HD13 LEU A 98 -6.753 4.560 10.046 1.00 12.32 H new ATOM 0 HD21 LEU A 98 -6.681 1.484 10.358 1.00 12.02 H new ATOM 0 HD22 LEU A 98 -6.516 2.309 8.790 1.00 12.02 H new ATOM 0 HD23 LEU A 98 -5.262 1.168 9.331 1.00 12.02 H new ATOM 1505 N SER A 99 -2.847 5.391 7.113 1.00 23.43 N ATOM 1506 CA SER A 99 -2.017 6.520 6.670 1.00 71.32 C ATOM 1507 C SER A 99 -2.725 7.356 5.592 1.00 40.24 C ATOM 1508 O SER A 99 -2.608 8.582 5.563 1.00 44.13 O ATOM 1509 CB SER A 99 -0.666 6.015 6.148 1.00 3.14 C ATOM 1510 OG SER A 99 0.023 5.271 7.145 1.00 1.11 O ATOM 0 H SER A 99 -2.429 4.474 6.958 1.00 23.43 H new ATOM 0 HA SER A 99 -1.848 7.165 7.532 1.00 71.32 H new ATOM 0 HB2 SER A 99 -0.823 5.391 5.268 1.00 3.14 H new ATOM 0 HB3 SER A 99 -0.055 6.861 5.834 1.00 3.14 H new ATOM 0 HG SER A 99 -0.201 4.321 7.058 1.00 1.11 H new ATOM 1516 N LEU A 100 -3.470 6.691 4.711 1.00 71.14 N ATOM 1517 CA LEU A 100 -4.239 7.383 3.668 1.00 25.25 C ATOM 1518 C LEU A 100 -5.400 8.208 4.259 1.00 40.13 C ATOM 1519 O LEU A 100 -5.626 9.354 3.858 1.00 12.22 O ATOM 1520 CB LEU A 100 -4.785 6.371 2.648 1.00 62.23 C ATOM 1521 CG LEU A 100 -3.726 5.696 1.757 1.00 3.30 C ATOM 1522 CD1 LEU A 100 -4.357 4.624 0.875 1.00 74.24 C ATOM 1523 CD2 LEU A 100 -2.999 6.736 0.902 1.00 53.52 C ATOM 0 H LEU A 100 -3.560 5.675 4.695 1.00 71.14 H new ATOM 0 HA LEU A 100 -3.560 8.074 3.169 1.00 25.25 H new ATOM 0 HB2 LEU A 100 -5.330 5.596 3.187 1.00 62.23 H new ATOM 0 HB3 LEU A 100 -5.505 6.879 2.006 1.00 62.23 H new ATOM 0 HG LEU A 100 -2.997 5.213 2.407 1.00 3.30 H new ATOM 0 HD11 LEU A 100 -3.588 4.163 0.256 1.00 74.24 H new ATOM 0 HD12 LEU A 100 -4.822 3.864 1.503 1.00 74.24 H new ATOM 0 HD13 LEU A 100 -5.114 5.078 0.235 1.00 74.24 H new ATOM 0 HD21 LEU A 100 -2.255 6.239 0.279 1.00 53.52 H new ATOM 0 HD22 LEU A 100 -3.719 7.251 0.266 1.00 53.52 H new ATOM 0 HD23 LEU A 100 -2.505 7.459 1.551 1.00 53.52 H new ATOM 1535 N GLN A 101 -6.137 7.627 5.209 1.00 51.12 N ATOM 1536 CA GLN A 101 -7.296 8.312 5.801 1.00 25.23 C ATOM 1537 C GLN A 101 -6.876 9.477 6.714 1.00 53.32 C ATOM 1538 O GLN A 101 -7.620 10.447 6.872 1.00 10.53 O ATOM 1539 CB GLN A 101 -8.193 7.332 6.574 1.00 34.12 C ATOM 1540 CG GLN A 101 -7.525 6.686 7.780 1.00 32.42 C ATOM 1541 CD GLN A 101 -8.486 5.860 8.613 1.00 74.15 C ATOM 1542 OE1 GLN A 101 -8.671 4.668 8.381 1.00 11.31 O ATOM 1543 NE2 GLN A 101 -9.106 6.484 9.592 1.00 54.31 N ATOM 0 H GLN A 101 -5.958 6.695 5.583 1.00 51.12 H new ATOM 0 HA GLN A 101 -7.868 8.726 4.970 1.00 25.23 H new ATOM 0 HB2 GLN A 101 -9.085 7.861 6.908 1.00 34.12 H new ATOM 0 HB3 GLN A 101 -8.524 6.547 5.894 1.00 34.12 H new ATOM 0 HG2 GLN A 101 -6.708 6.050 7.439 1.00 32.42 H new ATOM 0 HG3 GLN A 101 -7.085 7.463 8.405 1.00 32.42 H new ATOM 0 HE21 GLN A 101 -8.930 7.475 9.758 1.00 54.31 H new ATOM 0 HE22 GLN A 101 -9.763 5.977 10.185 1.00 54.31 H new ATOM 1552 N GLU A 102 -5.698 9.384 7.331 1.00 52.33 N ATOM 1553 CA GLU A 102 -5.190 10.490 8.148 1.00 35.12 C ATOM 1554 C GLU A 102 -4.570 11.588 7.263 1.00 31.13 C ATOM 1555 O GLU A 102 -4.706 12.775 7.552 1.00 30.13 O ATOM 1556 CB GLU A 102 -4.180 9.995 9.202 1.00 13.12 C ATOM 1557 CG GLU A 102 -2.863 9.470 8.638 1.00 14.13 C ATOM 1558 CD GLU A 102 -1.902 9.007 9.727 1.00 61.23 C ATOM 1559 OE1 GLU A 102 -1.422 9.861 10.505 1.00 72.01 O ATOM 1560 OE2 GLU A 102 -1.626 7.793 9.820 1.00 10.45 O ATOM 0 H GLU A 102 -5.085 8.570 7.284 1.00 52.33 H new ATOM 0 HA GLU A 102 -6.037 10.922 8.681 1.00 35.12 H new ATOM 0 HB2 GLU A 102 -3.963 10.814 9.888 1.00 13.12 H new ATOM 0 HB3 GLU A 102 -4.648 9.204 9.788 1.00 13.12 H new ATOM 0 HG2 GLU A 102 -3.067 8.640 7.962 1.00 14.13 H new ATOM 0 HG3 GLU A 102 -2.387 10.253 8.047 1.00 14.13 H new ATOM 1567 N LEU A 103 -3.909 11.192 6.171 1.00 72.24 N ATOM 1568 CA LEU A 103 -3.306 12.158 5.242 1.00 41.14 C ATOM 1569 C LEU A 103 -4.363 13.071 4.599 1.00 72.33 C ATOM 1570 O LEU A 103 -4.221 14.292 4.601 1.00 63.02 O ATOM 1571 CB LEU A 103 -2.514 11.436 4.140 1.00 0.32 C ATOM 1572 CG LEU A 103 -1.818 12.364 3.126 1.00 4.41 C ATOM 1573 CD1 LEU A 103 -0.781 13.248 3.817 1.00 5.44 C ATOM 1574 CD2 LEU A 103 -1.184 11.554 1.998 1.00 20.31 C ATOM 0 H LEU A 103 -3.777 10.215 5.908 1.00 72.24 H new ATOM 0 HA LEU A 103 -2.628 12.779 5.828 1.00 41.14 H new ATOM 0 HB2 LEU A 103 -1.760 10.805 4.610 1.00 0.32 H new ATOM 0 HB3 LEU A 103 -3.192 10.775 3.600 1.00 0.32 H new ATOM 0 HG LEU A 103 -2.574 13.016 2.689 1.00 4.41 H new ATOM 0 HD11 LEU A 103 -0.304 13.894 3.080 1.00 5.44 H new ATOM 0 HD12 LEU A 103 -1.271 13.861 4.573 1.00 5.44 H new ATOM 0 HD13 LEU A 103 -0.027 12.621 4.292 1.00 5.44 H new ATOM 0 HD21 LEU A 103 -0.698 12.229 1.294 1.00 20.31 H new ATOM 0 HD22 LEU A 103 -0.444 10.869 2.413 1.00 20.31 H new ATOM 0 HD23 LEU A 103 -1.956 10.984 1.481 1.00 20.31 H new ATOM 1586 N GLN A 104 -5.425 12.474 4.057 1.00 42.30 N ATOM 1587 CA GLN A 104 -6.469 13.237 3.352 1.00 53.11 C ATOM 1588 C GLN A 104 -7.089 14.340 4.232 1.00 53.11 C ATOM 1589 O GLN A 104 -7.593 15.340 3.716 1.00 51.40 O ATOM 1590 CB GLN A 104 -7.564 12.292 2.832 1.00 73.12 C ATOM 1591 CG GLN A 104 -8.236 11.458 3.915 1.00 34.34 C ATOM 1592 CD GLN A 104 -9.293 10.518 3.361 1.00 52.05 C ATOM 1593 OE1 GLN A 104 -10.467 10.862 3.277 1.00 50.21 O ATOM 1594 NE2 GLN A 104 -8.886 9.330 2.965 1.00 64.25 N ATOM 0 H GLN A 104 -5.590 11.468 4.090 1.00 42.30 H new ATOM 0 HA GLN A 104 -5.988 13.732 2.508 1.00 53.11 H new ATOM 0 HB2 GLN A 104 -8.324 12.882 2.320 1.00 73.12 H new ATOM 0 HB3 GLN A 104 -7.128 11.622 2.091 1.00 73.12 H new ATOM 0 HG2 GLN A 104 -7.479 10.877 4.442 1.00 34.34 H new ATOM 0 HG3 GLN A 104 -8.695 12.123 4.647 1.00 34.34 H new ATOM 0 HE21 GLN A 104 -7.902 9.074 3.048 1.00 64.25 H new ATOM 0 HE22 GLN A 104 -9.555 8.666 2.575 1.00 64.25 H new ATOM 1603 N VAL A 105 -7.053 14.164 5.553 1.00 50.13 N ATOM 1604 CA VAL A 105 -7.564 15.185 6.483 1.00 2.24 C ATOM 1605 C VAL A 105 -6.428 16.022 7.103 1.00 11.53 C ATOM 1606 O VAL A 105 -6.670 17.078 7.687 1.00 33.22 O ATOM 1607 CB VAL A 105 -8.407 14.549 7.620 1.00 20.31 C ATOM 1608 CG1 VAL A 105 -9.603 13.790 7.046 1.00 23.02 C ATOM 1609 CG2 VAL A 105 -7.553 13.633 8.499 1.00 61.30 C ATOM 0 H VAL A 105 -6.679 13.331 6.006 1.00 50.13 H new ATOM 0 HA VAL A 105 -8.200 15.843 5.891 1.00 2.24 H new ATOM 0 HB VAL A 105 -8.783 15.356 8.249 1.00 20.31 H new ATOM 0 HG11 VAL A 105 -10.181 13.352 7.860 1.00 23.02 H new ATOM 0 HG12 VAL A 105 -10.234 14.477 6.482 1.00 23.02 H new ATOM 0 HG13 VAL A 105 -9.249 12.999 6.386 1.00 23.02 H new ATOM 0 HG21 VAL A 105 -8.172 13.203 9.286 1.00 61.30 H new ATOM 0 HG22 VAL A 105 -7.133 12.833 7.890 1.00 61.30 H new ATOM 0 HG23 VAL A 105 -6.745 14.210 8.948 1.00 61.30 H new ATOM 1619 N SER A 106 -5.190 15.545 6.970 1.00 42.33 N ATOM 1620 CA SER A 106 -4.016 16.232 7.540 1.00 34.44 C ATOM 1621 C SER A 106 -3.062 16.730 6.441 1.00 5.15 C ATOM 1622 O SER A 106 -1.897 17.027 6.705 1.00 33.51 O ATOM 1623 CB SER A 106 -3.269 15.281 8.490 1.00 14.44 C ATOM 1624 OG SER A 106 -2.203 15.933 9.174 1.00 41.33 O ATOM 0 H SER A 106 -4.967 14.683 6.472 1.00 42.33 H new ATOM 0 HA SER A 106 -4.371 17.102 8.093 1.00 34.44 H new ATOM 0 HB2 SER A 106 -3.970 14.873 9.218 1.00 14.44 H new ATOM 0 HB3 SER A 106 -2.873 14.439 7.922 1.00 14.44 H new ATOM 0 HG SER A 106 -1.754 16.554 8.563 1.00 41.33 H new ATOM 1630 N SER A 107 -3.562 16.821 5.213 1.00 21.14 N ATOM 1631 CA SER A 107 -2.759 17.280 4.068 1.00 52.14 C ATOM 1632 C SER A 107 -2.290 18.734 4.234 1.00 4.53 C ATOM 1633 O SER A 107 -1.089 18.997 4.335 1.00 61.52 O ATOM 1634 CB SER A 107 -3.563 17.138 2.768 1.00 72.41 C ATOM 1635 OG SER A 107 -4.783 17.867 2.825 1.00 50.31 O ATOM 0 H SER A 107 -4.525 16.583 4.977 1.00 21.14 H new ATOM 0 HA SER A 107 -1.871 16.650 4.023 1.00 52.14 H new ATOM 0 HB2 SER A 107 -2.965 17.493 1.929 1.00 72.41 H new ATOM 0 HB3 SER A 107 -3.776 16.085 2.584 1.00 72.41 H new ATOM 0 HG SER A 107 -5.270 17.757 1.982 1.00 50.31 H new ATOM 1641 N ALA A 108 -3.248 19.667 4.251 1.00 24.43 N ATOM 1642 CA ALA A 108 -2.968 21.107 4.382 1.00 13.14 C ATOM 1643 C ALA A 108 -2.225 21.660 3.152 1.00 24.44 C ATOM 1644 O ALA A 108 -2.777 22.448 2.381 1.00 50.30 O ATOM 1645 CB ALA A 108 -2.188 21.402 5.666 1.00 2.44 C ATOM 0 H ALA A 108 -4.241 19.448 4.174 1.00 24.43 H new ATOM 0 HA ALA A 108 -3.929 21.618 4.441 1.00 13.14 H new ATOM 0 HB1 ALA A 108 -1.995 22.472 5.737 1.00 2.44 H new ATOM 0 HB2 ALA A 108 -2.772 21.081 6.528 1.00 2.44 H new ATOM 0 HB3 ALA A 108 -1.241 20.863 5.648 1.00 2.44 H new ATOM 1651 N ALA A 109 -0.977 21.232 2.975 1.00 53.02 N ATOM 1652 CA ALA A 109 -0.153 21.645 1.835 1.00 1.43 C ATOM 1653 C ALA A 109 -0.762 21.224 0.486 1.00 33.41 C ATOM 1654 O ALA A 109 -0.580 21.902 -0.525 1.00 55.55 O ATOM 1655 CB ALA A 109 1.240 21.054 1.980 1.00 20.11 C ATOM 0 H ALA A 109 -0.507 20.591 3.614 1.00 53.02 H new ATOM 0 HA ALA A 109 -0.105 22.734 1.839 1.00 1.43 H new ATOM 0 HB1 ALA A 109 1.855 21.360 1.133 1.00 20.11 H new ATOM 0 HB2 ALA A 109 1.692 21.412 2.905 1.00 20.11 H new ATOM 0 HB3 ALA A 109 1.173 19.966 2.006 1.00 20.11 H new ATOM 1661 N ALA A 110 -1.442 20.075 0.480 1.00 4.23 N ATOM 1662 CA ALA A 110 -2.126 19.555 -0.717 1.00 43.11 C ATOM 1663 C ALA A 110 -1.148 19.125 -1.832 1.00 71.11 C ATOM 1664 O ALA A 110 -1.576 18.651 -2.883 1.00 44.00 O ATOM 1665 CB ALA A 110 -3.128 20.579 -1.251 1.00 42.05 C ATOM 0 H ALA A 110 -1.537 19.477 1.301 1.00 4.23 H new ATOM 0 HA ALA A 110 -2.659 18.657 -0.405 1.00 43.11 H new ATOM 0 HB1 ALA A 110 -3.623 20.177 -2.135 1.00 42.05 H new ATOM 0 HB2 ALA A 110 -3.872 20.794 -0.484 1.00 42.05 H new ATOM 0 HB3 ALA A 110 -2.604 21.498 -1.515 1.00 42.05 H new ATOM 1671 N GLY A 111 0.157 19.261 -1.593 1.00 41.11 N ATOM 1672 CA GLY A 111 1.141 18.890 -2.611 1.00 51.43 C ATOM 1673 C GLY A 111 2.592 19.040 -2.162 1.00 61.42 C ATOM 1674 O GLY A 111 3.437 18.220 -2.516 1.00 30.01 O ATOM 0 H GLY A 111 0.552 19.618 -0.723 1.00 41.11 H new ATOM 0 HA2 GLY A 111 0.969 17.855 -2.907 1.00 51.43 H new ATOM 0 HA3 GLY A 111 0.981 19.505 -3.496 1.00 51.43 H new ATOM 1678 N VAL A 112 2.883 20.084 -1.388 1.00 55.02 N ATOM 1679 CA VAL A 112 4.251 20.335 -0.903 1.00 41.53 C ATOM 1680 C VAL A 112 4.843 19.096 -0.194 1.00 74.21 C ATOM 1681 O VAL A 112 4.285 18.605 0.788 1.00 74.41 O ATOM 1682 CB VAL A 112 4.296 21.545 0.065 1.00 24.21 C ATOM 1683 CG1 VAL A 112 5.716 21.786 0.582 1.00 72.23 C ATOM 1684 CG2 VAL A 112 3.742 22.799 -0.612 1.00 51.31 C ATOM 0 H VAL A 112 2.196 20.772 -1.080 1.00 55.02 H new ATOM 0 HA VAL A 112 4.854 20.559 -1.783 1.00 41.53 H new ATOM 0 HB VAL A 112 3.665 21.313 0.923 1.00 24.21 H new ATOM 0 HG11 VAL A 112 5.717 22.641 1.259 1.00 72.23 H new ATOM 0 HG12 VAL A 112 6.064 20.901 1.115 1.00 72.23 H new ATOM 0 HG13 VAL A 112 6.380 21.988 -0.259 1.00 72.23 H new ATOM 0 HG21 VAL A 112 3.783 23.637 0.084 1.00 51.31 H new ATOM 0 HG22 VAL A 112 4.340 23.031 -1.494 1.00 51.31 H new ATOM 0 HG23 VAL A 112 2.708 22.625 -0.910 1.00 51.31 H new ATOM 1694 N PRO A 113 5.979 18.569 -0.694 1.00 33.54 N ATOM 1695 CA PRO A 113 6.624 17.381 -0.113 1.00 65.13 C ATOM 1696 C PRO A 113 7.412 17.688 1.174 1.00 24.11 C ATOM 1697 O PRO A 113 7.876 18.808 1.384 1.00 42.41 O ATOM 1698 CB PRO A 113 7.568 16.928 -1.233 1.00 52.01 C ATOM 1699 CG PRO A 113 7.940 18.190 -1.938 1.00 34.14 C ATOM 1700 CD PRO A 113 6.722 19.081 -1.868 1.00 12.53 C ATOM 0 HA PRO A 113 5.896 16.630 0.193 1.00 65.13 H new ATOM 0 HB2 PRO A 113 8.447 16.423 -0.832 1.00 52.01 H new ATOM 0 HB3 PRO A 113 7.077 16.226 -1.907 1.00 52.01 H new ATOM 0 HG2 PRO A 113 8.798 18.664 -1.462 1.00 34.14 H new ATOM 0 HG3 PRO A 113 8.219 17.991 -2.973 1.00 34.14 H new ATOM 0 HD2 PRO A 113 6.998 20.128 -1.741 1.00 12.53 H new ATOM 0 HD3 PRO A 113 6.126 19.017 -2.778 1.00 12.53 H new ATOM 1708 N GLY A 114 7.535 16.687 2.048 1.00 5.25 N ATOM 1709 CA GLY A 114 8.341 16.833 3.262 1.00 0.33 C ATOM 1710 C GLY A 114 7.658 17.618 4.385 1.00 72.44 C ATOM 1711 O GLY A 114 8.163 17.659 5.506 1.00 31.10 O ATOM 0 H GLY A 114 7.092 15.775 1.940 1.00 5.25 H new ATOM 0 HA2 GLY A 114 8.599 15.841 3.634 1.00 0.33 H new ATOM 0 HA3 GLY A 114 9.276 17.330 3.005 1.00 0.33 H new ATOM 1715 N THR A 115 6.514 18.238 4.095 1.00 12.01 N ATOM 1716 CA THR A 115 5.788 19.044 5.095 1.00 63.02 C ATOM 1717 C THR A 115 5.125 18.174 6.179 1.00 52.12 C ATOM 1718 O THR A 115 5.129 18.522 7.361 1.00 11.13 O ATOM 1719 CB THR A 115 4.711 19.935 4.430 1.00 1.32 C ATOM 1720 OG1 THR A 115 4.021 20.710 5.422 1.00 22.43 O ATOM 1721 CG2 THR A 115 3.707 19.095 3.652 1.00 54.23 C ATOM 0 H THR A 115 6.065 18.202 3.180 1.00 12.01 H new ATOM 0 HA THR A 115 6.537 19.677 5.571 1.00 63.02 H new ATOM 0 HB THR A 115 5.217 20.605 3.735 1.00 1.32 H new ATOM 0 HG1 THR A 115 3.344 21.270 4.987 1.00 22.43 H new ATOM 0 HG21 THR A 115 2.963 19.748 3.196 1.00 54.23 H new ATOM 0 HG22 THR A 115 4.226 18.537 2.873 1.00 54.23 H new ATOM 0 HG23 THR A 115 3.213 18.399 4.329 1.00 54.23 H new ATOM 1729 N ASN A 116 4.554 17.039 5.771 1.00 32.14 N ATOM 1730 CA ASN A 116 3.923 16.102 6.710 1.00 15.44 C ATOM 1731 C ASN A 116 4.572 14.711 6.614 1.00 34.43 C ATOM 1732 O ASN A 116 4.501 14.060 5.568 1.00 4.14 O ATOM 1733 CB ASN A 116 2.415 15.986 6.438 1.00 40.02 C ATOM 1734 CG ASN A 116 1.667 17.275 6.735 1.00 43.15 C ATOM 1735 OD1 ASN A 116 1.261 17.525 7.864 1.00 43.23 O ATOM 1736 ND2 ASN A 116 1.460 18.093 5.725 1.00 11.15 N ATOM 0 H ASN A 116 4.514 16.744 4.795 1.00 32.14 H new ATOM 0 HA ASN A 116 4.072 16.494 7.716 1.00 15.44 H new ATOM 0 HB2 ASN A 116 2.258 15.711 5.395 1.00 40.02 H new ATOM 0 HB3 ASN A 116 2.001 15.182 7.046 1.00 40.02 H new ATOM 0 HD21 ASN A 116 0.949 18.964 5.870 1.00 11.15 H new ATOM 0 HD22 ASN A 116 1.811 17.856 4.797 1.00 11.15 H new ATOM 1743 N PRO A 117 5.224 14.239 7.700 1.00 5.14 N ATOM 1744 CA PRO A 117 5.864 12.904 7.752 1.00 32.02 C ATOM 1745 C PRO A 117 4.980 11.759 7.214 1.00 71.11 C ATOM 1746 O PRO A 117 5.495 10.749 6.733 1.00 31.24 O ATOM 1747 CB PRO A 117 6.137 12.715 9.248 1.00 4.21 C ATOM 1748 CG PRO A 117 6.351 14.098 9.759 1.00 52.32 C ATOM 1749 CD PRO A 117 5.423 14.985 8.962 1.00 30.44 C ATOM 0 HA PRO A 117 6.749 12.865 7.117 1.00 32.02 H new ATOM 0 HB2 PRO A 117 5.298 12.231 9.748 1.00 4.21 H new ATOM 0 HB3 PRO A 117 7.013 12.088 9.417 1.00 4.21 H new ATOM 0 HG2 PRO A 117 6.129 14.159 10.824 1.00 52.32 H new ATOM 0 HG3 PRO A 117 7.389 14.405 9.631 1.00 52.32 H new ATOM 0 HD2 PRO A 117 4.480 15.149 9.483 1.00 30.44 H new ATOM 0 HD3 PRO A 117 5.863 15.966 8.782 1.00 30.44 H new ATOM 1757 N VAL A 118 3.653 11.924 7.290 1.00 31.45 N ATOM 1758 CA VAL A 118 2.709 10.918 6.765 1.00 74.03 C ATOM 1759 C VAL A 118 3.060 10.504 5.322 1.00 73.10 C ATOM 1760 O VAL A 118 2.878 9.350 4.931 1.00 70.25 O ATOM 1761 CB VAL A 118 1.245 11.430 6.806 1.00 42.21 C ATOM 1762 CG1 VAL A 118 0.272 10.357 6.320 1.00 33.34 C ATOM 1763 CG2 VAL A 118 0.871 11.888 8.212 1.00 4.21 C ATOM 0 H VAL A 118 3.206 12.740 7.708 1.00 31.45 H new ATOM 0 HA VAL A 118 2.799 10.047 7.414 1.00 74.03 H new ATOM 0 HB VAL A 118 1.173 12.284 6.133 1.00 42.21 H new ATOM 0 HG11 VAL A 118 -0.746 10.744 6.360 1.00 33.34 H new ATOM 0 HG12 VAL A 118 0.516 10.083 5.294 1.00 33.34 H new ATOM 0 HG13 VAL A 118 0.351 9.478 6.959 1.00 33.34 H new ATOM 0 HG21 VAL A 118 -0.160 12.243 8.217 1.00 4.21 H new ATOM 0 HG22 VAL A 118 0.971 11.053 8.905 1.00 4.21 H new ATOM 0 HG23 VAL A 118 1.534 12.696 8.520 1.00 4.21 H new ATOM 1773 N LEU A 119 3.581 11.453 4.541 1.00 65.24 N ATOM 1774 CA LEU A 119 4.034 11.175 3.169 1.00 14.42 C ATOM 1775 C LEU A 119 5.100 10.064 3.149 1.00 54.31 C ATOM 1776 O LEU A 119 5.086 9.182 2.287 1.00 55.01 O ATOM 1777 CB LEU A 119 4.594 12.458 2.530 1.00 44.04 C ATOM 1778 CG LEU A 119 3.605 13.636 2.441 1.00 34.23 C ATOM 1779 CD1 LEU A 119 4.291 14.877 1.875 1.00 32.44 C ATOM 1780 CD2 LEU A 119 2.390 13.260 1.595 1.00 13.32 C ATOM 0 H LEU A 119 3.701 12.423 4.832 1.00 65.24 H new ATOM 0 HA LEU A 119 3.177 10.830 2.591 1.00 14.42 H new ATOM 0 HB2 LEU A 119 5.465 12.779 3.102 1.00 44.04 H new ATOM 0 HB3 LEU A 119 4.943 12.221 1.525 1.00 44.04 H new ATOM 0 HG LEU A 119 3.261 13.866 3.449 1.00 34.23 H new ATOM 0 HD11 LEU A 119 3.574 15.696 1.821 1.00 32.44 H new ATOM 0 HD12 LEU A 119 5.120 15.162 2.523 1.00 32.44 H new ATOM 0 HD13 LEU A 119 4.670 14.660 0.876 1.00 32.44 H new ATOM 0 HD21 LEU A 119 1.705 14.106 1.546 1.00 13.32 H new ATOM 0 HD22 LEU A 119 2.715 12.997 0.588 1.00 13.32 H new ATOM 0 HD23 LEU A 119 1.882 12.408 2.046 1.00 13.32 H new ATOM 1792 N ASN A 120 6.014 10.109 4.118 1.00 64.24 N ATOM 1793 CA ASN A 120 7.052 9.083 4.257 1.00 62.14 C ATOM 1794 C ASN A 120 6.452 7.775 4.783 1.00 71.22 C ATOM 1795 O ASN A 120 6.868 6.683 4.393 1.00 54.24 O ATOM 1796 CB ASN A 120 8.157 9.559 5.210 1.00 43.41 C ATOM 1797 CG ASN A 120 8.778 10.874 4.778 1.00 44.03 C ATOM 1798 OD1 ASN A 120 8.822 11.201 3.596 1.00 63.14 O ATOM 1799 ND2 ASN A 120 9.262 11.639 5.734 1.00 65.51 N ATOM 0 H ASN A 120 6.058 10.847 4.821 1.00 64.24 H new ATOM 0 HA ASN A 120 7.482 8.906 3.271 1.00 62.14 H new ATOM 0 HB2 ASN A 120 7.744 9.669 6.212 1.00 43.41 H new ATOM 0 HB3 ASN A 120 8.934 8.797 5.268 1.00 43.41 H new ATOM 0 HD21 ASN A 120 9.691 12.535 5.502 1.00 65.51 H new ATOM 0 HD22 ASN A 120 9.208 11.336 6.706 1.00 65.51 H new ATOM 1806 N ASN A 121 5.473 7.896 5.678 1.00 41.24 N ATOM 1807 CA ASN A 121 4.771 6.729 6.227 1.00 1.35 C ATOM 1808 C ASN A 121 4.096 5.912 5.115 1.00 31.20 C ATOM 1809 O ASN A 121 4.112 4.681 5.146 1.00 44.23 O ATOM 1810 CB ASN A 121 3.742 7.173 7.276 1.00 62.34 C ATOM 1811 CG ASN A 121 4.401 7.824 8.481 1.00 12.34 C ATOM 1812 OD1 ASN A 121 5.474 8.407 8.380 1.00 74.32 O ATOM 1813 ND2 ASN A 121 3.764 7.732 9.629 1.00 23.43 N ATOM 0 H ASN A 121 5.145 8.791 6.041 1.00 41.24 H new ATOM 0 HA ASN A 121 5.507 6.086 6.710 1.00 1.35 H new ATOM 0 HB2 ASN A 121 3.042 7.875 6.823 1.00 62.34 H new ATOM 0 HB3 ASN A 121 3.162 6.310 7.602 1.00 62.34 H new ATOM 0 HD21 ASN A 121 4.162 8.153 10.468 1.00 23.43 H new ATOM 0 HD22 ASN A 121 2.872 7.240 9.679 1.00 23.43 H new ATOM 1820 N LEU A 122 3.512 6.600 4.133 1.00 72.35 N ATOM 1821 CA LEU A 122 2.971 5.931 2.945 1.00 40.21 C ATOM 1822 C LEU A 122 4.068 5.142 2.215 1.00 2.24 C ATOM 1823 O LEU A 122 3.883 3.971 1.881 1.00 3.21 O ATOM 1824 CB LEU A 122 2.327 6.946 1.988 1.00 50.22 C ATOM 1825 CG LEU A 122 0.994 7.546 2.462 1.00 71.42 C ATOM 1826 CD1 LEU A 122 0.427 8.494 1.408 1.00 21.12 C ATOM 1827 CD2 LEU A 122 -0.009 6.439 2.785 1.00 61.43 C ATOM 0 H LEU A 122 3.401 7.614 4.134 1.00 72.35 H new ATOM 0 HA LEU A 122 2.203 5.233 3.279 1.00 40.21 H new ATOM 0 HB2 LEU A 122 3.033 7.760 1.820 1.00 50.22 H new ATOM 0 HB3 LEU A 122 2.165 6.460 1.026 1.00 50.22 H new ATOM 0 HG LEU A 122 1.179 8.117 3.372 1.00 71.42 H new ATOM 0 HD11 LEU A 122 -0.517 8.909 1.762 1.00 21.12 H new ATOM 0 HD12 LEU A 122 1.135 9.304 1.228 1.00 21.12 H new ATOM 0 HD13 LEU A 122 0.258 7.947 0.480 1.00 21.12 H new ATOM 0 HD21 LEU A 122 -0.947 6.884 3.119 1.00 61.43 H new ATOM 0 HD22 LEU A 122 -0.189 5.840 1.893 1.00 61.43 H new ATOM 0 HD23 LEU A 122 0.392 5.803 3.574 1.00 61.43 H new ATOM 1839 N LEU A 123 5.210 5.790 1.982 1.00 25.43 N ATOM 1840 CA LEU A 123 6.361 5.131 1.354 1.00 60.43 C ATOM 1841 C LEU A 123 6.760 3.867 2.133 1.00 33.03 C ATOM 1842 O LEU A 123 6.962 2.804 1.549 1.00 3.22 O ATOM 1843 CB LEU A 123 7.549 6.104 1.277 1.00 14.31 C ATOM 1844 CG LEU A 123 8.793 5.578 0.541 1.00 30.12 C ATOM 1845 CD1 LEU A 123 8.459 5.219 -0.905 1.00 22.34 C ATOM 1846 CD2 LEU A 123 9.922 6.607 0.597 1.00 34.30 C ATOM 0 H LEU A 123 5.365 6.770 2.218 1.00 25.43 H new ATOM 0 HA LEU A 123 6.078 4.834 0.344 1.00 60.43 H new ATOM 0 HB2 LEU A 123 7.216 7.017 0.784 1.00 14.31 H new ATOM 0 HB3 LEU A 123 7.838 6.377 2.292 1.00 14.31 H new ATOM 0 HG LEU A 123 9.129 4.671 1.043 1.00 30.12 H new ATOM 0 HD11 LEU A 123 9.355 4.850 -1.404 1.00 22.34 H new ATOM 0 HD12 LEU A 123 7.690 4.446 -0.920 1.00 22.34 H new ATOM 0 HD13 LEU A 123 8.093 6.105 -1.425 1.00 22.34 H new ATOM 0 HD21 LEU A 123 10.795 6.219 0.072 1.00 34.30 H new ATOM 0 HD22 LEU A 123 9.595 7.532 0.123 1.00 34.30 H new ATOM 0 HD23 LEU A 123 10.183 6.805 1.637 1.00 34.30 H new ATOM 1858 N SER A 124 6.859 3.995 3.457 1.00 62.14 N ATOM 1859 CA SER A 124 7.173 2.855 4.334 1.00 24.11 C ATOM 1860 C SER A 124 6.140 1.728 4.186 1.00 1.04 C ATOM 1861 O SER A 124 6.496 0.553 4.087 1.00 2.25 O ATOM 1862 CB SER A 124 7.236 3.306 5.801 1.00 12.55 C ATOM 1863 OG SER A 124 7.497 2.210 6.667 1.00 34.42 O ATOM 0 H SER A 124 6.727 4.877 3.951 1.00 62.14 H new ATOM 0 HA SER A 124 8.147 2.470 4.031 1.00 24.11 H new ATOM 0 HB2 SER A 124 8.015 4.059 5.919 1.00 12.55 H new ATOM 0 HB3 SER A 124 6.293 3.776 6.080 1.00 12.55 H new ATOM 0 HG SER A 124 7.533 2.527 7.594 1.00 34.42 H new ATOM 1869 N CYS A 125 4.857 2.092 4.166 1.00 51.32 N ATOM 1870 CA CYS A 125 3.775 1.113 3.996 1.00 11.43 C ATOM 1871 C CYS A 125 3.890 0.382 2.649 1.00 44.42 C ATOM 1872 O CYS A 125 3.857 -0.845 2.593 1.00 75.31 O ATOM 1873 CB CYS A 125 2.402 1.796 4.105 1.00 32.30 C ATOM 1874 SG CYS A 125 2.059 2.538 5.721 1.00 23.13 S ATOM 0 H CYS A 125 4.539 3.056 4.265 1.00 51.32 H new ATOM 0 HA CYS A 125 3.870 0.378 4.795 1.00 11.43 H new ATOM 0 HB2 CYS A 125 2.334 2.571 3.342 1.00 32.30 H new ATOM 0 HB3 CYS A 125 1.627 1.062 3.884 1.00 32.30 H new ATOM 0 HG CYS A 125 2.793 3.599 5.876 1.00 23.13 H new ATOM 1880 N VAL A 126 4.040 1.146 1.569 1.00 25.33 N ATOM 1881 CA VAL A 126 4.165 0.575 0.221 1.00 52.10 C ATOM 1882 C VAL A 126 5.396 -0.338 0.102 1.00 51.31 C ATOM 1883 O VAL A 126 5.313 -1.451 -0.430 1.00 44.30 O ATOM 1884 CB VAL A 126 4.247 1.691 -0.851 1.00 64.42 C ATOM 1885 CG1 VAL A 126 4.397 1.099 -2.252 1.00 63.23 C ATOM 1886 CG2 VAL A 126 3.020 2.594 -0.775 1.00 21.21 C ATOM 0 H VAL A 126 4.079 2.165 1.597 1.00 25.33 H new ATOM 0 HA VAL A 126 3.271 -0.024 0.049 1.00 52.10 H new ATOM 0 HB VAL A 126 5.133 2.292 -0.647 1.00 64.42 H new ATOM 0 HG11 VAL A 126 4.452 1.905 -2.984 1.00 63.23 H new ATOM 0 HG12 VAL A 126 5.308 0.503 -2.299 1.00 63.23 H new ATOM 0 HG13 VAL A 126 3.538 0.466 -2.473 1.00 63.23 H new ATOM 0 HG21 VAL A 126 3.093 3.372 -1.535 1.00 21.21 H new ATOM 0 HG22 VAL A 126 2.121 2.002 -0.948 1.00 21.21 H new ATOM 0 HG23 VAL A 126 2.967 3.054 0.212 1.00 21.21 H new ATOM 1896 N GLN A 127 6.537 0.134 0.600 1.00 0.13 N ATOM 1897 CA GLN A 127 7.774 -0.651 0.570 1.00 11.02 C ATOM 1898 C GLN A 127 7.649 -1.938 1.403 1.00 14.42 C ATOM 1899 O GLN A 127 8.133 -2.993 0.996 1.00 24.35 O ATOM 1900 CB GLN A 127 8.961 0.195 1.053 1.00 73.50 C ATOM 1901 CG GLN A 127 9.311 1.345 0.113 1.00 50.13 C ATOM 1902 CD GLN A 127 10.548 2.117 0.544 1.00 63.13 C ATOM 1903 OE1 GLN A 127 10.846 2.237 1.728 1.00 53.43 O ATOM 1904 NE2 GLN A 127 11.279 2.648 -0.417 1.00 11.35 N ATOM 0 H GLN A 127 6.633 1.054 1.029 1.00 0.13 H new ATOM 0 HA GLN A 127 7.954 -0.946 -0.464 1.00 11.02 H new ATOM 0 HB2 GLN A 127 8.732 0.599 2.039 1.00 73.50 H new ATOM 0 HB3 GLN A 127 9.833 -0.449 1.167 1.00 73.50 H new ATOM 0 HG2 GLN A 127 9.469 0.950 -0.891 1.00 50.13 H new ATOM 0 HG3 GLN A 127 8.465 2.030 0.057 1.00 50.13 H new ATOM 0 HE21 GLN A 127 11.003 2.530 -1.392 1.00 11.35 H new ATOM 0 HE22 GLN A 127 12.120 3.177 -0.185 1.00 11.35 H new ATOM 1913 N GLU A 128 6.984 -1.848 2.557 1.00 15.43 N ATOM 1914 CA GLU A 128 6.749 -3.022 3.410 1.00 24.13 C ATOM 1915 C GLU A 128 5.840 -4.045 2.707 1.00 25.30 C ATOM 1916 O GLU A 128 6.203 -5.211 2.564 1.00 0.13 O ATOM 1917 CB GLU A 128 6.129 -2.588 4.752 1.00 45.33 C ATOM 1918 CG GLU A 128 5.939 -3.725 5.762 1.00 51.41 C ATOM 1919 CD GLU A 128 7.251 -4.365 6.208 1.00 4.12 C ATOM 1920 OE1 GLU A 128 8.269 -3.647 6.322 1.00 61.31 O ATOM 1921 OE2 GLU A 128 7.267 -5.587 6.469 1.00 20.34 O ATOM 0 H GLU A 128 6.598 -0.978 2.924 1.00 15.43 H new ATOM 0 HA GLU A 128 7.709 -3.501 3.601 1.00 24.13 H new ATOM 0 HB2 GLU A 128 6.763 -1.823 5.200 1.00 45.33 H new ATOM 0 HB3 GLU A 128 5.161 -2.126 4.558 1.00 45.33 H new ATOM 0 HG2 GLU A 128 5.415 -3.340 6.637 1.00 51.41 H new ATOM 0 HG3 GLU A 128 5.301 -4.491 5.320 1.00 51.41 H new ATOM 1928 N ILE A 129 4.666 -3.595 2.252 1.00 15.01 N ATOM 1929 CA ILE A 129 3.712 -4.466 1.544 1.00 71.04 C ATOM 1930 C ILE A 129 4.369 -5.162 0.339 1.00 62.30 C ATOM 1931 O ILE A 129 4.322 -6.388 0.209 1.00 62.01 O ATOM 1932 CB ILE A 129 2.474 -3.663 1.052 1.00 25.35 C ATOM 1933 CG1 ILE A 129 1.712 -3.058 2.244 1.00 32.04 C ATOM 1934 CG2 ILE A 129 1.547 -4.544 0.212 1.00 73.32 C ATOM 1935 CD1 ILE A 129 0.526 -2.202 1.848 1.00 61.00 C ATOM 0 H ILE A 129 4.350 -2.631 2.360 1.00 15.01 H new ATOM 0 HA ILE A 129 3.390 -5.223 2.259 1.00 71.04 H new ATOM 0 HB ILE A 129 2.830 -2.849 0.421 1.00 25.35 H new ATOM 0 HG12 ILE A 129 1.365 -3.866 2.888 1.00 32.04 H new ATOM 0 HG13 ILE A 129 2.402 -2.454 2.834 1.00 32.04 H new ATOM 0 HG21 ILE A 129 0.690 -3.958 -0.119 1.00 73.32 H new ATOM 0 HG22 ILE A 129 2.089 -4.917 -0.657 1.00 73.32 H new ATOM 0 HG23 ILE A 129 1.201 -5.385 0.813 1.00 73.32 H new ATOM 0 HD11 ILE A 129 0.043 -1.813 2.744 1.00 61.00 H new ATOM 0 HD12 ILE A 129 0.867 -1.371 1.230 1.00 61.00 H new ATOM 0 HD13 ILE A 129 -0.186 -2.805 1.285 1.00 61.00 H new ATOM 1947 N SER A 130 4.987 -4.369 -0.536 1.00 21.15 N ATOM 1948 CA SER A 130 5.650 -4.905 -1.734 1.00 62.14 C ATOM 1949 C SER A 130 6.779 -5.880 -1.367 1.00 70.35 C ATOM 1950 O SER A 130 6.997 -6.877 -2.056 1.00 31.01 O ATOM 1951 CB SER A 130 6.214 -3.769 -2.599 1.00 64.34 C ATOM 1952 OG SER A 130 7.231 -3.048 -1.919 1.00 73.12 O ATOM 0 H SER A 130 5.045 -3.355 -0.442 1.00 21.15 H new ATOM 0 HA SER A 130 4.895 -5.449 -2.302 1.00 62.14 H new ATOM 0 HB2 SER A 130 6.616 -4.181 -3.524 1.00 64.34 H new ATOM 0 HB3 SER A 130 5.409 -3.089 -2.877 1.00 64.34 H new ATOM 0 HG SER A 130 6.825 -2.478 -1.233 1.00 73.12 H new ATOM 1958 N ASP A 131 7.488 -5.586 -0.277 1.00 51.01 N ATOM 1959 CA ASP A 131 8.573 -6.447 0.205 1.00 21.33 C ATOM 1960 C ASP A 131 8.034 -7.801 0.708 1.00 42.22 C ATOM 1961 O ASP A 131 8.594 -8.853 0.395 1.00 53.13 O ATOM 1962 CB ASP A 131 9.349 -5.731 1.315 1.00 33.02 C ATOM 1963 CG ASP A 131 10.506 -6.550 1.856 1.00 12.40 C ATOM 1964 OD1 ASP A 131 11.458 -6.821 1.097 1.00 61.11 O ATOM 1965 OD2 ASP A 131 10.476 -6.918 3.045 1.00 11.43 O ATOM 0 H ASP A 131 7.331 -4.755 0.293 1.00 51.01 H new ATOM 0 HA ASP A 131 9.246 -6.650 -0.628 1.00 21.33 H new ATOM 0 HB2 ASP A 131 9.730 -4.784 0.931 1.00 33.02 H new ATOM 0 HB3 ASP A 131 8.667 -5.493 2.131 1.00 33.02 H new ATOM 1970 N VAL A 132 6.939 -7.771 1.473 1.00 44.22 N ATOM 1971 CA VAL A 132 6.298 -9.001 1.970 1.00 10.25 C ATOM 1972 C VAL A 132 5.963 -9.971 0.820 1.00 44.02 C ATOM 1973 O VAL A 132 6.129 -11.188 0.948 1.00 62.22 O ATOM 1974 CB VAL A 132 5.005 -8.681 2.768 1.00 61.41 C ATOM 1975 CG1 VAL A 132 4.287 -9.962 3.191 1.00 51.10 C ATOM 1976 CG2 VAL A 132 5.323 -7.819 3.992 1.00 2.43 C ATOM 0 H VAL A 132 6.475 -6.911 1.764 1.00 44.22 H new ATOM 0 HA VAL A 132 7.016 -9.481 2.635 1.00 10.25 H new ATOM 0 HB VAL A 132 4.340 -8.120 2.112 1.00 61.41 H new ATOM 0 HG11 VAL A 132 3.385 -9.707 3.748 1.00 51.10 H new ATOM 0 HG12 VAL A 132 4.016 -10.537 2.305 1.00 51.10 H new ATOM 0 HG13 VAL A 132 4.947 -10.558 3.822 1.00 51.10 H new ATOM 0 HG21 VAL A 132 4.403 -7.607 4.536 1.00 2.43 H new ATOM 0 HG22 VAL A 132 6.015 -8.353 4.643 1.00 2.43 H new ATOM 0 HG23 VAL A 132 5.778 -6.882 3.669 1.00 2.43 H new ATOM 1986 N VAL A 133 5.513 -9.421 -0.305 1.00 24.01 N ATOM 1987 CA VAL A 133 5.175 -10.222 -1.490 1.00 14.34 C ATOM 1988 C VAL A 133 6.419 -10.902 -2.104 1.00 1.12 C ATOM 1989 O VAL A 133 6.314 -11.939 -2.766 1.00 71.45 O ATOM 1990 CB VAL A 133 4.481 -9.342 -2.569 1.00 54.24 C ATOM 1991 CG1 VAL A 133 4.088 -10.167 -3.796 1.00 75.23 C ATOM 1992 CG2 VAL A 133 3.262 -8.630 -1.979 1.00 64.13 C ATOM 0 H VAL A 133 5.372 -8.418 -0.426 1.00 24.01 H new ATOM 0 HA VAL A 133 4.490 -11.002 -1.159 1.00 14.34 H new ATOM 0 HB VAL A 133 5.197 -8.588 -2.896 1.00 54.24 H new ATOM 0 HG11 VAL A 133 3.606 -9.521 -4.530 1.00 75.23 H new ATOM 0 HG12 VAL A 133 4.980 -10.613 -4.236 1.00 75.23 H new ATOM 0 HG13 VAL A 133 3.398 -10.956 -3.498 1.00 75.23 H new ATOM 0 HG21 VAL A 133 2.790 -8.019 -2.748 1.00 64.13 H new ATOM 0 HG22 VAL A 133 2.549 -9.370 -1.615 1.00 64.13 H new ATOM 0 HG23 VAL A 133 3.577 -7.993 -1.153 1.00 64.13 H new ATOM 2002 N GLN A 134 7.600 -10.326 -1.869 1.00 24.54 N ATOM 2003 CA GLN A 134 8.847 -10.822 -2.473 1.00 33.01 C ATOM 2004 C GLN A 134 9.573 -11.844 -1.577 1.00 2.01 C ATOM 2005 O GLN A 134 10.569 -12.443 -1.999 1.00 61.44 O ATOM 2006 CB GLN A 134 9.792 -9.645 -2.753 1.00 12.22 C ATOM 2007 CG GLN A 134 9.166 -8.525 -3.579 1.00 75.24 C ATOM 2008 CD GLN A 134 10.125 -7.367 -3.801 1.00 33.00 C ATOM 2009 OE1 GLN A 134 11.333 -7.557 -3.898 1.00 43.41 O ATOM 2010 NE2 GLN A 134 9.602 -6.160 -3.866 1.00 75.22 N ATOM 0 H GLN A 134 7.723 -9.514 -1.264 1.00 24.54 H new ATOM 0 HA GLN A 134 8.573 -11.326 -3.400 1.00 33.01 H new ATOM 0 HB2 GLN A 134 10.134 -9.234 -1.803 1.00 12.22 H new ATOM 0 HB3 GLN A 134 10.674 -10.017 -3.275 1.00 12.22 H new ATOM 0 HG2 GLN A 134 8.849 -8.921 -4.544 1.00 75.24 H new ATOM 0 HG3 GLN A 134 8.271 -8.161 -3.074 1.00 75.24 H new ATOM 0 HE21 GLN A 134 8.593 -6.036 -3.782 1.00 75.22 H new ATOM 0 HE22 GLN A 134 10.206 -5.349 -4.001 1.00 75.22 H new ATOM 2019 N ARG A 135 9.087 -12.036 -0.348 1.00 54.12 N ATOM 2020 CA ARG A 135 9.770 -12.904 0.633 1.00 13.41 C ATOM 2021 C ARG A 135 9.493 -14.403 0.389 1.00 12.41 C ATOM 2022 O ARG A 135 8.566 -14.961 1.021 1.00 38.15 O ATOM 2023 CB ARG A 135 9.356 -12.517 2.063 1.00 23.21 C ATOM 2024 CG ARG A 135 9.625 -11.060 2.402 1.00 62.44 C ATOM 2025 CD ARG A 135 9.174 -10.710 3.814 1.00 70.02 C ATOM 2026 NE ARG A 135 9.282 -9.276 4.067 1.00 40.44 N ATOM 2027 CZ ARG A 135 8.700 -8.650 5.051 1.00 22.23 C ATOM 2028 NH1 ARG A 135 8.011 -9.295 5.941 1.00 52.41 N ATOM 2029 NH2 ARG A 135 8.818 -7.368 5.145 1.00 50.33 N ATOM 2030 OXT ARG A 135 10.220 -15.025 -0.418 1.00 38.15 O ATOM 0 H ARG A 135 8.228 -11.607 -0.003 1.00 54.12 H new ATOM 0 HA ARG A 135 10.841 -12.749 0.507 1.00 13.41 H new ATOM 0 HB2 ARG A 135 8.293 -12.721 2.192 1.00 23.21 H new ATOM 0 HB3 ARG A 135 9.890 -13.151 2.771 1.00 23.21 H new ATOM 0 HG2 ARG A 135 10.691 -10.855 2.301 1.00 62.44 H new ATOM 0 HG3 ARG A 135 9.108 -10.420 1.687 1.00 62.44 H new ATOM 0 HD2 ARG A 135 8.142 -11.030 3.958 1.00 70.02 H new ATOM 0 HD3 ARG A 135 9.780 -11.255 4.537 1.00 70.02 H new ATOM 0 HE ARG A 135 9.854 -8.724 3.428 1.00 40.44 H new ATOM 0 HH11 ARG A 135 7.918 -10.309 5.878 1.00 52.41 H new ATOM 0 HH12 ARG A 135 7.562 -8.788 6.704 1.00 52.41 H new ATOM 0 HH21 ARG A 135 9.363 -6.854 4.453 1.00 50.33 H new ATOM 0 HH22 ARG A 135 8.366 -6.869 5.911 1.00 50.33 H new