USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1100 hydrogens (14 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 NoAdj-H: B 36 ALY H2 : B 36 ALY N : B 35 VAL C :(H bumps) USER MOD Set 1.1: A 814 ASN : amide:sc= -0.195 K(o=-0.21,f=-1.1!) USER MOD Set 1.2: A 818 LYS NZ :NH3+ -138:sc= -0.0114 (180deg=-0.052) USER MOD Set 2.1: A 760 TYR OH : rot 98:sc= 0.596 USER MOD Set 2.2: A 798 ASN : amide:sc= -10.9! C(o=-22!,f=-27!) USER MOD Set 2.3: A 799 CYS SG : rot 44:sc= -11.7! USER MOD Set 3.1: A 789 MET CE :methyl -152:sc= -11.7! (180deg=-13.4!) USER MOD Set 3.2: A 793 GLN :FLIP amide:sc= -6.71! C(o=-19!,f=-18!) USER MOD Set 4.1: A 773 MET CE :methyl -115:sc= -10.8! (180deg=-12.2!) USER MOD Set 4.2: A 782 TYR OH : rot -38:sc= -5.28! USER MOD Set 5.1: A 744 SER OG : rot -49:sc= 0.194 USER MOD Set 5.2: A 812 CYS SG : rot 91:sc= 0.119! USER MOD Set 6.1: A 729 TYR OH : rot 180:sc= 0.372 USER MOD Set 6.2: A 733 LYS NZ :NH3+ -161:sc= 0.393 (180deg=0) USER MOD Single : A 716 SER OG : rot 180:sc= 0 USER MOD Single : A 717 HIS : no HD1:sc= 0 X(o=0,f=-0.0051) USER MOD Single : A 718 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 719 SER OG : rot 56:sc= 0.536 USER MOD Single : A 720 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 727 GLN : amide:sc= -2.07! C(o=-2.1!,f=-5.3!) USER MOD Single : A 730 SER OG : rot 180:sc= 0 USER MOD Single : A 731 THR OG1 : rot 101:sc= 1.24 USER MOD Single : A 734 SER OG : rot 67:sc= 0.0344 USER MOD Single : A 737 GLN :FLIP amide:sc= 0 F(o=-3.3!,f=0) USER MOD Single : A 738 GLN :FLIP amide:sc= -3.05 F(o=-7.3!,f=-3) USER MOD Single : A 740 LYS NZ :NH3+ 160:sc= -4.36! (180deg=-5.3) USER MOD Single : A 741 SER OG : rot -37:sc= 0.161 USER MOD Single : A 742 HIS : no HD1:sc= -9.38! C(o=-9.4!,f=-18!) USER MOD Single : A 743 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 749 MET CE :methyl -110:sc= -4.67! (180deg=-9.93!) USER MOD Single : A 753 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 755 THR OG1 : rot 180:sc= 0 USER MOD Single : A 761 TYR OH : rot 180:sc= 0 USER MOD Single : A 768 MET CE :methyl -129:sc= -4.21 (180deg=-11.1!) USER MOD Single : A 771 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 772 THR OG1 : rot 49:sc= 1.04 USER MOD Single : A 774 SER OG : rot -31:sc= 1.03 USER MOD Single : A 778 LYS NZ :NH3+ -147:sc= -0.189 (180deg=-0.82) USER MOD Single : A 779 ASN :FLIP amide:sc= -3.84! C(o=-7.5!,f=-3.8!) USER MOD Single : A 781 TYR OH : rot 180:sc= -1.05! USER MOD Single : A 784 SER OG : rot 45:sc= 0.938 USER MOD Single : A 785 LYS NZ :NH3+ -117:sc= 0.407 (180deg=-0.0232) USER MOD Single : A 786 LYS NZ :NH3+ 174:sc= -0.581 (180deg=-0.629) USER MOD Single : A 797 THR OG1 : rot -67:sc= 1.29 USER MOD Single : A 800 LYS NZ :NH3+ -113:sc= -1.17 (180deg=-1.58) USER MOD Single : A 802 TYR OH : rot 17:sc= -0.599! USER MOD Single : A 803 ASN : amide:sc= -3.72! X(o=-3.7!,f=-3.3) USER MOD Single : A 807 SER OG : rot 147:sc= -0.583 USER MOD Single : A 809 TYR OH : rot 164:sc= -0.97 USER MOD Single : A 810 TYR OH : rot 123:sc= 0.0403 USER MOD Single : A 811 LYS NZ :NH3+ -116:sc= -1.23 (180deg=-3.11!) USER MOD Single : A 822 SER OG : rot 180:sc= 0 USER MOD Single : A 823 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 825 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 832 LYS NZ :NH3+ 136:sc= -0.0758 (180deg=-0.451) USER MOD Single : B 31 SER OG : rot 40:sc= 0.0423 USER MOD Single : B 32 THR OG1 : rot 180:sc= 0 USER MOD Single : B 37 LYS NZ :NH3+ -132:sc= 0.164 (180deg=-2.1!) USER MOD Single : B 39 HIS : no HD1:sc= -4.68! C(o=-4.7!,f=-8.4!) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 CYS SG : rot 42:sc= -0.303 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 715 -30.463 4.874 -4.813 1.00 0.00 N ATOM 2 CA GLY A 715 -31.134 5.292 -3.551 1.00 0.00 C ATOM 3 C GLY A 715 -30.158 5.476 -2.406 1.00 0.00 C ATOM 4 O GLY A 715 -30.560 5.778 -1.282 1.00 0.00 O ATOM 0 HA2 GLY A 715 -31.670 6.226 -3.721 1.00 0.00 H new ATOM 0 HA3 GLY A 715 -31.877 4.544 -3.274 1.00 0.00 H new ATOM 10 N SER A 716 -28.871 5.293 -2.691 1.00 0.00 N ATOM 11 CA SER A 716 -27.835 5.439 -1.676 1.00 0.00 C ATOM 12 C SER A 716 -27.656 6.905 -1.289 1.00 0.00 C ATOM 13 O SER A 716 -28.103 7.333 -0.225 1.00 0.00 O ATOM 14 CB SER A 716 -26.510 4.866 -2.182 1.00 0.00 C ATOM 15 OG SER A 716 -26.632 3.487 -2.483 1.00 0.00 O ATOM 0 H SER A 716 -28.522 5.043 -3.617 1.00 0.00 H new ATOM 0 HA SER A 716 -28.147 4.884 -0.791 1.00 0.00 H new ATOM 0 HB2 SER A 716 -26.192 5.409 -3.072 1.00 0.00 H new ATOM 0 HB3 SER A 716 -25.736 5.010 -1.428 1.00 0.00 H new ATOM 0 HG SER A 716 -25.772 3.145 -2.806 1.00 0.00 H new ATOM 21 N HIS A 717 -27.002 7.666 -2.165 1.00 0.00 N ATOM 22 CA HIS A 717 -26.761 9.089 -1.931 1.00 0.00 C ATOM 23 C HIS A 717 -25.933 9.315 -0.669 1.00 0.00 C ATOM 24 O HIS A 717 -26.426 9.153 0.448 1.00 0.00 O ATOM 25 CB HIS A 717 -28.087 9.846 -1.824 1.00 0.00 C ATOM 26 CG HIS A 717 -28.908 9.795 -3.074 1.00 0.00 C ATOM 27 ND1 HIS A 717 -29.996 8.961 -3.227 1.00 0.00 N ATOM 28 CD2 HIS A 717 -28.801 10.485 -4.235 1.00 0.00 C ATOM 29 CE1 HIS A 717 -30.521 9.139 -4.425 1.00 0.00 C ATOM 30 NE2 HIS A 717 -29.815 10.059 -5.056 1.00 0.00 N ATOM 0 H HIS A 717 -26.628 7.319 -3.048 1.00 0.00 H new ATOM 0 HA HIS A 717 -26.197 9.471 -2.782 1.00 0.00 H new ATOM 0 HB2 HIS A 717 -28.668 9.430 -1.001 1.00 0.00 H new ATOM 0 HB3 HIS A 717 -27.882 10.887 -1.576 1.00 0.00 H new ATOM 0 HD2 HIS A 717 -28.057 11.231 -4.471 1.00 0.00 H new ATOM 0 HE1 HIS A 717 -31.381 8.620 -4.821 1.00 0.00 H new ATOM 0 HE2 HIS A 717 -29.994 10.398 -6.001 1.00 0.00 H new ATOM 39 N MET A 718 -24.672 9.694 -0.858 1.00 0.00 N ATOM 40 CA MET A 718 -23.768 9.954 0.260 1.00 0.00 C ATOM 41 C MET A 718 -23.669 8.745 1.184 1.00 0.00 C ATOM 42 O MET A 718 -23.573 8.889 2.403 1.00 0.00 O ATOM 43 CB MET A 718 -24.236 11.180 1.050 1.00 0.00 C ATOM 44 CG MET A 718 -24.047 12.495 0.309 1.00 0.00 C ATOM 45 SD MET A 718 -25.055 12.611 -1.182 1.00 0.00 S ATOM 46 CE MET A 718 -24.559 14.217 -1.801 1.00 0.00 C ATOM 0 H MET A 718 -24.251 9.828 -1.778 1.00 0.00 H new ATOM 0 HA MET A 718 -22.778 10.150 -0.151 1.00 0.00 H new ATOM 0 HB2 MET A 718 -25.291 11.061 1.297 1.00 0.00 H new ATOM 0 HB3 MET A 718 -23.691 11.223 1.993 1.00 0.00 H new ATOM 0 HG2 MET A 718 -24.296 13.321 0.975 1.00 0.00 H new ATOM 0 HG3 MET A 718 -22.996 12.608 0.041 1.00 0.00 H new ATOM 0 HE1 MET A 718 -25.098 14.434 -2.724 1.00 0.00 H new ATOM 0 HE2 MET A 718 -24.790 14.980 -1.058 1.00 0.00 H new ATOM 0 HE3 MET A 718 -23.487 14.216 -1.999 1.00 0.00 H new ATOM 56 N SER A 719 -23.690 7.553 0.596 1.00 0.00 N ATOM 57 CA SER A 719 -23.599 6.317 1.369 1.00 0.00 C ATOM 58 C SER A 719 -23.355 5.121 0.454 1.00 0.00 C ATOM 59 O SER A 719 -24.267 4.341 0.178 1.00 0.00 O ATOM 60 CB SER A 719 -24.879 6.104 2.180 1.00 0.00 C ATOM 61 OG SER A 719 -26.017 6.057 1.338 1.00 0.00 O ATOM 0 H SER A 719 -23.769 7.416 -0.412 1.00 0.00 H new ATOM 0 HA SER A 719 -22.755 6.405 2.053 1.00 0.00 H new ATOM 0 HB2 SER A 719 -24.804 5.176 2.746 1.00 0.00 H new ATOM 0 HB3 SER A 719 -24.992 6.911 2.904 1.00 0.00 H new ATOM 0 HG SER A 719 -25.896 5.357 0.663 1.00 0.00 H new ATOM 67 N LYS A 720 -22.119 4.980 -0.015 1.00 0.00 N ATOM 68 CA LYS A 720 -21.761 3.879 -0.899 1.00 0.00 C ATOM 69 C LYS A 720 -21.152 2.719 -0.115 1.00 0.00 C ATOM 70 O LYS A 720 -21.873 1.844 0.365 1.00 0.00 O ATOM 71 CB LYS A 720 -20.795 4.347 -1.981 1.00 0.00 C ATOM 72 CG LYS A 720 -21.352 5.445 -2.875 1.00 0.00 C ATOM 73 CD LYS A 720 -21.169 6.825 -2.258 1.00 0.00 C ATOM 74 CE LYS A 720 -19.711 7.256 -2.272 1.00 0.00 C ATOM 75 NZ LYS A 720 -19.521 8.595 -1.648 1.00 0.00 N ATOM 0 H LYS A 720 -21.350 5.614 0.203 1.00 0.00 H new ATOM 0 HA LYS A 720 -22.676 3.527 -1.376 1.00 0.00 H new ATOM 0 HB2 LYS A 720 -19.882 4.707 -1.507 1.00 0.00 H new ATOM 0 HB3 LYS A 720 -20.518 3.494 -2.600 1.00 0.00 H new ATOM 0 HG2 LYS A 720 -20.855 5.412 -3.844 1.00 0.00 H new ATOM 0 HG3 LYS A 720 -22.412 5.265 -3.054 1.00 0.00 H new ATOM 0 HD2 LYS A 720 -21.769 7.552 -2.806 1.00 0.00 H new ATOM 0 HD3 LYS A 720 -21.537 6.817 -1.232 1.00 0.00 H new ATOM 0 HE2 LYS A 720 -19.110 6.519 -1.740 1.00 0.00 H new ATOM 0 HE3 LYS A 720 -19.350 7.280 -3.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 720 -18.514 8.852 -1.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 720 -20.075 9.303 -2.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 720 -19.842 8.566 -0.659 1.00 0.00 H new ATOM 89 N GLU A 721 -19.827 2.728 0.021 1.00 0.00 N ATOM 90 CA GLU A 721 -19.116 1.677 0.747 1.00 0.00 C ATOM 91 C GLU A 721 -19.430 0.296 0.172 1.00 0.00 C ATOM 92 O GLU A 721 -20.496 -0.267 0.418 1.00 0.00 O ATOM 93 CB GLU A 721 -19.471 1.720 2.235 1.00 0.00 C ATOM 94 CG GLU A 721 -18.769 0.662 3.062 1.00 0.00 C ATOM 95 CD GLU A 721 -19.256 0.622 4.497 1.00 0.00 C ATOM 96 OE1 GLU A 721 -18.678 1.340 5.339 1.00 0.00 O ATOM 97 OE2 GLU A 721 -20.215 -0.128 4.779 1.00 0.00 O ATOM 0 H GLU A 721 -19.222 3.454 -0.363 1.00 0.00 H new ATOM 0 HA GLU A 721 -18.047 1.858 0.632 1.00 0.00 H new ATOM 0 HB2 GLU A 721 -19.219 2.704 2.631 1.00 0.00 H new ATOM 0 HB3 GLU A 721 -20.549 1.599 2.346 1.00 0.00 H new ATOM 0 HG2 GLU A 721 -18.924 -0.314 2.603 1.00 0.00 H new ATOM 0 HG3 GLU A 721 -17.696 0.852 3.052 1.00 0.00 H new ATOM 104 N PRO A 722 -18.486 -0.266 -0.599 1.00 0.00 N ATOM 105 CA PRO A 722 -18.641 -1.572 -1.219 1.00 0.00 C ATOM 106 C PRO A 722 -18.347 -2.718 -0.250 1.00 0.00 C ATOM 107 O PRO A 722 -17.799 -3.744 -0.638 1.00 0.00 O ATOM 108 CB PRO A 722 -17.635 -1.535 -2.357 1.00 0.00 C ATOM 109 CG PRO A 722 -16.614 -0.544 -1.966 1.00 0.00 C ATOM 110 CD PRO A 722 -17.195 0.343 -0.926 1.00 0.00 C ATOM 0 HA PRO A 722 -19.663 -1.756 -1.550 1.00 0.00 H new ATOM 0 HB2 PRO A 722 -17.187 -2.516 -2.513 1.00 0.00 H new ATOM 0 HB3 PRO A 722 -18.116 -1.251 -3.293 1.00 0.00 H new ATOM 0 HG2 PRO A 722 -15.726 -1.046 -1.583 1.00 0.00 H new ATOM 0 HG3 PRO A 722 -16.302 0.040 -2.832 1.00 0.00 H new ATOM 0 HD2 PRO A 722 -16.550 0.400 -0.049 1.00 0.00 H new ATOM 0 HD3 PRO A 722 -17.319 1.360 -1.297 1.00 0.00 H new ATOM 118 N ARG A 723 -18.757 -2.525 1.008 1.00 0.00 N ATOM 119 CA ARG A 723 -18.568 -3.505 2.084 1.00 0.00 C ATOM 120 C ARG A 723 -18.486 -4.941 1.571 1.00 0.00 C ATOM 121 O ARG A 723 -17.559 -5.672 1.918 1.00 0.00 O ATOM 122 CB ARG A 723 -19.704 -3.393 3.098 1.00 0.00 C ATOM 123 CG ARG A 723 -19.469 -4.221 4.347 1.00 0.00 C ATOM 124 CD ARG A 723 -18.666 -3.452 5.384 1.00 0.00 C ATOM 125 NE ARG A 723 -18.479 -4.225 6.610 1.00 0.00 N ATOM 126 CZ ARG A 723 -17.634 -3.881 7.577 1.00 0.00 C ATOM 127 NH1 ARG A 723 -16.897 -2.784 7.461 1.00 0.00 N ATOM 128 NH2 ARG A 723 -17.525 -4.635 8.662 1.00 0.00 N ATOM 0 H ARG A 723 -19.234 -1.676 1.311 1.00 0.00 H new ATOM 0 HA ARG A 723 -17.613 -3.273 2.556 1.00 0.00 H new ATOM 0 HB2 ARG A 723 -19.830 -2.348 3.380 1.00 0.00 H new ATOM 0 HB3 ARG A 723 -20.635 -3.710 2.628 1.00 0.00 H new ATOM 0 HG2 ARG A 723 -20.427 -4.517 4.774 1.00 0.00 H new ATOM 0 HG3 ARG A 723 -18.941 -5.137 4.083 1.00 0.00 H new ATOM 0 HD2 ARG A 723 -17.693 -3.189 4.968 1.00 0.00 H new ATOM 0 HD3 ARG A 723 -19.176 -2.517 5.618 1.00 0.00 H new ATOM 0 HE ARG A 723 -19.028 -5.076 6.731 1.00 0.00 H new ATOM 0 HH11 ARG A 723 -16.978 -2.201 6.628 1.00 0.00 H new ATOM 0 HH12 ARG A 723 -16.250 -2.523 8.205 1.00 0.00 H new ATOM 0 HH21 ARG A 723 -18.090 -5.479 8.755 1.00 0.00 H new ATOM 0 HH22 ARG A 723 -16.877 -4.371 9.404 1.00 0.00 H new ATOM 142 N ASP A 724 -19.459 -5.354 0.764 1.00 0.00 N ATOM 143 CA ASP A 724 -19.454 -6.709 0.225 1.00 0.00 C ATOM 144 C ASP A 724 -18.128 -7.000 -0.466 1.00 0.00 C ATOM 145 O ASP A 724 -17.612 -6.186 -1.229 1.00 0.00 O ATOM 146 CB ASP A 724 -20.625 -6.922 -0.726 1.00 0.00 C ATOM 147 CG ASP A 724 -20.481 -8.166 -1.575 1.00 0.00 C ATOM 148 OD1 ASP A 724 -20.748 -9.273 -1.061 1.00 0.00 O ATOM 149 OD2 ASP A 724 -20.117 -8.033 -2.757 1.00 0.00 O ATOM 0 H ASP A 724 -20.250 -4.779 0.473 1.00 0.00 H new ATOM 0 HA ASP A 724 -19.569 -7.409 1.053 1.00 0.00 H new ATOM 0 HB2 ASP A 724 -21.547 -6.988 -0.148 1.00 0.00 H new ATOM 0 HB3 ASP A 724 -20.719 -6.053 -1.378 1.00 0.00 H new ATOM 154 N PRO A 725 -17.575 -8.186 -0.200 1.00 0.00 N ATOM 155 CA PRO A 725 -16.289 -8.620 -0.740 1.00 0.00 C ATOM 156 C PRO A 725 -16.225 -8.593 -2.264 1.00 0.00 C ATOM 157 O PRO A 725 -15.138 -8.594 -2.841 1.00 0.00 O ATOM 158 CB PRO A 725 -16.145 -10.046 -0.209 1.00 0.00 C ATOM 159 CG PRO A 725 -17.523 -10.460 0.128 1.00 0.00 C ATOM 160 CD PRO A 725 -18.185 -9.221 0.631 1.00 0.00 C ATOM 0 HA PRO A 725 -15.484 -7.951 -0.435 1.00 0.00 H new ATOM 0 HB2 PRO A 725 -15.705 -10.705 -0.957 1.00 0.00 H new ATOM 0 HB3 PRO A 725 -15.496 -10.079 0.666 1.00 0.00 H new ATOM 0 HG2 PRO A 725 -18.041 -10.858 -0.745 1.00 0.00 H new ATOM 0 HG3 PRO A 725 -17.526 -11.244 0.885 1.00 0.00 H new ATOM 0 HD2 PRO A 725 -19.267 -9.258 0.506 1.00 0.00 H new ATOM 0 HD3 PRO A 725 -17.992 -9.058 1.691 1.00 0.00 H new ATOM 168 N ASP A 726 -17.385 -8.574 -2.913 1.00 0.00 N ATOM 169 CA ASP A 726 -17.441 -8.531 -4.372 1.00 0.00 C ATOM 170 C ASP A 726 -17.525 -7.089 -4.845 1.00 0.00 C ATOM 171 O ASP A 726 -16.830 -6.703 -5.787 1.00 0.00 O ATOM 172 CB ASP A 726 -18.624 -9.341 -4.906 1.00 0.00 C ATOM 173 CG ASP A 726 -18.693 -9.333 -6.420 1.00 0.00 C ATOM 174 OD1 ASP A 726 -19.339 -8.423 -6.980 1.00 0.00 O ATOM 175 OD2 ASP A 726 -18.102 -10.238 -7.047 1.00 0.00 O ATOM 0 H ASP A 726 -18.296 -8.588 -2.455 1.00 0.00 H new ATOM 0 HA ASP A 726 -16.529 -8.981 -4.763 1.00 0.00 H new ATOM 0 HB2 ASP A 726 -18.545 -10.370 -4.554 1.00 0.00 H new ATOM 0 HB3 ASP A 726 -19.551 -8.936 -4.501 1.00 0.00 H new ATOM 180 N GLN A 727 -18.381 -6.289 -4.201 1.00 0.00 N ATOM 181 CA GLN A 727 -18.491 -4.888 -4.571 1.00 0.00 C ATOM 182 C GLN A 727 -17.114 -4.271 -4.484 1.00 0.00 C ATOM 183 O GLN A 727 -16.693 -3.540 -5.370 1.00 0.00 O ATOM 184 CB GLN A 727 -19.462 -4.130 -3.680 1.00 0.00 C ATOM 185 CG GLN A 727 -20.814 -4.782 -3.567 1.00 0.00 C ATOM 186 CD GLN A 727 -21.678 -4.165 -2.485 1.00 0.00 C ATOM 187 OE1 GLN A 727 -21.172 -3.671 -1.478 1.00 0.00 O ATOM 188 NE2 GLN A 727 -22.991 -4.190 -2.689 1.00 0.00 N ATOM 0 H GLN A 727 -18.992 -6.585 -3.439 1.00 0.00 H new ATOM 0 HA GLN A 727 -18.884 -4.823 -5.586 1.00 0.00 H new ATOM 0 HB2 GLN A 727 -19.029 -4.036 -2.684 1.00 0.00 H new ATOM 0 HB3 GLN A 727 -19.587 -3.120 -4.070 1.00 0.00 H new ATOM 0 HG2 GLN A 727 -21.330 -4.706 -4.524 1.00 0.00 H new ATOM 0 HG3 GLN A 727 -20.683 -5.844 -3.359 1.00 0.00 H new ATOM 0 HE21 GLN A 727 -23.367 -4.610 -3.539 1.00 0.00 H new ATOM 0 HE22 GLN A 727 -23.623 -3.789 -1.996 1.00 0.00 H new ATOM 197 N LEU A 728 -16.406 -4.624 -3.413 1.00 0.00 N ATOM 198 CA LEU A 728 -15.056 -4.143 -3.183 1.00 0.00 C ATOM 199 C LEU A 728 -14.111 -4.771 -4.175 1.00 0.00 C ATOM 200 O LEU A 728 -13.415 -4.077 -4.892 1.00 0.00 O ATOM 201 CB LEU A 728 -14.606 -4.474 -1.768 1.00 0.00 C ATOM 202 CG LEU A 728 -14.959 -3.422 -0.744 1.00 0.00 C ATOM 203 CD1 LEU A 728 -14.969 -4.004 0.657 1.00 0.00 C ATOM 204 CD2 LEU A 728 -13.961 -2.306 -0.865 1.00 0.00 C ATOM 0 H LEU A 728 -16.755 -5.249 -2.686 1.00 0.00 H new ATOM 0 HA LEU A 728 -15.048 -3.060 -3.310 1.00 0.00 H new ATOM 0 HB2 LEU A 728 -15.054 -5.421 -1.468 1.00 0.00 H new ATOM 0 HB3 LEU A 728 -13.526 -4.618 -1.767 1.00 0.00 H new ATOM 0 HG LEU A 728 -15.964 -3.042 -0.930 1.00 0.00 H new ATOM 0 HD11 LEU A 728 -15.226 -3.224 1.373 1.00 0.00 H new ATOM 0 HD12 LEU A 728 -15.706 -4.805 0.713 1.00 0.00 H new ATOM 0 HD13 LEU A 728 -13.982 -4.402 0.893 1.00 0.00 H new ATOM 0 HD21 LEU A 728 -14.192 -1.530 -0.135 1.00 0.00 H new ATOM 0 HD22 LEU A 728 -12.959 -2.692 -0.679 1.00 0.00 H new ATOM 0 HD23 LEU A 728 -14.006 -1.885 -1.869 1.00 0.00 H new ATOM 216 N TYR A 729 -14.118 -6.088 -4.241 1.00 0.00 N ATOM 217 CA TYR A 729 -13.247 -6.789 -5.159 1.00 0.00 C ATOM 218 C TYR A 729 -13.095 -6.012 -6.445 1.00 0.00 C ATOM 219 O TYR A 729 -12.003 -5.551 -6.754 1.00 0.00 O ATOM 220 CB TYR A 729 -13.835 -8.166 -5.447 1.00 0.00 C ATOM 221 CG TYR A 729 -13.613 -8.662 -6.848 1.00 0.00 C ATOM 222 CD1 TYR A 729 -12.340 -8.840 -7.288 1.00 0.00 C ATOM 223 CD2 TYR A 729 -14.661 -8.961 -7.709 1.00 0.00 C ATOM 224 CE1 TYR A 729 -12.063 -9.298 -8.547 1.00 0.00 C ATOM 225 CE2 TYR A 729 -14.409 -9.425 -8.989 1.00 0.00 C ATOM 226 CZ TYR A 729 -13.102 -9.594 -9.405 1.00 0.00 C ATOM 227 OH TYR A 729 -12.837 -10.057 -10.672 1.00 0.00 O ATOM 0 H TYR A 729 -14.714 -6.690 -3.673 1.00 0.00 H new ATOM 0 HA TYR A 729 -12.261 -6.896 -4.708 1.00 0.00 H new ATOM 0 HB2 TYR A 729 -13.404 -8.884 -4.749 1.00 0.00 H new ATOM 0 HB3 TYR A 729 -14.907 -8.137 -5.252 1.00 0.00 H new ATOM 0 HD1 TYR A 729 -11.520 -8.613 -6.622 1.00 0.00 H new ATOM 0 HD2 TYR A 729 -15.681 -8.831 -7.377 1.00 0.00 H new ATOM 0 HE1 TYR A 729 -11.039 -9.427 -8.867 1.00 0.00 H new ATOM 0 HE2 TYR A 729 -15.227 -9.653 -9.657 1.00 0.00 H new ATOM 0 HH TYR A 729 -13.680 -10.217 -11.145 1.00 0.00 H new ATOM 237 N SER A 730 -14.175 -5.802 -7.164 1.00 0.00 N ATOM 238 CA SER A 730 -14.050 -5.082 -8.405 1.00 0.00 C ATOM 239 C SER A 730 -14.083 -3.574 -8.227 1.00 0.00 C ATOM 240 O SER A 730 -13.675 -2.838 -9.127 1.00 0.00 O ATOM 241 CB SER A 730 -14.993 -5.579 -9.473 1.00 0.00 C ATOM 242 OG SER A 730 -15.607 -4.507 -10.168 1.00 0.00 O ATOM 0 H SER A 730 -15.117 -6.108 -6.921 1.00 0.00 H new ATOM 0 HA SER A 730 -13.049 -5.305 -8.775 1.00 0.00 H new ATOM 0 HB2 SER A 730 -14.447 -6.205 -10.178 1.00 0.00 H new ATOM 0 HB3 SER A 730 -15.760 -6.206 -9.018 1.00 0.00 H new ATOM 0 HG SER A 730 -16.210 -4.864 -10.853 1.00 0.00 H new ATOM 248 N THR A 731 -14.573 -3.097 -7.085 1.00 0.00 N ATOM 249 CA THR A 731 -14.553 -1.663 -6.843 1.00 0.00 C ATOM 250 C THR A 731 -13.108 -1.298 -6.848 1.00 0.00 C ATOM 251 O THR A 731 -12.620 -0.537 -7.680 1.00 0.00 O ATOM 252 CB THR A 731 -15.161 -1.279 -5.477 1.00 0.00 C ATOM 253 OG1 THR A 731 -16.570 -1.062 -5.612 1.00 0.00 O ATOM 254 CG2 THR A 731 -14.508 -0.026 -4.906 1.00 0.00 C ATOM 0 H THR A 731 -14.975 -3.663 -6.338 1.00 0.00 H new ATOM 0 HA THR A 731 -15.145 -1.144 -7.597 1.00 0.00 H new ATOM 0 HB THR A 731 -14.977 -2.104 -4.789 1.00 0.00 H new ATOM 0 HG1 THR A 731 -17.054 -1.855 -5.300 1.00 0.00 H new ATOM 0 HG21 THR A 731 -14.961 0.214 -3.944 1.00 0.00 H new ATOM 0 HG22 THR A 731 -13.441 -0.201 -4.771 1.00 0.00 H new ATOM 0 HG23 THR A 731 -14.655 0.806 -5.594 1.00 0.00 H new ATOM 262 N LEU A 732 -12.451 -1.927 -5.909 1.00 0.00 N ATOM 263 CA LEU A 732 -11.044 -1.826 -5.715 1.00 0.00 C ATOM 264 C LEU A 732 -10.324 -2.211 -6.997 1.00 0.00 C ATOM 265 O LEU A 732 -9.263 -1.680 -7.304 1.00 0.00 O ATOM 266 CB LEU A 732 -10.646 -2.769 -4.607 1.00 0.00 C ATOM 267 CG LEU A 732 -11.527 -2.797 -3.363 1.00 0.00 C ATOM 268 CD1 LEU A 732 -11.397 -4.134 -2.694 1.00 0.00 C ATOM 269 CD2 LEU A 732 -11.131 -1.711 -2.402 1.00 0.00 C ATOM 0 H LEU A 732 -12.907 -2.545 -5.237 1.00 0.00 H new ATOM 0 HA LEU A 732 -10.774 -0.803 -5.451 1.00 0.00 H new ATOM 0 HB2 LEU A 732 -10.611 -3.778 -5.019 1.00 0.00 H new ATOM 0 HB3 LEU A 732 -9.632 -2.516 -4.297 1.00 0.00 H new ATOM 0 HG LEU A 732 -12.561 -2.630 -3.663 1.00 0.00 H new ATOM 0 HD11 LEU A 732 -12.026 -4.158 -1.804 1.00 0.00 H new ATOM 0 HD12 LEU A 732 -11.713 -4.918 -3.383 1.00 0.00 H new ATOM 0 HD13 LEU A 732 -10.358 -4.299 -2.409 1.00 0.00 H new ATOM 0 HD21 LEU A 732 -11.774 -1.751 -1.523 1.00 0.00 H new ATOM 0 HD22 LEU A 732 -10.093 -1.853 -2.100 1.00 0.00 H new ATOM 0 HD23 LEU A 732 -11.238 -0.740 -2.886 1.00 0.00 H new ATOM 281 N LYS A 733 -10.908 -3.151 -7.746 1.00 0.00 N ATOM 282 CA LYS A 733 -10.313 -3.583 -9.007 1.00 0.00 C ATOM 283 C LYS A 733 -10.082 -2.367 -9.872 1.00 0.00 C ATOM 284 O LYS A 733 -9.161 -2.327 -10.674 1.00 0.00 O ATOM 285 CB LYS A 733 -11.213 -4.596 -9.727 1.00 0.00 C ATOM 286 CG LYS A 733 -10.664 -5.106 -11.047 1.00 0.00 C ATOM 287 CD LYS A 733 -11.096 -6.537 -11.321 1.00 0.00 C ATOM 288 CE LYS A 733 -12.552 -6.621 -11.720 1.00 0.00 C ATOM 289 NZ LYS A 733 -12.808 -7.735 -12.674 1.00 0.00 N ATOM 0 H LYS A 733 -11.780 -3.620 -7.503 1.00 0.00 H new ATOM 0 HA LYS A 733 -9.364 -4.080 -8.806 1.00 0.00 H new ATOM 0 HB2 LYS A 733 -11.381 -5.446 -9.066 1.00 0.00 H new ATOM 0 HB3 LYS A 733 -12.184 -4.135 -9.907 1.00 0.00 H new ATOM 0 HG2 LYS A 733 -11.006 -4.461 -11.857 1.00 0.00 H new ATOM 0 HG3 LYS A 733 -9.575 -5.051 -11.034 1.00 0.00 H new ATOM 0 HD2 LYS A 733 -10.478 -6.957 -12.114 1.00 0.00 H new ATOM 0 HD3 LYS A 733 -10.928 -7.143 -10.431 1.00 0.00 H new ATOM 0 HE2 LYS A 733 -13.164 -6.760 -10.829 1.00 0.00 H new ATOM 0 HE3 LYS A 733 -12.858 -5.678 -12.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 733 -13.711 -7.572 -13.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 733 -12.038 -7.778 -13.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 733 -12.855 -8.634 -12.153 1.00 0.00 H new ATOM 303 N SER A 734 -10.910 -1.357 -9.651 1.00 0.00 N ATOM 304 CA SER A 734 -10.816 -0.114 -10.401 1.00 0.00 C ATOM 305 C SER A 734 -9.834 0.815 -9.716 1.00 0.00 C ATOM 306 O SER A 734 -8.944 1.355 -10.370 1.00 0.00 O ATOM 307 CB SER A 734 -12.186 0.553 -10.529 1.00 0.00 C ATOM 308 OG SER A 734 -13.120 -0.316 -11.146 1.00 0.00 O ATOM 0 H SER A 734 -11.657 -1.374 -8.956 1.00 0.00 H new ATOM 0 HA SER A 734 -10.460 -0.336 -11.407 1.00 0.00 H new ATOM 0 HB2 SER A 734 -12.548 0.840 -9.542 1.00 0.00 H new ATOM 0 HB3 SER A 734 -12.095 1.469 -11.113 1.00 0.00 H new ATOM 0 HG SER A 734 -13.297 -1.078 -10.556 1.00 0.00 H new ATOM 314 N ILE A 735 -9.999 1.020 -8.401 1.00 0.00 N ATOM 315 CA ILE A 735 -9.064 1.859 -7.681 1.00 0.00 C ATOM 316 C ILE A 735 -7.677 1.367 -8.014 1.00 0.00 C ATOM 317 O ILE A 735 -6.914 2.063 -8.656 1.00 0.00 O ATOM 318 CB ILE A 735 -9.286 1.852 -6.158 1.00 0.00 C ATOM 319 CG1 ILE A 735 -10.667 2.406 -5.872 1.00 0.00 C ATOM 320 CG2 ILE A 735 -8.232 2.720 -5.461 1.00 0.00 C ATOM 321 CD1 ILE A 735 -11.745 1.383 -5.898 1.00 0.00 C ATOM 0 H ILE A 735 -10.752 0.624 -7.838 1.00 0.00 H new ATOM 0 HA ILE A 735 -9.211 2.894 -7.990 1.00 0.00 H new ATOM 0 HB ILE A 735 -9.199 0.833 -5.781 1.00 0.00 H new ATOM 0 HG12 ILE A 735 -10.659 2.886 -4.894 1.00 0.00 H new ATOM 0 HG13 ILE A 735 -10.896 3.179 -6.605 1.00 0.00 H new ATOM 0 HG21 ILE A 735 -8.402 2.705 -4.384 1.00 0.00 H new ATOM 0 HG22 ILE A 735 -7.238 2.329 -5.677 1.00 0.00 H new ATOM 0 HG23 ILE A 735 -8.305 3.745 -5.826 1.00 0.00 H new ATOM 0 HD11 ILE A 735 -12.703 1.858 -5.684 1.00 0.00 H new ATOM 0 HD12 ILE A 735 -11.782 0.919 -6.883 1.00 0.00 H new ATOM 0 HD13 ILE A 735 -11.542 0.621 -5.145 1.00 0.00 H new ATOM 333 N LEU A 736 -7.397 0.127 -7.633 1.00 0.00 N ATOM 334 CA LEU A 736 -6.119 -0.498 -7.929 1.00 0.00 C ATOM 335 C LEU A 736 -5.710 -0.192 -9.352 1.00 0.00 C ATOM 336 O LEU A 736 -4.668 0.402 -9.600 1.00 0.00 O ATOM 337 CB LEU A 736 -6.221 -2.012 -7.760 1.00 0.00 C ATOM 338 CG LEU A 736 -5.169 -2.615 -6.859 1.00 0.00 C ATOM 339 CD1 LEU A 736 -5.414 -4.082 -6.768 1.00 0.00 C ATOM 340 CD2 LEU A 736 -3.777 -2.293 -7.342 1.00 0.00 C ATOM 0 H LEU A 736 -8.044 -0.467 -7.115 1.00 0.00 H new ATOM 0 HA LEU A 736 -5.374 -0.102 -7.238 1.00 0.00 H new ATOM 0 HB2 LEU A 736 -7.206 -2.255 -7.360 1.00 0.00 H new ATOM 0 HB3 LEU A 736 -6.151 -2.480 -8.742 1.00 0.00 H new ATOM 0 HG LEU A 736 -5.241 -2.182 -5.862 1.00 0.00 H new ATOM 0 HD11 LEU A 736 -4.664 -4.537 -6.121 1.00 0.00 H new ATOM 0 HD12 LEU A 736 -6.406 -4.260 -6.354 1.00 0.00 H new ATOM 0 HD13 LEU A 736 -5.351 -4.524 -7.762 1.00 0.00 H new ATOM 0 HD21 LEU A 736 -3.046 -2.743 -6.670 1.00 0.00 H new ATOM 0 HD22 LEU A 736 -3.639 -2.691 -8.347 1.00 0.00 H new ATOM 0 HD23 LEU A 736 -3.638 -1.212 -7.358 1.00 0.00 H new ATOM 352 N GLN A 737 -6.556 -0.612 -10.275 1.00 0.00 N ATOM 353 CA GLN A 737 -6.335 -0.393 -11.699 1.00 0.00 C ATOM 354 C GLN A 737 -5.914 1.047 -11.979 1.00 0.00 C ATOM 355 O GLN A 737 -5.132 1.318 -12.892 1.00 0.00 O ATOM 356 CB GLN A 737 -7.626 -0.730 -12.456 1.00 0.00 C ATOM 357 CG GLN A 737 -7.678 -2.149 -12.982 1.00 0.00 C ATOM 358 CD GLN A 737 -8.915 -2.428 -13.814 1.00 0.00 C ATOM 359 OE1 GLN A 737 -10.014 -1.754 -13.491 1.00 0.00 O flip ATOM 360 NE2 GLN A 737 -8.885 -3.243 -14.735 1.00 0.00 N flip ATOM 0 H GLN A 737 -7.417 -1.115 -10.062 1.00 0.00 H new ATOM 0 HA GLN A 737 -5.526 -1.040 -12.037 1.00 0.00 H new ATOM 0 HB2 GLN A 737 -8.476 -0.567 -11.794 1.00 0.00 H new ATOM 0 HB3 GLN A 737 -7.736 -0.039 -13.292 1.00 0.00 H new ATOM 0 HG2 GLN A 737 -6.791 -2.340 -13.585 1.00 0.00 H new ATOM 0 HG3 GLN A 737 -7.648 -2.843 -12.142 1.00 0.00 H new ATOM 0 HE21 GLN A 737 -8.020 -3.739 -14.949 1.00 0.00 H new ATOM 0 HE22 GLN A 737 -9.725 -3.423 -15.284 1.00 0.00 H new ATOM 369 N GLN A 738 -6.419 1.958 -11.165 1.00 0.00 N ATOM 370 CA GLN A 738 -6.138 3.381 -11.308 1.00 0.00 C ATOM 371 C GLN A 738 -4.836 3.790 -10.610 1.00 0.00 C ATOM 372 O GLN A 738 -3.939 4.352 -11.239 1.00 0.00 O ATOM 373 CB GLN A 738 -7.313 4.180 -10.750 1.00 0.00 C ATOM 374 CG GLN A 738 -8.554 4.078 -11.619 1.00 0.00 C ATOM 375 CD GLN A 738 -9.807 4.587 -10.935 1.00 0.00 C ATOM 376 OE1 GLN A 738 -9.889 4.387 -9.625 1.00 0.00 O flip ATOM 377 NE2 GLN A 738 -10.697 5.143 -11.578 1.00 0.00 N flip ATOM 0 H GLN A 738 -7.036 1.734 -10.385 1.00 0.00 H new ATOM 0 HA GLN A 738 -6.007 3.596 -12.369 1.00 0.00 H new ATOM 0 HB2 GLN A 738 -7.546 3.823 -9.747 1.00 0.00 H new ATOM 0 HB3 GLN A 738 -7.024 5.227 -10.657 1.00 0.00 H new ATOM 0 HG2 GLN A 738 -8.394 4.644 -12.537 1.00 0.00 H new ATOM 0 HG3 GLN A 738 -8.703 3.037 -11.908 1.00 0.00 H new ATOM 0 HE21 GLN A 738 -10.592 5.276 -12.584 1.00 0.00 H new ATOM 0 HE22 GLN A 738 -11.539 5.471 -11.105 1.00 0.00 H new ATOM 386 N VAL A 739 -4.745 3.509 -9.312 1.00 0.00 N ATOM 387 CA VAL A 739 -3.577 3.834 -8.525 1.00 0.00 C ATOM 388 C VAL A 739 -2.360 3.190 -9.153 1.00 0.00 C ATOM 389 O VAL A 739 -1.247 3.675 -9.025 1.00 0.00 O ATOM 390 CB VAL A 739 -3.722 3.308 -7.073 1.00 0.00 C ATOM 391 CG1 VAL A 739 -5.157 3.011 -6.709 1.00 0.00 C ATOM 392 CG2 VAL A 739 -2.852 2.099 -6.876 1.00 0.00 C ATOM 0 H VAL A 739 -5.486 3.048 -8.783 1.00 0.00 H new ATOM 0 HA VAL A 739 -3.470 4.918 -8.499 1.00 0.00 H new ATOM 0 HB VAL A 739 -3.390 4.099 -6.400 1.00 0.00 H new ATOM 0 HG11 VAL A 739 -5.204 2.646 -5.683 1.00 0.00 H new ATOM 0 HG12 VAL A 739 -5.751 3.921 -6.798 1.00 0.00 H new ATOM 0 HG13 VAL A 739 -5.554 2.252 -7.383 1.00 0.00 H new ATOM 0 HG21 VAL A 739 -2.960 1.736 -5.854 1.00 0.00 H new ATOM 0 HG22 VAL A 739 -3.153 1.317 -7.573 1.00 0.00 H new ATOM 0 HG23 VAL A 739 -1.811 2.366 -7.058 1.00 0.00 H new ATOM 402 N LYS A 740 -2.604 2.074 -9.816 1.00 0.00 N ATOM 403 CA LYS A 740 -1.565 1.313 -10.473 1.00 0.00 C ATOM 404 C LYS A 740 -1.262 1.923 -11.823 1.00 0.00 C ATOM 405 O LYS A 740 -0.113 1.966 -12.250 1.00 0.00 O ATOM 406 CB LYS A 740 -2.016 -0.134 -10.604 1.00 0.00 C ATOM 407 CG LYS A 740 -1.236 -0.962 -11.612 1.00 0.00 C ATOM 408 CD LYS A 740 -2.174 -1.804 -12.467 1.00 0.00 C ATOM 409 CE LYS A 740 -2.694 -3.020 -11.713 1.00 0.00 C ATOM 410 NZ LYS A 740 -3.689 -2.651 -10.670 1.00 0.00 N ATOM 0 H LYS A 740 -3.536 1.670 -9.912 1.00 0.00 H new ATOM 0 HA LYS A 740 -0.649 1.337 -9.883 1.00 0.00 H new ATOM 0 HB2 LYS A 740 -1.940 -0.612 -9.627 1.00 0.00 H new ATOM 0 HB3 LYS A 740 -3.069 -0.146 -10.884 1.00 0.00 H new ATOM 0 HG2 LYS A 740 -0.647 -0.304 -12.251 1.00 0.00 H new ATOM 0 HG3 LYS A 740 -0.533 -1.611 -11.089 1.00 0.00 H new ATOM 0 HD2 LYS A 740 -3.015 -1.192 -12.793 1.00 0.00 H new ATOM 0 HD3 LYS A 740 -1.651 -2.131 -13.366 1.00 0.00 H new ATOM 0 HE2 LYS A 740 -3.150 -3.715 -12.418 1.00 0.00 H new ATOM 0 HE3 LYS A 740 -1.858 -3.541 -11.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 740 -4.257 -3.486 -10.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 740 -3.193 -2.305 -9.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 740 -4.313 -1.904 -11.035 1.00 0.00 H new ATOM 424 N SER A 741 -2.302 2.383 -12.500 1.00 0.00 N ATOM 425 CA SER A 741 -2.118 3.029 -13.779 1.00 0.00 C ATOM 426 C SER A 741 -1.522 4.404 -13.546 1.00 0.00 C ATOM 427 O SER A 741 -1.138 5.107 -14.481 1.00 0.00 O ATOM 428 CB SER A 741 -3.442 3.141 -14.525 1.00 0.00 C ATOM 429 OG SER A 741 -3.244 3.577 -15.859 1.00 0.00 O ATOM 0 H SER A 741 -3.270 2.320 -12.185 1.00 0.00 H new ATOM 0 HA SER A 741 -1.443 2.433 -14.393 1.00 0.00 H new ATOM 0 HB2 SER A 741 -3.944 2.174 -14.527 1.00 0.00 H new ATOM 0 HB3 SER A 741 -4.097 3.840 -14.005 1.00 0.00 H new ATOM 0 HG SER A 741 -2.525 4.243 -15.882 1.00 0.00 H new ATOM 435 N HIS A 742 -1.457 4.773 -12.269 1.00 0.00 N ATOM 436 CA HIS A 742 -0.909 6.052 -11.861 1.00 0.00 C ATOM 437 C HIS A 742 0.554 6.164 -12.286 1.00 0.00 C ATOM 438 O HIS A 742 1.309 5.198 -12.237 1.00 0.00 O ATOM 439 CB HIS A 742 -1.047 6.222 -10.338 1.00 0.00 C ATOM 440 CG HIS A 742 -0.668 7.581 -9.837 1.00 0.00 C ATOM 441 ND1 HIS A 742 0.222 8.414 -10.478 1.00 0.00 N ATOM 442 CD2 HIS A 742 -1.071 8.249 -8.742 1.00 0.00 C ATOM 443 CE1 HIS A 742 0.352 9.532 -9.798 1.00 0.00 C ATOM 444 NE2 HIS A 742 -0.425 9.461 -8.736 1.00 0.00 N ATOM 0 H HIS A 742 -1.783 4.193 -11.496 1.00 0.00 H new ATOM 0 HA HIS A 742 -1.468 6.849 -12.352 1.00 0.00 H new ATOM 0 HB2 HIS A 742 -2.079 6.016 -10.052 1.00 0.00 H new ATOM 0 HB3 HIS A 742 -0.424 5.477 -9.842 1.00 0.00 H new ATOM 0 HD2 HIS A 742 -1.774 7.897 -8.002 1.00 0.00 H new ATOM 0 HE1 HIS A 742 0.986 10.365 -10.064 1.00 0.00 H new ATOM 0 HE2 HIS A 742 -0.529 10.186 -8.027 1.00 0.00 H new ATOM 453 N GLN A 743 0.926 7.351 -12.729 1.00 0.00 N ATOM 454 CA GLN A 743 2.278 7.646 -13.165 1.00 0.00 C ATOM 455 C GLN A 743 3.297 7.412 -12.055 1.00 0.00 C ATOM 456 O GLN A 743 4.477 7.199 -12.319 1.00 0.00 O ATOM 457 CB GLN A 743 2.319 9.092 -13.605 1.00 0.00 C ATOM 458 CG GLN A 743 3.575 9.450 -14.363 1.00 0.00 C ATOM 459 CD GLN A 743 3.737 10.945 -14.556 1.00 0.00 C ATOM 460 OE1 GLN A 743 2.755 11.682 -14.653 1.00 0.00 O ATOM 461 NE2 GLN A 743 4.983 11.403 -14.611 1.00 0.00 N ATOM 0 H GLN A 743 0.291 8.146 -12.797 1.00 0.00 H new ATOM 0 HA GLN A 743 2.541 6.979 -13.986 1.00 0.00 H new ATOM 0 HB2 GLN A 743 1.452 9.298 -14.233 1.00 0.00 H new ATOM 0 HB3 GLN A 743 2.237 9.734 -12.728 1.00 0.00 H new ATOM 0 HG2 GLN A 743 4.441 9.061 -13.827 1.00 0.00 H new ATOM 0 HG3 GLN A 743 3.558 8.962 -15.337 1.00 0.00 H new ATOM 0 HE21 GLN A 743 5.768 10.757 -14.526 1.00 0.00 H new ATOM 0 HE22 GLN A 743 5.155 12.400 -14.738 1.00 0.00 H new ATOM 470 N SER A 744 2.830 7.478 -10.820 1.00 0.00 N ATOM 471 CA SER A 744 3.683 7.266 -9.648 1.00 0.00 C ATOM 472 C SER A 744 3.596 5.833 -9.182 1.00 0.00 C ATOM 473 O SER A 744 4.072 5.480 -8.104 1.00 0.00 O ATOM 474 CB SER A 744 3.262 8.196 -8.508 1.00 0.00 C ATOM 475 OG SER A 744 3.906 9.453 -8.605 1.00 0.00 O ATOM 0 H SER A 744 1.856 7.678 -10.595 1.00 0.00 H new ATOM 0 HA SER A 744 4.711 7.487 -9.933 1.00 0.00 H new ATOM 0 HB2 SER A 744 2.181 8.336 -8.530 1.00 0.00 H new ATOM 0 HB3 SER A 744 3.504 7.734 -7.551 1.00 0.00 H new ATOM 0 HG SER A 744 4.868 9.319 -8.734 1.00 0.00 H new ATOM 481 N ALA A 745 2.976 5.018 -9.996 1.00 0.00 N ATOM 482 CA ALA A 745 2.781 3.628 -9.665 1.00 0.00 C ATOM 483 C ALA A 745 3.748 2.685 -10.365 1.00 0.00 C ATOM 484 O ALA A 745 3.675 1.485 -10.152 1.00 0.00 O ATOM 485 CB ALA A 745 1.358 3.255 -10.017 1.00 0.00 C ATOM 0 H ALA A 745 2.594 5.295 -10.900 1.00 0.00 H new ATOM 0 HA ALA A 745 2.977 3.515 -8.599 1.00 0.00 H new ATOM 0 HB1 ALA A 745 1.186 2.206 -9.775 1.00 0.00 H new ATOM 0 HB2 ALA A 745 0.667 3.877 -9.447 1.00 0.00 H new ATOM 0 HB3 ALA A 745 1.193 3.413 -11.083 1.00 0.00 H new ATOM 491 N TRP A 746 4.656 3.198 -11.180 1.00 0.00 N ATOM 492 CA TRP A 746 5.566 2.322 -11.903 1.00 0.00 C ATOM 493 C TRP A 746 6.540 1.564 -10.985 1.00 0.00 C ATOM 494 O TRP A 746 6.926 0.442 -11.316 1.00 0.00 O ATOM 495 CB TRP A 746 6.318 3.093 -12.983 1.00 0.00 C ATOM 496 CG TRP A 746 7.240 4.131 -12.446 1.00 0.00 C ATOM 497 CD1 TRP A 746 6.927 5.411 -12.110 1.00 0.00 C ATOM 498 CD2 TRP A 746 8.629 3.965 -12.173 1.00 0.00 C ATOM 499 NE1 TRP A 746 8.050 6.065 -11.659 1.00 0.00 N ATOM 500 CE2 TRP A 746 9.109 5.191 -11.688 1.00 0.00 C ATOM 501 CE3 TRP A 746 9.509 2.894 -12.300 1.00 0.00 C ATOM 502 CZ2 TRP A 746 10.442 5.373 -11.330 1.00 0.00 C ATOM 503 CZ3 TRP A 746 10.832 3.073 -11.942 1.00 0.00 C ATOM 504 CH2 TRP A 746 11.288 4.305 -11.462 1.00 0.00 C ATOM 0 H TRP A 746 4.782 4.195 -11.356 1.00 0.00 H new ATOM 0 HA TRP A 746 4.947 1.562 -12.380 1.00 0.00 H new ATOM 0 HB2 TRP A 746 6.890 2.389 -13.587 1.00 0.00 H new ATOM 0 HB3 TRP A 746 5.596 3.569 -13.646 1.00 0.00 H new ATOM 0 HD1 TRP A 746 5.943 5.849 -12.186 1.00 0.00 H new ATOM 0 HE1 TRP A 746 8.090 7.037 -11.354 1.00 0.00 H new ATOM 0 HE3 TRP A 746 9.164 1.940 -12.672 1.00 0.00 H new ATOM 0 HZ2 TRP A 746 10.796 6.324 -10.961 1.00 0.00 H new ATOM 0 HZ3 TRP A 746 11.524 2.249 -12.034 1.00 0.00 H new ATOM 0 HH2 TRP A 746 12.327 4.416 -11.190 1.00 0.00 H new ATOM 515 N PRO A 747 6.969 2.126 -9.827 1.00 0.00 N ATOM 516 CA PRO A 747 7.871 1.417 -8.924 1.00 0.00 C ATOM 517 C PRO A 747 7.110 0.367 -8.144 1.00 0.00 C ATOM 518 O PRO A 747 7.694 -0.491 -7.481 1.00 0.00 O ATOM 519 CB PRO A 747 8.389 2.510 -7.971 1.00 0.00 C ATOM 520 CG PRO A 747 7.823 3.794 -8.457 1.00 0.00 C ATOM 521 CD PRO A 747 6.616 3.445 -9.281 1.00 0.00 C ATOM 0 HA PRO A 747 8.674 0.903 -9.452 1.00 0.00 H new ATOM 0 HB2 PRO A 747 8.076 2.311 -6.946 1.00 0.00 H new ATOM 0 HB3 PRO A 747 9.479 2.541 -7.972 1.00 0.00 H new ATOM 0 HG2 PRO A 747 7.549 4.438 -7.621 1.00 0.00 H new ATOM 0 HG3 PRO A 747 8.555 4.339 -9.053 1.00 0.00 H new ATOM 0 HD2 PRO A 747 5.710 3.404 -8.676 1.00 0.00 H new ATOM 0 HD3 PRO A 747 6.439 4.176 -10.070 1.00 0.00 H new ATOM 529 N PHE A 748 5.785 0.454 -8.239 1.00 0.00 N ATOM 530 CA PHE A 748 4.897 -0.443 -7.520 1.00 0.00 C ATOM 531 C PHE A 748 4.092 -1.313 -8.488 1.00 0.00 C ATOM 532 O PHE A 748 3.542 -2.340 -8.105 1.00 0.00 O ATOM 533 CB PHE A 748 3.947 0.373 -6.632 1.00 0.00 C ATOM 534 CG PHE A 748 4.512 1.672 -6.115 1.00 0.00 C ATOM 535 CD1 PHE A 748 5.857 1.826 -5.909 1.00 0.00 C ATOM 536 CD2 PHE A 748 3.691 2.737 -5.835 1.00 0.00 C ATOM 537 CE1 PHE A 748 6.380 3.008 -5.436 1.00 0.00 C ATOM 538 CE2 PHE A 748 4.222 3.919 -5.354 1.00 0.00 C ATOM 539 CZ PHE A 748 5.559 4.047 -5.159 1.00 0.00 C ATOM 0 H PHE A 748 5.304 1.145 -8.814 1.00 0.00 H new ATOM 0 HA PHE A 748 5.502 -1.102 -6.897 1.00 0.00 H new ATOM 0 HB2 PHE A 748 3.041 0.589 -7.198 1.00 0.00 H new ATOM 0 HB3 PHE A 748 3.653 -0.241 -5.781 1.00 0.00 H new ATOM 0 HD1 PHE A 748 6.522 1.002 -6.122 1.00 0.00 H new ATOM 0 HD2 PHE A 748 2.626 2.650 -5.991 1.00 0.00 H new ATOM 0 HE1 PHE A 748 7.445 3.106 -5.286 1.00 0.00 H new ATOM 0 HE2 PHE A 748 3.567 4.748 -5.131 1.00 0.00 H new ATOM 0 HZ PHE A 748 5.966 4.975 -4.784 1.00 0.00 H new ATOM 549 N MET A 749 4.037 -0.886 -9.748 1.00 0.00 N ATOM 550 CA MET A 749 3.272 -1.585 -10.786 1.00 0.00 C ATOM 551 C MET A 749 3.523 -3.082 -10.781 1.00 0.00 C ATOM 552 O MET A 749 2.638 -3.875 -11.098 1.00 0.00 O ATOM 553 CB MET A 749 3.602 -1.022 -12.157 1.00 0.00 C ATOM 554 CG MET A 749 2.635 0.054 -12.542 1.00 0.00 C ATOM 555 SD MET A 749 3.168 1.054 -13.930 1.00 0.00 S ATOM 556 CE MET A 749 2.456 2.583 -13.368 1.00 0.00 C ATOM 0 H MET A 749 4.518 -0.050 -10.080 1.00 0.00 H new ATOM 0 HA MET A 749 2.218 -1.423 -10.562 1.00 0.00 H new ATOM 0 HB2 MET A 749 4.616 -0.621 -12.155 1.00 0.00 H new ATOM 0 HB3 MET A 749 3.576 -1.821 -12.898 1.00 0.00 H new ATOM 0 HG2 MET A 749 1.676 -0.404 -12.785 1.00 0.00 H new ATOM 0 HG3 MET A 749 2.469 0.703 -11.682 1.00 0.00 H new ATOM 0 HE1 MET A 749 1.613 2.848 -14.006 1.00 0.00 H new ATOM 0 HE2 MET A 749 2.111 2.468 -12.340 1.00 0.00 H new ATOM 0 HE3 MET A 749 3.207 3.372 -13.413 1.00 0.00 H new ATOM 566 N GLU A 750 4.737 -3.454 -10.425 1.00 0.00 N ATOM 567 CA GLU A 750 5.130 -4.852 -10.390 1.00 0.00 C ATOM 568 C GLU A 750 6.074 -5.123 -9.228 1.00 0.00 C ATOM 569 O GLU A 750 6.891 -4.274 -8.868 1.00 0.00 O ATOM 570 CB GLU A 750 5.800 -5.234 -11.707 1.00 0.00 C ATOM 571 CG GLU A 750 4.900 -6.016 -12.647 1.00 0.00 C ATOM 572 CD GLU A 750 5.625 -6.482 -13.894 1.00 0.00 C ATOM 573 OE1 GLU A 750 5.754 -5.678 -14.841 1.00 0.00 O ATOM 574 OE2 GLU A 750 6.063 -7.652 -13.924 1.00 0.00 O ATOM 0 H GLU A 750 5.474 -2.803 -10.154 1.00 0.00 H new ATOM 0 HA GLU A 750 4.235 -5.458 -10.250 1.00 0.00 H new ATOM 0 HB2 GLU A 750 6.135 -4.327 -12.210 1.00 0.00 H new ATOM 0 HB3 GLU A 750 6.689 -5.827 -11.493 1.00 0.00 H new ATOM 0 HG2 GLU A 750 4.496 -6.881 -12.121 1.00 0.00 H new ATOM 0 HG3 GLU A 750 4.053 -5.393 -12.935 1.00 0.00 H new ATOM 581 N PRO A 751 5.966 -6.316 -8.623 1.00 0.00 N ATOM 582 CA PRO A 751 6.808 -6.717 -7.507 1.00 0.00 C ATOM 583 C PRO A 751 8.277 -6.553 -7.831 1.00 0.00 C ATOM 584 O PRO A 751 8.713 -6.884 -8.934 1.00 0.00 O ATOM 585 CB PRO A 751 6.476 -8.187 -7.290 1.00 0.00 C ATOM 586 CG PRO A 751 5.727 -8.590 -8.497 1.00 0.00 C ATOM 587 CD PRO A 751 5.026 -7.368 -8.978 1.00 0.00 C ATOM 0 HA PRO A 751 6.625 -6.105 -6.624 1.00 0.00 H new ATOM 0 HB2 PRO A 751 7.381 -8.783 -7.169 1.00 0.00 H new ATOM 0 HB3 PRO A 751 5.879 -8.328 -6.389 1.00 0.00 H new ATOM 0 HG2 PRO A 751 6.400 -8.979 -9.261 1.00 0.00 H new ATOM 0 HG3 PRO A 751 5.015 -9.382 -8.267 1.00 0.00 H new ATOM 0 HD2 PRO A 751 4.839 -7.402 -10.051 1.00 0.00 H new ATOM 0 HD3 PRO A 751 4.061 -7.233 -8.490 1.00 0.00 H new ATOM 595 N VAL A 752 9.045 -6.048 -6.881 1.00 0.00 N ATOM 596 CA VAL A 752 10.452 -5.850 -7.100 1.00 0.00 C ATOM 597 C VAL A 752 11.180 -7.184 -7.188 1.00 0.00 C ATOM 598 O VAL A 752 10.692 -8.209 -6.710 1.00 0.00 O ATOM 599 CB VAL A 752 11.035 -4.930 -6.012 1.00 0.00 C ATOM 600 CG1 VAL A 752 10.268 -5.008 -4.718 1.00 0.00 C ATOM 601 CG2 VAL A 752 12.481 -5.191 -5.718 1.00 0.00 C ATOM 0 H VAL A 752 8.712 -5.771 -5.957 1.00 0.00 H new ATOM 0 HA VAL A 752 10.598 -5.352 -8.058 1.00 0.00 H new ATOM 0 HB VAL A 752 10.941 -3.930 -6.435 1.00 0.00 H new ATOM 0 HG11 VAL A 752 10.721 -4.340 -3.986 1.00 0.00 H new ATOM 0 HG12 VAL A 752 9.234 -4.710 -4.890 1.00 0.00 H new ATOM 0 HG13 VAL A 752 10.293 -6.030 -4.341 1.00 0.00 H new ATOM 0 HG21 VAL A 752 12.824 -4.506 -4.942 1.00 0.00 H new ATOM 0 HG22 VAL A 752 12.603 -6.218 -5.375 1.00 0.00 H new ATOM 0 HG23 VAL A 752 13.070 -5.038 -6.623 1.00 0.00 H new ATOM 611 N LYS A 753 12.354 -7.155 -7.803 1.00 0.00 N ATOM 612 CA LYS A 753 13.157 -8.362 -8.007 1.00 0.00 C ATOM 613 C LYS A 753 13.768 -8.818 -6.707 1.00 0.00 C ATOM 614 O LYS A 753 14.638 -9.691 -6.694 1.00 0.00 O ATOM 615 CB LYS A 753 14.290 -8.095 -9.000 1.00 0.00 C ATOM 616 CG LYS A 753 13.812 -7.611 -10.360 1.00 0.00 C ATOM 617 CD LYS A 753 14.093 -8.633 -11.452 1.00 0.00 C ATOM 618 CE LYS A 753 15.586 -8.807 -11.686 1.00 0.00 C ATOM 619 NZ LYS A 753 15.869 -9.811 -12.750 1.00 0.00 N ATOM 0 H LYS A 753 12.778 -6.304 -8.173 1.00 0.00 H new ATOM 0 HA LYS A 753 12.495 -9.134 -8.398 1.00 0.00 H new ATOM 0 HB2 LYS A 753 14.964 -7.351 -8.576 1.00 0.00 H new ATOM 0 HB3 LYS A 753 14.868 -9.010 -9.133 1.00 0.00 H new ATOM 0 HG2 LYS A 753 12.742 -7.408 -10.318 1.00 0.00 H new ATOM 0 HG3 LYS A 753 14.306 -6.671 -10.606 1.00 0.00 H new ATOM 0 HD2 LYS A 753 13.653 -9.591 -11.176 1.00 0.00 H new ATOM 0 HD3 LYS A 753 13.613 -8.317 -12.379 1.00 0.00 H new ATOM 0 HE2 LYS A 753 16.024 -7.849 -11.966 1.00 0.00 H new ATOM 0 HE3 LYS A 753 16.065 -9.117 -10.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 753 16.897 -9.900 -12.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 753 15.474 -10.732 -12.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 753 15.434 -9.503 -13.643 1.00 0.00 H new ATOM 633 N ARG A 754 13.317 -8.220 -5.615 1.00 0.00 N ATOM 634 CA ARG A 754 13.867 -8.520 -4.314 1.00 0.00 C ATOM 635 C ARG A 754 15.322 -8.100 -4.308 1.00 0.00 C ATOM 636 O ARG A 754 16.015 -8.226 -3.298 1.00 0.00 O ATOM 637 CB ARG A 754 13.758 -10.013 -4.001 1.00 0.00 C ATOM 638 CG ARG A 754 14.033 -10.352 -2.547 1.00 0.00 C ATOM 639 CD ARG A 754 13.766 -11.819 -2.258 1.00 0.00 C ATOM 640 NE ARG A 754 14.047 -12.163 -0.867 1.00 0.00 N ATOM 641 CZ ARG A 754 14.060 -13.410 -0.405 1.00 0.00 C ATOM 642 NH1 ARG A 754 13.814 -14.427 -1.221 1.00 0.00 N ATOM 643 NH2 ARG A 754 14.320 -13.643 0.875 1.00 0.00 N ATOM 0 H ARG A 754 12.571 -7.524 -5.610 1.00 0.00 H new ATOM 0 HA ARG A 754 13.307 -7.979 -3.551 1.00 0.00 H new ATOM 0 HB2 ARG A 754 12.758 -10.358 -4.263 1.00 0.00 H new ATOM 0 HB3 ARG A 754 14.459 -10.560 -4.632 1.00 0.00 H new ATOM 0 HG2 ARG A 754 15.070 -10.115 -2.307 1.00 0.00 H new ATOM 0 HG3 ARG A 754 13.408 -9.733 -1.903 1.00 0.00 H new ATOM 0 HD2 ARG A 754 12.725 -12.050 -2.485 1.00 0.00 H new ATOM 0 HD3 ARG A 754 14.380 -12.435 -2.915 1.00 0.00 H new ATOM 0 HE ARG A 754 14.244 -11.405 -0.214 1.00 0.00 H new ATOM 0 HH11 ARG A 754 13.614 -14.254 -2.206 1.00 0.00 H new ATOM 0 HH12 ARG A 754 13.825 -15.382 -0.863 1.00 0.00 H new ATOM 0 HH21 ARG A 754 14.510 -12.865 1.507 1.00 0.00 H new ATOM 0 HH22 ARG A 754 14.329 -14.600 1.227 1.00 0.00 H new ATOM 657 N THR A 755 15.783 -7.589 -5.455 1.00 0.00 N ATOM 658 CA THR A 755 17.162 -7.188 -5.583 1.00 0.00 C ATOM 659 C THR A 755 17.351 -5.880 -6.352 1.00 0.00 C ATOM 660 O THR A 755 18.397 -5.247 -6.206 1.00 0.00 O ATOM 661 CB THR A 755 18.015 -8.289 -6.222 1.00 0.00 C ATOM 662 OG1 THR A 755 17.681 -8.436 -7.607 1.00 0.00 O ATOM 663 CG2 THR A 755 17.807 -9.610 -5.497 1.00 0.00 C ATOM 0 H THR A 755 15.217 -7.450 -6.292 1.00 0.00 H new ATOM 0 HA THR A 755 17.501 -7.015 -4.562 1.00 0.00 H new ATOM 0 HB THR A 755 19.064 -8.003 -6.139 1.00 0.00 H new ATOM 0 HG1 THR A 755 18.234 -9.141 -8.004 1.00 0.00 H new ATOM 0 HG21 THR A 755 18.420 -10.381 -5.963 1.00 0.00 H new ATOM 0 HG22 THR A 755 18.095 -9.500 -4.451 1.00 0.00 H new ATOM 0 HG23 THR A 755 16.757 -9.896 -5.556 1.00 0.00 H new ATOM 671 N GLU A 756 16.375 -5.452 -7.181 1.00 0.00 N ATOM 672 CA GLU A 756 16.539 -4.154 -7.846 1.00 0.00 C ATOM 673 C GLU A 756 16.645 -3.213 -6.700 1.00 0.00 C ATOM 674 O GLU A 756 17.220 -2.125 -6.742 1.00 0.00 O ATOM 675 CB GLU A 756 15.339 -3.718 -8.686 1.00 0.00 C ATOM 676 CG GLU A 756 14.257 -4.743 -8.775 1.00 0.00 C ATOM 677 CD GLU A 756 13.006 -4.226 -9.457 1.00 0.00 C ATOM 678 OE1 GLU A 756 12.153 -3.636 -8.763 1.00 0.00 O ATOM 679 OE2 GLU A 756 12.879 -4.414 -10.685 1.00 0.00 O ATOM 0 H GLU A 756 15.514 -5.956 -7.394 1.00 0.00 H new ATOM 0 HA GLU A 756 17.383 -4.189 -8.535 1.00 0.00 H new ATOM 0 HB2 GLU A 756 14.925 -2.803 -8.262 1.00 0.00 H new ATOM 0 HB3 GLU A 756 15.681 -3.477 -9.692 1.00 0.00 H new ATOM 0 HG2 GLU A 756 14.630 -5.610 -9.320 1.00 0.00 H new ATOM 0 HG3 GLU A 756 14.003 -5.083 -7.771 1.00 0.00 H new ATOM 686 N ALA A 757 16.026 -3.736 -5.669 1.00 0.00 N ATOM 687 CA ALA A 757 15.902 -3.167 -4.390 1.00 0.00 C ATOM 688 C ALA A 757 16.854 -3.862 -3.450 1.00 0.00 C ATOM 689 O ALA A 757 16.552 -4.899 -2.861 1.00 0.00 O ATOM 690 CB ALA A 757 14.504 -3.370 -4.008 1.00 0.00 C ATOM 0 H ALA A 757 15.566 -4.644 -5.730 1.00 0.00 H new ATOM 0 HA ALA A 757 16.151 -2.106 -4.363 1.00 0.00 H new ATOM 0 HB1 ALA A 757 14.333 -2.950 -3.017 1.00 0.00 H new ATOM 0 HB2 ALA A 757 13.854 -2.875 -4.729 1.00 0.00 H new ATOM 0 HB3 ALA A 757 14.282 -4.437 -3.993 1.00 0.00 H new ATOM 696 N PRO A 758 18.023 -3.278 -3.337 1.00 0.00 N ATOM 697 CA PRO A 758 19.109 -3.791 -2.518 1.00 0.00 C ATOM 698 C PRO A 758 18.723 -3.870 -1.057 1.00 0.00 C ATOM 699 O PRO A 758 18.545 -2.851 -0.387 1.00 0.00 O ATOM 700 CB PRO A 758 20.233 -2.778 -2.754 1.00 0.00 C ATOM 701 CG PRO A 758 19.535 -1.547 -3.237 1.00 0.00 C ATOM 702 CD PRO A 758 18.350 -2.020 -3.990 1.00 0.00 C ATOM 0 HA PRO A 758 19.393 -4.810 -2.781 1.00 0.00 H new ATOM 0 HB2 PRO A 758 20.791 -2.584 -1.838 1.00 0.00 H new ATOM 0 HB3 PRO A 758 20.948 -3.144 -3.491 1.00 0.00 H new ATOM 0 HG2 PRO A 758 19.239 -0.913 -2.401 1.00 0.00 H new ATOM 0 HG3 PRO A 758 20.190 -0.951 -3.873 1.00 0.00 H new ATOM 0 HD2 PRO A 758 17.525 -1.309 -3.931 1.00 0.00 H new ATOM 0 HD3 PRO A 758 18.575 -2.161 -5.047 1.00 0.00 H new ATOM 710 N GLY A 759 18.596 -5.095 -0.572 1.00 0.00 N ATOM 711 CA GLY A 759 18.206 -5.303 0.798 1.00 0.00 C ATOM 712 C GLY A 759 16.782 -4.859 1.030 1.00 0.00 C ATOM 713 O GLY A 759 16.392 -4.581 2.160 1.00 0.00 O ATOM 0 H GLY A 759 18.757 -5.948 -1.107 1.00 0.00 H new ATOM 0 HA2 GLY A 759 18.307 -6.358 1.052 1.00 0.00 H new ATOM 0 HA3 GLY A 759 18.875 -4.750 1.458 1.00 0.00 H new ATOM 717 N TYR A 760 16.003 -4.779 -0.052 1.00 0.00 N ATOM 718 CA TYR A 760 14.610 -4.364 0.047 1.00 0.00 C ATOM 719 C TYR A 760 13.873 -5.137 1.125 1.00 0.00 C ATOM 720 O TYR A 760 13.335 -4.558 2.053 1.00 0.00 O ATOM 721 CB TYR A 760 13.939 -4.573 -1.290 1.00 0.00 C ATOM 722 CG TYR A 760 12.658 -3.798 -1.458 1.00 0.00 C ATOM 723 CD1 TYR A 760 12.672 -2.460 -1.785 1.00 0.00 C ATOM 724 CD2 TYR A 760 11.448 -4.385 -1.274 1.00 0.00 C ATOM 725 CE1 TYR A 760 11.525 -1.724 -1.923 1.00 0.00 C ATOM 726 CE2 TYR A 760 10.303 -3.655 -1.407 1.00 0.00 C ATOM 727 CZ TYR A 760 10.335 -2.331 -1.728 1.00 0.00 C ATOM 728 OH TYR A 760 9.166 -1.621 -1.842 1.00 0.00 O ATOM 0 H TYR A 760 16.315 -4.996 -0.999 1.00 0.00 H new ATOM 0 HA TYR A 760 14.580 -3.310 0.321 1.00 0.00 H new ATOM 0 HB2 TYR A 760 14.632 -4.287 -2.082 1.00 0.00 H new ATOM 0 HB3 TYR A 760 13.729 -5.635 -1.418 1.00 0.00 H new ATOM 0 HD1 TYR A 760 13.624 -1.973 -1.938 1.00 0.00 H new ATOM 0 HD2 TYR A 760 11.391 -5.434 -1.021 1.00 0.00 H new ATOM 0 HE1 TYR A 760 11.572 -0.677 -2.183 1.00 0.00 H new ATOM 0 HE2 TYR A 760 9.349 -4.138 -1.254 1.00 0.00 H new ATOM 0 HH TYR A 760 8.777 -1.771 -2.729 1.00 0.00 H new ATOM 738 N TYR A 761 13.871 -6.447 0.999 1.00 0.00 N ATOM 739 CA TYR A 761 13.187 -7.307 1.949 1.00 0.00 C ATOM 740 C TYR A 761 13.724 -7.154 3.369 1.00 0.00 C ATOM 741 O TYR A 761 13.078 -7.565 4.333 1.00 0.00 O ATOM 742 CB TYR A 761 13.279 -8.750 1.479 1.00 0.00 C ATOM 743 CG TYR A 761 12.232 -9.084 0.448 1.00 0.00 C ATOM 744 CD1 TYR A 761 11.931 -8.174 -0.552 1.00 0.00 C ATOM 745 CD2 TYR A 761 11.529 -10.281 0.485 1.00 0.00 C ATOM 746 CE1 TYR A 761 10.960 -8.442 -1.495 1.00 0.00 C ATOM 747 CE2 TYR A 761 10.557 -10.562 -0.459 1.00 0.00 C ATOM 748 CZ TYR A 761 10.276 -9.639 -1.446 1.00 0.00 C ATOM 749 OH TYR A 761 9.306 -9.911 -2.383 1.00 0.00 O ATOM 0 H TYR A 761 14.339 -6.946 0.242 1.00 0.00 H new ATOM 0 HA TYR A 761 12.141 -7.003 1.987 1.00 0.00 H new ATOM 0 HB2 TYR A 761 14.269 -8.931 1.060 1.00 0.00 H new ATOM 0 HB3 TYR A 761 13.169 -9.416 2.335 1.00 0.00 H new ATOM 0 HD1 TYR A 761 12.466 -7.237 -0.594 1.00 0.00 H new ATOM 0 HD2 TYR A 761 11.744 -11.002 1.260 1.00 0.00 H new ATOM 0 HE1 TYR A 761 10.737 -7.720 -2.266 1.00 0.00 H new ATOM 0 HE2 TYR A 761 10.021 -11.499 -0.424 1.00 0.00 H new ATOM 0 HH TYR A 761 8.921 -10.795 -2.208 1.00 0.00 H new ATOM 759 N GLU A 762 14.903 -6.563 3.493 1.00 0.00 N ATOM 760 CA GLU A 762 15.523 -6.359 4.798 1.00 0.00 C ATOM 761 C GLU A 762 14.829 -5.218 5.540 1.00 0.00 C ATOM 762 O GLU A 762 14.611 -5.274 6.751 1.00 0.00 O ATOM 763 CB GLU A 762 17.010 -6.048 4.612 1.00 0.00 C ATOM 764 CG GLU A 762 17.394 -4.644 5.035 1.00 0.00 C ATOM 765 CD GLU A 762 18.893 -4.462 5.171 1.00 0.00 C ATOM 766 OE1 GLU A 762 19.460 -4.936 6.176 1.00 0.00 O ATOM 767 OE2 GLU A 762 19.499 -3.844 4.270 1.00 0.00 O ATOM 0 H GLU A 762 15.452 -6.215 2.707 1.00 0.00 H new ATOM 0 HA GLU A 762 15.419 -7.267 5.392 1.00 0.00 H new ATOM 0 HB2 GLU A 762 17.597 -6.765 5.186 1.00 0.00 H new ATOM 0 HB3 GLU A 762 17.273 -6.187 3.564 1.00 0.00 H new ATOM 0 HG2 GLU A 762 17.011 -3.932 4.305 1.00 0.00 H new ATOM 0 HG3 GLU A 762 16.916 -4.413 5.987 1.00 0.00 H new ATOM 774 N VAL A 763 14.495 -4.190 4.780 1.00 0.00 N ATOM 775 CA VAL A 763 13.834 -3.002 5.282 1.00 0.00 C ATOM 776 C VAL A 763 12.352 -3.184 5.197 1.00 0.00 C ATOM 777 O VAL A 763 11.603 -2.974 6.152 1.00 0.00 O ATOM 778 CB VAL A 763 14.238 -1.761 4.433 1.00 0.00 C ATOM 779 CG1 VAL A 763 14.880 -2.145 3.124 1.00 0.00 C ATOM 780 CG2 VAL A 763 13.061 -0.907 4.077 1.00 0.00 C ATOM 0 H VAL A 763 14.680 -4.159 3.777 1.00 0.00 H new ATOM 0 HA VAL A 763 14.135 -2.844 6.318 1.00 0.00 H new ATOM 0 HB VAL A 763 14.938 -1.217 5.067 1.00 0.00 H new ATOM 0 HG11 VAL A 763 15.143 -1.244 2.570 1.00 0.00 H new ATOM 0 HG12 VAL A 763 15.781 -2.728 3.318 1.00 0.00 H new ATOM 0 HG13 VAL A 763 14.181 -2.741 2.537 1.00 0.00 H new ATOM 0 HG21 VAL A 763 13.395 -0.055 3.485 1.00 0.00 H new ATOM 0 HG22 VAL A 763 12.348 -1.494 3.498 1.00 0.00 H new ATOM 0 HG23 VAL A 763 12.582 -0.550 4.988 1.00 0.00 H new ATOM 790 N ILE A 764 11.961 -3.577 4.025 1.00 0.00 N ATOM 791 CA ILE A 764 10.596 -3.766 3.692 1.00 0.00 C ATOM 792 C ILE A 764 9.995 -5.021 4.290 1.00 0.00 C ATOM 793 O ILE A 764 10.046 -6.096 3.690 1.00 0.00 O ATOM 794 CB ILE A 764 10.457 -3.802 2.198 1.00 0.00 C ATOM 795 CG1 ILE A 764 11.180 -2.594 1.612 1.00 0.00 C ATOM 796 CG2 ILE A 764 9.001 -3.782 1.850 1.00 0.00 C ATOM 797 CD1 ILE A 764 10.367 -1.329 1.659 1.00 0.00 C ATOM 0 H ILE A 764 12.603 -3.779 3.259 1.00 0.00 H new ATOM 0 HA ILE A 764 10.044 -2.928 4.118 1.00 0.00 H new ATOM 0 HB ILE A 764 10.900 -4.708 1.784 1.00 0.00 H new ATOM 0 HG12 ILE A 764 12.112 -2.439 2.156 1.00 0.00 H new ATOM 0 HG13 ILE A 764 11.447 -2.807 0.577 1.00 0.00 H new ATOM 0 HG21 ILE A 764 8.886 -3.808 0.766 1.00 0.00 H new ATOM 0 HG22 ILE A 764 8.510 -4.651 2.288 1.00 0.00 H new ATOM 0 HG23 ILE A 764 8.546 -2.872 2.242 1.00 0.00 H new ATOM 0 HD11 ILE A 764 10.942 -0.511 1.226 1.00 0.00 H new ATOM 0 HD12 ILE A 764 9.447 -1.466 1.091 1.00 0.00 H new ATOM 0 HD13 ILE A 764 10.122 -1.092 2.694 1.00 0.00 H new ATOM 809 N ARG A 765 9.442 -4.881 5.480 1.00 0.00 N ATOM 810 CA ARG A 765 8.791 -5.995 6.148 1.00 0.00 C ATOM 811 C ARG A 765 7.724 -6.624 5.246 1.00 0.00 C ATOM 812 O ARG A 765 7.568 -7.845 5.222 1.00 0.00 O ATOM 813 CB ARG A 765 8.160 -5.527 7.463 1.00 0.00 C ATOM 814 CG ARG A 765 9.071 -5.636 8.663 1.00 0.00 C ATOM 815 CD ARG A 765 9.370 -7.081 9.007 1.00 0.00 C ATOM 816 NE ARG A 765 10.455 -7.630 8.197 1.00 0.00 N ATOM 817 CZ ARG A 765 10.849 -8.899 8.256 1.00 0.00 C ATOM 818 NH1 ARG A 765 10.249 -9.747 9.081 1.00 0.00 N ATOM 819 NH2 ARG A 765 11.846 -9.321 7.490 1.00 0.00 N ATOM 0 H ARG A 765 9.430 -4.007 6.005 1.00 0.00 H new ATOM 0 HA ARG A 765 9.545 -6.751 6.365 1.00 0.00 H new ATOM 0 HB2 ARG A 765 7.846 -4.489 7.353 1.00 0.00 H new ATOM 0 HB3 ARG A 765 7.261 -6.114 7.650 1.00 0.00 H new ATOM 0 HG2 ARG A 765 10.004 -5.109 8.462 1.00 0.00 H new ATOM 0 HG3 ARG A 765 8.606 -5.146 9.519 1.00 0.00 H new ATOM 0 HD2 ARG A 765 9.634 -7.154 10.062 1.00 0.00 H new ATOM 0 HD3 ARG A 765 8.471 -7.680 8.861 1.00 0.00 H new ATOM 0 HE ARG A 765 10.937 -7.005 7.550 1.00 0.00 H new ATOM 0 HH11 ARG A 765 9.483 -9.427 9.673 1.00 0.00 H new ATOM 0 HH12 ARG A 765 10.554 -10.719 9.123 1.00 0.00 H new ATOM 0 HH21 ARG A 765 12.311 -8.672 6.855 1.00 0.00 H new ATOM 0 HH22 ARG A 765 12.148 -10.294 7.536 1.00 0.00 H new ATOM 833 N PHE A 766 6.986 -5.787 4.502 1.00 0.00 N ATOM 834 CA PHE A 766 5.931 -6.288 3.612 1.00 0.00 C ATOM 835 C PHE A 766 5.985 -5.652 2.219 1.00 0.00 C ATOM 836 O PHE A 766 5.203 -4.751 1.915 1.00 0.00 O ATOM 837 CB PHE A 766 4.548 -6.029 4.206 1.00 0.00 C ATOM 838 CG PHE A 766 4.222 -6.858 5.404 1.00 0.00 C ATOM 839 CD1 PHE A 766 4.965 -6.717 6.544 1.00 0.00 C ATOM 840 CD2 PHE A 766 3.165 -7.751 5.396 1.00 0.00 C ATOM 841 CE1 PHE A 766 4.678 -7.447 7.676 1.00 0.00 C ATOM 842 CE2 PHE A 766 2.867 -8.492 6.522 1.00 0.00 C ATOM 843 CZ PHE A 766 3.627 -8.338 7.664 1.00 0.00 C ATOM 0 H PHE A 766 7.098 -4.773 4.499 1.00 0.00 H new ATOM 0 HA PHE A 766 6.107 -7.359 3.513 1.00 0.00 H new ATOM 0 HB2 PHE A 766 4.475 -4.976 4.478 1.00 0.00 H new ATOM 0 HB3 PHE A 766 3.797 -6.212 3.438 1.00 0.00 H new ATOM 0 HD1 PHE A 766 5.791 -6.021 6.556 1.00 0.00 H new ATOM 0 HD2 PHE A 766 2.569 -7.869 4.503 1.00 0.00 H new ATOM 0 HE1 PHE A 766 5.273 -7.322 8.568 1.00 0.00 H new ATOM 0 HE2 PHE A 766 2.042 -9.189 6.509 1.00 0.00 H new ATOM 0 HZ PHE A 766 3.398 -8.915 8.547 1.00 0.00 H new ATOM 853 N PRO A 767 6.908 -6.103 1.357 1.00 0.00 N ATOM 854 CA PRO A 767 7.038 -5.576 -0.004 1.00 0.00 C ATOM 855 C PRO A 767 5.797 -5.811 -0.863 1.00 0.00 C ATOM 856 O PRO A 767 5.673 -6.830 -1.542 1.00 0.00 O ATOM 857 CB PRO A 767 8.264 -6.306 -0.571 1.00 0.00 C ATOM 858 CG PRO A 767 8.964 -6.870 0.603 1.00 0.00 C ATOM 859 CD PRO A 767 7.931 -7.103 1.661 1.00 0.00 C ATOM 0 HA PRO A 767 7.151 -4.492 -0.001 1.00 0.00 H new ATOM 0 HB2 PRO A 767 7.967 -7.092 -1.266 1.00 0.00 H new ATOM 0 HB3 PRO A 767 8.909 -5.621 -1.121 1.00 0.00 H new ATOM 0 HG2 PRO A 767 9.465 -7.802 0.342 1.00 0.00 H new ATOM 0 HG3 PRO A 767 9.733 -6.184 0.959 1.00 0.00 H new ATOM 0 HD2 PRO A 767 7.530 -8.116 1.616 1.00 0.00 H new ATOM 0 HD3 PRO A 767 8.342 -6.967 2.661 1.00 0.00 H new ATOM 867 N MET A 768 4.880 -4.845 -0.816 1.00 0.00 N ATOM 868 CA MET A 768 3.642 -4.897 -1.587 1.00 0.00 C ATOM 869 C MET A 768 3.779 -4.080 -2.851 1.00 0.00 C ATOM 870 O MET A 768 4.634 -3.202 -2.956 1.00 0.00 O ATOM 871 CB MET A 768 2.480 -4.339 -0.764 1.00 0.00 C ATOM 872 CG MET A 768 1.096 -4.419 -1.425 1.00 0.00 C ATOM 873 SD MET A 768 0.805 -5.874 -2.427 1.00 0.00 S ATOM 874 CE MET A 768 0.283 -6.964 -1.143 1.00 0.00 C ATOM 0 H MET A 768 4.976 -4.007 -0.243 1.00 0.00 H new ATOM 0 HA MET A 768 3.444 -5.938 -1.842 1.00 0.00 H new ATOM 0 HB2 MET A 768 2.441 -4.875 0.184 1.00 0.00 H new ATOM 0 HB3 MET A 768 2.692 -3.295 -0.532 1.00 0.00 H new ATOM 0 HG2 MET A 768 0.337 -4.379 -0.644 1.00 0.00 H new ATOM 0 HG3 MET A 768 0.959 -3.536 -2.049 1.00 0.00 H new ATOM 0 HE1 MET A 768 0.853 -7.891 -1.199 1.00 0.00 H new ATOM 0 HE2 MET A 768 0.451 -6.492 -0.175 1.00 0.00 H new ATOM 0 HE3 MET A 768 -0.778 -7.183 -1.261 1.00 0.00 H new ATOM 884 N ASP A 769 2.933 -4.381 -3.806 1.00 0.00 N ATOM 885 CA ASP A 769 2.917 -3.677 -5.059 1.00 0.00 C ATOM 886 C ASP A 769 1.520 -3.703 -5.643 1.00 0.00 C ATOM 887 O ASP A 769 0.639 -4.377 -5.123 1.00 0.00 O ATOM 888 CB ASP A 769 3.910 -4.297 -6.029 1.00 0.00 C ATOM 889 CG ASP A 769 4.085 -5.784 -5.812 1.00 0.00 C ATOM 890 OD1 ASP A 769 4.805 -6.168 -4.867 1.00 0.00 O ATOM 891 OD2 ASP A 769 3.505 -6.563 -6.590 1.00 0.00 O ATOM 0 H ASP A 769 2.236 -5.123 -3.733 1.00 0.00 H new ATOM 0 HA ASP A 769 3.209 -2.641 -4.887 1.00 0.00 H new ATOM 0 HB2 ASP A 769 3.573 -4.120 -7.050 1.00 0.00 H new ATOM 0 HB3 ASP A 769 4.875 -3.802 -5.921 1.00 0.00 H new ATOM 896 N LEU A 770 1.316 -2.944 -6.699 1.00 0.00 N ATOM 897 CA LEU A 770 0.022 -2.888 -7.361 1.00 0.00 C ATOM 898 C LEU A 770 -0.268 -4.185 -8.086 1.00 0.00 C ATOM 899 O LEU A 770 -1.425 -4.527 -8.320 1.00 0.00 O ATOM 900 CB LEU A 770 -0.023 -1.697 -8.298 1.00 0.00 C ATOM 901 CG LEU A 770 0.670 -0.492 -7.734 1.00 0.00 C ATOM 902 CD1 LEU A 770 1.375 0.223 -8.833 1.00 0.00 C ATOM 903 CD2 LEU A 770 -0.319 0.418 -7.067 1.00 0.00 C ATOM 0 H LEU A 770 2.032 -2.353 -7.122 1.00 0.00 H new ATOM 0 HA LEU A 770 -0.759 -2.760 -6.611 1.00 0.00 H new ATOM 0 HB2 LEU A 770 0.441 -1.968 -9.246 1.00 0.00 H new ATOM 0 HB3 LEU A 770 -1.062 -1.447 -8.512 1.00 0.00 H new ATOM 0 HG LEU A 770 1.395 -0.809 -6.984 1.00 0.00 H new ATOM 0 HD11 LEU A 770 1.881 1.100 -8.430 1.00 0.00 H new ATOM 0 HD12 LEU A 770 2.109 -0.442 -9.288 1.00 0.00 H new ATOM 0 HD13 LEU A 770 0.652 0.535 -9.587 1.00 0.00 H new ATOM 0 HD21 LEU A 770 0.201 1.287 -6.663 1.00 0.00 H new ATOM 0 HD22 LEU A 770 -1.061 0.745 -7.795 1.00 0.00 H new ATOM 0 HD23 LEU A 770 -0.816 -0.116 -6.257 1.00 0.00 H new ATOM 915 N LYS A 771 0.783 -4.895 -8.470 1.00 0.00 N ATOM 916 CA LYS A 771 0.608 -6.184 -9.115 1.00 0.00 C ATOM 917 C LYS A 771 0.187 -7.196 -8.066 1.00 0.00 C ATOM 918 O LYS A 771 -0.718 -7.996 -8.290 1.00 0.00 O ATOM 919 CB LYS A 771 1.881 -6.654 -9.794 1.00 0.00 C ATOM 920 CG LYS A 771 1.610 -7.603 -10.937 1.00 0.00 C ATOM 921 CD LYS A 771 1.423 -6.844 -12.236 1.00 0.00 C ATOM 922 CE LYS A 771 0.729 -7.699 -13.280 1.00 0.00 C ATOM 923 NZ LYS A 771 0.520 -6.960 -14.556 1.00 0.00 N ATOM 0 H LYS A 771 1.753 -4.604 -8.348 1.00 0.00 H new ATOM 0 HA LYS A 771 -0.156 -6.084 -9.886 1.00 0.00 H new ATOM 0 HB2 LYS A 771 2.431 -5.790 -10.166 1.00 0.00 H new ATOM 0 HB3 LYS A 771 2.520 -7.146 -9.061 1.00 0.00 H new ATOM 0 HG2 LYS A 771 2.438 -8.305 -11.037 1.00 0.00 H new ATOM 0 HG3 LYS A 771 0.718 -8.191 -10.723 1.00 0.00 H new ATOM 0 HD2 LYS A 771 0.837 -5.944 -12.052 1.00 0.00 H new ATOM 0 HD3 LYS A 771 2.393 -6.521 -12.614 1.00 0.00 H new ATOM 0 HE2 LYS A 771 1.324 -8.592 -13.471 1.00 0.00 H new ATOM 0 HE3 LYS A 771 -0.233 -8.034 -12.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 771 0.043 -7.580 -15.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 771 -0.069 -6.121 -14.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 771 1.440 -6.662 -14.939 1.00 0.00 H new ATOM 937 N THR A 772 0.874 -7.170 -6.925 1.00 0.00 N ATOM 938 CA THR A 772 0.533 -8.052 -5.818 1.00 0.00 C ATOM 939 C THR A 772 -0.847 -7.655 -5.303 1.00 0.00 C ATOM 940 O THR A 772 -1.657 -8.505 -4.937 1.00 0.00 O ATOM 941 CB THR A 772 1.571 -8.014 -4.688 1.00 0.00 C ATOM 942 OG1 THR A 772 2.842 -8.466 -5.173 1.00 0.00 O ATOM 943 CG2 THR A 772 1.130 -8.901 -3.539 1.00 0.00 C ATOM 0 H THR A 772 1.665 -6.551 -6.747 1.00 0.00 H new ATOM 0 HA THR A 772 0.526 -9.080 -6.180 1.00 0.00 H new ATOM 0 HB THR A 772 1.660 -6.986 -4.336 1.00 0.00 H new ATOM 0 HG1 THR A 772 3.056 -8.004 -6.010 1.00 0.00 H new ATOM 0 HG21 THR A 772 1.875 -8.865 -2.745 1.00 0.00 H new ATOM 0 HG22 THR A 772 0.173 -8.549 -3.155 1.00 0.00 H new ATOM 0 HG23 THR A 772 1.025 -9.927 -3.891 1.00 0.00 H new ATOM 951 N MET A 773 -1.097 -6.342 -5.267 1.00 0.00 N ATOM 952 CA MET A 773 -2.407 -5.818 -4.895 1.00 0.00 C ATOM 953 C MET A 773 -3.425 -6.458 -5.831 1.00 0.00 C ATOM 954 O MET A 773 -4.283 -7.224 -5.411 1.00 0.00 O ATOM 955 CB MET A 773 -2.432 -4.296 -5.055 1.00 0.00 C ATOM 956 CG MET A 773 -2.118 -3.542 -3.783 1.00 0.00 C ATOM 957 SD MET A 773 -3.309 -3.876 -2.495 1.00 0.00 S ATOM 958 CE MET A 773 -4.760 -3.127 -3.206 1.00 0.00 C ATOM 0 H MET A 773 -0.406 -5.626 -5.492 1.00 0.00 H new ATOM 0 HA MET A 773 -2.635 -6.048 -3.854 1.00 0.00 H new ATOM 0 HB2 MET A 773 -1.713 -4.009 -5.823 1.00 0.00 H new ATOM 0 HB3 MET A 773 -3.417 -3.994 -5.411 1.00 0.00 H new ATOM 0 HG2 MET A 773 -1.122 -3.816 -3.436 1.00 0.00 H new ATOM 0 HG3 MET A 773 -2.100 -2.472 -3.991 1.00 0.00 H new ATOM 0 HE1 MET A 773 -5.071 -2.281 -2.592 1.00 0.00 H new ATOM 0 HE2 MET A 773 -4.533 -2.780 -4.214 1.00 0.00 H new ATOM 0 HE3 MET A 773 -5.565 -3.861 -3.247 1.00 0.00 H new ATOM 968 N SER A 774 -3.275 -6.172 -7.120 1.00 0.00 N ATOM 969 CA SER A 774 -4.159 -6.728 -8.141 1.00 0.00 C ATOM 970 C SER A 774 -4.193 -8.240 -8.075 1.00 0.00 C ATOM 971 O SER A 774 -5.185 -8.853 -8.430 1.00 0.00 O ATOM 972 CB SER A 774 -3.722 -6.282 -9.515 1.00 0.00 C ATOM 973 OG SER A 774 -2.536 -6.939 -9.924 1.00 0.00 O ATOM 0 H SER A 774 -2.548 -5.557 -7.484 1.00 0.00 H new ATOM 0 HA SER A 774 -5.165 -6.356 -7.948 1.00 0.00 H new ATOM 0 HB2 SER A 774 -4.517 -6.484 -10.233 1.00 0.00 H new ATOM 0 HB3 SER A 774 -3.560 -5.204 -9.514 1.00 0.00 H new ATOM 0 HG SER A 774 -1.984 -7.136 -9.139 1.00 0.00 H new ATOM 979 N GLU A 775 -3.095 -8.836 -7.648 1.00 0.00 N ATOM 980 CA GLU A 775 -3.022 -10.279 -7.503 1.00 0.00 C ATOM 981 C GLU A 775 -4.150 -10.726 -6.598 1.00 0.00 C ATOM 982 O GLU A 775 -4.992 -11.556 -6.964 1.00 0.00 O ATOM 983 CB GLU A 775 -1.673 -10.648 -6.904 1.00 0.00 C ATOM 984 CG GLU A 775 -0.879 -11.620 -7.741 1.00 0.00 C ATOM 985 CD GLU A 775 0.139 -12.399 -6.931 1.00 0.00 C ATOM 986 OE1 GLU A 775 -0.222 -13.468 -6.393 1.00 0.00 O ATOM 987 OE2 GLU A 775 1.296 -11.941 -6.833 1.00 0.00 O ATOM 0 H GLU A 775 -2.239 -8.342 -7.395 1.00 0.00 H new ATOM 0 HA GLU A 775 -3.121 -10.773 -8.470 1.00 0.00 H new ATOM 0 HB2 GLU A 775 -1.087 -9.739 -6.766 1.00 0.00 H new ATOM 0 HB3 GLU A 775 -1.831 -11.079 -5.915 1.00 0.00 H new ATOM 0 HG2 GLU A 775 -1.562 -12.318 -8.225 1.00 0.00 H new ATOM 0 HG3 GLU A 775 -0.366 -11.075 -8.533 1.00 0.00 H new ATOM 994 N ARG A 776 -4.177 -10.112 -5.430 1.00 0.00 N ATOM 995 CA ARG A 776 -5.190 -10.382 -4.438 1.00 0.00 C ATOM 996 C ARG A 776 -6.552 -10.098 -5.034 1.00 0.00 C ATOM 997 O ARG A 776 -7.470 -10.912 -4.980 1.00 0.00 O ATOM 998 CB ARG A 776 -4.929 -9.503 -3.241 1.00 0.00 C ATOM 999 CG ARG A 776 -3.747 -9.979 -2.416 1.00 0.00 C ATOM 1000 CD ARG A 776 -2.788 -8.851 -2.076 1.00 0.00 C ATOM 1001 NE ARG A 776 -1.540 -9.357 -1.512 1.00 0.00 N ATOM 1002 CZ ARG A 776 -1.423 -9.824 -0.273 1.00 0.00 C ATOM 1003 NH1 ARG A 776 -2.477 -9.855 0.530 1.00 0.00 N ATOM 1004 NH2 ARG A 776 -0.250 -10.262 0.165 1.00 0.00 N ATOM 0 H ARG A 776 -3.493 -9.411 -5.146 1.00 0.00 H new ATOM 0 HA ARG A 776 -5.163 -11.426 -4.125 1.00 0.00 H new ATOM 0 HB2 ARG A 776 -4.746 -8.482 -3.577 1.00 0.00 H new ATOM 0 HB3 ARG A 776 -5.819 -9.477 -2.613 1.00 0.00 H new ATOM 0 HG2 ARG A 776 -4.110 -10.434 -1.494 1.00 0.00 H new ATOM 0 HG3 ARG A 776 -3.212 -10.754 -2.965 1.00 0.00 H new ATOM 0 HD2 ARG A 776 -2.573 -8.272 -2.974 1.00 0.00 H new ATOM 0 HD3 ARG A 776 -3.260 -8.173 -1.365 1.00 0.00 H new ATOM 0 HE ARG A 776 -0.709 -9.352 -2.104 1.00 0.00 H new ATOM 0 HH11 ARG A 776 -3.381 -9.520 0.198 1.00 0.00 H new ATOM 0 HH12 ARG A 776 -2.384 -10.214 1.480 1.00 0.00 H new ATOM 0 HH21 ARG A 776 0.564 -10.241 -0.449 1.00 0.00 H new ATOM 0 HH22 ARG A 776 -0.162 -10.620 1.116 1.00 0.00 H new ATOM 1018 N LEU A 777 -6.634 -8.928 -5.623 1.00 0.00 N ATOM 1019 CA LEU A 777 -7.828 -8.438 -6.288 1.00 0.00 C ATOM 1020 C LEU A 777 -8.391 -9.483 -7.208 1.00 0.00 C ATOM 1021 O LEU A 777 -9.575 -9.804 -7.162 1.00 0.00 O ATOM 1022 CB LEU A 777 -7.435 -7.198 -7.083 1.00 0.00 C ATOM 1023 CG LEU A 777 -8.550 -6.297 -7.586 1.00 0.00 C ATOM 1024 CD1 LEU A 777 -9.842 -7.022 -7.827 1.00 0.00 C ATOM 1025 CD2 LEU A 777 -8.768 -5.186 -6.591 1.00 0.00 C ATOM 0 H LEU A 777 -5.855 -8.271 -5.656 1.00 0.00 H new ATOM 0 HA LEU A 777 -8.596 -8.199 -5.552 1.00 0.00 H new ATOM 0 HB2 LEU A 777 -6.773 -6.596 -6.460 1.00 0.00 H new ATOM 0 HB3 LEU A 777 -6.852 -7.523 -7.945 1.00 0.00 H new ATOM 0 HG LEU A 777 -8.234 -5.903 -8.552 1.00 0.00 H new ATOM 0 HD11 LEU A 777 -10.593 -6.318 -8.185 1.00 0.00 H new ATOM 0 HD12 LEU A 777 -9.689 -7.800 -8.575 1.00 0.00 H new ATOM 0 HD13 LEU A 777 -10.184 -7.476 -6.897 1.00 0.00 H new ATOM 0 HD21 LEU A 777 -9.567 -4.534 -6.943 1.00 0.00 H new ATOM 0 HD22 LEU A 777 -9.045 -5.611 -5.626 1.00 0.00 H new ATOM 0 HD23 LEU A 777 -7.850 -4.609 -6.483 1.00 0.00 H new ATOM 1037 N LYS A 778 -7.529 -10.007 -8.036 1.00 0.00 N ATOM 1038 CA LYS A 778 -7.912 -11.004 -8.988 1.00 0.00 C ATOM 1039 C LYS A 778 -8.675 -12.121 -8.293 1.00 0.00 C ATOM 1040 O LYS A 778 -9.751 -12.526 -8.729 1.00 0.00 O ATOM 1041 CB LYS A 778 -6.674 -11.594 -9.631 1.00 0.00 C ATOM 1042 CG LYS A 778 -6.457 -11.224 -11.058 1.00 0.00 C ATOM 1043 CD LYS A 778 -6.110 -9.766 -11.198 1.00 0.00 C ATOM 1044 CE LYS A 778 -5.075 -9.578 -12.266 1.00 0.00 C ATOM 1045 NZ LYS A 778 -3.791 -10.251 -11.927 1.00 0.00 N ATOM 0 H LYS A 778 -6.542 -9.752 -8.067 1.00 0.00 H new ATOM 0 HA LYS A 778 -8.545 -10.541 -9.745 1.00 0.00 H new ATOM 0 HB2 LYS A 778 -5.802 -11.282 -9.056 1.00 0.00 H new ATOM 0 HB3 LYS A 778 -6.731 -12.680 -9.559 1.00 0.00 H new ATOM 0 HG2 LYS A 778 -5.655 -11.833 -11.476 1.00 0.00 H new ATOM 0 HG3 LYS A 778 -7.356 -11.443 -11.634 1.00 0.00 H new ATOM 0 HD2 LYS A 778 -7.005 -9.194 -11.444 1.00 0.00 H new ATOM 0 HD3 LYS A 778 -5.737 -9.381 -10.249 1.00 0.00 H new ATOM 0 HE2 LYS A 778 -5.452 -9.973 -13.209 1.00 0.00 H new ATOM 0 HE3 LYS A 778 -4.897 -8.513 -12.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 778 -2.998 -9.701 -12.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 778 -3.695 -10.316 -10.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 778 -3.781 -11.207 -12.336 1.00 0.00 H new ATOM 1059 N ASN A 779 -8.087 -12.618 -7.203 1.00 0.00 N ATOM 1060 CA ASN A 779 -8.679 -13.696 -6.430 1.00 0.00 C ATOM 1061 C ASN A 779 -9.856 -13.211 -5.598 1.00 0.00 C ATOM 1062 O ASN A 779 -10.451 -13.988 -4.850 1.00 0.00 O ATOM 1063 CB ASN A 779 -7.646 -14.262 -5.473 1.00 0.00 C ATOM 1064 CG ASN A 779 -6.219 -14.035 -5.900 1.00 0.00 C ATOM 1065 OD1 ASN A 779 -5.535 -13.147 -5.179 1.00 0.00 O flip ATOM 1066 ND2 ASN A 779 -5.727 -14.653 -6.844 1.00 0.00 N flip ATOM 0 H ASN A 779 -7.195 -12.284 -6.839 1.00 0.00 H new ATOM 0 HA ASN A 779 -9.023 -14.450 -7.138 1.00 0.00 H new ATOM 0 HB2 ASN A 779 -7.795 -13.815 -4.490 1.00 0.00 H new ATOM 0 HB3 ASN A 779 -7.815 -15.333 -5.365 1.00 0.00 H new ATOM 0 HD21 ASN A 779 -6.293 -15.323 -7.365 1.00 0.00 H new ATOM 0 HD22 ASN A 779 -4.754 -14.495 -7.105 1.00 0.00 H new ATOM 1073 N ARG A 780 -10.166 -11.930 -5.717 1.00 0.00 N ATOM 1074 CA ARG A 780 -11.252 -11.322 -4.957 1.00 0.00 C ATOM 1075 C ARG A 780 -10.843 -11.263 -3.499 1.00 0.00 C ATOM 1076 O ARG A 780 -11.679 -11.112 -2.608 1.00 0.00 O ATOM 1077 CB ARG A 780 -12.552 -12.116 -5.068 1.00 0.00 C ATOM 1078 CG ARG A 780 -13.246 -12.011 -6.406 1.00 0.00 C ATOM 1079 CD ARG A 780 -12.464 -12.718 -7.490 1.00 0.00 C ATOM 1080 NE ARG A 780 -13.269 -13.724 -8.181 1.00 0.00 N ATOM 1081 CZ ARG A 780 -13.050 -14.115 -9.433 1.00 0.00 C ATOM 1082 NH1 ARG A 780 -12.060 -13.584 -10.136 1.00 0.00 N ATOM 1083 NH2 ARG A 780 -13.826 -15.039 -9.986 1.00 0.00 N ATOM 0 H ARG A 780 -9.678 -11.285 -6.338 1.00 0.00 H new ATOM 0 HA ARG A 780 -11.433 -10.328 -5.365 1.00 0.00 H new ATOM 0 HB2 ARG A 780 -12.339 -13.166 -4.867 1.00 0.00 H new ATOM 0 HB3 ARG A 780 -13.237 -11.775 -4.291 1.00 0.00 H new ATOM 0 HG2 ARG A 780 -14.244 -12.443 -6.335 1.00 0.00 H new ATOM 0 HG3 ARG A 780 -13.371 -10.961 -6.671 1.00 0.00 H new ATOM 0 HD2 ARG A 780 -12.102 -11.986 -8.212 1.00 0.00 H new ATOM 0 HD3 ARG A 780 -11.587 -13.194 -7.052 1.00 0.00 H new ATOM 0 HE ARG A 780 -14.044 -14.151 -7.673 1.00 0.00 H new ATOM 0 HH11 ARG A 780 -11.462 -12.872 -9.717 1.00 0.00 H new ATOM 0 HH12 ARG A 780 -11.896 -13.887 -11.096 1.00 0.00 H new ATOM 0 HH21 ARG A 780 -14.591 -15.450 -9.451 1.00 0.00 H new ATOM 0 HH22 ARG A 780 -13.657 -15.338 -10.946 1.00 0.00 H new ATOM 1097 N TYR A 781 -9.542 -11.392 -3.274 1.00 0.00 N ATOM 1098 CA TYR A 781 -8.988 -11.397 -1.939 1.00 0.00 C ATOM 1099 C TYR A 781 -9.491 -10.213 -1.134 1.00 0.00 C ATOM 1100 O TYR A 781 -9.775 -10.349 0.053 1.00 0.00 O ATOM 1101 CB TYR A 781 -7.462 -11.390 -2.033 1.00 0.00 C ATOM 1102 CG TYR A 781 -6.732 -11.041 -0.764 1.00 0.00 C ATOM 1103 CD1 TYR A 781 -6.571 -9.723 -0.412 1.00 0.00 C ATOM 1104 CD2 TYR A 781 -6.179 -12.015 0.054 1.00 0.00 C ATOM 1105 CE1 TYR A 781 -5.879 -9.356 0.712 1.00 0.00 C ATOM 1106 CE2 TYR A 781 -5.484 -11.668 1.197 1.00 0.00 C ATOM 1107 CZ TYR A 781 -5.332 -10.335 1.522 1.00 0.00 C ATOM 1108 OH TYR A 781 -4.627 -9.983 2.649 1.00 0.00 O ATOM 0 H TYR A 781 -8.848 -11.495 -4.014 1.00 0.00 H new ATOM 0 HA TYR A 781 -9.312 -12.299 -1.419 1.00 0.00 H new ATOM 0 HB2 TYR A 781 -7.132 -12.376 -2.361 1.00 0.00 H new ATOM 0 HB3 TYR A 781 -7.167 -10.681 -2.807 1.00 0.00 H new ATOM 0 HD1 TYR A 781 -7.001 -8.955 -1.038 1.00 0.00 H new ATOM 0 HD2 TYR A 781 -6.293 -13.057 -0.205 1.00 0.00 H new ATOM 0 HE1 TYR A 781 -5.762 -8.312 0.963 1.00 0.00 H new ATOM 0 HE2 TYR A 781 -5.063 -12.434 1.831 1.00 0.00 H new ATOM 0 HH TYR A 781 -4.312 -10.792 3.104 1.00 0.00 H new ATOM 1118 N TYR A 782 -9.617 -9.056 -1.784 1.00 0.00 N ATOM 1119 CA TYR A 782 -10.074 -7.858 -1.100 1.00 0.00 C ATOM 1120 C TYR A 782 -11.524 -7.948 -0.720 1.00 0.00 C ATOM 1121 O TYR A 782 -12.402 -7.395 -1.383 1.00 0.00 O ATOM 1122 CB TYR A 782 -9.808 -6.614 -1.936 1.00 0.00 C ATOM 1123 CG TYR A 782 -8.386 -6.511 -2.300 1.00 0.00 C ATOM 1124 CD1 TYR A 782 -7.483 -6.105 -1.371 1.00 0.00 C ATOM 1125 CD2 TYR A 782 -7.937 -6.861 -3.544 1.00 0.00 C ATOM 1126 CE1 TYR A 782 -6.163 -6.048 -1.654 1.00 0.00 C ATOM 1127 CE2 TYR A 782 -6.603 -6.788 -3.844 1.00 0.00 C ATOM 1128 CZ TYR A 782 -5.722 -6.382 -2.885 1.00 0.00 C ATOM 1129 OH TYR A 782 -4.389 -6.338 -3.147 1.00 0.00 O ATOM 0 H TYR A 782 -9.410 -8.928 -2.775 1.00 0.00 H new ATOM 0 HA TYR A 782 -9.500 -7.777 -0.177 1.00 0.00 H new ATOM 0 HB2 TYR A 782 -10.416 -6.643 -2.840 1.00 0.00 H new ATOM 0 HB3 TYR A 782 -10.108 -5.727 -1.378 1.00 0.00 H new ATOM 0 HD1 TYR A 782 -7.826 -5.822 -0.387 1.00 0.00 H new ATOM 0 HD2 TYR A 782 -8.638 -7.197 -4.293 1.00 0.00 H new ATOM 0 HE1 TYR A 782 -5.461 -5.735 -0.895 1.00 0.00 H new ATOM 0 HE2 TYR A 782 -6.251 -7.050 -4.831 1.00 0.00 H new ATOM 0 HH TYR A 782 -3.992 -5.564 -2.696 1.00 0.00 H new ATOM 1139 N VAL A 783 -11.756 -8.658 0.361 1.00 0.00 N ATOM 1140 CA VAL A 783 -13.078 -8.802 0.893 1.00 0.00 C ATOM 1141 C VAL A 783 -13.326 -7.651 1.823 1.00 0.00 C ATOM 1142 O VAL A 783 -14.260 -7.645 2.626 1.00 0.00 O ATOM 1143 CB VAL A 783 -13.237 -10.125 1.631 1.00 0.00 C ATOM 1144 CG1 VAL A 783 -13.236 -11.241 0.623 1.00 0.00 C ATOM 1145 CG2 VAL A 783 -12.128 -10.292 2.640 1.00 0.00 C ATOM 0 H VAL A 783 -11.033 -9.147 0.889 1.00 0.00 H new ATOM 0 HA VAL A 783 -13.803 -8.801 0.079 1.00 0.00 H new ATOM 0 HB VAL A 783 -14.180 -10.143 2.177 1.00 0.00 H new ATOM 0 HG11 VAL A 783 -13.349 -12.196 1.137 1.00 0.00 H new ATOM 0 HG12 VAL A 783 -14.063 -11.103 -0.073 1.00 0.00 H new ATOM 0 HG13 VAL A 783 -12.295 -11.234 0.074 1.00 0.00 H new ATOM 0 HG21 VAL A 783 -12.251 -11.241 3.162 1.00 0.00 H new ATOM 0 HG22 VAL A 783 -11.166 -10.282 2.128 1.00 0.00 H new ATOM 0 HG23 VAL A 783 -12.165 -9.474 3.360 1.00 0.00 H new ATOM 1155 N SER A 784 -12.453 -6.669 1.684 1.00 0.00 N ATOM 1156 CA SER A 784 -12.484 -5.487 2.498 1.00 0.00 C ATOM 1157 C SER A 784 -11.525 -4.442 1.936 1.00 0.00 C ATOM 1158 O SER A 784 -10.359 -4.750 1.689 1.00 0.00 O ATOM 1159 CB SER A 784 -12.068 -5.880 3.899 1.00 0.00 C ATOM 1160 OG SER A 784 -13.191 -6.191 4.706 1.00 0.00 O ATOM 0 H SER A 784 -11.701 -6.678 0.995 1.00 0.00 H new ATOM 0 HA SER A 784 -13.485 -5.056 2.508 1.00 0.00 H new ATOM 0 HB2 SER A 784 -11.401 -6.741 3.854 1.00 0.00 H new ATOM 0 HB3 SER A 784 -11.505 -5.065 4.355 1.00 0.00 H new ATOM 0 HG SER A 784 -13.807 -6.764 4.203 1.00 0.00 H new ATOM 1166 N LYS A 785 -12.005 -3.215 1.709 1.00 0.00 N ATOM 1167 CA LYS A 785 -11.129 -2.167 1.182 1.00 0.00 C ATOM 1168 C LYS A 785 -9.921 -2.023 2.059 1.00 0.00 C ATOM 1169 O LYS A 785 -8.969 -1.397 1.657 1.00 0.00 O ATOM 1170 CB LYS A 785 -11.799 -0.797 1.095 1.00 0.00 C ATOM 1171 CG LYS A 785 -12.567 -0.412 2.338 1.00 0.00 C ATOM 1172 CD LYS A 785 -13.966 -0.948 2.235 1.00 0.00 C ATOM 1173 CE LYS A 785 -14.985 0.159 2.125 1.00 0.00 C ATOM 1174 NZ LYS A 785 -15.024 1.005 3.350 1.00 0.00 N ATOM 0 H LYS A 785 -12.970 -2.929 1.877 1.00 0.00 H new ATOM 0 HA LYS A 785 -10.866 -2.482 0.172 1.00 0.00 H new ATOM 0 HB2 LYS A 785 -11.037 -0.042 0.902 1.00 0.00 H new ATOM 0 HB3 LYS A 785 -12.478 -0.789 0.243 1.00 0.00 H new ATOM 0 HG2 LYS A 785 -12.075 -0.813 3.224 1.00 0.00 H new ATOM 0 HG3 LYS A 785 -12.587 0.672 2.448 1.00 0.00 H new ATOM 0 HD2 LYS A 785 -14.042 -1.600 1.364 1.00 0.00 H new ATOM 0 HD3 LYS A 785 -14.186 -1.559 3.111 1.00 0.00 H new ATOM 0 HE2 LYS A 785 -14.752 0.782 1.261 1.00 0.00 H new ATOM 0 HE3 LYS A 785 -15.971 -0.272 1.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 785 -15.960 0.927 3.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 785 -14.294 0.683 4.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 785 -14.845 1.997 3.093 1.00 0.00 H new ATOM 1188 N LYS A 786 -9.976 -2.574 3.267 1.00 0.00 N ATOM 1189 CA LYS A 786 -8.851 -2.477 4.178 1.00 0.00 C ATOM 1190 C LYS A 786 -7.724 -3.390 3.732 1.00 0.00 C ATOM 1191 O LYS A 786 -6.557 -3.088 3.937 1.00 0.00 O ATOM 1192 CB LYS A 786 -9.273 -2.783 5.616 1.00 0.00 C ATOM 1193 CG LYS A 786 -9.763 -1.563 6.383 1.00 0.00 C ATOM 1194 CD LYS A 786 -10.537 -1.965 7.628 1.00 0.00 C ATOM 1195 CE LYS A 786 -10.862 -0.761 8.497 1.00 0.00 C ATOM 1196 NZ LYS A 786 -9.641 -0.180 9.121 1.00 0.00 N ATOM 0 H LYS A 786 -10.780 -3.086 3.631 1.00 0.00 H new ATOM 0 HA LYS A 786 -8.486 -1.450 4.156 1.00 0.00 H new ATOM 0 HB2 LYS A 786 -10.063 -3.533 5.601 1.00 0.00 H new ATOM 0 HB3 LYS A 786 -8.428 -3.220 6.148 1.00 0.00 H new ATOM 0 HG2 LYS A 786 -8.912 -0.943 6.666 1.00 0.00 H new ATOM 0 HG3 LYS A 786 -10.398 -0.957 5.738 1.00 0.00 H new ATOM 0 HD2 LYS A 786 -11.461 -2.465 7.337 1.00 0.00 H new ATOM 0 HD3 LYS A 786 -9.954 -2.683 8.204 1.00 0.00 H new ATOM 0 HE2 LYS A 786 -11.358 -0.001 7.893 1.00 0.00 H new ATOM 0 HE3 LYS A 786 -11.563 -1.056 9.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 786 -9.891 0.697 9.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 786 -9.238 -0.861 9.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 786 -8.940 0.031 8.382 1.00 0.00 H new ATOM 1210 N LEU A 787 -8.075 -4.530 3.164 1.00 0.00 N ATOM 1211 CA LEU A 787 -7.076 -5.427 2.619 1.00 0.00 C ATOM 1212 C LEU A 787 -6.379 -4.680 1.542 1.00 0.00 C ATOM 1213 O LEU A 787 -5.158 -4.653 1.405 1.00 0.00 O ATOM 1214 CB LEU A 787 -7.764 -6.613 1.978 1.00 0.00 C ATOM 1215 CG LEU A 787 -8.135 -7.698 2.928 1.00 0.00 C ATOM 1216 CD1 LEU A 787 -8.901 -8.772 2.197 1.00 0.00 C ATOM 1217 CD2 LEU A 787 -6.884 -8.207 3.600 1.00 0.00 C ATOM 0 H LEU A 787 -9.038 -4.854 3.069 1.00 0.00 H new ATOM 0 HA LEU A 787 -6.395 -5.769 3.399 1.00 0.00 H new ATOM 0 HB2 LEU A 787 -8.665 -6.265 1.473 1.00 0.00 H new ATOM 0 HB3 LEU A 787 -7.109 -7.027 1.211 1.00 0.00 H new ATOM 0 HG LEU A 787 -8.795 -7.327 3.712 1.00 0.00 H new ATOM 0 HD11 LEU A 787 -9.171 -9.565 2.894 1.00 0.00 H new ATOM 0 HD12 LEU A 787 -9.806 -8.344 1.766 1.00 0.00 H new ATOM 0 HD13 LEU A 787 -8.280 -9.184 1.402 1.00 0.00 H new ATOM 0 HD21 LEU A 787 -7.144 -9.002 4.298 1.00 0.00 H new ATOM 0 HD22 LEU A 787 -6.199 -8.595 2.847 1.00 0.00 H new ATOM 0 HD23 LEU A 787 -6.404 -7.392 4.141 1.00 0.00 H new ATOM 1229 N PHE A 788 -7.246 -4.079 0.791 1.00 0.00 N ATOM 1230 CA PHE A 788 -6.926 -3.277 -0.327 1.00 0.00 C ATOM 1231 C PHE A 788 -6.213 -2.020 0.067 1.00 0.00 C ATOM 1232 O PHE A 788 -5.298 -1.558 -0.614 1.00 0.00 O ATOM 1233 CB PHE A 788 -8.211 -2.966 -0.994 1.00 0.00 C ATOM 1234 CG PHE A 788 -7.924 -2.552 -2.345 1.00 0.00 C ATOM 1235 CD1 PHE A 788 -7.615 -1.274 -2.511 1.00 0.00 C ATOM 1236 CD2 PHE A 788 -7.907 -3.408 -3.411 1.00 0.00 C ATOM 1237 CE1 PHE A 788 -7.291 -0.781 -3.713 1.00 0.00 C ATOM 1238 CE2 PHE A 788 -7.581 -2.930 -4.651 1.00 0.00 C ATOM 1239 CZ PHE A 788 -7.275 -1.607 -4.800 1.00 0.00 C ATOM 0 H PHE A 788 -8.250 -4.144 0.958 1.00 0.00 H new ATOM 0 HA PHE A 788 -6.245 -3.807 -0.992 1.00 0.00 H new ATOM 0 HB2 PHE A 788 -8.862 -3.840 -0.994 1.00 0.00 H new ATOM 0 HB3 PHE A 788 -8.737 -2.177 -0.457 1.00 0.00 H new ATOM 0 HD1 PHE A 788 -7.625 -0.614 -1.656 1.00 0.00 H new ATOM 0 HD2 PHE A 788 -8.149 -4.452 -3.276 1.00 0.00 H new ATOM 0 HE1 PHE A 788 -7.044 0.265 -3.822 1.00 0.00 H new ATOM 0 HE2 PHE A 788 -7.566 -3.592 -5.504 1.00 0.00 H new ATOM 0 HZ PHE A 788 -7.021 -1.216 -5.774 1.00 0.00 H new ATOM 1249 N MET A 789 -6.630 -1.480 1.172 1.00 0.00 N ATOM 1250 CA MET A 789 -6.054 -0.279 1.670 1.00 0.00 C ATOM 1251 C MET A 789 -4.678 -0.597 2.171 1.00 0.00 C ATOM 1252 O MET A 789 -3.695 -0.175 1.607 1.00 0.00 O ATOM 1253 CB MET A 789 -6.912 0.275 2.777 1.00 0.00 C ATOM 1254 CG MET A 789 -8.068 1.105 2.265 1.00 0.00 C ATOM 1255 SD MET A 789 -8.234 2.624 3.184 1.00 0.00 S ATOM 1256 CE MET A 789 -7.772 3.775 1.910 1.00 0.00 C ATOM 0 H MET A 789 -7.379 -1.863 1.749 1.00 0.00 H new ATOM 0 HA MET A 789 -5.992 0.474 0.884 1.00 0.00 H new ATOM 0 HB2 MET A 789 -7.300 -0.549 3.376 1.00 0.00 H new ATOM 0 HB3 MET A 789 -6.296 0.886 3.436 1.00 0.00 H new ATOM 0 HG2 MET A 789 -7.916 1.331 1.210 1.00 0.00 H new ATOM 0 HG3 MET A 789 -8.991 0.530 2.339 1.00 0.00 H new ATOM 0 HE1 MET A 789 -7.339 4.666 2.364 1.00 0.00 H new ATOM 0 HE2 MET A 789 -7.039 3.312 1.250 1.00 0.00 H new ATOM 0 HE3 MET A 789 -8.654 4.053 1.334 1.00 0.00 H new ATOM 1266 N ALA A 790 -4.645 -1.429 3.191 1.00 0.00 N ATOM 1267 CA ALA A 790 -3.413 -1.864 3.823 1.00 0.00 C ATOM 1268 C ALA A 790 -2.349 -2.287 2.830 1.00 0.00 C ATOM 1269 O ALA A 790 -1.204 -1.880 2.952 1.00 0.00 O ATOM 1270 CB ALA A 790 -3.704 -3.044 4.725 1.00 0.00 C ATOM 0 H ALA A 790 -5.484 -1.829 3.612 1.00 0.00 H new ATOM 0 HA ALA A 790 -3.031 -1.009 4.380 1.00 0.00 H new ATOM 0 HB1 ALA A 790 -2.781 -3.374 5.202 1.00 0.00 H new ATOM 0 HB2 ALA A 790 -4.422 -2.749 5.490 1.00 0.00 H new ATOM 0 HB3 ALA A 790 -4.119 -3.860 4.134 1.00 0.00 H new ATOM 1276 N ASP A 791 -2.728 -3.125 1.871 1.00 0.00 N ATOM 1277 CA ASP A 791 -1.785 -3.640 0.887 1.00 0.00 C ATOM 1278 C ASP A 791 -1.337 -2.555 -0.096 1.00 0.00 C ATOM 1279 O ASP A 791 -0.148 -2.344 -0.284 1.00 0.00 O ATOM 1280 CB ASP A 791 -2.381 -4.845 0.170 1.00 0.00 C ATOM 1281 CG ASP A 791 -2.531 -6.043 1.086 1.00 0.00 C ATOM 1282 OD1 ASP A 791 -2.956 -5.856 2.245 1.00 0.00 O ATOM 1283 OD2 ASP A 791 -2.230 -7.170 0.644 1.00 0.00 O ATOM 0 H ASP A 791 -3.684 -3.462 1.755 1.00 0.00 H new ATOM 0 HA ASP A 791 -0.888 -3.966 1.413 1.00 0.00 H new ATOM 0 HB2 ASP A 791 -3.356 -4.577 -0.237 1.00 0.00 H new ATOM 0 HB3 ASP A 791 -1.746 -5.113 -0.674 1.00 0.00 H new ATOM 1288 N LEU A 792 -2.256 -1.866 -0.748 1.00 0.00 N ATOM 1289 CA LEU A 792 -1.832 -0.793 -1.640 1.00 0.00 C ATOM 1290 C LEU A 792 -1.036 0.184 -0.812 1.00 0.00 C ATOM 1291 O LEU A 792 -0.062 0.781 -1.266 1.00 0.00 O ATOM 1292 CB LEU A 792 -3.028 -0.065 -2.255 1.00 0.00 C ATOM 1293 CG LEU A 792 -3.113 -0.081 -3.755 1.00 0.00 C ATOM 1294 CD1 LEU A 792 -4.226 0.837 -4.199 1.00 0.00 C ATOM 1295 CD2 LEU A 792 -1.789 0.325 -4.349 1.00 0.00 C ATOM 0 H LEU A 792 -3.263 -2.017 -0.685 1.00 0.00 H new ATOM 0 HA LEU A 792 -1.245 -1.211 -2.457 1.00 0.00 H new ATOM 0 HB2 LEU A 792 -3.941 -0.507 -1.855 1.00 0.00 H new ATOM 0 HB3 LEU A 792 -3.005 0.973 -1.924 1.00 0.00 H new ATOM 0 HG LEU A 792 -3.337 -1.088 -4.106 1.00 0.00 H new ATOM 0 HD11 LEU A 792 -4.292 0.829 -5.287 1.00 0.00 H new ATOM 0 HD12 LEU A 792 -5.170 0.495 -3.776 1.00 0.00 H new ATOM 0 HD13 LEU A 792 -4.020 1.851 -3.855 1.00 0.00 H new ATOM 0 HD21 LEU A 792 -1.859 0.311 -5.437 1.00 0.00 H new ATOM 0 HD22 LEU A 792 -1.533 1.330 -4.015 1.00 0.00 H new ATOM 0 HD23 LEU A 792 -1.016 -0.372 -4.026 1.00 0.00 H new ATOM 1307 N GLN A 793 -1.466 0.301 0.431 1.00 0.00 N ATOM 1308 CA GLN A 793 -0.830 1.170 1.388 1.00 0.00 C ATOM 1309 C GLN A 793 0.451 0.518 1.829 1.00 0.00 C ATOM 1310 O GLN A 793 1.359 1.156 2.345 1.00 0.00 O ATOM 1311 CB GLN A 793 -1.759 1.436 2.565 1.00 0.00 C ATOM 1312 CG GLN A 793 -2.890 2.367 2.194 1.00 0.00 C ATOM 1313 CD GLN A 793 -3.967 2.469 3.255 1.00 0.00 C ATOM 1314 OE1 GLN A 793 -5.187 2.767 2.817 1.00 0.00 O flip ATOM 1315 NE2 GLN A 793 -3.708 2.289 4.445 1.00 0.00 N flip ATOM 0 H GLN A 793 -2.269 -0.208 0.801 1.00 0.00 H new ATOM 0 HA GLN A 793 -0.606 2.137 0.937 1.00 0.00 H new ATOM 0 HB2 GLN A 793 -2.169 0.492 2.924 1.00 0.00 H new ATOM 0 HB3 GLN A 793 -1.188 1.868 3.387 1.00 0.00 H new ATOM 0 HG2 GLN A 793 -2.484 3.361 2.004 1.00 0.00 H new ATOM 0 HG3 GLN A 793 -3.341 2.024 1.263 1.00 0.00 H new ATOM 0 HE21 GLN A 793 -2.756 2.062 4.731 1.00 0.00 H new ATOM 0 HE22 GLN A 793 -4.446 2.367 5.145 1.00 0.00 H new ATOM 1324 N ARG A 794 0.487 -0.781 1.610 1.00 0.00 N ATOM 1325 CA ARG A 794 1.636 -1.590 1.921 1.00 0.00 C ATOM 1326 C ARG A 794 2.719 -1.280 0.893 1.00 0.00 C ATOM 1327 O ARG A 794 3.909 -1.406 1.175 1.00 0.00 O ATOM 1328 CB ARG A 794 1.237 -3.071 1.920 1.00 0.00 C ATOM 1329 CG ARG A 794 2.262 -3.986 2.527 1.00 0.00 C ATOM 1330 CD ARG A 794 2.187 -3.902 4.029 1.00 0.00 C ATOM 1331 NE ARG A 794 1.712 -5.148 4.624 1.00 0.00 N ATOM 1332 CZ ARG A 794 0.781 -5.203 5.573 1.00 0.00 C ATOM 1333 NH1 ARG A 794 0.234 -4.087 6.036 1.00 0.00 N ATOM 1334 NH2 ARG A 794 0.393 -6.375 6.055 1.00 0.00 N ATOM 0 H ARG A 794 -0.290 -1.304 1.207 1.00 0.00 H new ATOM 0 HA ARG A 794 2.025 -1.367 2.915 1.00 0.00 H new ATOM 0 HB2 ARG A 794 0.299 -3.183 2.464 1.00 0.00 H new ATOM 0 HB3 ARG A 794 1.050 -3.384 0.893 1.00 0.00 H new ATOM 0 HG2 ARG A 794 2.088 -5.011 2.201 1.00 0.00 H new ATOM 0 HG3 ARG A 794 3.259 -3.708 2.186 1.00 0.00 H new ATOM 0 HD2 ARG A 794 3.173 -3.662 4.428 1.00 0.00 H new ATOM 0 HD3 ARG A 794 1.521 -3.087 4.314 1.00 0.00 H new ATOM 0 HE ARG A 794 2.116 -6.024 4.294 1.00 0.00 H new ATOM 0 HH11 ARG A 794 0.527 -3.183 5.665 1.00 0.00 H new ATOM 0 HH12 ARG A 794 -0.479 -4.132 6.764 1.00 0.00 H new ATOM 0 HH21 ARG A 794 0.808 -7.236 5.698 1.00 0.00 H new ATOM 0 HH22 ARG A 794 -0.321 -6.416 6.783 1.00 0.00 H new ATOM 1348 N VAL A 795 2.288 -0.850 -0.307 1.00 0.00 N ATOM 1349 CA VAL A 795 3.233 -0.465 -1.349 1.00 0.00 C ATOM 1350 C VAL A 795 3.729 0.941 -1.048 1.00 0.00 C ATOM 1351 O VAL A 795 4.920 1.153 -0.894 1.00 0.00 O ATOM 1352 CB VAL A 795 2.656 -0.565 -2.801 1.00 0.00 C ATOM 1353 CG1 VAL A 795 1.456 -1.478 -2.827 1.00 0.00 C ATOM 1354 CG2 VAL A 795 2.303 0.787 -3.418 1.00 0.00 C ATOM 0 H VAL A 795 1.306 -0.764 -0.568 1.00 0.00 H new ATOM 0 HA VAL A 795 4.058 -1.178 -1.331 1.00 0.00 H new ATOM 0 HB VAL A 795 3.454 -0.982 -3.415 1.00 0.00 H new ATOM 0 HG11 VAL A 795 1.066 -1.537 -3.843 1.00 0.00 H new ATOM 0 HG12 VAL A 795 1.749 -2.473 -2.492 1.00 0.00 H new ATOM 0 HG13 VAL A 795 0.685 -1.084 -2.165 1.00 0.00 H new ATOM 0 HG21 VAL A 795 1.910 0.637 -4.423 1.00 0.00 H new ATOM 0 HG22 VAL A 795 1.550 1.282 -2.804 1.00 0.00 H new ATOM 0 HG23 VAL A 795 3.197 1.409 -3.467 1.00 0.00 H new ATOM 1364 N PHE A 796 2.802 1.888 -0.900 1.00 0.00 N ATOM 1365 CA PHE A 796 3.176 3.267 -0.594 1.00 0.00 C ATOM 1366 C PHE A 796 4.056 3.292 0.647 1.00 0.00 C ATOM 1367 O PHE A 796 5.135 3.863 0.635 1.00 0.00 O ATOM 1368 CB PHE A 796 1.955 4.155 -0.349 1.00 0.00 C ATOM 1369 CG PHE A 796 0.745 3.793 -1.161 1.00 0.00 C ATOM 1370 CD1 PHE A 796 0.833 3.540 -2.511 1.00 0.00 C ATOM 1371 CD2 PHE A 796 -0.479 3.677 -0.559 1.00 0.00 C ATOM 1372 CE1 PHE A 796 -0.273 3.178 -3.240 1.00 0.00 C ATOM 1373 CE2 PHE A 796 -1.584 3.317 -1.286 1.00 0.00 C ATOM 1374 CZ PHE A 796 -1.472 3.066 -2.632 1.00 0.00 C ATOM 0 H PHE A 796 1.798 1.728 -0.986 1.00 0.00 H new ATOM 0 HA PHE A 796 3.713 3.658 -1.458 1.00 0.00 H new ATOM 0 HB2 PHE A 796 1.694 4.108 0.708 1.00 0.00 H new ATOM 0 HB3 PHE A 796 2.225 5.189 -0.565 1.00 0.00 H new ATOM 0 HD1 PHE A 796 1.789 3.628 -3.006 1.00 0.00 H new ATOM 0 HD2 PHE A 796 -0.575 3.871 0.499 1.00 0.00 H new ATOM 0 HE1 PHE A 796 -0.183 2.983 -4.298 1.00 0.00 H new ATOM 0 HE2 PHE A 796 -2.544 3.231 -0.800 1.00 0.00 H new ATOM 0 HZ PHE A 796 -2.343 2.779 -3.203 1.00 0.00 H new ATOM 1384 N THR A 797 3.585 2.641 1.714 1.00 0.00 N ATOM 1385 CA THR A 797 4.318 2.593 2.979 1.00 0.00 C ATOM 1386 C THR A 797 5.710 1.998 2.797 1.00 0.00 C ATOM 1387 O THR A 797 6.677 2.535 3.322 1.00 0.00 O ATOM 1388 CB THR A 797 3.560 1.785 4.066 1.00 0.00 C ATOM 1389 OG1 THR A 797 3.936 2.245 5.369 1.00 0.00 O ATOM 1390 CG2 THR A 797 3.853 0.297 3.955 1.00 0.00 C ATOM 0 H THR A 797 2.697 2.139 1.725 1.00 0.00 H new ATOM 0 HA THR A 797 4.408 3.627 3.313 1.00 0.00 H new ATOM 0 HB THR A 797 2.492 1.940 3.911 1.00 0.00 H new ATOM 0 HG1 THR A 797 4.875 2.022 5.536 1.00 0.00 H new ATOM 0 HG21 THR A 797 3.307 -0.240 4.730 1.00 0.00 H new ATOM 0 HG22 THR A 797 3.540 -0.063 2.975 1.00 0.00 H new ATOM 0 HG23 THR A 797 4.922 0.126 4.080 1.00 0.00 H new ATOM 1398 N ASN A 798 5.810 0.883 2.071 1.00 0.00 N ATOM 1399 CA ASN A 798 7.099 0.249 1.845 1.00 0.00 C ATOM 1400 C ASN A 798 7.937 1.116 0.919 1.00 0.00 C ATOM 1401 O ASN A 798 9.167 1.140 1.006 1.00 0.00 O ATOM 1402 CB ASN A 798 6.924 -1.170 1.286 1.00 0.00 C ATOM 1403 CG ASN A 798 6.560 -1.228 -0.186 1.00 0.00 C ATOM 1404 OD1 ASN A 798 7.012 -0.422 -0.992 1.00 0.00 O ATOM 1405 ND2 ASN A 798 5.745 -2.209 -0.546 1.00 0.00 N ATOM 0 H ASN A 798 5.019 0.408 1.636 1.00 0.00 H new ATOM 0 HA ASN A 798 7.622 0.154 2.797 1.00 0.00 H new ATOM 0 HB2 ASN A 798 7.850 -1.724 1.440 1.00 0.00 H new ATOM 0 HB3 ASN A 798 6.149 -1.679 1.859 1.00 0.00 H new ATOM 0 HD21 ASN A 798 5.473 -2.313 -1.524 1.00 0.00 H new ATOM 0 HD22 ASN A 798 5.390 -2.860 0.154 1.00 0.00 H new ATOM 1412 N CYS A 799 7.253 1.866 0.063 1.00 0.00 N ATOM 1413 CA CYS A 799 7.912 2.736 -0.873 1.00 0.00 C ATOM 1414 C CYS A 799 8.362 3.986 -0.150 1.00 0.00 C ATOM 1415 O CYS A 799 9.280 4.680 -0.555 1.00 0.00 O ATOM 1416 CB CYS A 799 6.976 3.025 -2.028 1.00 0.00 C ATOM 1417 SG CYS A 799 6.496 1.525 -2.907 1.00 0.00 S ATOM 0 H CYS A 799 6.235 1.881 0.007 1.00 0.00 H new ATOM 0 HA CYS A 799 8.802 2.265 -1.291 1.00 0.00 H new ATOM 0 HB2 CYS A 799 6.083 3.526 -1.654 1.00 0.00 H new ATOM 0 HB3 CYS A 799 7.460 3.712 -2.722 1.00 0.00 H new ATOM 0 HG CYS A 799 6.209 0.592 -2.048 1.00 0.00 H new ATOM 1423 N LYS A 800 7.634 4.270 0.898 1.00 0.00 N ATOM 1424 CA LYS A 800 7.878 5.384 1.784 1.00 0.00 C ATOM 1425 C LYS A 800 8.808 4.988 2.938 1.00 0.00 C ATOM 1426 O LYS A 800 9.425 5.826 3.590 1.00 0.00 O ATOM 1427 CB LYS A 800 6.536 5.820 2.258 1.00 0.00 C ATOM 1428 CG LYS A 800 5.841 6.625 1.190 1.00 0.00 C ATOM 1429 CD LYS A 800 4.948 7.669 1.774 1.00 0.00 C ATOM 1430 CE LYS A 800 3.676 7.053 2.290 1.00 0.00 C ATOM 1431 NZ LYS A 800 3.855 6.410 3.622 1.00 0.00 N ATOM 0 H LYS A 800 6.824 3.713 1.170 1.00 0.00 H new ATOM 0 HA LYS A 800 8.393 6.200 1.277 1.00 0.00 H new ATOM 0 HB2 LYS A 800 5.933 4.949 2.517 1.00 0.00 H new ATOM 0 HB3 LYS A 800 6.639 6.417 3.164 1.00 0.00 H new ATOM 0 HG2 LYS A 800 6.585 7.100 0.551 1.00 0.00 H new ATOM 0 HG3 LYS A 800 5.255 5.959 0.556 1.00 0.00 H new ATOM 0 HD2 LYS A 800 5.464 8.184 2.585 1.00 0.00 H new ATOM 0 HD3 LYS A 800 4.714 8.419 1.018 1.00 0.00 H new ATOM 0 HE2 LYS A 800 2.906 7.822 2.361 1.00 0.00 H new ATOM 0 HE3 LYS A 800 3.320 6.310 1.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 800 3.740 5.381 3.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 800 4.807 6.621 3.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 800 3.143 6.779 4.284 1.00 0.00 H new ATOM 1445 N GLU A 801 8.868 3.683 3.180 1.00 0.00 N ATOM 1446 CA GLU A 801 9.666 3.103 4.271 1.00 0.00 C ATOM 1447 C GLU A 801 11.151 3.059 3.977 1.00 0.00 C ATOM 1448 O GLU A 801 11.965 3.693 4.646 1.00 0.00 O ATOM 1449 CB GLU A 801 9.237 1.648 4.465 1.00 0.00 C ATOM 1450 CG GLU A 801 8.632 1.341 5.827 1.00 0.00 C ATOM 1451 CD GLU A 801 7.719 2.443 6.329 1.00 0.00 C ATOM 1452 OE1 GLU A 801 6.511 2.402 6.018 1.00 0.00 O ATOM 1453 OE2 GLU A 801 8.213 3.349 7.034 1.00 0.00 O ATOM 0 H GLU A 801 8.365 2.989 2.627 1.00 0.00 H new ATOM 0 HA GLU A 801 9.496 3.735 5.143 1.00 0.00 H new ATOM 0 HB2 GLU A 801 8.511 1.391 3.694 1.00 0.00 H new ATOM 0 HB3 GLU A 801 10.104 1.004 4.314 1.00 0.00 H new ATOM 0 HG2 GLU A 801 8.070 0.409 5.767 1.00 0.00 H new ATOM 0 HG3 GLU A 801 9.434 1.184 6.548 1.00 0.00 H new ATOM 1460 N TYR A 802 11.471 2.295 2.956 1.00 0.00 N ATOM 1461 CA TYR A 802 12.836 2.075 2.532 1.00 0.00 C ATOM 1462 C TYR A 802 13.378 3.266 1.801 1.00 0.00 C ATOM 1463 O TYR A 802 14.327 3.922 2.219 1.00 0.00 O ATOM 1464 CB TYR A 802 12.799 0.912 1.551 1.00 0.00 C ATOM 1465 CG TYR A 802 14.080 0.584 0.835 1.00 0.00 C ATOM 1466 CD1 TYR A 802 15.319 1.134 1.143 1.00 0.00 C ATOM 1467 CD2 TYR A 802 14.007 -0.295 -0.190 1.00 0.00 C ATOM 1468 CE1 TYR A 802 16.446 0.781 0.418 1.00 0.00 C ATOM 1469 CE2 TYR A 802 15.098 -0.657 -0.922 1.00 0.00 C ATOM 1470 CZ TYR A 802 16.325 -0.122 -0.620 1.00 0.00 C ATOM 1471 OH TYR A 802 17.425 -0.488 -1.355 1.00 0.00 O ATOM 0 H TYR A 802 10.781 1.802 2.389 1.00 0.00 H new ATOM 0 HA TYR A 802 13.465 1.886 3.402 1.00 0.00 H new ATOM 0 HB2 TYR A 802 12.475 0.023 2.092 1.00 0.00 H new ATOM 0 HB3 TYR A 802 12.037 1.125 0.802 1.00 0.00 H new ATOM 0 HD1 TYR A 802 15.404 1.842 1.954 1.00 0.00 H new ATOM 0 HD2 TYR A 802 13.048 -0.726 -0.438 1.00 0.00 H new ATOM 0 HE1 TYR A 802 17.408 1.207 0.662 1.00 0.00 H new ATOM 0 HE2 TYR A 802 14.998 -1.361 -1.735 1.00 0.00 H new ATOM 0 HH TYR A 802 18.240 -0.249 -0.865 1.00 0.00 H new ATOM 1481 N ASN A 803 12.701 3.536 0.724 1.00 0.00 N ATOM 1482 CA ASN A 803 13.060 4.588 -0.188 1.00 0.00 C ATOM 1483 C ASN A 803 13.168 5.941 0.477 1.00 0.00 C ATOM 1484 O ASN A 803 12.646 6.158 1.569 1.00 0.00 O ATOM 1485 CB ASN A 803 12.008 4.639 -1.274 1.00 0.00 C ATOM 1486 CG ASN A 803 11.805 3.285 -1.939 1.00 0.00 C ATOM 1487 OD1 ASN A 803 12.734 2.483 -2.034 1.00 0.00 O ATOM 1488 ND2 ASN A 803 10.585 3.023 -2.404 1.00 0.00 N ATOM 0 H ASN A 803 11.865 3.021 0.447 1.00 0.00 H new ATOM 0 HA ASN A 803 14.048 4.365 -0.591 1.00 0.00 H new ATOM 0 HB2 ASN A 803 11.064 4.978 -0.848 1.00 0.00 H new ATOM 0 HB3 ASN A 803 12.300 5.372 -2.026 1.00 0.00 H new ATOM 0 HD21 ASN A 803 10.393 2.130 -2.859 1.00 0.00 H new ATOM 0 HD22 ASN A 803 9.842 3.715 -2.305 1.00 0.00 H new ATOM 1495 N PRO A 804 13.934 6.840 -0.160 1.00 0.00 N ATOM 1496 CA PRO A 804 14.093 8.222 0.277 1.00 0.00 C ATOM 1497 C PRO A 804 13.083 9.132 -0.428 1.00 0.00 C ATOM 1498 O PRO A 804 12.780 8.926 -1.597 1.00 0.00 O ATOM 1499 CB PRO A 804 15.495 8.542 -0.190 1.00 0.00 C ATOM 1500 CG PRO A 804 15.611 7.802 -1.484 1.00 0.00 C ATOM 1501 CD PRO A 804 14.794 6.545 -1.327 1.00 0.00 C ATOM 0 HA PRO A 804 13.934 8.364 1.346 1.00 0.00 H new ATOM 0 HB2 PRO A 804 15.637 9.614 -0.327 1.00 0.00 H new ATOM 0 HB3 PRO A 804 16.243 8.210 0.530 1.00 0.00 H new ATOM 0 HG2 PRO A 804 15.240 8.406 -2.312 1.00 0.00 H new ATOM 0 HG3 PRO A 804 16.652 7.564 -1.704 1.00 0.00 H new ATOM 0 HD2 PRO A 804 14.203 6.335 -2.219 1.00 0.00 H new ATOM 0 HD3 PRO A 804 15.426 5.674 -1.151 1.00 0.00 H new ATOM 1509 N PRO A 805 12.569 10.163 0.256 1.00 0.00 N ATOM 1510 CA PRO A 805 11.564 11.069 -0.315 1.00 0.00 C ATOM 1511 C PRO A 805 12.130 11.945 -1.432 1.00 0.00 C ATOM 1512 O PRO A 805 11.490 12.904 -1.863 1.00 0.00 O ATOM 1513 CB PRO A 805 11.135 11.937 0.875 1.00 0.00 C ATOM 1514 CG PRO A 805 11.710 11.274 2.083 1.00 0.00 C ATOM 1515 CD PRO A 805 12.937 10.554 1.613 1.00 0.00 C ATOM 0 HA PRO A 805 10.744 10.517 -0.774 1.00 0.00 H new ATOM 0 HB2 PRO A 805 11.508 12.956 0.772 1.00 0.00 H new ATOM 0 HB3 PRO A 805 10.049 12.001 0.942 1.00 0.00 H new ATOM 0 HG2 PRO A 805 11.958 12.008 2.850 1.00 0.00 H new ATOM 0 HG3 PRO A 805 10.995 10.580 2.525 1.00 0.00 H new ATOM 0 HD2 PRO A 805 13.816 11.198 1.626 1.00 0.00 H new ATOM 0 HD3 PRO A 805 13.165 9.690 2.237 1.00 0.00 H new ATOM 1523 N GLU A 806 13.333 11.611 -1.899 1.00 0.00 N ATOM 1524 CA GLU A 806 13.980 12.377 -2.959 1.00 0.00 C ATOM 1525 C GLU A 806 14.235 11.523 -4.201 1.00 0.00 C ATOM 1526 O GLU A 806 14.427 12.049 -5.298 1.00 0.00 O ATOM 1527 CB GLU A 806 15.302 12.955 -2.456 1.00 0.00 C ATOM 1528 CG GLU A 806 15.150 13.861 -1.245 1.00 0.00 C ATOM 1529 CD GLU A 806 16.472 14.441 -0.781 1.00 0.00 C ATOM 1530 OE1 GLU A 806 17.157 13.783 0.030 1.00 0.00 O ATOM 1531 OE2 GLU A 806 16.823 15.553 -1.230 1.00 0.00 O ATOM 0 H GLU A 806 13.876 10.817 -1.560 1.00 0.00 H new ATOM 0 HA GLU A 806 13.305 13.186 -3.238 1.00 0.00 H new ATOM 0 HB2 GLU A 806 15.974 12.135 -2.203 1.00 0.00 H new ATOM 0 HB3 GLU A 806 15.773 13.517 -3.262 1.00 0.00 H new ATOM 0 HG2 GLU A 806 14.466 14.674 -1.488 1.00 0.00 H new ATOM 0 HG3 GLU A 806 14.698 13.297 -0.429 1.00 0.00 H new ATOM 1538 N SER A 807 14.237 10.208 -4.017 1.00 0.00 N ATOM 1539 CA SER A 807 14.471 9.266 -5.114 1.00 0.00 C ATOM 1540 C SER A 807 13.497 9.494 -6.256 1.00 0.00 C ATOM 1541 O SER A 807 13.758 10.266 -7.179 1.00 0.00 O ATOM 1542 CB SER A 807 14.304 7.851 -4.602 1.00 0.00 C ATOM 1543 OG SER A 807 13.203 7.786 -3.719 1.00 0.00 O ATOM 0 H SER A 807 14.078 9.764 -3.113 1.00 0.00 H new ATOM 0 HA SER A 807 15.483 9.423 -5.486 1.00 0.00 H new ATOM 0 HB2 SER A 807 14.152 7.168 -5.438 1.00 0.00 H new ATOM 0 HB3 SER A 807 15.211 7.531 -4.090 1.00 0.00 H new ATOM 0 HG SER A 807 12.775 6.907 -3.794 1.00 0.00 H new ATOM 1549 N GLU A 808 12.369 8.808 -6.166 1.00 0.00 N ATOM 1550 CA GLU A 808 11.325 8.887 -7.165 1.00 0.00 C ATOM 1551 C GLU A 808 10.142 8.047 -6.718 1.00 0.00 C ATOM 1552 O GLU A 808 9.002 8.510 -6.723 1.00 0.00 O ATOM 1553 CB GLU A 808 11.843 8.398 -8.518 1.00 0.00 C ATOM 1554 CG GLU A 808 10.757 8.260 -9.566 1.00 0.00 C ATOM 1555 CD GLU A 808 10.015 9.559 -9.818 1.00 0.00 C ATOM 1556 OE1 GLU A 808 9.069 9.860 -9.062 1.00 0.00 O ATOM 1557 OE2 GLU A 808 10.382 10.278 -10.772 1.00 0.00 O ATOM 0 H GLU A 808 12.154 8.179 -5.393 1.00 0.00 H new ATOM 0 HA GLU A 808 11.011 9.925 -7.277 1.00 0.00 H new ATOM 0 HB2 GLU A 808 12.601 9.092 -8.881 1.00 0.00 H new ATOM 0 HB3 GLU A 808 12.332 7.433 -8.384 1.00 0.00 H new ATOM 0 HG2 GLU A 808 11.201 7.913 -10.499 1.00 0.00 H new ATOM 0 HG3 GLU A 808 10.047 7.497 -9.248 1.00 0.00 H new ATOM 1564 N TYR A 809 10.423 6.807 -6.319 1.00 0.00 N ATOM 1565 CA TYR A 809 9.375 5.910 -5.856 1.00 0.00 C ATOM 1566 C TYR A 809 8.703 6.432 -4.595 1.00 0.00 C ATOM 1567 O TYR A 809 7.483 6.370 -4.460 1.00 0.00 O ATOM 1568 CB TYR A 809 9.898 4.511 -5.579 1.00 0.00 C ATOM 1569 CG TYR A 809 11.368 4.412 -5.284 1.00 0.00 C ATOM 1570 CD1 TYR A 809 12.001 5.217 -4.370 1.00 0.00 C ATOM 1571 CD2 TYR A 809 12.118 3.469 -5.915 1.00 0.00 C ATOM 1572 CE1 TYR A 809 13.349 5.062 -4.119 1.00 0.00 C ATOM 1573 CE2 TYR A 809 13.428 3.311 -5.672 1.00 0.00 C ATOM 1574 CZ TYR A 809 14.058 4.106 -4.771 1.00 0.00 C ATOM 1575 OH TYR A 809 15.398 3.944 -4.517 1.00 0.00 O ATOM 0 H TYR A 809 11.361 6.407 -6.308 1.00 0.00 H new ATOM 0 HA TYR A 809 8.647 5.865 -6.666 1.00 0.00 H new ATOM 0 HB2 TYR A 809 9.348 4.098 -4.734 1.00 0.00 H new ATOM 0 HB3 TYR A 809 9.676 3.883 -6.441 1.00 0.00 H new ATOM 0 HD1 TYR A 809 11.441 5.976 -3.844 1.00 0.00 H new ATOM 0 HD2 TYR A 809 11.642 2.824 -6.638 1.00 0.00 H new ATOM 0 HE1 TYR A 809 13.841 5.703 -3.402 1.00 0.00 H new ATOM 0 HE2 TYR A 809 13.984 2.547 -6.196 1.00 0.00 H new ATOM 0 HH TYR A 809 15.693 3.074 -4.858 1.00 0.00 H new ATOM 1585 N TYR A 810 9.506 6.938 -3.668 1.00 0.00 N ATOM 1586 CA TYR A 810 8.988 7.440 -2.403 1.00 0.00 C ATOM 1587 C TYR A 810 7.874 8.448 -2.625 1.00 0.00 C ATOM 1588 O TYR A 810 6.750 8.249 -2.168 1.00 0.00 O ATOM 1589 CB TYR A 810 10.103 8.080 -1.578 1.00 0.00 C ATOM 1590 CG TYR A 810 9.748 8.267 -0.120 1.00 0.00 C ATOM 1591 CD1 TYR A 810 8.522 8.769 0.253 1.00 0.00 C ATOM 1592 CD2 TYR A 810 10.642 7.937 0.879 1.00 0.00 C ATOM 1593 CE1 TYR A 810 8.194 8.936 1.575 1.00 0.00 C ATOM 1594 CE2 TYR A 810 10.328 8.102 2.210 1.00 0.00 C ATOM 1595 CZ TYR A 810 9.098 8.604 2.555 1.00 0.00 C ATOM 1596 OH TYR A 810 8.769 8.771 3.881 1.00 0.00 O ATOM 0 H TYR A 810 10.518 7.011 -3.769 1.00 0.00 H new ATOM 0 HA TYR A 810 8.582 6.589 -1.856 1.00 0.00 H new ATOM 0 HB2 TYR A 810 10.997 7.460 -1.649 1.00 0.00 H new ATOM 0 HB3 TYR A 810 10.352 9.049 -2.010 1.00 0.00 H new ATOM 0 HD1 TYR A 810 7.805 9.036 -0.509 1.00 0.00 H new ATOM 0 HD2 TYR A 810 11.610 7.540 0.611 1.00 0.00 H new ATOM 0 HE1 TYR A 810 7.225 9.329 1.845 1.00 0.00 H new ATOM 0 HE2 TYR A 810 11.043 7.839 2.975 1.00 0.00 H new ATOM 0 HH TYR A 810 8.852 7.914 4.349 1.00 0.00 H new ATOM 1606 N LYS A 811 8.180 9.540 -3.302 1.00 0.00 N ATOM 1607 CA LYS A 811 7.163 10.544 -3.561 1.00 0.00 C ATOM 1608 C LYS A 811 6.068 9.912 -4.380 1.00 0.00 C ATOM 1609 O LYS A 811 4.909 10.252 -4.243 1.00 0.00 O ATOM 1610 CB LYS A 811 7.729 11.747 -4.305 1.00 0.00 C ATOM 1611 CG LYS A 811 9.236 11.836 -4.241 1.00 0.00 C ATOM 1612 CD LYS A 811 9.810 12.649 -5.392 1.00 0.00 C ATOM 1613 CE LYS A 811 9.564 11.981 -6.737 1.00 0.00 C ATOM 1614 NZ LYS A 811 8.300 12.448 -7.371 1.00 0.00 N ATOM 0 H LYS A 811 9.105 9.753 -3.676 1.00 0.00 H new ATOM 0 HA LYS A 811 6.778 10.903 -2.607 1.00 0.00 H new ATOM 0 HB2 LYS A 811 7.419 11.698 -5.349 1.00 0.00 H new ATOM 0 HB3 LYS A 811 7.300 12.658 -3.887 1.00 0.00 H new ATOM 0 HG2 LYS A 811 9.532 12.289 -3.295 1.00 0.00 H new ATOM 0 HG3 LYS A 811 9.659 10.832 -4.260 1.00 0.00 H new ATOM 0 HD2 LYS A 811 9.362 13.643 -5.393 1.00 0.00 H new ATOM 0 HD3 LYS A 811 10.882 12.782 -5.243 1.00 0.00 H new ATOM 0 HE2 LYS A 811 10.401 12.189 -7.403 1.00 0.00 H new ATOM 0 HE3 LYS A 811 9.524 10.900 -6.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 811 7.637 11.651 -7.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 811 7.874 13.195 -6.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 811 8.505 12.825 -8.318 1.00 0.00 H new ATOM 1628 N CYS A 812 6.461 8.990 -5.243 1.00 0.00 N ATOM 1629 CA CYS A 812 5.512 8.275 -6.072 1.00 0.00 C ATOM 1630 C CYS A 812 4.585 7.455 -5.193 1.00 0.00 C ATOM 1631 O CYS A 812 3.507 7.057 -5.609 1.00 0.00 O ATOM 1632 CB CYS A 812 6.250 7.362 -7.048 1.00 0.00 C ATOM 1633 SG CYS A 812 6.722 8.156 -8.601 1.00 0.00 S ATOM 0 H CYS A 812 7.434 8.720 -5.386 1.00 0.00 H new ATOM 0 HA CYS A 812 4.924 8.994 -6.643 1.00 0.00 H new ATOM 0 HB2 CYS A 812 7.148 6.980 -6.562 1.00 0.00 H new ATOM 0 HB3 CYS A 812 5.618 6.502 -7.271 1.00 0.00 H new ATOM 0 HG CYS A 812 7.913 8.664 -8.484 1.00 0.00 H new ATOM 1639 N ALA A 813 5.024 7.204 -3.969 1.00 0.00 N ATOM 1640 CA ALA A 813 4.235 6.445 -3.016 1.00 0.00 C ATOM 1641 C ALA A 813 3.201 7.342 -2.373 1.00 0.00 C ATOM 1642 O ALA A 813 2.035 6.989 -2.283 1.00 0.00 O ATOM 1643 CB ALA A 813 5.131 5.817 -1.969 1.00 0.00 C ATOM 0 H ALA A 813 5.927 7.517 -3.613 1.00 0.00 H new ATOM 0 HA ALA A 813 3.718 5.642 -3.542 1.00 0.00 H new ATOM 0 HB1 ALA A 813 4.524 5.252 -1.262 1.00 0.00 H new ATOM 0 HB2 ALA A 813 5.842 5.148 -2.453 1.00 0.00 H new ATOM 0 HB3 ALA A 813 5.673 6.599 -1.437 1.00 0.00 H new ATOM 1649 N ASN A 814 3.650 8.504 -1.933 1.00 0.00 N ATOM 1650 CA ASN A 814 2.796 9.493 -1.321 1.00 0.00 C ATOM 1651 C ASN A 814 1.829 10.050 -2.362 1.00 0.00 C ATOM 1652 O ASN A 814 0.627 10.174 -2.130 1.00 0.00 O ATOM 1653 CB ASN A 814 3.682 10.608 -0.797 1.00 0.00 C ATOM 1654 CG ASN A 814 2.999 11.468 0.248 1.00 0.00 C ATOM 1655 OD1 ASN A 814 2.117 11.004 0.972 1.00 0.00 O ATOM 1656 ND2 ASN A 814 3.405 12.729 0.335 1.00 0.00 N ATOM 0 H ASN A 814 4.629 8.786 -1.993 1.00 0.00 H new ATOM 0 HA ASN A 814 2.218 9.051 -0.509 1.00 0.00 H new ATOM 0 HB2 ASN A 814 4.586 10.175 -0.368 1.00 0.00 H new ATOM 0 HB3 ASN A 814 3.994 11.238 -1.630 1.00 0.00 H new ATOM 0 HD21 ASN A 814 2.983 13.354 1.021 1.00 0.00 H new ATOM 0 HD22 ASN A 814 4.139 13.072 -0.285 1.00 0.00 H new ATOM 1663 N ILE A 815 2.397 10.356 -3.520 1.00 0.00 N ATOM 1664 CA ILE A 815 1.668 10.907 -4.658 1.00 0.00 C ATOM 1665 C ILE A 815 0.570 9.963 -5.072 1.00 0.00 C ATOM 1666 O ILE A 815 -0.576 10.355 -5.273 1.00 0.00 O ATOM 1667 CB ILE A 815 2.604 11.137 -5.854 1.00 0.00 C ATOM 1668 CG1 ILE A 815 3.331 12.460 -5.697 1.00 0.00 C ATOM 1669 CG2 ILE A 815 1.838 11.097 -7.161 1.00 0.00 C ATOM 1670 CD1 ILE A 815 4.719 12.434 -6.254 1.00 0.00 C ATOM 0 H ILE A 815 3.393 10.227 -3.700 1.00 0.00 H new ATOM 0 HA ILE A 815 1.243 11.863 -4.352 1.00 0.00 H new ATOM 0 HB ILE A 815 3.339 10.333 -5.877 1.00 0.00 H new ATOM 0 HG12 ILE A 815 2.760 13.243 -6.195 1.00 0.00 H new ATOM 0 HG13 ILE A 815 3.375 12.721 -4.640 1.00 0.00 H new ATOM 0 HG21 ILE A 815 2.525 11.263 -7.991 1.00 0.00 H new ATOM 0 HG22 ILE A 815 1.361 10.123 -7.274 1.00 0.00 H new ATOM 0 HG23 ILE A 815 1.076 11.876 -7.160 1.00 0.00 H new ATOM 0 HD11 ILE A 815 5.187 13.408 -6.112 1.00 0.00 H new ATOM 0 HD12 ILE A 815 5.304 11.672 -5.738 1.00 0.00 H new ATOM 0 HD13 ILE A 815 4.680 12.203 -7.318 1.00 0.00 H new ATOM 1682 N LEU A 816 0.950 8.716 -5.233 1.00 0.00 N ATOM 1683 CA LEU A 816 0.008 7.692 -5.590 1.00 0.00 C ATOM 1684 C LEU A 816 -0.981 7.557 -4.464 1.00 0.00 C ATOM 1685 O LEU A 816 -2.181 7.619 -4.665 1.00 0.00 O ATOM 1686 CB LEU A 816 0.731 6.378 -5.819 1.00 0.00 C ATOM 1687 CG LEU A 816 0.058 5.422 -6.774 1.00 0.00 C ATOM 1688 CD1 LEU A 816 0.836 4.147 -6.828 1.00 0.00 C ATOM 1689 CD2 LEU A 816 -1.357 5.194 -6.359 1.00 0.00 C ATOM 0 H LEU A 816 1.910 8.390 -5.121 1.00 0.00 H new ATOM 0 HA LEU A 816 -0.510 7.957 -6.512 1.00 0.00 H new ATOM 0 HB2 LEU A 816 1.731 6.595 -6.194 1.00 0.00 H new ATOM 0 HB3 LEU A 816 0.852 5.878 -4.858 1.00 0.00 H new ATOM 0 HG LEU A 816 0.037 5.849 -7.777 1.00 0.00 H new ATOM 0 HD11 LEU A 816 0.352 3.455 -7.517 1.00 0.00 H new ATOM 0 HD12 LEU A 816 1.849 4.353 -7.173 1.00 0.00 H new ATOM 0 HD13 LEU A 816 0.875 3.702 -5.834 1.00 0.00 H new ATOM 0 HD21 LEU A 816 -1.833 4.503 -7.055 1.00 0.00 H new ATOM 0 HD22 LEU A 816 -1.378 4.770 -5.355 1.00 0.00 H new ATOM 0 HD23 LEU A 816 -1.895 6.142 -6.364 1.00 0.00 H new ATOM 1701 N GLU A 817 -0.446 7.404 -3.271 1.00 0.00 N ATOM 1702 CA GLU A 817 -1.253 7.276 -2.077 1.00 0.00 C ATOM 1703 C GLU A 817 -2.322 8.378 -2.035 1.00 0.00 C ATOM 1704 O GLU A 817 -3.363 8.232 -1.413 1.00 0.00 O ATOM 1705 CB GLU A 817 -0.345 7.359 -0.855 1.00 0.00 C ATOM 1706 CG GLU A 817 -1.031 6.954 0.434 1.00 0.00 C ATOM 1707 CD GLU A 817 -0.074 6.875 1.607 1.00 0.00 C ATOM 1708 OE1 GLU A 817 0.130 7.910 2.277 1.00 0.00 O ATOM 1709 OE2 GLU A 817 0.471 5.779 1.856 1.00 0.00 O ATOM 0 H GLU A 817 0.559 7.365 -3.102 1.00 0.00 H new ATOM 0 HA GLU A 817 -1.765 6.314 -2.081 1.00 0.00 H new ATOM 0 HB2 GLU A 817 0.523 6.719 -1.013 1.00 0.00 H new ATOM 0 HB3 GLU A 817 0.025 8.379 -0.756 1.00 0.00 H new ATOM 0 HG2 GLU A 817 -1.820 7.671 0.662 1.00 0.00 H new ATOM 0 HG3 GLU A 817 -1.511 5.985 0.296 1.00 0.00 H new ATOM 1716 N LYS A 818 -2.039 9.487 -2.697 1.00 0.00 N ATOM 1717 CA LYS A 818 -2.967 10.605 -2.781 1.00 0.00 C ATOM 1718 C LYS A 818 -4.048 10.310 -3.811 1.00 0.00 C ATOM 1719 O LYS A 818 -5.231 10.226 -3.490 1.00 0.00 O ATOM 1720 CB LYS A 818 -2.187 11.810 -3.226 1.00 0.00 C ATOM 1721 CG LYS A 818 -1.519 12.574 -2.120 1.00 0.00 C ATOM 1722 CD LYS A 818 -0.324 13.343 -2.654 1.00 0.00 C ATOM 1723 CE LYS A 818 0.870 13.198 -1.737 1.00 0.00 C ATOM 1724 NZ LYS A 818 0.585 13.702 -0.366 1.00 0.00 N ATOM 0 H LYS A 818 -1.160 9.639 -3.192 1.00 0.00 H new ATOM 0 HA LYS A 818 -3.439 10.774 -1.813 1.00 0.00 H new ATOM 0 HB2 LYS A 818 -1.426 11.490 -3.938 1.00 0.00 H new ATOM 0 HB3 LYS A 818 -2.859 12.483 -3.759 1.00 0.00 H new ATOM 0 HG2 LYS A 818 -2.230 13.264 -1.665 1.00 0.00 H new ATOM 0 HG3 LYS A 818 -1.197 11.887 -1.338 1.00 0.00 H new ATOM 0 HD2 LYS A 818 -0.069 12.979 -3.649 1.00 0.00 H new ATOM 0 HD3 LYS A 818 -0.582 14.397 -2.756 1.00 0.00 H new ATOM 0 HE2 LYS A 818 1.161 12.149 -1.684 1.00 0.00 H new ATOM 0 HE3 LYS A 818 1.716 13.743 -2.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 818 1.403 14.241 -0.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 818 -0.252 14.319 -0.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 818 0.404 12.898 0.269 1.00 0.00 H new ATOM 1738 N PHE A 819 -3.612 10.197 -5.063 1.00 0.00 N ATOM 1739 CA PHE A 819 -4.503 9.866 -6.173 1.00 0.00 C ATOM 1740 C PHE A 819 -5.359 8.691 -5.743 1.00 0.00 C ATOM 1741 O PHE A 819 -6.588 8.748 -5.760 1.00 0.00 O ATOM 1742 CB PHE A 819 -3.651 9.509 -7.398 1.00 0.00 C ATOM 1743 CG PHE A 819 -4.351 8.738 -8.496 1.00 0.00 C ATOM 1744 CD1 PHE A 819 -4.788 7.437 -8.290 1.00 0.00 C ATOM 1745 CD2 PHE A 819 -4.529 9.301 -9.750 1.00 0.00 C ATOM 1746 CE1 PHE A 819 -5.385 6.719 -9.287 1.00 0.00 C ATOM 1747 CE2 PHE A 819 -5.138 8.584 -10.764 1.00 0.00 C ATOM 1748 CZ PHE A 819 -5.565 7.289 -10.532 1.00 0.00 C ATOM 0 H PHE A 819 -2.638 10.331 -5.336 1.00 0.00 H new ATOM 0 HA PHE A 819 -5.148 10.705 -6.436 1.00 0.00 H new ATOM 0 HB2 PHE A 819 -3.259 10.433 -7.824 1.00 0.00 H new ATOM 0 HB3 PHE A 819 -2.795 8.925 -7.061 1.00 0.00 H new ATOM 0 HD1 PHE A 819 -4.653 6.982 -7.320 1.00 0.00 H new ATOM 0 HD2 PHE A 819 -4.189 10.309 -9.937 1.00 0.00 H new ATOM 0 HE1 PHE A 819 -5.716 5.708 -9.102 1.00 0.00 H new ATOM 0 HE2 PHE A 819 -5.280 9.035 -11.735 1.00 0.00 H new ATOM 0 HZ PHE A 819 -6.038 6.725 -11.322 1.00 0.00 H new ATOM 1758 N PHE A 820 -4.667 7.616 -5.389 1.00 0.00 N ATOM 1759 CA PHE A 820 -5.293 6.417 -4.881 1.00 0.00 C ATOM 1760 C PHE A 820 -6.318 6.815 -3.852 1.00 0.00 C ATOM 1761 O PHE A 820 -7.449 6.364 -3.922 1.00 0.00 O ATOM 1762 CB PHE A 820 -4.211 5.490 -4.338 1.00 0.00 C ATOM 1763 CG PHE A 820 -4.470 4.841 -3.029 1.00 0.00 C ATOM 1764 CD1 PHE A 820 -4.075 5.390 -1.833 1.00 0.00 C ATOM 1765 CD2 PHE A 820 -5.036 3.627 -3.025 1.00 0.00 C ATOM 1766 CE1 PHE A 820 -4.283 4.703 -0.652 1.00 0.00 C ATOM 1767 CE2 PHE A 820 -5.234 2.932 -1.884 1.00 0.00 C ATOM 1768 CZ PHE A 820 -4.866 3.458 -0.685 1.00 0.00 C ATOM 0 H PHE A 820 -3.650 7.558 -5.449 1.00 0.00 H new ATOM 0 HA PHE A 820 -5.817 5.865 -5.661 1.00 0.00 H new ATOM 0 HB2 PHE A 820 -4.036 4.706 -5.075 1.00 0.00 H new ATOM 0 HB3 PHE A 820 -3.287 6.062 -4.255 1.00 0.00 H new ATOM 0 HD1 PHE A 820 -3.601 6.360 -1.816 1.00 0.00 H new ATOM 0 HD2 PHE A 820 -5.344 3.190 -3.964 1.00 0.00 H new ATOM 0 HE1 PHE A 820 -3.990 5.141 0.291 1.00 0.00 H new ATOM 0 HE2 PHE A 820 -5.687 1.953 -1.924 1.00 0.00 H new ATOM 0 HZ PHE A 820 -5.029 2.906 0.229 1.00 0.00 H new ATOM 1778 N PHE A 821 -5.942 7.720 -2.942 1.00 0.00 N ATOM 1779 CA PHE A 821 -6.875 8.185 -1.924 1.00 0.00 C ATOM 1780 C PHE A 821 -8.151 8.733 -2.532 1.00 0.00 C ATOM 1781 O PHE A 821 -9.230 8.536 -1.983 1.00 0.00 O ATOM 1782 CB PHE A 821 -6.227 9.185 -0.979 1.00 0.00 C ATOM 1783 CG PHE A 821 -6.051 8.573 0.366 1.00 0.00 C ATOM 1784 CD1 PHE A 821 -5.274 7.458 0.461 1.00 0.00 C ATOM 1785 CD2 PHE A 821 -6.707 9.038 1.493 1.00 0.00 C ATOM 1786 CE1 PHE A 821 -5.123 6.784 1.648 1.00 0.00 C ATOM 1787 CE2 PHE A 821 -6.556 8.386 2.705 1.00 0.00 C ATOM 1788 CZ PHE A 821 -5.762 7.251 2.783 1.00 0.00 C ATOM 0 H PHE A 821 -5.012 8.136 -2.893 1.00 0.00 H new ATOM 0 HA PHE A 821 -7.154 7.315 -1.329 1.00 0.00 H new ATOM 0 HB2 PHE A 821 -5.261 9.498 -1.374 1.00 0.00 H new ATOM 0 HB3 PHE A 821 -6.845 10.079 -0.903 1.00 0.00 H new ATOM 0 HD1 PHE A 821 -4.764 7.095 -0.419 1.00 0.00 H new ATOM 0 HD2 PHE A 821 -7.338 9.912 1.427 1.00 0.00 H new ATOM 0 HE1 PHE A 821 -4.510 5.896 1.695 1.00 0.00 H new ATOM 0 HE2 PHE A 821 -7.055 8.760 3.587 1.00 0.00 H new ATOM 0 HZ PHE A 821 -5.643 6.735 3.724 1.00 0.00 H new ATOM 1798 N SER A 822 -8.038 9.398 -3.667 1.00 0.00 N ATOM 1799 CA SER A 822 -9.211 9.941 -4.333 1.00 0.00 C ATOM 1800 C SER A 822 -10.025 8.818 -4.972 1.00 0.00 C ATOM 1801 O SER A 822 -11.227 8.949 -5.166 1.00 0.00 O ATOM 1802 CB SER A 822 -8.801 10.962 -5.394 1.00 0.00 C ATOM 1803 OG SER A 822 -9.936 11.493 -6.057 1.00 0.00 O ATOM 0 H SER A 822 -7.154 9.575 -4.145 1.00 0.00 H new ATOM 0 HA SER A 822 -9.828 10.443 -3.588 1.00 0.00 H new ATOM 0 HB2 SER A 822 -8.238 11.770 -4.927 1.00 0.00 H new ATOM 0 HB3 SER A 822 -8.139 10.490 -6.120 1.00 0.00 H new ATOM 0 HG SER A 822 -9.647 12.145 -6.730 1.00 0.00 H new ATOM 1809 N LYS A 823 -9.352 7.709 -5.275 1.00 0.00 N ATOM 1810 CA LYS A 823 -9.982 6.545 -5.910 1.00 0.00 C ATOM 1811 C LYS A 823 -10.705 5.665 -4.906 1.00 0.00 C ATOM 1812 O LYS A 823 -11.763 5.108 -5.198 1.00 0.00 O ATOM 1813 CB LYS A 823 -8.912 5.720 -6.623 1.00 0.00 C ATOM 1814 CG LYS A 823 -8.138 6.482 -7.670 1.00 0.00 C ATOM 1815 CD LYS A 823 -9.062 7.170 -8.644 1.00 0.00 C ATOM 1816 CE LYS A 823 -8.432 8.412 -9.228 1.00 0.00 C ATOM 1817 NZ LYS A 823 -9.446 9.332 -9.814 1.00 0.00 N ATOM 0 H LYS A 823 -8.356 7.589 -5.089 1.00 0.00 H new ATOM 0 HA LYS A 823 -10.722 6.915 -6.620 1.00 0.00 H new ATOM 0 HB2 LYS A 823 -8.213 5.333 -5.881 1.00 0.00 H new ATOM 0 HB3 LYS A 823 -9.387 4.859 -7.093 1.00 0.00 H new ATOM 0 HG2 LYS A 823 -7.500 7.222 -7.187 1.00 0.00 H new ATOM 0 HG3 LYS A 823 -7.482 5.799 -8.209 1.00 0.00 H new ATOM 0 HD2 LYS A 823 -9.322 6.481 -9.448 1.00 0.00 H new ATOM 0 HD3 LYS A 823 -9.991 7.436 -8.139 1.00 0.00 H new ATOM 0 HE2 LYS A 823 -7.875 8.935 -8.451 1.00 0.00 H new ATOM 0 HE3 LYS A 823 -7.715 8.127 -9.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 823 -8.970 10.171 -10.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 823 -9.961 8.843 -10.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 823 -10.116 9.626 -9.075 1.00 0.00 H new ATOM 1831 N ILE A 824 -10.135 5.548 -3.730 1.00 0.00 N ATOM 1832 CA ILE A 824 -10.723 4.741 -2.684 1.00 0.00 C ATOM 1833 C ILE A 824 -11.895 5.499 -2.123 1.00 0.00 C ATOM 1834 O ILE A 824 -13.001 4.985 -2.002 1.00 0.00 O ATOM 1835 CB ILE A 824 -9.719 4.471 -1.576 1.00 0.00 C ATOM 1836 CG1 ILE A 824 -8.675 5.528 -1.589 1.00 0.00 C ATOM 1837 CG2 ILE A 824 -9.088 3.116 -1.749 1.00 0.00 C ATOM 1838 CD1 ILE A 824 -7.502 5.229 -0.731 1.00 0.00 C ATOM 0 H ILE A 824 -9.260 6.004 -3.472 1.00 0.00 H new ATOM 0 HA ILE A 824 -11.036 3.781 -3.095 1.00 0.00 H new ATOM 0 HB ILE A 824 -10.237 4.484 -0.617 1.00 0.00 H new ATOM 0 HG12 ILE A 824 -8.334 5.675 -2.614 1.00 0.00 H new ATOM 0 HG13 ILE A 824 -9.120 6.468 -1.263 1.00 0.00 H new ATOM 0 HG21 ILE A 824 -8.372 2.943 -0.945 1.00 0.00 H new ATOM 0 HG22 ILE A 824 -9.861 2.348 -1.719 1.00 0.00 H new ATOM 0 HG23 ILE A 824 -8.573 3.074 -2.709 1.00 0.00 H new ATOM 0 HD11 ILE A 824 -6.786 6.048 -0.795 1.00 0.00 H new ATOM 0 HD12 ILE A 824 -7.828 5.112 0.303 1.00 0.00 H new ATOM 0 HD13 ILE A 824 -7.029 4.307 -1.069 1.00 0.00 H new ATOM 1850 N LYS A 825 -11.631 6.762 -1.837 1.00 0.00 N ATOM 1851 CA LYS A 825 -12.631 7.660 -1.301 1.00 0.00 C ATOM 1852 C LYS A 825 -13.853 7.629 -2.190 1.00 0.00 C ATOM 1853 O LYS A 825 -14.986 7.463 -1.740 1.00 0.00 O ATOM 1854 CB LYS A 825 -12.103 9.082 -1.270 1.00 0.00 C ATOM 1855 CG LYS A 825 -12.013 9.650 0.127 1.00 0.00 C ATOM 1856 CD LYS A 825 -11.369 11.013 0.135 1.00 0.00 C ATOM 1857 CE LYS A 825 -9.872 10.889 -0.041 1.00 0.00 C ATOM 1858 NZ LYS A 825 -9.283 12.080 -0.712 1.00 0.00 N ATOM 0 H LYS A 825 -10.715 7.191 -1.971 1.00 0.00 H new ATOM 0 HA LYS A 825 -12.880 7.341 -0.289 1.00 0.00 H new ATOM 0 HB2 LYS A 825 -11.115 9.107 -1.730 1.00 0.00 H new ATOM 0 HB3 LYS A 825 -12.752 9.717 -1.873 1.00 0.00 H new ATOM 0 HG2 LYS A 825 -13.012 9.717 0.557 1.00 0.00 H new ATOM 0 HG3 LYS A 825 -11.439 8.973 0.759 1.00 0.00 H new ATOM 0 HD2 LYS A 825 -11.786 11.624 -0.665 1.00 0.00 H new ATOM 0 HD3 LYS A 825 -11.591 11.522 1.073 1.00 0.00 H new ATOM 0 HE2 LYS A 825 -9.403 10.755 0.934 1.00 0.00 H new ATOM 0 HE3 LYS A 825 -9.650 9.997 -0.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 825 -8.256 11.950 -0.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 825 -9.710 12.195 -1.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 825 -9.471 12.929 -0.141 1.00 0.00 H new ATOM 1872 N GLU A 826 -13.574 7.798 -3.474 1.00 0.00 N ATOM 1873 CA GLU A 826 -14.596 7.804 -4.503 1.00 0.00 C ATOM 1874 C GLU A 826 -15.373 6.507 -4.483 1.00 0.00 C ATOM 1875 O GLU A 826 -16.591 6.486 -4.657 1.00 0.00 O ATOM 1876 CB GLU A 826 -13.941 7.990 -5.879 1.00 0.00 C ATOM 1877 CG GLU A 826 -13.880 6.714 -6.702 1.00 0.00 C ATOM 1878 CD GLU A 826 -13.067 6.872 -7.972 1.00 0.00 C ATOM 1879 OE1 GLU A 826 -13.403 7.759 -8.785 1.00 0.00 O ATOM 1880 OE2 GLU A 826 -12.096 6.108 -8.154 1.00 0.00 O ATOM 0 H GLU A 826 -12.628 7.935 -3.830 1.00 0.00 H new ATOM 0 HA GLU A 826 -15.283 8.628 -4.310 1.00 0.00 H new ATOM 0 HB2 GLU A 826 -14.495 8.746 -6.436 1.00 0.00 H new ATOM 0 HB3 GLU A 826 -12.930 8.372 -5.742 1.00 0.00 H new ATOM 0 HG2 GLU A 826 -13.448 5.917 -6.097 1.00 0.00 H new ATOM 0 HG3 GLU A 826 -14.893 6.405 -6.961 1.00 0.00 H new ATOM 1887 N ALA A 827 -14.648 5.426 -4.266 1.00 0.00 N ATOM 1888 CA ALA A 827 -15.243 4.109 -4.263 1.00 0.00 C ATOM 1889 C ALA A 827 -15.716 3.664 -2.880 1.00 0.00 C ATOM 1890 O ALA A 827 -15.870 2.469 -2.633 1.00 0.00 O ATOM 1891 CB ALA A 827 -14.245 3.132 -4.829 1.00 0.00 C ATOM 0 H ALA A 827 -13.643 5.437 -4.089 1.00 0.00 H new ATOM 0 HA ALA A 827 -16.140 4.142 -4.882 1.00 0.00 H new ATOM 0 HB1 ALA A 827 -14.678 2.132 -4.834 1.00 0.00 H new ATOM 0 HB2 ALA A 827 -13.990 3.422 -5.848 1.00 0.00 H new ATOM 0 HB3 ALA A 827 -13.345 3.135 -4.215 1.00 0.00 H new ATOM 1897 N GLY A 828 -15.962 4.619 -1.989 1.00 0.00 N ATOM 1898 CA GLY A 828 -16.417 4.280 -0.650 1.00 0.00 C ATOM 1899 C GLY A 828 -15.480 3.320 0.047 1.00 0.00 C ATOM 1900 O GLY A 828 -15.918 2.463 0.809 1.00 0.00 O ATOM 0 H GLY A 828 -15.856 5.618 -2.167 1.00 0.00 H new ATOM 0 HA2 GLY A 828 -16.508 5.191 -0.058 1.00 0.00 H new ATOM 0 HA3 GLY A 828 -17.411 3.837 -0.708 1.00 0.00 H new ATOM 1904 N LEU A 829 -14.191 3.485 -0.205 1.00 0.00 N ATOM 1905 CA LEU A 829 -13.165 2.627 0.361 1.00 0.00 C ATOM 1906 C LEU A 829 -12.744 3.134 1.726 1.00 0.00 C ATOM 1907 O LEU A 829 -13.501 3.008 2.685 1.00 0.00 O ATOM 1908 CB LEU A 829 -11.998 2.579 -0.625 1.00 0.00 C ATOM 1909 CG LEU A 829 -12.374 1.964 -1.982 1.00 0.00 C ATOM 1910 CD1 LEU A 829 -11.208 1.318 -2.661 1.00 0.00 C ATOM 1911 CD2 LEU A 829 -13.492 0.945 -1.840 1.00 0.00 C ATOM 0 H LEU A 829 -13.827 4.221 -0.810 1.00 0.00 H new ATOM 0 HA LEU A 829 -13.544 1.616 0.513 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -11.623 3.590 -0.783 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -11.184 2.003 -0.186 1.00 0.00 H new ATOM 0 HG LEU A 829 -12.715 2.795 -2.600 1.00 0.00 H new ATOM 0 HD11 LEU A 829 -11.529 0.900 -3.615 1.00 0.00 H new ATOM 0 HD12 LEU A 829 -10.430 2.062 -2.834 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -10.815 0.521 -2.029 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -13.733 0.530 -2.819 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -13.171 0.143 -1.175 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -14.375 1.430 -1.424 1.00 0.00 H new ATOM 1923 N ILE A 830 -11.555 3.727 1.789 1.00 0.00 N ATOM 1924 CA ILE A 830 -10.999 4.293 3.003 1.00 0.00 C ATOM 1925 C ILE A 830 -11.885 4.080 4.245 1.00 0.00 C ATOM 1926 O ILE A 830 -12.114 2.937 4.642 1.00 0.00 O ATOM 1927 CB ILE A 830 -10.705 5.765 2.723 1.00 0.00 C ATOM 1928 CG1 ILE A 830 -10.687 5.951 1.222 1.00 0.00 C ATOM 1929 CG2 ILE A 830 -9.358 6.145 3.275 1.00 0.00 C ATOM 1930 CD1 ILE A 830 -9.933 7.158 0.767 1.00 0.00 C ATOM 0 H ILE A 830 -10.943 3.827 0.979 1.00 0.00 H new ATOM 0 HA ILE A 830 -10.078 3.770 3.260 1.00 0.00 H new ATOM 0 HB ILE A 830 -11.464 6.390 3.193 1.00 0.00 H new ATOM 0 HG12 ILE A 830 -10.247 5.066 0.762 1.00 0.00 H new ATOM 0 HG13 ILE A 830 -11.714 6.020 0.863 1.00 0.00 H new ATOM 0 HG21 ILE A 830 -9.163 7.197 3.067 1.00 0.00 H new ATOM 0 HG22 ILE A 830 -9.346 5.980 4.352 1.00 0.00 H new ATOM 0 HG23 ILE A 830 -8.587 5.534 2.806 1.00 0.00 H new ATOM 0 HD11 ILE A 830 -9.967 7.220 -0.321 1.00 0.00 H new ATOM 0 HD12 ILE A 830 -10.385 8.052 1.196 1.00 0.00 H new ATOM 0 HD13 ILE A 830 -8.896 7.084 1.094 1.00 0.00 H new ATOM 1942 N ASP A 831 -12.344 5.159 4.884 1.00 0.00 N ATOM 1943 CA ASP A 831 -13.215 5.060 6.050 1.00 0.00 C ATOM 1944 C ASP A 831 -12.505 4.459 7.268 1.00 0.00 C ATOM 1945 O ASP A 831 -12.990 4.589 8.392 1.00 0.00 O ATOM 1946 CB ASP A 831 -14.467 4.242 5.720 1.00 0.00 C ATOM 1947 CG ASP A 831 -15.396 4.971 4.769 1.00 0.00 C ATOM 1948 OD1 ASP A 831 -15.229 4.818 3.541 1.00 0.00 O ATOM 1949 OD2 ASP A 831 -16.292 5.694 5.252 1.00 0.00 O ATOM 0 H ASP A 831 -12.123 6.116 4.608 1.00 0.00 H new ATOM 0 HA ASP A 831 -13.503 6.078 6.311 1.00 0.00 H new ATOM 0 HB2 ASP A 831 -14.171 3.291 5.277 1.00 0.00 H new ATOM 0 HB3 ASP A 831 -15.001 4.012 6.642 1.00 0.00 H new ATOM 1954 N LYS A 832 -11.365 3.805 7.048 1.00 0.00 N ATOM 1955 CA LYS A 832 -10.614 3.194 8.143 1.00 0.00 C ATOM 1956 C LYS A 832 -10.303 4.215 9.236 1.00 0.00 C ATOM 1957 O LYS A 832 -10.770 4.016 10.377 1.00 0.00 O ATOM 1958 CB LYS A 832 -9.318 2.564 7.623 1.00 0.00 C ATOM 1959 CG LYS A 832 -8.430 3.523 6.847 1.00 0.00 C ATOM 1960 CD LYS A 832 -7.113 2.870 6.461 1.00 0.00 C ATOM 1961 CE LYS A 832 -6.170 3.866 5.807 1.00 0.00 C ATOM 1962 NZ LYS A 832 -5.856 5.008 6.710 1.00 0.00 N ATOM 1963 OXT LYS A 832 -9.604 5.207 8.942 1.00 0.00 O ATOM 0 H LYS A 832 -10.943 3.685 6.127 1.00 0.00 H new ATOM 0 HA LYS A 832 -11.236 2.410 8.576 1.00 0.00 H new ATOM 0 HB2 LYS A 832 -8.755 2.167 8.468 1.00 0.00 H new ATOM 0 HB3 LYS A 832 -9.569 1.719 6.982 1.00 0.00 H new ATOM 0 HG2 LYS A 832 -8.950 3.856 5.949 1.00 0.00 H new ATOM 0 HG3 LYS A 832 -8.235 4.410 7.450 1.00 0.00 H new ATOM 0 HD2 LYS A 832 -6.641 2.448 7.348 1.00 0.00 H new ATOM 0 HD3 LYS A 832 -7.302 2.043 5.777 1.00 0.00 H new ATOM 0 HE2 LYS A 832 -5.246 3.361 5.526 1.00 0.00 H new ATOM 0 HE3 LYS A 832 -6.620 4.243 4.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 832 -4.837 5.213 6.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 832 -6.390 5.847 6.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 832 -6.121 4.763 7.685 1.00 0.00 H new TER 1977 LYS A 832 ATOM 1978 N SER B 31 25.453 8.139 -13.193 1.00 0.00 N ATOM 1979 CA SER B 31 24.088 8.666 -12.934 1.00 0.00 C ATOM 1980 C SER B 31 23.032 7.601 -13.214 1.00 0.00 C ATOM 1981 O SER B 31 21.897 7.918 -13.571 1.00 0.00 O ATOM 1982 CB SER B 31 23.827 9.898 -13.803 1.00 0.00 C ATOM 1983 OG SER B 31 24.750 10.934 -13.514 1.00 0.00 O ATOM 0 HA SER B 31 24.025 8.947 -11.883 1.00 0.00 H new ATOM 0 HB2 SER B 31 23.900 9.626 -14.856 1.00 0.00 H new ATOM 0 HB3 SER B 31 22.811 10.256 -13.636 1.00 0.00 H new ATOM 0 HG SER B 31 25.638 10.548 -13.365 1.00 0.00 H new ATOM 1991 N THR B 32 23.412 6.338 -13.048 1.00 0.00 N ATOM 1992 CA THR B 32 22.497 5.227 -13.284 1.00 0.00 C ATOM 1993 C THR B 32 21.805 4.804 -11.993 1.00 0.00 C ATOM 1994 O THR B 32 22.437 4.710 -10.941 1.00 0.00 O ATOM 1995 CB THR B 32 23.229 4.012 -13.881 1.00 0.00 C ATOM 1996 OG1 THR B 32 24.189 3.508 -12.944 1.00 0.00 O ATOM 1997 CG2 THR B 32 23.929 4.386 -15.179 1.00 0.00 C ATOM 0 H THR B 32 24.347 6.059 -12.751 1.00 0.00 H new ATOM 0 HA THR B 32 21.751 5.578 -13.997 1.00 0.00 H new ATOM 0 HB THR B 32 22.490 3.240 -14.094 1.00 0.00 H new ATOM 0 HG1 THR B 32 24.649 2.734 -13.331 1.00 0.00 H new ATOM 0 HG21 THR B 32 24.439 3.511 -15.582 1.00 0.00 H new ATOM 0 HG22 THR B 32 23.193 4.741 -15.900 1.00 0.00 H new ATOM 0 HG23 THR B 32 24.657 5.174 -14.986 1.00 0.00 H new ATOM 2005 N GLY B 33 20.504 4.548 -12.082 1.00 0.00 N ATOM 2006 CA GLY B 33 19.745 4.137 -10.915 1.00 0.00 C ATOM 2007 C GLY B 33 18.938 2.877 -11.159 1.00 0.00 C ATOM 2008 O GLY B 33 18.209 2.421 -10.278 1.00 0.00 O ATOM 0 H GLY B 33 19.961 4.618 -12.943 1.00 0.00 H new ATOM 0 HA2 GLY B 33 20.428 3.971 -10.082 1.00 0.00 H new ATOM 0 HA3 GLY B 33 19.073 4.943 -10.621 1.00 0.00 H new ATOM 2012 N GLY B 34 19.069 2.314 -12.357 1.00 0.00 N ATOM 2013 CA GLY B 34 18.338 1.106 -12.692 1.00 0.00 C ATOM 2014 C GLY B 34 16.839 1.290 -12.581 1.00 0.00 C ATOM 2015 O GLY B 34 16.248 2.081 -13.317 1.00 0.00 O ATOM 0 H GLY B 34 19.668 2.673 -13.101 1.00 0.00 H new ATOM 0 HA2 GLY B 34 18.590 0.802 -13.708 1.00 0.00 H new ATOM 0 HA3 GLY B 34 18.652 0.299 -12.030 1.00 0.00 H new ATOM 2019 N VAL B 35 16.221 0.557 -11.659 1.00 0.00 N ATOM 2020 CA VAL B 35 14.781 0.650 -11.452 1.00 0.00 C ATOM 2021 C VAL B 35 14.456 1.055 -10.021 1.00 0.00 C ATOM 2022 O VAL B 35 13.843 2.096 -9.786 1.00 0.00 O ATOM 2023 CB VAL B 35 14.072 -0.680 -11.766 1.00 0.00 C ATOM 2024 CG1 VAL B 35 12.584 -0.577 -11.446 1.00 0.00 C ATOM 2025 CG2 VAL B 35 14.286 -1.068 -13.222 1.00 0.00 C ATOM 0 H VAL B 35 16.694 -0.106 -11.045 1.00 0.00 H new ATOM 0 HA VAL B 35 14.418 1.415 -12.139 1.00 0.00 H new ATOM 0 HB VAL B 35 14.504 -1.461 -11.140 1.00 0.00 H new ATOM 0 HG11 VAL B 35 12.096 -1.525 -11.673 1.00 0.00 H new ATOM 0 HG12 VAL B 35 12.454 -0.347 -10.389 1.00 0.00 H new ATOM 0 HG13 VAL B 35 12.136 0.214 -12.047 1.00 0.00 H new ATOM 0 HG21 VAL B 35 13.778 -2.011 -13.426 1.00 0.00 H new ATOM 0 HG22 VAL B 35 13.881 -0.290 -13.869 1.00 0.00 H new ATOM 0 HG23 VAL B 35 15.353 -1.182 -13.415 1.00 0.00 H new HETATM 2035 OH ALY B 36 8.747 -1.091 -4.134 1.00 0.00 O HETATM 2036 CH ALY B 36 9.464 -0.239 -4.645 1.00 0.00 C HETATM 2037 CH3 ALY B 36 8.851 1.099 -5.021 1.00 0.00 C HETATM 2038 NZ ALY B 36 10.704 -0.498 -5.021 1.00 0.00 N HETATM 2039 CE ALY B 36 11.223 -1.846 -5.178 1.00 0.00 C HETATM 2040 CD ALY B 36 12.438 -1.896 -6.076 1.00 0.00 C HETATM 2041 CG ALY B 36 13.328 -0.738 -5.866 1.00 0.00 C HETATM 2042 CB ALY B 36 14.446 -0.794 -6.868 1.00 0.00 C HETATM 2043 CA ALY B 36 14.603 0.511 -7.663 1.00 0.00 C HETATM 2044 N ALY B 36 14.869 0.229 -9.065 1.00 0.00 N HETATM 2045 C ALY B 36 15.688 1.388 -7.062 1.00 0.00 C HETATM 2046 O ALY B 36 16.064 1.194 -5.906 1.00 0.00 O HETATM 0 HH33 ALY B 36 8.050 0.942 -5.744 1.00 0.00 H new HETATM 0 HH32 ALY B 36 8.446 1.577 -4.129 1.00 0.00 H new HETATM 0 HH31 ALY B 36 9.616 1.739 -5.460 1.00 0.00 H new HETATM 0 HZ ALY B 36 11.327 0.287 -5.210 1.00 0.00 H new HETATM 0 HG3 ALY B 36 13.729 -0.750 -4.853 1.00 0.00 H new HETATM 0 HG2 ALY B 36 12.769 0.191 -5.976 1.00 0.00 H new HETATM 0 HE3 ALY B 36 10.443 -2.487 -5.590 1.00 0.00 H new HETATM 0 HE2 ALY B 36 11.482 -2.249 -4.199 1.00 0.00 H new HETATM 0 HD3 ALY B 36 12.118 -1.923 -7.118 1.00 0.00 H new HETATM 0 HD2 ALY B 36 12.990 -2.817 -5.888 1.00 0.00 H new HETATM 0 HCA ALY B 36 13.664 1.061 -7.603 1.00 0.00 H new HETATM 0 HB3 ALY B 36 14.265 -1.616 -7.561 1.00 0.00 H new HETATM 0 HB2 ALY B 36 15.380 -1.013 -6.351 1.00 0.00 H new HETATM 0 H ALY B 36 14.927 -0.736 -9.389 1.00 0.00 H new ATOM 2061 N LYS B 37 16.160 2.368 -7.857 1.00 0.00 N ATOM 2062 CA LYS B 37 17.205 3.306 -7.426 1.00 0.00 C ATOM 2063 C LYS B 37 17.882 2.801 -6.162 1.00 0.00 C ATOM 2064 O LYS B 37 17.757 3.406 -5.098 1.00 0.00 O ATOM 2065 CB LYS B 37 16.610 4.699 -7.193 1.00 0.00 C ATOM 2066 CG LYS B 37 16.440 5.510 -8.468 1.00 0.00 C ATOM 2067 CD LYS B 37 15.812 6.867 -8.191 1.00 0.00 C ATOM 2068 CE LYS B 37 15.748 7.715 -9.452 1.00 0.00 C ATOM 2069 NZ LYS B 37 15.204 9.075 -9.182 1.00 0.00 N ATOM 0 H LYS B 37 15.828 2.528 -8.808 1.00 0.00 H new ATOM 0 HA LYS B 37 17.953 3.377 -8.215 1.00 0.00 H new ATOM 0 HB2 LYS B 37 15.640 4.594 -6.707 1.00 0.00 H new ATOM 0 HB3 LYS B 37 17.253 5.249 -6.506 1.00 0.00 H new ATOM 0 HG2 LYS B 37 17.411 5.648 -8.944 1.00 0.00 H new ATOM 0 HG3 LYS B 37 15.817 4.957 -9.171 1.00 0.00 H new ATOM 0 HD2 LYS B 37 14.807 6.730 -7.791 1.00 0.00 H new ATOM 0 HD3 LYS B 37 16.390 7.389 -7.428 1.00 0.00 H new ATOM 0 HE2 LYS B 37 16.746 7.802 -9.881 1.00 0.00 H new ATOM 0 HE3 LYS B 37 15.125 7.216 -10.194 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 14.470 9.301 -9.883 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 14.791 9.101 -8.228 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 15.971 9.775 -9.246 1.00 0.00 H new ATOM 2083 N PRO B 38 18.619 1.681 -6.277 1.00 0.00 N ATOM 2084 CA PRO B 38 19.281 1.036 -5.161 1.00 0.00 C ATOM 2085 C PRO B 38 19.669 1.983 -4.035 1.00 0.00 C ATOM 2086 O PRO B 38 20.706 2.646 -4.082 1.00 0.00 O ATOM 2087 CB PRO B 38 20.506 0.429 -5.830 1.00 0.00 C ATOM 2088 CG PRO B 38 19.989 -0.024 -7.150 1.00 0.00 C ATOM 2089 CD PRO B 38 18.907 0.958 -7.533 1.00 0.00 C ATOM 0 HA PRO B 38 18.634 0.318 -4.657 1.00 0.00 H new ATOM 0 HB2 PRO B 38 21.307 1.160 -5.941 1.00 0.00 H new ATOM 0 HB3 PRO B 38 20.911 -0.401 -5.251 1.00 0.00 H new ATOM 0 HG2 PRO B 38 20.784 -0.039 -7.896 1.00 0.00 H new ATOM 0 HG3 PRO B 38 19.592 -1.037 -7.087 1.00 0.00 H new ATOM 0 HD2 PRO B 38 19.244 1.637 -8.316 1.00 0.00 H new ATOM 0 HD3 PRO B 38 18.021 0.448 -7.912 1.00 0.00 H new ATOM 2097 N HIS B 39 18.812 2.032 -3.024 1.00 0.00 N ATOM 2098 CA HIS B 39 19.027 2.874 -1.861 1.00 0.00 C ATOM 2099 C HIS B 39 19.472 2.003 -0.675 1.00 0.00 C ATOM 2100 O HIS B 39 19.383 0.781 -0.741 1.00 0.00 O ATOM 2101 CB HIS B 39 17.738 3.658 -1.563 1.00 0.00 C ATOM 2102 CG HIS B 39 17.745 4.382 -0.253 1.00 0.00 C ATOM 2103 ND1 HIS B 39 17.681 3.742 0.965 1.00 0.00 N ATOM 2104 CD2 HIS B 39 17.805 5.705 0.025 1.00 0.00 C ATOM 2105 CE1 HIS B 39 17.699 4.639 1.934 1.00 0.00 C ATOM 2106 NE2 HIS B 39 17.776 5.837 1.390 1.00 0.00 N ATOM 0 H HIS B 39 17.950 1.489 -2.990 1.00 0.00 H new ATOM 0 HA HIS B 39 19.820 3.598 -2.048 1.00 0.00 H new ATOM 0 HB2 HIS B 39 17.573 4.380 -2.363 1.00 0.00 H new ATOM 0 HB3 HIS B 39 16.895 2.967 -1.578 1.00 0.00 H new ATOM 0 HD2 HIS B 39 17.865 6.508 -0.695 1.00 0.00 H new ATOM 0 HE1 HIS B 39 17.658 4.427 2.992 1.00 0.00 H new ATOM 0 HE2 HIS B 39 17.809 6.719 1.901 1.00 0.00 H new ATOM 2115 N ARG B 40 19.974 2.619 0.394 1.00 0.00 N ATOM 2116 CA ARG B 40 20.441 1.855 1.555 1.00 0.00 C ATOM 2117 C ARG B 40 19.648 2.184 2.820 1.00 0.00 C ATOM 2118 O ARG B 40 19.816 3.253 3.407 1.00 0.00 O ATOM 2119 CB ARG B 40 21.928 2.128 1.792 1.00 0.00 C ATOM 2120 CG ARG B 40 22.525 1.318 2.932 1.00 0.00 C ATOM 2121 CD ARG B 40 23.998 1.639 3.131 1.00 0.00 C ATOM 2122 NE ARG B 40 24.583 0.868 4.225 1.00 0.00 N ATOM 2123 CZ ARG B 40 25.840 1.009 4.637 1.00 0.00 C ATOM 2124 NH1 ARG B 40 26.640 1.891 4.054 1.00 0.00 N ATOM 2125 NH2 ARG B 40 26.298 0.267 5.636 1.00 0.00 N ATOM 0 H ARG B 40 20.068 3.631 0.483 1.00 0.00 H new ATOM 0 HA ARG B 40 20.286 0.799 1.335 1.00 0.00 H new ATOM 0 HB2 ARG B 40 22.478 1.911 0.877 1.00 0.00 H new ATOM 0 HB3 ARG B 40 22.064 3.189 2.002 1.00 0.00 H new ATOM 0 HG2 ARG B 40 21.979 1.525 3.852 1.00 0.00 H new ATOM 0 HG3 ARG B 40 22.408 0.254 2.724 1.00 0.00 H new ATOM 0 HD2 ARG B 40 24.542 1.431 2.210 1.00 0.00 H new ATOM 0 HD3 ARG B 40 24.113 2.703 3.336 1.00 0.00 H new ATOM 0 HE ARG B 40 23.995 0.183 4.700 1.00 0.00 H new ATOM 0 HH11 ARG B 40 26.292 2.465 3.286 1.00 0.00 H new ATOM 0 HH12 ARG B 40 27.603 1.995 4.374 1.00 0.00 H new ATOM 0 HH21 ARG B 40 25.686 -0.412 6.089 1.00 0.00 H new ATOM 0 HH22 ARG B 40 27.262 0.375 5.952 1.00 0.00 H new ATOM 2139 N TYR B 41 18.795 1.250 3.246 1.00 0.00 N ATOM 2140 CA TYR B 41 17.986 1.444 4.447 1.00 0.00 C ATOM 2141 C TYR B 41 17.993 0.197 5.326 1.00 0.00 C ATOM 2142 O TYR B 41 18.214 -0.912 4.841 1.00 0.00 O ATOM 2143 CB TYR B 41 16.545 1.805 4.076 1.00 0.00 C ATOM 2144 CG TYR B 41 15.840 2.627 5.136 1.00 0.00 C ATOM 2145 CD1 TYR B 41 16.334 3.871 5.512 1.00 0.00 C ATOM 2146 CD2 TYR B 41 14.691 2.161 5.764 1.00 0.00 C ATOM 2147 CE1 TYR B 41 15.702 4.626 6.481 1.00 0.00 C ATOM 2148 CE2 TYR B 41 14.054 2.912 6.733 1.00 0.00 C ATOM 2149 CZ TYR B 41 14.563 4.144 7.089 1.00 0.00 C ATOM 2150 OH TYR B 41 13.931 4.893 8.055 1.00 0.00 O ATOM 0 H TYR B 41 18.648 0.356 2.778 1.00 0.00 H new ATOM 0 HA TYR B 41 18.427 2.267 5.009 1.00 0.00 H new ATOM 0 HB2 TYR B 41 16.547 2.360 3.138 1.00 0.00 H new ATOM 0 HB3 TYR B 41 15.981 0.888 3.903 1.00 0.00 H new ATOM 0 HD1 TYR B 41 17.226 4.253 5.039 1.00 0.00 H new ATOM 0 HD2 TYR B 41 14.290 1.196 5.490 1.00 0.00 H new ATOM 0 HE1 TYR B 41 16.099 5.591 6.761 1.00 0.00 H new ATOM 0 HE2 TYR B 41 13.161 2.536 7.210 1.00 0.00 H new ATOM 0 HH TYR B 41 13.143 4.409 8.381 1.00 0.00 H new ATOM 2160 N LYS B 42 17.746 0.397 6.620 1.00 0.00 N ATOM 2161 CA LYS B 42 17.715 -0.699 7.586 1.00 0.00 C ATOM 2162 C LYS B 42 19.068 -1.400 7.669 1.00 0.00 C ATOM 2163 O LYS B 42 19.490 -2.074 6.729 1.00 0.00 O ATOM 2164 CB LYS B 42 16.623 -1.708 7.218 1.00 0.00 C ATOM 2165 CG LYS B 42 16.340 -2.724 8.314 1.00 0.00 C ATOM 2166 CD LYS B 42 15.626 -2.086 9.496 1.00 0.00 C ATOM 2167 CE LYS B 42 15.437 -3.075 10.635 1.00 0.00 C ATOM 2168 NZ LYS B 42 14.670 -2.483 11.766 1.00 0.00 N ATOM 0 H LYS B 42 17.563 1.315 7.025 1.00 0.00 H new ATOM 0 HA LYS B 42 17.490 -0.274 8.564 1.00 0.00 H new ATOM 0 HB2 LYS B 42 15.704 -1.169 6.988 1.00 0.00 H new ATOM 0 HB3 LYS B 42 16.918 -2.236 6.312 1.00 0.00 H new ATOM 0 HG2 LYS B 42 15.730 -3.533 7.913 1.00 0.00 H new ATOM 0 HG3 LYS B 42 17.277 -3.168 8.650 1.00 0.00 H new ATOM 0 HD2 LYS B 42 16.199 -1.229 9.849 1.00 0.00 H new ATOM 0 HD3 LYS B 42 14.655 -1.709 9.175 1.00 0.00 H new ATOM 0 HE2 LYS B 42 14.915 -3.958 10.266 1.00 0.00 H new ATOM 0 HE3 LYS B 42 16.412 -3.407 10.992 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 14.564 -3.190 12.521 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 15.180 -1.656 12.136 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 13.730 -2.189 11.432 1.00 0.00 H new ATOM 2182 N CYS B 43 19.742 -1.241 8.803 1.00 0.00 N ATOM 2183 CA CYS B 43 21.046 -1.859 9.011 1.00 0.00 C ATOM 2184 C CYS B 43 21.050 -2.716 10.275 1.00 0.00 C ATOM 2185 O CYS B 43 21.302 -2.162 11.366 1.00 0.00 O ATOM 2186 CB CYS B 43 22.136 -0.788 9.093 1.00 0.00 C ATOM 2187 SG CYS B 43 21.798 0.521 10.295 1.00 0.00 S ATOM 2188 OXT CYS B 43 20.798 -3.934 10.162 1.00 0.00 O ATOM 0 H CYS B 43 19.406 -0.689 9.592 1.00 0.00 H new ATOM 0 HA CYS B 43 21.253 -2.507 8.160 1.00 0.00 H new ATOM 0 HB2 CYS B 43 23.081 -1.266 9.349 1.00 0.00 H new ATOM 0 HB3 CYS B 43 22.263 -0.338 8.108 1.00 0.00 H new ATOM 0 HG CYS B 43 21.313 -0.002 11.382 1.00 0.00 H new TER 2194 CYS B 43