USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=42 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 180:sc= 0 USER MOD Set 1.2: A 711 ASN : amide:sc= -1.9! C(o=-3.1!,f=-7.1!) USER MOD Set 1.3: A 715 ASN : amide:sc= -1.16! K(o=-3.1!,f=-7.1) USER MOD Set 2.1: A 681 ASN : amide:sc= 2.37 K(o=3.5,f=-8.2!) USER MOD Set 2.2: A 685 THR OG1 : rot 180:sc= 1.09 USER MOD Set 3.1: A 663 SER OG : rot 157:sc= 1.02 USER MOD Set 3.2: A 672 THR OG1 : rot -110:sc= 1.52 USER MOD Set 4.1: A 640 SER OG : rot 90:sc= 0.776 USER MOD Set 4.2: A 654 ASN : amide:sc= 0.276 K(o=-0.41,f=-4.4) USER MOD Set 4.3: A 677 THR OG1 : rot 180:sc= -1.46! USER MOD Set 5.1: A 591 ASN : amide:sc= 0.0487 K(o=0.088,f=-4.1!) USER MOD Set 5.2: A 661 LYS NZ :NH3+ -177:sc= 0.0398 (180deg=-0.214) USER MOD Single : A 585 SER OG : rot 99:sc= 0.0303 USER MOD Single : A 587 THR OG1 : rot 180:sc= 0 USER MOD Single : A 593 THR OG1 : rot -69:sc= 0.178 USER MOD Single : A 597 SER OG : rot 180:sc= 0.00696 USER MOD Single : A 598 GLN : amide:sc= 1.07 K(o=1.1,f=-0.77) USER MOD Single : A 602 SER OG : rot 24:sc= 0.00939 USER MOD Single : A 606 THR OG1 : rot -170:sc= -0.441 USER MOD Single : A 609 THR OG1 : rot -58:sc= 1.23 USER MOD Single : A 610 LYS NZ :NH3+ -166:sc= -0.03 (180deg=-0.204) USER MOD Single : A 611 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0781) USER MOD Single : A 614 TYR OH : rot 16:sc= -1.07! USER MOD Single : A 615 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 618 THR OG1 : rot -74:sc= 1.8 USER MOD Single : A 620 LYS NZ :NH3+ -170:sc= -0.0223 (180deg=-0.162) USER MOD Single : A 621 TYR OH : rot 180:sc= 0 USER MOD Single : A 624 HIS : no HE2:sc= -1.24 K(o=-1.2,f=-8!) USER MOD Single : A 626 ASN : amide:sc= 1.53 K(o=1.5,f=-6.6!) USER MOD Single : A 632 SER OG : rot 90:sc= 0.712 USER MOD Single : A 644 GLN : amide:sc= 0.0763 K(o=0.076,f=-2.4!) USER MOD Single : A 646 SER OG : rot 178:sc= 1.96 USER MOD Single : A 648 SER OG : rot 180:sc= 0 USER MOD Single : A 651 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.116) USER MOD Single : A 652 SER OG : rot -149:sc= -0.67 USER MOD Single : A 658 SER OG : rot 34:sc= 0.0897 USER MOD Single : A 659 ASN : amide:sc= -1.91! C(o=-1.9!,f=-7.2!) USER MOD Single : A 664 TYR OH : rot 180:sc= 0 USER MOD Single : A 665 TYR OH : rot 180:sc= 0 USER MOD Single : A 668 MET CE :methyl -142:sc= 0 (180deg=-0.449) USER MOD Single : A 670 GLN :FLIP amide:sc= -1.1 F(o=-3.1!,f=-1.1) USER MOD Single : A 673 TYR OH : rot -125:sc= 1.34 USER MOD Single : A 679 TYR OH : rot -173:sc= -0.553 USER MOD Single : A 680 ASN : amide:sc=-0.00995 X(o=-0.0099,f=-0.19) USER MOD Single : A 683 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 689 THR OG1 : rot 77:sc= 0.771 USER MOD Single : A 706 TYR OH : rot 180:sc= 0.37 USER MOD Single : A 707 GLN : amide:sc= -0.507 X(o=-0.51,f=-0.26) USER MOD Single : A 712 SER OG : rot -15:sc= 1.25 USER MOD Single : A 713 THR OG1 : rot 180:sc= 0 USER MOD Single : A 714 TYR OH : rot 180:sc= 0.769 USER MOD Single : A 719 TYR OH : rot 30:sc=-0.00751 USER MOD Single : A 720 THR OG1 : rot 118:sc= 1.22 USER MOD Single : A 721 SER OG : rot 180:sc= -0.331 USER MOD Single : A 722 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 578 -14.859 1.066 -14.023 1.00 40.51 N ATOM 2 CA GLU A 578 -15.942 1.298 -13.070 1.00 60.25 C ATOM 3 C GLU A 578 -17.111 0.391 -13.364 1.00 2.54 C ATOM 4 O GLU A 578 -17.491 0.207 -14.523 1.00 21.53 O ATOM 5 CB GLU A 578 -16.397 2.748 -13.117 1.00 62.12 C ATOM 6 CG GLU A 578 -15.322 3.746 -12.748 1.00 12.03 C ATOM 7 CD GLU A 578 -15.820 5.153 -12.832 1.00 11.52 C ATOM 8 OE1 GLU A 578 -15.750 5.750 -13.923 1.00 60.43 O ATOM 9 OE2 GLU A 578 -16.293 5.687 -11.817 1.00 4.34 O ATOM 0 HA GLU A 578 -15.563 1.078 -12.072 1.00 60.25 H new ATOM 0 HB2 GLU A 578 -16.756 2.972 -14.121 1.00 62.12 H new ATOM 0 HB3 GLU A 578 -17.242 2.874 -12.441 1.00 62.12 H new ATOM 0 HG2 GLU A 578 -14.970 3.544 -11.736 1.00 12.03 H new ATOM 0 HG3 GLU A 578 -14.467 3.622 -13.413 1.00 12.03 H new ATOM 18 N ALA A 579 -17.663 -0.173 -12.319 1.00 64.31 N ATOM 19 CA ALA A 579 -18.815 -1.044 -12.380 1.00 22.42 C ATOM 20 C ALA A 579 -19.578 -0.856 -11.089 1.00 61.31 C ATOM 21 O ALA A 579 -19.107 -0.135 -10.211 1.00 54.51 O ATOM 22 CB ALA A 579 -18.376 -2.498 -12.533 1.00 12.43 C ATOM 0 H ALA A 579 -17.313 -0.035 -11.371 1.00 64.31 H new ATOM 0 HA ALA A 579 -19.440 -0.801 -13.239 1.00 22.42 H new ATOM 0 HB1 ALA A 579 -19.255 -3.141 -12.577 1.00 12.43 H new ATOM 0 HB2 ALA A 579 -17.799 -2.609 -13.451 1.00 12.43 H new ATOM 0 HB3 ALA A 579 -17.760 -2.784 -11.680 1.00 12.43 H new ATOM 28 N GLU A 580 -20.724 -1.471 -10.943 1.00 11.24 N ATOM 29 CA GLU A 580 -21.481 -1.297 -9.720 1.00 61.35 C ATOM 30 C GLU A 580 -20.943 -2.190 -8.625 1.00 22.42 C ATOM 31 O GLU A 580 -20.221 -1.719 -7.739 1.00 33.34 O ATOM 32 CB GLU A 580 -22.966 -1.531 -9.933 1.00 32.15 C ATOM 33 CG GLU A 580 -23.597 -0.569 -10.897 1.00 4.21 C ATOM 34 CD GLU A 580 -25.071 -0.787 -11.028 1.00 2.30 C ATOM 35 OE1 GLU A 580 -25.832 -0.241 -10.204 1.00 3.22 O ATOM 36 OE2 GLU A 580 -25.498 -1.512 -11.958 1.00 4.41 O ATOM 0 H GLU A 580 -21.150 -2.085 -11.637 1.00 11.24 H new ATOM 0 HA GLU A 580 -21.361 -0.260 -9.408 1.00 61.35 H new ATOM 0 HB2 GLU A 580 -23.116 -2.547 -10.297 1.00 32.15 H new ATOM 0 HB3 GLU A 580 -23.478 -1.458 -8.973 1.00 32.15 H new ATOM 0 HG2 GLU A 580 -23.410 0.452 -10.564 1.00 4.21 H new ATOM 0 HG3 GLU A 580 -23.127 -0.676 -11.875 1.00 4.21 H new ATOM 43 N ALA A 581 -21.266 -3.469 -8.722 1.00 54.10 N ATOM 44 CA ALA A 581 -20.842 -4.508 -7.787 1.00 40.31 C ATOM 45 C ALA A 581 -21.481 -4.374 -6.419 1.00 41.02 C ATOM 46 O ALA A 581 -21.272 -3.387 -5.696 1.00 1.44 O ATOM 47 CB ALA A 581 -19.320 -4.610 -7.678 1.00 50.04 C ATOM 0 H ALA A 581 -21.850 -3.828 -9.477 1.00 54.10 H new ATOM 0 HA ALA A 581 -21.204 -5.444 -8.213 1.00 40.31 H new ATOM 0 HB1 ALA A 581 -19.058 -5.397 -6.971 1.00 50.04 H new ATOM 0 HB2 ALA A 581 -18.900 -4.846 -8.656 1.00 50.04 H new ATOM 0 HB3 ALA A 581 -18.916 -3.660 -7.330 1.00 50.04 H new ATOM 53 N GLU A 582 -22.273 -5.346 -6.078 1.00 20.44 N ATOM 54 CA GLU A 582 -22.847 -5.420 -4.766 1.00 63.42 C ATOM 55 C GLU A 582 -21.861 -6.162 -3.896 1.00 11.21 C ATOM 56 O GLU A 582 -21.237 -5.586 -3.000 1.00 72.45 O ATOM 57 CB GLU A 582 -24.176 -6.186 -4.801 1.00 71.15 C ATOM 58 CG GLU A 582 -25.230 -5.585 -5.703 1.00 15.44 C ATOM 59 CD GLU A 582 -25.613 -4.190 -5.298 1.00 32.52 C ATOM 60 OE1 GLU A 582 -26.377 -4.037 -4.322 1.00 34.55 O ATOM 61 OE2 GLU A 582 -25.163 -3.233 -5.942 1.00 24.12 O ATOM 0 H GLU A 582 -22.540 -6.109 -6.700 1.00 20.44 H new ATOM 0 HA GLU A 582 -23.046 -4.420 -4.381 1.00 63.42 H new ATOM 0 HB2 GLU A 582 -23.981 -7.209 -5.124 1.00 71.15 H new ATOM 0 HB3 GLU A 582 -24.574 -6.242 -3.788 1.00 71.15 H new ATOM 0 HG2 GLU A 582 -24.861 -5.573 -6.728 1.00 15.44 H new ATOM 0 HG3 GLU A 582 -26.117 -6.219 -5.691 1.00 15.44 H new ATOM 68 N PHE A 583 -21.699 -7.435 -4.218 1.00 12.05 N ATOM 69 CA PHE A 583 -20.789 -8.346 -3.562 1.00 30.32 C ATOM 70 C PHE A 583 -20.900 -9.696 -4.248 1.00 53.53 C ATOM 71 O PHE A 583 -22.001 -10.124 -4.608 1.00 22.54 O ATOM 72 CB PHE A 583 -21.074 -8.474 -2.033 1.00 12.20 C ATOM 73 CG PHE A 583 -22.454 -8.973 -1.669 1.00 71.11 C ATOM 74 CD1 PHE A 583 -23.509 -8.087 -1.513 1.00 10.21 C ATOM 75 CD2 PHE A 583 -22.689 -10.323 -1.480 1.00 22.02 C ATOM 76 CE1 PHE A 583 -24.764 -8.540 -1.178 1.00 5.31 C ATOM 77 CE2 PHE A 583 -23.943 -10.779 -1.146 1.00 13.51 C ATOM 78 CZ PHE A 583 -24.982 -9.888 -0.996 1.00 5.14 C ATOM 0 H PHE A 583 -22.222 -7.875 -4.975 1.00 12.05 H new ATOM 0 HA PHE A 583 -19.775 -7.956 -3.647 1.00 30.32 H new ATOM 0 HB2 PHE A 583 -20.336 -9.149 -1.599 1.00 12.20 H new ATOM 0 HB3 PHE A 583 -20.925 -7.498 -1.570 1.00 12.20 H new ATOM 0 HD1 PHE A 583 -23.344 -7.029 -1.656 1.00 10.21 H new ATOM 0 HD2 PHE A 583 -21.878 -11.027 -1.596 1.00 22.02 H new ATOM 0 HE1 PHE A 583 -25.577 -7.840 -1.058 1.00 5.31 H new ATOM 0 HE2 PHE A 583 -24.113 -11.836 -1.001 1.00 13.51 H new ATOM 0 HZ PHE A 583 -25.967 -10.246 -0.736 1.00 5.14 H new ATOM 88 N LEU A 584 -19.790 -10.340 -4.453 1.00 43.20 N ATOM 89 CA LEU A 584 -19.763 -11.644 -5.099 1.00 73.32 C ATOM 90 C LEU A 584 -18.422 -12.262 -4.807 1.00 1.02 C ATOM 91 O LEU A 584 -18.310 -13.177 -4.005 1.00 13.00 O ATOM 92 CB LEU A 584 -20.005 -11.497 -6.648 1.00 32.32 C ATOM 93 CG LEU A 584 -20.257 -12.782 -7.504 1.00 62.41 C ATOM 94 CD1 LEU A 584 -20.591 -12.394 -8.928 1.00 63.02 C ATOM 95 CD2 LEU A 584 -19.064 -13.735 -7.518 1.00 21.33 C ATOM 0 H LEU A 584 -18.872 -9.988 -4.182 1.00 43.20 H new ATOM 0 HA LEU A 584 -20.558 -12.284 -4.716 1.00 73.32 H new ATOM 0 HB2 LEU A 584 -20.862 -10.837 -6.786 1.00 32.32 H new ATOM 0 HB3 LEU A 584 -19.139 -10.986 -7.069 1.00 32.32 H new ATOM 0 HG LEU A 584 -21.091 -13.306 -7.038 1.00 62.41 H new ATOM 0 HD11 LEU A 584 -20.765 -13.293 -9.519 1.00 63.02 H new ATOM 0 HD12 LEU A 584 -21.488 -11.775 -8.936 1.00 63.02 H new ATOM 0 HD13 LEU A 584 -19.760 -11.834 -9.357 1.00 63.02 H new ATOM 0 HD21 LEU A 584 -19.301 -14.606 -8.128 1.00 21.33 H new ATOM 0 HD22 LEU A 584 -18.196 -13.225 -7.936 1.00 21.33 H new ATOM 0 HD23 LEU A 584 -18.842 -14.055 -6.500 1.00 21.33 H new ATOM 103 N SER A 585 -17.414 -11.743 -5.445 1.00 23.52 N ATOM 104 CA SER A 585 -16.076 -12.191 -5.241 1.00 72.31 C ATOM 105 C SER A 585 -15.302 -11.150 -4.457 1.00 2.32 C ATOM 106 O SER A 585 -14.161 -11.355 -4.098 1.00 51.45 O ATOM 107 CB SER A 585 -15.412 -12.497 -6.589 1.00 5.22 C ATOM 108 OG SER A 585 -15.494 -11.385 -7.479 1.00 33.12 O ATOM 0 H SER A 585 -17.503 -10.990 -6.127 1.00 23.52 H new ATOM 0 HA SER A 585 -16.082 -13.113 -4.660 1.00 72.31 H new ATOM 0 HB2 SER A 585 -14.366 -12.759 -6.429 1.00 5.22 H new ATOM 0 HB3 SER A 585 -15.892 -13.364 -7.043 1.00 5.22 H new ATOM 0 HG SER A 585 -14.646 -10.893 -7.467 1.00 33.12 H new ATOM 114 N ARG A 586 -15.942 -10.032 -4.221 1.00 32.21 N ATOM 115 CA ARG A 586 -15.389 -8.965 -3.442 1.00 23.03 C ATOM 116 C ARG A 586 -16.270 -8.733 -2.231 1.00 75.12 C ATOM 117 O ARG A 586 -17.501 -8.747 -2.349 1.00 54.33 O ATOM 118 CB ARG A 586 -15.331 -7.661 -4.252 1.00 13.13 C ATOM 119 CG ARG A 586 -14.719 -6.498 -3.473 1.00 24.51 C ATOM 120 CD ARG A 586 -14.886 -5.170 -4.188 1.00 15.40 C ATOM 121 NE ARG A 586 -14.274 -4.071 -3.423 1.00 11.22 N ATOM 122 CZ ARG A 586 -14.939 -3.173 -2.667 1.00 34.41 C ATOM 123 NH1 ARG A 586 -16.246 -3.281 -2.497 1.00 35.15 N ATOM 124 NH2 ARG A 586 -14.280 -2.182 -2.069 1.00 52.21 N ATOM 0 H ARG A 586 -16.879 -9.840 -4.574 1.00 32.21 H new ATOM 0 HA ARG A 586 -14.378 -9.244 -3.146 1.00 23.03 H new ATOM 0 HB2 ARG A 586 -14.750 -7.829 -5.159 1.00 13.13 H new ATOM 0 HB3 ARG A 586 -16.339 -7.390 -4.565 1.00 13.13 H new ATOM 0 HG2 ARG A 586 -15.184 -6.439 -2.489 1.00 24.51 H new ATOM 0 HG3 ARG A 586 -13.658 -6.690 -3.313 1.00 24.51 H new ATOM 0 HD2 ARG A 586 -14.430 -5.227 -5.176 1.00 15.40 H new ATOM 0 HD3 ARG A 586 -15.946 -4.966 -4.338 1.00 15.40 H new ATOM 0 HE ARG A 586 -13.259 -3.981 -3.469 1.00 11.22 H new ATOM 0 HH11 ARG A 586 -16.756 -4.046 -2.938 1.00 35.15 H new ATOM 0 HH12 ARG A 586 -16.744 -2.599 -1.924 1.00 35.15 H new ATOM 0 HH21 ARG A 586 -13.270 -2.100 -2.182 1.00 52.21 H new ATOM 0 HH22 ARG A 586 -14.786 -1.505 -1.498 1.00 52.21 H new ATOM 136 N THR A 587 -15.662 -8.543 -1.103 1.00 34.42 N ATOM 137 CA THR A 587 -16.369 -8.181 0.088 1.00 64.33 C ATOM 138 C THR A 587 -15.686 -6.936 0.637 1.00 32.24 C ATOM 139 O THR A 587 -14.451 -6.790 0.512 1.00 23.43 O ATOM 140 CB THR A 587 -16.352 -9.322 1.173 1.00 4.10 C ATOM 141 OG1 THR A 587 -17.326 -9.042 2.191 1.00 52.31 O ATOM 142 CG2 THR A 587 -15.010 -9.391 1.857 1.00 11.42 C ATOM 0 H THR A 587 -14.654 -8.635 -0.980 1.00 34.42 H new ATOM 0 HA THR A 587 -17.418 -8.005 -0.152 1.00 64.33 H new ATOM 0 HB THR A 587 -16.568 -10.261 0.664 1.00 4.10 H new ATOM 0 HG1 THR A 587 -17.312 -9.756 2.862 1.00 52.31 H new ATOM 0 HG21 THR A 587 -15.022 -10.186 2.602 1.00 11.42 H new ATOM 0 HG22 THR A 587 -14.235 -9.597 1.118 1.00 11.42 H new ATOM 0 HG23 THR A 587 -14.801 -8.439 2.345 1.00 11.42 H new ATOM 148 N GLU A 588 -16.432 -6.020 1.152 1.00 73.41 N ATOM 149 CA GLU A 588 -15.824 -4.888 1.772 1.00 64.24 C ATOM 150 C GLU A 588 -16.015 -5.037 3.266 1.00 41.31 C ATOM 151 O GLU A 588 -17.147 -5.092 3.755 1.00 31.12 O ATOM 152 CB GLU A 588 -16.402 -3.583 1.220 1.00 54.13 C ATOM 153 CG GLU A 588 -15.692 -2.323 1.701 1.00 11.31 C ATOM 154 CD GLU A 588 -16.163 -1.097 0.962 1.00 34.21 C ATOM 155 OE1 GLU A 588 -15.641 -0.828 -0.145 1.00 32.13 O ATOM 156 OE2 GLU A 588 -17.061 -0.388 1.455 1.00 53.11 O ATOM 0 H GLU A 588 -17.452 -6.029 1.158 1.00 73.41 H new ATOM 0 HA GLU A 588 -14.757 -4.843 1.552 1.00 64.24 H new ATOM 0 HB2 GLU A 588 -16.361 -3.614 0.131 1.00 54.13 H new ATOM 0 HB3 GLU A 588 -17.454 -3.520 1.498 1.00 54.13 H new ATOM 0 HG2 GLU A 588 -15.867 -2.193 2.769 1.00 11.31 H new ATOM 0 HG3 GLU A 588 -14.617 -2.438 1.566 1.00 11.31 H new ATOM 163 N GLY A 589 -14.922 -5.114 3.976 1.00 70.22 N ATOM 164 CA GLY A 589 -14.965 -5.414 5.376 1.00 32.52 C ATOM 165 C GLY A 589 -15.056 -4.203 6.257 1.00 64.33 C ATOM 166 O GLY A 589 -15.746 -3.225 5.937 1.00 73.42 O ATOM 0 H GLY A 589 -13.984 -4.971 3.601 1.00 70.22 H new ATOM 0 HA2 GLY A 589 -15.821 -6.059 5.573 1.00 32.52 H new ATOM 0 HA3 GLY A 589 -14.072 -5.979 5.644 1.00 32.52 H new ATOM 170 N ASP A 590 -14.374 -4.260 7.363 1.00 5.44 N ATOM 171 CA ASP A 590 -14.429 -3.215 8.349 1.00 52.14 C ATOM 172 C ASP A 590 -13.056 -2.517 8.401 1.00 21.15 C ATOM 173 O ASP A 590 -12.275 -2.605 7.445 1.00 32.54 O ATOM 174 CB ASP A 590 -14.830 -3.838 9.717 1.00 62.33 C ATOM 175 CG ASP A 590 -15.182 -2.818 10.793 1.00 1.41 C ATOM 176 OD1 ASP A 590 -16.335 -2.351 10.835 1.00 31.42 O ATOM 177 OD2 ASP A 590 -14.298 -2.465 11.602 1.00 4.11 O ATOM 0 H ASP A 590 -13.760 -5.036 7.610 1.00 5.44 H new ATOM 0 HA ASP A 590 -15.177 -2.464 8.096 1.00 52.14 H new ATOM 0 HB2 ASP A 590 -15.684 -4.498 9.566 1.00 62.33 H new ATOM 0 HB3 ASP A 590 -14.008 -4.458 10.075 1.00 62.33 H new ATOM 182 N ASN A 591 -12.772 -1.839 9.481 1.00 14.13 N ATOM 183 CA ASN A 591 -11.575 -1.063 9.626 1.00 75.43 C ATOM 184 C ASN A 591 -10.418 -1.953 10.020 1.00 64.22 C ATOM 185 O ASN A 591 -10.451 -2.601 11.077 1.00 61.03 O ATOM 186 CB ASN A 591 -11.774 0.042 10.674 1.00 63.53 C ATOM 187 CG ASN A 591 -12.949 0.960 10.355 1.00 44.10 C ATOM 188 OD1 ASN A 591 -12.811 1.956 9.647 1.00 62.05 O ATOM 189 ND2 ASN A 591 -14.110 0.631 10.879 1.00 22.25 N ATOM 0 H ASN A 591 -13.380 -1.812 10.299 1.00 14.13 H new ATOM 0 HA ASN A 591 -11.348 -0.596 8.668 1.00 75.43 H new ATOM 0 HB2 ASN A 591 -11.932 -0.415 11.651 1.00 63.53 H new ATOM 0 HB3 ASN A 591 -10.863 0.637 10.744 1.00 63.53 H new ATOM 0 HD21 ASN A 591 -14.931 1.209 10.702 1.00 22.25 H new ATOM 0 HD22 ASN A 591 -14.189 -0.202 11.462 1.00 22.25 H new ATOM 195 N CYS A 592 -9.427 -2.030 9.134 1.00 32.21 N ATOM 196 CA CYS A 592 -8.187 -2.807 9.325 1.00 30.02 C ATOM 197 C CYS A 592 -8.417 -4.297 9.334 1.00 2.20 C ATOM 198 O CYS A 592 -7.471 -5.083 9.444 1.00 60.25 O ATOM 199 CB CYS A 592 -7.442 -2.383 10.581 1.00 33.52 C ATOM 200 SG CYS A 592 -6.865 -0.672 10.563 1.00 40.43 S ATOM 0 H CYS A 592 -9.457 -1.544 8.238 1.00 32.21 H new ATOM 0 HA CYS A 592 -7.566 -2.581 8.458 1.00 30.02 H new ATOM 0 HB2 CYS A 592 -8.096 -2.524 11.442 1.00 33.52 H new ATOM 0 HB3 CYS A 592 -6.585 -3.042 10.720 1.00 33.52 H new ATOM 205 N THR A 593 -9.644 -4.698 9.174 1.00 41.23 N ATOM 206 CA THR A 593 -9.973 -6.074 9.191 1.00 35.14 C ATOM 207 C THR A 593 -10.935 -6.375 8.075 1.00 72.53 C ATOM 208 O THR A 593 -11.780 -5.546 7.729 1.00 1.03 O ATOM 209 CB THR A 593 -10.612 -6.439 10.552 1.00 3.41 C ATOM 210 OG1 THR A 593 -11.630 -5.470 10.877 1.00 42.53 O ATOM 211 CG2 THR A 593 -9.577 -6.468 11.659 1.00 52.53 C ATOM 0 H THR A 593 -10.437 -4.073 9.029 1.00 41.23 H new ATOM 0 HA THR A 593 -9.068 -6.666 9.053 1.00 35.14 H new ATOM 0 HB THR A 593 -11.049 -7.434 10.467 1.00 3.41 H new ATOM 0 HG1 THR A 593 -11.209 -4.607 11.075 1.00 42.53 H new ATOM 0 HG21 THR A 593 -10.059 -6.728 12.601 1.00 52.53 H new ATOM 0 HG22 THR A 593 -8.815 -7.211 11.425 1.00 52.53 H new ATOM 0 HG23 THR A 593 -9.112 -5.486 11.748 1.00 52.53 H new ATOM 217 N VAL A 594 -10.798 -7.522 7.501 1.00 64.04 N ATOM 218 CA VAL A 594 -11.689 -7.938 6.480 1.00 55.23 C ATOM 219 C VAL A 594 -12.209 -9.325 6.768 1.00 70.31 C ATOM 220 O VAL A 594 -11.439 -10.230 7.095 1.00 0.44 O ATOM 221 CB VAL A 594 -11.044 -7.866 5.059 1.00 20.13 C ATOM 222 CG1 VAL A 594 -9.834 -8.787 4.912 1.00 21.23 C ATOM 223 CG2 VAL A 594 -12.077 -8.131 3.979 1.00 64.13 C ATOM 0 H VAL A 594 -10.065 -8.194 7.728 1.00 64.04 H new ATOM 0 HA VAL A 594 -12.527 -7.241 6.478 1.00 55.23 H new ATOM 0 HB VAL A 594 -10.672 -6.849 4.933 1.00 20.13 H new ATOM 0 HG11 VAL A 594 -9.427 -8.695 3.905 1.00 21.23 H new ATOM 0 HG12 VAL A 594 -9.072 -8.505 5.638 1.00 21.23 H new ATOM 0 HG13 VAL A 594 -10.139 -9.819 5.088 1.00 21.23 H new ATOM 0 HG21 VAL A 594 -11.602 -8.075 3.000 1.00 64.13 H new ATOM 0 HG22 VAL A 594 -12.503 -9.124 4.119 1.00 64.13 H new ATOM 0 HG23 VAL A 594 -12.869 -7.384 4.042 1.00 64.13 H new ATOM 229 N PHE A 595 -13.480 -9.486 6.723 1.00 15.44 N ATOM 230 CA PHE A 595 -14.046 -10.784 6.800 1.00 54.55 C ATOM 231 C PHE A 595 -14.766 -11.076 5.530 1.00 31.40 C ATOM 232 O PHE A 595 -15.576 -10.271 5.071 1.00 11.03 O ATOM 233 CB PHE A 595 -14.962 -10.981 8.015 1.00 62.24 C ATOM 234 CG PHE A 595 -15.624 -12.332 8.006 1.00 15.44 C ATOM 235 CD1 PHE A 595 -14.860 -13.479 7.945 1.00 13.22 C ATOM 236 CD2 PHE A 595 -16.996 -12.453 8.034 1.00 23.04 C ATOM 237 CE1 PHE A 595 -15.436 -14.716 7.910 1.00 51.13 C ATOM 238 CE2 PHE A 595 -17.587 -13.697 8.004 1.00 11.54 C ATOM 239 CZ PHE A 595 -16.798 -14.831 7.939 1.00 40.13 C ATOM 0 H PHE A 595 -14.156 -8.727 6.632 1.00 15.44 H new ATOM 0 HA PHE A 595 -13.229 -11.492 6.938 1.00 54.55 H new ATOM 0 HB2 PHE A 595 -14.381 -10.868 8.930 1.00 62.24 H new ATOM 0 HB3 PHE A 595 -15.725 -10.203 8.024 1.00 62.24 H new ATOM 0 HD1 PHE A 595 -13.783 -13.396 7.925 1.00 13.22 H new ATOM 0 HD2 PHE A 595 -17.612 -11.567 8.080 1.00 23.04 H new ATOM 0 HE1 PHE A 595 -14.818 -15.600 7.860 1.00 51.13 H new ATOM 0 HE2 PHE A 595 -18.663 -13.786 8.031 1.00 11.54 H new ATOM 0 HZ PHE A 595 -17.258 -15.808 7.911 1.00 40.13 H new ATOM 249 N ASP A 596 -14.461 -12.196 4.945 1.00 63.13 N ATOM 250 CA ASP A 596 -15.103 -12.565 3.737 1.00 21.22 C ATOM 251 C ASP A 596 -15.961 -13.768 3.985 1.00 25.14 C ATOM 252 O ASP A 596 -15.464 -14.820 4.417 1.00 72.14 O ATOM 253 CB ASP A 596 -14.100 -12.881 2.653 1.00 33.02 C ATOM 254 CG ASP A 596 -14.757 -12.921 1.280 1.00 34.54 C ATOM 255 OD1 ASP A 596 -15.992 -13.144 1.201 1.00 74.34 O ATOM 256 OD2 ASP A 596 -14.066 -12.705 0.283 1.00 35.40 O ATOM 0 H ASP A 596 -13.771 -12.863 5.291 1.00 63.13 H new ATOM 0 HA ASP A 596 -15.711 -11.725 3.401 1.00 21.22 H new ATOM 0 HB2 ASP A 596 -13.309 -12.131 2.657 1.00 33.02 H new ATOM 0 HB3 ASP A 596 -13.629 -13.842 2.860 1.00 33.02 H new ATOM 261 N SER A 597 -17.225 -13.625 3.715 1.00 54.21 N ATOM 262 CA SER A 597 -18.177 -14.676 3.885 1.00 65.43 C ATOM 263 C SER A 597 -17.947 -15.844 2.901 1.00 60.01 C ATOM 264 O SER A 597 -18.310 -16.987 3.206 1.00 62.44 O ATOM 265 CB SER A 597 -19.583 -14.100 3.761 1.00 73.23 C ATOM 266 OG SER A 597 -19.720 -13.369 2.551 1.00 45.31 O ATOM 0 H SER A 597 -17.628 -12.756 3.364 1.00 54.21 H new ATOM 0 HA SER A 597 -18.050 -15.101 4.881 1.00 65.43 H new ATOM 0 HB2 SER A 597 -20.316 -14.906 3.790 1.00 73.23 H new ATOM 0 HB3 SER A 597 -19.791 -13.450 4.610 1.00 73.23 H new ATOM 0 HG SER A 597 -20.629 -13.008 2.488 1.00 45.31 H new ATOM 272 N GLN A 598 -17.329 -15.576 1.735 1.00 53.01 N ATOM 273 CA GLN A 598 -17.080 -16.632 0.786 1.00 74.41 C ATOM 274 C GLN A 598 -15.854 -17.415 1.207 1.00 74.42 C ATOM 275 O GLN A 598 -15.808 -18.638 1.076 1.00 75.31 O ATOM 276 CB GLN A 598 -16.877 -16.093 -0.647 1.00 11.11 C ATOM 277 CG GLN A 598 -15.649 -15.228 -0.814 1.00 35.42 C ATOM 278 CD GLN A 598 -15.415 -14.679 -2.194 1.00 54.04 C ATOM 279 OE1 GLN A 598 -15.772 -15.284 -3.206 1.00 64.01 O ATOM 280 NE2 GLN A 598 -14.807 -13.519 -2.239 1.00 22.24 N ATOM 0 H GLN A 598 -17.006 -14.652 1.448 1.00 53.01 H new ATOM 0 HA GLN A 598 -17.958 -17.277 0.776 1.00 74.41 H new ATOM 0 HB2 GLN A 598 -16.810 -16.936 -1.334 1.00 11.11 H new ATOM 0 HB3 GLN A 598 -17.756 -15.516 -0.934 1.00 11.11 H new ATOM 0 HG2 GLN A 598 -15.720 -14.392 -0.119 1.00 35.42 H new ATOM 0 HG3 GLN A 598 -14.775 -15.811 -0.523 1.00 35.42 H new ATOM 0 HE21 GLN A 598 -14.530 -13.055 -1.374 1.00 22.24 H new ATOM 0 HE22 GLN A 598 -14.611 -13.080 -3.139 1.00 22.24 H new ATOM 288 N ALA A 599 -14.860 -16.711 1.749 1.00 51.12 N ATOM 289 CA ALA A 599 -13.618 -17.358 2.100 1.00 41.21 C ATOM 290 C ALA A 599 -13.716 -17.996 3.462 1.00 3.32 C ATOM 291 O ALA A 599 -12.997 -18.945 3.760 1.00 4.12 O ATOM 292 CB ALA A 599 -12.486 -16.340 2.105 1.00 72.12 C ATOM 0 H ALA A 599 -14.898 -15.711 1.948 1.00 51.12 H new ATOM 0 HA ALA A 599 -13.415 -18.132 1.359 1.00 41.21 H new ATOM 0 HB1 ALA A 599 -11.552 -16.836 2.371 1.00 72.12 H new ATOM 0 HB2 ALA A 599 -12.392 -15.896 1.114 1.00 72.12 H new ATOM 0 HB3 ALA A 599 -12.702 -15.559 2.834 1.00 72.12 H new ATOM 298 N GLY A 600 -14.650 -17.505 4.258 1.00 15.33 N ATOM 299 CA GLY A 600 -14.877 -18.041 5.584 1.00 14.05 C ATOM 300 C GLY A 600 -13.761 -17.690 6.560 1.00 75.31 C ATOM 301 O GLY A 600 -13.644 -18.301 7.615 1.00 53.03 O ATOM 0 H GLY A 600 -15.265 -16.732 4.005 1.00 15.33 H new ATOM 0 HA2 GLY A 600 -15.823 -17.660 5.968 1.00 14.05 H new ATOM 0 HA3 GLY A 600 -14.972 -19.125 5.522 1.00 14.05 H new ATOM 305 N PHE A 601 -12.954 -16.701 6.215 1.00 73.50 N ATOM 306 CA PHE A 601 -11.849 -16.292 7.065 1.00 34.51 C ATOM 307 C PHE A 601 -11.816 -14.789 7.211 1.00 62.11 C ATOM 308 O PHE A 601 -12.218 -14.046 6.292 1.00 72.41 O ATOM 309 CB PHE A 601 -10.486 -16.790 6.541 1.00 31.11 C ATOM 310 CG PHE A 601 -10.303 -18.287 6.532 1.00 70.25 C ATOM 311 CD1 PHE A 601 -10.094 -18.979 7.714 1.00 72.22 C ATOM 312 CD2 PHE A 601 -10.337 -18.996 5.345 1.00 42.13 C ATOM 313 CE1 PHE A 601 -9.921 -20.349 7.709 1.00 31.51 C ATOM 314 CE2 PHE A 601 -10.164 -20.367 5.333 1.00 75.14 C ATOM 315 CZ PHE A 601 -9.957 -21.044 6.516 1.00 53.31 C ATOM 0 H PHE A 601 -13.044 -16.166 5.351 1.00 73.50 H new ATOM 0 HA PHE A 601 -12.019 -16.752 8.039 1.00 34.51 H new ATOM 0 HB2 PHE A 601 -10.349 -16.418 5.526 1.00 31.11 H new ATOM 0 HB3 PHE A 601 -9.698 -16.349 7.151 1.00 31.11 H new ATOM 0 HD1 PHE A 601 -10.066 -18.441 8.650 1.00 72.22 H new ATOM 0 HD2 PHE A 601 -10.501 -18.471 4.415 1.00 42.13 H new ATOM 0 HE1 PHE A 601 -9.758 -20.877 8.637 1.00 31.51 H new ATOM 0 HE2 PHE A 601 -10.191 -20.907 4.398 1.00 75.14 H new ATOM 0 HZ PHE A 601 -9.823 -22.116 6.510 1.00 53.31 H new ATOM 325 N SER A 602 -11.358 -14.343 8.349 1.00 73.51 N ATOM 326 CA SER A 602 -11.248 -12.951 8.649 1.00 50.50 C ATOM 327 C SER A 602 -9.777 -12.615 8.865 1.00 14.52 C ATOM 328 O SER A 602 -9.058 -13.355 9.534 1.00 4.32 O ATOM 329 CB SER A 602 -12.077 -12.617 9.903 1.00 73.52 C ATOM 330 OG SER A 602 -12.073 -11.219 10.170 1.00 74.54 O ATOM 0 H SER A 602 -11.046 -14.953 9.105 1.00 73.51 H new ATOM 0 HA SER A 602 -11.636 -12.356 7.822 1.00 50.50 H new ATOM 0 HB2 SER A 602 -13.102 -12.960 9.765 1.00 73.52 H new ATOM 0 HB3 SER A 602 -11.674 -13.154 10.761 1.00 73.52 H new ATOM 0 HG SER A 602 -11.891 -10.728 9.341 1.00 74.54 H new ATOM 336 N PHE A 603 -9.331 -11.525 8.290 1.00 61.23 N ATOM 337 CA PHE A 603 -7.942 -11.136 8.378 1.00 24.13 C ATOM 338 C PHE A 603 -7.782 -9.704 8.873 1.00 5.20 C ATOM 339 O PHE A 603 -8.452 -8.788 8.384 1.00 1.41 O ATOM 340 CB PHE A 603 -7.248 -11.309 7.016 1.00 42.12 C ATOM 341 CG PHE A 603 -7.168 -12.738 6.530 1.00 45.50 C ATOM 342 CD1 PHE A 603 -6.081 -13.527 6.875 1.00 4.12 C ATOM 343 CD2 PHE A 603 -8.170 -13.297 5.725 1.00 54.04 C ATOM 344 CE1 PHE A 603 -5.983 -14.830 6.439 1.00 40.21 C ATOM 345 CE2 PHE A 603 -8.068 -14.603 5.293 1.00 53.32 C ATOM 346 CZ PHE A 603 -6.976 -15.367 5.649 1.00 41.02 C ATOM 0 H PHE A 603 -9.915 -10.885 7.751 1.00 61.23 H new ATOM 0 HA PHE A 603 -7.466 -11.791 9.108 1.00 24.13 H new ATOM 0 HB2 PHE A 603 -7.781 -10.715 6.273 1.00 42.12 H new ATOM 0 HB3 PHE A 603 -6.238 -10.904 7.083 1.00 42.12 H new ATOM 0 HD1 PHE A 603 -5.299 -13.114 7.495 1.00 4.12 H new ATOM 0 HD2 PHE A 603 -9.026 -12.702 5.442 1.00 54.04 H new ATOM 0 HE1 PHE A 603 -5.129 -15.430 6.716 1.00 40.21 H new ATOM 0 HE2 PHE A 603 -8.845 -15.028 4.675 1.00 53.32 H new ATOM 0 HZ PHE A 603 -6.899 -16.389 5.308 1.00 41.02 H new ATOM 356 N ASP A 604 -6.910 -9.531 9.846 1.00 73.22 N ATOM 357 CA ASP A 604 -6.572 -8.221 10.395 1.00 42.41 C ATOM 358 C ASP A 604 -5.229 -7.790 9.846 1.00 42.11 C ATOM 359 O ASP A 604 -4.213 -8.456 10.032 1.00 54.01 O ATOM 360 CB ASP A 604 -6.552 -8.236 11.955 1.00 72.21 C ATOM 361 CG ASP A 604 -5.492 -9.120 12.569 1.00 51.42 C ATOM 362 OD1 ASP A 604 -5.665 -10.361 12.566 1.00 51.43 O ATOM 363 OD2 ASP A 604 -4.472 -8.591 13.060 1.00 4.04 O ATOM 0 H ASP A 604 -6.407 -10.301 10.287 1.00 73.22 H new ATOM 0 HA ASP A 604 -7.339 -7.507 10.095 1.00 42.41 H new ATOM 0 HB2 ASP A 604 -6.406 -7.217 12.312 1.00 72.21 H new ATOM 0 HB3 ASP A 604 -7.528 -8.562 12.313 1.00 72.21 H new ATOM 368 N LEU A 605 -5.232 -6.721 9.114 1.00 41.22 N ATOM 369 CA LEU A 605 -4.002 -6.186 8.546 1.00 10.22 C ATOM 370 C LEU A 605 -3.605 -4.939 9.295 1.00 51.23 C ATOM 371 O LEU A 605 -2.809 -4.127 8.849 1.00 70.23 O ATOM 372 CB LEU A 605 -4.130 -5.955 7.043 1.00 20.32 C ATOM 373 CG LEU A 605 -4.404 -7.219 6.206 1.00 15.23 C ATOM 374 CD1 LEU A 605 -4.366 -6.910 4.734 1.00 3.02 C ATOM 375 CD2 LEU A 605 -3.411 -8.318 6.533 1.00 74.42 C ATOM 0 H LEU A 605 -6.071 -6.187 8.886 1.00 41.22 H new ATOM 0 HA LEU A 605 -3.204 -6.919 8.664 1.00 10.22 H new ATOM 0 HB2 LEU A 605 -4.935 -5.242 6.869 1.00 20.32 H new ATOM 0 HB3 LEU A 605 -3.211 -5.493 6.683 1.00 20.32 H new ATOM 0 HG LEU A 605 -5.404 -7.570 6.462 1.00 15.23 H new ATOM 0 HD11 LEU A 605 -4.563 -7.819 4.166 1.00 3.02 H new ATOM 0 HD12 LEU A 605 -5.125 -6.164 4.499 1.00 3.02 H new ATOM 0 HD13 LEU A 605 -3.382 -6.522 4.469 1.00 3.02 H new ATOM 0 HD21 LEU A 605 -3.629 -9.197 5.927 1.00 74.42 H new ATOM 0 HD22 LEU A 605 -2.400 -7.971 6.318 1.00 74.42 H new ATOM 0 HD23 LEU A 605 -3.489 -8.576 7.589 1.00 74.42 H new ATOM 383 N THR A 606 -4.144 -4.865 10.457 1.00 62.32 N ATOM 384 CA THR A 606 -3.978 -3.827 11.401 1.00 41.20 C ATOM 385 C THR A 606 -2.466 -3.616 11.767 1.00 12.43 C ATOM 386 O THR A 606 -1.988 -2.492 11.733 1.00 1.31 O ATOM 387 CB THR A 606 -4.770 -4.238 12.641 1.00 3.31 C ATOM 388 OG1 THR A 606 -5.955 -4.921 12.197 1.00 14.33 O ATOM 389 CG2 THR A 606 -5.213 -3.035 13.399 1.00 21.23 C ATOM 0 H THR A 606 -4.768 -5.596 10.799 1.00 62.32 H new ATOM 0 HA THR A 606 -4.334 -2.882 10.991 1.00 41.20 H new ATOM 0 HB THR A 606 -4.143 -4.864 13.277 1.00 3.31 H new ATOM 0 HG1 THR A 606 -6.558 -5.057 12.957 1.00 14.33 H new ATOM 0 HG21 THR A 606 -5.776 -3.346 14.279 1.00 21.23 H new ATOM 0 HG22 THR A 606 -4.341 -2.460 13.711 1.00 21.23 H new ATOM 0 HG23 THR A 606 -5.847 -2.417 12.763 1.00 21.23 H new ATOM 395 N PRO A 607 -1.683 -4.706 12.114 1.00 30.51 N ATOM 396 CA PRO A 607 -0.241 -4.590 12.442 1.00 4.42 C ATOM 397 C PRO A 607 0.582 -3.979 11.303 1.00 42.11 C ATOM 398 O PRO A 607 1.682 -3.475 11.512 1.00 54.11 O ATOM 399 CB PRO A 607 0.196 -6.046 12.689 1.00 33.33 C ATOM 400 CG PRO A 607 -0.874 -6.879 12.081 1.00 41.21 C ATOM 401 CD PRO A 607 -2.131 -6.104 12.262 1.00 32.22 C ATOM 0 HA PRO A 607 -0.081 -3.928 13.293 1.00 4.42 H new ATOM 0 HB2 PRO A 607 1.163 -6.251 12.230 1.00 33.33 H new ATOM 0 HB3 PRO A 607 0.298 -6.252 13.755 1.00 33.33 H new ATOM 0 HG2 PRO A 607 -0.675 -7.064 11.025 1.00 41.21 H new ATOM 0 HG3 PRO A 607 -0.939 -7.852 12.568 1.00 41.21 H new ATOM 0 HD2 PRO A 607 -2.880 -6.369 11.515 1.00 32.22 H new ATOM 0 HD3 PRO A 607 -2.578 -6.283 13.240 1.00 32.22 H new ATOM 409 N LEU A 608 0.029 -4.028 10.111 1.00 21.22 N ATOM 410 CA LEU A 608 0.678 -3.527 8.922 1.00 24.22 C ATOM 411 C LEU A 608 0.750 -2.002 8.890 1.00 41.55 C ATOM 412 O LEU A 608 1.484 -1.439 8.086 1.00 31.53 O ATOM 413 CB LEU A 608 0.010 -4.067 7.647 1.00 30.11 C ATOM 414 CG LEU A 608 0.260 -5.539 7.266 1.00 0.31 C ATOM 415 CD1 LEU A 608 -0.274 -6.507 8.302 1.00 0.03 C ATOM 416 CD2 LEU A 608 -0.335 -5.828 5.905 1.00 32.24 C ATOM 0 H LEU A 608 -0.896 -4.422 9.939 1.00 21.22 H new ATOM 0 HA LEU A 608 1.703 -3.895 8.955 1.00 24.22 H new ATOM 0 HB2 LEU A 608 -1.066 -3.927 7.749 1.00 30.11 H new ATOM 0 HB3 LEU A 608 0.334 -3.446 6.812 1.00 30.11 H new ATOM 0 HG LEU A 608 1.339 -5.688 7.228 1.00 0.31 H new ATOM 0 HD11 LEU A 608 -0.071 -7.529 7.983 1.00 0.03 H new ATOM 0 HD12 LEU A 608 0.214 -6.322 9.259 1.00 0.03 H new ATOM 0 HD13 LEU A 608 -1.350 -6.367 8.410 1.00 0.03 H new ATOM 0 HD21 LEU A 608 -0.154 -6.870 5.643 1.00 32.24 H new ATOM 0 HD22 LEU A 608 -1.409 -5.641 5.930 1.00 32.24 H new ATOM 0 HD23 LEU A 608 0.129 -5.181 5.160 1.00 32.24 H new ATOM 424 N THR A 609 -0.012 -1.352 9.748 1.00 53.11 N ATOM 425 CA THR A 609 0.006 0.118 9.846 1.00 41.13 C ATOM 426 C THR A 609 1.367 0.604 10.371 1.00 20.14 C ATOM 427 O THR A 609 1.898 0.056 11.341 1.00 2.14 O ATOM 428 CB THR A 609 -1.110 0.609 10.798 1.00 25.05 C ATOM 429 OG1 THR A 609 -2.378 0.054 10.396 1.00 51.23 O ATOM 430 CG2 THR A 609 -1.214 2.126 10.775 1.00 22.33 C ATOM 0 H THR A 609 -0.657 -1.808 10.394 1.00 53.11 H new ATOM 0 HA THR A 609 -0.164 0.526 8.849 1.00 41.13 H new ATOM 0 HB THR A 609 -0.859 0.282 11.807 1.00 25.05 H new ATOM 0 HG1 THR A 609 -2.571 0.315 9.471 1.00 51.23 H new ATOM 0 HG21 THR A 609 -2.006 2.447 11.452 1.00 22.33 H new ATOM 0 HG22 THR A 609 -0.266 2.561 11.093 1.00 22.33 H new ATOM 0 HG23 THR A 609 -1.445 2.460 9.763 1.00 22.33 H new ATOM 436 N LYS A 610 1.931 1.616 9.724 1.00 43.13 N ATOM 437 CA LYS A 610 3.199 2.162 10.143 1.00 51.23 C ATOM 438 C LYS A 610 3.178 3.680 10.188 1.00 74.05 C ATOM 439 O LYS A 610 2.574 4.320 9.347 1.00 62.21 O ATOM 440 CB LYS A 610 4.327 1.744 9.201 1.00 72.23 C ATOM 441 CG LYS A 610 4.687 0.279 9.192 1.00 54.32 C ATOM 442 CD LYS A 610 5.936 0.047 8.350 1.00 15.01 C ATOM 443 CE LYS A 610 6.393 -1.404 8.390 1.00 62.12 C ATOM 444 NZ LYS A 610 6.752 -1.845 9.756 1.00 33.44 N ATOM 0 H LYS A 610 1.523 2.070 8.907 1.00 43.13 H new ATOM 0 HA LYS A 610 3.375 1.766 11.143 1.00 51.23 H new ATOM 0 HB2 LYS A 610 4.050 2.034 8.187 1.00 72.23 H new ATOM 0 HB3 LYS A 610 5.219 2.313 9.463 1.00 72.23 H new ATOM 0 HG2 LYS A 610 4.858 -0.067 10.211 1.00 54.32 H new ATOM 0 HG3 LYS A 610 3.857 -0.304 8.792 1.00 54.32 H new ATOM 0 HD2 LYS A 610 5.735 0.335 7.318 1.00 15.01 H new ATOM 0 HD3 LYS A 610 6.740 0.690 8.710 1.00 15.01 H new ATOM 0 HE2 LYS A 610 5.600 -2.043 8.002 1.00 62.12 H new ATOM 0 HE3 LYS A 610 7.254 -1.529 7.733 1.00 62.12 H new ATOM 0 HZ1 LYS A 610 7.274 -2.743 9.705 1.00 33.44 H new ATOM 0 HZ2 LYS A 610 7.349 -1.123 10.208 1.00 33.44 H new ATOM 0 HZ3 LYS A 610 5.886 -1.979 10.316 1.00 33.44 H new ATOM 458 N LYS A 611 3.857 4.238 11.176 1.00 43.40 N ATOM 459 CA LYS A 611 4.091 5.685 11.252 1.00 53.22 C ATOM 460 C LYS A 611 5.091 6.106 10.219 1.00 23.42 C ATOM 461 O LYS A 611 5.029 7.204 9.663 1.00 2.45 O ATOM 462 CB LYS A 611 4.518 6.123 12.646 1.00 62.32 C ATOM 463 CG LYS A 611 3.360 6.456 13.553 1.00 11.13 C ATOM 464 CD LYS A 611 2.373 5.314 13.716 1.00 62.43 C ATOM 465 CE LYS A 611 1.164 5.751 14.526 1.00 54.42 C ATOM 466 NZ LYS A 611 1.518 6.144 15.913 1.00 12.54 N ATOM 0 H LYS A 611 4.263 3.711 11.949 1.00 43.40 H new ATOM 0 HA LYS A 611 3.145 6.185 11.043 1.00 53.22 H new ATOM 0 HB2 LYS A 611 5.110 5.330 13.102 1.00 62.32 H new ATOM 0 HB3 LYS A 611 5.166 6.996 12.562 1.00 62.32 H new ATOM 0 HG2 LYS A 611 3.745 6.736 14.533 1.00 11.13 H new ATOM 0 HG3 LYS A 611 2.836 7.325 13.156 1.00 11.13 H new ATOM 0 HD2 LYS A 611 2.051 4.964 12.735 1.00 62.43 H new ATOM 0 HD3 LYS A 611 2.862 4.474 14.210 1.00 62.43 H new ATOM 0 HE2 LYS A 611 0.681 6.591 14.026 1.00 54.42 H new ATOM 0 HE3 LYS A 611 0.439 4.938 14.557 1.00 54.42 H new ATOM 0 HZ1 LYS A 611 0.649 6.319 16.457 1.00 12.54 H new ATOM 0 HZ2 LYS A 611 2.060 5.379 16.363 1.00 12.54 H new ATOM 0 HZ3 LYS A 611 2.094 7.010 15.892 1.00 12.54 H new ATOM 480 N ASP A 612 6.014 5.220 9.980 1.00 40.51 N ATOM 481 CA ASP A 612 7.015 5.386 8.928 1.00 51.42 C ATOM 482 C ASP A 612 6.331 5.360 7.583 1.00 33.11 C ATOM 483 O ASP A 612 6.806 5.968 6.608 1.00 20.23 O ATOM 484 CB ASP A 612 8.058 4.252 8.977 1.00 13.32 C ATOM 485 CG ASP A 612 8.911 4.257 10.221 1.00 43.22 C ATOM 486 OD1 ASP A 612 8.463 3.738 11.278 1.00 2.32 O ATOM 487 OD2 ASP A 612 10.042 4.768 10.167 1.00 60.30 O ATOM 0 H ASP A 612 6.107 4.350 10.505 1.00 40.51 H new ATOM 0 HA ASP A 612 7.522 6.338 9.082 1.00 51.42 H new ATOM 0 HB2 ASP A 612 7.542 3.294 8.906 1.00 13.32 H new ATOM 0 HB3 ASP A 612 8.706 4.330 8.104 1.00 13.32 H new ATOM 492 N ALA A 613 5.190 4.656 7.554 1.00 1.52 N ATOM 493 CA ALA A 613 4.385 4.451 6.372 1.00 41.42 C ATOM 494 C ALA A 613 5.165 3.699 5.294 1.00 22.13 C ATOM 495 O ALA A 613 6.324 3.314 5.487 1.00 64.13 O ATOM 496 CB ALA A 613 3.818 5.769 5.854 1.00 71.44 C ATOM 0 H ALA A 613 4.803 4.206 8.384 1.00 1.52 H new ATOM 0 HA ALA A 613 3.537 3.825 6.648 1.00 41.42 H new ATOM 0 HB1 ALA A 613 3.217 5.582 4.964 1.00 71.44 H new ATOM 0 HB2 ALA A 613 3.195 6.224 6.624 1.00 71.44 H new ATOM 0 HB3 ALA A 613 4.637 6.444 5.604 1.00 71.44 H new ATOM 502 N TYR A 614 4.533 3.455 4.201 1.00 3.45 N ATOM 503 CA TYR A 614 5.156 2.772 3.113 1.00 51.31 C ATOM 504 C TYR A 614 5.272 3.713 1.952 1.00 21.54 C ATOM 505 O TYR A 614 4.299 4.353 1.567 1.00 43.52 O ATOM 506 CB TYR A 614 4.344 1.543 2.726 1.00 63.21 C ATOM 507 CG TYR A 614 4.243 0.486 3.811 1.00 11.34 C ATOM 508 CD1 TYR A 614 3.439 0.674 4.932 1.00 65.45 C ATOM 509 CD2 TYR A 614 4.944 -0.707 3.707 1.00 22.43 C ATOM 510 CE1 TYR A 614 3.341 -0.277 5.893 1.00 21.01 C ATOM 511 CE2 TYR A 614 4.844 -1.675 4.675 1.00 35.51 C ATOM 512 CZ TYR A 614 4.038 -1.451 5.767 1.00 22.12 C ATOM 513 OH TYR A 614 3.927 -2.395 6.737 1.00 5.01 O ATOM 0 H TYR A 614 3.564 3.723 4.031 1.00 3.45 H new ATOM 0 HA TYR A 614 6.150 2.439 3.410 1.00 51.31 H new ATOM 0 HB2 TYR A 614 3.338 1.860 2.451 1.00 63.21 H new ATOM 0 HB3 TYR A 614 4.790 1.093 1.839 1.00 63.21 H new ATOM 0 HD1 TYR A 614 2.883 1.594 5.038 1.00 65.45 H new ATOM 0 HD2 TYR A 614 5.579 -0.877 2.850 1.00 22.43 H new ATOM 0 HE1 TYR A 614 2.715 -0.110 6.757 1.00 21.01 H new ATOM 0 HE2 TYR A 614 5.391 -2.601 4.580 1.00 35.51 H new ATOM 0 HH TYR A 614 3.147 -2.199 7.296 1.00 5.01 H new ATOM 523 N LYS A 615 6.442 3.836 1.425 1.00 21.43 N ATOM 524 CA LYS A 615 6.686 4.694 0.350 1.00 1.24 C ATOM 525 C LYS A 615 7.357 3.951 -0.780 1.00 21.44 C ATOM 526 O LYS A 615 8.361 3.278 -0.584 1.00 70.51 O ATOM 527 CB LYS A 615 7.546 5.809 0.848 1.00 31.44 C ATOM 528 CG LYS A 615 8.133 6.666 -0.198 1.00 72.02 C ATOM 529 CD LYS A 615 9.116 7.602 0.449 1.00 22.22 C ATOM 530 CE LYS A 615 10.002 8.201 -0.566 1.00 12.43 C ATOM 531 NZ LYS A 615 10.958 9.170 0.016 1.00 65.53 N ATOM 0 H LYS A 615 7.264 3.325 1.747 1.00 21.43 H new ATOM 0 HA LYS A 615 5.750 5.092 -0.042 1.00 1.24 H new ATOM 0 HB2 LYS A 615 6.953 6.433 1.516 1.00 31.44 H new ATOM 0 HB3 LYS A 615 8.355 5.385 1.443 1.00 31.44 H new ATOM 0 HG2 LYS A 615 8.630 6.056 -0.952 1.00 72.02 H new ATOM 0 HG3 LYS A 615 7.352 7.230 -0.708 1.00 72.02 H new ATOM 0 HD2 LYS A 615 8.582 8.388 0.983 1.00 22.22 H new ATOM 0 HD3 LYS A 615 9.710 7.062 1.186 1.00 22.22 H new ATOM 0 HE2 LYS A 615 10.555 7.410 -1.073 1.00 12.43 H new ATOM 0 HE3 LYS A 615 9.397 8.702 -1.322 1.00 12.43 H new ATOM 0 HZ1 LYS A 615 11.557 9.562 -0.738 1.00 65.53 H new ATOM 0 HZ2 LYS A 615 10.434 9.941 0.477 1.00 65.53 H new ATOM 0 HZ3 LYS A 615 11.556 8.689 0.718 1.00 65.53 H new ATOM 545 N VAL A 616 6.787 4.067 -1.926 1.00 23.40 N ATOM 546 CA VAL A 616 7.312 3.473 -3.131 1.00 45.31 C ATOM 547 C VAL A 616 7.869 4.599 -3.969 1.00 33.40 C ATOM 548 O VAL A 616 7.249 5.648 -4.069 1.00 13.03 O ATOM 549 CB VAL A 616 6.200 2.759 -3.933 1.00 72.34 C ATOM 550 CG1 VAL A 616 6.761 2.075 -5.177 1.00 35.25 C ATOM 551 CG2 VAL A 616 5.432 1.769 -3.064 1.00 14.32 C ATOM 0 H VAL A 616 5.921 4.587 -2.069 1.00 23.40 H new ATOM 0 HA VAL A 616 8.072 2.733 -2.878 1.00 45.31 H new ATOM 0 HB VAL A 616 5.498 3.524 -4.263 1.00 72.34 H new ATOM 0 HG11 VAL A 616 5.952 1.583 -5.717 1.00 35.25 H new ATOM 0 HG12 VAL A 616 7.228 2.819 -5.822 1.00 35.25 H new ATOM 0 HG13 VAL A 616 7.503 1.334 -4.881 1.00 35.25 H new ATOM 0 HG21 VAL A 616 4.658 1.286 -3.660 1.00 14.32 H new ATOM 0 HG22 VAL A 616 6.118 1.014 -2.679 1.00 14.32 H new ATOM 0 HG23 VAL A 616 4.970 2.298 -2.231 1.00 14.32 H new ATOM 557 N GLU A 617 9.003 4.402 -4.549 1.00 53.52 N ATOM 558 CA GLU A 617 9.650 5.450 -5.308 1.00 13.11 C ATOM 559 C GLU A 617 9.789 5.078 -6.757 1.00 15.23 C ATOM 560 O GLU A 617 10.179 3.963 -7.082 1.00 33.34 O ATOM 561 CB GLU A 617 11.009 5.756 -4.709 1.00 51.55 C ATOM 562 CG GLU A 617 10.928 6.321 -3.313 1.00 33.02 C ATOM 563 CD GLU A 617 12.271 6.483 -2.678 1.00 24.21 C ATOM 564 OE1 GLU A 617 13.027 7.375 -3.095 1.00 13.11 O ATOM 565 OE2 GLU A 617 12.580 5.731 -1.733 1.00 4.11 O ATOM 0 H GLU A 617 9.516 3.521 -4.519 1.00 53.52 H new ATOM 0 HA GLU A 617 9.024 6.341 -5.256 1.00 13.11 H new ATOM 0 HB2 GLU A 617 11.605 4.844 -4.691 1.00 51.55 H new ATOM 0 HB3 GLU A 617 11.531 6.465 -5.352 1.00 51.55 H new ATOM 0 HG2 GLU A 617 10.427 7.288 -3.345 1.00 33.02 H new ATOM 0 HG3 GLU A 617 10.315 5.665 -2.695 1.00 33.02 H new ATOM 572 N THR A 618 9.454 6.000 -7.628 1.00 42.31 N ATOM 573 CA THR A 618 9.600 5.785 -9.030 1.00 44.12 C ATOM 574 C THR A 618 10.626 6.800 -9.519 1.00 72.21 C ATOM 575 O THR A 618 11.386 7.345 -8.701 1.00 42.33 O ATOM 576 CB THR A 618 8.246 5.978 -9.779 1.00 22.51 C ATOM 577 OG1 THR A 618 7.828 7.344 -9.683 1.00 3.42 O ATOM 578 CG2 THR A 618 7.155 5.093 -9.166 1.00 42.35 C ATOM 0 H THR A 618 9.075 6.913 -7.377 1.00 42.31 H new ATOM 0 HA THR A 618 9.923 4.763 -9.228 1.00 44.12 H new ATOM 0 HB THR A 618 8.395 5.699 -10.822 1.00 22.51 H new ATOM 0 HG1 THR A 618 7.503 7.524 -8.776 1.00 3.42 H new ATOM 0 HG21 THR A 618 6.219 5.244 -9.704 1.00 42.35 H new ATOM 0 HG22 THR A 618 7.451 4.047 -9.240 1.00 42.35 H new ATOM 0 HG23 THR A 618 7.018 5.358 -8.118 1.00 42.35 H new ATOM 584 N ASP A 619 10.651 7.070 -10.801 1.00 20.42 N ATOM 585 CA ASP A 619 11.605 8.018 -11.363 1.00 71.35 C ATOM 586 C ASP A 619 11.368 9.425 -10.845 1.00 21.32 C ATOM 587 O ASP A 619 12.312 10.148 -10.531 1.00 51.23 O ATOM 588 CB ASP A 619 11.573 8.017 -12.898 1.00 24.13 C ATOM 589 CG ASP A 619 12.012 6.705 -13.502 1.00 53.25 C ATOM 590 OD1 ASP A 619 13.222 6.497 -13.670 1.00 11.25 O ATOM 591 OD2 ASP A 619 11.144 5.855 -13.804 1.00 32.21 O ATOM 0 H ASP A 619 10.022 6.649 -11.485 1.00 20.42 H new ATOM 0 HA ASP A 619 12.593 7.690 -11.039 1.00 71.35 H new ATOM 0 HB2 ASP A 619 10.561 8.243 -13.234 1.00 24.13 H new ATOM 0 HB3 ASP A 619 12.218 8.814 -13.269 1.00 24.13 H new ATOM 596 N LYS A 620 10.108 9.820 -10.744 1.00 3.13 N ATOM 597 CA LYS A 620 9.810 11.175 -10.293 1.00 43.11 C ATOM 598 C LYS A 620 8.787 11.222 -9.183 1.00 13.21 C ATOM 599 O LYS A 620 8.642 12.253 -8.520 1.00 35.02 O ATOM 600 CB LYS A 620 9.325 12.055 -11.454 1.00 42.15 C ATOM 601 CG LYS A 620 10.293 12.182 -12.626 1.00 55.11 C ATOM 602 CD LYS A 620 9.722 13.063 -13.736 1.00 22.44 C ATOM 603 CE LYS A 620 8.429 12.491 -14.319 1.00 62.32 C ATOM 604 NZ LYS A 620 8.619 11.128 -14.869 1.00 12.42 N ATOM 0 H LYS A 620 9.295 9.243 -10.960 1.00 3.13 H new ATOM 0 HA LYS A 620 10.750 11.562 -9.899 1.00 43.11 H new ATOM 0 HB2 LYS A 620 8.383 11.651 -11.825 1.00 42.15 H new ATOM 0 HB3 LYS A 620 9.115 13.053 -11.068 1.00 42.15 H new ATOM 0 HG2 LYS A 620 11.236 12.603 -12.276 1.00 55.11 H new ATOM 0 HG3 LYS A 620 10.514 11.192 -13.024 1.00 55.11 H new ATOM 0 HD2 LYS A 620 9.531 14.062 -13.343 1.00 22.44 H new ATOM 0 HD3 LYS A 620 10.461 13.169 -14.530 1.00 22.44 H new ATOM 0 HE2 LYS A 620 7.663 12.465 -13.544 1.00 62.32 H new ATOM 0 HE3 LYS A 620 8.064 13.151 -15.106 1.00 62.32 H new ATOM 0 HZ1 LYS A 620 7.771 10.847 -15.401 1.00 12.42 H new ATOM 0 HZ2 LYS A 620 9.443 11.121 -15.503 1.00 12.42 H new ATOM 0 HZ3 LYS A 620 8.776 10.458 -14.089 1.00 12.42 H new ATOM 618 N TYR A 621 8.086 10.161 -8.957 1.00 22.12 N ATOM 619 CA TYR A 621 7.015 10.219 -8.001 1.00 44.23 C ATOM 620 C TYR A 621 7.187 9.185 -6.939 1.00 21.25 C ATOM 621 O TYR A 621 7.640 8.079 -7.207 1.00 33.01 O ATOM 622 CB TYR A 621 5.674 10.009 -8.722 1.00 4.24 C ATOM 623 CG TYR A 621 5.476 10.962 -9.874 1.00 2.43 C ATOM 624 CD1 TYR A 621 5.217 12.301 -9.658 1.00 2.05 C ATOM 625 CD2 TYR A 621 5.597 10.525 -11.181 1.00 63.40 C ATOM 626 CE1 TYR A 621 5.078 13.177 -10.718 1.00 21.31 C ATOM 627 CE2 TYR A 621 5.464 11.394 -12.237 1.00 72.31 C ATOM 628 CZ TYR A 621 5.206 12.714 -12.001 1.00 50.03 C ATOM 629 OH TYR A 621 5.075 13.580 -13.059 1.00 11.32 O ATOM 0 H TYR A 621 8.226 9.257 -9.408 1.00 22.12 H new ATOM 0 HA TYR A 621 7.028 11.199 -7.525 1.00 44.23 H new ATOM 0 HB2 TYR A 621 5.621 8.984 -9.090 1.00 4.24 H new ATOM 0 HB3 TYR A 621 4.859 10.134 -8.009 1.00 4.24 H new ATOM 0 HD1 TYR A 621 5.122 12.669 -8.647 1.00 2.05 H new ATOM 0 HD2 TYR A 621 5.800 9.482 -11.375 1.00 63.40 H new ATOM 0 HE1 TYR A 621 4.870 14.221 -10.536 1.00 21.31 H new ATOM 0 HE2 TYR A 621 5.563 11.034 -13.250 1.00 72.31 H new ATOM 0 HH TYR A 621 5.195 13.090 -13.899 1.00 11.32 H new ATOM 639 N GLU A 622 6.868 9.533 -5.751 1.00 51.23 N ATOM 640 CA GLU A 622 6.843 8.574 -4.711 1.00 21.30 C ATOM 641 C GLU A 622 5.417 8.414 -4.335 1.00 2.20 C ATOM 642 O GLU A 622 4.627 9.366 -4.450 1.00 13.13 O ATOM 643 CB GLU A 622 7.634 8.994 -3.453 1.00 0.43 C ATOM 644 CG GLU A 622 7.024 10.162 -2.700 1.00 14.11 C ATOM 645 CD GLU A 622 7.661 10.416 -1.353 1.00 20.15 C ATOM 646 OE1 GLU A 622 8.721 11.065 -1.296 1.00 41.42 O ATOM 647 OE2 GLU A 622 7.108 9.967 -0.318 1.00 52.32 O ATOM 0 H GLU A 622 6.618 10.482 -5.471 1.00 51.23 H new ATOM 0 HA GLU A 622 7.312 7.659 -5.073 1.00 21.30 H new ATOM 0 HB2 GLU A 622 7.706 8.140 -2.780 1.00 0.43 H new ATOM 0 HB3 GLU A 622 8.651 9.256 -3.746 1.00 0.43 H new ATOM 0 HG2 GLU A 622 7.112 11.062 -3.309 1.00 14.11 H new ATOM 0 HG3 GLU A 622 5.959 9.976 -2.559 1.00 14.11 H new ATOM 654 N PHE A 623 5.065 7.271 -3.937 1.00 60.30 N ATOM 655 CA PHE A 623 3.771 7.072 -3.446 1.00 70.32 C ATOM 656 C PHE A 623 3.930 6.730 -2.008 1.00 71.43 C ATOM 657 O PHE A 623 4.612 5.764 -1.668 1.00 34.03 O ATOM 658 CB PHE A 623 3.085 5.924 -4.192 1.00 4.21 C ATOM 659 CG PHE A 623 2.954 6.136 -5.686 1.00 53.31 C ATOM 660 CD1 PHE A 623 3.996 5.817 -6.543 1.00 31.23 C ATOM 661 CD2 PHE A 623 1.793 6.652 -6.223 1.00 41.40 C ATOM 662 CE1 PHE A 623 3.875 6.014 -7.900 1.00 0.44 C ATOM 663 CE2 PHE A 623 1.668 6.849 -7.580 1.00 70.15 C ATOM 664 CZ PHE A 623 2.711 6.531 -8.419 1.00 33.14 C ATOM 0 H PHE A 623 5.661 6.443 -3.940 1.00 60.30 H new ATOM 0 HA PHE A 623 3.152 7.959 -3.583 1.00 70.32 H new ATOM 0 HB2 PHE A 623 3.646 5.006 -4.016 1.00 4.21 H new ATOM 0 HB3 PHE A 623 2.091 5.776 -3.770 1.00 4.21 H new ATOM 0 HD1 PHE A 623 4.912 5.410 -6.142 1.00 31.23 H new ATOM 0 HD2 PHE A 623 0.971 6.905 -5.570 1.00 41.40 H new ATOM 0 HE1 PHE A 623 4.694 5.763 -8.557 1.00 0.44 H new ATOM 0 HE2 PHE A 623 0.752 7.253 -7.985 1.00 70.15 H new ATOM 0 HZ PHE A 623 2.616 6.687 -9.483 1.00 33.14 H new ATOM 674 N HIS A 624 3.345 7.498 -1.172 1.00 0.33 N ATOM 675 CA HIS A 624 3.429 7.250 0.213 1.00 40.40 C ATOM 676 C HIS A 624 2.054 6.843 0.669 1.00 44.21 C ATOM 677 O HIS A 624 1.094 7.594 0.512 1.00 31.01 O ATOM 678 CB HIS A 624 3.865 8.534 0.908 1.00 60.22 C ATOM 679 CG HIS A 624 4.863 8.320 1.978 1.00 53.44 C ATOM 680 ND1 HIS A 624 6.156 8.759 1.873 1.00 51.11 N ATOM 681 CD2 HIS A 624 4.771 7.717 3.176 1.00 4.22 C ATOM 682 CE1 HIS A 624 6.814 8.429 2.955 1.00 74.22 C ATOM 683 NE2 HIS A 624 6.000 7.798 3.766 1.00 0.14 N ATOM 0 H HIS A 624 2.794 8.317 -1.429 1.00 0.33 H new ATOM 0 HA HIS A 624 4.149 6.466 0.447 1.00 40.40 H new ATOM 0 HB2 HIS A 624 4.281 9.215 0.166 1.00 60.22 H new ATOM 0 HB3 HIS A 624 2.988 9.023 1.333 1.00 60.22 H new ATOM 0 HD1 HIS A 624 6.545 9.264 1.077 1.00 51.11 H new ATOM 0 HD2 HIS A 624 3.889 7.255 3.594 1.00 4.22 H new ATOM 0 HE1 HIS A 624 7.855 8.641 3.148 1.00 74.22 H new ATOM 692 N ILE A 625 1.961 5.691 1.244 1.00 72.21 N ATOM 693 CA ILE A 625 0.692 5.131 1.634 1.00 10.31 C ATOM 694 C ILE A 625 0.849 4.482 2.985 1.00 73.03 C ATOM 695 O ILE A 625 1.967 4.139 3.395 1.00 14.45 O ATOM 696 CB ILE A 625 0.190 4.048 0.601 1.00 13.25 C ATOM 697 CG1 ILE A 625 1.123 2.837 0.615 1.00 13.40 C ATOM 698 CG2 ILE A 625 0.087 4.629 -0.813 1.00 34.12 C ATOM 699 CD1 ILE A 625 0.815 1.772 -0.427 1.00 23.32 C ATOM 0 H ILE A 625 2.764 5.100 1.462 1.00 72.21 H new ATOM 0 HA ILE A 625 -0.044 5.934 1.666 1.00 10.31 H new ATOM 0 HB ILE A 625 -0.809 3.731 0.902 1.00 13.25 H new ATOM 0 HG12 ILE A 625 2.145 3.184 0.466 1.00 13.40 H new ATOM 0 HG13 ILE A 625 1.083 2.379 1.603 1.00 13.40 H new ATOM 0 HG21 ILE A 625 -0.261 3.857 -1.499 1.00 34.12 H new ATOM 0 HG22 ILE A 625 -0.618 5.460 -0.814 1.00 34.12 H new ATOM 0 HG23 ILE A 625 1.067 4.983 -1.133 1.00 34.12 H new ATOM 0 HD11 ILE A 625 1.532 0.956 -0.336 1.00 23.32 H new ATOM 0 HD12 ILE A 625 -0.193 1.389 -0.269 1.00 23.32 H new ATOM 0 HD13 ILE A 625 0.886 2.207 -1.424 1.00 23.32 H new ATOM 706 N ASN A 626 -0.211 4.357 3.679 1.00 12.33 N ATOM 707 CA ASN A 626 -0.200 3.680 4.947 1.00 54.14 C ATOM 708 C ASN A 626 -1.380 2.738 4.993 1.00 0.43 C ATOM 709 O ASN A 626 -2.366 2.949 4.284 1.00 32.00 O ATOM 710 CB ASN A 626 -0.255 4.687 6.101 1.00 23.10 C ATOM 711 CG ASN A 626 -0.134 4.042 7.471 1.00 33.54 C ATOM 712 OD1 ASN A 626 0.517 2.992 7.636 1.00 70.45 O ATOM 713 ND2 ASN A 626 -0.753 4.640 8.451 1.00 24.21 N ATOM 0 H ASN A 626 -1.124 4.716 3.399 1.00 12.33 H new ATOM 0 HA ASN A 626 0.725 3.114 5.058 1.00 54.14 H new ATOM 0 HB2 ASN A 626 0.548 5.414 5.978 1.00 23.10 H new ATOM 0 HB3 ASN A 626 -1.194 5.238 6.049 1.00 23.10 H new ATOM 0 HD21 ASN A 626 -0.714 4.249 9.392 1.00 24.21 H new ATOM 0 HD22 ASN A 626 -1.276 5.498 8.276 1.00 24.21 H new ATOM 719 N VAL A 627 -1.276 1.697 5.779 1.00 4.42 N ATOM 720 CA VAL A 627 -2.334 0.726 5.892 1.00 53.31 C ATOM 721 C VAL A 627 -3.274 1.190 6.960 1.00 63.11 C ATOM 722 O VAL A 627 -2.894 1.257 8.124 1.00 21.50 O ATOM 723 CB VAL A 627 -1.793 -0.667 6.260 1.00 45.35 C ATOM 724 CG1 VAL A 627 -2.887 -1.713 6.186 1.00 53.25 C ATOM 725 CG2 VAL A 627 -0.652 -1.034 5.362 1.00 54.54 C ATOM 0 H VAL A 627 -0.459 1.499 6.357 1.00 4.42 H new ATOM 0 HA VAL A 627 -2.838 0.639 4.929 1.00 53.31 H new ATOM 0 HB VAL A 627 -1.432 -0.632 7.288 1.00 45.35 H new ATOM 0 HG11 VAL A 627 -2.477 -2.688 6.451 1.00 53.25 H new ATOM 0 HG12 VAL A 627 -3.686 -1.454 6.881 1.00 53.25 H new ATOM 0 HG13 VAL A 627 -3.286 -1.751 5.173 1.00 53.25 H new ATOM 0 HG21 VAL A 627 -0.279 -2.022 5.633 1.00 54.54 H new ATOM 0 HG22 VAL A 627 -0.993 -1.047 4.327 1.00 54.54 H new ATOM 0 HG23 VAL A 627 0.147 -0.301 5.472 1.00 54.54 H new ATOM 731 N CYS A 628 -4.473 1.524 6.541 1.00 41.25 N ATOM 732 CA CYS A 628 -5.535 2.082 7.366 1.00 43.14 C ATOM 733 C CYS A 628 -5.295 3.535 7.665 1.00 71.44 C ATOM 734 O CYS A 628 -4.154 3.989 7.822 1.00 51.42 O ATOM 735 CB CYS A 628 -5.713 1.355 8.707 1.00 31.33 C ATOM 736 SG CYS A 628 -6.232 -0.378 8.650 1.00 63.11 S ATOM 0 H CYS A 628 -4.754 1.410 5.567 1.00 41.25 H new ATOM 0 HA CYS A 628 -6.441 1.953 6.774 1.00 43.14 H new ATOM 0 HB2 CYS A 628 -4.767 1.406 9.246 1.00 31.33 H new ATOM 0 HB3 CYS A 628 -6.446 1.907 9.295 1.00 31.33 H new ATOM 741 N GLY A 629 -6.378 4.246 7.761 1.00 33.33 N ATOM 742 CA GLY A 629 -6.363 5.597 8.191 1.00 22.11 C ATOM 743 C GLY A 629 -5.616 6.487 7.262 1.00 75.41 C ATOM 744 O GLY A 629 -5.744 6.383 6.035 1.00 55.51 O ATOM 0 H GLY A 629 -7.308 3.891 7.537 1.00 33.33 H new ATOM 0 HA2 GLY A 629 -7.388 5.955 8.285 1.00 22.11 H new ATOM 0 HA3 GLY A 629 -5.913 5.654 9.182 1.00 22.11 H new ATOM 748 N PRO A 630 -4.869 7.394 7.823 1.00 30.14 N ATOM 749 CA PRO A 630 -4.055 8.312 7.086 1.00 10.31 C ATOM 750 C PRO A 630 -2.608 7.859 6.948 1.00 74.10 C ATOM 751 O PRO A 630 -2.170 6.874 7.561 1.00 15.55 O ATOM 752 CB PRO A 630 -4.090 9.515 7.977 1.00 73.14 C ATOM 753 CG PRO A 630 -4.108 8.952 9.369 1.00 53.21 C ATOM 754 CD PRO A 630 -4.786 7.632 9.278 1.00 62.11 C ATOM 0 HA PRO A 630 -4.414 8.448 6.066 1.00 10.31 H new ATOM 0 HB2 PRO A 630 -3.220 10.152 7.818 1.00 73.14 H new ATOM 0 HB3 PRO A 630 -4.972 10.126 7.785 1.00 73.14 H new ATOM 0 HG2 PRO A 630 -3.095 8.843 9.757 1.00 53.21 H new ATOM 0 HG3 PRO A 630 -4.640 9.616 10.050 1.00 53.21 H new ATOM 0 HD2 PRO A 630 -4.216 6.851 9.782 1.00 62.11 H new ATOM 0 HD3 PRO A 630 -5.773 7.654 9.739 1.00 62.11 H new ATOM 762 N VAL A 631 -1.873 8.587 6.164 1.00 32.42 N ATOM 763 CA VAL A 631 -0.485 8.371 6.041 1.00 13.23 C ATOM 764 C VAL A 631 0.221 9.443 6.833 1.00 3.21 C ATOM 765 O VAL A 631 -0.066 10.643 6.693 1.00 55.41 O ATOM 766 CB VAL A 631 -0.009 8.363 4.550 1.00 71.13 C ATOM 767 CG1 VAL A 631 -0.366 9.642 3.810 1.00 22.24 C ATOM 768 CG2 VAL A 631 1.469 8.075 4.443 1.00 44.43 C ATOM 0 H VAL A 631 -2.233 9.351 5.592 1.00 32.42 H new ATOM 0 HA VAL A 631 -0.241 7.383 6.432 1.00 13.23 H new ATOM 0 HB VAL A 631 -0.552 7.554 4.062 1.00 71.13 H new ATOM 0 HG11 VAL A 631 -0.011 9.579 2.781 1.00 22.24 H new ATOM 0 HG12 VAL A 631 -1.448 9.774 3.813 1.00 22.24 H new ATOM 0 HG13 VAL A 631 0.104 10.492 4.304 1.00 22.24 H new ATOM 0 HG21 VAL A 631 1.765 8.077 3.394 1.00 44.43 H new ATOM 0 HG22 VAL A 631 2.029 8.841 4.980 1.00 44.43 H new ATOM 0 HG23 VAL A 631 1.682 7.099 4.878 1.00 44.43 H new ATOM 774 N SER A 632 1.111 9.034 7.661 1.00 30.03 N ATOM 775 CA SER A 632 1.825 9.928 8.470 1.00 75.20 C ATOM 776 C SER A 632 3.123 10.353 7.803 1.00 43.10 C ATOM 777 O SER A 632 4.199 9.800 8.062 1.00 70.11 O ATOM 778 CB SER A 632 2.011 9.319 9.858 1.00 14.41 C ATOM 779 OG SER A 632 2.461 7.980 9.744 1.00 22.03 O ATOM 0 H SER A 632 1.361 8.054 7.791 1.00 30.03 H new ATOM 0 HA SER A 632 1.258 10.849 8.601 1.00 75.20 H new ATOM 0 HB2 SER A 632 2.731 9.906 10.428 1.00 14.41 H new ATOM 0 HB3 SER A 632 1.070 9.349 10.407 1.00 14.41 H new ATOM 0 HG SER A 632 3.441 7.964 9.734 1.00 22.03 H new ATOM 785 N VAL A 633 2.995 11.262 6.861 1.00 3.03 N ATOM 786 CA VAL A 633 4.136 11.804 6.165 1.00 24.04 C ATOM 787 C VAL A 633 4.073 13.319 6.114 1.00 1.22 C ATOM 788 O VAL A 633 3.034 13.893 5.772 1.00 33.42 O ATOM 789 CB VAL A 633 4.294 11.210 4.724 1.00 12.35 C ATOM 790 CG1 VAL A 633 3.082 11.449 3.847 1.00 3.23 C ATOM 791 CG2 VAL A 633 5.573 11.692 4.049 1.00 1.23 C ATOM 0 H VAL A 633 2.099 11.644 6.558 1.00 3.03 H new ATOM 0 HA VAL A 633 5.019 11.510 6.733 1.00 24.04 H new ATOM 0 HB VAL A 633 4.372 10.130 4.853 1.00 12.35 H new ATOM 0 HG11 VAL A 633 3.254 11.014 2.862 1.00 3.23 H new ATOM 0 HG12 VAL A 633 2.207 10.984 4.301 1.00 3.23 H new ATOM 0 HG13 VAL A 633 2.912 12.521 3.745 1.00 3.23 H new ATOM 0 HG21 VAL A 633 5.644 11.257 3.052 1.00 1.23 H new ATOM 0 HG22 VAL A 633 5.555 12.779 3.970 1.00 1.23 H new ATOM 0 HG23 VAL A 633 6.435 11.385 4.641 1.00 1.23 H new ATOM 797 N GLY A 634 5.180 13.966 6.446 1.00 74.53 N ATOM 798 CA GLY A 634 5.259 15.417 6.394 1.00 12.22 C ATOM 799 C GLY A 634 5.420 15.907 4.974 1.00 61.11 C ATOM 800 O GLY A 634 6.442 16.504 4.608 1.00 12.11 O ATOM 0 H GLY A 634 6.037 13.508 6.755 1.00 74.53 H new ATOM 0 HA2 GLY A 634 4.358 15.848 6.830 1.00 12.22 H new ATOM 0 HA3 GLY A 634 6.100 15.759 6.997 1.00 12.22 H new ATOM 804 N ALA A 635 4.424 15.628 4.193 1.00 15.22 N ATOM 805 CA ALA A 635 4.354 15.972 2.799 1.00 4.35 C ATOM 806 C ALA A 635 2.910 16.046 2.414 1.00 14.14 C ATOM 807 O ALA A 635 2.505 16.874 1.595 1.00 42.31 O ATOM 808 CB ALA A 635 5.047 14.919 1.946 1.00 60.31 C ATOM 0 H ALA A 635 3.596 15.131 4.521 1.00 15.22 H new ATOM 0 HA ALA A 635 4.853 16.927 2.634 1.00 4.35 H new ATOM 0 HB1 ALA A 635 4.981 15.201 0.895 1.00 60.31 H new ATOM 0 HB2 ALA A 635 6.095 14.847 2.237 1.00 60.31 H new ATOM 0 HB3 ALA A 635 4.562 13.954 2.094 1.00 60.31 H new ATOM 814 N CYS A 636 2.121 15.169 3.001 1.00 21.44 N ATOM 815 CA CYS A 636 0.722 15.144 2.722 1.00 1.41 C ATOM 816 C CYS A 636 -0.078 15.239 4.012 1.00 53.44 C ATOM 817 O CYS A 636 0.356 14.728 5.051 1.00 62.34 O ATOM 818 CB CYS A 636 0.401 13.892 1.934 1.00 71.12 C ATOM 819 SG CYS A 636 1.347 13.789 0.375 1.00 12.23 S ATOM 0 H CYS A 636 2.436 14.469 3.673 1.00 21.44 H new ATOM 0 HA CYS A 636 0.442 16.007 2.118 1.00 1.41 H new ATOM 0 HB2 CYS A 636 0.617 13.016 2.545 1.00 71.12 H new ATOM 0 HB3 CYS A 636 -0.666 13.870 1.711 1.00 71.12 H new ATOM 824 N PRO A 637 -1.243 15.908 3.970 1.00 62.31 N ATOM 825 CA PRO A 637 -2.073 16.150 5.158 1.00 22.43 C ATOM 826 C PRO A 637 -2.583 14.860 5.838 1.00 40.25 C ATOM 827 O PRO A 637 -2.796 13.836 5.182 1.00 52.04 O ATOM 828 CB PRO A 637 -3.247 16.970 4.611 1.00 2.44 C ATOM 829 CG PRO A 637 -3.281 16.659 3.161 1.00 52.12 C ATOM 830 CD PRO A 637 -1.858 16.489 2.761 1.00 51.42 C ATOM 0 HA PRO A 637 -1.501 16.651 5.939 1.00 22.43 H new ATOM 0 HB2 PRO A 637 -4.183 16.694 5.097 1.00 2.44 H new ATOM 0 HB3 PRO A 637 -3.100 18.036 4.784 1.00 2.44 H new ATOM 0 HG2 PRO A 637 -3.855 15.753 2.967 1.00 52.12 H new ATOM 0 HG3 PRO A 637 -3.754 17.463 2.598 1.00 52.12 H new ATOM 0 HD2 PRO A 637 -1.757 15.829 1.899 1.00 51.42 H new ATOM 0 HD3 PRO A 637 -1.398 17.439 2.491 1.00 51.42 H new ATOM 838 N PRO A 638 -2.771 14.912 7.179 1.00 11.42 N ATOM 839 CA PRO A 638 -3.288 13.786 7.999 1.00 3.33 C ATOM 840 C PRO A 638 -4.661 13.239 7.552 1.00 13.55 C ATOM 841 O PRO A 638 -5.113 12.223 8.048 1.00 3.13 O ATOM 842 CB PRO A 638 -3.392 14.378 9.398 1.00 65.52 C ATOM 843 CG PRO A 638 -2.406 15.483 9.408 1.00 44.13 C ATOM 844 CD PRO A 638 -2.439 16.072 8.036 1.00 15.42 C ATOM 0 HA PRO A 638 -2.625 12.925 7.915 1.00 3.33 H new ATOM 0 HB2 PRO A 638 -4.399 14.743 9.601 1.00 65.52 H new ATOM 0 HB3 PRO A 638 -3.163 13.635 10.161 1.00 65.52 H new ATOM 0 HG2 PRO A 638 -2.663 16.229 10.160 1.00 44.13 H new ATOM 0 HG3 PRO A 638 -1.409 15.115 9.652 1.00 44.13 H new ATOM 0 HD2 PRO A 638 -3.187 16.861 7.954 1.00 15.42 H new ATOM 0 HD3 PRO A 638 -1.480 16.513 7.764 1.00 15.42 H new ATOM 852 N ASP A 639 -5.344 13.929 6.676 1.00 74.31 N ATOM 853 CA ASP A 639 -6.619 13.425 6.154 1.00 10.53 C ATOM 854 C ASP A 639 -6.404 12.544 4.941 1.00 32.21 C ATOM 855 O ASP A 639 -7.352 11.983 4.395 1.00 14.21 O ATOM 856 CB ASP A 639 -7.588 14.552 5.806 1.00 21.13 C ATOM 857 CG ASP A 639 -7.018 15.549 4.822 1.00 21.41 C ATOM 858 OD1 ASP A 639 -6.195 16.374 5.235 1.00 63.11 O ATOM 859 OD2 ASP A 639 -7.391 15.521 3.634 1.00 74.33 O ATOM 0 H ASP A 639 -5.056 14.833 6.303 1.00 74.31 H new ATOM 0 HA ASP A 639 -7.065 12.832 6.952 1.00 10.53 H new ATOM 0 HB2 ASP A 639 -8.500 14.123 5.390 1.00 21.13 H new ATOM 0 HB3 ASP A 639 -7.870 15.075 6.720 1.00 21.13 H new ATOM 864 N SER A 640 -5.180 12.423 4.520 1.00 54.53 N ATOM 865 CA SER A 640 -4.840 11.627 3.376 1.00 4.43 C ATOM 866 C SER A 640 -4.194 10.323 3.848 1.00 50.11 C ATOM 867 O SER A 640 -3.360 10.338 4.748 1.00 11.05 O ATOM 868 CB SER A 640 -3.884 12.435 2.473 1.00 5.51 C ATOM 869 OG SER A 640 -3.534 11.749 1.279 1.00 13.03 O ATOM 0 H SER A 640 -4.382 12.877 4.964 1.00 54.53 H new ATOM 0 HA SER A 640 -5.731 11.377 2.799 1.00 4.43 H new ATOM 0 HB2 SER A 640 -4.353 13.385 2.215 1.00 5.51 H new ATOM 0 HB3 SER A 640 -2.977 12.668 3.031 1.00 5.51 H new ATOM 0 HG SER A 640 -4.180 11.967 0.575 1.00 13.03 H new ATOM 875 N GLY A 641 -4.616 9.208 3.269 1.00 74.13 N ATOM 876 CA GLY A 641 -4.061 7.908 3.623 1.00 41.43 C ATOM 877 C GLY A 641 -3.083 7.418 2.596 1.00 51.24 C ATOM 878 O GLY A 641 -2.170 6.639 2.901 1.00 11.53 O ATOM 0 H GLY A 641 -5.341 9.177 2.552 1.00 74.13 H new ATOM 0 HA2 GLY A 641 -3.566 7.976 4.592 1.00 41.43 H new ATOM 0 HA3 GLY A 641 -4.870 7.185 3.728 1.00 41.43 H new ATOM 882 N ALA A 642 -3.263 7.866 1.386 1.00 25.22 N ATOM 883 CA ALA A 642 -2.369 7.543 0.318 1.00 54.54 C ATOM 884 C ALA A 642 -2.151 8.792 -0.489 1.00 50.31 C ATOM 885 O ALA A 642 -3.100 9.417 -0.962 1.00 71.03 O ATOM 886 CB ALA A 642 -2.950 6.431 -0.528 1.00 52.30 C ATOM 0 H ALA A 642 -4.040 8.469 1.114 1.00 25.22 H new ATOM 0 HA ALA A 642 -1.414 7.187 0.704 1.00 54.54 H new ATOM 0 HB1 ALA A 642 -2.261 6.193 -1.339 1.00 52.30 H new ATOM 0 HB2 ALA A 642 -3.104 5.546 0.090 1.00 52.30 H new ATOM 0 HB3 ALA A 642 -3.904 6.752 -0.945 1.00 52.30 H new ATOM 892 N CYS A 643 -0.928 9.176 -0.614 1.00 20.21 N ATOM 893 CA CYS A 643 -0.592 10.393 -1.273 1.00 51.52 C ATOM 894 C CYS A 643 0.673 10.263 -2.091 1.00 2.43 C ATOM 895 O CYS A 643 1.652 9.662 -1.638 1.00 44.23 O ATOM 896 CB CYS A 643 -0.461 11.502 -0.255 1.00 70.13 C ATOM 897 SG CYS A 643 0.001 13.114 -0.952 1.00 23.45 S ATOM 0 H CYS A 643 -0.127 8.653 -0.260 1.00 20.21 H new ATOM 0 HA CYS A 643 -1.395 10.634 -1.969 1.00 51.52 H new ATOM 0 HB2 CYS A 643 -1.409 11.607 0.273 1.00 70.13 H new ATOM 0 HB3 CYS A 643 0.286 11.213 0.485 1.00 70.13 H new ATOM 902 N GLN A 644 0.661 10.794 -3.282 1.00 3.23 N ATOM 903 CA GLN A 644 1.858 10.817 -4.079 1.00 72.14 C ATOM 904 C GLN A 644 2.417 12.192 -4.142 1.00 12.35 C ATOM 905 O GLN A 644 1.682 13.160 -4.188 1.00 3.34 O ATOM 906 CB GLN A 644 1.656 10.336 -5.495 1.00 41.23 C ATOM 907 CG GLN A 644 0.519 10.971 -6.254 1.00 21.55 C ATOM 908 CD GLN A 644 0.509 10.545 -7.703 1.00 21.22 C ATOM 909 OE1 GLN A 644 -0.106 9.562 -8.067 1.00 5.44 O ATOM 910 NE2 GLN A 644 1.200 11.280 -8.532 1.00 34.13 N ATOM 0 H GLN A 644 -0.158 11.214 -3.721 1.00 3.23 H new ATOM 0 HA GLN A 644 2.544 10.130 -3.583 1.00 72.14 H new ATOM 0 HB2 GLN A 644 2.578 10.508 -6.051 1.00 41.23 H new ATOM 0 HB3 GLN A 644 1.494 9.258 -5.472 1.00 41.23 H new ATOM 0 HG2 GLN A 644 -0.428 10.698 -5.788 1.00 21.55 H new ATOM 0 HG3 GLN A 644 0.602 12.056 -6.194 1.00 21.55 H new ATOM 0 HE21 GLN A 644 1.704 12.098 -8.190 1.00 34.13 H new ATOM 0 HE22 GLN A 644 1.236 11.036 -9.522 1.00 34.13 H new ATOM 918 N VAL A 645 3.702 12.272 -4.155 1.00 4.34 N ATOM 919 CA VAL A 645 4.383 13.516 -4.260 1.00 72.13 C ATOM 920 C VAL A 645 5.512 13.419 -5.252 1.00 72.51 C ATOM 921 O VAL A 645 6.319 12.475 -5.228 1.00 44.24 O ATOM 922 CB VAL A 645 4.834 14.118 -2.872 1.00 62.03 C ATOM 923 CG1 VAL A 645 5.591 13.119 -2.043 1.00 70.33 C ATOM 924 CG2 VAL A 645 5.679 15.384 -3.058 1.00 13.11 C ATOM 0 H VAL A 645 4.319 11.463 -4.092 1.00 4.34 H new ATOM 0 HA VAL A 645 3.662 14.239 -4.641 1.00 72.13 H new ATOM 0 HB VAL A 645 3.920 14.380 -2.339 1.00 62.03 H new ATOM 0 HG11 VAL A 645 5.881 13.577 -1.097 1.00 70.33 H new ATOM 0 HG12 VAL A 645 4.958 12.254 -1.848 1.00 70.33 H new ATOM 0 HG13 VAL A 645 6.484 12.801 -2.582 1.00 70.33 H new ATOM 0 HG21 VAL A 645 5.972 15.772 -2.083 1.00 13.11 H new ATOM 0 HG22 VAL A 645 6.571 15.144 -3.637 1.00 13.11 H new ATOM 0 HG23 VAL A 645 5.095 16.137 -3.587 1.00 13.11 H new ATOM 930 N SER A 646 5.524 14.352 -6.154 1.00 3.00 N ATOM 931 CA SER A 646 6.538 14.455 -7.133 1.00 70.13 C ATOM 932 C SER A 646 7.789 14.955 -6.472 1.00 61.13 C ATOM 933 O SER A 646 7.807 16.050 -5.926 1.00 75.21 O ATOM 934 CB SER A 646 6.110 15.432 -8.240 1.00 55.04 C ATOM 935 OG SER A 646 7.122 15.566 -9.236 1.00 72.33 O ATOM 0 H SER A 646 4.808 15.075 -6.223 1.00 3.00 H new ATOM 0 HA SER A 646 6.715 13.478 -7.583 1.00 70.13 H new ATOM 0 HB2 SER A 646 5.188 15.080 -8.702 1.00 55.04 H new ATOM 0 HB3 SER A 646 5.896 16.407 -7.803 1.00 55.04 H new ATOM 0 HG SER A 646 6.806 16.163 -9.946 1.00 72.33 H new ATOM 941 N ARG A 647 8.817 14.159 -6.495 1.00 24.01 N ATOM 942 CA ARG A 647 10.090 14.570 -5.955 1.00 33.33 C ATOM 943 C ARG A 647 10.689 15.625 -6.895 1.00 1.04 C ATOM 944 O ARG A 647 11.546 16.429 -6.513 1.00 71.12 O ATOM 945 CB ARG A 647 11.010 13.347 -5.786 1.00 12.41 C ATOM 946 CG ARG A 647 11.478 12.695 -7.078 1.00 14.24 C ATOM 947 CD ARG A 647 12.107 11.341 -6.800 1.00 32.22 C ATOM 948 NE ARG A 647 13.192 11.411 -5.818 1.00 22.33 N ATOM 949 CZ ARG A 647 13.459 10.470 -4.893 1.00 4.02 C ATOM 950 NH1 ARG A 647 12.722 9.365 -4.829 1.00 11.43 N ATOM 951 NH2 ARG A 647 14.460 10.641 -4.043 1.00 15.20 N ATOM 0 H ARG A 647 8.804 13.216 -6.883 1.00 24.01 H new ATOM 0 HA ARG A 647 9.971 15.012 -4.966 1.00 33.33 H new ATOM 0 HB2 ARG A 647 11.887 13.650 -5.214 1.00 12.41 H new ATOM 0 HB3 ARG A 647 10.485 12.599 -5.192 1.00 12.41 H new ATOM 0 HG2 ARG A 647 10.634 12.577 -7.758 1.00 14.24 H new ATOM 0 HG3 ARG A 647 12.200 13.341 -7.576 1.00 14.24 H new ATOM 0 HD2 ARG A 647 11.340 10.656 -6.439 1.00 32.22 H new ATOM 0 HD3 ARG A 647 12.492 10.926 -7.731 1.00 32.22 H new ATOM 0 HE ARG A 647 13.791 12.236 -5.837 1.00 22.33 H new ATOM 0 HH11 ARG A 647 11.951 9.228 -5.482 1.00 11.43 H new ATOM 0 HH12 ARG A 647 12.928 8.655 -4.127 1.00 11.43 H new ATOM 0 HH21 ARG A 647 15.029 11.486 -4.089 1.00 15.20 H new ATOM 0 HH22 ARG A 647 14.662 9.928 -3.342 1.00 15.20 H new ATOM 963 N SER A 648 10.181 15.620 -8.121 1.00 2.41 N ATOM 964 CA SER A 648 10.611 16.505 -9.157 1.00 73.15 C ATOM 965 C SER A 648 9.940 17.895 -9.004 1.00 52.31 C ATOM 966 O SER A 648 10.611 18.934 -9.038 1.00 74.44 O ATOM 967 CB SER A 648 10.215 15.895 -10.518 1.00 72.11 C ATOM 968 OG SER A 648 10.843 16.569 -11.595 1.00 11.24 O ATOM 0 H SER A 648 9.443 14.980 -8.413 1.00 2.41 H new ATOM 0 HA SER A 648 11.691 16.634 -9.093 1.00 73.15 H new ATOM 0 HB2 SER A 648 10.490 14.840 -10.538 1.00 72.11 H new ATOM 0 HB3 SER A 648 9.133 15.945 -10.638 1.00 72.11 H new ATOM 0 HG SER A 648 10.572 16.156 -12.442 1.00 11.24 H new ATOM 974 N ASP A 649 8.622 17.897 -8.805 1.00 73.13 N ATOM 975 CA ASP A 649 7.830 19.150 -8.810 1.00 62.14 C ATOM 976 C ASP A 649 7.463 19.622 -7.428 1.00 50.45 C ATOM 977 O ASP A 649 7.071 20.770 -7.245 1.00 22.21 O ATOM 978 CB ASP A 649 6.525 18.967 -9.587 1.00 1.12 C ATOM 979 CG ASP A 649 6.695 18.508 -11.005 1.00 31.52 C ATOM 980 OD1 ASP A 649 6.704 17.286 -11.234 1.00 51.20 O ATOM 981 OD2 ASP A 649 6.798 19.359 -11.921 1.00 53.03 O ATOM 0 H ASP A 649 8.072 17.054 -8.638 1.00 73.13 H new ATOM 0 HA ASP A 649 8.472 19.894 -9.282 1.00 62.14 H new ATOM 0 HB2 ASP A 649 5.902 18.245 -9.059 1.00 1.12 H new ATOM 0 HB3 ASP A 649 5.984 19.913 -9.589 1.00 1.12 H new ATOM 986 N ARG A 650 7.553 18.725 -6.480 1.00 43.44 N ATOM 987 CA ARG A 650 7.182 18.936 -5.100 1.00 22.12 C ATOM 988 C ARG A 650 5.634 19.070 -4.969 1.00 33.52 C ATOM 989 O ARG A 650 5.078 19.497 -3.955 1.00 44.11 O ATOM 990 CB ARG A 650 7.986 20.098 -4.513 1.00 71.33 C ATOM 991 CG ARG A 650 7.722 20.369 -3.080 1.00 34.30 C ATOM 992 CD ARG A 650 7.970 19.145 -2.212 1.00 34.35 C ATOM 993 NE ARG A 650 9.317 18.602 -2.363 1.00 72.53 N ATOM 994 CZ ARG A 650 9.689 17.397 -1.927 1.00 42.23 C ATOM 995 NH1 ARG A 650 8.819 16.627 -1.284 1.00 61.20 N ATOM 996 NH2 ARG A 650 10.924 16.966 -2.124 1.00 44.34 N ATOM 0 H ARG A 650 7.903 17.783 -6.655 1.00 43.44 H new ATOM 0 HA ARG A 650 7.443 18.068 -4.495 1.00 22.12 H new ATOM 0 HB2 ARG A 650 9.048 19.888 -4.640 1.00 71.33 H new ATOM 0 HB3 ARG A 650 7.768 20.999 -5.086 1.00 71.33 H new ATOM 0 HG2 ARG A 650 8.358 21.187 -2.743 1.00 34.30 H new ATOM 0 HG3 ARG A 650 6.690 20.697 -2.958 1.00 34.30 H new ATOM 0 HD2 ARG A 650 7.805 19.408 -1.167 1.00 34.35 H new ATOM 0 HD3 ARG A 650 7.243 18.374 -2.465 1.00 34.35 H new ATOM 0 HE ARG A 650 10.016 19.179 -2.830 1.00 72.53 H new ATOM 0 HH11 ARG A 650 7.867 16.957 -1.124 1.00 61.20 H new ATOM 0 HH12 ARG A 650 9.103 15.706 -0.950 1.00 61.20 H new ATOM 0 HH21 ARG A 650 11.598 17.556 -2.612 1.00 44.34 H new ATOM 0 HH22 ARG A 650 11.202 16.044 -1.788 1.00 44.34 H new ATOM 1008 N LYS A 651 4.976 18.608 -5.994 1.00 74.12 N ATOM 1009 CA LYS A 651 3.534 18.554 -6.069 1.00 33.44 C ATOM 1010 C LYS A 651 3.055 17.272 -5.445 1.00 44.50 C ATOM 1011 O LYS A 651 3.647 16.224 -5.687 1.00 72.50 O ATOM 1012 CB LYS A 651 3.142 18.519 -7.530 1.00 73.31 C ATOM 1013 CG LYS A 651 3.345 19.767 -8.295 1.00 54.13 C ATOM 1014 CD LYS A 651 2.251 20.737 -8.005 1.00 71.13 C ATOM 1015 CE LYS A 651 2.347 21.928 -8.898 1.00 30.30 C ATOM 1016 NZ LYS A 651 3.613 22.678 -8.718 1.00 31.33 N ATOM 0 H LYS A 651 5.437 18.246 -6.829 1.00 74.12 H new ATOM 0 HA LYS A 651 3.103 19.414 -5.557 1.00 33.44 H new ATOM 0 HB2 LYS A 651 3.708 17.724 -8.016 1.00 73.31 H new ATOM 0 HB3 LYS A 651 2.089 18.246 -7.595 1.00 73.31 H new ATOM 0 HG2 LYS A 651 4.308 20.207 -8.036 1.00 54.13 H new ATOM 0 HG3 LYS A 651 3.371 19.547 -9.362 1.00 54.13 H new ATOM 0 HD2 LYS A 651 1.284 20.252 -8.141 1.00 71.13 H new ATOM 0 HD3 LYS A 651 2.306 21.053 -6.963 1.00 71.13 H new ATOM 0 HE2 LYS A 651 2.265 21.606 -9.936 1.00 30.30 H new ATOM 0 HE3 LYS A 651 1.505 22.592 -8.703 1.00 30.30 H new ATOM 0 HZ1 LYS A 651 3.564 23.573 -9.245 1.00 31.33 H new ATOM 0 HZ2 LYS A 651 3.757 22.879 -7.708 1.00 31.33 H new ATOM 0 HZ3 LYS A 651 4.407 22.109 -9.074 1.00 31.33 H new ATOM 1030 N SER A 652 2.008 17.329 -4.672 1.00 31.43 N ATOM 1031 CA SER A 652 1.459 16.123 -4.128 1.00 70.13 C ATOM 1032 C SER A 652 0.014 16.006 -4.544 1.00 23.33 C ATOM 1033 O SER A 652 -0.688 17.012 -4.682 1.00 31.24 O ATOM 1034 CB SER A 652 1.559 16.062 -2.609 1.00 75.42 C ATOM 1035 OG SER A 652 2.855 16.397 -2.135 1.00 72.25 O ATOM 0 H SER A 652 1.523 18.187 -4.408 1.00 31.43 H new ATOM 0 HA SER A 652 2.044 15.291 -4.520 1.00 70.13 H new ATOM 0 HB2 SER A 652 0.829 16.743 -2.172 1.00 75.42 H new ATOM 0 HB3 SER A 652 1.300 15.058 -2.271 1.00 75.42 H new ATOM 0 HG SER A 652 3.037 15.906 -1.307 1.00 72.25 H new ATOM 1041 N TRP A 653 -0.418 14.807 -4.764 1.00 55.51 N ATOM 1042 CA TRP A 653 -1.767 14.540 -5.161 1.00 12.42 C ATOM 1043 C TRP A 653 -2.364 13.545 -4.198 1.00 23.42 C ATOM 1044 O TRP A 653 -1.667 12.649 -3.702 1.00 31.54 O ATOM 1045 CB TRP A 653 -1.824 14.028 -6.609 1.00 73.33 C ATOM 1046 CG TRP A 653 -1.271 15.011 -7.618 1.00 12.13 C ATOM 1047 CD1 TRP A 653 -1.959 15.994 -8.269 1.00 43.34 C ATOM 1048 CD2 TRP A 653 0.085 15.103 -8.079 1.00 41.54 C ATOM 1049 NE1 TRP A 653 -1.112 16.686 -9.108 1.00 23.13 N ATOM 1050 CE2 TRP A 653 0.141 16.157 -9.009 1.00 44.24 C ATOM 1051 CE3 TRP A 653 1.252 14.396 -7.797 1.00 42.32 C ATOM 1052 CZ2 TRP A 653 1.316 16.515 -9.655 1.00 13.21 C ATOM 1053 CZ3 TRP A 653 2.416 14.750 -8.429 1.00 53.13 C ATOM 1054 CH2 TRP A 653 2.443 15.804 -9.354 1.00 11.03 C ATOM 0 H TRP A 653 0.162 13.973 -4.673 1.00 55.51 H new ATOM 0 HA TRP A 653 -2.349 15.461 -5.131 1.00 12.42 H new ATOM 0 HB2 TRP A 653 -1.265 13.095 -6.678 1.00 73.33 H new ATOM 0 HB3 TRP A 653 -2.859 13.800 -6.865 1.00 73.33 H new ATOM 0 HD1 TRP A 653 -3.012 16.199 -8.145 1.00 43.34 H new ATOM 0 HE1 TRP A 653 -1.379 17.468 -9.706 1.00 23.13 H new ATOM 0 HE3 TRP A 653 1.240 13.580 -7.090 1.00 42.32 H new ATOM 0 HZ2 TRP A 653 1.339 17.325 -10.369 1.00 13.21 H new ATOM 0 HZ3 TRP A 653 3.325 14.209 -8.211 1.00 53.13 H new ATOM 0 HH2 TRP A 653 3.374 16.059 -9.838 1.00 11.03 H new ATOM 1065 N ASN A 654 -3.628 13.675 -3.950 1.00 11.34 N ATOM 1066 CA ASN A 654 -4.289 12.876 -2.947 1.00 25.15 C ATOM 1067 C ASN A 654 -4.918 11.672 -3.589 1.00 33.20 C ATOM 1068 O ASN A 654 -5.848 11.794 -4.385 1.00 41.42 O ATOM 1069 CB ASN A 654 -5.343 13.728 -2.258 1.00 61.20 C ATOM 1070 CG ASN A 654 -6.025 13.069 -1.096 1.00 2.31 C ATOM 1071 OD1 ASN A 654 -5.496 12.156 -0.472 1.00 31.02 O ATOM 1072 ND2 ASN A 654 -7.174 13.570 -0.759 1.00 43.12 N ATOM 0 H ASN A 654 -4.238 14.335 -4.432 1.00 11.34 H new ATOM 0 HA ASN A 654 -3.567 12.530 -2.207 1.00 25.15 H new ATOM 0 HB2 ASN A 654 -4.875 14.649 -1.911 1.00 61.20 H new ATOM 0 HB3 ASN A 654 -6.098 14.010 -2.992 1.00 61.20 H new ATOM 0 HD21 ASN A 654 -7.672 13.204 0.053 1.00 43.12 H new ATOM 0 HD22 ASN A 654 -7.579 14.330 -1.306 1.00 43.12 H new ATOM 1078 N LEU A 655 -4.402 10.517 -3.233 1.00 12.43 N ATOM 1079 CA LEU A 655 -4.797 9.255 -3.821 1.00 60.30 C ATOM 1080 C LEU A 655 -5.773 8.534 -2.913 1.00 33.23 C ATOM 1081 O LEU A 655 -5.997 7.328 -3.046 1.00 33.55 O ATOM 1082 CB LEU A 655 -3.564 8.379 -4.013 1.00 72.35 C ATOM 1083 CG LEU A 655 -2.419 8.971 -4.819 1.00 43.24 C ATOM 1084 CD1 LEU A 655 -1.290 7.969 -4.932 1.00 43.43 C ATOM 1085 CD2 LEU A 655 -2.890 9.400 -6.190 1.00 61.14 C ATOM 0 H LEU A 655 -3.684 10.426 -2.515 1.00 12.43 H new ATOM 0 HA LEU A 655 -5.275 9.450 -4.781 1.00 60.30 H new ATOM 0 HB2 LEU A 655 -3.182 8.110 -3.028 1.00 72.35 H new ATOM 0 HB3 LEU A 655 -3.877 7.454 -4.497 1.00 72.35 H new ATOM 0 HG LEU A 655 -2.052 9.856 -4.299 1.00 43.24 H new ATOM 0 HD11 LEU A 655 -0.475 8.403 -5.511 1.00 43.43 H new ATOM 0 HD12 LEU A 655 -0.930 7.712 -3.936 1.00 43.43 H new ATOM 0 HD13 LEU A 655 -1.651 7.069 -5.431 1.00 43.43 H new ATOM 0 HD21 LEU A 655 -2.053 9.820 -6.747 1.00 61.14 H new ATOM 0 HD22 LEU A 655 -3.286 8.537 -6.725 1.00 61.14 H new ATOM 0 HD23 LEU A 655 -3.672 10.153 -6.087 1.00 61.14 H new ATOM 1093 N GLY A 656 -6.328 9.251 -1.987 1.00 24.12 N ATOM 1094 CA GLY A 656 -7.294 8.673 -1.128 1.00 65.43 C ATOM 1095 C GLY A 656 -7.239 9.241 0.238 1.00 53.14 C ATOM 1096 O GLY A 656 -6.165 9.309 0.859 1.00 33.42 O ATOM 0 H GLY A 656 -6.125 10.235 -1.812 1.00 24.12 H new ATOM 0 HA2 GLY A 656 -8.289 8.830 -1.545 1.00 65.43 H new ATOM 0 HA3 GLY A 656 -7.135 7.596 -1.078 1.00 65.43 H new ATOM 1100 N ARG A 657 -8.385 9.664 0.726 1.00 61.20 N ATOM 1101 CA ARG A 657 -8.476 10.192 2.046 1.00 55.23 C ATOM 1102 C ARG A 657 -8.369 9.035 3.027 1.00 51.34 C ATOM 1103 O ARG A 657 -8.467 7.864 2.621 1.00 33.24 O ATOM 1104 CB ARG A 657 -9.805 10.937 2.244 1.00 31.23 C ATOM 1105 CG ARG A 657 -10.130 11.928 1.131 1.00 63.54 C ATOM 1106 CD ARG A 657 -11.372 12.751 1.430 1.00 43.04 C ATOM 1107 NE ARG A 657 -12.576 11.933 1.622 1.00 14.15 N ATOM 1108 CZ ARG A 657 -13.744 12.129 0.981 1.00 35.41 C ATOM 1109 NH1 ARG A 657 -13.856 13.092 0.064 1.00 64.44 N ATOM 1110 NH2 ARG A 657 -14.799 11.372 1.271 1.00 64.11 N ATOM 0 H ARG A 657 -9.267 9.647 0.214 1.00 61.20 H new ATOM 0 HA ARG A 657 -7.669 10.906 2.214 1.00 55.23 H new ATOM 0 HB2 ARG A 657 -10.612 10.208 2.315 1.00 31.23 H new ATOM 0 HB3 ARG A 657 -9.773 11.470 3.194 1.00 31.23 H new ATOM 0 HG2 ARG A 657 -9.282 12.596 0.985 1.00 63.54 H new ATOM 0 HG3 ARG A 657 -10.273 11.386 0.196 1.00 63.54 H new ATOM 0 HD2 ARG A 657 -11.198 13.346 2.326 1.00 43.04 H new ATOM 0 HD3 ARG A 657 -11.542 13.450 0.611 1.00 43.04 H new ATOM 0 HE ARG A 657 -12.524 11.162 2.288 1.00 14.15 H new ATOM 0 HH11 ARG A 657 -13.055 13.684 -0.154 1.00 64.44 H new ATOM 0 HH12 ARG A 657 -14.743 13.236 -0.419 1.00 64.44 H new ATOM 0 HH21 ARG A 657 -14.724 10.642 1.980 1.00 64.11 H new ATOM 0 HH22 ARG A 657 -15.683 11.522 0.785 1.00 64.11 H new ATOM 1122 N SER A 658 -8.185 9.355 4.273 1.00 2.23 N ATOM 1123 CA SER A 658 -8.049 8.371 5.329 1.00 42.34 C ATOM 1124 C SER A 658 -9.250 7.414 5.375 1.00 71.15 C ATOM 1125 O SER A 658 -10.402 7.849 5.428 1.00 74.33 O ATOM 1126 CB SER A 658 -7.901 9.109 6.649 1.00 51.22 C ATOM 1127 OG SER A 658 -8.941 10.071 6.797 1.00 72.05 O ATOM 0 H SER A 658 -8.123 10.319 4.599 1.00 2.23 H new ATOM 0 HA SER A 658 -7.168 7.758 5.136 1.00 42.34 H new ATOM 0 HB2 SER A 658 -7.933 8.399 7.476 1.00 51.22 H new ATOM 0 HB3 SER A 658 -6.930 9.603 6.690 1.00 51.22 H new ATOM 0 HG SER A 658 -9.759 9.736 6.375 1.00 72.05 H new ATOM 1133 N ASN A 659 -8.960 6.127 5.331 1.00 23.43 N ATOM 1134 CA ASN A 659 -9.974 5.084 5.316 1.00 43.41 C ATOM 1135 C ASN A 659 -9.345 3.800 5.832 1.00 71.34 C ATOM 1136 O ASN A 659 -8.149 3.636 5.734 1.00 44.42 O ATOM 1137 CB ASN A 659 -10.466 4.877 3.882 1.00 51.33 C ATOM 1138 CG ASN A 659 -11.566 3.852 3.776 1.00 15.30 C ATOM 1139 OD1 ASN A 659 -12.364 3.674 4.688 1.00 53.34 O ATOM 1140 ND2 ASN A 659 -11.590 3.160 2.684 1.00 55.13 N ATOM 0 H ASN A 659 -8.005 5.771 5.304 1.00 23.43 H new ATOM 0 HA ASN A 659 -10.819 5.366 5.945 1.00 43.41 H new ATOM 0 HB2 ASN A 659 -10.824 5.827 3.486 1.00 51.33 H new ATOM 0 HB3 ASN A 659 -9.628 4.567 3.258 1.00 51.33 H new ATOM 0 HD21 ASN A 659 -12.293 2.432 2.557 1.00 55.13 H new ATOM 0 HD22 ASN A 659 -10.906 3.342 1.950 1.00 55.13 H new ATOM 1146 N ALA A 660 -10.118 2.909 6.391 1.00 14.21 N ATOM 1147 CA ALA A 660 -9.547 1.681 6.906 1.00 33.03 C ATOM 1148 C ALA A 660 -10.303 0.463 6.423 1.00 63.20 C ATOM 1149 O ALA A 660 -10.054 -0.639 6.889 1.00 63.14 O ATOM 1150 CB ALA A 660 -9.511 1.715 8.429 1.00 3.44 C ATOM 0 H ALA A 660 -11.128 3.001 6.503 1.00 14.21 H new ATOM 0 HA ALA A 660 -8.528 1.605 6.526 1.00 33.03 H new ATOM 0 HB1 ALA A 660 -9.080 0.787 8.804 1.00 3.44 H new ATOM 0 HB2 ALA A 660 -8.903 2.557 8.760 1.00 3.44 H new ATOM 0 HB3 ALA A 660 -10.525 1.826 8.815 1.00 3.44 H new ATOM 1156 N LYS A 661 -11.196 0.649 5.474 1.00 63.40 N ATOM 1157 CA LYS A 661 -12.029 -0.450 5.009 1.00 31.51 C ATOM 1158 C LYS A 661 -11.259 -1.376 4.077 1.00 52.42 C ATOM 1159 O LYS A 661 -10.883 -0.991 2.958 1.00 45.51 O ATOM 1160 CB LYS A 661 -13.304 0.060 4.324 1.00 41.31 C ATOM 1161 CG LYS A 661 -14.099 1.049 5.145 1.00 15.22 C ATOM 1162 CD LYS A 661 -14.406 0.503 6.519 1.00 73.20 C ATOM 1163 CE LYS A 661 -15.318 1.429 7.268 1.00 22.04 C ATOM 1164 NZ LYS A 661 -14.752 2.798 7.409 1.00 4.15 N ATOM 0 H LYS A 661 -11.366 1.541 5.010 1.00 63.40 H new ATOM 0 HA LYS A 661 -12.324 -1.021 5.889 1.00 31.51 H new ATOM 0 HB2 LYS A 661 -13.032 0.527 3.378 1.00 41.31 H new ATOM 0 HB3 LYS A 661 -13.941 -0.792 4.087 1.00 41.31 H new ATOM 0 HG2 LYS A 661 -13.539 1.980 5.238 1.00 15.22 H new ATOM 0 HG3 LYS A 661 -15.030 1.287 4.630 1.00 15.22 H new ATOM 0 HD2 LYS A 661 -14.871 -0.479 6.430 1.00 73.20 H new ATOM 0 HD3 LYS A 661 -13.479 0.368 7.077 1.00 73.20 H new ATOM 0 HE2 LYS A 661 -16.276 1.487 6.751 1.00 22.04 H new ATOM 0 HE3 LYS A 661 -15.515 1.017 8.258 1.00 22.04 H new ATOM 0 HZ1 LYS A 661 -15.397 3.384 7.977 1.00 4.15 H new ATOM 0 HZ2 LYS A 661 -13.827 2.744 7.881 1.00 4.15 H new ATOM 0 HZ3 LYS A 661 -14.636 3.224 6.468 1.00 4.15 H new ATOM 1178 N LEU A 662 -11.009 -2.579 4.542 1.00 63.03 N ATOM 1179 CA LEU A 662 -10.312 -3.569 3.749 1.00 41.01 C ATOM 1180 C LEU A 662 -11.296 -4.300 2.852 1.00 13.21 C ATOM 1181 O LEU A 662 -12.478 -4.380 3.152 1.00 53.33 O ATOM 1182 CB LEU A 662 -9.573 -4.588 4.618 1.00 3.32 C ATOM 1183 CG LEU A 662 -8.497 -4.084 5.577 1.00 44.20 C ATOM 1184 CD1 LEU A 662 -7.767 -5.259 6.187 1.00 25.12 C ATOM 1185 CD2 LEU A 662 -7.529 -3.146 4.892 1.00 3.11 C ATOM 0 H LEU A 662 -11.280 -2.898 5.472 1.00 63.03 H new ATOM 0 HA LEU A 662 -9.573 -3.039 3.148 1.00 41.01 H new ATOM 0 HB2 LEU A 662 -10.318 -5.123 5.207 1.00 3.32 H new ATOM 0 HB3 LEU A 662 -9.109 -5.316 3.953 1.00 3.32 H new ATOM 0 HG LEU A 662 -8.986 -3.515 6.368 1.00 44.20 H new ATOM 0 HD11 LEU A 662 -7.000 -4.896 6.871 1.00 25.12 H new ATOM 0 HD12 LEU A 662 -8.474 -5.883 6.734 1.00 25.12 H new ATOM 0 HD13 LEU A 662 -7.300 -5.847 5.397 1.00 25.12 H new ATOM 0 HD21 LEU A 662 -6.779 -2.810 5.608 1.00 3.11 H new ATOM 0 HD22 LEU A 662 -7.038 -3.667 4.070 1.00 3.11 H new ATOM 0 HD23 LEU A 662 -8.071 -2.284 4.503 1.00 3.11 H new ATOM 1193 N SER A 663 -10.826 -4.801 1.758 1.00 54.41 N ATOM 1194 CA SER A 663 -11.647 -5.517 0.831 1.00 61.21 C ATOM 1195 C SER A 663 -11.048 -6.907 0.595 1.00 63.34 C ATOM 1196 O SER A 663 -9.847 -7.066 0.589 1.00 65.10 O ATOM 1197 CB SER A 663 -11.702 -4.735 -0.480 1.00 44.34 C ATOM 1198 OG SER A 663 -12.116 -3.387 -0.240 1.00 71.34 O ATOM 0 H SER A 663 -9.849 -4.725 1.476 1.00 54.41 H new ATOM 0 HA SER A 663 -12.656 -5.631 1.227 1.00 61.21 H new ATOM 0 HB2 SER A 663 -10.721 -4.742 -0.956 1.00 44.34 H new ATOM 0 HB3 SER A 663 -12.395 -5.217 -1.170 1.00 44.34 H new ATOM 0 HG SER A 663 -11.811 -2.815 -0.975 1.00 71.34 H new ATOM 1204 N TYR A 664 -11.857 -7.894 0.435 1.00 31.22 N ATOM 1205 CA TYR A 664 -11.327 -9.200 0.133 1.00 54.33 C ATOM 1206 C TYR A 664 -11.802 -9.525 -1.242 1.00 33.31 C ATOM 1207 O TYR A 664 -12.979 -9.327 -1.552 1.00 52.22 O ATOM 1208 CB TYR A 664 -11.847 -10.271 1.105 1.00 53.30 C ATOM 1209 CG TYR A 664 -11.016 -11.554 1.179 1.00 13.41 C ATOM 1210 CD1 TYR A 664 -10.874 -12.397 0.085 1.00 4.12 C ATOM 1211 CD2 TYR A 664 -10.378 -11.911 2.353 1.00 15.15 C ATOM 1212 CE1 TYR A 664 -10.127 -13.552 0.158 1.00 61.30 C ATOM 1213 CE2 TYR A 664 -9.628 -13.067 2.433 1.00 64.14 C ATOM 1214 CZ TYR A 664 -9.508 -13.882 1.333 1.00 23.21 C ATOM 1215 OH TYR A 664 -8.760 -15.036 1.410 1.00 13.31 O ATOM 0 H TYR A 664 -12.873 -7.837 0.504 1.00 31.22 H new ATOM 0 HA TYR A 664 -10.240 -9.191 0.218 1.00 54.33 H new ATOM 0 HB2 TYR A 664 -11.900 -9.836 2.103 1.00 53.30 H new ATOM 0 HB3 TYR A 664 -12.865 -10.534 0.817 1.00 53.30 H new ATOM 0 HD1 TYR A 664 -11.360 -12.141 -0.845 1.00 4.12 H new ATOM 0 HD2 TYR A 664 -10.468 -11.275 3.221 1.00 15.15 H new ATOM 0 HE1 TYR A 664 -10.030 -14.193 -0.706 1.00 61.30 H new ATOM 0 HE2 TYR A 664 -9.137 -13.330 3.358 1.00 64.14 H new ATOM 0 HH TYR A 664 -8.387 -15.124 2.312 1.00 13.31 H new ATOM 1225 N TYR A 665 -10.921 -9.955 -2.061 1.00 75.30 N ATOM 1226 CA TYR A 665 -11.257 -10.358 -3.370 1.00 14.14 C ATOM 1227 C TYR A 665 -10.932 -11.819 -3.447 1.00 30.24 C ATOM 1228 O TYR A 665 -9.950 -12.242 -2.861 1.00 1.32 O ATOM 1229 CB TYR A 665 -10.423 -9.570 -4.369 1.00 45.31 C ATOM 1230 CG TYR A 665 -10.832 -9.814 -5.775 1.00 22.43 C ATOM 1231 CD1 TYR A 665 -11.990 -9.250 -6.261 1.00 73.22 C ATOM 1232 CD2 TYR A 665 -10.085 -10.620 -6.616 1.00 23.21 C ATOM 1233 CE1 TYR A 665 -12.400 -9.470 -7.537 1.00 14.03 C ATOM 1234 CE2 TYR A 665 -10.487 -10.849 -7.905 1.00 44.14 C ATOM 1235 CZ TYR A 665 -11.648 -10.271 -8.365 1.00 22.12 C ATOM 1236 OH TYR A 665 -12.054 -10.490 -9.660 1.00 41.11 O ATOM 0 H TYR A 665 -9.929 -10.038 -1.837 1.00 75.30 H new ATOM 0 HA TYR A 665 -12.307 -10.179 -3.600 1.00 14.14 H new ATOM 0 HB2 TYR A 665 -10.510 -8.506 -4.149 1.00 45.31 H new ATOM 0 HB3 TYR A 665 -9.373 -9.836 -4.249 1.00 45.31 H new ATOM 0 HD1 TYR A 665 -12.584 -8.620 -5.615 1.00 73.22 H new ATOM 0 HD2 TYR A 665 -9.175 -11.073 -6.252 1.00 23.21 H new ATOM 0 HE1 TYR A 665 -13.312 -9.019 -7.900 1.00 14.03 H new ATOM 0 HE2 TYR A 665 -9.897 -11.478 -8.555 1.00 44.14 H new ATOM 0 HH TYR A 665 -11.411 -11.077 -10.110 1.00 41.11 H new ATOM 1246 N ASP A 666 -11.760 -12.602 -4.100 1.00 42.44 N ATOM 1247 CA ASP A 666 -11.495 -14.030 -4.212 1.00 10.35 C ATOM 1248 C ASP A 666 -10.103 -14.248 -4.768 1.00 25.50 C ATOM 1249 O ASP A 666 -9.790 -13.822 -5.881 1.00 10.02 O ATOM 1250 CB ASP A 666 -12.550 -14.715 -5.095 1.00 0.10 C ATOM 1251 CG ASP A 666 -12.292 -16.199 -5.281 1.00 12.31 C ATOM 1252 OD1 ASP A 666 -12.441 -16.967 -4.313 1.00 74.23 O ATOM 1253 OD2 ASP A 666 -11.960 -16.622 -6.406 1.00 73.02 O ATOM 0 H ASP A 666 -12.614 -12.286 -4.559 1.00 42.44 H new ATOM 0 HA ASP A 666 -11.553 -14.478 -3.220 1.00 10.35 H new ATOM 0 HB2 ASP A 666 -13.535 -14.576 -4.650 1.00 0.10 H new ATOM 0 HB3 ASP A 666 -12.570 -14.230 -6.071 1.00 0.10 H new ATOM 1258 N GLY A 667 -9.273 -14.888 -3.982 1.00 54.10 N ATOM 1259 CA GLY A 667 -7.914 -15.088 -4.361 1.00 71.12 C ATOM 1260 C GLY A 667 -6.929 -14.284 -3.505 1.00 31.02 C ATOM 1261 O GLY A 667 -5.958 -14.842 -3.024 1.00 62.21 O ATOM 0 H GLY A 667 -9.525 -15.277 -3.074 1.00 54.10 H new ATOM 0 HA2 GLY A 667 -7.673 -16.148 -4.283 1.00 71.12 H new ATOM 0 HA3 GLY A 667 -7.789 -14.809 -5.407 1.00 71.12 H new ATOM 1265 N MET A 668 -7.197 -12.973 -3.290 1.00 54.10 N ATOM 1266 CA MET A 668 -6.249 -12.073 -2.565 1.00 32.42 C ATOM 1267 C MET A 668 -6.983 -10.901 -1.900 1.00 61.02 C ATOM 1268 O MET A 668 -8.039 -10.478 -2.344 1.00 41.25 O ATOM 1269 CB MET A 668 -5.175 -11.482 -3.515 1.00 70.31 C ATOM 1270 CG MET A 668 -4.229 -12.494 -4.170 1.00 31.13 C ATOM 1271 SD MET A 668 -3.145 -13.358 -2.996 1.00 53.21 S ATOM 1272 CE MET A 668 -2.296 -14.480 -4.106 1.00 4.22 C ATOM 0 H MET A 668 -8.052 -12.513 -3.603 1.00 54.10 H new ATOM 0 HA MET A 668 -5.770 -12.692 -1.807 1.00 32.42 H new ATOM 0 HB2 MET A 668 -5.682 -10.925 -4.303 1.00 70.31 H new ATOM 0 HB3 MET A 668 -4.576 -10.765 -2.953 1.00 70.31 H new ATOM 0 HG2 MET A 668 -4.821 -13.231 -4.712 1.00 31.13 H new ATOM 0 HG3 MET A 668 -3.612 -11.977 -4.905 1.00 31.13 H new ATOM 0 HE1 MET A 668 -2.152 -15.441 -3.612 1.00 4.22 H new ATOM 0 HE2 MET A 668 -2.892 -14.621 -5.007 1.00 4.22 H new ATOM 0 HE3 MET A 668 -1.326 -14.062 -4.374 1.00 4.22 H new ATOM 1282 N ILE A 669 -6.395 -10.364 -0.867 1.00 32.41 N ATOM 1283 CA ILE A 669 -6.971 -9.248 -0.128 1.00 64.21 C ATOM 1284 C ILE A 669 -6.602 -7.909 -0.797 1.00 64.23 C ATOM 1285 O ILE A 669 -5.505 -7.751 -1.311 1.00 31.24 O ATOM 1286 CB ILE A 669 -6.528 -9.260 1.366 1.00 54.40 C ATOM 1287 CG1 ILE A 669 -6.964 -10.573 2.028 1.00 22.33 C ATOM 1288 CG2 ILE A 669 -7.118 -8.068 2.126 1.00 44.32 C ATOM 1289 CD1 ILE A 669 -6.523 -10.714 3.465 1.00 13.31 C ATOM 0 H ILE A 669 -5.497 -10.682 -0.503 1.00 32.41 H new ATOM 0 HA ILE A 669 -8.055 -9.360 -0.149 1.00 64.21 H new ATOM 0 HB ILE A 669 -5.442 -9.180 1.401 1.00 54.40 H new ATOM 0 HG12 ILE A 669 -8.051 -10.647 1.984 1.00 22.33 H new ATOM 0 HG13 ILE A 669 -6.564 -11.408 1.453 1.00 22.33 H new ATOM 0 HG21 ILE A 669 -6.792 -8.102 3.166 1.00 44.32 H new ATOM 0 HG22 ILE A 669 -6.776 -7.140 1.669 1.00 44.32 H new ATOM 0 HG23 ILE A 669 -8.206 -8.113 2.085 1.00 44.32 H new ATOM 0 HD11 ILE A 669 -6.871 -11.668 3.860 1.00 13.31 H new ATOM 0 HD12 ILE A 669 -5.435 -10.674 3.517 1.00 13.31 H new ATOM 0 HD13 ILE A 669 -6.945 -9.901 4.056 1.00 13.31 H new ATOM 1296 N GLN A 670 -7.540 -6.991 -0.837 1.00 74.32 N ATOM 1297 CA GLN A 670 -7.346 -5.676 -1.422 1.00 53.32 C ATOM 1298 C GLN A 670 -7.741 -4.571 -0.424 1.00 43.35 C ATOM 1299 O GLN A 670 -8.419 -4.826 0.546 1.00 2.43 O ATOM 1300 CB GLN A 670 -8.138 -5.550 -2.735 1.00 4.32 C ATOM 1301 CG GLN A 670 -7.566 -6.380 -3.890 1.00 70.50 C ATOM 1302 CD GLN A 670 -8.422 -6.366 -5.151 1.00 61.11 C ATOM 1303 OE1 GLN A 670 -9.186 -5.319 -5.350 1.00 54.23 O flip ATOM 1304 NE2 GLN A 670 -8.411 -7.315 -5.927 1.00 55.23 N flip ATOM 0 H GLN A 670 -8.476 -7.135 -0.459 1.00 74.32 H new ATOM 0 HA GLN A 670 -6.288 -5.552 -1.653 1.00 53.32 H new ATOM 0 HB2 GLN A 670 -9.169 -5.856 -2.556 1.00 4.32 H new ATOM 0 HB3 GLN A 670 -8.164 -4.502 -3.032 1.00 4.32 H new ATOM 0 HG2 GLN A 670 -6.572 -6.006 -4.135 1.00 70.50 H new ATOM 0 HG3 GLN A 670 -7.445 -7.411 -3.557 1.00 70.50 H new ATOM 0 HE21 GLN A 670 -7.806 -8.116 -5.745 1.00 55.23 H new ATOM 0 HE22 GLN A 670 -9.007 -7.304 -6.755 1.00 55.23 H new ATOM 1312 N LEU A 671 -7.286 -3.372 -0.639 1.00 40.33 N ATOM 1313 CA LEU A 671 -7.669 -2.265 0.220 1.00 23.03 C ATOM 1314 C LEU A 671 -8.157 -1.159 -0.689 1.00 74.12 C ATOM 1315 O LEU A 671 -7.448 -0.777 -1.624 1.00 64.13 O ATOM 1316 CB LEU A 671 -6.450 -1.794 1.066 1.00 13.43 C ATOM 1317 CG LEU A 671 -6.719 -0.960 2.350 1.00 54.11 C ATOM 1318 CD1 LEU A 671 -5.419 -0.607 3.046 1.00 75.03 C ATOM 1319 CD2 LEU A 671 -7.548 0.288 2.105 1.00 45.24 C ATOM 0 H LEU A 671 -6.650 -3.125 -1.397 1.00 40.33 H new ATOM 0 HA LEU A 671 -8.451 -2.558 0.921 1.00 23.03 H new ATOM 0 HB2 LEU A 671 -5.886 -2.680 1.358 1.00 13.43 H new ATOM 0 HB3 LEU A 671 -5.803 -1.204 0.416 1.00 13.43 H new ATOM 0 HG LEU A 671 -7.316 -1.599 3.001 1.00 54.11 H new ATOM 0 HD11 LEU A 671 -5.633 -0.023 3.942 1.00 75.03 H new ATOM 0 HD12 LEU A 671 -4.896 -1.522 3.325 1.00 75.03 H new ATOM 0 HD13 LEU A 671 -4.793 -0.022 2.372 1.00 75.03 H new ATOM 0 HD21 LEU A 671 -7.694 0.818 3.046 1.00 45.24 H new ATOM 0 HD22 LEU A 671 -7.029 0.937 1.400 1.00 45.24 H new ATOM 0 HD23 LEU A 671 -8.517 0.006 1.693 1.00 45.24 H new ATOM 1327 N THR A 672 -9.345 -0.665 -0.433 1.00 1.14 N ATOM 1328 CA THR A 672 -9.943 0.352 -1.267 1.00 44.01 C ATOM 1329 C THR A 672 -9.932 1.713 -0.536 1.00 3.54 C ATOM 1330 O THR A 672 -10.528 1.850 0.522 1.00 32.03 O ATOM 1331 CB THR A 672 -11.414 -0.037 -1.588 1.00 52.40 C ATOM 1332 OG1 THR A 672 -11.465 -1.399 -2.093 1.00 23.14 O ATOM 1333 CG2 THR A 672 -12.003 0.902 -2.637 1.00 13.45 C ATOM 0 H THR A 672 -9.923 -0.955 0.356 1.00 1.14 H new ATOM 0 HA THR A 672 -9.369 0.432 -2.190 1.00 44.01 H new ATOM 0 HB THR A 672 -11.996 0.042 -0.670 1.00 52.40 H new ATOM 0 HG1 THR A 672 -11.694 -1.386 -3.046 1.00 23.14 H new ATOM 0 HG21 THR A 672 -13.033 0.613 -2.847 1.00 13.45 H new ATOM 0 HG22 THR A 672 -11.983 1.925 -2.262 1.00 13.45 H new ATOM 0 HG23 THR A 672 -11.415 0.840 -3.552 1.00 13.45 H new ATOM 1339 N TYR A 673 -9.227 2.690 -1.074 1.00 73.54 N ATOM 1340 CA TYR A 673 -9.241 4.028 -0.501 1.00 14.44 C ATOM 1341 C TYR A 673 -10.224 4.958 -1.181 1.00 24.23 C ATOM 1342 O TYR A 673 -10.865 4.601 -2.178 1.00 21.25 O ATOM 1343 CB TYR A 673 -7.853 4.663 -0.409 1.00 61.11 C ATOM 1344 CG TYR A 673 -7.070 4.236 0.801 1.00 33.14 C ATOM 1345 CD1 TYR A 673 -7.393 4.758 2.035 1.00 33.45 C ATOM 1346 CD2 TYR A 673 -6.025 3.324 0.727 1.00 63.24 C ATOM 1347 CE1 TYR A 673 -6.723 4.391 3.168 1.00 61.23 C ATOM 1348 CE2 TYR A 673 -5.332 2.950 1.871 1.00 1.24 C ATOM 1349 CZ TYR A 673 -5.700 3.492 3.093 1.00 5.14 C ATOM 1350 OH TYR A 673 -5.053 3.124 4.244 1.00 72.05 O ATOM 0 H TYR A 673 -8.640 2.587 -1.902 1.00 73.54 H new ATOM 0 HA TYR A 673 -9.591 3.884 0.521 1.00 14.44 H new ATOM 0 HB2 TYR A 673 -7.287 4.408 -1.305 1.00 61.11 H new ATOM 0 HB3 TYR A 673 -7.960 5.748 -0.397 1.00 61.11 H new ATOM 0 HD1 TYR A 673 -8.197 5.476 2.108 1.00 33.45 H new ATOM 0 HD2 TYR A 673 -5.749 2.902 -0.228 1.00 63.24 H new ATOM 0 HE1 TYR A 673 -7.003 4.812 4.122 1.00 61.23 H new ATOM 0 HE2 TYR A 673 -4.516 2.245 1.809 1.00 1.24 H new ATOM 0 HH TYR A 673 -4.091 3.277 4.142 1.00 72.05 H new ATOM 1360 N ARG A 674 -10.338 6.156 -0.628 1.00 71.12 N ATOM 1361 CA ARG A 674 -11.266 7.145 -1.115 1.00 32.21 C ATOM 1362 C ARG A 674 -10.823 7.838 -2.379 1.00 31.13 C ATOM 1363 O ARG A 674 -9.723 7.656 -2.858 1.00 52.21 O ATOM 1364 CB ARG A 674 -11.602 8.187 -0.049 1.00 52.32 C ATOM 1365 CG ARG A 674 -12.453 7.680 1.092 1.00 11.45 C ATOM 1366 CD ARG A 674 -13.762 7.103 0.566 1.00 53.25 C ATOM 1367 NE ARG A 674 -14.448 8.035 -0.355 1.00 12.21 N ATOM 1368 CZ ARG A 674 -15.553 7.749 -1.037 1.00 30.44 C ATOM 1369 NH1 ARG A 674 -16.181 6.597 -0.835 1.00 22.11 N ATOM 1370 NH2 ARG A 674 -16.033 8.635 -1.910 1.00 14.31 N ATOM 0 H ARG A 674 -9.785 6.463 0.172 1.00 71.12 H new ATOM 0 HA ARG A 674 -12.163 6.577 -1.362 1.00 32.21 H new ATOM 0 HB2 ARG A 674 -10.671 8.581 0.359 1.00 52.32 H new ATOM 0 HB3 ARG A 674 -12.119 9.020 -0.526 1.00 52.32 H new ATOM 0 HG2 ARG A 674 -11.909 6.916 1.648 1.00 11.45 H new ATOM 0 HG3 ARG A 674 -12.661 8.493 1.788 1.00 11.45 H new ATOM 0 HD2 ARG A 674 -13.563 6.164 0.050 1.00 53.25 H new ATOM 0 HD3 ARG A 674 -14.419 6.872 1.404 1.00 53.25 H new ATOM 0 HE ARG A 674 -14.044 8.964 -0.476 1.00 12.21 H new ATOM 0 HH11 ARG A 674 -15.816 5.929 -0.156 1.00 22.11 H new ATOM 0 HH12 ARG A 674 -17.029 6.379 -1.359 1.00 22.11 H new ATOM 0 HH21 ARG A 674 -15.553 9.524 -2.050 1.00 14.31 H new ATOM 0 HH22 ARG A 674 -16.880 8.424 -2.437 1.00 14.31 H new ATOM 1382 N ASP A 675 -11.718 8.660 -2.852 1.00 54.22 N ATOM 1383 CA ASP A 675 -11.621 9.443 -4.071 1.00 1.44 C ATOM 1384 C ASP A 675 -10.499 10.497 -4.012 1.00 73.21 C ATOM 1385 O ASP A 675 -9.886 10.806 -5.019 1.00 2.22 O ATOM 1386 CB ASP A 675 -12.983 10.107 -4.300 1.00 44.43 C ATOM 1387 CG ASP A 675 -13.429 10.943 -3.121 1.00 34.42 C ATOM 1388 OD1 ASP A 675 -13.755 10.348 -2.056 1.00 51.12 O ATOM 1389 OD2 ASP A 675 -13.455 12.186 -3.230 1.00 43.14 O ATOM 0 H ASP A 675 -12.601 8.818 -2.367 1.00 54.22 H new ATOM 0 HA ASP A 675 -11.362 8.785 -4.900 1.00 1.44 H new ATOM 0 HB2 ASP A 675 -12.931 10.737 -5.188 1.00 44.43 H new ATOM 0 HB3 ASP A 675 -13.729 9.338 -4.498 1.00 44.43 H new ATOM 1394 N GLY A 676 -10.293 11.065 -2.841 1.00 3.33 N ATOM 1395 CA GLY A 676 -9.184 11.985 -2.623 1.00 30.35 C ATOM 1396 C GLY A 676 -9.231 13.234 -3.493 1.00 45.32 C ATOM 1397 O GLY A 676 -10.175 14.023 -3.412 1.00 14.43 O ATOM 0 H GLY A 676 -10.878 10.908 -2.021 1.00 3.33 H new ATOM 0 HA2 GLY A 676 -9.176 12.285 -1.575 1.00 30.35 H new ATOM 0 HA3 GLY A 676 -8.248 11.459 -2.811 1.00 30.35 H new ATOM 1401 N THR A 677 -8.225 13.413 -4.306 1.00 4.42 N ATOM 1402 CA THR A 677 -8.136 14.540 -5.193 1.00 15.22 C ATOM 1403 C THR A 677 -8.159 14.044 -6.634 1.00 5.40 C ATOM 1404 O THR A 677 -7.403 13.152 -6.983 1.00 62.52 O ATOM 1405 CB THR A 677 -6.838 15.348 -4.933 1.00 15.01 C ATOM 1406 OG1 THR A 677 -6.875 15.865 -3.601 1.00 13.44 O ATOM 1407 CG2 THR A 677 -6.672 16.506 -5.916 1.00 52.04 C ATOM 0 H THR A 677 -7.434 12.772 -4.371 1.00 4.42 H new ATOM 0 HA THR A 677 -8.986 15.198 -5.013 1.00 15.22 H new ATOM 0 HB THR A 677 -5.991 14.676 -5.069 1.00 15.01 H new ATOM 0 HG1 THR A 677 -6.058 16.376 -3.426 1.00 13.44 H new ATOM 0 HG21 THR A 677 -5.749 17.042 -5.694 1.00 52.04 H new ATOM 0 HG22 THR A 677 -6.630 16.117 -6.933 1.00 52.04 H new ATOM 0 HG23 THR A 677 -7.518 17.187 -5.823 1.00 52.04 H new ATOM 1413 N PRO A 678 -9.031 14.589 -7.483 1.00 63.52 N ATOM 1414 CA PRO A 678 -9.122 14.184 -8.867 1.00 5.25 C ATOM 1415 C PRO A 678 -7.924 14.657 -9.691 1.00 52.00 C ATOM 1416 O PRO A 678 -7.238 15.605 -9.303 1.00 72.33 O ATOM 1417 CB PRO A 678 -10.429 14.791 -9.344 1.00 31.41 C ATOM 1418 CG PRO A 678 -10.558 16.026 -8.536 1.00 61.21 C ATOM 1419 CD PRO A 678 -10.005 15.665 -7.175 1.00 22.41 C ATOM 0 HA PRO A 678 -9.106 13.100 -8.982 1.00 5.25 H new ATOM 0 HB2 PRO A 678 -10.402 15.012 -10.411 1.00 31.41 H new ATOM 0 HB3 PRO A 678 -11.268 14.115 -9.179 1.00 31.41 H new ATOM 0 HG2 PRO A 678 -10.001 16.849 -8.982 1.00 61.21 H new ATOM 0 HG3 PRO A 678 -11.598 16.345 -8.467 1.00 61.21 H new ATOM 0 HD2 PRO A 678 -9.525 16.518 -6.695 1.00 22.41 H new ATOM 0 HD3 PRO A 678 -10.788 15.319 -6.500 1.00 22.41 H new ATOM 1427 N TYR A 679 -7.655 13.934 -10.780 1.00 25.20 N ATOM 1428 CA TYR A 679 -6.514 14.188 -11.697 1.00 33.21 C ATOM 1429 C TYR A 679 -6.300 15.663 -11.986 1.00 2.33 C ATOM 1430 O TYR A 679 -5.450 16.308 -11.352 1.00 22.25 O ATOM 1431 CB TYR A 679 -6.689 13.473 -13.060 1.00 63.45 C ATOM 1432 CG TYR A 679 -6.617 11.968 -13.074 1.00 30.31 C ATOM 1433 CD1 TYR A 679 -7.490 11.206 -12.339 1.00 51.24 C ATOM 1434 CD2 TYR A 679 -5.683 11.310 -13.860 1.00 32.44 C ATOM 1435 CE1 TYR A 679 -7.450 9.845 -12.367 1.00 54.04 C ATOM 1436 CE2 TYR A 679 -5.644 9.931 -13.903 1.00 42.34 C ATOM 1437 CZ TYR A 679 -6.539 9.213 -13.145 1.00 74.24 C ATOM 1438 OH TYR A 679 -6.536 7.862 -13.183 1.00 10.12 O ATOM 0 H TYR A 679 -8.227 13.139 -11.065 1.00 25.20 H new ATOM 0 HA TYR A 679 -5.648 13.791 -11.167 1.00 33.21 H new ATOM 0 HB2 TYR A 679 -7.655 13.767 -13.472 1.00 63.45 H new ATOM 0 HB3 TYR A 679 -5.925 13.852 -13.738 1.00 63.45 H new ATOM 0 HD1 TYR A 679 -8.228 11.698 -11.723 1.00 51.24 H new ATOM 0 HD2 TYR A 679 -4.979 11.883 -14.445 1.00 32.44 H new ATOM 0 HE1 TYR A 679 -8.143 9.271 -11.770 1.00 54.04 H new ATOM 0 HE2 TYR A 679 -4.921 9.423 -14.523 1.00 42.34 H new ATOM 0 HH TYR A 679 -5.760 7.551 -13.695 1.00 10.12 H new ATOM 1448 N ASN A 680 -7.086 16.166 -12.934 1.00 31.03 N ATOM 1449 CA ASN A 680 -7.021 17.542 -13.466 1.00 12.20 C ATOM 1450 C ASN A 680 -7.796 17.567 -14.773 1.00 11.54 C ATOM 1451 O ASN A 680 -7.593 18.439 -15.624 1.00 40.32 O ATOM 1452 CB ASN A 680 -5.557 17.959 -13.768 1.00 32.03 C ATOM 1453 CG ASN A 680 -4.827 17.027 -14.751 1.00 41.41 C ATOM 1454 OD1 ASN A 680 -4.182 16.060 -14.345 1.00 2.43 O ATOM 1455 ND2 ASN A 680 -4.921 17.309 -16.025 1.00 25.14 N ATOM 0 H ASN A 680 -7.818 15.611 -13.377 1.00 31.03 H new ATOM 0 HA ASN A 680 -7.435 18.229 -12.728 1.00 12.20 H new ATOM 0 HB2 ASN A 680 -5.555 18.970 -14.174 1.00 32.03 H new ATOM 0 HB3 ASN A 680 -4.999 17.990 -12.832 1.00 32.03 H new ATOM 0 HD21 ASN A 680 -4.452 16.720 -16.714 1.00 25.14 H new ATOM 0 HD22 ASN A 680 -5.463 18.117 -16.330 1.00 25.14 H new ATOM 1461 N ASN A 681 -8.728 16.653 -14.907 1.00 74.04 N ATOM 1462 CA ASN A 681 -9.378 16.420 -16.169 1.00 35.05 C ATOM 1463 C ASN A 681 -10.777 16.983 -16.191 1.00 31.55 C ATOM 1464 O ASN A 681 -11.298 17.432 -15.166 1.00 70.14 O ATOM 1465 CB ASN A 681 -9.377 14.917 -16.519 1.00 64.42 C ATOM 1466 CG ASN A 681 -10.105 14.037 -15.504 1.00 54.22 C ATOM 1467 OD1 ASN A 681 -10.150 14.337 -14.305 1.00 25.42 O ATOM 1468 ND2 ASN A 681 -10.663 12.957 -15.969 1.00 22.23 N ATOM 0 H ASN A 681 -9.053 16.055 -14.148 1.00 74.04 H new ATOM 0 HA ASN A 681 -8.807 16.947 -16.933 1.00 35.05 H new ATOM 0 HB2 ASN A 681 -9.839 14.783 -17.497 1.00 64.42 H new ATOM 0 HB3 ASN A 681 -8.345 14.576 -16.605 1.00 64.42 H new ATOM 0 HD21 ASN A 681 -11.158 12.326 -15.338 1.00 22.23 H new ATOM 0 HD22 ASN A 681 -10.606 12.741 -16.964 1.00 22.23 H new ATOM 1474 N GLU A 682 -11.389 16.942 -17.358 1.00 20.23 N ATOM 1475 CA GLU A 682 -12.720 17.494 -17.571 1.00 45.55 C ATOM 1476 C GLU A 682 -13.767 16.780 -16.733 1.00 65.04 C ATOM 1477 O GLU A 682 -14.693 17.399 -16.238 1.00 62.31 O ATOM 1478 CB GLU A 682 -13.096 17.402 -19.040 1.00 3.53 C ATOM 1479 CG GLU A 682 -12.132 18.106 -19.971 1.00 51.03 C ATOM 1480 CD GLU A 682 -12.549 17.985 -21.407 1.00 42.30 C ATOM 1481 OE1 GLU A 682 -12.196 16.977 -22.054 1.00 21.32 O ATOM 1482 OE2 GLU A 682 -13.253 18.885 -21.909 1.00 31.41 O ATOM 0 H GLU A 682 -10.978 16.523 -18.192 1.00 20.23 H new ATOM 0 HA GLU A 682 -12.694 18.539 -17.262 1.00 45.55 H new ATOM 0 HB2 GLU A 682 -13.156 16.351 -19.323 1.00 3.53 H new ATOM 0 HB3 GLU A 682 -14.091 17.826 -19.176 1.00 3.53 H new ATOM 0 HG2 GLU A 682 -12.069 19.160 -19.699 1.00 51.03 H new ATOM 0 HG3 GLU A 682 -11.134 17.685 -19.846 1.00 51.03 H new ATOM 1489 N LYS A 683 -13.599 15.489 -16.573 1.00 32.12 N ATOM 1490 CA LYS A 683 -14.537 14.677 -15.826 1.00 51.41 C ATOM 1491 C LYS A 683 -14.341 14.808 -14.315 1.00 31.30 C ATOM 1492 O LYS A 683 -15.278 14.560 -13.542 1.00 1.14 O ATOM 1493 CB LYS A 683 -14.376 13.218 -16.238 1.00 24.22 C ATOM 1494 CG LYS A 683 -15.328 12.266 -15.548 1.00 12.02 C ATOM 1495 CD LYS A 683 -15.118 10.868 -16.028 1.00 23.13 C ATOM 1496 CE LYS A 683 -16.065 9.897 -15.348 1.00 2.02 C ATOM 1497 NZ LYS A 683 -15.894 8.530 -15.868 1.00 14.22 N ATOM 0 H LYS A 683 -12.809 14.969 -16.956 1.00 32.12 H new ATOM 0 HA LYS A 683 -15.542 15.031 -16.056 1.00 51.41 H new ATOM 0 HB2 LYS A 683 -14.520 13.139 -17.316 1.00 24.22 H new ATOM 0 HB3 LYS A 683 -13.353 12.905 -16.029 1.00 24.22 H new ATOM 0 HG2 LYS A 683 -15.177 12.312 -14.469 1.00 12.02 H new ATOM 0 HG3 LYS A 683 -16.357 12.571 -15.739 1.00 12.02 H new ATOM 0 HD2 LYS A 683 -15.266 10.827 -17.107 1.00 23.13 H new ATOM 0 HD3 LYS A 683 -14.088 10.567 -15.836 1.00 23.13 H new ATOM 0 HE2 LYS A 683 -15.886 9.904 -14.273 1.00 2.02 H new ATOM 0 HE3 LYS A 683 -17.094 10.221 -15.502 1.00 2.02 H new ATOM 0 HZ1 LYS A 683 -16.555 7.889 -15.384 1.00 14.22 H new ATOM 0 HZ2 LYS A 683 -16.088 8.520 -16.890 1.00 14.22 H new ATOM 0 HZ3 LYS A 683 -14.918 8.214 -15.698 1.00 14.22 H new ATOM 1511 N ARG A 684 -13.145 15.252 -13.902 1.00 54.03 N ATOM 1512 CA ARG A 684 -12.745 15.254 -12.496 1.00 63.01 C ATOM 1513 C ARG A 684 -12.748 13.830 -11.992 1.00 74.22 C ATOM 1514 O ARG A 684 -13.660 13.399 -11.277 1.00 24.45 O ATOM 1515 CB ARG A 684 -13.598 16.155 -11.539 1.00 64.31 C ATOM 1516 CG ARG A 684 -13.582 17.666 -11.790 1.00 33.32 C ATOM 1517 CD ARG A 684 -14.267 18.059 -13.084 1.00 21.51 C ATOM 1518 NE ARG A 684 -15.668 17.598 -13.132 1.00 75.23 N ATOM 1519 CZ ARG A 684 -16.651 18.171 -13.838 1.00 35.42 C ATOM 1520 NH1 ARG A 684 -16.441 19.320 -14.476 1.00 2.13 N ATOM 1521 NH2 ARG A 684 -17.854 17.607 -13.867 1.00 33.44 N ATOM 0 H ARG A 684 -12.433 15.618 -14.534 1.00 54.03 H new ATOM 0 HA ARG A 684 -11.751 15.701 -12.475 1.00 63.01 H new ATOM 0 HB2 ARG A 684 -14.633 15.816 -11.591 1.00 64.31 H new ATOM 0 HB3 ARG A 684 -13.257 15.980 -10.519 1.00 64.31 H new ATOM 0 HG2 ARG A 684 -14.072 18.172 -10.958 1.00 33.32 H new ATOM 0 HG3 ARG A 684 -12.549 18.014 -11.812 1.00 33.32 H new ATOM 0 HD2 ARG A 684 -14.238 19.143 -13.194 1.00 21.51 H new ATOM 0 HD3 ARG A 684 -13.718 17.638 -13.927 1.00 21.51 H new ATOM 0 HE ARG A 684 -15.908 16.774 -12.581 1.00 75.23 H new ATOM 0 HH11 ARG A 684 -15.527 19.770 -14.429 1.00 2.13 H new ATOM 0 HH12 ARG A 684 -17.194 19.751 -15.012 1.00 2.13 H new ATOM 0 HH21 ARG A 684 -18.024 16.742 -13.353 1.00 33.44 H new ATOM 0 HH22 ARG A 684 -18.607 18.039 -14.403 1.00 33.44 H new ATOM 1533 N THR A 685 -11.786 13.085 -12.433 1.00 43.41 N ATOM 1534 CA THR A 685 -11.669 11.723 -12.038 1.00 63.14 C ATOM 1535 C THR A 685 -10.878 11.637 -10.741 1.00 64.33 C ATOM 1536 O THR A 685 -9.724 12.045 -10.704 1.00 43.52 O ATOM 1537 CB THR A 685 -10.953 10.896 -13.112 1.00 10.22 C ATOM 1538 OG1 THR A 685 -11.653 10.985 -14.363 1.00 55.34 O ATOM 1539 CG2 THR A 685 -10.885 9.462 -12.679 1.00 34.42 C ATOM 0 H THR A 685 -11.062 13.405 -13.076 1.00 43.41 H new ATOM 0 HA THR A 685 -12.673 11.322 -11.898 1.00 63.14 H new ATOM 0 HB THR A 685 -9.945 11.290 -13.243 1.00 10.22 H new ATOM 0 HG1 THR A 685 -11.183 10.454 -15.039 1.00 55.34 H new ATOM 0 HG21 THR A 685 -10.376 8.875 -13.443 1.00 34.42 H new ATOM 0 HG22 THR A 685 -10.335 9.391 -11.741 1.00 34.42 H new ATOM 0 HG23 THR A 685 -11.895 9.076 -12.538 1.00 34.42 H new ATOM 1545 N PRO A 686 -11.487 11.142 -9.666 1.00 50.02 N ATOM 1546 CA PRO A 686 -10.817 11.007 -8.375 1.00 61.33 C ATOM 1547 C PRO A 686 -9.683 9.981 -8.411 1.00 52.20 C ATOM 1548 O PRO A 686 -9.799 8.921 -9.055 1.00 52.34 O ATOM 1549 CB PRO A 686 -11.923 10.524 -7.449 1.00 63.52 C ATOM 1550 CG PRO A 686 -12.949 9.922 -8.332 1.00 74.21 C ATOM 1551 CD PRO A 686 -12.880 10.675 -9.617 1.00 41.42 C ATOM 0 HA PRO A 686 -10.353 11.943 -8.063 1.00 61.33 H new ATOM 0 HB2 PRO A 686 -11.544 9.794 -6.734 1.00 63.52 H new ATOM 0 HB3 PRO A 686 -12.339 11.350 -6.871 1.00 63.52 H new ATOM 0 HG2 PRO A 686 -12.753 8.861 -8.491 1.00 74.21 H new ATOM 0 HG3 PRO A 686 -13.941 10.000 -7.887 1.00 74.21 H new ATOM 0 HD2 PRO A 686 -13.120 10.039 -10.469 1.00 41.42 H new ATOM 0 HD3 PRO A 686 -13.583 11.508 -9.633 1.00 41.42 H new ATOM 1559 N ARG A 687 -8.601 10.293 -7.737 1.00 73.55 N ATOM 1560 CA ARG A 687 -7.476 9.398 -7.658 1.00 63.42 C ATOM 1561 C ARG A 687 -7.624 8.572 -6.404 1.00 41.53 C ATOM 1562 O ARG A 687 -7.688 9.112 -5.310 1.00 21.51 O ATOM 1563 CB ARG A 687 -6.160 10.174 -7.582 1.00 74.54 C ATOM 1564 CG ARG A 687 -5.920 11.151 -8.718 1.00 53.44 C ATOM 1565 CD ARG A 687 -4.570 11.829 -8.559 1.00 32.40 C ATOM 1566 NE ARG A 687 -4.385 12.949 -9.492 1.00 73.51 N ATOM 1567 CZ ARG A 687 -3.361 13.073 -10.352 1.00 50.32 C ATOM 1568 NH1 ARG A 687 -2.526 12.056 -10.561 1.00 20.42 N ATOM 1569 NH2 ARG A 687 -3.205 14.206 -11.040 1.00 12.22 N ATOM 0 H ARG A 687 -8.478 11.170 -7.231 1.00 73.55 H new ATOM 0 HA ARG A 687 -7.455 8.771 -8.549 1.00 63.42 H new ATOM 0 HB2 ARG A 687 -6.134 10.723 -6.641 1.00 74.54 H new ATOM 0 HB3 ARG A 687 -5.337 9.460 -7.558 1.00 74.54 H new ATOM 0 HG2 ARG A 687 -5.960 10.626 -9.672 1.00 53.44 H new ATOM 0 HG3 ARG A 687 -6.711 11.901 -8.734 1.00 53.44 H new ATOM 0 HD2 ARG A 687 -4.469 12.193 -7.536 1.00 32.40 H new ATOM 0 HD3 ARG A 687 -3.779 11.096 -8.716 1.00 32.40 H new ATOM 0 HE ARG A 687 -5.088 13.688 -9.486 1.00 73.51 H new ATOM 0 HH11 ARG A 687 -2.662 11.175 -10.066 1.00 20.42 H new ATOM 0 HH12 ARG A 687 -1.751 12.159 -11.216 1.00 20.42 H new ATOM 0 HH21 ARG A 687 -3.863 14.975 -10.912 1.00 12.22 H new ATOM 0 HH22 ARG A 687 -2.428 14.303 -11.694 1.00 12.22 H new ATOM 1581 N ALA A 688 -7.657 7.286 -6.553 1.00 11.31 N ATOM 1582 CA ALA A 688 -7.846 6.413 -5.421 1.00 72.30 C ATOM 1583 C ALA A 688 -6.767 5.366 -5.406 1.00 73.23 C ATOM 1584 O ALA A 688 -6.095 5.162 -6.404 1.00 24.24 O ATOM 1585 CB ALA A 688 -9.222 5.762 -5.484 1.00 32.14 C ATOM 0 H ALA A 688 -7.556 6.808 -7.448 1.00 11.31 H new ATOM 0 HA ALA A 688 -7.785 6.996 -4.502 1.00 72.30 H new ATOM 0 HB1 ALA A 688 -9.353 5.105 -4.624 1.00 32.14 H new ATOM 0 HB2 ALA A 688 -9.991 6.534 -5.471 1.00 32.14 H new ATOM 0 HB3 ALA A 688 -9.308 5.180 -6.402 1.00 32.14 H new ATOM 1591 N THR A 689 -6.590 4.724 -4.286 1.00 14.00 N ATOM 1592 CA THR A 689 -5.565 3.724 -4.136 1.00 11.21 C ATOM 1593 C THR A 689 -6.177 2.365 -3.826 1.00 35.41 C ATOM 1594 O THR A 689 -7.082 2.251 -2.983 1.00 11.04 O ATOM 1595 CB THR A 689 -4.591 4.128 -3.015 1.00 73.30 C ATOM 1596 OG1 THR A 689 -4.029 5.392 -3.334 1.00 14.20 O ATOM 1597 CG2 THR A 689 -3.469 3.112 -2.850 1.00 35.31 C ATOM 0 H THR A 689 -7.152 4.878 -3.449 1.00 14.00 H new ATOM 0 HA THR A 689 -5.019 3.651 -5.076 1.00 11.21 H new ATOM 0 HB THR A 689 -5.146 4.172 -2.078 1.00 73.30 H new ATOM 0 HG1 THR A 689 -4.683 6.097 -3.147 1.00 14.20 H new ATOM 0 HG21 THR A 689 -2.803 3.433 -2.049 1.00 35.31 H new ATOM 0 HG22 THR A 689 -3.893 2.139 -2.601 1.00 35.31 H new ATOM 0 HG23 THR A 689 -2.907 3.036 -3.781 1.00 35.31 H new ATOM 1603 N LEU A 690 -5.707 1.359 -4.524 1.00 75.12 N ATOM 1604 CA LEU A 690 -6.132 0.022 -4.324 1.00 2.31 C ATOM 1605 C LEU A 690 -4.887 -0.800 -4.092 1.00 5.12 C ATOM 1606 O LEU A 690 -4.036 -0.923 -4.969 1.00 3.31 O ATOM 1607 CB LEU A 690 -6.894 -0.482 -5.575 1.00 32.43 C ATOM 1608 CG LEU A 690 -7.698 -1.801 -5.470 1.00 0.33 C ATOM 1609 CD1 LEU A 690 -6.838 -3.004 -5.140 1.00 44.33 C ATOM 1610 CD2 LEU A 690 -8.824 -1.659 -4.479 1.00 13.42 C ATOM 0 H LEU A 690 -5.006 1.464 -5.257 1.00 75.12 H new ATOM 0 HA LEU A 690 -6.809 -0.057 -3.473 1.00 2.31 H new ATOM 0 HB2 LEU A 690 -7.585 0.304 -5.881 1.00 32.43 H new ATOM 0 HB3 LEU A 690 -6.168 -0.599 -6.380 1.00 32.43 H new ATOM 0 HG LEU A 690 -8.114 -1.988 -6.460 1.00 0.33 H new ATOM 0 HD11 LEU A 690 -7.464 -3.894 -5.081 1.00 44.33 H new ATOM 0 HD12 LEU A 690 -6.087 -3.139 -5.919 1.00 44.33 H new ATOM 0 HD13 LEU A 690 -6.343 -2.845 -4.182 1.00 44.33 H new ATOM 0 HD21 LEU A 690 -9.377 -2.596 -4.420 1.00 13.42 H new ATOM 0 HD22 LEU A 690 -8.417 -1.415 -3.498 1.00 13.42 H new ATOM 0 HD23 LEU A 690 -9.494 -0.862 -4.802 1.00 13.42 H new ATOM 1618 N ILE A 691 -4.769 -1.349 -2.946 1.00 55.22 N ATOM 1619 CA ILE A 691 -3.621 -2.146 -2.643 1.00 34.44 C ATOM 1620 C ILE A 691 -4.017 -3.603 -2.748 1.00 73.12 C ATOM 1621 O ILE A 691 -4.994 -4.010 -2.156 1.00 54.23 O ATOM 1622 CB ILE A 691 -3.103 -1.846 -1.224 1.00 40.30 C ATOM 1623 CG1 ILE A 691 -2.814 -0.344 -1.079 1.00 43.04 C ATOM 1624 CG2 ILE A 691 -1.837 -2.652 -0.955 1.00 42.32 C ATOM 1625 CD1 ILE A 691 -2.421 0.080 0.322 1.00 73.43 C ATOM 0 H ILE A 691 -5.450 -1.268 -2.191 1.00 55.22 H new ATOM 0 HA ILE A 691 -2.821 -1.915 -3.346 1.00 34.44 H new ATOM 0 HB ILE A 691 -3.865 -2.130 -0.498 1.00 40.30 H new ATOM 0 HG12 ILE A 691 -2.014 -0.071 -1.767 1.00 43.04 H new ATOM 0 HG13 ILE A 691 -3.699 0.216 -1.381 1.00 43.04 H new ATOM 0 HG21 ILE A 691 -1.475 -2.436 0.050 1.00 42.32 H new ATOM 0 HG22 ILE A 691 -2.058 -3.716 -1.040 1.00 42.32 H new ATOM 0 HG23 ILE A 691 -1.072 -2.381 -1.682 1.00 42.32 H new ATOM 0 HD11 ILE A 691 -2.234 1.154 0.338 1.00 73.43 H new ATOM 0 HD12 ILE A 691 -3.228 -0.159 1.014 1.00 73.43 H new ATOM 0 HD13 ILE A 691 -1.517 -0.450 0.622 1.00 73.43 H new ATOM 1632 N THR A 692 -3.302 -4.350 -3.536 1.00 44.44 N ATOM 1633 CA THR A 692 -3.574 -5.748 -3.714 1.00 64.22 C ATOM 1634 C THR A 692 -2.506 -6.541 -2.960 1.00 43.44 C ATOM 1635 O THR A 692 -1.317 -6.404 -3.229 1.00 1.21 O ATOM 1636 CB THR A 692 -3.518 -6.087 -5.207 1.00 21.31 C ATOM 1637 OG1 THR A 692 -4.355 -5.147 -5.926 1.00 30.11 O ATOM 1638 CG2 THR A 692 -4.026 -7.496 -5.469 1.00 61.33 C ATOM 0 H THR A 692 -2.509 -4.006 -4.077 1.00 44.44 H new ATOM 0 HA THR A 692 -4.563 -5.999 -3.332 1.00 64.22 H new ATOM 0 HB THR A 692 -2.482 -6.025 -5.541 1.00 21.31 H new ATOM 0 HG1 THR A 692 -4.327 -5.351 -6.884 1.00 30.11 H new ATOM 0 HG21 THR A 692 -3.975 -7.709 -6.537 1.00 61.33 H new ATOM 0 HG22 THR A 692 -3.409 -8.212 -4.926 1.00 61.33 H new ATOM 0 HG23 THR A 692 -5.059 -7.579 -5.132 1.00 61.33 H new ATOM 1644 N PHE A 693 -2.934 -7.327 -2.025 1.00 13.52 N ATOM 1645 CA PHE A 693 -2.057 -8.073 -1.159 1.00 33.15 C ATOM 1646 C PHE A 693 -1.913 -9.480 -1.663 1.00 12.31 C ATOM 1647 O PHE A 693 -2.895 -10.133 -1.955 1.00 73.23 O ATOM 1648 CB PHE A 693 -2.641 -8.100 0.239 1.00 30.31 C ATOM 1649 CG PHE A 693 -2.827 -6.732 0.875 1.00 73.54 C ATOM 1650 CD1 PHE A 693 -3.836 -5.889 0.457 1.00 3.51 C ATOM 1651 CD2 PHE A 693 -1.999 -6.302 1.888 1.00 72.11 C ATOM 1652 CE1 PHE A 693 -4.015 -4.665 1.029 1.00 11.43 C ATOM 1653 CE2 PHE A 693 -2.175 -5.072 2.472 1.00 0.34 C ATOM 1654 CZ PHE A 693 -3.185 -4.253 2.040 1.00 3.10 C ATOM 0 H PHE A 693 -3.924 -7.476 -1.832 1.00 13.52 H new ATOM 0 HA PHE A 693 -1.077 -7.596 -1.144 1.00 33.15 H new ATOM 0 HB2 PHE A 693 -3.607 -8.604 0.205 1.00 30.31 H new ATOM 0 HB3 PHE A 693 -1.991 -8.698 0.878 1.00 30.31 H new ATOM 0 HD1 PHE A 693 -4.496 -6.205 -0.338 1.00 3.51 H new ATOM 0 HD2 PHE A 693 -1.199 -6.942 2.228 1.00 72.11 H new ATOM 0 HE1 PHE A 693 -4.810 -4.020 0.686 1.00 11.43 H new ATOM 0 HE2 PHE A 693 -1.520 -4.751 3.269 1.00 0.34 H new ATOM 0 HZ PHE A 693 -3.327 -3.284 2.495 1.00 3.10 H new ATOM 1664 N LEU A 694 -0.702 -9.938 -1.747 1.00 2.51 N ATOM 1665 CA LEU A 694 -0.418 -11.248 -2.250 1.00 23.21 C ATOM 1666 C LEU A 694 0.155 -12.124 -1.174 1.00 14.22 C ATOM 1667 O LEU A 694 0.897 -11.663 -0.292 1.00 13.14 O ATOM 1668 CB LEU A 694 0.588 -11.216 -3.423 1.00 35.03 C ATOM 1669 CG LEU A 694 0.197 -10.479 -4.718 1.00 61.32 C ATOM 1670 CD1 LEU A 694 -1.111 -10.982 -5.289 1.00 73.14 C ATOM 1671 CD2 LEU A 694 0.194 -8.973 -4.558 1.00 44.14 C ATOM 0 H LEU A 694 0.124 -9.410 -1.466 1.00 2.51 H new ATOM 0 HA LEU A 694 -1.368 -11.649 -2.602 1.00 23.21 H new ATOM 0 HB2 LEU A 694 1.510 -10.768 -3.054 1.00 35.03 H new ATOM 0 HB3 LEU A 694 0.819 -12.248 -3.688 1.00 35.03 H new ATOM 0 HG LEU A 694 0.977 -10.713 -5.443 1.00 61.32 H new ATOM 0 HD11 LEU A 694 -1.345 -10.433 -6.201 1.00 73.14 H new ATOM 0 HD12 LEU A 694 -1.024 -12.044 -5.517 1.00 73.14 H new ATOM 0 HD13 LEU A 694 -1.908 -10.832 -4.560 1.00 73.14 H new ATOM 0 HD21 LEU A 694 -0.089 -8.507 -5.502 1.00 44.14 H new ATOM 0 HD22 LEU A 694 -0.521 -8.691 -3.786 1.00 44.14 H new ATOM 0 HD23 LEU A 694 1.190 -8.636 -4.271 1.00 44.14 H new ATOM 1679 N CYS A 695 -0.198 -13.370 -1.247 1.00 33.03 N ATOM 1680 CA CYS A 695 0.335 -14.396 -0.379 1.00 23.30 C ATOM 1681 C CYS A 695 1.689 -14.856 -0.873 1.00 31.41 C ATOM 1682 O CYS A 695 1.795 -15.431 -1.961 1.00 35.54 O ATOM 1683 CB CYS A 695 -0.610 -15.617 -0.314 1.00 2.21 C ATOM 1684 SG CYS A 695 0.177 -17.118 0.418 1.00 42.31 S ATOM 0 H CYS A 695 -0.878 -13.718 -1.923 1.00 33.03 H new ATOM 0 HA CYS A 695 0.431 -13.963 0.617 1.00 23.30 H new ATOM 0 HB2 CYS A 695 -1.490 -15.355 0.273 1.00 2.21 H new ATOM 0 HB3 CYS A 695 -0.957 -15.852 -1.320 1.00 2.21 H new ATOM 1689 N ASP A 696 2.726 -14.592 -0.112 1.00 54.05 N ATOM 1690 CA ASP A 696 4.026 -15.119 -0.472 1.00 42.23 C ATOM 1691 C ASP A 696 4.628 -15.948 0.649 1.00 35.23 C ATOM 1692 O ASP A 696 4.417 -15.665 1.838 1.00 22.34 O ATOM 1693 CB ASP A 696 5.011 -14.046 -0.953 1.00 3.12 C ATOM 1694 CG ASP A 696 6.343 -14.658 -1.395 1.00 51.24 C ATOM 1695 OD1 ASP A 696 6.442 -15.143 -2.538 1.00 31.20 O ATOM 1696 OD2 ASP A 696 7.289 -14.675 -0.609 1.00 3.34 O ATOM 0 H ASP A 696 2.701 -14.031 0.739 1.00 54.05 H new ATOM 0 HA ASP A 696 3.848 -15.774 -1.324 1.00 42.23 H new ATOM 0 HB2 ASP A 696 4.571 -13.494 -1.783 1.00 3.12 H new ATOM 0 HB3 ASP A 696 5.188 -13.329 -0.151 1.00 3.12 H new ATOM 1701 N ARG A 697 5.345 -16.973 0.227 1.00 3.24 N ATOM 1702 CA ARG A 697 6.079 -17.941 1.057 1.00 34.32 C ATOM 1703 C ARG A 697 6.920 -17.256 2.138 1.00 61.44 C ATOM 1704 O ARG A 697 6.970 -17.713 3.284 1.00 64.42 O ATOM 1705 CB ARG A 697 7.036 -18.671 0.134 1.00 71.44 C ATOM 1706 CG ARG A 697 6.369 -19.426 -0.987 1.00 34.32 C ATOM 1707 CD ARG A 697 7.300 -19.530 -2.175 1.00 22.44 C ATOM 1708 NE ARG A 697 7.586 -18.182 -2.700 1.00 74.04 N ATOM 1709 CZ ARG A 697 8.071 -17.890 -3.901 1.00 75.32 C ATOM 1710 NH1 ARG A 697 8.375 -18.850 -4.771 1.00 2.24 N ATOM 1711 NH2 ARG A 697 8.229 -16.620 -4.233 1.00 4.05 N ATOM 0 H ARG A 697 5.444 -17.174 -0.768 1.00 3.24 H new ATOM 0 HA ARG A 697 5.362 -18.598 1.549 1.00 34.32 H new ATOM 0 HB2 ARG A 697 7.730 -17.948 -0.294 1.00 71.44 H new ATOM 0 HB3 ARG A 697 7.628 -19.370 0.724 1.00 71.44 H new ATOM 0 HG2 ARG A 697 6.089 -20.423 -0.647 1.00 34.32 H new ATOM 0 HG3 ARG A 697 5.450 -18.919 -1.280 1.00 34.32 H new ATOM 0 HD2 ARG A 697 8.228 -20.021 -1.881 1.00 22.44 H new ATOM 0 HD3 ARG A 697 6.847 -20.145 -2.952 1.00 22.44 H new ATOM 0 HE ARG A 697 7.392 -17.396 -2.079 1.00 74.04 H new ATOM 0 HH11 ARG A 697 8.236 -19.829 -4.520 1.00 2.24 H new ATOM 0 HH12 ARG A 697 8.747 -18.607 -5.689 1.00 2.24 H new ATOM 0 HH21 ARG A 697 7.980 -15.885 -3.571 1.00 4.05 H new ATOM 0 HH22 ARG A 697 8.600 -16.375 -5.151 1.00 4.05 H new ATOM 1723 N ASP A 698 7.580 -16.179 1.774 1.00 5.34 N ATOM 1724 CA ASP A 698 8.458 -15.501 2.697 1.00 74.23 C ATOM 1725 C ASP A 698 8.259 -14.016 2.621 1.00 4.40 C ATOM 1726 O ASP A 698 8.585 -13.380 1.619 1.00 52.13 O ATOM 1727 CB ASP A 698 9.922 -15.860 2.416 1.00 10.41 C ATOM 1728 CG ASP A 698 10.889 -15.136 3.330 1.00 73.20 C ATOM 1729 OD1 ASP A 698 11.100 -15.600 4.462 1.00 22.54 O ATOM 1730 OD2 ASP A 698 11.464 -14.097 2.921 1.00 3.30 O ATOM 0 H ASP A 698 7.525 -15.756 0.848 1.00 5.34 H new ATOM 0 HA ASP A 698 8.211 -15.831 3.706 1.00 74.23 H new ATOM 0 HB2 ASP A 698 10.056 -16.936 2.531 1.00 10.41 H new ATOM 0 HB3 ASP A 698 10.158 -15.618 1.380 1.00 10.41 H new ATOM 1735 N ALA A 699 7.715 -13.473 3.664 1.00 20.14 N ATOM 1736 CA ALA A 699 7.459 -12.070 3.761 1.00 2.12 C ATOM 1737 C ALA A 699 7.356 -11.699 5.221 1.00 31.21 C ATOM 1738 O ALA A 699 7.689 -12.503 6.101 1.00 52.01 O ATOM 1739 CB ALA A 699 6.164 -11.716 3.020 1.00 33.32 C ATOM 0 H ALA A 699 7.431 -14.002 4.488 1.00 20.14 H new ATOM 0 HA ALA A 699 8.273 -11.510 3.300 1.00 2.12 H new ATOM 0 HB1 ALA A 699 5.980 -10.645 3.101 1.00 33.32 H new ATOM 0 HB2 ALA A 699 6.260 -11.989 1.969 1.00 33.32 H new ATOM 0 HB3 ALA A 699 5.331 -12.262 3.462 1.00 33.32 H new ATOM 1745 N GLY A 700 6.912 -10.520 5.479 1.00 31.11 N ATOM 1746 CA GLY A 700 6.766 -10.069 6.816 1.00 1.21 C ATOM 1747 C GLY A 700 5.554 -9.236 6.929 1.00 14.22 C ATOM 1748 O GLY A 700 4.445 -9.719 6.674 1.00 13.55 O ATOM 0 H GLY A 700 6.640 -9.841 4.768 1.00 31.11 H new ATOM 0 HA2 GLY A 700 6.698 -10.921 7.492 1.00 1.21 H new ATOM 0 HA3 GLY A 700 7.643 -9.495 7.114 1.00 1.21 H new ATOM 1752 N VAL A 701 5.747 -7.980 7.247 1.00 13.41 N ATOM 1753 CA VAL A 701 4.649 -7.066 7.368 1.00 72.42 C ATOM 1754 C VAL A 701 4.122 -6.741 5.978 1.00 40.11 C ATOM 1755 O VAL A 701 2.909 -6.636 5.754 1.00 54.32 O ATOM 1756 CB VAL A 701 5.050 -5.782 8.151 1.00 44.41 C ATOM 1757 CG1 VAL A 701 6.063 -4.917 7.413 1.00 63.14 C ATOM 1758 CG2 VAL A 701 3.842 -4.995 8.597 1.00 51.22 C ATOM 0 H VAL A 701 6.663 -7.569 7.427 1.00 13.41 H new ATOM 0 HA VAL A 701 3.855 -7.536 7.948 1.00 72.42 H new ATOM 0 HB VAL A 701 5.561 -6.126 9.051 1.00 44.41 H new ATOM 0 HG11 VAL A 701 6.298 -4.039 8.014 1.00 63.14 H new ATOM 0 HG12 VAL A 701 6.973 -5.491 7.238 1.00 63.14 H new ATOM 0 HG13 VAL A 701 5.644 -4.601 6.458 1.00 63.14 H new ATOM 0 HG21 VAL A 701 4.166 -4.107 9.140 1.00 51.22 H new ATOM 0 HG22 VAL A 701 3.261 -4.695 7.725 1.00 51.22 H new ATOM 0 HG23 VAL A 701 3.225 -5.614 9.249 1.00 51.22 H new ATOM 1764 N GLY A 702 5.025 -6.641 5.035 1.00 70.23 N ATOM 1765 CA GLY A 702 4.628 -6.432 3.707 1.00 50.32 C ATOM 1766 C GLY A 702 5.525 -5.530 2.940 1.00 62.44 C ATOM 1767 O GLY A 702 6.074 -4.565 3.477 1.00 62.15 O ATOM 0 H GLY A 702 6.032 -6.704 5.183 1.00 70.23 H new ATOM 0 HA2 GLY A 702 4.578 -7.395 3.198 1.00 50.32 H new ATOM 0 HA3 GLY A 702 3.621 -6.015 3.702 1.00 50.32 H new ATOM 1771 N PHE A 703 5.686 -5.858 1.700 1.00 24.43 N ATOM 1772 CA PHE A 703 6.458 -5.068 0.769 1.00 14.14 C ATOM 1773 C PHE A 703 5.549 -4.619 -0.386 1.00 42.50 C ATOM 1774 O PHE A 703 5.169 -5.440 -1.231 1.00 52.11 O ATOM 1775 CB PHE A 703 7.612 -5.904 0.186 1.00 74.12 C ATOM 1776 CG PHE A 703 8.538 -6.509 1.207 1.00 74.50 C ATOM 1777 CD1 PHE A 703 9.605 -5.788 1.712 1.00 54.20 C ATOM 1778 CD2 PHE A 703 8.340 -7.808 1.653 1.00 2.11 C ATOM 1779 CE1 PHE A 703 10.458 -6.349 2.640 1.00 24.12 C ATOM 1780 CE2 PHE A 703 9.187 -8.373 2.582 1.00 62.31 C ATOM 1781 CZ PHE A 703 10.247 -7.643 3.076 1.00 51.45 C ATOM 0 H PHE A 703 5.280 -6.698 1.287 1.00 24.43 H new ATOM 0 HA PHE A 703 6.865 -4.204 1.295 1.00 14.14 H new ATOM 0 HB2 PHE A 703 7.190 -6.706 -0.420 1.00 74.12 H new ATOM 0 HB3 PHE A 703 8.196 -5.272 -0.483 1.00 74.12 H new ATOM 0 HD1 PHE A 703 9.772 -4.775 1.376 1.00 54.20 H new ATOM 0 HD2 PHE A 703 7.512 -8.384 1.267 1.00 2.11 H new ATOM 0 HE1 PHE A 703 11.290 -5.777 3.025 1.00 24.12 H new ATOM 0 HE2 PHE A 703 9.021 -9.385 2.922 1.00 62.31 H new ATOM 0 HZ PHE A 703 10.913 -8.083 3.804 1.00 51.45 H new ATOM 1791 N PRO A 704 5.118 -3.347 -0.389 1.00 64.41 N ATOM 1792 CA PRO A 704 4.347 -2.776 -1.497 1.00 61.44 C ATOM 1793 C PRO A 704 5.214 -2.328 -2.685 1.00 14.02 C ATOM 1794 O PRO A 704 6.370 -1.904 -2.522 1.00 15.33 O ATOM 1795 CB PRO A 704 3.689 -1.555 -0.869 1.00 50.53 C ATOM 1796 CG PRO A 704 4.637 -1.133 0.193 1.00 42.43 C ATOM 1797 CD PRO A 704 5.249 -2.397 0.733 1.00 1.43 C ATOM 0 HA PRO A 704 3.659 -3.513 -1.911 1.00 61.44 H new ATOM 0 HB2 PRO A 704 3.536 -0.764 -1.603 1.00 50.53 H new ATOM 0 HB3 PRO A 704 2.711 -1.799 -0.455 1.00 50.53 H new ATOM 0 HG2 PRO A 704 5.403 -0.470 -0.209 1.00 42.43 H new ATOM 0 HG3 PRO A 704 4.121 -0.583 0.980 1.00 42.43 H new ATOM 0 HD2 PRO A 704 6.291 -2.250 1.015 1.00 1.43 H new ATOM 0 HD3 PRO A 704 4.725 -2.750 1.621 1.00 1.43 H new ATOM 1805 N GLU A 705 4.650 -2.442 -3.862 1.00 24.04 N ATOM 1806 CA GLU A 705 5.256 -1.997 -5.087 1.00 63.13 C ATOM 1807 C GLU A 705 4.171 -1.393 -5.980 1.00 33.02 C ATOM 1808 O GLU A 705 3.049 -1.886 -5.995 1.00 41.31 O ATOM 1809 CB GLU A 705 5.929 -3.186 -5.784 1.00 1.51 C ATOM 1810 CG GLU A 705 6.592 -2.846 -7.102 1.00 34.51 C ATOM 1811 CD GLU A 705 7.577 -1.712 -6.956 1.00 2.53 C ATOM 1812 OE1 GLU A 705 8.698 -1.947 -6.486 1.00 13.01 O ATOM 1813 OE2 GLU A 705 7.222 -0.565 -7.292 1.00 63.44 O ATOM 0 H GLU A 705 3.729 -2.860 -3.995 1.00 24.04 H new ATOM 0 HA GLU A 705 6.014 -1.241 -4.883 1.00 63.13 H new ATOM 0 HB2 GLU A 705 6.677 -3.608 -5.113 1.00 1.51 H new ATOM 0 HB3 GLU A 705 5.182 -3.961 -5.956 1.00 1.51 H new ATOM 0 HG2 GLU A 705 7.105 -3.726 -7.489 1.00 34.51 H new ATOM 0 HG3 GLU A 705 5.830 -2.574 -7.833 1.00 34.51 H new ATOM 1820 N TYR A 706 4.495 -0.354 -6.711 1.00 20.42 N ATOM 1821 CA TYR A 706 3.523 0.282 -7.569 1.00 11.22 C ATOM 1822 C TYR A 706 3.441 -0.437 -8.885 1.00 45.13 C ATOM 1823 O TYR A 706 4.437 -0.562 -9.592 1.00 22.04 O ATOM 1824 CB TYR A 706 3.826 1.772 -7.781 1.00 55.34 C ATOM 1825 CG TYR A 706 2.858 2.458 -8.731 1.00 15.24 C ATOM 1826 CD1 TYR A 706 1.515 2.601 -8.402 1.00 75.30 C ATOM 1827 CD2 TYR A 706 3.285 2.969 -9.949 1.00 60.15 C ATOM 1828 CE1 TYR A 706 0.639 3.225 -9.247 1.00 51.12 C ATOM 1829 CE2 TYR A 706 2.410 3.596 -10.802 1.00 53.01 C ATOM 1830 CZ TYR A 706 1.090 3.724 -10.446 1.00 32.33 C ATOM 1831 OH TYR A 706 0.216 4.354 -11.290 1.00 45.13 O ATOM 0 H TYR A 706 5.423 0.069 -6.730 1.00 20.42 H new ATOM 0 HA TYR A 706 2.555 0.221 -7.071 1.00 11.22 H new ATOM 0 HB2 TYR A 706 3.799 2.281 -6.817 1.00 55.34 H new ATOM 0 HB3 TYR A 706 4.839 1.877 -8.169 1.00 55.34 H new ATOM 0 HD1 TYR A 706 1.156 2.212 -7.461 1.00 75.30 H new ATOM 0 HD2 TYR A 706 4.323 2.872 -10.231 1.00 60.15 H new ATOM 0 HE1 TYR A 706 -0.401 3.325 -8.974 1.00 51.12 H new ATOM 0 HE2 TYR A 706 2.758 3.986 -11.747 1.00 53.01 H new ATOM 0 HH TYR A 706 0.693 4.649 -12.094 1.00 45.13 H new ATOM 1841 N GLN A 707 2.277 -0.932 -9.208 1.00 1.22 N ATOM 1842 CA GLN A 707 2.098 -1.620 -10.453 1.00 41.21 C ATOM 1843 C GLN A 707 1.741 -0.645 -11.546 1.00 33.24 C ATOM 1844 O GLN A 707 2.610 -0.239 -12.310 1.00 71.23 O ATOM 1845 CB GLN A 707 1.082 -2.748 -10.325 1.00 5.45 C ATOM 1846 CG GLN A 707 1.535 -3.850 -9.382 1.00 43.31 C ATOM 1847 CD GLN A 707 2.805 -4.549 -9.862 1.00 53.54 C ATOM 1848 OE1 GLN A 707 2.742 -5.533 -10.590 1.00 41.50 O ATOM 1849 NE2 GLN A 707 3.956 -4.045 -9.471 1.00 40.44 N ATOM 0 H GLN A 707 1.441 -0.871 -8.626 1.00 1.22 H new ATOM 0 HA GLN A 707 3.043 -2.088 -10.729 1.00 41.21 H new ATOM 0 HB2 GLN A 707 0.136 -2.339 -9.970 1.00 5.45 H new ATOM 0 HB3 GLN A 707 0.895 -3.175 -11.310 1.00 5.45 H new ATOM 0 HG2 GLN A 707 1.709 -3.427 -8.392 1.00 43.31 H new ATOM 0 HG3 GLN A 707 0.737 -4.585 -9.279 1.00 43.31 H new ATOM 0 HE21 GLN A 707 3.974 -3.225 -8.865 1.00 40.44 H new ATOM 0 HE22 GLN A 707 4.830 -4.474 -9.774 1.00 40.44 H new ATOM 1857 N GLU A 708 0.489 -0.231 -11.595 1.00 24.54 N ATOM 1858 CA GLU A 708 0.051 0.717 -12.595 1.00 2.10 C ATOM 1859 C GLU A 708 -1.350 1.183 -12.313 1.00 65.11 C ATOM 1860 O GLU A 708 -2.219 0.397 -11.911 1.00 44.43 O ATOM 1861 CB GLU A 708 0.116 0.113 -14.015 1.00 34.34 C ATOM 1862 CG GLU A 708 -0.784 -1.094 -14.221 1.00 30.20 C ATOM 1863 CD GLU A 708 -0.644 -1.693 -15.583 1.00 34.33 C ATOM 1864 OE1 GLU A 708 -1.365 -1.271 -16.520 1.00 3.15 O ATOM 1865 OE2 GLU A 708 0.196 -2.606 -15.748 1.00 71.41 O ATOM 0 H GLU A 708 -0.241 -0.538 -10.952 1.00 24.54 H new ATOM 0 HA GLU A 708 0.730 1.569 -12.549 1.00 2.10 H new ATOM 0 HB2 GLU A 708 -0.156 0.882 -14.738 1.00 34.34 H new ATOM 0 HB3 GLU A 708 1.145 -0.175 -14.228 1.00 34.34 H new ATOM 0 HG2 GLU A 708 -0.549 -1.849 -13.471 1.00 30.20 H new ATOM 0 HG3 GLU A 708 -1.822 -0.799 -14.063 1.00 30.20 H new ATOM 1872 N GLU A 709 -1.553 2.452 -12.445 1.00 44.10 N ATOM 1873 CA GLU A 709 -2.870 3.002 -12.418 1.00 12.31 C ATOM 1874 C GLU A 709 -3.437 2.874 -13.825 1.00 71.14 C ATOM 1875 O GLU A 709 -2.776 3.253 -14.811 1.00 54.21 O ATOM 1876 CB GLU A 709 -2.820 4.469 -11.936 1.00 14.04 C ATOM 1877 CG GLU A 709 -4.159 5.199 -11.797 1.00 21.12 C ATOM 1878 CD GLU A 709 -4.830 5.500 -13.106 1.00 71.44 C ATOM 1879 OE1 GLU A 709 -4.384 6.426 -13.797 1.00 72.44 O ATOM 1880 OE2 GLU A 709 -5.797 4.824 -13.460 1.00 33.31 O ATOM 0 H GLU A 709 -0.810 3.139 -12.575 1.00 44.10 H new ATOM 0 HA GLU A 709 -3.515 2.470 -11.719 1.00 12.31 H new ATOM 0 HB2 GLU A 709 -2.320 4.491 -10.968 1.00 14.04 H new ATOM 0 HB3 GLU A 709 -2.197 5.033 -12.630 1.00 14.04 H new ATOM 0 HG2 GLU A 709 -4.830 4.593 -11.188 1.00 21.12 H new ATOM 0 HG3 GLU A 709 -3.997 6.134 -11.260 1.00 21.12 H new ATOM 1887 N ASP A 710 -4.619 2.337 -13.918 1.00 34.13 N ATOM 1888 CA ASP A 710 -5.275 2.129 -15.203 1.00 64.45 C ATOM 1889 C ASP A 710 -6.786 2.275 -15.058 1.00 51.30 C ATOM 1890 O ASP A 710 -7.481 2.772 -15.949 1.00 51.33 O ATOM 1891 CB ASP A 710 -4.944 0.730 -15.720 1.00 54.23 C ATOM 1892 CG ASP A 710 -5.564 0.440 -17.059 1.00 45.34 C ATOM 1893 OD1 ASP A 710 -4.956 0.778 -18.085 1.00 1.43 O ATOM 1894 OD2 ASP A 710 -6.654 -0.156 -17.104 1.00 71.21 O ATOM 0 H ASP A 710 -5.165 2.027 -13.114 1.00 34.13 H new ATOM 0 HA ASP A 710 -4.916 2.878 -15.909 1.00 64.45 H new ATOM 0 HB2 ASP A 710 -3.862 0.622 -15.795 1.00 54.23 H new ATOM 0 HB3 ASP A 710 -5.289 -0.010 -14.998 1.00 54.23 H new ATOM 1899 N ASN A 711 -7.276 1.867 -13.918 1.00 55.01 N ATOM 1900 CA ASN A 711 -8.703 1.837 -13.623 1.00 75.21 C ATOM 1901 C ASN A 711 -9.123 3.042 -12.765 1.00 42.42 C ATOM 1902 O ASN A 711 -10.127 2.984 -12.080 1.00 1.01 O ATOM 1903 CB ASN A 711 -9.030 0.515 -12.892 1.00 70.13 C ATOM 1904 CG ASN A 711 -8.207 0.320 -11.619 1.00 23.02 C ATOM 1905 OD1 ASN A 711 -8.603 0.740 -10.550 1.00 10.04 O ATOM 1906 ND2 ASN A 711 -7.068 -0.347 -11.734 1.00 71.12 N ATOM 0 H ASN A 711 -6.693 1.538 -13.148 1.00 55.01 H new ATOM 0 HA ASN A 711 -9.261 1.895 -14.558 1.00 75.21 H new ATOM 0 HB2 ASN A 711 -10.090 0.498 -12.639 1.00 70.13 H new ATOM 0 HB3 ASN A 711 -8.850 -0.322 -13.567 1.00 70.13 H new ATOM 0 HD21 ASN A 711 -6.494 -0.522 -10.909 1.00 71.12 H new ATOM 0 HD22 ASN A 711 -6.765 -0.686 -12.647 1.00 71.12 H new ATOM 1912 N SER A 712 -8.325 4.131 -12.835 1.00 64.50 N ATOM 1913 CA SER A 712 -8.488 5.428 -12.092 1.00 72.10 C ATOM 1914 C SER A 712 -8.051 5.289 -10.648 1.00 54.14 C ATOM 1915 O SER A 712 -7.913 6.265 -9.902 1.00 65.53 O ATOM 1916 CB SER A 712 -9.890 6.102 -12.228 1.00 44.14 C ATOM 1917 OG SER A 712 -10.945 5.358 -11.621 1.00 54.24 O ATOM 0 H SER A 712 -7.503 4.143 -13.439 1.00 64.50 H new ATOM 0 HA SER A 712 -7.817 6.128 -12.590 1.00 72.10 H new ATOM 0 HB2 SER A 712 -9.852 7.094 -11.778 1.00 44.14 H new ATOM 0 HB3 SER A 712 -10.116 6.240 -13.285 1.00 44.14 H new ATOM 0 HG SER A 712 -10.636 4.447 -11.431 1.00 54.24 H new ATOM 1923 N THR A 713 -7.831 4.084 -10.274 1.00 64.02 N ATOM 1924 CA THR A 713 -7.392 3.753 -9.001 1.00 42.45 C ATOM 1925 C THR A 713 -5.987 3.158 -9.142 1.00 41.23 C ATOM 1926 O THR A 713 -5.726 2.343 -10.043 1.00 64.34 O ATOM 1927 CB THR A 713 -8.373 2.744 -8.382 1.00 42.10 C ATOM 1928 OG1 THR A 713 -9.711 3.275 -8.472 1.00 34.41 O ATOM 1929 CG2 THR A 713 -8.055 2.484 -6.933 1.00 13.24 C ATOM 0 H THR A 713 -7.962 3.278 -10.885 1.00 64.02 H new ATOM 0 HA THR A 713 -7.351 4.623 -8.345 1.00 42.45 H new ATOM 0 HB THR A 713 -8.287 1.806 -8.930 1.00 42.10 H new ATOM 0 HG1 THR A 713 -10.343 2.637 -8.081 1.00 34.41 H new ATOM 0 HG21 THR A 713 -8.768 1.766 -6.527 1.00 13.24 H new ATOM 0 HG22 THR A 713 -7.046 2.080 -6.849 1.00 13.24 H new ATOM 0 HG23 THR A 713 -8.121 3.417 -6.373 1.00 13.24 H new ATOM 1935 N TYR A 714 -5.100 3.604 -8.307 1.00 12.22 N ATOM 1936 CA TYR A 714 -3.726 3.191 -8.325 1.00 55.22 C ATOM 1937 C TYR A 714 -3.596 1.868 -7.619 1.00 25.15 C ATOM 1938 O TYR A 714 -3.915 1.762 -6.451 1.00 70.30 O ATOM 1939 CB TYR A 714 -2.851 4.264 -7.634 1.00 41.14 C ATOM 1940 CG TYR A 714 -2.820 5.618 -8.345 1.00 40.51 C ATOM 1941 CD1 TYR A 714 -3.943 6.439 -8.386 1.00 14.23 C ATOM 1942 CD2 TYR A 714 -1.664 6.072 -8.965 1.00 64.35 C ATOM 1943 CE1 TYR A 714 -3.915 7.662 -9.026 1.00 42.10 C ATOM 1944 CE2 TYR A 714 -1.629 7.294 -9.607 1.00 72.52 C ATOM 1945 CZ TYR A 714 -2.757 8.086 -9.634 1.00 13.24 C ATOM 1946 OH TYR A 714 -2.726 9.313 -10.265 1.00 24.30 O ATOM 0 H TYR A 714 -5.314 4.282 -7.575 1.00 12.22 H new ATOM 0 HA TYR A 714 -3.387 3.077 -9.355 1.00 55.22 H new ATOM 0 HB2 TYR A 714 -3.216 4.411 -6.617 1.00 41.14 H new ATOM 0 HB3 TYR A 714 -1.831 3.887 -7.556 1.00 41.14 H new ATOM 0 HD1 TYR A 714 -4.855 6.113 -7.908 1.00 14.23 H new ATOM 0 HD2 TYR A 714 -0.776 5.458 -8.945 1.00 64.35 H new ATOM 0 HE1 TYR A 714 -4.799 8.283 -9.049 1.00 42.10 H new ATOM 0 HE2 TYR A 714 -0.721 7.628 -10.086 1.00 72.52 H new ATOM 0 HH TYR A 714 -1.835 9.464 -10.643 1.00 24.30 H new ATOM 1956 N ASN A 715 -3.132 0.872 -8.324 1.00 74.42 N ATOM 1957 CA ASN A 715 -2.967 -0.452 -7.752 1.00 73.22 C ATOM 1958 C ASN A 715 -1.543 -0.726 -7.367 1.00 31.12 C ATOM 1959 O ASN A 715 -0.594 -0.500 -8.148 1.00 52.10 O ATOM 1960 CB ASN A 715 -3.434 -1.529 -8.720 1.00 41.44 C ATOM 1961 CG ASN A 715 -4.942 -1.748 -8.753 1.00 31.14 C ATOM 1962 OD1 ASN A 715 -5.669 -1.071 -9.474 1.00 35.11 O ATOM 1963 ND2 ASN A 715 -5.414 -2.740 -8.006 1.00 4.54 N ATOM 0 H ASN A 715 -2.857 0.946 -9.304 1.00 74.42 H new ATOM 0 HA ASN A 715 -3.582 -0.477 -6.852 1.00 73.22 H new ATOM 0 HB2 ASN A 715 -3.097 -1.267 -9.723 1.00 41.44 H new ATOM 0 HB3 ASN A 715 -2.950 -2.469 -8.456 1.00 41.44 H new ATOM 0 HD21 ASN A 715 -6.410 -2.960 -8.020 1.00 4.54 H new ATOM 0 HD22 ASN A 715 -4.780 -3.282 -7.418 1.00 4.54 H new ATOM 1969 N PHE A 716 -1.398 -1.190 -6.159 1.00 71.34 N ATOM 1970 CA PHE A 716 -0.134 -1.561 -5.600 1.00 54.14 C ATOM 1971 C PHE A 716 -0.097 -3.040 -5.333 1.00 23.41 C ATOM 1972 O PHE A 716 -1.123 -3.650 -5.038 1.00 43.42 O ATOM 1973 CB PHE A 716 0.151 -0.783 -4.308 1.00 30.12 C ATOM 1974 CG PHE A 716 0.382 0.683 -4.525 1.00 4.41 C ATOM 1975 CD1 PHE A 716 -0.678 1.559 -4.696 1.00 23.32 C ATOM 1976 CD2 PHE A 716 1.667 1.180 -4.565 1.00 33.50 C ATOM 1977 CE1 PHE A 716 -0.453 2.901 -4.905 1.00 3.10 C ATOM 1978 CE2 PHE A 716 1.896 2.518 -4.770 1.00 30.12 C ATOM 1979 CZ PHE A 716 0.834 3.379 -4.940 1.00 24.15 C ATOM 0 H PHE A 716 -2.181 -1.324 -5.519 1.00 71.34 H new ATOM 0 HA PHE A 716 0.641 -1.310 -6.324 1.00 54.14 H new ATOM 0 HB2 PHE A 716 -0.688 -0.912 -3.624 1.00 30.12 H new ATOM 0 HB3 PHE A 716 1.027 -1.212 -3.822 1.00 30.12 H new ATOM 0 HD1 PHE A 716 -1.691 1.185 -4.665 1.00 23.32 H new ATOM 0 HD2 PHE A 716 2.503 0.509 -4.434 1.00 33.50 H new ATOM 0 HE1 PHE A 716 -1.286 3.575 -5.041 1.00 3.10 H new ATOM 0 HE2 PHE A 716 2.908 2.895 -4.798 1.00 30.12 H new ATOM 0 HZ PHE A 716 1.014 4.432 -5.101 1.00 24.15 H new ATOM 1989 N ARG A 717 1.068 -3.593 -5.436 1.00 45.02 N ATOM 1990 CA ARG A 717 1.309 -4.992 -5.209 1.00 51.43 C ATOM 1991 C ARG A 717 1.970 -5.127 -3.860 1.00 54.02 C ATOM 1992 O ARG A 717 3.037 -4.584 -3.648 1.00 4.45 O ATOM 1993 CB ARG A 717 2.236 -5.518 -6.308 1.00 0.54 C ATOM 1994 CG ARG A 717 2.615 -6.967 -6.168 1.00 72.32 C ATOM 1995 CD ARG A 717 3.462 -7.448 -7.331 1.00 54.01 C ATOM 1996 NE ARG A 717 4.786 -6.810 -7.375 1.00 3.24 N ATOM 1997 CZ ARG A 717 5.664 -6.954 -8.379 1.00 21.54 C ATOM 1998 NH1 ARG A 717 5.334 -7.648 -9.466 1.00 25.43 N ATOM 1999 NH2 ARG A 717 6.863 -6.412 -8.290 1.00 63.02 N ATOM 0 H ARG A 717 1.908 -3.072 -5.688 1.00 45.02 H new ATOM 0 HA ARG A 717 0.381 -5.564 -5.229 1.00 51.43 H new ATOM 0 HB2 ARG A 717 1.751 -5.375 -7.274 1.00 0.54 H new ATOM 0 HB3 ARG A 717 3.146 -4.917 -6.316 1.00 0.54 H new ATOM 0 HG2 ARG A 717 3.163 -7.110 -5.237 1.00 72.32 H new ATOM 0 HG3 ARG A 717 1.712 -7.573 -6.102 1.00 72.32 H new ATOM 0 HD2 ARG A 717 3.587 -8.529 -7.261 1.00 54.01 H new ATOM 0 HD3 ARG A 717 2.936 -7.248 -8.265 1.00 54.01 H new ATOM 0 HE ARG A 717 5.055 -6.218 -6.589 1.00 3.24 H new ATOM 0 HH11 ARG A 717 4.410 -8.073 -9.538 1.00 25.43 H new ATOM 0 HH12 ARG A 717 6.005 -7.754 -10.226 1.00 25.43 H new ATOM 0 HH21 ARG A 717 7.123 -5.883 -7.458 1.00 63.02 H new ATOM 0 HH22 ARG A 717 7.530 -6.522 -9.054 1.00 63.02 H new ATOM 2011 N TRP A 718 1.339 -5.815 -2.961 1.00 35.41 N ATOM 2012 CA TRP A 718 1.829 -5.915 -1.612 1.00 23.35 C ATOM 2013 C TRP A 718 2.111 -7.378 -1.260 1.00 64.45 C ATOM 2014 O TRP A 718 1.206 -8.183 -1.220 1.00 34.13 O ATOM 2015 CB TRP A 718 0.742 -5.357 -0.679 1.00 73.33 C ATOM 2016 CG TRP A 718 1.158 -5.117 0.726 1.00 25.44 C ATOM 2017 CD1 TRP A 718 1.495 -6.040 1.657 1.00 64.42 C ATOM 2018 CD2 TRP A 718 1.231 -3.855 1.371 1.00 72.11 C ATOM 2019 NE1 TRP A 718 1.792 -5.423 2.837 1.00 35.40 N ATOM 2020 CE2 TRP A 718 1.646 -4.085 2.682 1.00 3.32 C ATOM 2021 CE3 TRP A 718 0.998 -2.547 0.959 1.00 62.43 C ATOM 2022 CZ2 TRP A 718 1.832 -3.065 3.581 1.00 5.42 C ATOM 2023 CZ3 TRP A 718 1.178 -1.533 1.865 1.00 63.52 C ATOM 2024 CH2 TRP A 718 1.594 -1.798 3.152 1.00 2.21 C ATOM 0 H TRP A 718 0.472 -6.324 -3.135 1.00 35.41 H new ATOM 0 HA TRP A 718 2.757 -5.353 -1.504 1.00 23.35 H new ATOM 0 HB2 TRP A 718 0.379 -4.418 -1.096 1.00 73.33 H new ATOM 0 HB3 TRP A 718 -0.099 -6.051 -0.676 1.00 73.33 H new ATOM 0 HD1 TRP A 718 1.524 -7.107 1.490 1.00 64.42 H new ATOM 0 HE1 TRP A 718 2.078 -5.893 3.696 1.00 35.40 H new ATOM 0 HE3 TRP A 718 0.682 -2.335 -0.052 1.00 62.43 H new ATOM 0 HZ2 TRP A 718 2.156 -3.262 4.592 1.00 5.42 H new ATOM 0 HZ3 TRP A 718 0.991 -0.512 1.566 1.00 63.52 H new ATOM 0 HH2 TRP A 718 1.735 -0.976 3.838 1.00 2.21 H new ATOM 2035 N TYR A 719 3.350 -7.712 -1.013 1.00 33.33 N ATOM 2036 CA TYR A 719 3.690 -9.074 -0.597 1.00 40.31 C ATOM 2037 C TYR A 719 3.686 -9.167 0.917 1.00 44.04 C ATOM 2038 O TYR A 719 4.563 -8.602 1.572 1.00 32.24 O ATOM 2039 CB TYR A 719 5.064 -9.497 -1.123 1.00 71.11 C ATOM 2040 CG TYR A 719 5.158 -9.651 -2.618 1.00 32.31 C ATOM 2041 CD1 TYR A 719 4.788 -10.840 -3.226 1.00 21.43 C ATOM 2042 CD2 TYR A 719 5.636 -8.625 -3.422 1.00 25.40 C ATOM 2043 CE1 TYR A 719 4.890 -11.008 -4.587 1.00 70.34 C ATOM 2044 CE2 TYR A 719 5.738 -8.785 -4.787 1.00 44.00 C ATOM 2045 CZ TYR A 719 5.363 -9.979 -5.364 1.00 11.34 C ATOM 2046 OH TYR A 719 5.471 -10.148 -6.727 1.00 54.10 O ATOM 0 H TYR A 719 4.144 -7.076 -1.088 1.00 33.33 H new ATOM 0 HA TYR A 719 2.940 -9.745 -1.016 1.00 40.31 H new ATOM 0 HB2 TYR A 719 5.801 -8.760 -0.803 1.00 71.11 H new ATOM 0 HB3 TYR A 719 5.338 -10.444 -0.658 1.00 71.11 H new ATOM 0 HD1 TYR A 719 4.412 -11.650 -2.619 1.00 21.43 H new ATOM 0 HD2 TYR A 719 5.932 -7.689 -2.972 1.00 25.40 H new ATOM 0 HE1 TYR A 719 4.600 -11.943 -5.042 1.00 70.34 H new ATOM 0 HE2 TYR A 719 6.110 -7.979 -5.402 1.00 44.00 H new ATOM 0 HH TYR A 719 4.785 -10.777 -7.034 1.00 54.10 H new ATOM 2056 N THR A 720 2.696 -9.830 1.478 1.00 13.15 N ATOM 2057 CA THR A 720 2.622 -9.972 2.910 1.00 40.35 C ATOM 2058 C THR A 720 2.138 -11.363 3.307 1.00 71.31 C ATOM 2059 O THR A 720 1.257 -11.950 2.664 1.00 4.22 O ATOM 2060 CB THR A 720 1.725 -8.887 3.574 1.00 24.35 C ATOM 2061 OG1 THR A 720 1.737 -9.040 5.003 1.00 74.30 O ATOM 2062 CG2 THR A 720 0.297 -8.985 3.081 1.00 64.21 C ATOM 0 H THR A 720 1.936 -10.276 0.964 1.00 13.15 H new ATOM 0 HA THR A 720 3.638 -9.832 3.280 1.00 40.35 H new ATOM 0 HB THR A 720 2.128 -7.911 3.302 1.00 24.35 H new ATOM 0 HG1 THR A 720 2.121 -8.238 5.415 1.00 74.30 H new ATOM 0 HG21 THR A 720 -0.307 -8.215 3.561 1.00 64.21 H new ATOM 0 HG22 THR A 720 0.274 -8.843 2.001 1.00 64.21 H new ATOM 0 HG23 THR A 720 -0.106 -9.968 3.326 1.00 64.21 H new ATOM 2068 N SER A 721 2.726 -11.892 4.340 1.00 44.30 N ATOM 2069 CA SER A 721 2.330 -13.158 4.888 1.00 53.42 C ATOM 2070 C SER A 721 0.957 -13.048 5.601 1.00 63.32 C ATOM 2071 O SER A 721 0.216 -14.031 5.703 1.00 15.01 O ATOM 2072 CB SER A 721 3.423 -13.663 5.823 1.00 53.34 C ATOM 2073 OG SER A 721 4.641 -13.833 5.106 1.00 22.50 O ATOM 0 H SER A 721 3.503 -11.452 4.832 1.00 44.30 H new ATOM 0 HA SER A 721 2.205 -13.882 4.083 1.00 53.42 H new ATOM 0 HB2 SER A 721 3.569 -12.956 6.640 1.00 53.34 H new ATOM 0 HB3 SER A 721 3.120 -14.610 6.271 1.00 53.34 H new ATOM 0 HG SER A 721 5.337 -14.156 5.716 1.00 22.50 H new ATOM 2079 N TYR A 722 0.614 -11.833 6.048 1.00 34.15 N ATOM 2080 CA TYR A 722 -0.623 -11.586 6.789 1.00 15.51 C ATOM 2081 C TYR A 722 -1.875 -11.652 5.913 1.00 3.20 C ATOM 2082 O TYR A 722 -2.995 -11.680 6.429 1.00 75.42 O ATOM 2083 CB TYR A 722 -0.562 -10.235 7.498 1.00 53.25 C ATOM 2084 CG TYR A 722 0.479 -10.156 8.599 1.00 35.12 C ATOM 2085 CD1 TYR A 722 0.232 -10.708 9.849 1.00 70.32 C ATOM 2086 CD2 TYR A 722 1.701 -9.538 8.391 1.00 35.00 C ATOM 2087 CE1 TYR A 722 1.171 -10.643 10.859 1.00 42.11 C ATOM 2088 CE2 TYR A 722 2.647 -9.468 9.401 1.00 64.51 C ATOM 2089 CZ TYR A 722 2.377 -10.019 10.629 1.00 43.10 C ATOM 2090 OH TYR A 722 3.326 -9.955 11.632 1.00 13.32 O ATOM 0 H TYR A 722 1.185 -11.000 5.906 1.00 34.15 H new ATOM 0 HA TYR A 722 -0.703 -12.388 7.522 1.00 15.51 H new ATOM 0 HB2 TYR A 722 -0.354 -9.460 6.761 1.00 53.25 H new ATOM 0 HB3 TYR A 722 -1.541 -10.016 7.923 1.00 53.25 H new ATOM 0 HD1 TYR A 722 -0.713 -11.197 10.035 1.00 70.32 H new ATOM 0 HD2 TYR A 722 1.920 -9.104 7.427 1.00 35.00 H new ATOM 0 HE1 TYR A 722 0.961 -11.079 11.824 1.00 42.11 H new ATOM 0 HE2 TYR A 722 3.594 -8.981 9.223 1.00 64.51 H new ATOM 0 HH TYR A 722 4.119 -9.482 11.303 1.00 13.32 H new ATOM 2100 N ALA A 723 -1.692 -11.666 4.610 1.00 63.34 N ATOM 2101 CA ALA A 723 -2.819 -11.725 3.684 1.00 43.50 C ATOM 2102 C ALA A 723 -2.982 -13.117 3.141 1.00 53.41 C ATOM 2103 O ALA A 723 -3.770 -13.352 2.234 1.00 51.45 O ATOM 2104 CB ALA A 723 -2.612 -10.765 2.533 1.00 25.05 C ATOM 0 H ALA A 723 -0.776 -11.638 4.161 1.00 63.34 H new ATOM 0 HA ALA A 723 -3.718 -11.443 4.232 1.00 43.50 H new ATOM 0 HB1 ALA A 723 -3.462 -10.823 1.853 1.00 25.05 H new ATOM 0 HB2 ALA A 723 -2.524 -9.749 2.918 1.00 25.05 H new ATOM 0 HB3 ALA A 723 -1.701 -11.030 1.997 1.00 25.05 H new ATOM 2110 N CYS A 724 -2.255 -14.037 3.693 1.00 64.41 N ATOM 2111 CA CYS A 724 -2.282 -15.362 3.180 1.00 74.34 C ATOM 2112 C CYS A 724 -2.998 -16.308 4.124 1.00 24.05 C ATOM 2113 O CYS A 724 -2.667 -16.365 5.314 1.00 64.02 O ATOM 2114 CB CYS A 724 -0.868 -15.853 2.941 1.00 25.12 C ATOM 2115 SG CYS A 724 -0.797 -17.479 2.148 1.00 11.51 S ATOM 0 H CYS A 724 -1.640 -13.893 4.494 1.00 64.41 H new ATOM 0 HA CYS A 724 -2.829 -15.344 2.238 1.00 74.34 H new ATOM 0 HB2 CYS A 724 -0.340 -15.130 2.319 1.00 25.12 H new ATOM 0 HB3 CYS A 724 -0.341 -15.898 3.894 1.00 25.12 H new ATOM 2120 N PRO A 725 -4.008 -17.046 3.621 1.00 72.21 N ATOM 2121 CA PRO A 725 -4.689 -18.076 4.389 1.00 51.30 C ATOM 2122 C PRO A 725 -3.829 -19.344 4.467 1.00 51.34 C ATOM 2123 O PRO A 725 -3.021 -19.465 5.407 1.00 37.94 O ATOM 2124 CB PRO A 725 -5.979 -18.353 3.580 1.00 24.41 C ATOM 2125 CG PRO A 725 -6.014 -17.321 2.501 1.00 53.54 C ATOM 2126 CD PRO A 725 -4.595 -16.904 2.280 1.00 13.14 C ATOM 2127 OXT PRO A 725 -3.950 -20.222 3.579 1.00 37.94 O ATOM 0 HA PRO A 725 -4.890 -17.771 5.416 1.00 51.30 H new ATOM 0 HB2 PRO A 725 -5.968 -19.358 3.159 1.00 24.41 H new ATOM 0 HB3 PRO A 725 -6.862 -18.284 4.216 1.00 24.41 H new ATOM 0 HG2 PRO A 725 -6.448 -17.727 1.587 1.00 53.54 H new ATOM 0 HG3 PRO A 725 -6.629 -16.470 2.795 1.00 53.54 H new ATOM 0 HD2 PRO A 725 -4.095 -17.539 1.549 1.00 13.14 H new ATOM 0 HD3 PRO A 725 -4.526 -15.880 1.913 1.00 13.14 H new TER 2135 PRO A 725