USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 956 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 692 THR OG1 : rot -177:sc= 0.262 USER MOD Set 1.2: A 707 GLN : amide:sc= 1.16 K(o=2.4,f=0.075) USER MOD Set 1.3: A 715 ASN : amide:sc= 0.934 K(o=2.4,f=-2.2) USER MOD Set 2.1: A 681 ASN : amide:sc= -0.439 K(o=-0.19,f=0.56) USER MOD Set 2.2: A 685 THR OG1 : rot -170:sc= 0.245 USER MOD Set 3.1: A 668 MET CE :methyl -137:sc= -0.346 (180deg=-0.706) USER MOD Set 3.2: A 670 GLN : amide:sc= -5.4! K(o=-5.7!,f=-3.3) USER MOD Set 4.1: A 663 SER OG : rot 140:sc= 0.429 USER MOD Set 4.2: A 672 THR OG1 : rot 180:sc= -0.0352 USER MOD Set 5.1: A 644 GLN : amide:sc= 0.00621 K(o=0.51,f=-0.43) USER MOD Set 5.2: A 714 TYR OH : rot -30:sc= 0.501 USER MOD Set 6.1: A 640 SER OG : rot -100:sc= -0.315 USER MOD Set 6.2: A 654 ASN : amide:sc= -0.257 X(o=-0.57,f=-0.9) USER MOD Set 7.1: A 587 THR OG1 : rot 135:sc= 1.98 USER MOD Set 7.2: A 598 GLN : amide:sc= 0.936 K(o=2.9,f=1.7) USER MOD Single : A 585 SER OG : rot 180:sc= 0.0919 USER MOD Single : A 591 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 593 THR OG1 : rot -64:sc= 0.535 USER MOD Single : A 597 SER OG : rot 180:sc= 0 USER MOD Single : A 602 SER OG : rot 29:sc= 0.0284 USER MOD Single : A 606 THR OG1 : rot 180:sc= -0.107 USER MOD Single : A 609 THR OG1 : rot 85:sc= 0.97 USER MOD Single : A 610 LYS NZ :NH3+ -179:sc= 0.721 (180deg=0.719) USER MOD Single : A 611 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 614 TYR OH : rot 7:sc= 0.884 USER MOD Single : A 615 LYS NZ :NH3+ -140:sc= 2.25 (180deg=0.862) USER MOD Single : A 618 THR OG1 : rot -53:sc= 1.75 USER MOD Single : A 620 LYS NZ :NH3+ 172:sc= 1.27 (180deg=1.15) USER MOD Single : A 621 TYR OH : rot 180:sc= 0 USER MOD Single : A 624 HIS : no HD1:sc= -1.92 X(o=-1.9,f=-1.7) USER MOD Single : A 626 ASN : amide:sc= 2.02 K(o=2,f=-7!) USER MOD Single : A 632 SER OG : rot 121:sc= 1.33 USER MOD Single : A 646 SER OG : rot 150:sc= 0.973 USER MOD Single : A 648 SER OG : rot 180:sc= 0 USER MOD Single : A 651 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 652 SER OG : rot 180:sc= 0 USER MOD Single : A 658 SER OG : rot 170:sc= -0.213 USER MOD Single : A 659 ASN : amide:sc= -1.28! K(o=-1.3!,f=-0.022) USER MOD Single : A 661 LYS NZ :NH3+ -176:sc= 1.26 (180deg=1.17) USER MOD Single : A 664 TYR OH : rot -156:sc= -0.116! USER MOD Single : A 665 TYR OH : rot 180:sc= 0 USER MOD Single : A 673 TYR OH : rot 160:sc= 0.994 USER MOD Single : A 677 THR OG1 : rot -149:sc= 0.814 USER MOD Single : A 679 TYR OH : rot 24:sc= -1.23 USER MOD Single : A 680 ASN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 683 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 689 THR OG1 : rot 69:sc= -0.522 USER MOD Single : A 706 TYR OH : rot -156:sc= -1.4! USER MOD Single : A 711 ASN : amide:sc= -1.58! K(o=-1.6!,f=-0.013) USER MOD Single : A 712 SER OG : rot 180:sc= 0 USER MOD Single : A 713 THR OG1 : rot 180:sc= 0 USER MOD Single : A 719 TYR OH : rot 180:sc= 0.976 USER MOD Single : A 720 THR OG1 : rot 134:sc= 1.46 USER MOD Single : A 721 SER OG : rot 180:sc= 0 USER MOD Single : A 722 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 578 1.849 -24.533 9.474 1.00 12.33 N ATOM 2 CA GLU A 578 1.153 -24.817 10.744 1.00 5.44 C ATOM 3 C GLU A 578 1.695 -23.958 11.891 1.00 73.21 C ATOM 4 O GLU A 578 1.359 -24.174 13.063 1.00 23.34 O ATOM 5 CB GLU A 578 1.226 -26.305 11.105 1.00 22.13 C ATOM 6 CG GLU A 578 2.631 -26.869 11.219 1.00 32.55 C ATOM 7 CD GLU A 578 2.629 -28.291 11.715 1.00 4.20 C ATOM 8 OE1 GLU A 578 2.398 -29.217 10.923 1.00 4.14 O ATOM 9 OE2 GLU A 578 2.841 -28.506 12.921 1.00 34.13 O ATOM 0 HA GLU A 578 0.105 -24.556 10.596 1.00 5.44 H new ATOM 0 HB2 GLU A 578 0.711 -26.459 12.053 1.00 22.13 H new ATOM 0 HB3 GLU A 578 0.682 -26.874 10.351 1.00 22.13 H new ATOM 0 HG2 GLU A 578 3.119 -26.825 10.246 1.00 32.55 H new ATOM 0 HG3 GLU A 578 3.217 -26.249 11.898 1.00 32.55 H new ATOM 18 N ALA A 579 2.507 -22.991 11.547 1.00 64.23 N ATOM 19 CA ALA A 579 3.071 -22.055 12.482 1.00 75.11 C ATOM 20 C ALA A 579 3.428 -20.824 11.701 1.00 64.13 C ATOM 21 O ALA A 579 4.562 -20.661 11.240 1.00 12.03 O ATOM 22 CB ALA A 579 4.290 -22.629 13.185 1.00 62.01 C ATOM 0 H ALA A 579 2.801 -22.830 10.584 1.00 64.23 H new ATOM 0 HA ALA A 579 2.352 -21.824 13.268 1.00 75.11 H new ATOM 0 HB1 ALA A 579 4.688 -21.892 13.883 1.00 62.01 H new ATOM 0 HB2 ALA A 579 4.005 -23.529 13.730 1.00 62.01 H new ATOM 0 HB3 ALA A 579 5.052 -22.878 12.447 1.00 62.01 H new ATOM 28 N GLU A 580 2.446 -19.993 11.504 1.00 61.53 N ATOM 29 CA GLU A 580 2.551 -18.884 10.586 1.00 71.34 C ATOM 30 C GLU A 580 3.015 -17.624 11.318 1.00 61.21 C ATOM 31 O GLU A 580 3.631 -16.729 10.727 1.00 33.40 O ATOM 32 CB GLU A 580 1.178 -18.628 9.962 1.00 22.14 C ATOM 33 CG GLU A 580 0.390 -19.898 9.581 1.00 42.11 C ATOM 34 CD GLU A 580 1.101 -20.843 8.627 1.00 45.32 C ATOM 35 OE1 GLU A 580 1.069 -20.611 7.411 1.00 51.43 O ATOM 36 OE2 GLU A 580 1.648 -21.871 9.080 1.00 32.01 O ATOM 0 H GLU A 580 1.544 -20.061 11.975 1.00 61.53 H new ATOM 0 HA GLU A 580 3.280 -19.128 9.813 1.00 71.34 H new ATOM 0 HB2 GLU A 580 0.580 -18.044 10.662 1.00 22.14 H new ATOM 0 HB3 GLU A 580 1.309 -18.018 9.068 1.00 22.14 H new ATOM 0 HG2 GLU A 580 0.149 -20.443 10.494 1.00 42.11 H new ATOM 0 HG3 GLU A 580 -0.556 -19.597 9.130 1.00 42.11 H new ATOM 43 N ALA A 581 2.700 -17.555 12.594 1.00 53.42 N ATOM 44 CA ALA A 581 3.054 -16.425 13.423 1.00 50.01 C ATOM 45 C ALA A 581 3.254 -16.878 14.854 1.00 54.11 C ATOM 46 O ALA A 581 2.279 -17.116 15.584 1.00 21.23 O ATOM 47 CB ALA A 581 1.972 -15.358 13.360 1.00 52.11 C ATOM 0 H ALA A 581 2.188 -18.286 13.087 1.00 53.42 H new ATOM 0 HA ALA A 581 3.985 -15.997 13.050 1.00 50.01 H new ATOM 0 HB1 ALA A 581 2.255 -14.515 13.990 1.00 52.11 H new ATOM 0 HB2 ALA A 581 1.855 -15.019 12.331 1.00 52.11 H new ATOM 0 HB3 ALA A 581 1.029 -15.775 13.714 1.00 52.11 H new ATOM 53 N GLU A 582 4.490 -16.992 15.255 1.00 15.14 N ATOM 54 CA GLU A 582 4.830 -17.475 16.579 1.00 61.13 C ATOM 55 C GLU A 582 5.625 -16.408 17.300 1.00 70.33 C ATOM 56 O GLU A 582 5.127 -15.731 18.206 1.00 73.33 O ATOM 57 CB GLU A 582 5.672 -18.758 16.466 1.00 25.01 C ATOM 58 CG GLU A 582 4.992 -19.908 15.742 1.00 73.25 C ATOM 59 CD GLU A 582 3.794 -20.429 16.481 1.00 24.04 C ATOM 60 OE1 GLU A 582 2.697 -19.897 16.310 1.00 0.01 O ATOM 61 OE2 GLU A 582 3.942 -21.395 17.261 1.00 73.15 O ATOM 0 H GLU A 582 5.296 -16.754 14.677 1.00 15.14 H new ATOM 0 HA GLU A 582 3.919 -17.697 17.134 1.00 61.13 H new ATOM 0 HB2 GLU A 582 6.601 -18.521 15.948 1.00 25.01 H new ATOM 0 HB3 GLU A 582 5.941 -19.088 17.469 1.00 25.01 H new ATOM 0 HG2 GLU A 582 4.686 -19.577 14.749 1.00 73.25 H new ATOM 0 HG3 GLU A 582 5.708 -20.718 15.602 1.00 73.25 H new ATOM 68 N PHE A 583 6.842 -16.267 16.870 1.00 32.15 N ATOM 69 CA PHE A 583 7.777 -15.285 17.337 1.00 72.54 C ATOM 70 C PHE A 583 8.945 -15.286 16.380 1.00 34.44 C ATOM 71 O PHE A 583 9.981 -15.879 16.621 1.00 32.43 O ATOM 72 CB PHE A 583 8.194 -15.476 18.842 1.00 43.33 C ATOM 73 CG PHE A 583 8.774 -16.835 19.219 1.00 44.32 C ATOM 74 CD1 PHE A 583 7.942 -17.922 19.446 1.00 42.04 C ATOM 75 CD2 PHE A 583 10.145 -17.011 19.366 1.00 54.31 C ATOM 76 CE1 PHE A 583 8.463 -19.151 19.804 1.00 51.43 C ATOM 77 CE2 PHE A 583 10.669 -18.239 19.721 1.00 63.43 C ATOM 78 CZ PHE A 583 9.825 -19.310 19.938 1.00 24.42 C ATOM 0 H PHE A 583 7.232 -16.867 16.143 1.00 32.15 H new ATOM 0 HA PHE A 583 7.306 -14.302 17.340 1.00 72.54 H new ATOM 0 HB2 PHE A 583 8.928 -14.710 19.093 1.00 43.33 H new ATOM 0 HB3 PHE A 583 7.318 -15.294 19.465 1.00 43.33 H new ATOM 0 HD1 PHE A 583 6.873 -17.806 19.342 1.00 42.04 H new ATOM 0 HD2 PHE A 583 10.810 -16.176 19.200 1.00 54.31 H new ATOM 0 HE1 PHE A 583 7.802 -19.987 19.979 1.00 51.43 H new ATOM 0 HE2 PHE A 583 11.737 -18.361 19.829 1.00 63.43 H new ATOM 0 HZ PHE A 583 10.232 -20.272 20.213 1.00 24.42 H new ATOM 88 N LEU A 584 8.706 -14.742 15.230 1.00 54.00 N ATOM 89 CA LEU A 584 9.691 -14.749 14.185 1.00 72.53 C ATOM 90 C LEU A 584 10.617 -13.539 14.283 1.00 12.12 C ATOM 91 O LEU A 584 11.617 -13.560 15.023 1.00 14.01 O ATOM 92 CB LEU A 584 9.011 -14.796 12.802 1.00 62.53 C ATOM 93 CG LEU A 584 7.998 -15.918 12.575 1.00 44.34 C ATOM 94 CD1 LEU A 584 7.360 -15.781 11.209 1.00 75.35 C ATOM 95 CD2 LEU A 584 8.648 -17.279 12.724 1.00 4.42 C ATOM 0 H LEU A 584 7.829 -14.282 14.985 1.00 54.00 H new ATOM 0 HA LEU A 584 10.299 -15.645 14.308 1.00 72.53 H new ATOM 0 HB2 LEU A 584 8.507 -13.844 12.638 1.00 62.53 H new ATOM 0 HB3 LEU A 584 9.789 -14.880 12.043 1.00 62.53 H new ATOM 0 HG LEU A 584 7.221 -15.833 13.335 1.00 44.34 H new ATOM 0 HD11 LEU A 584 6.641 -16.587 11.061 1.00 75.35 H new ATOM 0 HD12 LEU A 584 6.849 -14.821 11.141 1.00 75.35 H new ATOM 0 HD13 LEU A 584 8.131 -15.837 10.440 1.00 75.35 H new ATOM 0 HD21 LEU A 584 7.904 -18.058 12.557 1.00 4.42 H new ATOM 0 HD22 LEU A 584 9.450 -17.381 11.993 1.00 4.42 H new ATOM 0 HD23 LEU A 584 9.058 -17.378 13.729 1.00 4.42 H new ATOM 103 N SER A 585 10.233 -12.487 13.582 1.00 32.35 N ATOM 104 CA SER A 585 10.965 -11.252 13.439 1.00 35.31 C ATOM 105 C SER A 585 10.273 -10.549 12.279 1.00 44.30 C ATOM 106 O SER A 585 9.127 -10.916 11.938 1.00 25.43 O ATOM 107 CB SER A 585 12.445 -11.564 13.058 1.00 44.12 C ATOM 108 OG SER A 585 13.247 -10.393 13.001 1.00 43.22 O ATOM 0 H SER A 585 9.351 -12.477 13.070 1.00 32.35 H new ATOM 0 HA SER A 585 10.978 -10.655 14.351 1.00 35.31 H new ATOM 0 HB2 SER A 585 12.867 -12.255 13.787 1.00 44.12 H new ATOM 0 HB3 SER A 585 12.470 -12.066 12.091 1.00 44.12 H new ATOM 0 HG SER A 585 14.165 -10.637 12.761 1.00 43.22 H new ATOM 114 N ARG A 586 10.898 -9.562 11.698 1.00 61.31 N ATOM 115 CA ARG A 586 10.373 -8.982 10.498 1.00 31.51 C ATOM 116 C ARG A 586 11.203 -9.507 9.338 1.00 13.42 C ATOM 117 O ARG A 586 12.381 -9.170 9.197 1.00 52.13 O ATOM 118 CB ARG A 586 10.429 -7.454 10.540 1.00 40.20 C ATOM 119 CG ARG A 586 9.811 -6.793 9.317 1.00 61.54 C ATOM 120 CD ARG A 586 9.984 -5.278 9.329 1.00 21.32 C ATOM 121 NE ARG A 586 11.396 -4.900 9.358 1.00 53.21 N ATOM 122 CZ ARG A 586 12.114 -4.495 8.295 1.00 70.31 C ATOM 123 NH1 ARG A 586 11.555 -4.418 7.086 1.00 64.55 N ATOM 124 NH2 ARG A 586 13.389 -4.170 8.446 1.00 62.42 N ATOM 0 H ARG A 586 11.766 -9.146 12.035 1.00 61.31 H new ATOM 0 HA ARG A 586 9.324 -9.257 10.385 1.00 31.51 H new ATOM 0 HB2 ARG A 586 9.912 -7.103 11.433 1.00 40.20 H new ATOM 0 HB3 ARG A 586 11.469 -7.138 10.628 1.00 40.20 H new ATOM 0 HG2 ARG A 586 10.268 -7.202 8.416 1.00 61.54 H new ATOM 0 HG3 ARG A 586 8.749 -7.035 9.274 1.00 61.54 H new ATOM 0 HD2 ARG A 586 9.510 -4.850 8.446 1.00 21.32 H new ATOM 0 HD3 ARG A 586 9.476 -4.860 10.198 1.00 21.32 H new ATOM 0 HE ARG A 586 11.875 -4.947 10.257 1.00 53.21 H new ATOM 0 HH11 ARG A 586 10.574 -4.667 6.961 1.00 64.55 H new ATOM 0 HH12 ARG A 586 12.109 -4.110 6.287 1.00 64.55 H new ATOM 0 HH21 ARG A 586 13.824 -4.227 9.367 1.00 62.42 H new ATOM 0 HH22 ARG A 586 13.936 -3.863 7.642 1.00 62.42 H new ATOM 136 N THR A 587 10.600 -10.311 8.534 1.00 44.12 N ATOM 137 CA THR A 587 11.265 -10.926 7.421 1.00 1.13 C ATOM 138 C THR A 587 10.917 -10.155 6.157 1.00 50.24 C ATOM 139 O THR A 587 9.767 -9.801 5.958 1.00 32.45 O ATOM 140 CB THR A 587 10.780 -12.378 7.285 1.00 44.23 C ATOM 141 OG1 THR A 587 10.909 -13.038 8.553 1.00 4.23 O ATOM 142 CG2 THR A 587 11.600 -13.127 6.248 1.00 33.20 C ATOM 0 H THR A 587 9.617 -10.569 8.626 1.00 44.12 H new ATOM 0 HA THR A 587 12.344 -10.916 7.575 1.00 1.13 H new ATOM 0 HB THR A 587 9.738 -12.369 6.966 1.00 44.23 H new ATOM 0 HG1 THR A 587 10.094 -13.548 8.741 1.00 4.23 H new ATOM 0 HG21 THR A 587 11.238 -14.152 6.169 1.00 33.20 H new ATOM 0 HG22 THR A 587 11.503 -12.633 5.281 1.00 33.20 H new ATOM 0 HG23 THR A 587 12.648 -13.134 6.548 1.00 33.20 H new ATOM 148 N GLU A 588 11.881 -9.878 5.322 1.00 73.10 N ATOM 149 CA GLU A 588 11.607 -9.133 4.123 1.00 44.45 C ATOM 150 C GLU A 588 11.633 -10.013 2.892 1.00 31.03 C ATOM 151 O GLU A 588 12.510 -10.874 2.730 1.00 13.22 O ATOM 152 CB GLU A 588 12.555 -7.943 3.961 1.00 4.22 C ATOM 153 CG GLU A 588 12.474 -6.940 5.095 1.00 55.42 C ATOM 154 CD GLU A 588 13.353 -5.733 4.883 1.00 71.02 C ATOM 155 OE1 GLU A 588 14.584 -5.864 4.977 1.00 41.42 O ATOM 156 OE2 GLU A 588 12.825 -4.630 4.626 1.00 15.42 O ATOM 0 H GLU A 588 12.855 -10.154 5.447 1.00 73.10 H new ATOM 0 HA GLU A 588 10.596 -8.740 4.227 1.00 44.45 H new ATOM 0 HB2 GLU A 588 13.578 -8.312 3.887 1.00 4.22 H new ATOM 0 HB3 GLU A 588 12.330 -7.436 3.023 1.00 4.22 H new ATOM 0 HG2 GLU A 588 11.440 -6.613 5.210 1.00 55.42 H new ATOM 0 HG3 GLU A 588 12.759 -7.430 6.026 1.00 55.42 H new ATOM 163 N GLY A 589 10.653 -9.818 2.067 1.00 13.14 N ATOM 164 CA GLY A 589 10.558 -10.474 0.814 1.00 23.44 C ATOM 165 C GLY A 589 10.708 -9.455 -0.266 1.00 3.11 C ATOM 166 O GLY A 589 10.634 -8.254 0.006 1.00 1.32 O ATOM 0 H GLY A 589 9.880 -9.180 2.257 1.00 13.14 H new ATOM 0 HA2 GLY A 589 11.332 -11.236 0.726 1.00 23.44 H new ATOM 0 HA3 GLY A 589 9.598 -10.983 0.724 1.00 23.44 H new ATOM 170 N ASP A 590 10.857 -9.882 -1.470 1.00 3.43 N ATOM 171 CA ASP A 590 11.198 -8.950 -2.514 1.00 52.04 C ATOM 172 C ASP A 590 10.277 -9.082 -3.711 1.00 21.13 C ATOM 173 O ASP A 590 9.989 -10.191 -4.169 1.00 51.44 O ATOM 174 CB ASP A 590 12.666 -9.144 -2.921 1.00 73.41 C ATOM 175 CG ASP A 590 13.168 -8.108 -3.901 1.00 72.32 C ATOM 176 OD1 ASP A 590 13.042 -8.312 -5.109 1.00 32.52 O ATOM 177 OD2 ASP A 590 13.725 -7.073 -3.459 1.00 11.02 O ATOM 0 H ASP A 590 10.753 -10.853 -1.765 1.00 3.43 H new ATOM 0 HA ASP A 590 11.067 -7.940 -2.127 1.00 52.04 H new ATOM 0 HB2 ASP A 590 13.288 -9.116 -2.027 1.00 73.41 H new ATOM 0 HB3 ASP A 590 12.784 -10.134 -3.361 1.00 73.41 H new ATOM 182 N ASN A 591 9.797 -7.940 -4.171 1.00 21.13 N ATOM 183 CA ASN A 591 8.940 -7.792 -5.359 1.00 42.04 C ATOM 184 C ASN A 591 7.530 -8.359 -5.173 1.00 54.45 C ATOM 185 O ASN A 591 7.240 -9.514 -5.547 1.00 73.43 O ATOM 186 CB ASN A 591 9.602 -8.319 -6.655 1.00 74.13 C ATOM 187 CG ASN A 591 8.753 -8.060 -7.899 1.00 52.25 C ATOM 188 OD1 ASN A 591 8.012 -7.080 -7.972 1.00 61.54 O ATOM 189 ND2 ASN A 591 8.855 -8.931 -8.873 1.00 15.11 N ATOM 0 H ASN A 591 9.995 -7.048 -3.717 1.00 21.13 H new ATOM 0 HA ASN A 591 8.822 -6.715 -5.480 1.00 42.04 H new ATOM 0 HB2 ASN A 591 10.575 -7.845 -6.779 1.00 74.13 H new ATOM 0 HB3 ASN A 591 9.779 -9.390 -6.558 1.00 74.13 H new ATOM 0 HD21 ASN A 591 8.310 -8.808 -9.726 1.00 15.11 H new ATOM 0 HD22 ASN A 591 9.480 -9.732 -8.778 1.00 15.11 H new ATOM 195 N CYS A 592 6.689 -7.564 -4.493 1.00 12.21 N ATOM 196 CA CYS A 592 5.233 -7.813 -4.302 1.00 35.34 C ATOM 197 C CYS A 592 4.910 -9.096 -3.539 1.00 3.45 C ATOM 198 O CYS A 592 3.734 -9.427 -3.319 1.00 50.04 O ATOM 199 CB CYS A 592 4.507 -7.798 -5.644 1.00 70.44 C ATOM 200 SG CYS A 592 4.697 -6.240 -6.560 1.00 43.33 S ATOM 0 H CYS A 592 7.002 -6.703 -4.044 1.00 12.21 H new ATOM 0 HA CYS A 592 4.875 -6.996 -3.676 1.00 35.34 H new ATOM 0 HB2 CYS A 592 4.880 -8.618 -6.258 1.00 70.44 H new ATOM 0 HB3 CYS A 592 3.446 -7.983 -5.475 1.00 70.44 H new ATOM 205 N THR A 593 5.923 -9.790 -3.107 1.00 51.43 N ATOM 206 CA THR A 593 5.750 -11.037 -2.448 1.00 64.30 C ATOM 207 C THR A 593 6.632 -11.105 -1.238 1.00 24.42 C ATOM 208 O THR A 593 7.710 -10.499 -1.205 1.00 74.34 O ATOM 209 CB THR A 593 6.051 -12.229 -3.401 1.00 33.14 C ATOM 210 OG1 THR A 593 7.343 -12.061 -4.019 1.00 32.13 O ATOM 211 CG2 THR A 593 4.986 -12.365 -4.477 1.00 11.54 C ATOM 0 H THR A 593 6.895 -9.498 -3.206 1.00 51.43 H new ATOM 0 HA THR A 593 4.708 -11.113 -2.138 1.00 64.30 H new ATOM 0 HB THR A 593 6.049 -13.139 -2.800 1.00 33.14 H new ATOM 0 HG1 THR A 593 7.332 -11.263 -4.588 1.00 32.13 H new ATOM 0 HG21 THR A 593 5.229 -13.208 -5.125 1.00 11.54 H new ATOM 0 HG22 THR A 593 4.016 -12.534 -4.010 1.00 11.54 H new ATOM 0 HG23 THR A 593 4.949 -11.451 -5.070 1.00 11.54 H new ATOM 217 N VAL A 594 6.184 -11.803 -0.256 1.00 2.24 N ATOM 218 CA VAL A 594 6.920 -11.966 0.946 1.00 10.30 C ATOM 219 C VAL A 594 7.071 -13.433 1.282 1.00 10.33 C ATOM 220 O VAL A 594 6.114 -14.189 1.236 1.00 12.24 O ATOM 221 CB VAL A 594 6.322 -11.130 2.109 1.00 2.21 C ATOM 222 CG1 VAL A 594 4.847 -11.422 2.311 1.00 74.10 C ATOM 223 CG2 VAL A 594 7.075 -11.353 3.396 1.00 55.23 C ATOM 0 H VAL A 594 5.284 -12.283 -0.265 1.00 2.24 H new ATOM 0 HA VAL A 594 7.924 -11.571 0.791 1.00 10.30 H new ATOM 0 HB VAL A 594 6.426 -10.083 1.826 1.00 2.21 H new ATOM 0 HG11 VAL A 594 4.466 -10.817 3.134 1.00 74.10 H new ATOM 0 HG12 VAL A 594 4.300 -11.181 1.400 1.00 74.10 H new ATOM 0 HG13 VAL A 594 4.714 -12.478 2.545 1.00 74.10 H new ATOM 0 HG21 VAL A 594 6.628 -10.752 4.188 1.00 55.23 H new ATOM 0 HG22 VAL A 594 7.025 -12.407 3.669 1.00 55.23 H new ATOM 0 HG23 VAL A 594 8.117 -11.062 3.263 1.00 55.23 H new ATOM 229 N PHE A 595 8.277 -13.826 1.576 1.00 21.33 N ATOM 230 CA PHE A 595 8.594 -15.196 1.860 1.00 74.40 C ATOM 231 C PHE A 595 9.426 -15.321 3.130 1.00 13.41 C ATOM 232 O PHE A 595 10.408 -14.591 3.326 1.00 10.41 O ATOM 233 CB PHE A 595 9.242 -15.872 0.626 1.00 31.43 C ATOM 234 CG PHE A 595 10.377 -15.089 -0.016 1.00 11.00 C ATOM 235 CD1 PHE A 595 11.683 -15.239 0.412 1.00 62.35 C ATOM 236 CD2 PHE A 595 10.120 -14.207 -1.059 1.00 74.22 C ATOM 237 CE1 PHE A 595 12.708 -14.528 -0.180 1.00 22.42 C ATOM 238 CE2 PHE A 595 11.142 -13.493 -1.653 1.00 72.43 C ATOM 239 CZ PHE A 595 12.438 -13.654 -1.213 1.00 73.12 C ATOM 0 H PHE A 595 9.078 -13.196 1.626 1.00 21.33 H new ATOM 0 HA PHE A 595 7.670 -15.739 2.060 1.00 74.40 H new ATOM 0 HB2 PHE A 595 9.619 -16.851 0.923 1.00 31.43 H new ATOM 0 HB3 PHE A 595 8.469 -16.042 -0.124 1.00 31.43 H new ATOM 0 HD1 PHE A 595 11.904 -15.921 1.220 1.00 62.35 H new ATOM 0 HD2 PHE A 595 9.107 -14.078 -1.410 1.00 74.22 H new ATOM 0 HE1 PHE A 595 13.723 -14.656 0.166 1.00 22.42 H new ATOM 0 HE2 PHE A 595 10.926 -12.810 -2.461 1.00 72.43 H new ATOM 0 HZ PHE A 595 13.240 -13.098 -1.675 1.00 73.12 H new ATOM 249 N ASP A 596 9.004 -16.223 3.986 1.00 32.25 N ATOM 250 CA ASP A 596 9.601 -16.437 5.296 1.00 11.21 C ATOM 251 C ASP A 596 9.923 -17.922 5.457 1.00 42.00 C ATOM 252 O ASP A 596 9.021 -18.742 5.429 1.00 42.33 O ATOM 253 CB ASP A 596 8.541 -16.079 6.336 1.00 51.20 C ATOM 254 CG ASP A 596 9.065 -16.071 7.726 1.00 14.33 C ATOM 255 OD1 ASP A 596 9.326 -17.138 8.248 1.00 50.50 O ATOM 256 OD2 ASP A 596 9.210 -14.986 8.305 1.00 3.25 O ATOM 0 H ASP A 596 8.219 -16.845 3.792 1.00 32.25 H new ATOM 0 HA ASP A 596 10.505 -15.839 5.411 1.00 11.21 H new ATOM 0 HB2 ASP A 596 8.130 -15.096 6.104 1.00 51.20 H new ATOM 0 HB3 ASP A 596 7.719 -16.792 6.268 1.00 51.20 H new ATOM 261 N SER A 597 11.191 -18.266 5.576 1.00 75.00 N ATOM 262 CA SER A 597 11.626 -19.660 5.781 1.00 2.04 C ATOM 263 C SER A 597 11.289 -20.176 7.195 1.00 54.50 C ATOM 264 O SER A 597 11.103 -21.378 7.416 1.00 11.03 O ATOM 265 CB SER A 597 13.122 -19.777 5.525 1.00 53.12 C ATOM 266 OG SER A 597 13.442 -19.331 4.215 1.00 3.42 O ATOM 0 H SER A 597 11.959 -17.596 5.535 1.00 75.00 H new ATOM 0 HA SER A 597 11.080 -20.282 5.071 1.00 2.04 H new ATOM 0 HB2 SER A 597 13.669 -19.186 6.260 1.00 53.12 H new ATOM 0 HB3 SER A 597 13.438 -20.813 5.649 1.00 53.12 H new ATOM 0 HG SER A 597 14.408 -19.412 4.069 1.00 3.42 H new ATOM 272 N GLN A 598 11.191 -19.252 8.119 1.00 50.40 N ATOM 273 CA GLN A 598 11.006 -19.533 9.536 1.00 72.33 C ATOM 274 C GLN A 598 9.600 -20.095 9.773 1.00 3.43 C ATOM 275 O GLN A 598 9.410 -21.047 10.539 1.00 1.05 O ATOM 276 CB GLN A 598 11.198 -18.225 10.287 1.00 53.35 C ATOM 277 CG GLN A 598 12.535 -17.560 9.993 1.00 25.52 C ATOM 278 CD GLN A 598 12.462 -16.059 10.129 1.00 71.22 C ATOM 279 OE1 GLN A 598 12.695 -15.488 11.196 1.00 63.51 O ATOM 280 NE2 GLN A 598 12.146 -15.418 9.034 1.00 62.21 N ATOM 0 H GLN A 598 11.238 -18.255 7.909 1.00 50.40 H new ATOM 0 HA GLN A 598 11.724 -20.275 9.887 1.00 72.33 H new ATOM 0 HB2 GLN A 598 10.392 -17.540 10.024 1.00 53.35 H new ATOM 0 HB3 GLN A 598 11.120 -18.413 11.358 1.00 53.35 H new ATOM 0 HG2 GLN A 598 13.291 -17.949 10.675 1.00 25.52 H new ATOM 0 HG3 GLN A 598 12.854 -17.817 8.983 1.00 25.52 H new ATOM 0 HE21 GLN A 598 11.962 -15.936 8.175 1.00 62.21 H new ATOM 0 HE22 GLN A 598 12.083 -14.400 9.039 1.00 62.21 H new ATOM 288 N ALA A 599 8.628 -19.495 9.130 1.00 43.14 N ATOM 289 CA ALA A 599 7.269 -19.981 9.168 1.00 64.43 C ATOM 290 C ALA A 599 6.985 -20.831 7.943 1.00 31.45 C ATOM 291 O ALA A 599 6.016 -21.602 7.916 1.00 62.52 O ATOM 292 CB ALA A 599 6.305 -18.812 9.214 1.00 51.45 C ATOM 0 H ALA A 599 8.756 -18.655 8.565 1.00 43.14 H new ATOM 0 HA ALA A 599 7.137 -20.591 10.062 1.00 64.43 H new ATOM 0 HB1 ALA A 599 5.281 -19.185 9.243 1.00 51.45 H new ATOM 0 HB2 ALA A 599 6.499 -18.216 10.106 1.00 51.45 H new ATOM 0 HB3 ALA A 599 6.441 -18.193 8.327 1.00 51.45 H new ATOM 298 N GLY A 600 7.831 -20.686 6.930 1.00 32.44 N ATOM 299 CA GLY A 600 7.684 -21.474 5.709 1.00 73.52 C ATOM 300 C GLY A 600 6.497 -20.985 4.938 1.00 53.13 C ATOM 301 O GLY A 600 5.751 -21.759 4.337 1.00 62.23 O ATOM 0 H GLY A 600 8.618 -20.038 6.927 1.00 32.44 H new ATOM 0 HA2 GLY A 600 8.585 -21.393 5.101 1.00 73.52 H new ATOM 0 HA3 GLY A 600 7.561 -22.528 5.957 1.00 73.52 H new ATOM 305 N PHE A 601 6.345 -19.693 4.946 1.00 72.42 N ATOM 306 CA PHE A 601 5.183 -19.045 4.423 1.00 74.00 C ATOM 307 C PHE A 601 5.575 -18.136 3.264 1.00 13.43 C ATOM 308 O PHE A 601 6.714 -17.643 3.206 1.00 11.12 O ATOM 309 CB PHE A 601 4.562 -18.237 5.580 1.00 25.43 C ATOM 310 CG PHE A 601 3.231 -17.600 5.317 1.00 43.32 C ATOM 311 CD1 PHE A 601 2.079 -18.367 5.309 1.00 3.54 C ATOM 312 CD2 PHE A 601 3.125 -16.241 5.103 1.00 73.41 C ATOM 313 CE1 PHE A 601 0.850 -17.794 5.092 1.00 41.12 C ATOM 314 CE2 PHE A 601 1.898 -15.661 4.891 1.00 31.30 C ATOM 315 CZ PHE A 601 0.758 -16.441 4.885 1.00 35.01 C ATOM 0 H PHE A 601 7.040 -19.050 5.324 1.00 72.42 H new ATOM 0 HA PHE A 601 4.462 -19.766 4.038 1.00 74.00 H new ATOM 0 HB2 PHE A 601 4.459 -18.899 6.440 1.00 25.43 H new ATOM 0 HB3 PHE A 601 5.264 -17.453 5.863 1.00 25.43 H new ATOM 0 HD1 PHE A 601 2.148 -19.432 5.476 1.00 3.54 H new ATOM 0 HD2 PHE A 601 4.014 -15.628 5.102 1.00 73.41 H new ATOM 0 HE1 PHE A 601 -0.040 -18.406 5.084 1.00 41.12 H new ATOM 0 HE2 PHE A 601 1.825 -14.596 4.729 1.00 31.30 H new ATOM 0 HZ PHE A 601 -0.207 -15.985 4.717 1.00 35.01 H new ATOM 325 N SER A 602 4.666 -17.956 2.340 1.00 34.12 N ATOM 326 CA SER A 602 4.856 -17.077 1.216 1.00 22.51 C ATOM 327 C SER A 602 3.554 -16.356 0.957 1.00 51.34 C ATOM 328 O SER A 602 2.493 -16.976 0.982 1.00 42.05 O ATOM 329 CB SER A 602 5.304 -17.873 -0.014 1.00 71.34 C ATOM 330 OG SER A 602 4.385 -18.928 -0.311 1.00 34.21 O ATOM 0 H SER A 602 3.759 -18.423 2.348 1.00 34.12 H new ATOM 0 HA SER A 602 5.638 -16.349 1.432 1.00 22.51 H new ATOM 0 HB2 SER A 602 5.385 -17.206 -0.872 1.00 71.34 H new ATOM 0 HB3 SER A 602 6.296 -18.290 0.161 1.00 71.34 H new ATOM 0 HG SER A 602 3.488 -18.676 -0.007 1.00 34.21 H new ATOM 336 N PHE A 603 3.612 -15.071 0.736 1.00 32.43 N ATOM 337 CA PHE A 603 2.407 -14.316 0.555 1.00 1.23 C ATOM 338 C PHE A 603 2.592 -13.323 -0.585 1.00 11.11 C ATOM 339 O PHE A 603 3.712 -12.863 -0.831 1.00 41.35 O ATOM 340 CB PHE A 603 2.104 -13.578 1.841 1.00 64.00 C ATOM 341 CG PHE A 603 0.657 -13.323 2.040 1.00 62.12 C ATOM 342 CD1 PHE A 603 -0.151 -14.326 2.527 1.00 41.21 C ATOM 343 CD2 PHE A 603 0.102 -12.103 1.753 1.00 74.24 C ATOM 344 CE1 PHE A 603 -1.482 -14.122 2.728 1.00 21.21 C ATOM 345 CE2 PHE A 603 -1.236 -11.888 1.949 1.00 34.30 C ATOM 346 CZ PHE A 603 -2.024 -12.907 2.441 1.00 11.54 C ATOM 0 H PHE A 603 4.475 -14.530 0.678 1.00 32.43 H new ATOM 0 HA PHE A 603 1.580 -14.981 0.308 1.00 1.23 H new ATOM 0 HB2 PHE A 603 2.484 -14.157 2.683 1.00 64.00 H new ATOM 0 HB3 PHE A 603 2.637 -12.627 1.841 1.00 64.00 H new ATOM 0 HD1 PHE A 603 0.278 -15.291 2.753 1.00 41.21 H new ATOM 0 HD2 PHE A 603 0.723 -11.307 1.370 1.00 74.24 H new ATOM 0 HE1 PHE A 603 -2.103 -14.918 3.112 1.00 21.21 H new ATOM 0 HE2 PHE A 603 -1.671 -10.927 1.720 1.00 34.30 H new ATOM 0 HZ PHE A 603 -3.079 -12.740 2.600 1.00 11.54 H new ATOM 356 N ASP A 604 1.518 -13.000 -1.271 1.00 14.12 N ATOM 357 CA ASP A 604 1.574 -12.076 -2.402 1.00 22.10 C ATOM 358 C ASP A 604 0.559 -10.961 -2.231 1.00 41.11 C ATOM 359 O ASP A 604 -0.567 -11.195 -1.791 1.00 54.24 O ATOM 360 CB ASP A 604 1.360 -12.802 -3.754 1.00 14.32 C ATOM 361 CG ASP A 604 -0.026 -13.392 -3.929 1.00 4.14 C ATOM 362 OD1 ASP A 604 -0.311 -14.462 -3.350 1.00 53.23 O ATOM 363 OD2 ASP A 604 -0.847 -12.801 -4.675 1.00 71.21 O ATOM 0 H ASP A 604 0.586 -13.362 -1.070 1.00 14.12 H new ATOM 0 HA ASP A 604 2.574 -11.643 -2.419 1.00 22.10 H new ATOM 0 HB2 ASP A 604 1.549 -12.099 -4.565 1.00 14.32 H new ATOM 0 HB3 ASP A 604 2.097 -13.600 -3.846 1.00 14.32 H new ATOM 368 N LEU A 605 0.964 -9.747 -2.540 1.00 70.51 N ATOM 369 CA LEU A 605 0.075 -8.579 -2.433 1.00 73.51 C ATOM 370 C LEU A 605 -0.070 -7.917 -3.769 1.00 1.22 C ATOM 371 O LEU A 605 -0.683 -6.856 -3.903 1.00 4.42 O ATOM 372 CB LEU A 605 0.569 -7.568 -1.397 1.00 35.11 C ATOM 373 CG LEU A 605 0.547 -7.996 0.072 1.00 45.24 C ATOM 374 CD1 LEU A 605 -0.856 -8.392 0.528 1.00 63.54 C ATOM 375 CD2 LEU A 605 1.562 -9.083 0.378 1.00 22.42 C ATOM 0 H LEU A 605 1.904 -9.529 -2.870 1.00 70.51 H new ATOM 0 HA LEU A 605 -0.897 -8.941 -2.097 1.00 73.51 H new ATOM 0 HB2 LEU A 605 1.593 -7.297 -1.653 1.00 35.11 H new ATOM 0 HB3 LEU A 605 -0.034 -6.665 -1.494 1.00 35.11 H new ATOM 0 HG LEU A 605 0.843 -7.121 0.651 1.00 45.24 H new ATOM 0 HD11 LEU A 605 -0.828 -8.689 1.576 1.00 63.54 H new ATOM 0 HD12 LEU A 605 -1.530 -7.544 0.409 1.00 63.54 H new ATOM 0 HD13 LEU A 605 -1.213 -9.226 -0.076 1.00 63.54 H new ATOM 0 HD21 LEU A 605 1.504 -9.349 1.433 1.00 22.42 H new ATOM 0 HD22 LEU A 605 1.348 -9.962 -0.230 1.00 22.42 H new ATOM 0 HD23 LEU A 605 2.564 -8.720 0.150 1.00 22.42 H new ATOM 383 N THR A 606 0.482 -8.576 -4.744 1.00 20.33 N ATOM 384 CA THR A 606 0.457 -8.178 -6.125 1.00 12.41 C ATOM 385 C THR A 606 -0.979 -7.745 -6.609 1.00 32.44 C ATOM 386 O THR A 606 -1.113 -6.682 -7.210 1.00 11.44 O ATOM 387 CB THR A 606 0.964 -9.343 -6.973 1.00 42.11 C ATOM 388 OG1 THR A 606 2.160 -9.861 -6.368 1.00 54.53 O ATOM 389 CG2 THR A 606 1.289 -8.873 -8.366 1.00 72.54 C ATOM 0 H THR A 606 0.987 -9.449 -4.593 1.00 20.33 H new ATOM 0 HA THR A 606 1.099 -7.304 -6.238 1.00 12.41 H new ATOM 0 HB THR A 606 0.193 -10.112 -7.028 1.00 42.11 H new ATOM 0 HG1 THR A 606 2.497 -10.612 -6.900 1.00 54.53 H new ATOM 0 HG21 THR A 606 1.649 -9.714 -8.959 1.00 72.54 H new ATOM 0 HG22 THR A 606 0.393 -8.460 -8.829 1.00 72.54 H new ATOM 0 HG23 THR A 606 2.061 -8.105 -8.320 1.00 72.54 H new ATOM 395 N PRO A 607 -2.075 -8.550 -6.335 1.00 54.22 N ATOM 396 CA PRO A 607 -3.457 -8.194 -6.748 1.00 44.35 C ATOM 397 C PRO A 607 -3.966 -6.847 -6.187 1.00 50.35 C ATOM 398 O PRO A 607 -4.991 -6.337 -6.638 1.00 61.31 O ATOM 399 CB PRO A 607 -4.315 -9.340 -6.190 1.00 15.15 C ATOM 400 CG PRO A 607 -3.461 -10.009 -5.172 1.00 51.33 C ATOM 401 CD PRO A 607 -2.063 -9.869 -5.660 1.00 2.44 C ATOM 0 HA PRO A 607 -3.503 -8.071 -7.830 1.00 44.35 H new ATOM 0 HB2 PRO A 607 -5.235 -8.962 -5.745 1.00 15.15 H new ATOM 0 HB3 PRO A 607 -4.605 -10.035 -6.978 1.00 15.15 H new ATOM 0 HG2 PRO A 607 -3.582 -9.544 -4.194 1.00 51.33 H new ATOM 0 HG3 PRO A 607 -3.733 -11.059 -5.062 1.00 51.33 H new ATOM 0 HD2 PRO A 607 -1.345 -9.896 -4.840 1.00 2.44 H new ATOM 0 HD3 PRO A 607 -1.793 -10.671 -6.347 1.00 2.44 H new ATOM 409 N LEU A 608 -3.265 -6.285 -5.212 1.00 41.12 N ATOM 410 CA LEU A 608 -3.667 -5.035 -4.619 1.00 44.53 C ATOM 411 C LEU A 608 -3.029 -3.846 -5.347 1.00 74.14 C ATOM 412 O LEU A 608 -3.201 -2.704 -4.943 1.00 32.23 O ATOM 413 CB LEU A 608 -3.312 -4.975 -3.119 1.00 0.55 C ATOM 414 CG LEU A 608 -4.050 -5.909 -2.130 1.00 54.34 C ATOM 415 CD1 LEU A 608 -3.703 -7.361 -2.340 1.00 70.33 C ATOM 416 CD2 LEU A 608 -3.748 -5.507 -0.701 1.00 61.43 C ATOM 0 H LEU A 608 -2.412 -6.684 -4.819 1.00 41.12 H new ATOM 0 HA LEU A 608 -4.751 -4.973 -4.720 1.00 44.53 H new ATOM 0 HB2 LEU A 608 -2.245 -5.177 -3.026 1.00 0.55 H new ATOM 0 HB3 LEU A 608 -3.473 -3.950 -2.785 1.00 0.55 H new ATOM 0 HG LEU A 608 -5.117 -5.798 -2.324 1.00 54.34 H new ATOM 0 HD11 LEU A 608 -4.247 -7.973 -1.621 1.00 70.33 H new ATOM 0 HD12 LEU A 608 -3.979 -7.658 -3.352 1.00 70.33 H new ATOM 0 HD13 LEU A 608 -2.631 -7.503 -2.200 1.00 70.33 H new ATOM 0 HD21 LEU A 608 -4.274 -6.173 -0.017 1.00 61.43 H new ATOM 0 HD22 LEU A 608 -2.675 -5.577 -0.522 1.00 61.43 H new ATOM 0 HD23 LEU A 608 -4.077 -4.481 -0.534 1.00 61.43 H new ATOM 424 N THR A 609 -2.287 -4.127 -6.390 1.00 13.03 N ATOM 425 CA THR A 609 -1.642 -3.100 -7.190 1.00 65.44 C ATOM 426 C THR A 609 -2.672 -2.419 -8.112 1.00 55.32 C ATOM 427 O THR A 609 -3.385 -3.097 -8.863 1.00 74.12 O ATOM 428 CB THR A 609 -0.527 -3.733 -8.048 1.00 40.51 C ATOM 429 OG1 THR A 609 0.398 -4.422 -7.192 1.00 51.41 O ATOM 430 CG2 THR A 609 0.218 -2.688 -8.865 1.00 24.44 C ATOM 0 H THR A 609 -2.109 -5.078 -6.714 1.00 13.03 H new ATOM 0 HA THR A 609 -1.211 -2.354 -6.523 1.00 65.44 H new ATOM 0 HB THR A 609 -0.992 -4.432 -8.744 1.00 40.51 H new ATOM 0 HG1 THR A 609 0.064 -5.325 -7.009 1.00 51.41 H new ATOM 0 HG21 THR A 609 0.995 -3.174 -9.455 1.00 24.44 H new ATOM 0 HG22 THR A 609 -0.480 -2.181 -9.531 1.00 24.44 H new ATOM 0 HG23 THR A 609 0.674 -1.959 -8.195 1.00 24.44 H new ATOM 436 N LYS A 610 -2.756 -1.104 -8.056 1.00 64.54 N ATOM 437 CA LYS A 610 -3.676 -0.379 -8.912 1.00 11.02 C ATOM 438 C LYS A 610 -2.937 0.551 -9.838 1.00 11.43 C ATOM 439 O LYS A 610 -1.900 1.097 -9.479 1.00 14.00 O ATOM 440 CB LYS A 610 -4.641 0.479 -8.115 1.00 13.22 C ATOM 441 CG LYS A 610 -5.567 -0.236 -7.171 1.00 42.40 C ATOM 442 CD LYS A 610 -6.528 0.765 -6.522 1.00 23.41 C ATOM 443 CE LYS A 610 -7.479 1.367 -7.514 1.00 71.30 C ATOM 444 NZ LYS A 610 -8.297 2.448 -6.927 1.00 50.41 N ATOM 0 H LYS A 610 -2.202 -0.518 -7.431 1.00 64.54 H new ATOM 0 HA LYS A 610 -4.221 -1.141 -9.470 1.00 11.02 H new ATOM 0 HB2 LYS A 610 -4.059 1.199 -7.539 1.00 13.22 H new ATOM 0 HB3 LYS A 610 -5.248 1.050 -8.818 1.00 13.22 H new ATOM 0 HG2 LYS A 610 -6.131 -0.998 -7.709 1.00 42.40 H new ATOM 0 HG3 LYS A 610 -4.990 -0.750 -6.402 1.00 42.40 H new ATOM 0 HD2 LYS A 610 -7.094 0.265 -5.737 1.00 23.41 H new ATOM 0 HD3 LYS A 610 -5.954 1.559 -6.044 1.00 23.41 H new ATOM 0 HE2 LYS A 610 -6.916 1.760 -8.360 1.00 71.30 H new ATOM 0 HE3 LYS A 610 -8.136 0.588 -7.902 1.00 71.30 H new ATOM 0 HZ1 LYS A 610 -8.949 2.820 -7.647 1.00 50.41 H new ATOM 0 HZ2 LYS A 610 -8.843 2.074 -6.125 1.00 50.41 H new ATOM 0 HZ3 LYS A 610 -7.675 3.213 -6.595 1.00 50.41 H new ATOM 458 N LYS A 611 -3.463 0.728 -11.022 1.00 34.35 N ATOM 459 CA LYS A 611 -2.943 1.719 -11.949 1.00 52.25 C ATOM 460 C LYS A 611 -3.397 3.133 -11.535 1.00 3.02 C ATOM 461 O LYS A 611 -2.791 4.132 -11.904 1.00 71.40 O ATOM 462 CB LYS A 611 -3.341 1.392 -13.403 1.00 62.41 C ATOM 463 CG LYS A 611 -4.838 1.251 -13.640 1.00 1.33 C ATOM 464 CD LYS A 611 -5.141 0.890 -15.084 1.00 41.11 C ATOM 465 CE LYS A 611 -6.632 0.663 -15.296 1.00 1.34 C ATOM 466 NZ LYS A 611 -6.950 0.295 -16.690 1.00 10.35 N ATOM 0 H LYS A 611 -4.259 0.197 -11.376 1.00 34.35 H new ATOM 0 HA LYS A 611 -1.854 1.691 -11.906 1.00 52.25 H new ATOM 0 HB2 LYS A 611 -2.957 2.176 -14.055 1.00 62.41 H new ATOM 0 HB3 LYS A 611 -2.852 0.464 -13.699 1.00 62.41 H new ATOM 0 HG2 LYS A 611 -5.241 0.483 -12.980 1.00 1.33 H new ATOM 0 HG3 LYS A 611 -5.338 2.186 -13.385 1.00 1.33 H new ATOM 0 HD2 LYS A 611 -4.795 1.688 -15.741 1.00 41.11 H new ATOM 0 HD3 LYS A 611 -4.591 -0.010 -15.359 1.00 41.11 H new ATOM 0 HE2 LYS A 611 -6.976 -0.126 -14.627 1.00 1.34 H new ATOM 0 HE3 LYS A 611 -7.177 1.568 -15.028 1.00 1.34 H new ATOM 0 HZ1 LYS A 611 -7.975 0.151 -16.786 1.00 10.35 H new ATOM 0 HZ2 LYS A 611 -6.647 1.058 -17.328 1.00 10.35 H new ATOM 0 HZ3 LYS A 611 -6.452 -0.583 -16.939 1.00 10.35 H new ATOM 480 N ASP A 612 -4.479 3.194 -10.764 1.00 43.33 N ATOM 481 CA ASP A 612 -5.031 4.468 -10.271 1.00 75.33 C ATOM 482 C ASP A 612 -4.549 4.773 -8.875 1.00 12.20 C ATOM 483 O ASP A 612 -4.631 5.918 -8.426 1.00 71.52 O ATOM 484 CB ASP A 612 -6.571 4.456 -10.257 1.00 64.32 C ATOM 485 CG ASP A 612 -7.200 4.426 -11.623 1.00 22.55 C ATOM 486 OD1 ASP A 612 -7.384 3.330 -12.193 1.00 43.00 O ATOM 487 OD2 ASP A 612 -7.537 5.508 -12.153 1.00 61.22 O ATOM 0 H ASP A 612 -5.001 2.372 -10.461 1.00 43.33 H new ATOM 0 HA ASP A 612 -4.680 5.237 -10.960 1.00 75.33 H new ATOM 0 HB2 ASP A 612 -6.911 3.587 -9.694 1.00 64.32 H new ATOM 0 HB3 ASP A 612 -6.925 5.339 -9.726 1.00 64.32 H new ATOM 492 N ALA A 613 -4.037 3.740 -8.201 1.00 2.43 N ATOM 493 CA ALA A 613 -3.606 3.808 -6.802 1.00 24.34 C ATOM 494 C ALA A 613 -4.805 4.020 -5.860 1.00 51.55 C ATOM 495 O ALA A 613 -5.962 4.059 -6.295 1.00 53.22 O ATOM 496 CB ALA A 613 -2.522 4.868 -6.587 1.00 0.32 C ATOM 0 H ALA A 613 -3.908 2.818 -8.618 1.00 2.43 H new ATOM 0 HA ALA A 613 -3.158 2.846 -6.554 1.00 24.34 H new ATOM 0 HB1 ALA A 613 -2.232 4.884 -5.536 1.00 0.32 H new ATOM 0 HB2 ALA A 613 -1.653 4.629 -7.200 1.00 0.32 H new ATOM 0 HB3 ALA A 613 -2.908 5.847 -6.872 1.00 0.32 H new ATOM 502 N TYR A 614 -4.529 4.093 -4.594 1.00 14.52 N ATOM 503 CA TYR A 614 -5.540 4.297 -3.561 1.00 2.41 C ATOM 504 C TYR A 614 -5.351 5.653 -2.927 1.00 25.22 C ATOM 505 O TYR A 614 -4.222 6.028 -2.626 1.00 41.32 O ATOM 506 CB TYR A 614 -5.369 3.244 -2.456 1.00 51.20 C ATOM 507 CG TYR A 614 -5.513 1.822 -2.921 1.00 13.02 C ATOM 508 CD1 TYR A 614 -4.443 1.153 -3.498 1.00 23.50 C ATOM 509 CD2 TYR A 614 -6.715 1.149 -2.795 1.00 50.52 C ATOM 510 CE1 TYR A 614 -4.567 -0.130 -3.931 1.00 41.43 C ATOM 511 CE2 TYR A 614 -6.845 -0.151 -3.231 1.00 65.22 C ATOM 512 CZ TYR A 614 -5.768 -0.785 -3.797 1.00 62.20 C ATOM 513 OH TYR A 614 -5.891 -2.073 -4.247 1.00 43.01 O ATOM 0 H TYR A 614 -3.581 4.013 -4.226 1.00 14.52 H new ATOM 0 HA TYR A 614 -6.526 4.219 -4.019 1.00 2.41 H new ATOM 0 HB2 TYR A 614 -4.385 3.367 -2.004 1.00 51.20 H new ATOM 0 HB3 TYR A 614 -6.105 3.433 -1.674 1.00 51.20 H new ATOM 0 HD1 TYR A 614 -3.495 1.660 -3.605 1.00 23.50 H new ATOM 0 HD2 TYR A 614 -7.562 1.649 -2.349 1.00 50.52 H new ATOM 0 HE1 TYR A 614 -3.723 -0.634 -4.379 1.00 41.43 H new ATOM 0 HE2 TYR A 614 -7.788 -0.668 -3.128 1.00 65.22 H new ATOM 0 HH TYR A 614 -5.012 -2.408 -4.523 1.00 43.01 H new ATOM 523 N LYS A 615 -6.408 6.406 -2.740 1.00 12.12 N ATOM 524 CA LYS A 615 -6.274 7.632 -2.045 1.00 53.12 C ATOM 525 C LYS A 615 -6.985 7.590 -0.702 1.00 31.44 C ATOM 526 O LYS A 615 -8.080 7.035 -0.575 1.00 4.51 O ATOM 527 CB LYS A 615 -6.831 8.766 -2.847 1.00 53.32 C ATOM 528 CG LYS A 615 -8.294 8.599 -3.172 1.00 40.42 C ATOM 529 CD LYS A 615 -8.863 9.808 -3.819 1.00 35.40 C ATOM 530 CE LYS A 615 -8.700 11.043 -2.930 1.00 73.10 C ATOM 531 NZ LYS A 615 -9.366 12.243 -3.471 1.00 40.42 N ATOM 0 H LYS A 615 -7.351 6.183 -3.060 1.00 12.12 H new ATOM 0 HA LYS A 615 -5.208 7.787 -1.881 1.00 53.12 H new ATOM 0 HB2 LYS A 615 -6.691 9.696 -2.296 1.00 53.32 H new ATOM 0 HB3 LYS A 615 -6.267 8.858 -3.775 1.00 53.32 H new ATOM 0 HG2 LYS A 615 -8.423 7.741 -3.831 1.00 40.42 H new ATOM 0 HG3 LYS A 615 -8.846 8.384 -2.257 1.00 40.42 H new ATOM 0 HD2 LYS A 615 -8.369 9.978 -4.775 1.00 35.40 H new ATOM 0 HD3 LYS A 615 -9.920 9.647 -4.031 1.00 35.40 H new ATOM 0 HE2 LYS A 615 -9.104 10.826 -1.941 1.00 73.10 H new ATOM 0 HE3 LYS A 615 -7.638 11.252 -2.801 1.00 73.10 H new ATOM 0 HZ1 LYS A 615 -8.762 13.075 -3.314 1.00 40.42 H new ATOM 0 HZ2 LYS A 615 -9.528 12.120 -4.491 1.00 40.42 H new ATOM 0 HZ3 LYS A 615 -10.278 12.381 -2.990 1.00 40.42 H new ATOM 545 N VAL A 616 -6.356 8.159 0.268 1.00 62.45 N ATOM 546 CA VAL A 616 -6.935 8.359 1.562 1.00 41.20 C ATOM 547 C VAL A 616 -6.972 9.854 1.757 1.00 24.20 C ATOM 548 O VAL A 616 -5.931 10.493 1.742 1.00 55.52 O ATOM 549 CB VAL A 616 -6.034 7.756 2.675 1.00 44.14 C ATOM 550 CG1 VAL A 616 -6.702 7.853 4.040 1.00 1.34 C ATOM 551 CG2 VAL A 616 -5.643 6.327 2.356 1.00 61.43 C ATOM 0 H VAL A 616 -5.401 8.508 0.187 1.00 62.45 H new ATOM 0 HA VAL A 616 -7.915 7.886 1.621 1.00 41.20 H new ATOM 0 HB VAL A 616 -5.119 8.347 2.712 1.00 44.14 H new ATOM 0 HG11 VAL A 616 -6.047 7.423 4.797 1.00 1.34 H new ATOM 0 HG12 VAL A 616 -6.893 8.899 4.278 1.00 1.34 H new ATOM 0 HG13 VAL A 616 -7.645 7.306 4.023 1.00 1.34 H new ATOM 0 HG21 VAL A 616 -5.013 5.935 3.155 1.00 61.43 H new ATOM 0 HG22 VAL A 616 -6.541 5.715 2.269 1.00 61.43 H new ATOM 0 HG23 VAL A 616 -5.094 6.302 1.415 1.00 61.43 H new ATOM 557 N GLU A 617 -8.120 10.418 1.911 1.00 52.12 N ATOM 558 CA GLU A 617 -8.190 11.842 2.077 1.00 75.52 C ATOM 559 C GLU A 617 -8.695 12.220 3.442 1.00 34.24 C ATOM 560 O GLU A 617 -9.685 11.681 3.931 1.00 12.11 O ATOM 561 CB GLU A 617 -8.984 12.535 0.950 1.00 42.53 C ATOM 562 CG GLU A 617 -10.429 12.096 0.801 1.00 63.33 C ATOM 563 CD GLU A 617 -11.139 12.836 -0.310 1.00 42.14 C ATOM 564 OE1 GLU A 617 -11.609 13.974 -0.079 1.00 44.14 O ATOM 565 OE2 GLU A 617 -11.233 12.301 -1.425 1.00 31.14 O ATOM 0 H GLU A 617 -9.016 9.930 1.927 1.00 52.12 H new ATOM 0 HA GLU A 617 -7.168 12.214 1.998 1.00 75.52 H new ATOM 0 HB2 GLU A 617 -8.966 13.611 1.126 1.00 42.53 H new ATOM 0 HB3 GLU A 617 -8.470 12.358 0.005 1.00 42.53 H new ATOM 0 HG2 GLU A 617 -10.463 11.025 0.601 1.00 63.33 H new ATOM 0 HG3 GLU A 617 -10.956 12.262 1.741 1.00 63.33 H new ATOM 572 N THR A 618 -7.994 13.114 4.054 1.00 55.25 N ATOM 573 CA THR A 618 -8.327 13.633 5.347 1.00 63.35 C ATOM 574 C THR A 618 -8.429 15.139 5.211 1.00 65.13 C ATOM 575 O THR A 618 -8.306 15.652 4.099 1.00 42.14 O ATOM 576 CB THR A 618 -7.230 13.265 6.385 1.00 31.33 C ATOM 577 OG1 THR A 618 -5.952 13.779 5.954 1.00 51.33 O ATOM 578 CG2 THR A 618 -7.133 11.755 6.567 1.00 24.35 C ATOM 0 H THR A 618 -7.145 13.520 3.659 1.00 55.25 H new ATOM 0 HA THR A 618 -9.267 13.207 5.697 1.00 63.35 H new ATOM 0 HB THR A 618 -7.504 13.714 7.340 1.00 31.33 H new ATOM 0 HG1 THR A 618 -5.767 13.472 5.042 1.00 51.33 H new ATOM 0 HG21 THR A 618 -6.358 11.526 7.298 1.00 24.35 H new ATOM 0 HG22 THR A 618 -8.090 11.369 6.919 1.00 24.35 H new ATOM 0 HG23 THR A 618 -6.882 11.289 5.614 1.00 24.35 H new ATOM 584 N ASP A 619 -8.675 15.845 6.287 1.00 21.40 N ATOM 585 CA ASP A 619 -8.712 17.308 6.224 1.00 41.44 C ATOM 586 C ASP A 619 -7.313 17.855 6.089 1.00 61.10 C ATOM 587 O ASP A 619 -7.103 18.942 5.546 1.00 65.23 O ATOM 588 CB ASP A 619 -9.380 17.928 7.450 1.00 74.14 C ATOM 589 CG ASP A 619 -10.828 17.566 7.586 1.00 2.33 C ATOM 590 OD1 ASP A 619 -11.674 18.170 6.882 1.00 30.12 O ATOM 591 OD2 ASP A 619 -11.153 16.678 8.399 1.00 34.14 O ATOM 0 H ASP A 619 -8.852 15.449 7.210 1.00 21.40 H new ATOM 0 HA ASP A 619 -9.308 17.574 5.351 1.00 41.44 H new ATOM 0 HB2 ASP A 619 -8.847 17.608 8.346 1.00 74.14 H new ATOM 0 HB3 ASP A 619 -9.288 19.013 7.395 1.00 74.14 H new ATOM 596 N LYS A 620 -6.358 17.086 6.564 1.00 34.13 N ATOM 597 CA LYS A 620 -4.975 17.482 6.545 1.00 52.32 C ATOM 598 C LYS A 620 -4.323 17.184 5.198 1.00 64.50 C ATOM 599 O LYS A 620 -3.894 18.103 4.491 1.00 64.23 O ATOM 600 CB LYS A 620 -4.203 16.791 7.674 1.00 65.42 C ATOM 601 CG LYS A 620 -4.707 17.135 9.074 1.00 2.24 C ATOM 602 CD LYS A 620 -3.947 16.384 10.169 1.00 71.42 C ATOM 603 CE LYS A 620 -2.464 16.732 10.171 1.00 11.11 C ATOM 604 NZ LYS A 620 -1.736 16.055 11.262 1.00 21.34 N ATOM 0 H LYS A 620 -6.523 16.167 6.974 1.00 34.13 H new ATOM 0 HA LYS A 620 -4.940 18.560 6.700 1.00 52.32 H new ATOM 0 HB2 LYS A 620 -4.262 15.712 7.533 1.00 65.42 H new ATOM 0 HB3 LYS A 620 -3.150 17.065 7.601 1.00 65.42 H new ATOM 0 HG2 LYS A 620 -4.610 18.208 9.239 1.00 2.24 H new ATOM 0 HG3 LYS A 620 -5.768 16.897 9.144 1.00 2.24 H new ATOM 0 HD2 LYS A 620 -4.378 16.625 11.141 1.00 71.42 H new ATOM 0 HD3 LYS A 620 -4.068 15.310 10.024 1.00 71.42 H new ATOM 0 HE2 LYS A 620 -2.025 16.451 9.214 1.00 11.11 H new ATOM 0 HE3 LYS A 620 -2.345 17.811 10.272 1.00 11.11 H new ATOM 0 HZ1 LYS A 620 -0.714 16.210 11.146 1.00 21.34 H new ATOM 0 HZ2 LYS A 620 -2.043 16.442 12.177 1.00 21.34 H new ATOM 0 HZ3 LYS A 620 -1.937 15.035 11.233 1.00 21.34 H new ATOM 618 N TYR A 621 -4.260 15.916 4.830 1.00 1.12 N ATOM 619 CA TYR A 621 -3.570 15.526 3.600 1.00 21.52 C ATOM 620 C TYR A 621 -4.379 14.495 2.831 1.00 61.21 C ATOM 621 O TYR A 621 -5.316 13.887 3.369 1.00 61.13 O ATOM 622 CB TYR A 621 -2.228 14.831 3.927 1.00 20.41 C ATOM 623 CG TYR A 621 -1.290 15.540 4.875 1.00 71.22 C ATOM 624 CD1 TYR A 621 -0.425 16.523 4.433 1.00 22.33 C ATOM 625 CD2 TYR A 621 -1.247 15.184 6.215 1.00 45.20 C ATOM 626 CE1 TYR A 621 0.456 17.134 5.302 1.00 72.12 C ATOM 627 CE2 TYR A 621 -0.376 15.793 7.089 1.00 1.11 C ATOM 628 CZ TYR A 621 0.474 16.766 6.627 1.00 71.33 C ATOM 629 OH TYR A 621 1.360 17.371 7.494 1.00 32.34 O ATOM 0 H TYR A 621 -4.671 15.143 5.354 1.00 1.12 H new ATOM 0 HA TYR A 621 -3.426 16.439 3.022 1.00 21.52 H new ATOM 0 HB2 TYR A 621 -2.450 13.849 4.345 1.00 20.41 H new ATOM 0 HB3 TYR A 621 -1.697 14.665 2.989 1.00 20.41 H new ATOM 0 HD1 TYR A 621 -0.439 16.817 3.394 1.00 22.33 H new ATOM 0 HD2 TYR A 621 -1.910 14.414 6.580 1.00 45.20 H new ATOM 0 HE1 TYR A 621 1.129 17.898 4.943 1.00 72.12 H new ATOM 0 HE2 TYR A 621 -0.362 15.507 8.130 1.00 1.11 H new ATOM 0 HH TYR A 621 1.244 16.999 8.393 1.00 32.34 H new ATOM 639 N GLU A 622 -4.028 14.313 1.582 1.00 41.22 N ATOM 640 CA GLU A 622 -4.499 13.182 0.836 1.00 73.32 C ATOM 641 C GLU A 622 -3.321 12.303 0.647 1.00 20.53 C ATOM 642 O GLU A 622 -2.265 12.769 0.218 1.00 31.40 O ATOM 643 CB GLU A 622 -5.045 13.511 -0.553 1.00 72.40 C ATOM 644 CG GLU A 622 -6.186 14.472 -0.599 1.00 30.30 C ATOM 645 CD GLU A 622 -6.814 14.517 -1.967 1.00 33.11 C ATOM 646 OE1 GLU A 622 -6.126 14.882 -2.939 1.00 55.21 O ATOM 647 OE2 GLU A 622 -7.993 14.138 -2.103 1.00 14.20 O ATOM 0 H GLU A 622 -3.414 14.940 1.062 1.00 41.22 H new ATOM 0 HA GLU A 622 -5.325 12.739 1.393 1.00 73.32 H new ATOM 0 HB2 GLU A 622 -4.231 13.916 -1.155 1.00 72.40 H new ATOM 0 HB3 GLU A 622 -5.360 12.581 -1.027 1.00 72.40 H new ATOM 0 HG2 GLU A 622 -6.936 14.184 0.138 1.00 30.30 H new ATOM 0 HG3 GLU A 622 -5.836 15.467 -0.325 1.00 30.30 H new ATOM 654 N PHE A 623 -3.471 11.074 0.942 1.00 23.34 N ATOM 655 CA PHE A 623 -2.403 10.156 0.789 1.00 72.50 C ATOM 656 C PHE A 623 -2.730 9.265 -0.352 1.00 14.33 C ATOM 657 O PHE A 623 -3.793 8.672 -0.391 1.00 51.14 O ATOM 658 CB PHE A 623 -2.226 9.321 2.063 1.00 22.10 C ATOM 659 CG PHE A 623 -1.929 10.130 3.294 1.00 40.15 C ATOM 660 CD1 PHE A 623 -2.958 10.613 4.090 1.00 52.34 C ATOM 661 CD2 PHE A 623 -0.626 10.405 3.654 1.00 61.31 C ATOM 662 CE1 PHE A 623 -2.686 11.354 5.217 1.00 32.35 C ATOM 663 CE2 PHE A 623 -0.348 11.144 4.782 1.00 14.04 C ATOM 664 CZ PHE A 623 -1.378 11.620 5.564 1.00 12.52 C ATOM 0 H PHE A 623 -4.337 10.668 1.298 1.00 23.34 H new ATOM 0 HA PHE A 623 -1.473 10.694 0.605 1.00 72.50 H new ATOM 0 HB2 PHE A 623 -3.133 8.742 2.233 1.00 22.10 H new ATOM 0 HB3 PHE A 623 -1.417 8.608 1.907 1.00 22.10 H new ATOM 0 HD1 PHE A 623 -3.983 10.405 3.822 1.00 52.34 H new ATOM 0 HD2 PHE A 623 0.185 10.036 3.044 1.00 61.31 H new ATOM 0 HE1 PHE A 623 -3.495 11.726 5.828 1.00 32.35 H new ATOM 0 HE2 PHE A 623 0.677 11.350 5.054 1.00 14.04 H new ATOM 0 HZ PHE A 623 -1.161 12.201 6.448 1.00 12.52 H new ATOM 674 N HIS A 624 -1.863 9.195 -1.294 1.00 44.35 N ATOM 675 CA HIS A 624 -2.053 8.314 -2.390 1.00 52.32 C ATOM 676 C HIS A 624 -1.051 7.208 -2.268 1.00 13.14 C ATOM 677 O HIS A 624 0.161 7.455 -2.255 1.00 24.41 O ATOM 678 CB HIS A 624 -1.984 9.059 -3.733 1.00 0.34 C ATOM 679 CG HIS A 624 -3.174 9.984 -3.995 1.00 71.10 C ATOM 680 ND1 HIS A 624 -4.149 9.688 -4.918 1.00 62.32 N ATOM 681 CD2 HIS A 624 -3.540 11.207 -3.461 1.00 53.14 C ATOM 682 CE1 HIS A 624 -5.046 10.650 -4.952 1.00 70.44 C ATOM 683 NE2 HIS A 624 -4.704 11.584 -4.087 1.00 43.24 N ATOM 0 H HIS A 624 -1.004 9.744 -1.329 1.00 44.35 H new ATOM 0 HA HIS A 624 -3.053 7.881 -2.367 1.00 52.32 H new ATOM 0 HB2 HIS A 624 -1.067 9.647 -3.764 1.00 0.34 H new ATOM 0 HB3 HIS A 624 -1.921 8.328 -4.539 1.00 0.34 H new ATOM 0 HD2 HIS A 624 -3.012 11.760 -2.698 1.00 53.14 H new ATOM 0 HE1 HIS A 624 -5.920 10.671 -5.586 1.00 70.44 H new ATOM 0 HE2 HIS A 624 -5.219 12.446 -3.911 1.00 43.24 H new ATOM 692 N ILE A 625 -1.559 6.003 -2.145 1.00 3.52 N ATOM 693 CA ILE A 625 -0.763 4.833 -1.832 1.00 43.04 C ATOM 694 C ILE A 625 -1.059 3.742 -2.845 1.00 13.12 C ATOM 695 O ILE A 625 -2.155 3.685 -3.398 1.00 42.41 O ATOM 696 CB ILE A 625 -1.165 4.299 -0.425 1.00 43.11 C ATOM 697 CG1 ILE A 625 -1.187 5.445 0.586 1.00 71.11 C ATOM 698 CG2 ILE A 625 -0.200 3.202 0.041 1.00 63.32 C ATOM 699 CD1 ILE A 625 -1.628 5.039 1.962 1.00 13.32 C ATOM 0 H ILE A 625 -2.552 5.803 -2.261 1.00 3.52 H new ATOM 0 HA ILE A 625 0.293 5.101 -1.853 1.00 43.04 H new ATOM 0 HB ILE A 625 -2.163 3.867 -0.496 1.00 43.11 H new ATOM 0 HG12 ILE A 625 -0.189 5.879 0.649 1.00 71.11 H new ATOM 0 HG13 ILE A 625 -1.852 6.227 0.219 1.00 71.11 H new ATOM 0 HG21 ILE A 625 -0.502 2.846 1.026 1.00 63.32 H new ATOM 0 HG22 ILE A 625 -0.222 2.374 -0.667 1.00 63.32 H new ATOM 0 HG23 ILE A 625 0.811 3.606 0.096 1.00 63.32 H new ATOM 0 HD11 ILE A 625 -1.616 5.909 2.619 1.00 13.32 H new ATOM 0 HD12 ILE A 625 -2.639 4.633 1.915 1.00 13.32 H new ATOM 0 HD13 ILE A 625 -0.950 4.280 2.352 1.00 13.32 H new ATOM 706 N ASN A 626 -0.102 2.913 -3.094 1.00 24.21 N ATOM 707 CA ASN A 626 -0.247 1.806 -3.990 1.00 42.23 C ATOM 708 C ASN A 626 0.602 0.698 -3.416 1.00 1.15 C ATOM 709 O ASN A 626 1.461 0.981 -2.617 1.00 53.53 O ATOM 710 CB ASN A 626 0.165 2.225 -5.407 1.00 33.22 C ATOM 711 CG ASN A 626 -0.255 1.256 -6.479 1.00 74.50 C ATOM 712 OD1 ASN A 626 -1.187 0.457 -6.297 1.00 34.40 O ATOM 713 ND2 ASN A 626 0.332 1.388 -7.624 1.00 65.35 N ATOM 0 H ASN A 626 0.824 2.984 -2.673 1.00 24.21 H new ATOM 0 HA ASN A 626 -1.277 1.461 -4.081 1.00 42.23 H new ATOM 0 HB2 ASN A 626 -0.266 3.202 -5.626 1.00 33.22 H new ATOM 0 HB3 ASN A 626 1.248 2.340 -5.440 1.00 33.22 H new ATOM 0 HD21 ASN A 626 0.032 0.824 -8.419 1.00 65.35 H new ATOM 0 HD22 ASN A 626 1.095 2.057 -7.732 1.00 65.35 H new ATOM 719 N VAL A 627 0.294 -0.544 -3.697 1.00 33.31 N ATOM 720 CA VAL A 627 1.069 -1.645 -3.105 1.00 42.54 C ATOM 721 C VAL A 627 2.404 -1.871 -3.826 1.00 52.33 C ATOM 722 O VAL A 627 3.459 -1.983 -3.217 1.00 4.41 O ATOM 723 CB VAL A 627 0.239 -2.937 -3.015 1.00 2.21 C ATOM 724 CG1 VAL A 627 1.062 -4.085 -2.440 1.00 1.00 C ATOM 725 CG2 VAL A 627 -0.977 -2.679 -2.148 1.00 3.52 C ATOM 0 H VAL A 627 -0.466 -0.830 -4.314 1.00 33.31 H new ATOM 0 HA VAL A 627 1.315 -1.346 -2.086 1.00 42.54 H new ATOM 0 HB VAL A 627 -0.073 -3.227 -4.018 1.00 2.21 H new ATOM 0 HG11 VAL A 627 0.447 -4.984 -2.389 1.00 1.00 H new ATOM 0 HG12 VAL A 627 1.924 -4.271 -3.080 1.00 1.00 H new ATOM 0 HG13 VAL A 627 1.404 -3.822 -1.439 1.00 1.00 H new ATOM 0 HG21 VAL A 627 -1.573 -3.589 -2.077 1.00 3.52 H new ATOM 0 HG22 VAL A 627 -0.656 -2.377 -1.151 1.00 3.52 H new ATOM 0 HG23 VAL A 627 -1.578 -1.885 -2.591 1.00 3.52 H new ATOM 731 N CYS A 628 2.336 -1.898 -5.078 1.00 32.33 N ATOM 732 CA CYS A 628 3.489 -2.033 -5.932 1.00 61.51 C ATOM 733 C CYS A 628 3.364 -1.036 -7.052 1.00 33.33 C ATOM 734 O CYS A 628 2.260 -0.762 -7.514 1.00 1.34 O ATOM 735 CB CYS A 628 3.594 -3.440 -6.540 1.00 24.45 C ATOM 736 SG CYS A 628 3.819 -4.831 -5.380 1.00 5.11 S ATOM 0 H CYS A 628 1.456 -1.826 -5.589 1.00 32.33 H new ATOM 0 HA CYS A 628 4.382 -1.858 -5.332 1.00 61.51 H new ATOM 0 HB2 CYS A 628 2.690 -3.626 -7.120 1.00 24.45 H new ATOM 0 HB3 CYS A 628 4.429 -3.445 -7.240 1.00 24.45 H new ATOM 741 N GLY A 629 4.461 -0.494 -7.478 1.00 42.42 N ATOM 742 CA GLY A 629 4.435 0.439 -8.558 1.00 54.23 C ATOM 743 C GLY A 629 4.296 1.852 -8.061 1.00 12.33 C ATOM 744 O GLY A 629 4.426 2.107 -6.862 1.00 53.11 O ATOM 0 H GLY A 629 5.387 -0.682 -7.093 1.00 42.42 H new ATOM 0 HA2 GLY A 629 5.350 0.346 -9.143 1.00 54.23 H new ATOM 0 HA3 GLY A 629 3.605 0.203 -9.224 1.00 54.23 H new ATOM 748 N PRO A 630 4.068 2.805 -8.944 1.00 64.41 N ATOM 749 CA PRO A 630 3.909 4.186 -8.559 1.00 45.02 C ATOM 750 C PRO A 630 2.467 4.525 -8.217 1.00 30.05 C ATOM 751 O PRO A 630 1.558 3.709 -8.392 1.00 1.21 O ATOM 752 CB PRO A 630 4.333 4.928 -9.817 1.00 52.34 C ATOM 753 CG PRO A 630 3.907 4.039 -10.940 1.00 11.25 C ATOM 754 CD PRO A 630 3.948 2.623 -10.407 1.00 33.02 C ATOM 0 HA PRO A 630 4.483 4.439 -7.667 1.00 45.02 H new ATOM 0 HB2 PRO A 630 3.854 5.905 -9.881 1.00 52.34 H new ATOM 0 HB3 PRO A 630 5.409 5.099 -9.833 1.00 52.34 H new ATOM 0 HG2 PRO A 630 2.904 4.297 -11.280 1.00 11.25 H new ATOM 0 HG3 PRO A 630 4.572 4.150 -11.797 1.00 11.25 H new ATOM 0 HD2 PRO A 630 3.046 2.070 -10.669 1.00 33.02 H new ATOM 0 HD3 PRO A 630 4.793 2.066 -10.812 1.00 33.02 H new ATOM 762 N VAL A 631 2.263 5.718 -7.740 1.00 13.01 N ATOM 763 CA VAL A 631 0.934 6.201 -7.468 1.00 11.50 C ATOM 764 C VAL A 631 0.553 7.239 -8.465 1.00 22.31 C ATOM 765 O VAL A 631 1.347 8.147 -8.780 1.00 21.53 O ATOM 766 CB VAL A 631 0.765 6.797 -6.041 1.00 4.03 C ATOM 767 CG1 VAL A 631 0.846 5.719 -5.021 1.00 34.52 C ATOM 768 CG2 VAL A 631 1.810 7.873 -5.745 1.00 4.40 C ATOM 0 H VAL A 631 3.007 6.383 -7.528 1.00 13.01 H new ATOM 0 HA VAL A 631 0.281 5.331 -7.537 1.00 11.50 H new ATOM 0 HB VAL A 631 -0.218 7.267 -5.998 1.00 4.03 H new ATOM 0 HG11 VAL A 631 0.726 6.149 -4.027 1.00 34.52 H new ATOM 0 HG12 VAL A 631 0.055 4.990 -5.199 1.00 34.52 H new ATOM 0 HG13 VAL A 631 1.816 5.226 -5.089 1.00 34.52 H new ATOM 0 HG21 VAL A 631 1.656 8.263 -4.739 1.00 4.40 H new ATOM 0 HG22 VAL A 631 2.808 7.441 -5.818 1.00 4.40 H new ATOM 0 HG23 VAL A 631 1.712 8.684 -6.467 1.00 4.40 H new ATOM 774 N SER A 632 -0.619 7.106 -8.998 1.00 33.31 N ATOM 775 CA SER A 632 -1.076 8.100 -9.913 1.00 74.12 C ATOM 776 C SER A 632 -1.709 9.248 -9.134 1.00 11.42 C ATOM 777 O SER A 632 -2.616 9.042 -8.319 1.00 61.40 O ATOM 778 CB SER A 632 -2.065 7.479 -10.884 1.00 24.52 C ATOM 779 OG SER A 632 -1.459 6.396 -11.582 1.00 62.04 O ATOM 0 H SER A 632 -1.265 6.336 -8.821 1.00 33.31 H new ATOM 0 HA SER A 632 -0.239 8.496 -10.489 1.00 74.12 H new ATOM 0 HB2 SER A 632 -2.943 7.126 -10.343 1.00 24.52 H new ATOM 0 HB3 SER A 632 -2.409 8.231 -11.594 1.00 24.52 H new ATOM 0 HG SER A 632 -1.963 5.573 -11.410 1.00 62.04 H new ATOM 785 N VAL A 633 -1.212 10.448 -9.381 1.00 74.44 N ATOM 786 CA VAL A 633 -1.680 11.670 -8.742 1.00 31.03 C ATOM 787 C VAL A 633 -1.363 12.786 -9.704 1.00 34.14 C ATOM 788 O VAL A 633 -0.342 12.721 -10.373 1.00 23.22 O ATOM 789 CB VAL A 633 -0.893 11.998 -7.412 1.00 41.01 C ATOM 790 CG1 VAL A 633 -1.508 13.176 -6.668 1.00 43.14 C ATOM 791 CG2 VAL A 633 -0.750 10.799 -6.491 1.00 11.11 C ATOM 0 H VAL A 633 -0.455 10.605 -10.046 1.00 74.44 H new ATOM 0 HA VAL A 633 -2.737 11.558 -8.501 1.00 31.03 H new ATOM 0 HB VAL A 633 0.113 12.276 -7.727 1.00 41.01 H new ATOM 0 HG11 VAL A 633 -0.938 13.370 -5.759 1.00 43.14 H new ATOM 0 HG12 VAL A 633 -1.487 14.060 -7.305 1.00 43.14 H new ATOM 0 HG13 VAL A 633 -2.540 12.942 -6.406 1.00 43.14 H new ATOM 0 HG21 VAL A 633 -0.200 11.091 -5.596 1.00 11.11 H new ATOM 0 HG22 VAL A 633 -1.739 10.438 -6.208 1.00 11.11 H new ATOM 0 HG23 VAL A 633 -0.208 10.006 -7.007 1.00 11.11 H new ATOM 797 N GLY A 634 -2.176 13.806 -9.762 1.00 1.14 N ATOM 798 CA GLY A 634 -1.872 14.928 -10.635 1.00 35.32 C ATOM 799 C GLY A 634 -0.957 15.941 -9.955 1.00 12.10 C ATOM 800 O GLY A 634 -1.051 17.149 -10.211 1.00 74.13 O ATOM 0 H GLY A 634 -3.041 13.892 -9.229 1.00 1.14 H new ATOM 0 HA2 GLY A 634 -1.397 14.562 -11.545 1.00 35.32 H new ATOM 0 HA3 GLY A 634 -2.799 15.418 -10.934 1.00 35.32 H new ATOM 804 N ALA A 635 -0.070 15.449 -9.092 1.00 31.12 N ATOM 805 CA ALA A 635 0.828 16.303 -8.322 1.00 2.20 C ATOM 806 C ALA A 635 2.040 15.526 -7.799 1.00 33.20 C ATOM 807 O ALA A 635 2.780 16.030 -6.948 1.00 23.23 O ATOM 808 CB ALA A 635 0.076 16.894 -7.136 1.00 63.45 C ATOM 0 H ALA A 635 0.045 14.452 -8.908 1.00 31.12 H new ATOM 0 HA ALA A 635 1.184 17.092 -8.985 1.00 2.20 H new ATOM 0 HB1 ALA A 635 0.747 17.532 -6.561 1.00 63.45 H new ATOM 0 HB2 ALA A 635 -0.766 17.485 -7.497 1.00 63.45 H new ATOM 0 HB3 ALA A 635 -0.292 16.088 -6.501 1.00 63.45 H new ATOM 814 N CYS A 636 2.274 14.331 -8.303 1.00 44.44 N ATOM 815 CA CYS A 636 3.347 13.503 -7.754 1.00 62.11 C ATOM 816 C CYS A 636 4.114 12.780 -8.857 1.00 62.14 C ATOM 817 O CYS A 636 3.515 12.354 -9.854 1.00 63.41 O ATOM 818 CB CYS A 636 2.773 12.488 -6.751 1.00 44.13 C ATOM 819 SG CYS A 636 1.828 13.239 -5.368 1.00 3.51 S ATOM 0 H CYS A 636 1.753 13.912 -9.074 1.00 44.44 H new ATOM 0 HA CYS A 636 4.047 14.160 -7.237 1.00 62.11 H new ATOM 0 HB2 CYS A 636 2.123 11.796 -7.285 1.00 44.13 H new ATOM 0 HB3 CYS A 636 3.593 11.901 -6.338 1.00 44.13 H new ATOM 824 N PRO A 637 5.449 12.639 -8.699 1.00 45.11 N ATOM 825 CA PRO A 637 6.297 11.954 -9.678 1.00 62.55 C ATOM 826 C PRO A 637 5.878 10.484 -9.878 1.00 4.24 C ATOM 827 O PRO A 637 5.648 9.748 -8.904 1.00 41.44 O ATOM 828 CB PRO A 637 7.712 12.040 -9.075 1.00 20.42 C ATOM 829 CG PRO A 637 7.502 12.345 -7.632 1.00 43.35 C ATOM 830 CD PRO A 637 6.236 13.141 -7.553 1.00 4.41 C ATOM 0 HA PRO A 637 6.225 12.411 -10.665 1.00 62.55 H new ATOM 0 HB2 PRO A 637 8.253 11.103 -9.205 1.00 20.42 H new ATOM 0 HB3 PRO A 637 8.301 12.818 -9.561 1.00 20.42 H new ATOM 0 HG2 PRO A 637 7.422 11.428 -7.048 1.00 43.35 H new ATOM 0 HG3 PRO A 637 8.342 12.909 -7.227 1.00 43.35 H new ATOM 0 HD2 PRO A 637 5.718 12.980 -6.608 1.00 4.41 H new ATOM 0 HD3 PRO A 637 6.427 14.211 -7.634 1.00 4.41 H new ATOM 838 N PRO A 638 5.791 10.038 -11.142 1.00 32.13 N ATOM 839 CA PRO A 638 5.333 8.677 -11.508 1.00 44.32 C ATOM 840 C PRO A 638 6.358 7.556 -11.207 1.00 14.42 C ATOM 841 O PRO A 638 6.304 6.469 -11.797 1.00 31.43 O ATOM 842 CB PRO A 638 5.100 8.793 -13.012 1.00 71.11 C ATOM 843 CG PRO A 638 6.039 9.852 -13.460 1.00 53.24 C ATOM 844 CD PRO A 638 6.122 10.841 -12.339 1.00 74.31 C ATOM 0 HA PRO A 638 4.458 8.388 -10.926 1.00 44.32 H new ATOM 0 HB2 PRO A 638 5.299 7.848 -13.517 1.00 71.11 H new ATOM 0 HB3 PRO A 638 4.067 9.061 -13.233 1.00 71.11 H new ATOM 0 HG2 PRO A 638 7.020 9.433 -13.682 1.00 53.24 H new ATOM 0 HG3 PRO A 638 5.681 10.328 -14.373 1.00 53.24 H new ATOM 0 HD2 PRO A 638 7.117 11.280 -12.265 1.00 74.31 H new ATOM 0 HD3 PRO A 638 5.420 11.663 -12.477 1.00 74.31 H new ATOM 852 N ASP A 639 7.264 7.817 -10.302 1.00 70.53 N ATOM 853 CA ASP A 639 8.241 6.817 -9.871 1.00 53.50 C ATOM 854 C ASP A 639 8.173 6.649 -8.362 1.00 75.42 C ATOM 855 O ASP A 639 8.959 5.918 -7.755 1.00 73.15 O ATOM 856 CB ASP A 639 9.664 7.212 -10.285 1.00 60.44 C ATOM 857 CG ASP A 639 10.140 8.478 -9.618 1.00 11.10 C ATOM 858 OD1 ASP A 639 9.708 9.568 -10.033 1.00 64.21 O ATOM 859 OD2 ASP A 639 10.941 8.398 -8.662 1.00 32.21 O ATOM 0 H ASP A 639 7.357 8.720 -9.837 1.00 70.53 H new ATOM 0 HA ASP A 639 7.996 5.873 -10.358 1.00 53.50 H new ATOM 0 HB2 ASP A 639 10.347 6.399 -10.039 1.00 60.44 H new ATOM 0 HB3 ASP A 639 9.699 7.342 -11.367 1.00 60.44 H new ATOM 864 N SER A 640 7.238 7.315 -7.755 1.00 64.15 N ATOM 865 CA SER A 640 7.071 7.234 -6.338 1.00 12.11 C ATOM 866 C SER A 640 5.790 6.468 -6.036 1.00 23.20 C ATOM 867 O SER A 640 4.796 6.614 -6.758 1.00 53.12 O ATOM 868 CB SER A 640 7.037 8.634 -5.783 1.00 52.42 C ATOM 869 OG SER A 640 8.198 9.327 -6.227 1.00 44.24 O ATOM 0 H SER A 640 6.572 7.927 -8.227 1.00 64.15 H new ATOM 0 HA SER A 640 7.897 6.700 -5.868 1.00 12.11 H new ATOM 0 HB2 SER A 640 6.137 9.151 -6.116 1.00 52.42 H new ATOM 0 HB3 SER A 640 7.005 8.608 -4.694 1.00 52.42 H new ATOM 0 HG SER A 640 8.867 9.337 -5.511 1.00 44.24 H new ATOM 875 N GLY A 641 5.809 5.660 -4.994 1.00 54.10 N ATOM 876 CA GLY A 641 4.682 4.797 -4.726 1.00 1.51 C ATOM 877 C GLY A 641 3.864 5.224 -3.530 1.00 73.31 C ATOM 878 O GLY A 641 2.920 4.550 -3.142 1.00 32.44 O ATOM 0 H GLY A 641 6.580 5.585 -4.331 1.00 54.10 H new ATOM 0 HA2 GLY A 641 4.038 4.771 -5.605 1.00 1.51 H new ATOM 0 HA3 GLY A 641 5.043 3.781 -4.565 1.00 1.51 H new ATOM 882 N ALA A 642 4.234 6.330 -2.936 1.00 43.54 N ATOM 883 CA ALA A 642 3.469 6.910 -1.854 1.00 32.34 C ATOM 884 C ALA A 642 3.661 8.404 -1.872 1.00 22.52 C ATOM 885 O ALA A 642 4.797 8.888 -1.831 1.00 42.52 O ATOM 886 CB ALA A 642 3.902 6.336 -0.519 1.00 11.10 C ATOM 0 H ALA A 642 5.072 6.855 -3.186 1.00 43.54 H new ATOM 0 HA ALA A 642 2.414 6.672 -1.989 1.00 32.34 H new ATOM 0 HB1 ALA A 642 3.313 6.787 0.279 1.00 11.10 H new ATOM 0 HB2 ALA A 642 3.747 5.257 -0.519 1.00 11.10 H new ATOM 0 HB3 ALA A 642 4.958 6.551 -0.356 1.00 11.10 H new ATOM 892 N CYS A 643 2.583 9.137 -1.945 1.00 41.30 N ATOM 893 CA CYS A 643 2.670 10.588 -2.018 1.00 5.42 C ATOM 894 C CYS A 643 1.510 11.244 -1.281 1.00 35.53 C ATOM 895 O CYS A 643 0.359 10.799 -1.400 1.00 11.05 O ATOM 896 CB CYS A 643 2.705 11.037 -3.476 1.00 42.24 C ATOM 897 SG CYS A 643 2.930 12.830 -3.719 1.00 50.13 S ATOM 0 H CYS A 643 1.633 8.765 -1.956 1.00 41.30 H new ATOM 0 HA CYS A 643 3.593 10.902 -1.531 1.00 5.42 H new ATOM 0 HB2 CYS A 643 3.514 10.512 -3.984 1.00 42.24 H new ATOM 0 HB3 CYS A 643 1.775 10.733 -3.957 1.00 42.24 H new ATOM 902 N GLN A 644 1.807 12.269 -0.506 1.00 0.21 N ATOM 903 CA GLN A 644 0.794 12.996 0.215 1.00 60.11 C ATOM 904 C GLN A 644 0.748 14.423 -0.254 1.00 42.53 C ATOM 905 O GLN A 644 1.788 15.037 -0.536 1.00 1.22 O ATOM 906 CB GLN A 644 1.007 12.972 1.747 1.00 2.14 C ATOM 907 CG GLN A 644 2.323 13.573 2.226 1.00 14.22 C ATOM 908 CD GLN A 644 2.427 13.642 3.740 1.00 24.34 C ATOM 909 OE1 GLN A 644 1.441 13.765 4.434 1.00 54.15 O ATOM 910 NE2 GLN A 644 3.626 13.584 4.253 1.00 42.13 N ATOM 0 H GLN A 644 2.755 12.616 -0.362 1.00 0.21 H new ATOM 0 HA GLN A 644 -0.152 12.495 0.008 1.00 60.11 H new ATOM 0 HB2 GLN A 644 0.186 13.510 2.221 1.00 2.14 H new ATOM 0 HB3 GLN A 644 0.951 11.939 2.090 1.00 2.14 H new ATOM 0 HG2 GLN A 644 3.150 12.979 1.837 1.00 14.22 H new ATOM 0 HG3 GLN A 644 2.429 14.576 1.814 1.00 14.22 H new ATOM 0 HE21 GLN A 644 4.437 13.480 3.643 1.00 42.13 H new ATOM 0 HE22 GLN A 644 3.752 13.642 5.264 1.00 42.13 H new ATOM 918 N VAL A 645 -0.426 14.937 -0.363 1.00 12.44 N ATOM 919 CA VAL A 645 -0.611 16.305 -0.701 1.00 42.33 C ATOM 920 C VAL A 645 -1.460 16.971 0.374 1.00 21.24 C ATOM 921 O VAL A 645 -2.548 16.497 0.719 1.00 71.21 O ATOM 922 CB VAL A 645 -1.206 16.498 -2.138 1.00 72.11 C ATOM 923 CG1 VAL A 645 -2.545 15.805 -2.297 1.00 25.21 C ATOM 924 CG2 VAL A 645 -1.309 17.978 -2.499 1.00 43.33 C ATOM 0 H VAL A 645 -1.292 14.417 -0.219 1.00 12.44 H new ATOM 0 HA VAL A 645 0.364 16.791 -0.733 1.00 42.33 H new ATOM 0 HB VAL A 645 -0.514 16.026 -2.836 1.00 72.11 H new ATOM 0 HG11 VAL A 645 -2.920 15.965 -3.308 1.00 25.21 H new ATOM 0 HG12 VAL A 645 -2.425 14.736 -2.120 1.00 25.21 H new ATOM 0 HG13 VAL A 645 -3.254 16.215 -1.578 1.00 25.21 H new ATOM 0 HG21 VAL A 645 -1.725 18.080 -3.501 1.00 43.33 H new ATOM 0 HG22 VAL A 645 -1.958 18.483 -1.784 1.00 43.33 H new ATOM 0 HG23 VAL A 645 -0.317 18.429 -2.470 1.00 43.33 H new ATOM 930 N SER A 646 -0.932 18.017 0.933 1.00 72.42 N ATOM 931 CA SER A 646 -1.587 18.744 1.970 1.00 51.05 C ATOM 932 C SER A 646 -2.751 19.512 1.415 1.00 73.31 C ATOM 933 O SER A 646 -2.685 20.062 0.315 1.00 72.22 O ATOM 934 CB SER A 646 -0.598 19.695 2.651 1.00 50.42 C ATOM 935 OG SER A 646 -1.235 20.492 3.629 1.00 35.14 O ATOM 0 H SER A 646 -0.019 18.393 0.675 1.00 72.42 H new ATOM 0 HA SER A 646 -1.961 18.037 2.711 1.00 51.05 H new ATOM 0 HB2 SER A 646 0.202 19.118 3.115 1.00 50.42 H new ATOM 0 HB3 SER A 646 -0.135 20.337 1.902 1.00 50.42 H new ATOM 0 HG SER A 646 -0.597 20.710 4.340 1.00 35.14 H new ATOM 941 N ARG A 647 -3.806 19.536 2.155 1.00 55.45 N ATOM 942 CA ARG A 647 -4.960 20.273 1.772 1.00 32.24 C ATOM 943 C ARG A 647 -4.958 21.610 2.482 1.00 0.23 C ATOM 944 O ARG A 647 -5.404 22.606 1.941 1.00 72.02 O ATOM 945 CB ARG A 647 -6.220 19.489 2.098 1.00 52.12 C ATOM 946 CG ARG A 647 -6.288 18.134 1.407 1.00 50.24 C ATOM 947 CD ARG A 647 -7.565 17.405 1.753 1.00 73.35 C ATOM 948 NE ARG A 647 -8.750 18.138 1.316 1.00 35.50 N ATOM 949 CZ ARG A 647 -10.009 17.823 1.630 1.00 43.32 C ATOM 950 NH1 ARG A 647 -10.264 16.836 2.483 1.00 31.20 N ATOM 951 NH2 ARG A 647 -11.009 18.528 1.111 1.00 42.21 N ATOM 0 H ARG A 647 -3.893 19.044 3.044 1.00 55.45 H new ATOM 0 HA ARG A 647 -4.942 20.444 0.696 1.00 32.24 H new ATOM 0 HB2 ARG A 647 -6.278 19.341 3.176 1.00 52.12 H new ATOM 0 HB3 ARG A 647 -7.090 20.079 1.810 1.00 52.12 H new ATOM 0 HG2 ARG A 647 -6.226 18.270 0.327 1.00 50.24 H new ATOM 0 HG3 ARG A 647 -5.430 17.530 1.702 1.00 50.24 H new ATOM 0 HD2 ARG A 647 -7.557 16.419 1.288 1.00 73.35 H new ATOM 0 HD3 ARG A 647 -7.612 17.249 2.831 1.00 73.35 H new ATOM 0 HE ARG A 647 -8.604 18.956 0.724 1.00 35.50 H new ATOM 0 HH11 ARG A 647 -9.495 16.313 2.903 1.00 31.20 H new ATOM 0 HH12 ARG A 647 -11.228 16.601 2.718 1.00 31.20 H new ATOM 0 HH21 ARG A 647 -10.812 19.303 0.478 1.00 42.21 H new ATOM 0 HH22 ARG A 647 -11.974 18.294 1.346 1.00 42.21 H new ATOM 963 N SER A 648 -4.411 21.632 3.685 1.00 72.24 N ATOM 964 CA SER A 648 -4.382 22.848 4.465 1.00 62.11 C ATOM 965 C SER A 648 -3.209 23.762 4.056 1.00 41.12 C ATOM 966 O SER A 648 -3.377 24.981 3.932 1.00 0.15 O ATOM 967 CB SER A 648 -4.288 22.499 5.952 1.00 52.15 C ATOM 968 OG SER A 648 -5.349 21.625 6.336 1.00 50.42 O ATOM 0 H SER A 648 -3.984 20.824 4.138 1.00 72.24 H new ATOM 0 HA SER A 648 -5.304 23.397 4.273 1.00 62.11 H new ATOM 0 HB2 SER A 648 -3.328 22.026 6.159 1.00 52.15 H new ATOM 0 HB3 SER A 648 -4.329 23.411 6.547 1.00 52.15 H new ATOM 0 HG SER A 648 -5.269 21.413 7.289 1.00 50.42 H new ATOM 974 N ASP A 649 -2.039 23.174 3.814 1.00 50.31 N ATOM 975 CA ASP A 649 -0.850 23.971 3.485 1.00 45.44 C ATOM 976 C ASP A 649 -0.516 23.836 1.997 1.00 22.33 C ATOM 977 O ASP A 649 0.318 24.556 1.461 1.00 24.44 O ATOM 978 CB ASP A 649 0.338 23.526 4.358 1.00 73.34 C ATOM 979 CG ASP A 649 1.522 24.476 4.300 1.00 50.34 C ATOM 980 OD1 ASP A 649 1.490 25.514 5.007 1.00 51.43 O ATOM 981 OD2 ASP A 649 2.492 24.209 3.583 1.00 22.34 O ATOM 0 H ASP A 649 -1.885 22.166 3.838 1.00 50.31 H new ATOM 0 HA ASP A 649 -1.056 25.021 3.692 1.00 45.44 H new ATOM 0 HB2 ASP A 649 0.005 23.436 5.392 1.00 73.34 H new ATOM 0 HB3 ASP A 649 0.662 22.535 4.040 1.00 73.34 H new ATOM 986 N ARG A 650 -1.212 22.904 1.348 1.00 54.54 N ATOM 987 CA ARG A 650 -1.101 22.616 -0.094 1.00 41.11 C ATOM 988 C ARG A 650 0.296 22.214 -0.592 1.00 13.24 C ATOM 989 O ARG A 650 0.582 22.328 -1.786 1.00 31.00 O ATOM 990 CB ARG A 650 -1.667 23.762 -0.903 1.00 12.53 C ATOM 991 CG ARG A 650 -3.157 23.925 -0.724 1.00 61.35 C ATOM 992 CD ARG A 650 -3.658 25.131 -1.450 1.00 31.14 C ATOM 993 NE ARG A 650 -3.370 25.094 -2.894 1.00 64.22 N ATOM 994 CZ ARG A 650 -3.415 26.169 -3.695 1.00 31.34 C ATOM 995 NH1 ARG A 650 -3.804 27.347 -3.203 1.00 13.25 N ATOM 996 NH2 ARG A 650 -3.082 26.068 -4.977 1.00 32.31 N ATOM 0 H ARG A 650 -1.891 22.306 1.819 1.00 54.54 H new ATOM 0 HA ARG A 650 -1.698 21.718 -0.249 1.00 41.11 H new ATOM 0 HB2 ARG A 650 -1.168 24.687 -0.613 1.00 12.53 H new ATOM 0 HB3 ARG A 650 -1.448 23.599 -1.958 1.00 12.53 H new ATOM 0 HG2 ARG A 650 -3.670 23.036 -1.092 1.00 61.35 H new ATOM 0 HG3 ARG A 650 -3.391 24.012 0.337 1.00 61.35 H new ATOM 0 HD2 ARG A 650 -4.735 25.216 -1.302 1.00 31.14 H new ATOM 0 HD3 ARG A 650 -3.205 26.023 -1.017 1.00 31.14 H new ATOM 0 HE ARG A 650 -3.121 24.197 -3.310 1.00 64.22 H new ATOM 0 HH11 ARG A 650 -4.066 27.428 -2.221 1.00 13.25 H new ATOM 0 HH12 ARG A 650 -3.839 28.166 -3.809 1.00 13.25 H new ATOM 0 HH21 ARG A 650 -2.790 25.168 -5.359 1.00 32.31 H new ATOM 0 HH22 ARG A 650 -3.119 26.890 -5.580 1.00 32.31 H new ATOM 1008 N LYS A 651 1.130 21.684 0.275 1.00 51.43 N ATOM 1009 CA LYS A 651 2.405 21.138 -0.177 1.00 63.51 C ATOM 1010 C LYS A 651 2.252 19.684 -0.522 1.00 13.12 C ATOM 1011 O LYS A 651 1.248 19.064 -0.190 1.00 13.44 O ATOM 1012 CB LYS A 651 3.506 21.281 0.854 1.00 72.52 C ATOM 1013 CG LYS A 651 3.991 22.681 1.090 1.00 32.03 C ATOM 1014 CD LYS A 651 5.097 22.666 2.123 1.00 4.32 C ATOM 1015 CE LYS A 651 5.678 24.038 2.374 1.00 62.05 C ATOM 1016 NZ LYS A 651 6.734 23.987 3.411 1.00 61.53 N ATOM 0 H LYS A 651 0.961 21.616 1.279 1.00 51.43 H new ATOM 0 HA LYS A 651 2.693 21.715 -1.056 1.00 63.51 H new ATOM 0 HB2 LYS A 651 3.149 20.874 1.800 1.00 72.52 H new ATOM 0 HB3 LYS A 651 4.353 20.669 0.543 1.00 72.52 H new ATOM 0 HG2 LYS A 651 4.356 23.113 0.158 1.00 32.03 H new ATOM 0 HG3 LYS A 651 3.168 23.309 1.432 1.00 32.03 H new ATOM 0 HD2 LYS A 651 4.709 22.263 3.059 1.00 4.32 H new ATOM 0 HD3 LYS A 651 5.890 21.995 1.791 1.00 4.32 H new ATOM 0 HE2 LYS A 651 6.092 24.436 1.448 1.00 62.05 H new ATOM 0 HE3 LYS A 651 4.887 24.719 2.688 1.00 62.05 H new ATOM 0 HZ1 LYS A 651 7.116 24.942 3.564 1.00 61.53 H new ATOM 0 HZ2 LYS A 651 6.330 23.629 4.300 1.00 61.53 H new ATOM 0 HZ3 LYS A 651 7.498 23.354 3.098 1.00 61.53 H new ATOM 1030 N SER A 652 3.233 19.150 -1.160 1.00 31.44 N ATOM 1031 CA SER A 652 3.237 17.767 -1.536 1.00 71.22 C ATOM 1032 C SER A 652 4.562 17.116 -1.127 1.00 73.10 C ATOM 1033 O SER A 652 5.601 17.789 -1.081 1.00 10.13 O ATOM 1034 CB SER A 652 2.957 17.639 -3.043 1.00 31.00 C ATOM 1035 OG SER A 652 3.793 18.515 -3.807 1.00 34.33 O ATOM 0 H SER A 652 4.069 19.662 -1.442 1.00 31.44 H new ATOM 0 HA SER A 652 2.444 17.234 -1.011 1.00 71.22 H new ATOM 0 HB2 SER A 652 3.122 16.609 -3.359 1.00 31.00 H new ATOM 0 HB3 SER A 652 1.910 17.869 -3.241 1.00 31.00 H new ATOM 0 HG SER A 652 3.593 18.409 -4.760 1.00 34.33 H new ATOM 1041 N TRP A 653 4.516 15.846 -0.774 1.00 54.40 N ATOM 1042 CA TRP A 653 5.708 15.105 -0.358 1.00 24.10 C ATOM 1043 C TRP A 653 5.591 13.664 -0.784 1.00 51.03 C ATOM 1044 O TRP A 653 4.490 13.110 -0.824 1.00 15.14 O ATOM 1045 CB TRP A 653 5.835 15.037 1.173 1.00 22.11 C ATOM 1046 CG TRP A 653 5.994 16.304 1.959 1.00 34.33 C ATOM 1047 CD1 TRP A 653 7.163 16.860 2.387 1.00 55.10 C ATOM 1048 CD2 TRP A 653 4.951 17.134 2.460 1.00 24.31 C ATOM 1049 NE1 TRP A 653 6.908 17.953 3.159 1.00 73.32 N ATOM 1050 CE2 TRP A 653 5.554 18.163 3.199 1.00 3.31 C ATOM 1051 CE3 TRP A 653 3.568 17.105 2.351 1.00 40.44 C ATOM 1052 CZ2 TRP A 653 4.811 19.155 3.835 1.00 51.31 C ATOM 1053 CZ3 TRP A 653 2.832 18.075 2.968 1.00 33.21 C ATOM 1054 CH2 TRP A 653 3.447 19.094 3.706 1.00 54.23 C ATOM 0 H TRP A 653 3.659 15.294 -0.765 1.00 54.40 H new ATOM 0 HA TRP A 653 6.556 15.623 -0.807 1.00 24.10 H new ATOM 0 HB2 TRP A 653 4.949 14.527 1.552 1.00 22.11 H new ATOM 0 HB3 TRP A 653 6.691 14.402 1.402 1.00 22.11 H new ATOM 0 HD1 TRP A 653 8.148 16.488 2.149 1.00 55.10 H new ATOM 0 HE1 TRP A 653 7.610 18.523 3.631 1.00 73.32 H new ATOM 0 HE3 TRP A 653 3.080 16.325 1.785 1.00 40.44 H new ATOM 0 HZ2 TRP A 653 5.288 19.938 4.405 1.00 51.31 H new ATOM 0 HZ3 TRP A 653 1.755 18.056 2.885 1.00 33.21 H new ATOM 0 HH2 TRP A 653 2.836 19.846 4.183 1.00 54.23 H new ATOM 1065 N ASN A 654 6.711 13.051 -1.056 1.00 70.32 N ATOM 1066 CA ASN A 654 6.748 11.628 -1.278 1.00 44.31 C ATOM 1067 C ASN A 654 6.963 10.949 0.027 1.00 75.41 C ATOM 1068 O ASN A 654 7.778 11.405 0.852 1.00 45.22 O ATOM 1069 CB ASN A 654 7.864 11.178 -2.224 1.00 13.14 C ATOM 1070 CG ASN A 654 7.637 11.503 -3.666 1.00 10.01 C ATOM 1071 OD1 ASN A 654 6.510 11.598 -4.131 1.00 55.14 O ATOM 1072 ND2 ASN A 654 8.705 11.652 -4.389 1.00 74.53 N ATOM 0 H ASN A 654 7.616 13.516 -1.130 1.00 70.32 H new ATOM 0 HA ASN A 654 5.798 11.362 -1.742 1.00 44.31 H new ATOM 0 HB2 ASN A 654 8.799 11.640 -1.905 1.00 13.14 H new ATOM 0 HB3 ASN A 654 7.991 10.100 -2.125 1.00 13.14 H new ATOM 0 HD21 ASN A 654 8.622 11.857 -5.385 1.00 74.53 H new ATOM 0 HD22 ASN A 654 9.627 11.565 -3.961 1.00 74.53 H new ATOM 1078 N LEU A 655 6.250 9.894 0.257 1.00 0.22 N ATOM 1079 CA LEU A 655 6.458 9.138 1.455 1.00 71.22 C ATOM 1080 C LEU A 655 7.281 7.903 1.130 1.00 1.22 C ATOM 1081 O LEU A 655 7.431 7.006 1.947 1.00 13.05 O ATOM 1082 CB LEU A 655 5.161 8.740 2.171 1.00 34.43 C ATOM 1083 CG LEU A 655 4.171 9.828 2.556 1.00 22.33 C ATOM 1084 CD1 LEU A 655 3.274 10.168 1.436 1.00 74.43 C ATOM 1085 CD2 LEU A 655 3.387 9.461 3.780 1.00 64.13 C ATOM 0 H LEU A 655 5.523 9.536 -0.362 1.00 0.22 H new ATOM 0 HA LEU A 655 6.992 9.786 2.150 1.00 71.22 H new ATOM 0 HB2 LEU A 655 4.637 8.029 1.533 1.00 34.43 H new ATOM 0 HB3 LEU A 655 5.437 8.208 3.082 1.00 34.43 H new ATOM 0 HG LEU A 655 4.756 10.716 2.795 1.00 22.33 H new ATOM 0 HD11 LEU A 655 2.581 10.949 1.749 1.00 74.43 H new ATOM 0 HD12 LEU A 655 3.865 10.524 0.592 1.00 74.43 H new ATOM 0 HD13 LEU A 655 2.712 9.283 1.138 1.00 74.43 H new ATOM 0 HD21 LEU A 655 2.691 10.265 4.021 1.00 64.13 H new ATOM 0 HD22 LEU A 655 2.830 8.543 3.594 1.00 64.13 H new ATOM 0 HD23 LEU A 655 4.069 9.308 4.617 1.00 64.13 H new ATOM 1093 N GLY A 656 7.791 7.866 -0.076 1.00 5.21 N ATOM 1094 CA GLY A 656 8.678 6.821 -0.467 1.00 34.23 C ATOM 1095 C GLY A 656 8.573 6.496 -1.928 1.00 32.35 C ATOM 1096 O GLY A 656 7.488 6.596 -2.538 1.00 1.54 O ATOM 0 H GLY A 656 7.600 8.557 -0.802 1.00 5.21 H new ATOM 0 HA2 GLY A 656 9.702 7.113 -0.235 1.00 34.23 H new ATOM 0 HA3 GLY A 656 8.461 5.927 0.117 1.00 34.23 H new ATOM 1100 N ARG A 657 9.690 6.143 -2.502 1.00 52.51 N ATOM 1101 CA ARG A 657 9.769 5.751 -3.885 1.00 63.23 C ATOM 1102 C ARG A 657 9.186 4.343 -4.018 1.00 71.33 C ATOM 1103 O ARG A 657 9.197 3.586 -3.041 1.00 51.31 O ATOM 1104 CB ARG A 657 11.216 5.745 -4.366 1.00 30.22 C ATOM 1105 CG ARG A 657 12.098 4.742 -3.652 1.00 54.01 C ATOM 1106 CD ARG A 657 13.489 4.767 -4.202 1.00 34.43 C ATOM 1107 NE ARG A 657 14.361 3.797 -3.532 1.00 34.25 N ATOM 1108 CZ ARG A 657 15.685 3.731 -3.679 1.00 12.25 C ATOM 1109 NH1 ARG A 657 16.309 4.573 -4.497 1.00 33.15 N ATOM 1110 NH2 ARG A 657 16.381 2.820 -3.014 1.00 15.24 N ATOM 0 H ARG A 657 10.586 6.119 -2.015 1.00 52.51 H new ATOM 0 HA ARG A 657 9.210 6.462 -4.494 1.00 63.23 H new ATOM 0 HB2 ARG A 657 11.232 5.532 -5.435 1.00 30.22 H new ATOM 0 HB3 ARG A 657 11.636 6.742 -4.234 1.00 30.22 H new ATOM 0 HG2 ARG A 657 12.120 4.966 -2.585 1.00 54.01 H new ATOM 0 HG3 ARG A 657 11.678 3.742 -3.759 1.00 54.01 H new ATOM 0 HD2 ARG A 657 13.461 4.552 -5.270 1.00 34.43 H new ATOM 0 HD3 ARG A 657 13.906 5.768 -4.089 1.00 34.43 H new ATOM 0 HE ARG A 657 13.922 3.122 -2.906 1.00 34.25 H new ATOM 0 HH11 ARG A 657 15.775 5.272 -5.014 1.00 33.15 H new ATOM 0 HH12 ARG A 657 17.322 4.520 -4.608 1.00 33.15 H new ATOM 0 HH21 ARG A 657 15.904 2.169 -2.390 1.00 15.24 H new ATOM 0 HH22 ARG A 657 17.394 2.770 -3.126 1.00 15.24 H new ATOM 1122 N SER A 658 8.632 4.019 -5.170 1.00 12.14 N ATOM 1123 CA SER A 658 8.067 2.701 -5.407 1.00 52.13 C ATOM 1124 C SER A 658 9.091 1.588 -5.105 1.00 54.42 C ATOM 1125 O SER A 658 10.119 1.456 -5.774 1.00 31.51 O ATOM 1126 CB SER A 658 7.608 2.612 -6.835 1.00 51.12 C ATOM 1127 OG SER A 658 6.707 3.652 -7.122 1.00 24.45 O ATOM 0 H SER A 658 8.560 4.655 -5.964 1.00 12.14 H new ATOM 0 HA SER A 658 7.220 2.558 -4.736 1.00 52.13 H new ATOM 0 HB2 SER A 658 8.466 2.670 -7.505 1.00 51.12 H new ATOM 0 HB3 SER A 658 7.130 1.648 -7.011 1.00 51.12 H new ATOM 0 HG SER A 658 6.540 3.683 -8.087 1.00 24.45 H new ATOM 1133 N ASN A 659 8.795 0.846 -4.083 1.00 32.21 N ATOM 1134 CA ASN A 659 9.601 -0.236 -3.590 1.00 33.03 C ATOM 1135 C ASN A 659 8.716 -1.373 -3.171 1.00 21.21 C ATOM 1136 O ASN A 659 7.912 -1.260 -2.262 1.00 25.52 O ATOM 1137 CB ASN A 659 10.466 0.249 -2.450 1.00 31.00 C ATOM 1138 CG ASN A 659 11.128 -0.840 -1.636 1.00 3.44 C ATOM 1139 OD1 ASN A 659 12.191 -1.334 -1.973 1.00 2.52 O ATOM 1140 ND2 ASN A 659 10.522 -1.177 -0.524 1.00 34.34 N ATOM 0 H ASN A 659 7.942 0.983 -3.540 1.00 32.21 H new ATOM 0 HA ASN A 659 10.261 -0.597 -4.378 1.00 33.03 H new ATOM 0 HB2 ASN A 659 11.241 0.900 -2.855 1.00 31.00 H new ATOM 0 HB3 ASN A 659 9.854 0.857 -1.784 1.00 31.00 H new ATOM 0 HD21 ASN A 659 10.939 -1.874 0.093 1.00 34.34 H new ATOM 0 HD22 ASN A 659 9.634 -0.742 -0.275 1.00 34.34 H new ATOM 1146 N ALA A 660 8.899 -2.449 -3.813 1.00 44.04 N ATOM 1147 CA ALA A 660 8.035 -3.614 -3.670 1.00 5.12 C ATOM 1148 C ALA A 660 8.587 -4.628 -2.656 1.00 34.31 C ATOM 1149 O ALA A 660 8.310 -5.827 -2.752 1.00 41.53 O ATOM 1150 CB ALA A 660 7.821 -4.259 -5.038 1.00 64.31 C ATOM 0 H ALA A 660 9.662 -2.582 -4.477 1.00 44.04 H new ATOM 0 HA ALA A 660 7.075 -3.280 -3.276 1.00 5.12 H new ATOM 0 HB1 ALA A 660 7.175 -5.131 -4.932 1.00 64.31 H new ATOM 0 HB2 ALA A 660 7.353 -3.540 -5.710 1.00 64.31 H new ATOM 0 HB3 ALA A 660 8.782 -4.568 -5.449 1.00 64.31 H new ATOM 1156 N LYS A 661 9.347 -4.151 -1.691 1.00 54.55 N ATOM 1157 CA LYS A 661 9.845 -4.970 -0.622 1.00 61.22 C ATOM 1158 C LYS A 661 8.698 -5.179 0.389 1.00 62.32 C ATOM 1159 O LYS A 661 8.132 -4.206 0.902 1.00 14.53 O ATOM 1160 CB LYS A 661 10.982 -4.229 0.093 1.00 72.11 C ATOM 1161 CG LYS A 661 11.854 -5.107 0.957 1.00 30.11 C ATOM 1162 CD LYS A 661 12.773 -5.944 0.091 1.00 5.30 C ATOM 1163 CE LYS A 661 13.881 -5.093 -0.537 1.00 65.12 C ATOM 1164 NZ LYS A 661 14.835 -5.898 -1.336 1.00 3.43 N ATOM 0 H LYS A 661 9.635 -3.174 -1.633 1.00 54.55 H new ATOM 0 HA LYS A 661 10.207 -5.921 -1.012 1.00 61.22 H new ATOM 0 HB2 LYS A 661 11.607 -3.741 -0.654 1.00 72.11 H new ATOM 0 HB3 LYS A 661 10.553 -3.442 0.713 1.00 72.11 H new ATOM 0 HG2 LYS A 661 12.443 -4.491 1.636 1.00 30.11 H new ATOM 0 HG3 LYS A 661 11.232 -5.756 1.573 1.00 30.11 H new ATOM 0 HD2 LYS A 661 13.218 -6.737 0.692 1.00 5.30 H new ATOM 0 HD3 LYS A 661 12.193 -6.427 -0.696 1.00 5.30 H new ATOM 0 HE2 LYS A 661 13.432 -4.331 -1.174 1.00 65.12 H new ATOM 0 HE3 LYS A 661 14.423 -4.570 0.251 1.00 65.12 H new ATOM 0 HZ1 LYS A 661 15.601 -5.286 -1.682 1.00 3.43 H new ATOM 0 HZ2 LYS A 661 15.236 -6.652 -0.742 1.00 3.43 H new ATOM 0 HZ3 LYS A 661 14.338 -6.322 -2.145 1.00 3.43 H new ATOM 1178 N LEU A 662 8.350 -6.412 0.648 1.00 1.22 N ATOM 1179 CA LEU A 662 7.304 -6.729 1.614 1.00 65.43 C ATOM 1180 C LEU A 662 7.907 -7.271 2.878 1.00 5.14 C ATOM 1181 O LEU A 662 8.775 -8.118 2.832 1.00 12.53 O ATOM 1182 CB LEU A 662 6.262 -7.734 1.055 1.00 24.54 C ATOM 1183 CG LEU A 662 5.153 -7.203 0.125 1.00 74.51 C ATOM 1184 CD1 LEU A 662 4.247 -6.249 0.870 1.00 45.54 C ATOM 1185 CD2 LEU A 662 5.712 -6.536 -1.108 1.00 64.30 C ATOM 0 H LEU A 662 8.774 -7.227 0.205 1.00 1.22 H new ATOM 0 HA LEU A 662 6.778 -5.798 1.827 1.00 65.43 H new ATOM 0 HB2 LEU A 662 6.806 -8.509 0.514 1.00 24.54 H new ATOM 0 HB3 LEU A 662 5.779 -8.218 1.904 1.00 24.54 H new ATOM 0 HG LEU A 662 4.573 -8.065 -0.205 1.00 74.51 H new ATOM 0 HD11 LEU A 662 3.471 -5.885 0.197 1.00 45.54 H new ATOM 0 HD12 LEU A 662 3.785 -6.767 1.710 1.00 45.54 H new ATOM 0 HD13 LEU A 662 4.831 -5.406 1.240 1.00 45.54 H new ATOM 0 HD21 LEU A 662 4.893 -6.179 -1.732 1.00 64.30 H new ATOM 0 HD22 LEU A 662 6.338 -5.694 -0.814 1.00 64.30 H new ATOM 0 HD23 LEU A 662 6.310 -7.253 -1.670 1.00 64.30 H new ATOM 1193 N SER A 663 7.463 -6.788 3.986 1.00 45.12 N ATOM 1194 CA SER A 663 7.954 -7.236 5.250 1.00 44.20 C ATOM 1195 C SER A 663 6.892 -8.062 5.957 1.00 10.33 C ATOM 1196 O SER A 663 5.726 -7.737 5.918 1.00 70.10 O ATOM 1197 CB SER A 663 8.331 -6.036 6.108 1.00 2.51 C ATOM 1198 OG SER A 663 9.331 -5.254 5.480 1.00 71.41 O ATOM 0 H SER A 663 6.745 -6.066 4.045 1.00 45.12 H new ATOM 0 HA SER A 663 8.836 -7.856 5.091 1.00 44.20 H new ATOM 0 HB2 SER A 663 7.448 -5.424 6.291 1.00 2.51 H new ATOM 0 HB3 SER A 663 8.689 -6.378 7.079 1.00 2.51 H new ATOM 0 HG SER A 663 9.136 -4.303 5.615 1.00 71.41 H new ATOM 1204 N TYR A 664 7.293 -9.131 6.555 1.00 22.32 N ATOM 1205 CA TYR A 664 6.399 -9.939 7.321 1.00 41.14 C ATOM 1206 C TYR A 664 6.777 -9.724 8.752 1.00 14.23 C ATOM 1207 O TYR A 664 7.878 -10.067 9.155 1.00 54.43 O ATOM 1208 CB TYR A 664 6.609 -11.405 6.933 1.00 75.31 C ATOM 1209 CG TYR A 664 5.575 -12.398 7.426 1.00 13.05 C ATOM 1210 CD1 TYR A 664 4.235 -12.206 7.162 1.00 72.10 C ATOM 1211 CD2 TYR A 664 5.950 -13.552 8.097 1.00 34.53 C ATOM 1212 CE1 TYR A 664 3.289 -13.108 7.543 1.00 43.43 C ATOM 1213 CE2 TYR A 664 5.009 -14.490 8.479 1.00 23.44 C ATOM 1214 CZ TYR A 664 3.679 -14.269 8.202 1.00 24.23 C ATOM 1215 OH TYR A 664 2.731 -15.203 8.589 1.00 25.33 O ATOM 0 H TYR A 664 8.254 -9.473 6.528 1.00 22.32 H new ATOM 0 HA TYR A 664 5.353 -9.684 7.149 1.00 41.14 H new ATOM 0 HB2 TYR A 664 6.647 -11.466 5.845 1.00 75.31 H new ATOM 0 HB3 TYR A 664 7.585 -11.718 7.304 1.00 75.31 H new ATOM 0 HD1 TYR A 664 3.927 -11.314 6.637 1.00 72.10 H new ATOM 0 HD2 TYR A 664 6.992 -13.721 8.325 1.00 34.53 H new ATOM 0 HE1 TYR A 664 2.245 -12.924 7.335 1.00 43.43 H new ATOM 0 HE2 TYR A 664 5.315 -15.390 8.991 1.00 23.44 H new ATOM 0 HH TYR A 664 3.082 -15.737 9.332 1.00 25.33 H new ATOM 1225 N TYR A 665 5.906 -9.147 9.508 1.00 13.10 N ATOM 1226 CA TYR A 665 6.204 -8.862 10.876 1.00 23.55 C ATOM 1227 C TYR A 665 5.429 -9.824 11.727 1.00 33.53 C ATOM 1228 O TYR A 665 4.338 -9.511 12.218 1.00 5.44 O ATOM 1229 CB TYR A 665 5.886 -7.393 11.215 1.00 63.22 C ATOM 1230 CG TYR A 665 6.356 -6.918 12.578 1.00 23.22 C ATOM 1231 CD1 TYR A 665 5.582 -7.100 13.713 1.00 22.32 C ATOM 1232 CD2 TYR A 665 7.576 -6.273 12.722 1.00 50.35 C ATOM 1233 CE1 TYR A 665 6.007 -6.659 14.946 1.00 25.44 C ATOM 1234 CE2 TYR A 665 8.008 -5.830 13.954 1.00 22.50 C ATOM 1235 CZ TYR A 665 7.217 -6.028 15.063 1.00 11.34 C ATOM 1236 OH TYR A 665 7.643 -5.594 16.298 1.00 11.33 O ATOM 0 H TYR A 665 4.976 -8.861 9.203 1.00 13.10 H new ATOM 0 HA TYR A 665 7.269 -8.991 11.070 1.00 23.55 H new ATOM 0 HB2 TYR A 665 6.337 -6.757 10.453 1.00 63.22 H new ATOM 0 HB3 TYR A 665 4.807 -7.250 11.152 1.00 63.22 H new ATOM 0 HD1 TYR A 665 4.627 -7.597 13.629 1.00 22.32 H new ATOM 0 HD2 TYR A 665 8.198 -6.115 11.854 1.00 50.35 H new ATOM 0 HE1 TYR A 665 5.388 -6.810 15.818 1.00 25.44 H new ATOM 0 HE2 TYR A 665 8.961 -5.331 14.048 1.00 22.50 H new ATOM 0 HH TYR A 665 8.521 -5.168 16.210 1.00 11.33 H new ATOM 1246 N ASP A 666 5.969 -11.033 11.796 1.00 3.20 N ATOM 1247 CA ASP A 666 5.388 -12.173 12.510 1.00 34.03 C ATOM 1248 C ASP A 666 3.875 -12.298 12.265 1.00 62.32 C ATOM 1249 O ASP A 666 3.054 -11.871 13.075 1.00 32.30 O ATOM 1250 CB ASP A 666 5.742 -12.166 14.010 1.00 22.22 C ATOM 1251 CG ASP A 666 5.284 -13.416 14.739 1.00 4.33 C ATOM 1252 OD1 ASP A 666 5.956 -14.452 14.614 1.00 14.03 O ATOM 1253 OD2 ASP A 666 4.262 -13.365 15.458 1.00 25.43 O ATOM 0 H ASP A 666 6.854 -11.260 11.342 1.00 3.20 H new ATOM 0 HA ASP A 666 5.845 -13.070 12.092 1.00 34.03 H new ATOM 0 HB2 ASP A 666 6.821 -12.063 14.121 1.00 22.22 H new ATOM 0 HB3 ASP A 666 5.289 -11.293 14.479 1.00 22.22 H new ATOM 1258 N GLY A 667 3.528 -12.772 11.093 1.00 42.34 N ATOM 1259 CA GLY A 667 2.132 -12.979 10.749 1.00 11.14 C ATOM 1260 C GLY A 667 1.491 -11.827 10.005 1.00 30.21 C ATOM 1261 O GLY A 667 0.703 -12.042 9.081 1.00 73.32 O ATOM 0 H GLY A 667 4.189 -13.023 10.358 1.00 42.34 H new ATOM 0 HA2 GLY A 667 2.051 -13.879 10.139 1.00 11.14 H new ATOM 0 HA3 GLY A 667 1.569 -13.162 11.664 1.00 11.14 H new ATOM 1265 N MET A 668 1.803 -10.620 10.387 1.00 43.42 N ATOM 1266 CA MET A 668 1.238 -9.480 9.703 1.00 72.33 C ATOM 1267 C MET A 668 2.122 -9.097 8.557 1.00 21.10 C ATOM 1268 O MET A 668 3.320 -8.874 8.747 1.00 53.21 O ATOM 1269 CB MET A 668 1.078 -8.278 10.631 1.00 60.44 C ATOM 1270 CG MET A 668 0.174 -8.508 11.828 1.00 45.53 C ATOM 1271 SD MET A 668 -0.042 -7.016 12.822 1.00 11.44 S ATOM 1272 CE MET A 668 1.655 -6.634 13.254 1.00 4.53 C ATOM 0 H MET A 668 2.435 -10.397 11.156 1.00 43.42 H new ATOM 0 HA MET A 668 0.249 -9.766 9.347 1.00 72.33 H new ATOM 0 HB2 MET A 668 2.063 -7.982 10.990 1.00 60.44 H new ATOM 0 HB3 MET A 668 0.685 -7.442 10.053 1.00 60.44 H new ATOM 0 HG2 MET A 668 -0.800 -8.856 11.483 1.00 45.53 H new ATOM 0 HG3 MET A 668 0.593 -9.299 12.450 1.00 45.53 H new ATOM 0 HE1 MET A 668 1.708 -6.348 14.305 1.00 4.53 H new ATOM 0 HE2 MET A 668 2.280 -7.511 13.085 1.00 4.53 H new ATOM 0 HE3 MET A 668 2.011 -5.810 12.636 1.00 4.53 H new ATOM 1282 N ILE A 669 1.571 -9.043 7.374 1.00 33.53 N ATOM 1283 CA ILE A 669 2.341 -8.598 6.256 1.00 75.33 C ATOM 1284 C ILE A 669 2.297 -7.078 6.237 1.00 14.30 C ATOM 1285 O ILE A 669 1.240 -6.476 6.450 1.00 14.43 O ATOM 1286 CB ILE A 669 1.867 -9.138 4.873 1.00 44.31 C ATOM 1287 CG1 ILE A 669 1.999 -10.658 4.711 1.00 42.22 C ATOM 1288 CG2 ILE A 669 2.610 -8.451 3.748 1.00 45.20 C ATOM 1289 CD1 ILE A 669 0.977 -11.488 5.456 1.00 74.41 C ATOM 0 H ILE A 669 0.606 -9.299 7.166 1.00 33.53 H new ATOM 0 HA ILE A 669 3.348 -8.992 6.391 1.00 75.33 H new ATOM 0 HB ILE A 669 0.802 -8.908 4.827 1.00 44.31 H new ATOM 0 HG12 ILE A 669 1.932 -10.899 3.650 1.00 42.22 H new ATOM 0 HG13 ILE A 669 2.994 -10.955 5.043 1.00 42.22 H new ATOM 0 HG21 ILE A 669 2.264 -8.842 2.791 1.00 45.20 H new ATOM 0 HG22 ILE A 669 2.423 -7.378 3.790 1.00 45.20 H new ATOM 0 HG23 ILE A 669 3.679 -8.637 3.851 1.00 45.20 H new ATOM 0 HD11 ILE A 669 1.163 -12.546 5.271 1.00 74.41 H new ATOM 0 HD12 ILE A 669 1.054 -11.287 6.525 1.00 74.41 H new ATOM 0 HD13 ILE A 669 -0.024 -11.230 5.110 1.00 74.41 H new ATOM 1296 N GLN A 670 3.422 -6.474 6.019 1.00 51.33 N ATOM 1297 CA GLN A 670 3.548 -5.059 6.016 1.00 74.51 C ATOM 1298 C GLN A 670 4.310 -4.574 4.780 1.00 33.42 C ATOM 1299 O GLN A 670 5.344 -5.125 4.417 1.00 32.33 O ATOM 1300 CB GLN A 670 4.206 -4.602 7.326 1.00 32.02 C ATOM 1301 CG GLN A 670 3.342 -4.941 8.547 1.00 14.43 C ATOM 1302 CD GLN A 670 3.936 -4.555 9.868 1.00 42.41 C ATOM 1303 OE1 GLN A 670 3.673 -5.184 10.882 1.00 75.50 O ATOM 1304 NE2 GLN A 670 4.724 -3.533 9.879 1.00 41.32 N ATOM 0 H GLN A 670 4.296 -6.966 5.834 1.00 51.33 H new ATOM 0 HA GLN A 670 2.557 -4.608 5.959 1.00 74.51 H new ATOM 0 HB2 GLN A 670 5.181 -5.078 7.428 1.00 32.02 H new ATOM 0 HB3 GLN A 670 4.378 -3.526 7.290 1.00 32.02 H new ATOM 0 HG2 GLN A 670 2.377 -4.445 8.440 1.00 14.43 H new ATOM 0 HG3 GLN A 670 3.150 -6.014 8.551 1.00 14.43 H new ATOM 0 HE21 GLN A 670 4.921 -3.032 9.013 1.00 41.32 H new ATOM 0 HE22 GLN A 670 5.150 -3.227 10.754 1.00 41.32 H new ATOM 1312 N LEU A 671 3.777 -3.562 4.146 1.00 50.25 N ATOM 1313 CA LEU A 671 4.358 -2.974 2.935 1.00 71.51 C ATOM 1314 C LEU A 671 5.202 -1.833 3.394 1.00 24.52 C ATOM 1315 O LEU A 671 4.843 -1.170 4.365 1.00 14.52 O ATOM 1316 CB LEU A 671 3.234 -2.444 2.012 1.00 54.03 C ATOM 1317 CG LEU A 671 3.636 -1.797 0.659 1.00 52.14 C ATOM 1318 CD1 LEU A 671 4.254 -2.803 -0.304 1.00 30.14 C ATOM 1319 CD2 LEU A 671 2.441 -1.128 0.012 1.00 14.33 C ATOM 0 H LEU A 671 2.916 -3.107 4.449 1.00 50.25 H new ATOM 0 HA LEU A 671 4.937 -3.709 2.376 1.00 71.51 H new ATOM 0 HB2 LEU A 671 2.562 -3.274 1.797 1.00 54.03 H new ATOM 0 HB3 LEU A 671 2.661 -1.708 2.575 1.00 54.03 H new ATOM 0 HG LEU A 671 4.395 -1.047 0.881 1.00 52.14 H new ATOM 0 HD11 LEU A 671 4.518 -2.301 -1.235 1.00 30.14 H new ATOM 0 HD12 LEU A 671 5.151 -3.232 0.144 1.00 30.14 H new ATOM 0 HD13 LEU A 671 3.536 -3.597 -0.511 1.00 30.14 H new ATOM 0 HD21 LEU A 671 2.743 -0.681 -0.935 1.00 14.33 H new ATOM 0 HD22 LEU A 671 1.663 -1.869 -0.169 1.00 14.33 H new ATOM 0 HD23 LEU A 671 2.056 -0.352 0.674 1.00 14.33 H new ATOM 1327 N THR A 672 6.310 -1.598 2.769 1.00 54.14 N ATOM 1328 CA THR A 672 7.157 -0.542 3.213 1.00 55.42 C ATOM 1329 C THR A 672 7.794 0.193 2.050 1.00 11.21 C ATOM 1330 O THR A 672 8.504 -0.391 1.236 1.00 12.33 O ATOM 1331 CB THR A 672 8.256 -1.070 4.172 1.00 23.53 C ATOM 1332 OG1 THR A 672 7.633 -1.786 5.255 1.00 53.44 O ATOM 1333 CG2 THR A 672 9.063 0.091 4.751 1.00 44.54 C ATOM 0 H THR A 672 6.646 -2.117 1.958 1.00 54.14 H new ATOM 0 HA THR A 672 6.527 0.162 3.756 1.00 55.42 H new ATOM 0 HB THR A 672 8.923 -1.727 3.614 1.00 23.53 H new ATOM 0 HG1 THR A 672 8.323 -2.123 5.864 1.00 53.44 H new ATOM 0 HG21 THR A 672 9.830 -0.297 5.422 1.00 44.54 H new ATOM 0 HG22 THR A 672 9.537 0.645 3.940 1.00 44.54 H new ATOM 0 HG23 THR A 672 8.399 0.755 5.305 1.00 44.54 H new ATOM 1339 N TYR A 673 7.510 1.452 1.968 1.00 62.13 N ATOM 1340 CA TYR A 673 8.149 2.305 1.012 1.00 33.30 C ATOM 1341 C TYR A 673 9.191 3.113 1.703 1.00 11.34 C ATOM 1342 O TYR A 673 8.946 3.648 2.786 1.00 51.21 O ATOM 1343 CB TYR A 673 7.179 3.215 0.276 1.00 75.41 C ATOM 1344 CG TYR A 673 6.288 2.514 -0.710 1.00 33.12 C ATOM 1345 CD1 TYR A 673 6.824 1.650 -1.639 1.00 21.03 C ATOM 1346 CD2 TYR A 673 4.931 2.756 -0.756 1.00 32.44 C ATOM 1347 CE1 TYR A 673 6.039 1.047 -2.587 1.00 20.31 C ATOM 1348 CE2 TYR A 673 4.140 2.141 -1.702 1.00 34.31 C ATOM 1349 CZ TYR A 673 4.717 1.286 -2.618 1.00 53.22 C ATOM 1350 OH TYR A 673 3.963 0.699 -3.591 1.00 21.44 O ATOM 0 H TYR A 673 6.827 1.922 2.562 1.00 62.13 H new ATOM 0 HA TYR A 673 8.600 1.666 0.253 1.00 33.30 H new ATOM 0 HB2 TYR A 673 6.555 3.728 1.009 1.00 75.41 H new ATOM 0 HB3 TYR A 673 7.748 3.981 -0.250 1.00 75.41 H new ATOM 0 HD1 TYR A 673 7.884 1.444 -1.620 1.00 21.03 H new ATOM 0 HD2 TYR A 673 4.484 3.434 -0.044 1.00 32.44 H new ATOM 0 HE1 TYR A 673 6.483 0.379 -3.310 1.00 20.31 H new ATOM 0 HE2 TYR A 673 3.076 2.327 -1.726 1.00 34.31 H new ATOM 0 HH TYR A 673 3.023 0.688 -3.315 1.00 21.44 H new ATOM 1360 N ARG A 674 10.347 3.189 1.111 1.00 13.42 N ATOM 1361 CA ARG A 674 11.444 3.903 1.692 1.00 41.44 C ATOM 1362 C ARG A 674 11.972 4.925 0.719 1.00 73.31 C ATOM 1363 O ARG A 674 11.588 4.928 -0.457 1.00 23.02 O ATOM 1364 CB ARG A 674 12.556 2.939 2.141 1.00 53.34 C ATOM 1365 CG ARG A 674 12.113 1.950 3.213 1.00 74.35 C ATOM 1366 CD ARG A 674 13.227 0.994 3.604 1.00 70.32 C ATOM 1367 NE ARG A 674 14.387 1.675 4.198 1.00 73.54 N ATOM 1368 CZ ARG A 674 15.575 1.081 4.420 1.00 21.42 C ATOM 1369 NH1 ARG A 674 15.751 -0.198 4.110 1.00 24.41 N ATOM 1370 NH2 ARG A 674 16.571 1.767 4.968 1.00 11.02 N ATOM 0 H ARG A 674 10.555 2.757 0.211 1.00 13.42 H new ATOM 0 HA ARG A 674 11.085 4.425 2.579 1.00 41.44 H new ATOM 0 HB2 ARG A 674 12.916 2.385 1.274 1.00 53.34 H new ATOM 0 HB3 ARG A 674 13.397 3.520 2.520 1.00 53.34 H new ATOM 0 HG2 ARG A 674 11.779 2.497 4.095 1.00 74.35 H new ATOM 0 HG3 ARG A 674 11.258 1.380 2.849 1.00 74.35 H new ATOM 0 HD2 ARG A 674 12.839 0.264 4.314 1.00 70.32 H new ATOM 0 HD3 ARG A 674 13.550 0.441 2.722 1.00 70.32 H new ATOM 0 HE ARG A 674 14.286 2.656 4.457 1.00 73.54 H new ATOM 0 HH11 ARG A 674 14.985 -0.734 3.702 1.00 24.41 H new ATOM 0 HH12 ARG A 674 16.652 -0.645 4.280 1.00 24.41 H new ATOM 0 HH21 ARG A 674 16.437 2.746 5.222 1.00 11.02 H new ATOM 0 HH22 ARG A 674 17.470 1.315 5.135 1.00 11.02 H new ATOM 1382 N ASP A 675 12.833 5.778 1.221 1.00 63.30 N ATOM 1383 CA ASP A 675 13.445 6.874 0.483 1.00 54.34 C ATOM 1384 C ASP A 675 12.390 7.797 -0.111 1.00 1.44 C ATOM 1385 O ASP A 675 12.140 7.815 -1.320 1.00 13.12 O ATOM 1386 CB ASP A 675 14.476 6.416 -0.578 1.00 12.41 C ATOM 1387 CG ASP A 675 15.313 7.575 -1.126 1.00 72.44 C ATOM 1388 OD1 ASP A 675 16.287 7.989 -0.447 1.00 54.33 O ATOM 1389 OD2 ASP A 675 15.023 8.090 -2.223 1.00 44.12 O ATOM 0 H ASP A 675 13.143 5.732 2.192 1.00 63.30 H new ATOM 0 HA ASP A 675 14.020 7.442 1.214 1.00 54.34 H new ATOM 0 HB2 ASP A 675 15.139 5.671 -0.137 1.00 12.41 H new ATOM 0 HB3 ASP A 675 13.953 5.930 -1.401 1.00 12.41 H new ATOM 1394 N GLY A 676 11.669 8.440 0.767 1.00 72.00 N ATOM 1395 CA GLY A 676 10.742 9.450 0.375 1.00 75.43 C ATOM 1396 C GLY A 676 11.373 10.806 0.473 1.00 21.31 C ATOM 1397 O GLY A 676 12.595 10.940 0.346 1.00 31.10 O ATOM 0 H GLY A 676 11.712 8.274 1.772 1.00 72.00 H new ATOM 0 HA2 GLY A 676 10.409 9.270 -0.647 1.00 75.43 H new ATOM 0 HA3 GLY A 676 9.857 9.407 1.010 1.00 75.43 H new ATOM 1401 N THR A 677 10.580 11.799 0.703 1.00 10.14 N ATOM 1402 CA THR A 677 11.085 13.133 0.854 1.00 50.34 C ATOM 1403 C THR A 677 11.533 13.319 2.310 1.00 61.32 C ATOM 1404 O THR A 677 10.771 13.017 3.222 1.00 21.15 O ATOM 1405 CB THR A 677 9.975 14.155 0.522 1.00 74.05 C ATOM 1406 OG1 THR A 677 9.414 13.849 -0.763 1.00 55.21 O ATOM 1407 CG2 THR A 677 10.521 15.578 0.504 1.00 21.42 C ATOM 0 H THR A 677 9.567 11.715 0.792 1.00 10.14 H new ATOM 0 HA THR A 677 11.924 13.292 0.177 1.00 50.34 H new ATOM 0 HB THR A 677 9.209 14.089 1.295 1.00 74.05 H new ATOM 0 HG1 THR A 677 9.112 14.676 -1.194 1.00 55.21 H new ATOM 0 HG21 THR A 677 9.716 16.274 0.267 1.00 21.42 H new ATOM 0 HG22 THR A 677 10.935 15.821 1.483 1.00 21.42 H new ATOM 0 HG23 THR A 677 11.303 15.658 -0.251 1.00 21.42 H new ATOM 1413 N PRO A 678 12.767 13.772 2.548 1.00 50.10 N ATOM 1414 CA PRO A 678 13.269 14.010 3.906 1.00 54.24 C ATOM 1415 C PRO A 678 12.475 15.093 4.613 1.00 22.45 C ATOM 1416 O PRO A 678 11.867 15.947 3.963 1.00 3.42 O ATOM 1417 CB PRO A 678 14.714 14.469 3.684 1.00 54.20 C ATOM 1418 CG PRO A 678 14.758 14.943 2.274 1.00 2.42 C ATOM 1419 CD PRO A 678 13.780 14.093 1.526 1.00 15.04 C ATOM 0 HA PRO A 678 13.188 13.124 4.536 1.00 54.24 H new ATOM 0 HB2 PRO A 678 14.985 15.266 4.376 1.00 54.20 H new ATOM 0 HB3 PRO A 678 15.417 13.652 3.847 1.00 54.20 H new ATOM 0 HG2 PRO A 678 14.490 15.997 2.208 1.00 2.42 H new ATOM 0 HG3 PRO A 678 15.761 14.842 1.859 1.00 2.42 H new ATOM 0 HD2 PRO A 678 13.345 14.627 0.681 1.00 15.04 H new ATOM 0 HD3 PRO A 678 14.250 13.194 1.127 1.00 15.04 H new ATOM 1427 N TYR A 679 12.436 15.039 5.927 1.00 70.13 N ATOM 1428 CA TYR A 679 11.749 16.066 6.694 1.00 20.23 C ATOM 1429 C TYR A 679 12.821 17.003 7.216 1.00 22.31 C ATOM 1430 O TYR A 679 13.965 16.963 6.761 1.00 21.42 O ATOM 1431 CB TYR A 679 11.046 15.493 7.937 1.00 14.55 C ATOM 1432 CG TYR A 679 10.361 14.161 7.807 1.00 61.40 C ATOM 1433 CD1 TYR A 679 11.080 12.982 7.935 1.00 2.22 C ATOM 1434 CD2 TYR A 679 9.010 14.076 7.586 1.00 24.20 C ATOM 1435 CE1 TYR A 679 10.465 11.762 7.835 1.00 33.30 C ATOM 1436 CE2 TYR A 679 8.387 12.856 7.489 1.00 44.12 C ATOM 1437 CZ TYR A 679 9.118 11.707 7.615 1.00 20.12 C ATOM 1438 OH TYR A 679 8.493 10.494 7.497 1.00 4.34 O ATOM 0 H TYR A 679 12.867 14.303 6.486 1.00 70.13 H new ATOM 0 HA TYR A 679 11.006 16.540 6.052 1.00 20.23 H new ATOM 0 HB2 TYR A 679 11.787 15.412 8.732 1.00 14.55 H new ATOM 0 HB3 TYR A 679 10.304 16.220 8.266 1.00 14.55 H new ATOM 0 HD1 TYR A 679 12.144 13.026 8.117 1.00 2.22 H new ATOM 0 HD2 TYR A 679 8.428 14.981 7.487 1.00 24.20 H new ATOM 0 HE1 TYR A 679 11.040 10.852 7.929 1.00 33.30 H new ATOM 0 HE2 TYR A 679 7.323 12.804 7.314 1.00 44.12 H new ATOM 0 HH TYR A 679 9.022 9.807 7.954 1.00 4.34 H new ATOM 1448 N ASN A 680 12.475 17.808 8.187 1.00 63.14 N ATOM 1449 CA ASN A 680 13.439 18.658 8.871 1.00 10.22 C ATOM 1450 C ASN A 680 13.879 17.978 10.163 1.00 61.04 C ATOM 1451 O ASN A 680 14.354 18.622 11.101 1.00 23.44 O ATOM 1452 CB ASN A 680 12.850 20.038 9.174 1.00 55.53 C ATOM 1453 CG ASN A 680 12.523 20.837 7.927 1.00 11.34 C ATOM 1454 OD1 ASN A 680 13.154 20.673 6.880 1.00 20.40 O ATOM 1455 ND2 ASN A 680 11.569 21.722 8.031 1.00 42.35 N ATOM 0 H ASN A 680 11.520 17.899 8.532 1.00 63.14 H new ATOM 0 HA ASN A 680 14.300 18.804 8.218 1.00 10.22 H new ATOM 0 HB2 ASN A 680 11.944 19.916 9.767 1.00 55.53 H new ATOM 0 HB3 ASN A 680 13.557 20.601 9.783 1.00 55.53 H new ATOM 0 HD21 ASN A 680 11.325 22.305 7.230 1.00 42.35 H new ATOM 0 HD22 ASN A 680 11.068 21.831 8.913 1.00 42.35 H new ATOM 1461 N ASN A 681 13.734 16.655 10.184 1.00 40.04 N ATOM 1462 CA ASN A 681 14.133 15.830 11.319 1.00 63.42 C ATOM 1463 C ASN A 681 15.654 15.805 11.413 1.00 44.23 C ATOM 1464 O ASN A 681 16.344 15.657 10.390 1.00 1.23 O ATOM 1465 CB ASN A 681 13.590 14.391 11.163 1.00 33.12 C ATOM 1466 CG ASN A 681 13.938 13.484 12.340 1.00 25.03 C ATOM 1467 OD1 ASN A 681 14.071 13.938 13.472 1.00 64.30 O ATOM 1468 ND2 ASN A 681 14.108 12.212 12.078 1.00 14.15 N ATOM 0 H ASN A 681 13.335 16.124 9.410 1.00 40.04 H new ATOM 0 HA ASN A 681 13.716 16.256 12.232 1.00 63.42 H new ATOM 0 HB2 ASN A 681 12.506 14.429 11.050 1.00 33.12 H new ATOM 0 HB3 ASN A 681 13.990 13.956 10.247 1.00 33.12 H new ATOM 0 HD21 ASN A 681 14.359 11.566 12.827 1.00 14.15 H new ATOM 0 HD22 ASN A 681 13.990 11.867 11.125 1.00 14.15 H new ATOM 1474 N GLU A 682 16.170 15.935 12.616 1.00 54.51 N ATOM 1475 CA GLU A 682 17.614 16.020 12.847 1.00 1.34 C ATOM 1476 C GLU A 682 18.356 14.741 12.484 1.00 51.11 C ATOM 1477 O GLU A 682 19.531 14.780 12.178 1.00 74.24 O ATOM 1478 CB GLU A 682 17.909 16.391 14.279 1.00 63.41 C ATOM 1479 CG GLU A 682 17.341 17.717 14.704 1.00 52.42 C ATOM 1480 CD GLU A 682 17.701 18.041 16.116 1.00 21.02 C ATOM 1481 OE1 GLU A 682 18.762 18.653 16.343 1.00 24.02 O ATOM 1482 OE2 GLU A 682 16.937 17.674 17.024 1.00 21.14 O ATOM 0 H GLU A 682 15.610 15.986 13.467 1.00 54.51 H new ATOM 0 HA GLU A 682 17.978 16.803 12.182 1.00 1.34 H new ATOM 0 HB2 GLU A 682 17.514 15.613 14.932 1.00 63.41 H new ATOM 0 HB3 GLU A 682 18.989 16.409 14.422 1.00 63.41 H new ATOM 0 HG2 GLU A 682 17.712 18.501 14.044 1.00 52.42 H new ATOM 0 HG3 GLU A 682 16.256 17.699 14.599 1.00 52.42 H new ATOM 1489 N LYS A 683 17.670 13.620 12.516 1.00 44.51 N ATOM 1490 CA LYS A 683 18.276 12.328 12.174 1.00 43.34 C ATOM 1491 C LYS A 683 18.536 12.223 10.655 1.00 62.44 C ATOM 1492 O LYS A 683 19.322 11.383 10.205 1.00 71.02 O ATOM 1493 CB LYS A 683 17.342 11.188 12.616 1.00 11.50 C ATOM 1494 CG LYS A 683 17.860 9.775 12.333 1.00 71.50 C ATOM 1495 CD LYS A 683 16.817 8.721 12.663 1.00 61.12 C ATOM 1496 CE LYS A 683 16.458 8.704 14.137 1.00 32.02 C ATOM 1497 NZ LYS A 683 15.364 7.753 14.417 1.00 21.41 N ATOM 0 H LYS A 683 16.685 13.565 12.776 1.00 44.51 H new ATOM 0 HA LYS A 683 19.231 12.248 12.693 1.00 43.34 H new ATOM 0 HB2 LYS A 683 17.160 11.283 13.686 1.00 11.50 H new ATOM 0 HB3 LYS A 683 16.381 11.312 12.117 1.00 11.50 H new ATOM 0 HG2 LYS A 683 18.141 9.693 11.283 1.00 71.50 H new ATOM 0 HG3 LYS A 683 18.761 9.593 12.919 1.00 71.50 H new ATOM 0 HD2 LYS A 683 15.918 8.907 12.075 1.00 61.12 H new ATOM 0 HD3 LYS A 683 17.191 7.740 12.372 1.00 61.12 H new ATOM 0 HE2 LYS A 683 17.336 8.433 14.723 1.00 32.02 H new ATOM 0 HE3 LYS A 683 16.161 9.704 14.452 1.00 32.02 H new ATOM 0 HZ1 LYS A 683 15.144 7.767 15.433 1.00 21.41 H new ATOM 0 HZ2 LYS A 683 14.519 8.027 13.876 1.00 21.41 H new ATOM 0 HZ3 LYS A 683 15.657 6.795 14.139 1.00 21.41 H new ATOM 1511 N ARG A 684 17.901 13.119 9.901 1.00 1.23 N ATOM 1512 CA ARG A 684 17.887 13.102 8.432 1.00 40.11 C ATOM 1513 C ARG A 684 17.189 11.874 7.920 1.00 52.41 C ATOM 1514 O ARG A 684 17.811 10.872 7.561 1.00 1.15 O ATOM 1515 CB ARG A 684 19.251 13.319 7.729 1.00 13.44 C ATOM 1516 CG ARG A 684 19.873 14.682 7.958 1.00 64.44 C ATOM 1517 CD ARG A 684 20.592 14.769 9.287 1.00 25.53 C ATOM 1518 NE ARG A 684 21.750 13.863 9.328 1.00 62.34 N ATOM 1519 CZ ARG A 684 22.428 13.515 10.425 1.00 30.22 C ATOM 1520 NH1 ARG A 684 22.025 13.918 11.620 1.00 61.44 N ATOM 1521 NH2 ARG A 684 23.502 12.743 10.316 1.00 52.44 N ATOM 0 H ARG A 684 17.370 13.894 10.298 1.00 1.23 H new ATOM 0 HA ARG A 684 17.319 13.991 8.158 1.00 40.11 H new ATOM 0 HB2 ARG A 684 19.947 12.555 8.074 1.00 13.44 H new ATOM 0 HB3 ARG A 684 19.119 13.170 6.657 1.00 13.44 H new ATOM 0 HG2 ARG A 684 20.575 14.899 7.153 1.00 64.44 H new ATOM 0 HG3 ARG A 684 19.096 15.445 7.917 1.00 64.44 H new ATOM 0 HD2 ARG A 684 20.923 15.793 9.458 1.00 25.53 H new ATOM 0 HD3 ARG A 684 19.903 14.518 10.093 1.00 25.53 H new ATOM 0 HE ARG A 684 22.062 13.466 8.442 1.00 62.34 H new ATOM 0 HH11 ARG A 684 21.191 14.499 11.708 1.00 61.44 H new ATOM 0 HH12 ARG A 684 22.548 13.648 12.453 1.00 61.44 H new ATOM 0 HH21 ARG A 684 23.806 12.419 9.398 1.00 52.44 H new ATOM 0 HH22 ARG A 684 24.024 12.474 11.150 1.00 52.44 H new ATOM 1533 N THR A 685 15.902 11.937 7.949 1.00 5.25 N ATOM 1534 CA THR A 685 15.087 10.819 7.586 1.00 32.33 C ATOM 1535 C THR A 685 14.273 11.098 6.321 1.00 30.40 C ATOM 1536 O THR A 685 13.504 12.066 6.278 1.00 33.14 O ATOM 1537 CB THR A 685 14.117 10.472 8.734 1.00 50.20 C ATOM 1538 OG1 THR A 685 14.851 10.315 9.962 1.00 22.33 O ATOM 1539 CG2 THR A 685 13.365 9.180 8.429 1.00 52.42 C ATOM 0 H THR A 685 15.379 12.768 8.226 1.00 5.25 H new ATOM 0 HA THR A 685 15.757 9.981 7.392 1.00 32.33 H new ATOM 0 HB THR A 685 13.398 11.285 8.835 1.00 50.20 H new ATOM 0 HG1 THR A 685 14.261 9.943 10.650 1.00 22.33 H new ATOM 0 HG21 THR A 685 12.686 8.952 9.250 1.00 52.42 H new ATOM 0 HG22 THR A 685 12.794 9.300 7.508 1.00 52.42 H new ATOM 0 HG23 THR A 685 14.077 8.364 8.310 1.00 52.42 H new ATOM 1545 N PRO A 686 14.448 10.296 5.272 1.00 43.04 N ATOM 1546 CA PRO A 686 13.572 10.340 4.123 1.00 23.42 C ATOM 1547 C PRO A 686 12.264 9.665 4.506 1.00 65.42 C ATOM 1548 O PRO A 686 12.278 8.508 4.972 1.00 54.23 O ATOM 1549 CB PRO A 686 14.305 9.511 3.056 1.00 13.52 C ATOM 1550 CG PRO A 686 15.666 9.263 3.616 1.00 42.12 C ATOM 1551 CD PRO A 686 15.518 9.316 5.101 1.00 45.33 C ATOM 0 HA PRO A 686 13.350 11.348 3.772 1.00 23.42 H new ATOM 0 HB2 PRO A 686 13.784 8.574 2.859 1.00 13.52 H new ATOM 0 HB3 PRO A 686 14.361 10.049 2.110 1.00 13.52 H new ATOM 0 HG2 PRO A 686 16.048 8.293 3.297 1.00 42.12 H new ATOM 0 HG3 PRO A 686 16.374 10.015 3.268 1.00 42.12 H new ATOM 0 HD2 PRO A 686 15.251 8.345 5.518 1.00 45.33 H new ATOM 0 HD3 PRO A 686 16.440 9.630 5.591 1.00 45.33 H new ATOM 1559 N ARG A 687 11.159 10.389 4.350 1.00 2.42 N ATOM 1560 CA ARG A 687 9.828 9.930 4.727 1.00 43.13 C ATOM 1561 C ARG A 687 9.543 8.523 4.199 1.00 31.10 C ATOM 1562 O ARG A 687 9.889 8.199 3.068 1.00 71.22 O ATOM 1563 CB ARG A 687 8.799 10.951 4.232 1.00 61.51 C ATOM 1564 CG ARG A 687 7.369 10.656 4.588 1.00 31.44 C ATOM 1565 CD ARG A 687 6.447 11.798 4.166 1.00 1.41 C ATOM 1566 NE ARG A 687 6.594 13.029 4.984 1.00 33.40 N ATOM 1567 CZ ARG A 687 7.242 14.152 4.630 1.00 11.00 C ATOM 1568 NH1 ARG A 687 8.060 14.154 3.580 1.00 24.52 N ATOM 1569 NH2 ARG A 687 7.118 15.255 5.377 1.00 24.25 N ATOM 0 H ARG A 687 11.165 11.328 3.951 1.00 2.42 H new ATOM 0 HA ARG A 687 9.763 9.858 5.813 1.00 43.13 H new ATOM 0 HB2 ARG A 687 9.061 11.929 4.636 1.00 61.51 H new ATOM 0 HB3 ARG A 687 8.877 11.022 3.147 1.00 61.51 H new ATOM 0 HG2 ARG A 687 7.054 9.732 4.102 1.00 31.44 H new ATOM 0 HG3 ARG A 687 7.285 10.496 5.663 1.00 31.44 H new ATOM 0 HD2 ARG A 687 6.643 12.043 3.122 1.00 1.41 H new ATOM 0 HD3 ARG A 687 5.413 11.457 4.224 1.00 1.41 H new ATOM 0 HE ARG A 687 6.160 13.021 5.907 1.00 33.40 H new ATOM 0 HH11 ARG A 687 8.198 13.300 3.039 1.00 24.52 H new ATOM 0 HH12 ARG A 687 8.549 15.009 3.316 1.00 24.52 H new ATOM 0 HH21 ARG A 687 6.533 15.242 6.212 1.00 24.25 H new ATOM 0 HH22 ARG A 687 7.609 16.109 5.111 1.00 24.25 H new ATOM 1581 N ALA A 688 8.945 7.704 5.037 1.00 14.22 N ATOM 1582 CA ALA A 688 8.687 6.319 4.714 1.00 74.24 C ATOM 1583 C ALA A 688 7.234 5.964 4.992 1.00 63.11 C ATOM 1584 O ALA A 688 6.585 6.577 5.858 1.00 31.13 O ATOM 1585 CB ALA A 688 9.614 5.415 5.515 1.00 64.31 C ATOM 0 H ALA A 688 8.623 7.982 5.964 1.00 14.22 H new ATOM 0 HA ALA A 688 8.878 6.170 3.651 1.00 74.24 H new ATOM 0 HB1 ALA A 688 9.412 4.373 5.265 1.00 64.31 H new ATOM 0 HB2 ALA A 688 10.650 5.652 5.274 1.00 64.31 H new ATOM 0 HB3 ALA A 688 9.444 5.572 6.580 1.00 64.31 H new ATOM 1591 N THR A 689 6.738 4.986 4.271 1.00 43.34 N ATOM 1592 CA THR A 689 5.364 4.551 4.390 1.00 51.42 C ATOM 1593 C THR A 689 5.339 3.088 4.734 1.00 21.34 C ATOM 1594 O THR A 689 6.053 2.301 4.117 1.00 33.14 O ATOM 1595 CB THR A 689 4.658 4.683 3.037 1.00 54.11 C ATOM 1596 OG1 THR A 689 4.914 5.943 2.515 1.00 24.41 O ATOM 1597 CG2 THR A 689 3.158 4.520 3.181 1.00 62.22 C ATOM 0 H THR A 689 7.279 4.466 3.580 1.00 43.34 H new ATOM 0 HA THR A 689 4.875 5.158 5.152 1.00 51.42 H new ATOM 0 HB THR A 689 5.035 3.901 2.378 1.00 54.11 H new ATOM 0 HG1 THR A 689 5.859 6.008 2.265 1.00 24.41 H new ATOM 0 HG21 THR A 689 2.686 4.619 2.204 1.00 62.22 H new ATOM 0 HG22 THR A 689 2.937 3.535 3.593 1.00 62.22 H new ATOM 0 HG23 THR A 689 2.771 5.288 3.850 1.00 62.22 H new ATOM 1603 N LEU A 690 4.554 2.710 5.693 1.00 50.43 N ATOM 1604 CA LEU A 690 4.391 1.351 5.971 1.00 24.30 C ATOM 1605 C LEU A 690 2.922 1.016 6.144 1.00 63.44 C ATOM 1606 O LEU A 690 2.219 1.652 6.916 1.00 24.24 O ATOM 1607 CB LEU A 690 5.270 0.910 7.158 1.00 22.31 C ATOM 1608 CG LEU A 690 5.127 -0.544 7.590 1.00 54.23 C ATOM 1609 CD1 LEU A 690 6.382 -1.009 8.277 1.00 14.42 C ATOM 1610 CD2 LEU A 690 3.961 -0.701 8.548 1.00 54.14 C ATOM 0 H LEU A 690 4.020 3.342 6.290 1.00 50.43 H new ATOM 0 HA LEU A 690 4.742 0.771 5.118 1.00 24.30 H new ATOM 0 HB2 LEU A 690 6.313 1.091 6.899 1.00 22.31 H new ATOM 0 HB3 LEU A 690 5.039 1.547 8.012 1.00 22.31 H new ATOM 0 HG LEU A 690 4.950 -1.145 6.698 1.00 54.23 H new ATOM 0 HD11 LEU A 690 6.266 -2.049 8.581 1.00 14.42 H new ATOM 0 HD12 LEU A 690 7.225 -0.922 7.592 1.00 14.42 H new ATOM 0 HD13 LEU A 690 6.565 -0.392 9.157 1.00 14.42 H new ATOM 0 HD21 LEU A 690 3.873 -1.746 8.846 1.00 54.14 H new ATOM 0 HD22 LEU A 690 4.130 -0.084 9.431 1.00 54.14 H new ATOM 0 HD23 LEU A 690 3.041 -0.386 8.056 1.00 54.14 H new ATOM 1618 N ILE A 691 2.475 0.027 5.416 1.00 21.45 N ATOM 1619 CA ILE A 691 1.094 -0.420 5.467 1.00 65.20 C ATOM 1620 C ILE A 691 1.055 -1.760 6.171 1.00 63.12 C ATOM 1621 O ILE A 691 1.840 -2.637 5.846 1.00 13.32 O ATOM 1622 CB ILE A 691 0.456 -0.643 4.038 1.00 72.00 C ATOM 1623 CG1 ILE A 691 0.368 0.620 3.162 1.00 32.11 C ATOM 1624 CG2 ILE A 691 -0.916 -1.254 4.161 1.00 63.13 C ATOM 1625 CD1 ILE A 691 1.687 1.244 2.775 1.00 65.00 C ATOM 0 H ILE A 691 3.057 -0.499 4.764 1.00 21.45 H new ATOM 0 HA ILE A 691 0.529 0.358 5.981 1.00 65.20 H new ATOM 0 HB ILE A 691 1.143 -1.320 3.531 1.00 72.00 H new ATOM 0 HG12 ILE A 691 -0.176 0.370 2.251 1.00 32.11 H new ATOM 0 HG13 ILE A 691 -0.224 1.366 3.692 1.00 32.11 H new ATOM 0 HG21 ILE A 691 -1.340 -1.400 3.167 1.00 63.13 H new ATOM 0 HG22 ILE A 691 -0.842 -2.216 4.669 1.00 63.13 H new ATOM 0 HG23 ILE A 691 -1.560 -0.589 4.736 1.00 63.13 H new ATOM 0 HD11 ILE A 691 1.506 2.125 2.160 1.00 65.00 H new ATOM 0 HD12 ILE A 691 2.230 1.535 3.674 1.00 65.00 H new ATOM 0 HD13 ILE A 691 2.279 0.523 2.211 1.00 65.00 H new ATOM 1632 N THR A 692 0.174 -1.911 7.102 1.00 74.30 N ATOM 1633 CA THR A 692 -0.004 -3.171 7.763 1.00 1.41 C ATOM 1634 C THR A 692 -1.292 -3.820 7.225 1.00 44.42 C ATOM 1635 O THR A 692 -2.374 -3.213 7.287 1.00 4.15 O ATOM 1636 CB THR A 692 -0.079 -2.969 9.301 1.00 20.20 C ATOM 1637 OG1 THR A 692 1.112 -2.282 9.760 1.00 63.34 O ATOM 1638 CG2 THR A 692 -0.193 -4.305 10.029 1.00 2.35 C ATOM 0 H THR A 692 -0.445 -1.169 7.430 1.00 74.30 H new ATOM 0 HA THR A 692 0.844 -3.826 7.562 1.00 1.41 H new ATOM 0 HB THR A 692 -0.967 -2.375 9.520 1.00 20.20 H new ATOM 0 HG1 THR A 692 1.085 -2.196 10.736 1.00 63.34 H new ATOM 0 HG21 THR A 692 -0.244 -4.131 11.104 1.00 2.35 H new ATOM 0 HG22 THR A 692 -1.096 -4.821 9.702 1.00 2.35 H new ATOM 0 HG23 THR A 692 0.679 -4.919 9.802 1.00 2.35 H new ATOM 1644 N PHE A 693 -1.169 -5.022 6.672 1.00 10.40 N ATOM 1645 CA PHE A 693 -2.304 -5.721 6.082 1.00 74.11 C ATOM 1646 C PHE A 693 -2.944 -6.663 7.103 1.00 61.15 C ATOM 1647 O PHE A 693 -2.301 -7.601 7.587 1.00 24.32 O ATOM 1648 CB PHE A 693 -1.871 -6.519 4.835 1.00 42.24 C ATOM 1649 CG PHE A 693 -1.217 -5.697 3.751 1.00 12.50 C ATOM 1650 CD1 PHE A 693 -1.959 -4.846 2.948 1.00 52.15 C ATOM 1651 CD2 PHE A 693 0.143 -5.785 3.540 1.00 4.33 C ATOM 1652 CE1 PHE A 693 -1.342 -4.094 1.957 1.00 4.54 C ATOM 1653 CE2 PHE A 693 0.760 -5.045 2.556 1.00 53.32 C ATOM 1654 CZ PHE A 693 0.016 -4.197 1.764 1.00 43.13 C ATOM 0 H PHE A 693 -0.289 -5.535 6.620 1.00 10.40 H new ATOM 0 HA PHE A 693 -3.037 -4.973 5.780 1.00 74.11 H new ATOM 0 HB2 PHE A 693 -1.179 -7.302 5.145 1.00 42.24 H new ATOM 0 HB3 PHE A 693 -2.747 -7.015 4.417 1.00 42.24 H new ATOM 0 HD1 PHE A 693 -3.026 -4.767 3.094 1.00 52.15 H new ATOM 0 HD2 PHE A 693 0.734 -6.445 4.157 1.00 4.33 H new ATOM 0 HE1 PHE A 693 -1.927 -3.429 1.339 1.00 4.54 H new ATOM 0 HE2 PHE A 693 1.826 -5.129 2.405 1.00 53.32 H new ATOM 0 HZ PHE A 693 0.499 -3.614 0.993 1.00 43.13 H new ATOM 1664 N LEU A 694 -4.194 -6.397 7.429 1.00 11.03 N ATOM 1665 CA LEU A 694 -4.947 -7.178 8.402 1.00 33.53 C ATOM 1666 C LEU A 694 -6.031 -8.024 7.736 1.00 14.10 C ATOM 1667 O LEU A 694 -6.466 -7.735 6.612 1.00 5.14 O ATOM 1668 CB LEU A 694 -5.606 -6.291 9.492 1.00 12.12 C ATOM 1669 CG LEU A 694 -4.695 -5.486 10.441 1.00 70.33 C ATOM 1670 CD1 LEU A 694 -3.671 -6.371 11.129 1.00 24.22 C ATOM 1671 CD2 LEU A 694 -4.045 -4.303 9.747 1.00 43.50 C ATOM 0 H LEU A 694 -4.724 -5.626 7.024 1.00 11.03 H new ATOM 0 HA LEU A 694 -4.217 -7.833 8.877 1.00 33.53 H new ATOM 0 HB2 LEU A 694 -6.266 -5.584 8.989 1.00 12.12 H new ATOM 0 HB3 LEU A 694 -6.236 -6.935 10.106 1.00 12.12 H new ATOM 0 HG LEU A 694 -5.339 -5.077 11.220 1.00 70.33 H new ATOM 0 HD11 LEU A 694 -3.050 -5.764 11.788 1.00 24.22 H new ATOM 0 HD12 LEU A 694 -4.184 -7.134 11.715 1.00 24.22 H new ATOM 0 HD13 LEU A 694 -3.043 -6.851 10.379 1.00 24.22 H new ATOM 0 HD21 LEU A 694 -3.413 -3.767 10.456 1.00 43.50 H new ATOM 0 HD22 LEU A 694 -3.437 -4.658 8.915 1.00 43.50 H new ATOM 0 HD23 LEU A 694 -4.818 -3.632 9.371 1.00 43.50 H new ATOM 1679 N CYS A 695 -6.481 -9.039 8.464 1.00 13.10 N ATOM 1680 CA CYS A 695 -7.551 -9.955 8.038 1.00 31.34 C ATOM 1681 C CYS A 695 -8.844 -9.569 8.777 1.00 23.43 C ATOM 1682 O CYS A 695 -9.817 -10.324 8.841 1.00 53.03 O ATOM 1683 CB CYS A 695 -7.146 -11.437 8.395 1.00 20.01 C ATOM 1684 SG CYS A 695 -8.473 -12.727 8.180 1.00 30.32 S ATOM 0 H CYS A 695 -6.109 -9.259 9.388 1.00 13.10 H new ATOM 0 HA CYS A 695 -7.706 -9.883 6.961 1.00 31.34 H new ATOM 0 HB2 CYS A 695 -6.293 -11.717 7.777 1.00 20.01 H new ATOM 0 HB3 CYS A 695 -6.810 -11.460 9.432 1.00 20.01 H new ATOM 1689 N ASP A 696 -8.880 -8.361 9.279 1.00 14.34 N ATOM 1690 CA ASP A 696 -10.069 -7.909 9.989 1.00 40.51 C ATOM 1691 C ASP A 696 -11.048 -7.340 9.025 1.00 11.34 C ATOM 1692 O ASP A 696 -10.672 -6.546 8.163 1.00 3.24 O ATOM 1693 CB ASP A 696 -9.780 -6.891 11.092 1.00 33.33 C ATOM 1694 CG ASP A 696 -8.997 -7.442 12.242 1.00 73.23 C ATOM 1695 OD1 ASP A 696 -9.569 -8.204 13.052 1.00 71.41 O ATOM 1696 OD2 ASP A 696 -7.808 -7.110 12.378 1.00 1.24 O ATOM 0 H ASP A 696 -8.123 -7.680 9.217 1.00 14.34 H new ATOM 0 HA ASP A 696 -10.482 -8.789 10.482 1.00 40.51 H new ATOM 0 HB2 ASP A 696 -9.233 -6.052 10.663 1.00 33.33 H new ATOM 0 HB3 ASP A 696 -10.725 -6.498 11.465 1.00 33.33 H new ATOM 1701 N ARG A 697 -12.310 -7.774 9.165 1.00 71.05 N ATOM 1702 CA ARG A 697 -13.458 -7.377 8.314 1.00 61.23 C ATOM 1703 C ARG A 697 -13.190 -7.555 6.814 1.00 61.22 C ATOM 1704 O ARG A 697 -12.144 -8.073 6.398 1.00 1.42 O ATOM 1705 CB ARG A 697 -14.013 -5.954 8.643 1.00 23.23 C ATOM 1706 CG ARG A 697 -13.051 -4.789 8.446 1.00 63.34 C ATOM 1707 CD ARG A 697 -13.722 -3.474 8.760 1.00 71.41 C ATOM 1708 NE ARG A 697 -12.807 -2.334 8.627 1.00 34.34 N ATOM 1709 CZ ARG A 697 -13.200 -1.061 8.464 1.00 45.33 C ATOM 1710 NH1 ARG A 697 -14.490 -0.773 8.374 1.00 71.14 N ATOM 1711 NH2 ARG A 697 -12.307 -0.088 8.396 1.00 13.21 N ATOM 0 H ARG A 697 -12.575 -8.433 9.897 1.00 71.05 H new ATOM 0 HA ARG A 697 -14.250 -8.080 8.572 1.00 61.23 H new ATOM 0 HB2 ARG A 697 -14.893 -5.779 8.024 1.00 23.23 H new ATOM 0 HB3 ARG A 697 -14.347 -5.949 9.680 1.00 23.23 H new ATOM 0 HG2 ARG A 697 -12.180 -4.919 9.088 1.00 63.34 H new ATOM 0 HG3 ARG A 697 -12.690 -4.781 7.418 1.00 63.34 H new ATOM 0 HD2 ARG A 697 -14.572 -3.334 8.092 1.00 71.41 H new ATOM 0 HD3 ARG A 697 -14.116 -3.504 9.776 1.00 71.41 H new ATOM 0 HE ARG A 697 -11.805 -2.522 8.661 1.00 34.34 H new ATOM 0 HH11 ARG A 697 -15.184 -1.519 8.429 1.00 71.14 H new ATOM 0 HH12 ARG A 697 -14.789 0.194 8.250 1.00 71.14 H new ATOM 0 HH21 ARG A 697 -11.312 -0.303 8.467 1.00 13.21 H new ATOM 0 HH22 ARG A 697 -12.613 0.877 8.272 1.00 13.21 H new ATOM 1723 N ASP A 698 -14.140 -7.193 6.016 1.00 42.13 N ATOM 1724 CA ASP A 698 -13.961 -7.275 4.595 1.00 2.41 C ATOM 1725 C ASP A 698 -14.201 -5.942 3.963 1.00 63.21 C ATOM 1726 O ASP A 698 -15.160 -5.248 4.294 1.00 24.50 O ATOM 1727 CB ASP A 698 -14.862 -8.333 3.959 1.00 42.11 C ATOM 1728 CG ASP A 698 -14.673 -8.412 2.455 1.00 61.22 C ATOM 1729 OD1 ASP A 698 -13.779 -9.134 1.999 1.00 63.42 O ATOM 1730 OD2 ASP A 698 -15.427 -7.745 1.714 1.00 72.43 O ATOM 0 H ASP A 698 -15.047 -6.838 6.318 1.00 42.13 H new ATOM 0 HA ASP A 698 -12.929 -7.578 4.416 1.00 2.41 H new ATOM 0 HB2 ASP A 698 -14.648 -9.305 4.403 1.00 42.11 H new ATOM 0 HB3 ASP A 698 -15.904 -8.103 4.182 1.00 42.11 H new ATOM 1735 N ALA A 699 -13.316 -5.578 3.090 1.00 3.41 N ATOM 1736 CA ALA A 699 -13.401 -4.347 2.354 1.00 21.23 C ATOM 1737 C ALA A 699 -13.012 -4.638 0.918 1.00 14.34 C ATOM 1738 O ALA A 699 -12.561 -3.754 0.186 1.00 4.50 O ATOM 1739 CB ALA A 699 -12.455 -3.321 2.969 1.00 33.15 C ATOM 0 H ALA A 699 -12.494 -6.137 2.861 1.00 3.41 H new ATOM 0 HA ALA A 699 -14.412 -3.941 2.388 1.00 21.23 H new ATOM 0 HB1 ALA A 699 -12.519 -2.387 2.411 1.00 33.15 H new ATOM 0 HB2 ALA A 699 -12.736 -3.144 4.007 1.00 33.15 H new ATOM 0 HB3 ALA A 699 -11.433 -3.698 2.929 1.00 33.15 H new ATOM 1745 N GLY A 700 -13.220 -5.888 0.514 1.00 53.31 N ATOM 1746 CA GLY A 700 -12.845 -6.321 -0.814 1.00 31.13 C ATOM 1747 C GLY A 700 -11.347 -6.419 -0.955 1.00 15.15 C ATOM 1748 O GLY A 700 -10.697 -7.241 -0.281 1.00 74.13 O ATOM 0 H GLY A 700 -13.646 -6.613 1.092 1.00 53.31 H new ATOM 0 HA2 GLY A 700 -13.296 -7.291 -1.024 1.00 31.13 H new ATOM 0 HA3 GLY A 700 -13.237 -5.621 -1.552 1.00 31.13 H new ATOM 1752 N VAL A 701 -10.788 -5.558 -1.787 1.00 4.54 N ATOM 1753 CA VAL A 701 -9.353 -5.523 -2.016 1.00 13.22 C ATOM 1754 C VAL A 701 -8.683 -4.828 -0.830 1.00 33.41 C ATOM 1755 O VAL A 701 -7.487 -5.004 -0.554 1.00 75.51 O ATOM 1756 CB VAL A 701 -8.999 -4.790 -3.347 1.00 5.23 C ATOM 1757 CG1 VAL A 701 -7.504 -4.856 -3.636 1.00 42.14 C ATOM 1758 CG2 VAL A 701 -9.796 -5.361 -4.514 1.00 61.34 C ATOM 0 H VAL A 701 -11.313 -4.866 -2.321 1.00 4.54 H new ATOM 0 HA VAL A 701 -8.987 -6.546 -2.107 1.00 13.22 H new ATOM 0 HB VAL A 701 -9.272 -3.742 -3.226 1.00 5.23 H new ATOM 0 HG11 VAL A 701 -7.291 -4.336 -4.570 1.00 42.14 H new ATOM 0 HG12 VAL A 701 -6.955 -4.381 -2.823 1.00 42.14 H new ATOM 0 HG13 VAL A 701 -7.196 -5.898 -3.722 1.00 42.14 H new ATOM 0 HG21 VAL A 701 -9.530 -4.832 -5.429 1.00 61.34 H new ATOM 0 HG22 VAL A 701 -9.567 -6.421 -4.627 1.00 61.34 H new ATOM 0 HG23 VAL A 701 -10.862 -5.239 -4.321 1.00 61.34 H new ATOM 1764 N GLY A 702 -9.469 -4.070 -0.120 1.00 22.11 N ATOM 1765 CA GLY A 702 -8.996 -3.404 1.036 1.00 0.44 C ATOM 1766 C GLY A 702 -8.806 -1.947 0.815 1.00 74.11 C ATOM 1767 O GLY A 702 -8.417 -1.516 -0.271 1.00 54.33 O ATOM 0 H GLY A 702 -10.452 -3.903 -0.335 1.00 22.11 H new ATOM 0 HA2 GLY A 702 -9.702 -3.555 1.853 1.00 0.44 H new ATOM 0 HA3 GLY A 702 -8.050 -3.848 1.346 1.00 0.44 H new ATOM 1771 N PHE A 703 -9.106 -1.189 1.811 1.00 65.43 N ATOM 1772 CA PHE A 703 -8.919 0.221 1.766 1.00 14.11 C ATOM 1773 C PHE A 703 -7.915 0.612 2.841 1.00 23.13 C ATOM 1774 O PHE A 703 -8.057 0.194 4.000 1.00 62.45 O ATOM 1775 CB PHE A 703 -10.263 0.945 1.966 1.00 74.31 C ATOM 1776 CG PHE A 703 -10.157 2.441 1.928 1.00 22.24 C ATOM 1777 CD1 PHE A 703 -9.999 3.105 0.722 1.00 24.34 C ATOM 1778 CD2 PHE A 703 -10.198 3.182 3.096 1.00 20.35 C ATOM 1779 CE1 PHE A 703 -9.886 4.477 0.683 1.00 21.43 C ATOM 1780 CE2 PHE A 703 -10.081 4.552 3.063 1.00 14.30 C ATOM 1781 CZ PHE A 703 -9.925 5.202 1.857 1.00 22.10 C ATOM 0 H PHE A 703 -9.492 -1.533 2.690 1.00 65.43 H new ATOM 0 HA PHE A 703 -8.532 0.517 0.791 1.00 14.11 H new ATOM 0 HB2 PHE A 703 -10.959 0.620 1.193 1.00 74.31 H new ATOM 0 HB3 PHE A 703 -10.688 0.644 2.924 1.00 74.31 H new ATOM 0 HD1 PHE A 703 -9.964 2.540 -0.198 1.00 24.34 H new ATOM 0 HD2 PHE A 703 -10.323 2.679 4.044 1.00 20.35 H new ATOM 0 HE1 PHE A 703 -9.767 4.984 -0.263 1.00 21.43 H new ATOM 0 HE2 PHE A 703 -10.111 5.119 3.982 1.00 14.30 H new ATOM 0 HZ PHE A 703 -9.833 6.278 1.831 1.00 22.10 H new ATOM 1791 N PRO A 704 -6.865 1.359 2.480 1.00 41.11 N ATOM 1792 CA PRO A 704 -5.898 1.828 3.452 1.00 3.33 C ATOM 1793 C PRO A 704 -6.456 2.994 4.258 1.00 53.41 C ATOM 1794 O PRO A 704 -7.079 3.895 3.713 1.00 30.11 O ATOM 1795 CB PRO A 704 -4.718 2.293 2.593 1.00 41.33 C ATOM 1796 CG PRO A 704 -5.318 2.656 1.275 1.00 22.23 C ATOM 1797 CD PRO A 704 -6.538 1.789 1.105 1.00 44.34 C ATOM 0 HA PRO A 704 -5.627 1.060 4.176 1.00 3.33 H new ATOM 0 HB2 PRO A 704 -4.213 3.147 3.045 1.00 41.33 H new ATOM 0 HB3 PRO A 704 -3.974 1.504 2.484 1.00 41.33 H new ATOM 0 HG2 PRO A 704 -5.586 3.712 1.249 1.00 22.23 H new ATOM 0 HG3 PRO A 704 -4.607 2.488 0.466 1.00 22.23 H new ATOM 0 HD2 PRO A 704 -7.361 2.343 0.653 1.00 44.34 H new ATOM 0 HD3 PRO A 704 -6.334 0.936 0.458 1.00 44.34 H new ATOM 1805 N GLU A 705 -6.235 2.963 5.528 1.00 23.24 N ATOM 1806 CA GLU A 705 -6.681 3.996 6.408 1.00 64.31 C ATOM 1807 C GLU A 705 -5.509 4.646 7.088 1.00 30.12 C ATOM 1808 O GLU A 705 -4.494 3.993 7.375 1.00 54.23 O ATOM 1809 CB GLU A 705 -7.664 3.442 7.428 1.00 45.43 C ATOM 1810 CG GLU A 705 -8.952 2.945 6.809 1.00 21.23 C ATOM 1811 CD GLU A 705 -9.911 2.386 7.824 1.00 10.54 C ATOM 1812 OE1 GLU A 705 -10.697 3.173 8.418 1.00 44.23 O ATOM 1813 OE2 GLU A 705 -9.927 1.151 8.012 1.00 74.40 O ATOM 0 H GLU A 705 -5.732 2.208 5.994 1.00 23.24 H new ATOM 0 HA GLU A 705 -7.198 4.755 5.820 1.00 64.31 H new ATOM 0 HB2 GLU A 705 -7.191 2.624 7.971 1.00 45.43 H new ATOM 0 HB3 GLU A 705 -7.895 4.218 8.158 1.00 45.43 H new ATOM 0 HG2 GLU A 705 -9.433 3.765 6.275 1.00 21.23 H new ATOM 0 HG3 GLU A 705 -8.722 2.176 6.072 1.00 21.23 H new ATOM 1820 N TYR A 706 -5.639 5.915 7.334 1.00 62.11 N ATOM 1821 CA TYR A 706 -4.607 6.696 7.953 1.00 73.35 C ATOM 1822 C TYR A 706 -4.557 6.397 9.449 1.00 42.12 C ATOM 1823 O TYR A 706 -5.475 6.732 10.192 1.00 14.34 O ATOM 1824 CB TYR A 706 -4.874 8.173 7.660 1.00 73.24 C ATOM 1825 CG TYR A 706 -3.865 9.163 8.192 1.00 5.35 C ATOM 1826 CD1 TYR A 706 -2.495 8.938 8.091 1.00 60.22 C ATOM 1827 CD2 TYR A 706 -4.293 10.357 8.747 1.00 2.54 C ATOM 1828 CE1 TYR A 706 -1.590 9.883 8.534 1.00 24.22 C ATOM 1829 CE2 TYR A 706 -3.403 11.297 9.197 1.00 52.12 C ATOM 1830 CZ TYR A 706 -2.059 11.064 9.088 1.00 22.32 C ATOM 1831 OH TYR A 706 -1.180 12.018 9.505 1.00 11.03 O ATOM 0 H TYR A 706 -6.479 6.447 7.107 1.00 62.11 H new ATOM 0 HA TYR A 706 -3.628 6.440 7.547 1.00 73.35 H new ATOM 0 HB2 TYR A 706 -4.938 8.299 6.579 1.00 73.24 H new ATOM 0 HB3 TYR A 706 -5.851 8.430 8.069 1.00 73.24 H new ATOM 0 HD1 TYR A 706 -2.136 8.014 7.662 1.00 60.22 H new ATOM 0 HD2 TYR A 706 -5.352 10.552 8.827 1.00 2.54 H new ATOM 0 HE1 TYR A 706 -0.528 9.704 8.450 1.00 24.22 H new ATOM 0 HE2 TYR A 706 -3.761 12.217 9.635 1.00 52.12 H new ATOM 0 HH TYR A 706 -1.606 12.580 10.186 1.00 11.03 H new ATOM 1841 N GLN A 707 -3.495 5.725 9.857 1.00 34.22 N ATOM 1842 CA GLN A 707 -3.292 5.323 11.239 1.00 45.43 C ATOM 1843 C GLN A 707 -3.155 6.548 12.128 1.00 12.03 C ATOM 1844 O GLN A 707 -4.058 6.880 12.912 1.00 10.21 O ATOM 1845 CB GLN A 707 -2.002 4.509 11.328 1.00 54.12 C ATOM 1846 CG GLN A 707 -1.660 3.952 12.695 1.00 13.32 C ATOM 1847 CD GLN A 707 -2.545 2.815 13.090 1.00 1.32 C ATOM 1848 OE1 GLN A 707 -3.593 2.996 13.705 1.00 22.03 O ATOM 1849 NE2 GLN A 707 -2.133 1.639 12.731 1.00 44.44 N ATOM 0 H GLN A 707 -2.741 5.440 9.232 1.00 34.22 H new ATOM 0 HA GLN A 707 -4.146 4.732 11.570 1.00 45.43 H new ATOM 0 HB2 GLN A 707 -2.071 3.678 10.626 1.00 54.12 H new ATOM 0 HB3 GLN A 707 -1.176 5.138 10.997 1.00 54.12 H new ATOM 0 HG2 GLN A 707 -0.622 3.618 12.698 1.00 13.32 H new ATOM 0 HG3 GLN A 707 -1.741 4.746 13.437 1.00 13.32 H new ATOM 0 HE21 GLN A 707 -1.255 1.540 12.221 1.00 44.44 H new ATOM 0 HE22 GLN A 707 -2.687 0.813 12.958 1.00 44.44 H new ATOM 1857 N GLU A 708 -2.035 7.227 11.959 1.00 25.10 N ATOM 1858 CA GLU A 708 -1.652 8.356 12.752 1.00 14.42 C ATOM 1859 C GLU A 708 -0.333 8.846 12.191 1.00 33.10 C ATOM 1860 O GLU A 708 0.375 8.077 11.518 1.00 11.53 O ATOM 1861 CB GLU A 708 -1.449 7.900 14.205 1.00 34.12 C ATOM 1862 CG GLU A 708 -1.097 8.997 15.185 1.00 74.31 C ATOM 1863 CD GLU A 708 -0.849 8.455 16.559 1.00 32.40 C ATOM 1864 OE1 GLU A 708 -1.828 8.188 17.301 1.00 45.22 O ATOM 1865 OE2 GLU A 708 0.324 8.251 16.915 1.00 32.40 O ATOM 0 H GLU A 708 -1.352 6.991 11.239 1.00 25.10 H new ATOM 0 HA GLU A 708 -2.409 9.140 12.730 1.00 14.42 H new ATOM 0 HB2 GLU A 708 -2.362 7.411 14.545 1.00 34.12 H new ATOM 0 HB3 GLU A 708 -0.658 7.150 14.226 1.00 34.12 H new ATOM 0 HG2 GLU A 708 -0.209 9.525 14.837 1.00 74.31 H new ATOM 0 HG3 GLU A 708 -1.907 9.725 15.222 1.00 74.31 H new ATOM 1872 N GLU A 709 -0.012 10.085 12.425 1.00 61.34 N ATOM 1873 CA GLU A 709 1.243 10.615 11.984 1.00 14.24 C ATOM 1874 C GLU A 709 2.294 10.522 13.062 1.00 3.41 C ATOM 1875 O GLU A 709 2.024 10.720 14.263 1.00 25.25 O ATOM 1876 CB GLU A 709 1.152 12.062 11.432 1.00 20.22 C ATOM 1877 CG GLU A 709 0.531 13.111 12.361 1.00 43.33 C ATOM 1878 CD GLU A 709 -0.954 12.921 12.561 1.00 63.20 C ATOM 1879 OE1 GLU A 709 -1.737 13.461 11.749 1.00 2.12 O ATOM 1880 OE2 GLU A 709 -1.357 12.218 13.515 1.00 32.32 O ATOM 0 H GLU A 709 -0.606 10.749 12.921 1.00 61.34 H new ATOM 0 HA GLU A 709 1.543 9.986 11.146 1.00 14.24 H new ATOM 0 HB2 GLU A 709 2.158 12.391 11.170 1.00 20.22 H new ATOM 0 HB3 GLU A 709 0.573 12.039 10.508 1.00 20.22 H new ATOM 0 HG2 GLU A 709 1.030 13.071 13.329 1.00 43.33 H new ATOM 0 HG3 GLU A 709 0.712 14.104 11.950 1.00 43.33 H new ATOM 1887 N ASP A 710 3.462 10.193 12.635 1.00 42.20 N ATOM 1888 CA ASP A 710 4.636 10.125 13.460 1.00 64.13 C ATOM 1889 C ASP A 710 5.647 11.051 12.839 1.00 24.21 C ATOM 1890 O ASP A 710 5.533 11.369 11.642 1.00 63.50 O ATOM 1891 CB ASP A 710 5.166 8.675 13.519 1.00 24.44 C ATOM 1892 CG ASP A 710 6.507 8.527 14.219 1.00 73.13 C ATOM 1893 OD1 ASP A 710 7.543 8.645 13.542 1.00 24.03 O ATOM 1894 OD2 ASP A 710 6.548 8.303 15.446 1.00 53.01 O ATOM 0 H ASP A 710 3.643 9.952 11.660 1.00 42.20 H new ATOM 0 HA ASP A 710 4.422 10.424 14.486 1.00 64.13 H new ATOM 0 HB2 ASP A 710 4.432 8.053 14.031 1.00 24.44 H new ATOM 0 HB3 ASP A 710 5.256 8.292 12.503 1.00 24.44 H new ATOM 1899 N ASN A 711 6.618 11.488 13.615 1.00 74.32 N ATOM 1900 CA ASN A 711 7.626 12.432 13.140 1.00 54.12 C ATOM 1901 C ASN A 711 8.427 11.878 11.965 1.00 42.32 C ATOM 1902 O ASN A 711 8.968 12.651 11.160 1.00 44.33 O ATOM 1903 CB ASN A 711 8.567 12.873 14.278 1.00 23.13 C ATOM 1904 CG ASN A 711 7.915 13.777 15.347 1.00 35.30 C ATOM 1905 OD1 ASN A 711 8.596 14.585 15.975 1.00 31.12 O ATOM 1906 ND2 ASN A 711 6.613 13.673 15.543 1.00 73.34 N ATOM 0 H ASN A 711 6.736 11.205 14.588 1.00 74.32 H new ATOM 0 HA ASN A 711 7.086 13.309 12.784 1.00 54.12 H new ATOM 0 HB2 ASN A 711 8.963 11.983 14.768 1.00 23.13 H new ATOM 0 HB3 ASN A 711 9.415 13.402 13.844 1.00 23.13 H new ATOM 0 HD21 ASN A 711 6.151 14.271 16.228 1.00 73.34 H new ATOM 0 HD22 ASN A 711 6.069 12.995 15.009 1.00 73.34 H new ATOM 1912 N SER A 712 8.506 10.549 11.845 1.00 72.23 N ATOM 1913 CA SER A 712 9.236 9.977 10.753 1.00 65.11 C ATOM 1914 C SER A 712 8.609 8.699 10.137 1.00 13.22 C ATOM 1915 O SER A 712 8.952 8.341 9.008 1.00 52.32 O ATOM 1916 CB SER A 712 10.683 9.741 11.142 1.00 64.01 C ATOM 1917 OG SER A 712 10.778 8.886 12.264 1.00 71.25 O ATOM 0 H SER A 712 8.078 9.878 12.483 1.00 72.23 H new ATOM 0 HA SER A 712 9.185 10.720 9.957 1.00 65.11 H new ATOM 0 HB2 SER A 712 11.222 9.303 10.301 1.00 64.01 H new ATOM 0 HB3 SER A 712 11.162 10.694 11.366 1.00 64.01 H new ATOM 0 HG SER A 712 11.721 8.749 12.492 1.00 71.25 H new ATOM 1923 N THR A 713 7.731 8.001 10.836 1.00 64.44 N ATOM 1924 CA THR A 713 7.160 6.788 10.250 1.00 21.21 C ATOM 1925 C THR A 713 5.614 6.802 10.181 1.00 62.23 C ATOM 1926 O THR A 713 4.919 6.766 11.200 1.00 13.02 O ATOM 1927 CB THR A 713 7.687 5.521 10.958 1.00 73.50 C ATOM 1928 OG1 THR A 713 9.130 5.546 10.908 1.00 30.41 O ATOM 1929 CG2 THR A 713 7.202 4.264 10.239 1.00 1.44 C ATOM 0 H THR A 713 7.404 8.235 11.773 1.00 64.44 H new ATOM 0 HA THR A 713 7.500 6.766 9.215 1.00 21.21 H new ATOM 0 HB THR A 713 7.324 5.505 11.986 1.00 73.50 H new ATOM 0 HG1 THR A 713 9.487 4.750 11.354 1.00 30.41 H new ATOM 0 HG21 THR A 713 7.583 3.381 10.752 1.00 1.44 H new ATOM 0 HG22 THR A 713 6.112 4.242 10.240 1.00 1.44 H new ATOM 0 HG23 THR A 713 7.564 4.270 9.211 1.00 1.44 H new ATOM 1935 N TYR A 714 5.105 6.843 8.965 1.00 41.14 N ATOM 1936 CA TYR A 714 3.677 6.863 8.702 1.00 71.21 C ATOM 1937 C TYR A 714 3.169 5.429 8.573 1.00 12.40 C ATOM 1938 O TYR A 714 3.724 4.633 7.801 1.00 41.50 O ATOM 1939 CB TYR A 714 3.385 7.630 7.385 1.00 4.44 C ATOM 1940 CG TYR A 714 3.750 9.123 7.381 1.00 21.42 C ATOM 1941 CD1 TYR A 714 5.028 9.554 7.717 1.00 14.33 C ATOM 1942 CD2 TYR A 714 2.808 10.092 7.033 1.00 15.54 C ATOM 1943 CE1 TYR A 714 5.361 10.887 7.710 1.00 61.31 C ATOM 1944 CE2 TYR A 714 3.138 11.434 7.015 1.00 20.10 C ATOM 1945 CZ TYR A 714 4.414 11.828 7.356 1.00 24.24 C ATOM 1946 OH TYR A 714 4.758 13.170 7.314 1.00 53.41 O ATOM 0 H TYR A 714 5.677 6.864 8.121 1.00 41.14 H new ATOM 0 HA TYR A 714 3.170 7.366 9.526 1.00 71.21 H new ATOM 0 HB2 TYR A 714 3.927 7.141 6.575 1.00 4.44 H new ATOM 0 HB3 TYR A 714 2.323 7.535 7.160 1.00 4.44 H new ATOM 0 HD1 TYR A 714 5.776 8.825 7.990 1.00 14.33 H new ATOM 0 HD2 TYR A 714 1.805 9.788 6.773 1.00 15.54 H new ATOM 0 HE1 TYR A 714 6.359 11.198 7.980 1.00 61.31 H new ATOM 0 HE2 TYR A 714 2.399 12.171 6.735 1.00 20.10 H new ATOM 0 HH TYR A 714 5.463 13.348 7.971 1.00 53.41 H new ATOM 1956 N ASN A 715 2.145 5.091 9.324 1.00 2.03 N ATOM 1957 CA ASN A 715 1.560 3.755 9.247 1.00 2.22 C ATOM 1958 C ASN A 715 0.214 3.839 8.576 1.00 12.02 C ATOM 1959 O ASN A 715 -0.513 4.834 8.734 1.00 11.13 O ATOM 1960 CB ASN A 715 1.395 3.092 10.647 1.00 53.41 C ATOM 1961 CG ASN A 715 0.818 1.674 10.577 1.00 31.03 C ATOM 1962 OD1 ASN A 715 -0.382 1.478 10.648 1.00 4.14 O ATOM 1963 ND2 ASN A 715 1.672 0.684 10.433 1.00 11.23 N ATOM 0 H ASN A 715 1.696 5.714 9.995 1.00 2.03 H new ATOM 0 HA ASN A 715 2.244 3.133 8.669 1.00 2.22 H new ATOM 0 HB2 ASN A 715 2.365 3.059 11.143 1.00 53.41 H new ATOM 0 HB3 ASN A 715 0.743 3.713 11.262 1.00 53.41 H new ATOM 0 HD21 ASN A 715 1.334 -0.277 10.378 1.00 11.23 H new ATOM 0 HD22 ASN A 715 2.672 0.877 10.376 1.00 11.23 H new ATOM 1969 N PHE A 716 -0.102 2.845 7.810 1.00 62.40 N ATOM 1970 CA PHE A 716 -1.379 2.746 7.189 1.00 20.42 C ATOM 1971 C PHE A 716 -2.045 1.440 7.511 1.00 33.11 C ATOM 1972 O PHE A 716 -1.439 0.366 7.430 1.00 22.51 O ATOM 1973 CB PHE A 716 -1.315 3.044 5.698 1.00 44.54 C ATOM 1974 CG PHE A 716 -1.049 4.498 5.435 1.00 40.22 C ATOM 1975 CD1 PHE A 716 -2.097 5.406 5.423 1.00 4.41 C ATOM 1976 CD2 PHE A 716 0.238 4.964 5.226 1.00 3.41 C ATOM 1977 CE1 PHE A 716 -1.866 6.746 5.208 1.00 1.12 C ATOM 1978 CE2 PHE A 716 0.472 6.306 5.006 1.00 14.42 C ATOM 1979 CZ PHE A 716 -0.580 7.196 4.998 1.00 20.40 C ATOM 0 H PHE A 716 0.528 2.072 7.597 1.00 62.40 H new ATOM 0 HA PHE A 716 -2.016 3.523 7.612 1.00 20.42 H new ATOM 0 HB2 PHE A 716 -0.531 2.442 5.239 1.00 44.54 H new ATOM 0 HB3 PHE A 716 -2.255 2.755 5.228 1.00 44.54 H new ATOM 0 HD1 PHE A 716 -3.107 5.058 5.584 1.00 4.41 H new ATOM 0 HD2 PHE A 716 1.066 4.271 5.235 1.00 3.41 H new ATOM 0 HE1 PHE A 716 -2.691 7.443 5.204 1.00 1.12 H new ATOM 0 HE2 PHE A 716 1.479 6.659 4.840 1.00 14.42 H new ATOM 0 HZ PHE A 716 -0.397 8.247 4.827 1.00 20.40 H new ATOM 1989 N ARG A 717 -3.274 1.546 7.890 1.00 2.41 N ATOM 1990 CA ARG A 717 -4.070 0.446 8.348 1.00 63.21 C ATOM 1991 C ARG A 717 -4.870 -0.092 7.162 1.00 23.21 C ATOM 1992 O ARG A 717 -5.707 0.603 6.629 1.00 12.22 O ATOM 1993 CB ARG A 717 -5.013 1.003 9.420 1.00 4.42 C ATOM 1994 CG ARG A 717 -5.795 -0.011 10.208 1.00 42.52 C ATOM 1995 CD ARG A 717 -4.884 -0.851 11.082 1.00 62.40 C ATOM 1996 NE ARG A 717 -5.659 -1.744 11.928 1.00 61.14 N ATOM 1997 CZ ARG A 717 -5.178 -2.585 12.831 1.00 71.23 C ATOM 1998 NH1 ARG A 717 -3.872 -2.659 13.063 1.00 54.40 N ATOM 1999 NH2 ARG A 717 -6.015 -3.343 13.516 1.00 23.22 N ATOM 0 H ARG A 717 -3.776 2.434 7.891 1.00 2.41 H new ATOM 0 HA ARG A 717 -3.465 -0.362 8.759 1.00 63.21 H new ATOM 0 HB2 ARG A 717 -4.425 1.599 10.117 1.00 4.42 H new ATOM 0 HB3 ARG A 717 -5.718 1.680 8.938 1.00 4.42 H new ATOM 0 HG2 ARG A 717 -6.531 0.498 10.830 1.00 42.52 H new ATOM 0 HG3 ARG A 717 -6.346 -0.658 9.526 1.00 42.52 H new ATOM 0 HD2 ARG A 717 -4.207 -1.432 10.456 1.00 62.40 H new ATOM 0 HD3 ARG A 717 -4.266 -0.201 11.702 1.00 62.40 H new ATOM 0 HE ARG A 717 -6.672 -1.720 11.815 1.00 61.14 H new ATOM 0 HH11 ARG A 717 -3.227 -2.064 12.543 1.00 54.40 H new ATOM 0 HH12 ARG A 717 -3.514 -3.311 13.761 1.00 54.40 H new ATOM 0 HH21 ARG A 717 -7.019 -3.276 13.347 1.00 23.22 H new ATOM 0 HH22 ARG A 717 -5.658 -3.995 14.214 1.00 23.22 H new ATOM 2011 N TRP A 718 -4.601 -1.297 6.741 1.00 52.52 N ATOM 2012 CA TRP A 718 -5.262 -1.838 5.566 1.00 11.14 C ATOM 2013 C TRP A 718 -6.015 -3.119 5.941 1.00 34.42 C ATOM 2014 O TRP A 718 -5.415 -4.084 6.416 1.00 43.23 O ATOM 2015 CB TRP A 718 -4.188 -2.143 4.511 1.00 22.14 C ATOM 2016 CG TRP A 718 -4.668 -2.419 3.106 1.00 64.23 C ATOM 2017 CD1 TRP A 718 -5.568 -3.353 2.699 1.00 44.15 C ATOM 2018 CD2 TRP A 718 -4.207 -1.767 1.909 1.00 61.14 C ATOM 2019 NE1 TRP A 718 -5.713 -3.308 1.333 1.00 70.21 N ATOM 2020 CE2 TRP A 718 -4.891 -2.348 0.830 1.00 41.42 C ATOM 2021 CE3 TRP A 718 -3.286 -0.740 1.648 1.00 25.22 C ATOM 2022 CZ2 TRP A 718 -4.686 -1.948 -0.481 1.00 70.53 C ATOM 2023 CZ3 TRP A 718 -3.087 -0.347 0.345 1.00 32.55 C ATOM 2024 CH2 TRP A 718 -3.783 -0.947 -0.702 1.00 13.13 C ATOM 0 H TRP A 718 -3.933 -1.927 7.185 1.00 52.52 H new ATOM 0 HA TRP A 718 -5.980 -1.121 5.169 1.00 11.14 H new ATOM 0 HB2 TRP A 718 -3.499 -1.299 4.474 1.00 22.14 H new ATOM 0 HB3 TRP A 718 -3.616 -3.007 4.850 1.00 22.14 H new ATOM 0 HD1 TRP A 718 -6.093 -4.032 3.354 1.00 44.15 H new ATOM 0 HE1 TRP A 718 -6.337 -3.900 0.784 1.00 70.21 H new ATOM 0 HE3 TRP A 718 -2.744 -0.268 2.454 1.00 25.22 H new ATOM 0 HZ2 TRP A 718 -5.220 -2.411 -1.298 1.00 70.53 H new ATOM 0 HZ3 TRP A 718 -2.379 0.440 0.130 1.00 32.55 H new ATOM 0 HH2 TRP A 718 -3.604 -0.613 -1.713 1.00 13.13 H new ATOM 2035 N TYR A 719 -7.314 -3.114 5.755 1.00 63.05 N ATOM 2036 CA TYR A 719 -8.124 -4.292 6.021 1.00 1.35 C ATOM 2037 C TYR A 719 -8.500 -4.950 4.715 1.00 34.30 C ATOM 2038 O TYR A 719 -9.290 -4.404 3.944 1.00 53.33 O ATOM 2039 CB TYR A 719 -9.383 -3.934 6.809 1.00 20.14 C ATOM 2040 CG TYR A 719 -9.102 -3.375 8.176 1.00 73.33 C ATOM 2041 CD1 TYR A 719 -8.621 -4.190 9.178 1.00 72.34 C ATOM 2042 CD2 TYR A 719 -9.327 -2.043 8.468 1.00 51.34 C ATOM 2043 CE1 TYR A 719 -8.369 -3.700 10.437 1.00 74.31 C ATOM 2044 CE2 TYR A 719 -9.076 -1.541 9.726 1.00 32.25 C ATOM 2045 CZ TYR A 719 -8.596 -2.378 10.705 1.00 50.34 C ATOM 2046 OH TYR A 719 -8.337 -1.890 11.961 1.00 20.13 O ATOM 0 H TYR A 719 -7.839 -2.307 5.419 1.00 63.05 H new ATOM 0 HA TYR A 719 -7.538 -4.984 6.626 1.00 1.35 H new ATOM 0 HB2 TYR A 719 -9.962 -3.206 6.241 1.00 20.14 H new ATOM 0 HB3 TYR A 719 -10.003 -4.825 6.911 1.00 20.14 H new ATOM 0 HD1 TYR A 719 -8.439 -5.234 8.970 1.00 72.34 H new ATOM 0 HD2 TYR A 719 -9.705 -1.386 7.699 1.00 51.34 H new ATOM 0 HE1 TYR A 719 -7.994 -4.355 11.210 1.00 74.31 H new ATOM 0 HE2 TYR A 719 -9.255 -0.498 9.941 1.00 32.25 H new ATOM 0 HH TYR A 719 -8.549 -0.934 11.990 1.00 20.13 H new ATOM 2056 N THR A 720 -7.919 -6.088 4.444 1.00 60.01 N ATOM 2057 CA THR A 720 -8.153 -6.756 3.192 1.00 45.02 C ATOM 2058 C THR A 720 -8.386 -8.241 3.355 1.00 11.24 C ATOM 2059 O THR A 720 -7.771 -8.894 4.201 1.00 61.33 O ATOM 2060 CB THR A 720 -7.042 -6.477 2.145 1.00 22.10 C ATOM 2061 OG1 THR A 720 -7.287 -7.211 0.934 1.00 60.22 O ATOM 2062 CG2 THR A 720 -5.674 -6.816 2.670 1.00 44.11 C ATOM 0 H THR A 720 -7.280 -6.572 5.074 1.00 60.01 H new ATOM 0 HA THR A 720 -9.076 -6.325 2.805 1.00 45.02 H new ATOM 0 HB THR A 720 -7.069 -5.408 1.934 1.00 22.10 H new ATOM 0 HG1 THR A 720 -7.167 -6.619 0.163 1.00 60.22 H new ATOM 0 HG21 THR A 720 -4.928 -6.605 1.904 1.00 44.11 H new ATOM 0 HG22 THR A 720 -5.465 -6.216 3.555 1.00 44.11 H new ATOM 0 HG23 THR A 720 -5.636 -7.873 2.932 1.00 44.11 H new ATOM 2068 N SER A 721 -9.270 -8.766 2.543 1.00 63.51 N ATOM 2069 CA SER A 721 -9.553 -10.168 2.533 1.00 43.20 C ATOM 2070 C SER A 721 -8.337 -10.939 1.968 1.00 1.24 C ATOM 2071 O SER A 721 -8.119 -12.109 2.302 1.00 10.21 O ATOM 2072 CB SER A 721 -10.809 -10.425 1.695 1.00 14.54 C ATOM 2073 OG SER A 721 -11.178 -11.790 1.689 1.00 15.42 O ATOM 0 H SER A 721 -9.813 -8.225 1.870 1.00 63.51 H new ATOM 0 HA SER A 721 -9.737 -10.520 3.548 1.00 43.20 H new ATOM 0 HB2 SER A 721 -11.633 -9.829 2.087 1.00 14.54 H new ATOM 0 HB3 SER A 721 -10.635 -10.093 0.671 1.00 14.54 H new ATOM 0 HG SER A 721 -11.984 -11.909 1.144 1.00 15.42 H new ATOM 2079 N TYR A 722 -7.523 -10.260 1.134 1.00 5.33 N ATOM 2080 CA TYR A 722 -6.349 -10.888 0.531 1.00 0.21 C ATOM 2081 C TYR A 722 -5.293 -11.228 1.561 1.00 63.22 C ATOM 2082 O TYR A 722 -4.621 -12.227 1.431 1.00 12.04 O ATOM 2083 CB TYR A 722 -5.706 -10.015 -0.547 1.00 11.15 C ATOM 2084 CG TYR A 722 -6.476 -9.858 -1.838 1.00 35.13 C ATOM 2085 CD1 TYR A 722 -6.421 -10.843 -2.814 1.00 3.45 C ATOM 2086 CD2 TYR A 722 -7.210 -8.716 -2.107 1.00 44.23 C ATOM 2087 CE1 TYR A 722 -7.075 -10.692 -4.019 1.00 41.52 C ATOM 2088 CE2 TYR A 722 -7.874 -8.568 -3.309 1.00 13.41 C ATOM 2089 CZ TYR A 722 -7.799 -9.554 -4.259 1.00 70.02 C ATOM 2090 OH TYR A 722 -8.435 -9.389 -5.466 1.00 61.31 O ATOM 0 H TYR A 722 -7.663 -9.285 0.870 1.00 5.33 H new ATOM 0 HA TYR A 722 -6.721 -11.804 0.073 1.00 0.21 H new ATOM 0 HB2 TYR A 722 -5.539 -9.023 -0.127 1.00 11.15 H new ATOM 0 HB3 TYR A 722 -4.726 -10.431 -0.783 1.00 11.15 H new ATOM 0 HD1 TYR A 722 -5.856 -11.744 -2.627 1.00 3.45 H new ATOM 0 HD2 TYR A 722 -7.264 -7.931 -1.368 1.00 44.23 H new ATOM 0 HE1 TYR A 722 -7.017 -11.467 -4.769 1.00 41.52 H new ATOM 0 HE2 TYR A 722 -8.452 -7.676 -3.501 1.00 13.41 H new ATOM 0 HH TYR A 722 -8.905 -8.529 -5.473 1.00 61.31 H new ATOM 2100 N ALA A 723 -5.192 -10.405 2.608 1.00 71.14 N ATOM 2101 CA ALA A 723 -4.136 -10.528 3.633 1.00 33.42 C ATOM 2102 C ALA A 723 -4.444 -11.593 4.659 1.00 42.55 C ATOM 2103 O ALA A 723 -3.884 -11.589 5.764 1.00 15.24 O ATOM 2104 CB ALA A 723 -3.962 -9.208 4.337 1.00 44.25 C ATOM 0 H ALA A 723 -5.837 -9.633 2.775 1.00 71.14 H new ATOM 0 HA ALA A 723 -3.221 -10.818 3.117 1.00 33.42 H new ATOM 0 HB1 ALA A 723 -3.183 -9.299 5.093 1.00 44.25 H new ATOM 0 HB2 ALA A 723 -3.678 -8.444 3.613 1.00 44.25 H new ATOM 0 HB3 ALA A 723 -4.900 -8.924 4.815 1.00 44.25 H new ATOM 2110 N CYS A 724 -5.268 -12.513 4.310 1.00 53.54 N ATOM 2111 CA CYS A 724 -5.656 -13.492 5.239 1.00 35.42 C ATOM 2112 C CYS A 724 -5.428 -14.871 4.647 1.00 51.22 C ATOM 2113 O CYS A 724 -5.892 -15.151 3.541 1.00 62.03 O ATOM 2114 CB CYS A 724 -7.117 -13.289 5.577 1.00 61.34 C ATOM 2115 SG CYS A 724 -7.669 -14.187 7.037 1.00 53.24 S ATOM 0 H CYS A 724 -5.684 -12.603 3.383 1.00 53.54 H new ATOM 0 HA CYS A 724 -5.063 -13.407 6.150 1.00 35.42 H new ATOM 0 HB2 CYS A 724 -7.299 -12.225 5.728 1.00 61.34 H new ATOM 0 HB3 CYS A 724 -7.722 -13.598 4.724 1.00 61.34 H new ATOM 2120 N PRO A 725 -4.677 -15.737 5.347 1.00 64.13 N ATOM 2121 CA PRO A 725 -4.425 -17.086 4.896 1.00 73.15 C ATOM 2122 C PRO A 725 -5.567 -18.025 5.293 1.00 1.24 C ATOM 2123 O PRO A 725 -6.550 -18.125 4.531 1.00 38.01 O ATOM 2124 CB PRO A 725 -3.115 -17.471 5.602 1.00 64.53 C ATOM 2125 CG PRO A 725 -2.989 -16.553 6.784 1.00 15.24 C ATOM 2126 CD PRO A 725 -4.012 -15.451 6.631 1.00 62.02 C ATOM 2127 OXT PRO A 725 -5.509 -18.637 6.378 1.00 38.01 O ATOM 0 HA PRO A 725 -4.353 -17.160 3.811 1.00 73.15 H new ATOM 0 HB2 PRO A 725 -3.136 -18.513 5.920 1.00 64.53 H new ATOM 0 HB3 PRO A 725 -2.264 -17.360 4.930 1.00 64.53 H new ATOM 0 HG2 PRO A 725 -3.155 -17.101 7.711 1.00 15.24 H new ATOM 0 HG3 PRO A 725 -1.984 -16.135 6.836 1.00 15.24 H new ATOM 0 HD2 PRO A 725 -4.725 -15.454 7.456 1.00 62.02 H new ATOM 0 HD3 PRO A 725 -3.539 -14.469 6.622 1.00 62.02 H new TER 2135 PRO A 725