USER MOD reduce.3.24.130724 H: found=0, std=0, add=807, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 807 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 840 MET CE :methyl -152:sc= -2.44! (180deg=-2.24!) USER MOD Set 1.2: A 881 MET CE :methyl 143:sc= -3.47! (180deg=-1.87) USER MOD Set 2.1: A 845 THR OG1 : rot -111:sc= 0.111 USER MOD Set 2.2: A 892 ASN : amide:sc= -0.542 X(o=-0.43,f=0) USER MOD Single : A 802 SER OG : rot 1:sc= 0.416 USER MOD Single : A 803 SER OG : rot 180:sc= 0.00143 USER MOD Single : A 805 SER OG : rot 8:sc= 0.397 USER MOD Single : A 806 SER OG : rot 180:sc= 0 USER MOD Single : A 809 GLN : amide:sc= 0 X(o=0,f=-0.008) USER MOD Single : A 810 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 811 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0166) USER MOD Single : A 813 THR OG1 : rot 180:sc= 0 USER MOD Single : A 817 GLN : amide:sc= -0.0369 X(o=-0.037,f=0) USER MOD Single : A 819 SER OG : rot 62:sc= 1.08 USER MOD Single : A 820 THR OG1 : rot 180:sc= 0 USER MOD Single : A 821 THR OG1 : rot 180:sc= -0.209 USER MOD Single : A 826 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 829 GLN : amide:sc= -0.277 X(o=-0.28,f=-0.46) USER MOD Single : A 830 TYR OH : rot 180:sc= 0 USER MOD Single : A 831 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 841 LYS NZ :NH3+ -139:sc= -0.124 (180deg=-1.99!) USER MOD Single : A 842 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 844 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 847 SER OG : rot 160:sc= -0.438 USER MOD Single : A 848 HIS : no HD1:sc= -2.63! C(o=-2.6!,f=-4!) USER MOD Single : A 849 ASN : amide:sc= 0.0339 K(o=0.034,f=-1.5!) USER MOD Single : A 853 SER OG : rot 180:sc= 0 USER MOD Single : A 856 TYR OH : rot -16:sc= -0.686 USER MOD Single : A 857 ASN : amide:sc= -0.476 K(o=-0.48,f=-1.5) USER MOD Single : A 858 GLN : amide:sc= -0.415 K(o=-0.42,f=-1.2) USER MOD Single : A 860 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 864 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 869 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.016) USER MOD Single : A 870 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 874 SER OG : rot 180:sc= 0 USER MOD Single : A 880 TYR OH : rot 180:sc= 0 USER MOD Single : A 885 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 887 ASN :FLIP amide:sc= -2.8! C(o=-4.1!,f=-2.8!) USER MOD Single : A 889 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 890 GLN : amide:sc= -0.496 X(o=-0.5,f=-0.34) USER MOD Single : A 891 TYR OH : rot 47:sc= 0.0311 USER MOD Single : A 893 TYR OH : rot 180:sc= 0 USER MOD Single : A 896 SER OG : rot 180:sc= 0 USER MOD Single : A 899 SER OG : rot 180:sc= 0 USER MOD Single : A 900 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 801 -18.577 -17.689 -26.836 1.00 0.00 N ATOM 2 CA GLY A 801 -19.090 -16.378 -26.484 1.00 0.00 C ATOM 3 C GLY A 801 -18.014 -15.464 -25.933 1.00 0.00 C ATOM 4 O GLY A 801 -16.934 -15.920 -25.558 1.00 0.00 O ATOM 0 HA2 GLY A 801 -19.537 -15.918 -27.365 1.00 0.00 H new ATOM 0 HA3 GLY A 801 -19.883 -16.488 -25.744 1.00 0.00 H new ATOM 8 N SER A 802 -18.308 -14.168 -25.884 1.00 0.00 N ATOM 9 CA SER A 802 -17.355 -13.187 -25.380 1.00 0.00 C ATOM 10 C SER A 802 -18.075 -11.944 -24.866 1.00 0.00 C ATOM 11 O SER A 802 -19.143 -11.583 -25.360 1.00 0.00 O ATOM 12 CB SER A 802 -16.363 -12.797 -26.478 1.00 0.00 C ATOM 13 OG SER A 802 -15.573 -13.907 -26.869 1.00 0.00 O ATOM 0 H SER A 802 -19.199 -13.774 -26.187 1.00 0.00 H new ATOM 0 HA SER A 802 -16.810 -13.639 -24.551 1.00 0.00 H new ATOM 0 HB2 SER A 802 -16.905 -12.410 -27.341 1.00 0.00 H new ATOM 0 HB3 SER A 802 -15.717 -11.995 -26.121 1.00 0.00 H new ATOM 0 HG SER A 802 -15.847 -14.699 -26.360 1.00 0.00 H new ATOM 19 N SER A 803 -17.483 -11.294 -23.869 1.00 0.00 N ATOM 20 CA SER A 803 -18.069 -10.094 -23.283 1.00 0.00 C ATOM 21 C SER A 803 -16.984 -9.158 -22.762 1.00 0.00 C ATOM 22 O SER A 803 -15.803 -9.502 -22.754 1.00 0.00 O ATOM 23 CB SER A 803 -19.024 -10.469 -22.148 1.00 0.00 C ATOM 24 OG SER A 803 -19.914 -9.406 -21.858 1.00 0.00 O ATOM 0 H SER A 803 -16.598 -11.578 -23.450 1.00 0.00 H new ATOM 0 HA SER A 803 -18.628 -9.575 -24.062 1.00 0.00 H new ATOM 0 HB2 SER A 803 -19.592 -11.357 -22.425 1.00 0.00 H new ATOM 0 HB3 SER A 803 -18.452 -10.722 -21.256 1.00 0.00 H new ATOM 0 HG SER A 803 -20.515 -9.671 -21.131 1.00 0.00 H new ATOM 30 N GLY A 804 -17.394 -7.971 -22.326 1.00 0.00 N ATOM 31 CA GLY A 804 -16.445 -7.002 -21.809 1.00 0.00 C ATOM 32 C GLY A 804 -17.021 -5.601 -21.749 1.00 0.00 C ATOM 33 O GLY A 804 -17.472 -5.065 -22.761 1.00 0.00 O ATOM 0 H GLY A 804 -18.366 -7.663 -22.321 1.00 0.00 H new ATOM 0 HA2 GLY A 804 -16.129 -7.305 -20.811 1.00 0.00 H new ATOM 0 HA3 GLY A 804 -15.555 -6.999 -22.438 1.00 0.00 H new ATOM 37 N SER A 805 -17.008 -5.008 -20.560 1.00 0.00 N ATOM 38 CA SER A 805 -17.538 -3.663 -20.371 1.00 0.00 C ATOM 39 C SER A 805 -16.838 -2.961 -19.211 1.00 0.00 C ATOM 40 O SER A 805 -16.050 -3.570 -18.487 1.00 0.00 O ATOM 41 CB SER A 805 -19.045 -3.717 -20.114 1.00 0.00 C ATOM 42 OG SER A 805 -19.753 -4.046 -21.296 1.00 0.00 O ATOM 0 H SER A 805 -16.636 -5.438 -19.713 1.00 0.00 H new ATOM 0 HA SER A 805 -17.352 -3.095 -21.282 1.00 0.00 H new ATOM 0 HB2 SER A 805 -19.259 -4.455 -19.341 1.00 0.00 H new ATOM 0 HB3 SER A 805 -19.388 -2.753 -19.738 1.00 0.00 H new ATOM 0 HG SER A 805 -19.117 -4.288 -22.002 1.00 0.00 H new ATOM 48 N SER A 806 -17.131 -1.676 -19.042 1.00 0.00 N ATOM 49 CA SER A 806 -16.527 -0.888 -17.973 1.00 0.00 C ATOM 50 C SER A 806 -17.518 0.135 -17.426 1.00 0.00 C ATOM 51 O SER A 806 -18.378 0.632 -18.151 1.00 0.00 O ATOM 52 CB SER A 806 -15.272 -0.177 -18.481 1.00 0.00 C ATOM 53 OG SER A 806 -15.578 0.691 -19.558 1.00 0.00 O ATOM 0 H SER A 806 -17.783 -1.158 -19.631 1.00 0.00 H new ATOM 0 HA SER A 806 -16.250 -1.567 -17.167 1.00 0.00 H new ATOM 0 HB2 SER A 806 -14.819 0.392 -17.669 1.00 0.00 H new ATOM 0 HB3 SER A 806 -14.537 -0.915 -18.802 1.00 0.00 H new ATOM 0 HG SER A 806 -14.759 1.135 -19.863 1.00 0.00 H new ATOM 59 N GLY A 807 -17.391 0.444 -16.139 1.00 0.00 N ATOM 60 CA GLY A 807 -18.280 1.405 -15.515 1.00 0.00 C ATOM 61 C GLY A 807 -17.588 2.228 -14.446 1.00 0.00 C ATOM 62 O GLY A 807 -17.389 1.758 -13.325 1.00 0.00 O ATOM 0 H GLY A 807 -16.687 0.045 -15.517 1.00 0.00 H new ATOM 0 HA2 GLY A 807 -18.683 2.071 -16.278 1.00 0.00 H new ATOM 0 HA3 GLY A 807 -19.126 0.879 -15.073 1.00 0.00 H new ATOM 66 N ILE A 808 -17.219 3.456 -14.793 1.00 0.00 N ATOM 67 CA ILE A 808 -16.545 4.344 -13.855 1.00 0.00 C ATOM 68 C ILE A 808 -17.465 4.726 -12.700 1.00 0.00 C ATOM 69 O ILE A 808 -18.465 5.416 -12.894 1.00 0.00 O ATOM 70 CB ILE A 808 -16.052 5.627 -14.549 1.00 0.00 C ATOM 71 CG1 ILE A 808 -15.086 5.280 -15.684 1.00 0.00 C ATOM 72 CG2 ILE A 808 -15.384 6.552 -13.542 1.00 0.00 C ATOM 73 CD1 ILE A 808 -14.931 6.386 -16.705 1.00 0.00 C ATOM 0 H ILE A 808 -17.376 3.859 -15.717 1.00 0.00 H new ATOM 0 HA ILE A 808 -15.686 3.797 -13.466 1.00 0.00 H new ATOM 0 HB ILE A 808 -16.912 6.145 -14.974 1.00 0.00 H new ATOM 0 HG12 ILE A 808 -14.109 5.048 -15.260 1.00 0.00 H new ATOM 0 HG13 ILE A 808 -15.438 4.379 -16.187 1.00 0.00 H new ATOM 0 HG21 ILE A 808 -15.041 7.454 -14.048 1.00 0.00 H new ATOM 0 HG22 ILE A 808 -16.099 6.822 -12.765 1.00 0.00 H new ATOM 0 HG23 ILE A 808 -14.532 6.044 -13.090 1.00 0.00 H new ATOM 0 HD11 ILE A 808 -14.232 6.071 -17.480 1.00 0.00 H new ATOM 0 HD12 ILE A 808 -15.899 6.603 -17.156 1.00 0.00 H new ATOM 0 HD13 ILE A 808 -14.550 7.282 -16.216 1.00 0.00 H new ATOM 85 N GLN A 809 -17.119 4.273 -11.500 1.00 0.00 N ATOM 86 CA GLN A 809 -17.914 4.568 -10.314 1.00 0.00 C ATOM 87 C GLN A 809 -17.372 5.795 -9.587 1.00 0.00 C ATOM 88 O GLN A 809 -16.163 5.944 -9.418 1.00 0.00 O ATOM 89 CB GLN A 809 -17.926 3.365 -9.369 1.00 0.00 C ATOM 90 CG GLN A 809 -16.554 3.009 -8.819 1.00 0.00 C ATOM 91 CD GLN A 809 -16.587 1.801 -7.905 1.00 0.00 C ATOM 92 OE1 GLN A 809 -17.362 1.753 -6.949 1.00 0.00 O ATOM 93 NE2 GLN A 809 -15.744 0.816 -8.193 1.00 0.00 N ATOM 0 H GLN A 809 -16.294 3.700 -11.323 1.00 0.00 H new ATOM 0 HA GLN A 809 -18.934 4.779 -10.635 1.00 0.00 H new ATOM 0 HB2 GLN A 809 -18.599 3.574 -8.537 1.00 0.00 H new ATOM 0 HB3 GLN A 809 -18.331 2.502 -9.898 1.00 0.00 H new ATOM 0 HG2 GLN A 809 -15.874 2.814 -9.648 1.00 0.00 H new ATOM 0 HG3 GLN A 809 -16.153 3.863 -8.272 1.00 0.00 H new ATOM 0 HE21 GLN A 809 -15.119 0.898 -8.995 1.00 0.00 H new ATOM 0 HE22 GLN A 809 -15.721 -0.022 -7.612 1.00 0.00 H new ATOM 102 N MET A 810 -18.276 6.670 -9.159 1.00 0.00 N ATOM 103 CA MET A 810 -17.889 7.883 -8.449 1.00 0.00 C ATOM 104 C MET A 810 -17.456 7.563 -7.022 1.00 0.00 C ATOM 105 O MET A 810 -17.513 6.413 -6.587 1.00 0.00 O ATOM 106 CB MET A 810 -19.047 8.882 -8.432 1.00 0.00 C ATOM 107 CG MET A 810 -20.304 8.343 -7.768 1.00 0.00 C ATOM 108 SD MET A 810 -21.528 9.628 -7.450 1.00 0.00 S ATOM 109 CE MET A 810 -22.378 8.943 -6.030 1.00 0.00 C ATOM 0 H MET A 810 -19.282 6.561 -9.292 1.00 0.00 H new ATOM 0 HA MET A 810 -17.044 8.328 -8.975 1.00 0.00 H new ATOM 0 HB2 MET A 810 -18.729 9.785 -7.911 1.00 0.00 H new ATOM 0 HB3 MET A 810 -19.282 9.171 -9.456 1.00 0.00 H new ATOM 0 HG2 MET A 810 -20.746 7.576 -8.404 1.00 0.00 H new ATOM 0 HG3 MET A 810 -20.036 7.862 -6.828 1.00 0.00 H new ATOM 0 HE1 MET A 810 -23.167 9.625 -5.714 1.00 0.00 H new ATOM 0 HE2 MET A 810 -22.816 7.981 -6.297 1.00 0.00 H new ATOM 0 HE3 MET A 810 -21.669 8.805 -5.213 1.00 0.00 H new ATOM 119 N LYS A 811 -17.023 8.588 -6.296 1.00 0.00 N ATOM 120 CA LYS A 811 -16.581 8.418 -4.917 1.00 0.00 C ATOM 121 C LYS A 811 -16.480 9.764 -4.207 1.00 0.00 C ATOM 122 O LYS A 811 -15.930 10.722 -4.750 1.00 0.00 O ATOM 123 CB LYS A 811 -15.227 7.705 -4.878 1.00 0.00 C ATOM 124 CG LYS A 811 -14.115 8.474 -5.570 1.00 0.00 C ATOM 125 CD LYS A 811 -12.771 7.787 -5.398 1.00 0.00 C ATOM 126 CE LYS A 811 -11.630 8.664 -5.890 1.00 0.00 C ATOM 127 NZ LYS A 811 -11.714 8.912 -7.356 1.00 0.00 N ATOM 0 H LYS A 811 -16.969 9.547 -6.640 1.00 0.00 H new ATOM 0 HA LYS A 811 -17.321 7.809 -4.398 1.00 0.00 H new ATOM 0 HB2 LYS A 811 -14.946 7.533 -3.839 1.00 0.00 H new ATOM 0 HB3 LYS A 811 -15.327 6.726 -5.347 1.00 0.00 H new ATOM 0 HG2 LYS A 811 -14.343 8.569 -6.632 1.00 0.00 H new ATOM 0 HG3 LYS A 811 -14.063 9.484 -5.164 1.00 0.00 H new ATOM 0 HD2 LYS A 811 -12.617 7.544 -4.347 1.00 0.00 H new ATOM 0 HD3 LYS A 811 -12.770 6.845 -5.946 1.00 0.00 H new ATOM 0 HE2 LYS A 811 -11.648 9.616 -5.359 1.00 0.00 H new ATOM 0 HE3 LYS A 811 -10.678 8.187 -5.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 811 -10.883 9.456 -7.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 811 -11.739 8.003 -7.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 811 -12.578 9.450 -7.568 1.00 0.00 H new ATOM 141 N GLU A 812 -17.012 9.828 -2.991 1.00 0.00 N ATOM 142 CA GLU A 812 -16.980 11.058 -2.208 1.00 0.00 C ATOM 143 C GLU A 812 -15.551 11.408 -1.802 1.00 0.00 C ATOM 144 O GLU A 812 -14.717 10.525 -1.598 1.00 0.00 O ATOM 145 CB GLU A 812 -17.856 10.918 -0.961 1.00 0.00 C ATOM 146 CG GLU A 812 -17.348 9.881 0.027 1.00 0.00 C ATOM 147 CD GLU A 812 -16.368 10.461 1.029 1.00 0.00 C ATOM 148 OE1 GLU A 812 -16.745 11.409 1.748 1.00 0.00 O ATOM 149 OE2 GLU A 812 -15.223 9.966 1.093 1.00 0.00 O ATOM 0 H GLU A 812 -17.470 9.044 -2.527 1.00 0.00 H new ATOM 0 HA GLU A 812 -17.371 11.864 -2.829 1.00 0.00 H new ATOM 0 HB2 GLU A 812 -17.918 11.884 -0.461 1.00 0.00 H new ATOM 0 HB3 GLU A 812 -18.868 10.652 -1.266 1.00 0.00 H new ATOM 0 HG2 GLU A 812 -18.194 9.448 0.561 1.00 0.00 H new ATOM 0 HG3 GLU A 812 -16.866 9.070 -0.519 1.00 0.00 H new ATOM 156 N THR A 813 -15.275 12.703 -1.687 1.00 0.00 N ATOM 157 CA THR A 813 -13.947 13.171 -1.308 1.00 0.00 C ATOM 158 C THR A 813 -13.982 13.897 0.032 1.00 0.00 C ATOM 159 O THR A 813 -14.976 14.536 0.378 1.00 0.00 O ATOM 160 CB THR A 813 -13.358 14.113 -2.374 1.00 0.00 C ATOM 161 OG1 THR A 813 -13.310 13.449 -3.642 1.00 0.00 O ATOM 162 CG2 THR A 813 -11.961 14.569 -1.981 1.00 0.00 C ATOM 0 H THR A 813 -15.953 13.447 -1.851 1.00 0.00 H new ATOM 0 HA THR A 813 -13.313 12.288 -1.224 1.00 0.00 H new ATOM 0 HB THR A 813 -14.001 14.990 -2.448 1.00 0.00 H new ATOM 0 HG1 THR A 813 -12.936 14.055 -4.315 1.00 0.00 H new ATOM 0 HG21 THR A 813 -11.566 15.233 -2.749 1.00 0.00 H new ATOM 0 HG22 THR A 813 -12.006 15.100 -1.030 1.00 0.00 H new ATOM 0 HG23 THR A 813 -11.309 13.701 -1.882 1.00 0.00 H new ATOM 170 N VAL A 814 -12.891 13.795 0.784 1.00 0.00 N ATOM 171 CA VAL A 814 -12.796 14.444 2.086 1.00 0.00 C ATOM 172 C VAL A 814 -11.375 14.926 2.357 1.00 0.00 C ATOM 173 O VAL A 814 -10.408 14.340 1.873 1.00 0.00 O ATOM 174 CB VAL A 814 -13.230 13.495 3.219 1.00 0.00 C ATOM 175 CG1 VAL A 814 -12.247 12.341 3.355 1.00 0.00 C ATOM 176 CG2 VAL A 814 -13.357 14.255 4.530 1.00 0.00 C ATOM 0 H VAL A 814 -12.060 13.269 0.514 1.00 0.00 H new ATOM 0 HA VAL A 814 -13.469 15.301 2.063 1.00 0.00 H new ATOM 0 HB VAL A 814 -14.207 13.081 2.969 1.00 0.00 H new ATOM 0 HG11 VAL A 814 -12.570 11.681 4.160 1.00 0.00 H new ATOM 0 HG12 VAL A 814 -12.211 11.782 2.420 1.00 0.00 H new ATOM 0 HG13 VAL A 814 -11.255 12.733 3.582 1.00 0.00 H new ATOM 0 HG21 VAL A 814 -13.664 13.569 5.320 1.00 0.00 H new ATOM 0 HG22 VAL A 814 -12.395 14.698 4.788 1.00 0.00 H new ATOM 0 HG23 VAL A 814 -14.103 15.043 4.423 1.00 0.00 H new ATOM 186 N GLU A 815 -11.258 15.997 3.136 1.00 0.00 N ATOM 187 CA GLU A 815 -9.955 16.558 3.472 1.00 0.00 C ATOM 188 C GLU A 815 -9.749 16.588 4.983 1.00 0.00 C ATOM 189 O GLU A 815 -10.662 16.287 5.750 1.00 0.00 O ATOM 190 CB GLU A 815 -9.820 17.971 2.899 1.00 0.00 C ATOM 191 CG GLU A 815 -10.641 19.010 3.644 1.00 0.00 C ATOM 192 CD GLU A 815 -11.014 20.193 2.771 1.00 0.00 C ATOM 193 OE1 GLU A 815 -11.276 19.983 1.568 1.00 0.00 O ATOM 194 OE2 GLU A 815 -11.043 21.328 3.291 1.00 0.00 O ATOM 0 H GLU A 815 -12.049 16.493 3.546 1.00 0.00 H new ATOM 0 HA GLU A 815 -9.189 15.920 3.031 1.00 0.00 H new ATOM 0 HB2 GLU A 815 -8.771 18.265 2.922 1.00 0.00 H new ATOM 0 HB3 GLU A 815 -10.125 17.961 1.853 1.00 0.00 H new ATOM 0 HG2 GLU A 815 -11.549 18.544 4.026 1.00 0.00 H new ATOM 0 HG3 GLU A 815 -10.077 19.363 4.507 1.00 0.00 H new ATOM 201 N GLU A 816 -8.541 16.954 5.403 1.00 0.00 N ATOM 202 CA GLU A 816 -8.215 17.022 6.822 1.00 0.00 C ATOM 203 C GLU A 816 -6.946 17.839 7.050 1.00 0.00 C ATOM 204 O GLU A 816 -6.006 17.778 6.258 1.00 0.00 O ATOM 205 CB GLU A 816 -8.037 15.614 7.395 1.00 0.00 C ATOM 206 CG GLU A 816 -7.738 15.597 8.885 1.00 0.00 C ATOM 207 CD GLU A 816 -8.985 15.755 9.733 1.00 0.00 C ATOM 208 OE1 GLU A 816 -10.053 15.263 9.312 1.00 0.00 O ATOM 209 OE2 GLU A 816 -8.893 16.369 10.816 1.00 0.00 O ATOM 0 H GLU A 816 -7.773 17.207 4.781 1.00 0.00 H new ATOM 0 HA GLU A 816 -9.041 17.514 7.335 1.00 0.00 H new ATOM 0 HB2 GLU A 816 -8.943 15.037 7.208 1.00 0.00 H new ATOM 0 HB3 GLU A 816 -7.226 15.115 6.864 1.00 0.00 H new ATOM 0 HG2 GLU A 816 -7.245 14.659 9.142 1.00 0.00 H new ATOM 0 HG3 GLU A 816 -7.039 16.400 9.121 1.00 0.00 H new ATOM 216 N GLN A 817 -6.929 18.604 8.137 1.00 0.00 N ATOM 217 CA GLN A 817 -5.778 19.434 8.469 1.00 0.00 C ATOM 218 C GLN A 817 -4.784 18.667 9.334 1.00 0.00 C ATOM 219 O GLN A 817 -5.098 18.276 10.458 1.00 0.00 O ATOM 220 CB GLN A 817 -6.229 20.704 9.193 1.00 0.00 C ATOM 221 CG GLN A 817 -5.129 21.741 9.346 1.00 0.00 C ATOM 222 CD GLN A 817 -5.511 22.862 10.292 1.00 0.00 C ATOM 223 OE1 GLN A 817 -5.584 24.026 9.896 1.00 0.00 O ATOM 224 NE2 GLN A 817 -5.758 22.518 11.550 1.00 0.00 N ATOM 0 H GLN A 817 -7.700 18.666 8.802 1.00 0.00 H new ATOM 0 HA GLN A 817 -5.283 19.712 7.539 1.00 0.00 H new ATOM 0 HB2 GLN A 817 -7.061 21.148 8.646 1.00 0.00 H new ATOM 0 HB3 GLN A 817 -6.603 20.435 10.181 1.00 0.00 H new ATOM 0 HG2 GLN A 817 -4.225 21.255 9.712 1.00 0.00 H new ATOM 0 HG3 GLN A 817 -4.892 22.161 8.368 1.00 0.00 H new ATOM 0 HE21 GLN A 817 -5.686 21.541 11.835 1.00 0.00 H new ATOM 0 HE22 GLN A 817 -6.020 23.230 12.231 1.00 0.00 H new ATOM 233 N ALA A 818 -3.585 18.454 8.803 1.00 0.00 N ATOM 234 CA ALA A 818 -2.545 17.734 9.528 1.00 0.00 C ATOM 235 C ALA A 818 -2.480 18.183 10.984 1.00 0.00 C ATOM 236 O ALA A 818 -2.289 19.365 11.271 1.00 0.00 O ATOM 237 CB ALA A 818 -1.196 17.933 8.852 1.00 0.00 C ATOM 0 H ALA A 818 -3.309 18.770 7.873 1.00 0.00 H new ATOM 0 HA ALA A 818 -2.794 16.673 9.513 1.00 0.00 H new ATOM 0 HB1 ALA A 818 -0.429 17.390 9.404 1.00 0.00 H new ATOM 0 HB2 ALA A 818 -1.242 17.557 7.830 1.00 0.00 H new ATOM 0 HB3 ALA A 818 -0.949 18.995 8.837 1.00 0.00 H new ATOM 243 N SER A 819 -2.640 17.233 11.899 1.00 0.00 N ATOM 244 CA SER A 819 -2.604 17.531 13.326 1.00 0.00 C ATOM 245 C SER A 819 -1.760 16.504 14.075 1.00 0.00 C ATOM 246 O SER A 819 -1.971 15.298 13.948 1.00 0.00 O ATOM 247 CB SER A 819 -4.022 17.558 13.899 1.00 0.00 C ATOM 248 OG SER A 819 -4.833 18.493 13.209 1.00 0.00 O ATOM 0 H SER A 819 -2.796 16.250 11.678 1.00 0.00 H new ATOM 0 HA SER A 819 -2.149 18.513 13.455 1.00 0.00 H new ATOM 0 HB2 SER A 819 -4.465 16.565 13.828 1.00 0.00 H new ATOM 0 HB3 SER A 819 -3.985 17.815 14.958 1.00 0.00 H new ATOM 0 HG SER A 819 -4.903 18.232 12.267 1.00 0.00 H new ATOM 254 N THR A 820 -0.801 16.992 14.856 1.00 0.00 N ATOM 255 CA THR A 820 0.077 16.119 15.625 1.00 0.00 C ATOM 256 C THR A 820 -0.646 15.541 16.836 1.00 0.00 C ATOM 257 O THR A 820 -1.181 16.279 17.664 1.00 0.00 O ATOM 258 CB THR A 820 1.336 16.867 16.102 1.00 0.00 C ATOM 259 OG1 THR A 820 2.062 17.371 14.975 1.00 0.00 O ATOM 260 CG2 THR A 820 2.232 15.950 16.920 1.00 0.00 C ATOM 0 H THR A 820 -0.613 17.988 14.972 1.00 0.00 H new ATOM 0 HA THR A 820 0.375 15.307 14.962 1.00 0.00 H new ATOM 0 HB THR A 820 1.022 17.699 16.733 1.00 0.00 H new ATOM 0 HG1 THR A 820 2.860 17.847 15.286 1.00 0.00 H new ATOM 0 HG21 THR A 820 3.115 16.500 17.246 1.00 0.00 H new ATOM 0 HG22 THR A 820 1.686 15.591 17.792 1.00 0.00 H new ATOM 0 HG23 THR A 820 2.539 15.101 16.309 1.00 0.00 H new ATOM 268 N THR A 821 -0.659 14.215 16.934 1.00 0.00 N ATOM 269 CA THR A 821 -1.317 13.537 18.044 1.00 0.00 C ATOM 270 C THR A 821 -0.715 12.157 18.280 1.00 0.00 C ATOM 271 O THR A 821 -0.472 11.407 17.335 1.00 0.00 O ATOM 272 CB THR A 821 -2.830 13.390 17.795 1.00 0.00 C ATOM 273 OG1 THR A 821 -3.404 14.667 17.497 1.00 0.00 O ATOM 274 CG2 THR A 821 -3.522 12.787 19.008 1.00 0.00 C ATOM 0 H THR A 821 -0.221 13.589 16.258 1.00 0.00 H new ATOM 0 HA THR A 821 -1.161 14.154 18.929 1.00 0.00 H new ATOM 0 HB THR A 821 -2.973 12.722 16.946 1.00 0.00 H new ATOM 0 HG1 THR A 821 -4.366 14.564 17.339 1.00 0.00 H new ATOM 0 HG21 THR A 821 -4.589 12.693 18.809 1.00 0.00 H new ATOM 0 HG22 THR A 821 -3.103 11.802 19.214 1.00 0.00 H new ATOM 0 HG23 THR A 821 -3.370 13.433 19.872 1.00 0.00 H new ATOM 282 N GLU A 822 -0.478 11.828 19.546 1.00 0.00 N ATOM 283 CA GLU A 822 0.095 10.536 19.904 1.00 0.00 C ATOM 284 C GLU A 822 -0.398 9.441 18.962 1.00 0.00 C ATOM 285 O GLU A 822 0.398 8.706 18.378 1.00 0.00 O ATOM 286 CB GLU A 822 -0.260 10.179 21.349 1.00 0.00 C ATOM 287 CG GLU A 822 0.706 9.194 21.988 1.00 0.00 C ATOM 288 CD GLU A 822 2.092 9.779 22.180 1.00 0.00 C ATOM 289 OE1 GLU A 822 2.836 9.885 21.182 1.00 0.00 O ATOM 290 OE2 GLU A 822 2.433 10.130 23.329 1.00 0.00 O ATOM 0 H GLU A 822 -0.674 12.438 20.340 1.00 0.00 H new ATOM 0 HA GLU A 822 1.178 10.610 19.811 1.00 0.00 H new ATOM 0 HB2 GLU A 822 -0.282 11.091 21.945 1.00 0.00 H new ATOM 0 HB3 GLU A 822 -1.265 9.757 21.374 1.00 0.00 H new ATOM 0 HG2 GLU A 822 0.312 8.878 22.954 1.00 0.00 H new ATOM 0 HG3 GLU A 822 0.775 8.302 21.365 1.00 0.00 H new ATOM 297 N ARG A 823 -1.715 9.340 18.821 1.00 0.00 N ATOM 298 CA ARG A 823 -2.315 8.335 17.952 1.00 0.00 C ATOM 299 C ARG A 823 -1.588 8.271 16.612 1.00 0.00 C ATOM 300 O ARG A 823 -1.216 7.194 16.146 1.00 0.00 O ATOM 301 CB ARG A 823 -3.797 8.643 17.727 1.00 0.00 C ATOM 302 CG ARG A 823 -4.639 8.538 18.987 1.00 0.00 C ATOM 303 CD ARG A 823 -6.109 8.803 18.699 1.00 0.00 C ATOM 304 NE ARG A 823 -6.763 7.651 18.084 1.00 0.00 N ATOM 305 CZ ARG A 823 -7.117 6.562 18.757 1.00 0.00 C ATOM 306 NH1 ARG A 823 -6.882 6.477 20.059 1.00 0.00 N ATOM 307 NH2 ARG A 823 -7.708 5.555 18.127 1.00 0.00 N ATOM 0 H ARG A 823 -2.387 9.942 19.297 1.00 0.00 H new ATOM 0 HA ARG A 823 -2.223 7.366 18.442 1.00 0.00 H new ATOM 0 HB2 ARG A 823 -3.892 9.649 17.319 1.00 0.00 H new ATOM 0 HB3 ARG A 823 -4.192 7.957 16.978 1.00 0.00 H new ATOM 0 HG2 ARG A 823 -4.525 7.544 19.420 1.00 0.00 H new ATOM 0 HG3 ARG A 823 -4.278 9.252 19.728 1.00 0.00 H new ATOM 0 HD2 ARG A 823 -6.620 9.057 19.628 1.00 0.00 H new ATOM 0 HD3 ARG A 823 -6.199 9.666 18.039 1.00 0.00 H new ATOM 0 HE ARG A 823 -6.958 7.685 17.083 1.00 0.00 H new ATOM 0 HH11 ARG A 823 -6.428 7.249 20.547 1.00 0.00 H new ATOM 0 HH12 ARG A 823 -7.155 5.639 20.573 1.00 0.00 H new ATOM 0 HH21 ARG A 823 -7.891 5.617 17.125 1.00 0.00 H new ATOM 0 HH22 ARG A 823 -7.980 4.719 18.644 1.00 0.00 H new ATOM 321 N VAL A 824 -1.390 9.432 15.996 1.00 0.00 N ATOM 322 CA VAL A 824 -0.708 9.508 14.710 1.00 0.00 C ATOM 323 C VAL A 824 0.634 8.787 14.756 1.00 0.00 C ATOM 324 O VAL A 824 0.968 8.016 13.856 1.00 0.00 O ATOM 325 CB VAL A 824 -0.478 10.970 14.283 1.00 0.00 C ATOM 326 CG1 VAL A 824 0.298 11.029 12.976 1.00 0.00 C ATOM 327 CG2 VAL A 824 -1.805 11.703 14.157 1.00 0.00 C ATOM 0 H VAL A 824 -1.692 10.333 16.367 1.00 0.00 H new ATOM 0 HA VAL A 824 -1.354 9.021 13.980 1.00 0.00 H new ATOM 0 HB VAL A 824 0.114 11.466 15.052 1.00 0.00 H new ATOM 0 HG11 VAL A 824 0.451 12.070 12.690 1.00 0.00 H new ATOM 0 HG12 VAL A 824 1.265 10.542 13.105 1.00 0.00 H new ATOM 0 HG13 VAL A 824 -0.265 10.517 12.195 1.00 0.00 H new ATOM 0 HG21 VAL A 824 -1.624 12.734 13.855 1.00 0.00 H new ATOM 0 HG22 VAL A 824 -2.424 11.209 13.408 1.00 0.00 H new ATOM 0 HG23 VAL A 824 -2.320 11.692 15.118 1.00 0.00 H new ATOM 337 N PHE A 825 1.401 9.042 15.811 1.00 0.00 N ATOM 338 CA PHE A 825 2.708 8.417 15.976 1.00 0.00 C ATOM 339 C PHE A 825 2.678 6.963 15.515 1.00 0.00 C ATOM 340 O PHE A 825 3.522 6.533 14.730 1.00 0.00 O ATOM 341 CB PHE A 825 3.153 8.492 17.438 1.00 0.00 C ATOM 342 CG PHE A 825 4.594 8.126 17.646 1.00 0.00 C ATOM 343 CD1 PHE A 825 4.980 6.798 17.731 1.00 0.00 C ATOM 344 CD2 PHE A 825 5.564 9.110 17.755 1.00 0.00 C ATOM 345 CE1 PHE A 825 6.306 6.459 17.923 1.00 0.00 C ATOM 346 CE2 PHE A 825 6.892 8.776 17.946 1.00 0.00 C ATOM 347 CZ PHE A 825 7.263 7.449 18.030 1.00 0.00 C ATOM 0 H PHE A 825 1.140 9.678 16.565 1.00 0.00 H new ATOM 0 HA PHE A 825 3.423 8.961 15.358 1.00 0.00 H new ATOM 0 HB2 PHE A 825 2.986 9.503 17.809 1.00 0.00 H new ATOM 0 HB3 PHE A 825 2.528 7.827 18.034 1.00 0.00 H new ATOM 0 HD1 PHE A 825 4.237 6.019 17.646 1.00 0.00 H new ATOM 0 HD2 PHE A 825 5.279 10.150 17.690 1.00 0.00 H new ATOM 0 HE1 PHE A 825 6.594 5.420 17.989 1.00 0.00 H new ATOM 0 HE2 PHE A 825 7.638 9.552 18.029 1.00 0.00 H new ATOM 0 HZ PHE A 825 8.300 7.185 18.179 1.00 0.00 H new ATOM 357 N GLN A 826 1.699 6.212 16.011 1.00 0.00 N ATOM 358 CA GLN A 826 1.559 4.806 15.651 1.00 0.00 C ATOM 359 C GLN A 826 1.222 4.653 14.172 1.00 0.00 C ATOM 360 O GLN A 826 1.740 3.764 13.496 1.00 0.00 O ATOM 361 CB GLN A 826 0.475 4.145 16.504 1.00 0.00 C ATOM 362 CG GLN A 826 0.967 3.694 17.870 1.00 0.00 C ATOM 363 CD GLN A 826 -0.168 3.323 18.805 1.00 0.00 C ATOM 364 OE1 GLN A 826 -0.913 2.376 18.551 1.00 0.00 O ATOM 365 NE2 GLN A 826 -0.305 4.069 19.895 1.00 0.00 N ATOM 0 H GLN A 826 0.992 6.554 16.662 1.00 0.00 H new ATOM 0 HA GLN A 826 2.512 4.312 15.840 1.00 0.00 H new ATOM 0 HB2 GLN A 826 -0.349 4.846 16.637 1.00 0.00 H new ATOM 0 HB3 GLN A 826 0.077 3.284 15.968 1.00 0.00 H new ATOM 0 HG2 GLN A 826 1.628 2.836 17.749 1.00 0.00 H new ATOM 0 HG3 GLN A 826 1.558 4.491 18.321 1.00 0.00 H new ATOM 0 HE21 GLN A 826 0.335 4.844 20.066 1.00 0.00 H new ATOM 0 HE22 GLN A 826 -1.050 3.867 20.561 1.00 0.00 H new ATOM 374 N ASP A 827 0.352 5.525 13.675 1.00 0.00 N ATOM 375 CA ASP A 827 -0.054 5.488 12.275 1.00 0.00 C ATOM 376 C ASP A 827 1.160 5.573 11.355 1.00 0.00 C ATOM 377 O ASP A 827 1.256 4.843 10.369 1.00 0.00 O ATOM 378 CB ASP A 827 -1.021 6.633 11.972 1.00 0.00 C ATOM 379 CG ASP A 827 -1.398 6.699 10.505 1.00 0.00 C ATOM 380 OD1 ASP A 827 -0.513 7.004 9.678 1.00 0.00 O ATOM 381 OD2 ASP A 827 -2.577 6.445 10.183 1.00 0.00 O ATOM 0 H ASP A 827 -0.086 6.267 14.221 1.00 0.00 H new ATOM 0 HA ASP A 827 -0.559 4.539 12.093 1.00 0.00 H new ATOM 0 HB2 ASP A 827 -1.923 6.511 12.571 1.00 0.00 H new ATOM 0 HB3 ASP A 827 -0.566 7.578 12.270 1.00 0.00 H new ATOM 386 N ARG A 828 2.084 6.470 11.684 1.00 0.00 N ATOM 387 CA ARG A 828 3.290 6.653 10.886 1.00 0.00 C ATOM 388 C ARG A 828 4.143 5.388 10.893 1.00 0.00 C ATOM 389 O ARG A 828 4.239 4.689 9.885 1.00 0.00 O ATOM 390 CB ARG A 828 4.105 7.833 11.418 1.00 0.00 C ATOM 391 CG ARG A 828 5.189 8.305 10.463 1.00 0.00 C ATOM 392 CD ARG A 828 5.557 9.759 10.711 1.00 0.00 C ATOM 393 NE ARG A 828 6.347 9.924 11.928 1.00 0.00 N ATOM 394 CZ ARG A 828 6.955 11.057 12.262 1.00 0.00 C ATOM 395 NH1 ARG A 828 6.864 12.119 11.473 1.00 0.00 N ATOM 396 NH2 ARG A 828 7.656 11.129 13.386 1.00 0.00 N ATOM 0 H ARG A 828 2.020 7.081 12.498 1.00 0.00 H new ATOM 0 HA ARG A 828 2.988 6.862 9.860 1.00 0.00 H new ATOM 0 HB2 ARG A 828 3.431 8.664 11.628 1.00 0.00 H new ATOM 0 HB3 ARG A 828 4.565 7.548 12.364 1.00 0.00 H new ATOM 0 HG2 ARG A 828 6.074 7.680 10.579 1.00 0.00 H new ATOM 0 HG3 ARG A 828 4.847 8.186 9.435 1.00 0.00 H new ATOM 0 HD2 ARG A 828 6.120 10.141 9.859 1.00 0.00 H new ATOM 0 HD3 ARG A 828 4.648 10.355 10.786 1.00 0.00 H new ATOM 0 HE ARG A 828 6.437 9.125 12.556 1.00 0.00 H new ATOM 0 HH11 ARG A 828 6.326 12.067 10.608 1.00 0.00 H new ATOM 0 HH12 ARG A 828 7.332 12.988 11.731 1.00 0.00 H new ATOM 0 HH21 ARG A 828 7.729 10.314 13.995 1.00 0.00 H new ATOM 0 HH22 ARG A 828 8.122 11.999 13.641 1.00 0.00 H new ATOM 410 N GLN A 829 4.759 5.102 12.035 1.00 0.00 N ATOM 411 CA GLN A 829 5.604 3.921 12.172 1.00 0.00 C ATOM 412 C GLN A 829 4.998 2.730 11.438 1.00 0.00 C ATOM 413 O GLN A 829 5.694 2.010 10.721 1.00 0.00 O ATOM 414 CB GLN A 829 5.803 3.578 13.649 1.00 0.00 C ATOM 415 CG GLN A 829 4.502 3.355 14.402 1.00 0.00 C ATOM 416 CD GLN A 829 4.724 2.887 15.827 1.00 0.00 C ATOM 417 OE1 GLN A 829 4.541 1.711 16.142 1.00 0.00 O ATOM 418 NE2 GLN A 829 5.122 3.808 16.697 1.00 0.00 N ATOM 0 H GLN A 829 4.689 5.671 12.879 1.00 0.00 H new ATOM 0 HA GLN A 829 6.573 4.145 11.725 1.00 0.00 H new ATOM 0 HB2 GLN A 829 6.416 2.680 13.726 1.00 0.00 H new ATOM 0 HB3 GLN A 829 6.358 4.384 14.129 1.00 0.00 H new ATOM 0 HG2 GLN A 829 3.930 4.283 14.413 1.00 0.00 H new ATOM 0 HG3 GLN A 829 3.901 2.617 13.871 1.00 0.00 H new ATOM 0 HE21 GLN A 829 5.261 4.771 16.392 1.00 0.00 H new ATOM 0 HE22 GLN A 829 5.289 3.552 17.670 1.00 0.00 H new ATOM 427 N TYR A 830 3.699 2.527 11.621 1.00 0.00 N ATOM 428 CA TYR A 830 2.999 1.421 10.979 1.00 0.00 C ATOM 429 C TYR A 830 3.068 1.542 9.460 1.00 0.00 C ATOM 430 O TYR A 830 3.316 0.561 8.759 1.00 0.00 O ATOM 431 CB TYR A 830 1.539 1.380 11.433 1.00 0.00 C ATOM 432 CG TYR A 830 1.348 0.772 12.804 1.00 0.00 C ATOM 433 CD1 TYR A 830 1.987 -0.411 13.156 1.00 0.00 C ATOM 434 CD2 TYR A 830 0.528 1.379 13.747 1.00 0.00 C ATOM 435 CE1 TYR A 830 1.815 -0.971 14.407 1.00 0.00 C ATOM 436 CE2 TYR A 830 0.351 0.827 15.001 1.00 0.00 C ATOM 437 CZ TYR A 830 0.996 -0.348 15.326 1.00 0.00 C ATOM 438 OH TYR A 830 0.822 -0.901 16.574 1.00 0.00 O ATOM 0 H TYR A 830 3.108 3.115 12.209 1.00 0.00 H new ATOM 0 HA TYR A 830 3.490 0.494 11.275 1.00 0.00 H new ATOM 0 HB2 TYR A 830 1.140 2.394 11.436 1.00 0.00 H new ATOM 0 HB3 TYR A 830 0.958 0.810 10.708 1.00 0.00 H new ATOM 0 HD1 TYR A 830 2.629 -0.901 12.439 1.00 0.00 H new ATOM 0 HD2 TYR A 830 0.020 2.298 13.495 1.00 0.00 H new ATOM 0 HE1 TYR A 830 2.319 -1.891 14.664 1.00 0.00 H new ATOM 0 HE2 TYR A 830 -0.289 1.313 15.723 1.00 0.00 H new ATOM 0 HH TYR A 830 0.216 -0.338 17.100 1.00 0.00 H new ATOM 448 N GLN A 831 2.847 2.753 8.958 1.00 0.00 N ATOM 449 CA GLN A 831 2.883 3.003 7.522 1.00 0.00 C ATOM 450 C GLN A 831 4.205 2.535 6.922 1.00 0.00 C ATOM 451 O GLN A 831 4.227 1.894 5.871 1.00 0.00 O ATOM 452 CB GLN A 831 2.679 4.492 7.237 1.00 0.00 C ATOM 453 CG GLN A 831 1.226 4.931 7.312 1.00 0.00 C ATOM 454 CD GLN A 831 0.506 4.795 5.985 1.00 0.00 C ATOM 455 OE1 GLN A 831 0.566 3.750 5.337 1.00 0.00 O ATOM 456 NE2 GLN A 831 -0.181 5.854 5.572 1.00 0.00 N ATOM 0 H GLN A 831 2.641 3.576 9.524 1.00 0.00 H new ATOM 0 HA GLN A 831 2.074 2.438 7.059 1.00 0.00 H new ATOM 0 HB2 GLN A 831 3.263 5.073 7.950 1.00 0.00 H new ATOM 0 HB3 GLN A 831 3.068 4.720 6.245 1.00 0.00 H new ATOM 0 HG2 GLN A 831 0.709 4.335 8.064 1.00 0.00 H new ATOM 0 HG3 GLN A 831 1.181 5.969 7.641 1.00 0.00 H new ATOM 0 HE21 GLN A 831 -0.204 6.700 6.141 1.00 0.00 H new ATOM 0 HE22 GLN A 831 -0.686 5.821 4.686 1.00 0.00 H new ATOM 465 N ILE A 832 5.303 2.859 7.595 1.00 0.00 N ATOM 466 CA ILE A 832 6.628 2.471 7.128 1.00 0.00 C ATOM 467 C ILE A 832 6.770 0.954 7.076 1.00 0.00 C ATOM 468 O ILE A 832 6.968 0.375 6.007 1.00 0.00 O ATOM 469 CB ILE A 832 7.735 3.048 8.030 1.00 0.00 C ATOM 470 CG1 ILE A 832 7.806 4.569 7.877 1.00 0.00 C ATOM 471 CG2 ILE A 832 9.076 2.413 7.696 1.00 0.00 C ATOM 472 CD1 ILE A 832 6.664 5.299 8.548 1.00 0.00 C ATOM 0 H ILE A 832 5.302 3.390 8.466 1.00 0.00 H new ATOM 0 HA ILE A 832 6.740 2.879 6.123 1.00 0.00 H new ATOM 0 HB ILE A 832 7.495 2.817 9.068 1.00 0.00 H new ATOM 0 HG12 ILE A 832 8.748 4.924 8.294 1.00 0.00 H new ATOM 0 HG13 ILE A 832 7.813 4.819 6.816 1.00 0.00 H new ATOM 0 HG21 ILE A 832 9.848 2.831 8.342 1.00 0.00 H new ATOM 0 HG22 ILE A 832 9.017 1.336 7.852 1.00 0.00 H new ATOM 0 HG23 ILE A 832 9.325 2.616 6.655 1.00 0.00 H new ATOM 0 HD11 ILE A 832 6.780 6.372 8.398 1.00 0.00 H new ATOM 0 HD12 ILE A 832 5.719 4.972 8.115 1.00 0.00 H new ATOM 0 HD13 ILE A 832 6.669 5.079 9.616 1.00 0.00 H new ATOM 484 N ASP A 833 6.666 0.315 8.236 1.00 0.00 N ATOM 485 CA ASP A 833 6.780 -1.136 8.323 1.00 0.00 C ATOM 486 C ASP A 833 5.803 -1.816 7.369 1.00 0.00 C ATOM 487 O ASP A 833 6.207 -2.574 6.488 1.00 0.00 O ATOM 488 CB ASP A 833 6.521 -1.604 9.756 1.00 0.00 C ATOM 489 CG ASP A 833 7.785 -1.633 10.593 1.00 0.00 C ATOM 490 OD1 ASP A 833 8.751 -0.928 10.233 1.00 0.00 O ATOM 491 OD2 ASP A 833 7.808 -2.360 11.608 1.00 0.00 O ATOM 0 H ASP A 833 6.503 0.779 9.129 1.00 0.00 H new ATOM 0 HA ASP A 833 7.794 -1.414 8.035 1.00 0.00 H new ATOM 0 HB2 ASP A 833 5.793 -0.942 10.225 1.00 0.00 H new ATOM 0 HB3 ASP A 833 6.079 -2.600 9.736 1.00 0.00 H new ATOM 496 N ALA A 834 4.516 -1.539 7.551 1.00 0.00 N ATOM 497 CA ALA A 834 3.482 -2.122 6.705 1.00 0.00 C ATOM 498 C ALA A 834 3.923 -2.162 5.246 1.00 0.00 C ATOM 499 O ALA A 834 3.944 -3.223 4.623 1.00 0.00 O ATOM 500 CB ALA A 834 2.183 -1.342 6.845 1.00 0.00 C ATOM 0 H ALA A 834 4.165 -0.914 8.277 1.00 0.00 H new ATOM 0 HA ALA A 834 3.314 -3.147 7.034 1.00 0.00 H new ATOM 0 HB1 ALA A 834 1.420 -1.789 6.208 1.00 0.00 H new ATOM 0 HB2 ALA A 834 1.851 -1.371 7.883 1.00 0.00 H new ATOM 0 HB3 ALA A 834 2.346 -0.307 6.545 1.00 0.00 H new ATOM 506 N ALA A 835 4.275 -1.000 4.707 1.00 0.00 N ATOM 507 CA ALA A 835 4.718 -0.902 3.322 1.00 0.00 C ATOM 508 C ALA A 835 5.891 -1.838 3.053 1.00 0.00 C ATOM 509 O ALA A 835 5.952 -2.488 2.009 1.00 0.00 O ATOM 510 CB ALA A 835 5.098 0.533 2.989 1.00 0.00 C ATOM 0 H ALA A 835 4.262 -0.112 5.209 1.00 0.00 H new ATOM 0 HA ALA A 835 3.891 -1.205 2.680 1.00 0.00 H new ATOM 0 HB1 ALA A 835 5.427 0.591 1.951 1.00 0.00 H new ATOM 0 HB2 ALA A 835 4.233 1.181 3.132 1.00 0.00 H new ATOM 0 HB3 ALA A 835 5.906 0.857 3.644 1.00 0.00 H new ATOM 516 N ILE A 836 6.820 -1.901 4.001 1.00 0.00 N ATOM 517 CA ILE A 836 7.992 -2.758 3.866 1.00 0.00 C ATOM 518 C ILE A 836 7.596 -4.231 3.843 1.00 0.00 C ATOM 519 O ILE A 836 7.709 -4.900 2.816 1.00 0.00 O ATOM 520 CB ILE A 836 8.995 -2.526 5.011 1.00 0.00 C ATOM 521 CG1 ILE A 836 9.597 -1.122 4.913 1.00 0.00 C ATOM 522 CG2 ILE A 836 10.090 -3.581 4.978 1.00 0.00 C ATOM 523 CD1 ILE A 836 10.361 -0.705 6.150 1.00 0.00 C ATOM 0 H ILE A 836 6.784 -1.369 4.871 1.00 0.00 H new ATOM 0 HA ILE A 836 8.466 -2.496 2.920 1.00 0.00 H new ATOM 0 HB ILE A 836 8.466 -2.609 5.961 1.00 0.00 H new ATOM 0 HG12 ILE A 836 10.265 -1.081 4.052 1.00 0.00 H new ATOM 0 HG13 ILE A 836 8.797 -0.404 4.731 1.00 0.00 H new ATOM 0 HG21 ILE A 836 10.791 -3.403 5.793 1.00 0.00 H new ATOM 0 HG22 ILE A 836 9.646 -4.570 5.090 1.00 0.00 H new ATOM 0 HG23 ILE A 836 10.619 -3.527 4.026 1.00 0.00 H new ATOM 0 HD11 ILE A 836 10.760 0.300 6.010 1.00 0.00 H new ATOM 0 HD12 ILE A 836 9.692 -0.713 7.011 1.00 0.00 H new ATOM 0 HD13 ILE A 836 11.183 -1.400 6.322 1.00 0.00 H new ATOM 535 N VAL A 837 7.129 -4.730 4.983 1.00 0.00 N ATOM 536 CA VAL A 837 6.713 -6.123 5.095 1.00 0.00 C ATOM 537 C VAL A 837 5.916 -6.558 3.870 1.00 0.00 C ATOM 538 O VAL A 837 6.061 -7.682 3.390 1.00 0.00 O ATOM 539 CB VAL A 837 5.860 -6.355 6.357 1.00 0.00 C ATOM 540 CG1 VAL A 837 5.368 -7.793 6.412 1.00 0.00 C ATOM 541 CG2 VAL A 837 6.654 -6.006 7.607 1.00 0.00 C ATOM 0 H VAL A 837 7.029 -4.190 5.843 1.00 0.00 H new ATOM 0 HA VAL A 837 7.622 -6.720 5.165 1.00 0.00 H new ATOM 0 HB VAL A 837 4.990 -5.700 6.312 1.00 0.00 H new ATOM 0 HG11 VAL A 837 4.767 -7.938 7.310 1.00 0.00 H new ATOM 0 HG12 VAL A 837 4.761 -8.004 5.532 1.00 0.00 H new ATOM 0 HG13 VAL A 837 6.223 -8.469 6.434 1.00 0.00 H new ATOM 0 HG21 VAL A 837 6.037 -6.176 8.489 1.00 0.00 H new ATOM 0 HG22 VAL A 837 7.543 -6.634 7.660 1.00 0.00 H new ATOM 0 HG23 VAL A 837 6.952 -4.958 7.568 1.00 0.00 H new ATOM 551 N ARG A 838 5.075 -5.660 3.368 1.00 0.00 N ATOM 552 CA ARG A 838 4.254 -5.951 2.199 1.00 0.00 C ATOM 553 C ARG A 838 5.126 -6.234 0.980 1.00 0.00 C ATOM 554 O ARG A 838 4.969 -7.260 0.316 1.00 0.00 O ATOM 555 CB ARG A 838 3.313 -4.781 1.906 1.00 0.00 C ATOM 556 CG ARG A 838 2.051 -4.788 2.753 1.00 0.00 C ATOM 557 CD ARG A 838 1.340 -6.130 2.684 1.00 0.00 C ATOM 558 NE ARG A 838 -0.101 -5.997 2.877 1.00 0.00 N ATOM 559 CZ ARG A 838 -0.950 -7.017 2.807 1.00 0.00 C ATOM 560 NH1 ARG A 838 -0.503 -8.239 2.551 1.00 0.00 N ATOM 561 NH2 ARG A 838 -2.248 -6.816 2.995 1.00 0.00 N ATOM 0 H ARG A 838 4.944 -4.724 3.753 1.00 0.00 H new ATOM 0 HA ARG A 838 3.661 -6.840 2.415 1.00 0.00 H new ATOM 0 HB2 ARG A 838 3.847 -3.846 2.073 1.00 0.00 H new ATOM 0 HB3 ARG A 838 3.034 -4.805 0.853 1.00 0.00 H new ATOM 0 HG2 ARG A 838 2.306 -4.563 3.789 1.00 0.00 H new ATOM 0 HG3 ARG A 838 1.378 -4.001 2.412 1.00 0.00 H new ATOM 0 HD2 ARG A 838 1.535 -6.594 1.717 1.00 0.00 H new ATOM 0 HD3 ARG A 838 1.748 -6.796 3.445 1.00 0.00 H new ATOM 0 HE ARG A 838 -0.477 -5.070 3.077 1.00 0.00 H new ATOM 0 HH11 ARG A 838 0.494 -8.398 2.407 1.00 0.00 H new ATOM 0 HH12 ARG A 838 -1.157 -9.020 2.498 1.00 0.00 H new ATOM 0 HH21 ARG A 838 -2.595 -5.878 3.194 1.00 0.00 H new ATOM 0 HH22 ARG A 838 -2.899 -7.600 2.941 1.00 0.00 H new ATOM 575 N ILE A 839 6.045 -5.319 0.690 1.00 0.00 N ATOM 576 CA ILE A 839 6.941 -5.470 -0.449 1.00 0.00 C ATOM 577 C ILE A 839 7.750 -6.759 -0.344 1.00 0.00 C ATOM 578 O ILE A 839 7.727 -7.593 -1.248 1.00 0.00 O ATOM 579 CB ILE A 839 7.910 -4.278 -0.565 1.00 0.00 C ATOM 580 CG1 ILE A 839 7.128 -2.968 -0.683 1.00 0.00 C ATOM 581 CG2 ILE A 839 8.832 -4.460 -1.761 1.00 0.00 C ATOM 582 CD1 ILE A 839 7.861 -1.774 -0.113 1.00 0.00 C ATOM 0 H ILE A 839 6.188 -4.465 1.229 1.00 0.00 H new ATOM 0 HA ILE A 839 6.315 -5.507 -1.341 1.00 0.00 H new ATOM 0 HB ILE A 839 8.521 -4.235 0.337 1.00 0.00 H new ATOM 0 HG12 ILE A 839 6.906 -2.780 -1.733 1.00 0.00 H new ATOM 0 HG13 ILE A 839 6.173 -3.077 -0.170 1.00 0.00 H new ATOM 0 HG21 ILE A 839 9.511 -3.610 -1.830 1.00 0.00 H new ATOM 0 HG22 ILE A 839 9.409 -5.376 -1.639 1.00 0.00 H new ATOM 0 HG23 ILE A 839 8.237 -4.524 -2.672 1.00 0.00 H new ATOM 0 HD11 ILE A 839 7.248 -0.880 -0.231 1.00 0.00 H new ATOM 0 HD12 ILE A 839 8.060 -1.941 0.946 1.00 0.00 H new ATOM 0 HD13 ILE A 839 8.804 -1.639 -0.643 1.00 0.00 H new ATOM 594 N MET A 840 8.463 -6.915 0.767 1.00 0.00 N ATOM 595 CA MET A 840 9.277 -8.104 0.991 1.00 0.00 C ATOM 596 C MET A 840 8.430 -9.369 0.887 1.00 0.00 C ATOM 597 O MET A 840 8.642 -10.199 0.003 1.00 0.00 O ATOM 598 CB MET A 840 9.948 -8.037 2.364 1.00 0.00 C ATOM 599 CG MET A 840 10.790 -6.788 2.569 1.00 0.00 C ATOM 600 SD MET A 840 11.195 -6.499 4.302 1.00 0.00 S ATOM 601 CE MET A 840 12.971 -6.291 4.204 1.00 0.00 C ATOM 0 H MET A 840 8.493 -6.234 1.525 1.00 0.00 H new ATOM 0 HA MET A 840 10.047 -8.138 0.220 1.00 0.00 H new ATOM 0 HB2 MET A 840 9.180 -8.079 3.137 1.00 0.00 H new ATOM 0 HB3 MET A 840 10.579 -8.916 2.494 1.00 0.00 H new ATOM 0 HG2 MET A 840 11.712 -6.878 1.995 1.00 0.00 H new ATOM 0 HG3 MET A 840 10.253 -5.924 2.177 1.00 0.00 H new ATOM 0 HE1 MET A 840 13.426 -6.595 5.147 1.00 0.00 H new ATOM 0 HE2 MET A 840 13.365 -6.907 3.396 1.00 0.00 H new ATOM 0 HE3 MET A 840 13.205 -5.244 4.010 1.00 0.00 H new ATOM 611 N LYS A 841 7.472 -9.511 1.797 1.00 0.00 N ATOM 612 CA LYS A 841 6.593 -10.674 1.808 1.00 0.00 C ATOM 613 C LYS A 841 6.304 -11.151 0.388 1.00 0.00 C ATOM 614 O LYS A 841 6.487 -12.325 0.068 1.00 0.00 O ATOM 615 CB LYS A 841 5.282 -10.341 2.522 1.00 0.00 C ATOM 616 CG LYS A 841 4.224 -11.423 2.388 1.00 0.00 C ATOM 617 CD LYS A 841 3.149 -11.288 3.453 1.00 0.00 C ATOM 618 CE LYS A 841 2.113 -10.243 3.069 1.00 0.00 C ATOM 619 NZ LYS A 841 1.014 -10.825 2.250 1.00 0.00 N ATOM 0 H LYS A 841 7.285 -8.834 2.537 1.00 0.00 H new ATOM 0 HA LYS A 841 7.099 -11.476 2.346 1.00 0.00 H new ATOM 0 HB2 LYS A 841 5.486 -10.174 3.579 1.00 0.00 H new ATOM 0 HB3 LYS A 841 4.887 -9.407 2.122 1.00 0.00 H new ATOM 0 HG2 LYS A 841 3.767 -11.366 1.400 1.00 0.00 H new ATOM 0 HG3 LYS A 841 4.693 -12.404 2.466 1.00 0.00 H new ATOM 0 HD2 LYS A 841 2.659 -12.250 3.601 1.00 0.00 H new ATOM 0 HD3 LYS A 841 3.608 -11.015 4.403 1.00 0.00 H new ATOM 0 HE2 LYS A 841 1.696 -9.797 3.972 1.00 0.00 H new ATOM 0 HE3 LYS A 841 2.596 -9.441 2.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 841 0.765 -10.166 1.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 841 1.327 -11.728 1.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 841 0.182 -10.988 2.852 1.00 0.00 H new ATOM 633 N MET A 842 5.853 -10.232 -0.460 1.00 0.00 N ATOM 634 CA MET A 842 5.541 -10.559 -1.846 1.00 0.00 C ATOM 635 C MET A 842 6.790 -11.027 -2.588 1.00 0.00 C ATOM 636 O MET A 842 6.749 -12.005 -3.335 1.00 0.00 O ATOM 637 CB MET A 842 4.937 -9.346 -2.555 1.00 0.00 C ATOM 638 CG MET A 842 3.565 -8.955 -2.030 1.00 0.00 C ATOM 639 SD MET A 842 2.920 -7.466 -2.814 1.00 0.00 S ATOM 640 CE MET A 842 1.353 -8.065 -3.442 1.00 0.00 C ATOM 0 H MET A 842 5.696 -9.255 -0.211 1.00 0.00 H new ATOM 0 HA MET A 842 4.813 -11.371 -1.847 1.00 0.00 H new ATOM 0 HB2 MET A 842 5.613 -8.498 -2.447 1.00 0.00 H new ATOM 0 HB3 MET A 842 4.862 -9.559 -3.621 1.00 0.00 H new ATOM 0 HG2 MET A 842 2.869 -9.778 -2.194 1.00 0.00 H new ATOM 0 HG3 MET A 842 3.624 -8.798 -0.953 1.00 0.00 H new ATOM 0 HE1 MET A 842 0.834 -7.256 -3.955 1.00 0.00 H new ATOM 0 HE2 MET A 842 1.530 -8.883 -4.140 1.00 0.00 H new ATOM 0 HE3 MET A 842 0.741 -8.421 -2.613 1.00 0.00 H new ATOM 650 N ARG A 843 7.897 -10.323 -2.377 1.00 0.00 N ATOM 651 CA ARG A 843 9.156 -10.666 -3.027 1.00 0.00 C ATOM 652 C ARG A 843 10.030 -11.512 -2.106 1.00 0.00 C ATOM 653 O ARG A 843 10.726 -10.987 -1.237 1.00 0.00 O ATOM 654 CB ARG A 843 9.906 -9.397 -3.435 1.00 0.00 C ATOM 655 CG ARG A 843 9.080 -8.451 -4.292 1.00 0.00 C ATOM 656 CD ARG A 843 9.139 -8.835 -5.762 1.00 0.00 C ATOM 657 NE ARG A 843 10.388 -8.409 -6.390 1.00 0.00 N ATOM 658 CZ ARG A 843 10.532 -8.245 -7.700 1.00 0.00 C ATOM 659 NH1 ARG A 843 9.512 -8.469 -8.516 1.00 0.00 N ATOM 660 NH2 ARG A 843 11.700 -7.855 -8.195 1.00 0.00 N ATOM 0 H ARG A 843 7.948 -9.512 -1.761 1.00 0.00 H new ATOM 0 HA ARG A 843 8.928 -11.248 -3.920 1.00 0.00 H new ATOM 0 HB2 ARG A 843 10.229 -8.871 -2.537 1.00 0.00 H new ATOM 0 HB3 ARG A 843 10.806 -9.677 -3.982 1.00 0.00 H new ATOM 0 HG2 ARG A 843 8.044 -8.462 -3.953 1.00 0.00 H new ATOM 0 HG3 ARG A 843 9.445 -7.432 -4.166 1.00 0.00 H new ATOM 0 HD2 ARG A 843 9.035 -9.916 -5.859 1.00 0.00 H new ATOM 0 HD3 ARG A 843 8.297 -8.385 -6.288 1.00 0.00 H new ATOM 0 HE ARG A 843 11.193 -8.228 -5.790 1.00 0.00 H new ATOM 0 HH11 ARG A 843 8.613 -8.768 -8.138 1.00 0.00 H new ATOM 0 HH12 ARG A 843 9.626 -8.342 -9.522 1.00 0.00 H new ATOM 0 HH21 ARG A 843 12.487 -7.681 -7.569 1.00 0.00 H new ATOM 0 HH22 ARG A 843 11.811 -7.729 -9.201 1.00 0.00 H new ATOM 674 N LYS A 844 9.989 -12.826 -2.302 1.00 0.00 N ATOM 675 CA LYS A 844 10.777 -13.746 -1.491 1.00 0.00 C ATOM 676 C LYS A 844 12.121 -13.129 -1.118 1.00 0.00 C ATOM 677 O LYS A 844 12.564 -13.225 0.027 1.00 0.00 O ATOM 678 CB LYS A 844 10.998 -15.060 -2.244 1.00 0.00 C ATOM 679 CG LYS A 844 9.710 -15.766 -2.629 1.00 0.00 C ATOM 680 CD LYS A 844 9.045 -16.409 -1.423 1.00 0.00 C ATOM 681 CE LYS A 844 8.181 -17.593 -1.829 1.00 0.00 C ATOM 682 NZ LYS A 844 7.733 -18.383 -0.649 1.00 0.00 N ATOM 0 H LYS A 844 9.418 -13.278 -3.016 1.00 0.00 H new ATOM 0 HA LYS A 844 10.224 -13.948 -0.574 1.00 0.00 H new ATOM 0 HB2 LYS A 844 11.576 -14.859 -3.146 1.00 0.00 H new ATOM 0 HB3 LYS A 844 11.597 -15.728 -1.624 1.00 0.00 H new ATOM 0 HG2 LYS A 844 9.025 -15.052 -3.086 1.00 0.00 H new ATOM 0 HG3 LYS A 844 9.922 -16.529 -3.379 1.00 0.00 H new ATOM 0 HD2 LYS A 844 9.808 -16.739 -0.718 1.00 0.00 H new ATOM 0 HD3 LYS A 844 8.432 -15.670 -0.907 1.00 0.00 H new ATOM 0 HE2 LYS A 844 7.310 -17.236 -2.379 1.00 0.00 H new ATOM 0 HE3 LYS A 844 8.743 -18.237 -2.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 844 7.147 -19.181 -0.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 844 8.563 -18.746 -0.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 844 7.175 -17.775 -0.016 1.00 0.00 H new ATOM 696 N THR A 845 12.765 -12.493 -2.092 1.00 0.00 N ATOM 697 CA THR A 845 14.058 -11.860 -1.866 1.00 0.00 C ATOM 698 C THR A 845 14.136 -10.506 -2.561 1.00 0.00 C ATOM 699 O THR A 845 13.816 -10.384 -3.744 1.00 0.00 O ATOM 700 CB THR A 845 15.214 -12.748 -2.365 1.00 0.00 C ATOM 701 OG1 THR A 845 15.180 -14.015 -1.700 1.00 0.00 O ATOM 702 CG2 THR A 845 16.557 -12.076 -2.119 1.00 0.00 C ATOM 0 H THR A 845 12.412 -12.403 -3.045 1.00 0.00 H new ATOM 0 HA THR A 845 14.157 -11.719 -0.790 1.00 0.00 H new ATOM 0 HB THR A 845 15.092 -12.898 -3.438 1.00 0.00 H new ATOM 0 HG1 THR A 845 15.951 -14.090 -1.099 1.00 0.00 H new ATOM 0 HG21 THR A 845 17.358 -12.721 -2.479 1.00 0.00 H new ATOM 0 HG22 THR A 845 16.591 -11.125 -2.650 1.00 0.00 H new ATOM 0 HG23 THR A 845 16.686 -11.900 -1.051 1.00 0.00 H new ATOM 710 N LEU A 846 14.564 -9.489 -1.821 1.00 0.00 N ATOM 711 CA LEU A 846 14.685 -8.142 -2.367 1.00 0.00 C ATOM 712 C LEU A 846 15.859 -7.401 -1.734 1.00 0.00 C ATOM 713 O LEU A 846 16.262 -7.701 -0.611 1.00 0.00 O ATOM 714 CB LEU A 846 13.391 -7.359 -2.138 1.00 0.00 C ATOM 715 CG LEU A 846 13.074 -6.271 -3.164 1.00 0.00 C ATOM 716 CD1 LEU A 846 12.604 -6.889 -4.471 1.00 0.00 C ATOM 717 CD2 LEU A 846 12.027 -5.311 -2.618 1.00 0.00 C ATOM 0 H LEU A 846 14.833 -9.572 -0.841 1.00 0.00 H new ATOM 0 HA LEU A 846 14.867 -8.226 -3.438 1.00 0.00 H new ATOM 0 HB2 LEU A 846 12.561 -8.065 -2.119 1.00 0.00 H new ATOM 0 HB3 LEU A 846 13.439 -6.897 -1.152 1.00 0.00 H new ATOM 0 HG LEU A 846 13.986 -5.708 -3.361 1.00 0.00 H new ATOM 0 HD11 LEU A 846 12.383 -6.099 -5.189 1.00 0.00 H new ATOM 0 HD12 LEU A 846 13.387 -7.534 -4.871 1.00 0.00 H new ATOM 0 HD13 LEU A 846 11.705 -7.478 -4.292 1.00 0.00 H new ATOM 0 HD21 LEU A 846 11.814 -4.543 -3.362 1.00 0.00 H new ATOM 0 HD22 LEU A 846 11.113 -5.860 -2.391 1.00 0.00 H new ATOM 0 HD23 LEU A 846 12.403 -4.841 -1.709 1.00 0.00 H new ATOM 729 N SER A 847 16.402 -6.431 -2.463 1.00 0.00 N ATOM 730 CA SER A 847 17.530 -5.648 -1.974 1.00 0.00 C ATOM 731 C SER A 847 17.051 -4.360 -1.310 1.00 0.00 C ATOM 732 O SER A 847 15.876 -4.003 -1.398 1.00 0.00 O ATOM 733 CB SER A 847 18.485 -5.318 -3.123 1.00 0.00 C ATOM 734 OG SER A 847 17.855 -4.497 -4.090 1.00 0.00 O ATOM 0 H SER A 847 16.079 -6.169 -3.394 1.00 0.00 H new ATOM 0 HA SER A 847 18.059 -6.244 -1.231 1.00 0.00 H new ATOM 0 HB2 SER A 847 19.368 -4.813 -2.732 1.00 0.00 H new ATOM 0 HB3 SER A 847 18.827 -6.241 -3.592 1.00 0.00 H new ATOM 0 HG SER A 847 18.537 -4.042 -4.627 1.00 0.00 H new ATOM 740 N HIS A 848 17.970 -3.667 -0.646 1.00 0.00 N ATOM 741 CA HIS A 848 17.643 -2.418 0.033 1.00 0.00 C ATOM 742 C HIS A 848 17.157 -1.370 -0.963 1.00 0.00 C ATOM 743 O HIS A 848 16.108 -0.756 -0.770 1.00 0.00 O ATOM 744 CB HIS A 848 18.862 -1.892 0.792 1.00 0.00 C ATOM 745 CG HIS A 848 18.616 -0.589 1.489 1.00 0.00 C ATOM 746 ND1 HIS A 848 18.268 -0.501 2.820 1.00 0.00 N ATOM 747 CD2 HIS A 848 18.672 0.684 1.031 1.00 0.00 C ATOM 748 CE1 HIS A 848 18.119 0.770 3.151 1.00 0.00 C ATOM 749 NE2 HIS A 848 18.359 1.509 2.083 1.00 0.00 N ATOM 0 H HIS A 848 18.947 -3.949 -0.563 1.00 0.00 H new ATOM 0 HA HIS A 848 16.841 -2.618 0.743 1.00 0.00 H new ATOM 0 HB2 HIS A 848 19.171 -2.635 1.527 1.00 0.00 H new ATOM 0 HB3 HIS A 848 19.690 -1.771 0.094 1.00 0.00 H new ATOM 0 HD2 HIS A 848 18.917 0.993 0.026 1.00 0.00 H new ATOM 0 HE1 HIS A 848 17.847 1.141 4.128 1.00 0.00 H new ATOM 0 HE2 HIS A 848 18.318 2.528 2.046 1.00 0.00 H new ATOM 757 N ASN A 849 17.928 -1.169 -2.027 1.00 0.00 N ATOM 758 CA ASN A 849 17.576 -0.194 -3.052 1.00 0.00 C ATOM 759 C ASN A 849 16.130 -0.376 -3.503 1.00 0.00 C ATOM 760 O ASN A 849 15.325 0.554 -3.434 1.00 0.00 O ATOM 761 CB ASN A 849 18.516 -0.323 -4.253 1.00 0.00 C ATOM 762 CG ASN A 849 19.947 0.044 -3.909 1.00 0.00 C ATOM 763 OD1 ASN A 849 20.624 -0.675 -3.174 1.00 0.00 O ATOM 764 ND2 ASN A 849 20.413 1.168 -4.439 1.00 0.00 N ATOM 0 H ASN A 849 18.800 -1.668 -2.201 1.00 0.00 H new ATOM 0 HA ASN A 849 17.681 0.802 -2.621 1.00 0.00 H new ATOM 0 HB2 ASN A 849 18.486 -1.347 -4.626 1.00 0.00 H new ATOM 0 HB3 ASN A 849 18.162 0.320 -5.059 1.00 0.00 H new ATOM 0 HD21 ASN A 849 21.368 1.467 -4.242 1.00 0.00 H new ATOM 0 HD22 ASN A 849 19.816 1.733 -5.043 1.00 0.00 H new ATOM 771 N LEU A 850 15.806 -1.579 -3.964 1.00 0.00 N ATOM 772 CA LEU A 850 14.457 -1.885 -4.425 1.00 0.00 C ATOM 773 C LEU A 850 13.462 -1.836 -3.270 1.00 0.00 C ATOM 774 O LEU A 850 12.299 -1.473 -3.453 1.00 0.00 O ATOM 775 CB LEU A 850 14.422 -3.264 -5.086 1.00 0.00 C ATOM 776 CG LEU A 850 14.923 -3.330 -6.529 1.00 0.00 C ATOM 777 CD1 LEU A 850 14.005 -2.540 -7.449 1.00 0.00 C ATOM 778 CD2 LEU A 850 16.350 -2.811 -6.623 1.00 0.00 C ATOM 0 H LEU A 850 16.460 -2.359 -4.028 1.00 0.00 H new ATOM 0 HA LEU A 850 14.171 -1.131 -5.158 1.00 0.00 H new ATOM 0 HB2 LEU A 850 15.019 -3.949 -4.484 1.00 0.00 H new ATOM 0 HB3 LEU A 850 13.396 -3.630 -5.062 1.00 0.00 H new ATOM 0 HG LEU A 850 14.915 -4.372 -6.849 1.00 0.00 H new ATOM 0 HD11 LEU A 850 14.377 -2.598 -8.472 1.00 0.00 H new ATOM 0 HD12 LEU A 850 12.999 -2.957 -7.405 1.00 0.00 H new ATOM 0 HD13 LEU A 850 13.980 -1.498 -7.131 1.00 0.00 H new ATOM 0 HD21 LEU A 850 16.690 -2.866 -7.657 1.00 0.00 H new ATOM 0 HD22 LEU A 850 16.384 -1.776 -6.284 1.00 0.00 H new ATOM 0 HD23 LEU A 850 17.001 -3.420 -5.995 1.00 0.00 H new ATOM 790 N LEU A 851 13.927 -2.202 -2.081 1.00 0.00 N ATOM 791 CA LEU A 851 13.078 -2.199 -0.894 1.00 0.00 C ATOM 792 C LEU A 851 12.629 -0.782 -0.550 1.00 0.00 C ATOM 793 O LEU A 851 11.447 -0.453 -0.649 1.00 0.00 O ATOM 794 CB LEU A 851 13.825 -2.812 0.293 1.00 0.00 C ATOM 795 CG LEU A 851 13.156 -2.657 1.659 1.00 0.00 C ATOM 796 CD1 LEU A 851 11.920 -3.539 1.751 1.00 0.00 C ATOM 797 CD2 LEU A 851 14.136 -2.992 2.774 1.00 0.00 C ATOM 0 H LEU A 851 14.886 -2.504 -1.913 1.00 0.00 H new ATOM 0 HA LEU A 851 12.194 -2.799 -1.108 1.00 0.00 H new ATOM 0 HB2 LEU A 851 13.966 -3.875 0.098 1.00 0.00 H new ATOM 0 HB3 LEU A 851 14.817 -2.363 0.343 1.00 0.00 H new ATOM 0 HG LEU A 851 12.846 -1.618 1.775 1.00 0.00 H new ATOM 0 HD11 LEU A 851 11.457 -3.416 2.730 1.00 0.00 H new ATOM 0 HD12 LEU A 851 11.210 -3.253 0.975 1.00 0.00 H new ATOM 0 HD13 LEU A 851 12.206 -4.582 1.614 1.00 0.00 H new ATOM 0 HD21 LEU A 851 13.643 -2.876 3.739 1.00 0.00 H new ATOM 0 HD22 LEU A 851 14.477 -4.021 2.662 1.00 0.00 H new ATOM 0 HD23 LEU A 851 14.992 -2.319 2.721 1.00 0.00 H new ATOM 809 N VAL A 852 13.581 0.054 -0.147 1.00 0.00 N ATOM 810 CA VAL A 852 13.285 1.436 0.209 1.00 0.00 C ATOM 811 C VAL A 852 12.492 2.129 -0.894 1.00 0.00 C ATOM 812 O VAL A 852 11.521 2.836 -0.623 1.00 0.00 O ATOM 813 CB VAL A 852 14.574 2.235 0.478 1.00 0.00 C ATOM 814 CG1 VAL A 852 15.361 1.610 1.619 1.00 0.00 C ATOM 815 CG2 VAL A 852 15.421 2.319 -0.782 1.00 0.00 C ATOM 0 H VAL A 852 14.564 -0.202 -0.059 1.00 0.00 H new ATOM 0 HA VAL A 852 12.687 1.407 1.120 1.00 0.00 H new ATOM 0 HB VAL A 852 14.299 3.248 0.771 1.00 0.00 H new ATOM 0 HG11 VAL A 852 16.268 2.188 1.795 1.00 0.00 H new ATOM 0 HG12 VAL A 852 14.752 1.608 2.523 1.00 0.00 H new ATOM 0 HG13 VAL A 852 15.628 0.586 1.359 1.00 0.00 H new ATOM 0 HG21 VAL A 852 16.328 2.887 -0.574 1.00 0.00 H new ATOM 0 HG22 VAL A 852 15.689 1.314 -1.108 1.00 0.00 H new ATOM 0 HG23 VAL A 852 14.854 2.816 -1.569 1.00 0.00 H new ATOM 825 N SER A 853 12.911 1.920 -2.138 1.00 0.00 N ATOM 826 CA SER A 853 12.242 2.528 -3.282 1.00 0.00 C ATOM 827 C SER A 853 10.748 2.218 -3.265 1.00 0.00 C ATOM 828 O SER A 853 9.917 3.123 -3.189 1.00 0.00 O ATOM 829 CB SER A 853 12.863 2.027 -4.587 1.00 0.00 C ATOM 830 OG SER A 853 12.568 2.904 -5.661 1.00 0.00 O ATOM 0 H SER A 853 13.711 1.334 -2.379 1.00 0.00 H new ATOM 0 HA SER A 853 12.372 3.608 -3.217 1.00 0.00 H new ATOM 0 HB2 SER A 853 13.943 1.941 -4.470 1.00 0.00 H new ATOM 0 HB3 SER A 853 12.486 1.030 -4.814 1.00 0.00 H new ATOM 0 HG SER A 853 12.977 2.563 -6.484 1.00 0.00 H new ATOM 836 N GLU A 854 10.415 0.933 -3.335 1.00 0.00 N ATOM 837 CA GLU A 854 9.022 0.504 -3.328 1.00 0.00 C ATOM 838 C GLU A 854 8.243 1.200 -2.216 1.00 0.00 C ATOM 839 O GLU A 854 7.195 1.798 -2.456 1.00 0.00 O ATOM 840 CB GLU A 854 8.933 -1.014 -3.156 1.00 0.00 C ATOM 841 CG GLU A 854 9.095 -1.785 -4.455 1.00 0.00 C ATOM 842 CD GLU A 854 7.835 -1.777 -5.299 1.00 0.00 C ATOM 843 OE1 GLU A 854 6.899 -2.537 -4.976 1.00 0.00 O ATOM 844 OE2 GLU A 854 7.786 -1.009 -6.283 1.00 0.00 O ATOM 0 H GLU A 854 11.091 0.172 -3.397 1.00 0.00 H new ATOM 0 HA GLU A 854 8.579 0.780 -4.285 1.00 0.00 H new ATOM 0 HB2 GLU A 854 9.701 -1.337 -2.454 1.00 0.00 H new ATOM 0 HB3 GLU A 854 7.970 -1.265 -2.712 1.00 0.00 H new ATOM 0 HG2 GLU A 854 9.915 -1.354 -5.029 1.00 0.00 H new ATOM 0 HG3 GLU A 854 9.370 -2.815 -4.230 1.00 0.00 H new ATOM 851 N VAL A 855 8.765 1.116 -0.996 1.00 0.00 N ATOM 852 CA VAL A 855 8.120 1.738 0.155 1.00 0.00 C ATOM 853 C VAL A 855 7.765 3.192 -0.133 1.00 0.00 C ATOM 854 O VAL A 855 6.607 3.595 -0.012 1.00 0.00 O ATOM 855 CB VAL A 855 9.022 1.679 1.403 1.00 0.00 C ATOM 856 CG1 VAL A 855 8.403 2.468 2.547 1.00 0.00 C ATOM 857 CG2 VAL A 855 9.270 0.235 1.813 1.00 0.00 C ATOM 0 H VAL A 855 9.632 0.624 -0.779 1.00 0.00 H new ATOM 0 HA VAL A 855 7.207 1.176 0.348 1.00 0.00 H new ATOM 0 HB VAL A 855 9.982 2.133 1.158 1.00 0.00 H new ATOM 0 HG11 VAL A 855 9.054 2.415 3.420 1.00 0.00 H new ATOM 0 HG12 VAL A 855 8.282 3.509 2.247 1.00 0.00 H new ATOM 0 HG13 VAL A 855 7.429 2.046 2.795 1.00 0.00 H new ATOM 0 HG21 VAL A 855 9.909 0.212 2.696 1.00 0.00 H new ATOM 0 HG22 VAL A 855 8.319 -0.247 2.040 1.00 0.00 H new ATOM 0 HG23 VAL A 855 9.760 -0.296 0.997 1.00 0.00 H new ATOM 867 N TYR A 856 8.767 3.976 -0.515 1.00 0.00 N ATOM 868 CA TYR A 856 8.560 5.387 -0.819 1.00 0.00 C ATOM 869 C TYR A 856 7.369 5.574 -1.753 1.00 0.00 C ATOM 870 O TYR A 856 6.520 6.436 -1.530 1.00 0.00 O ATOM 871 CB TYR A 856 9.818 5.983 -1.453 1.00 0.00 C ATOM 872 CG TYR A 856 10.981 6.103 -0.494 1.00 0.00 C ATOM 873 CD1 TYR A 856 10.846 6.781 0.711 1.00 0.00 C ATOM 874 CD2 TYR A 856 12.214 5.537 -0.792 1.00 0.00 C ATOM 875 CE1 TYR A 856 11.906 6.894 1.590 1.00 0.00 C ATOM 876 CE2 TYR A 856 13.279 5.644 0.081 1.00 0.00 C ATOM 877 CZ TYR A 856 13.120 6.323 1.271 1.00 0.00 C ATOM 878 OH TYR A 856 14.178 6.432 2.144 1.00 0.00 O ATOM 0 H TYR A 856 9.730 3.658 -0.621 1.00 0.00 H new ATOM 0 HA TYR A 856 8.351 5.907 0.116 1.00 0.00 H new ATOM 0 HB2 TYR A 856 10.117 5.363 -2.298 1.00 0.00 H new ATOM 0 HB3 TYR A 856 9.582 6.970 -1.850 1.00 0.00 H new ATOM 0 HD1 TYR A 856 9.896 7.227 0.965 1.00 0.00 H new ATOM 0 HD2 TYR A 856 12.342 5.004 -1.723 1.00 0.00 H new ATOM 0 HE1 TYR A 856 11.784 7.427 2.522 1.00 0.00 H new ATOM 0 HE2 TYR A 856 14.231 5.198 -0.167 1.00 0.00 H new ATOM 0 HH TYR A 856 13.992 7.139 2.797 1.00 0.00 H new ATOM 888 N ASN A 857 7.313 4.759 -2.802 1.00 0.00 N ATOM 889 CA ASN A 857 6.226 4.833 -3.771 1.00 0.00 C ATOM 890 C ASN A 857 4.883 4.548 -3.106 1.00 0.00 C ATOM 891 O ASN A 857 3.855 5.093 -3.505 1.00 0.00 O ATOM 892 CB ASN A 857 6.464 3.842 -4.912 1.00 0.00 C ATOM 893 CG ASN A 857 5.239 3.663 -5.787 1.00 0.00 C ATOM 894 OD1 ASN A 857 4.457 4.595 -5.978 1.00 0.00 O ATOM 895 ND2 ASN A 857 5.066 2.461 -6.325 1.00 0.00 N ATOM 0 H ASN A 857 8.008 4.040 -3.002 1.00 0.00 H new ATOM 0 HA ASN A 857 6.202 5.845 -4.176 1.00 0.00 H new ATOM 0 HB2 ASN A 857 7.296 4.190 -5.524 1.00 0.00 H new ATOM 0 HB3 ASN A 857 6.755 2.877 -4.497 1.00 0.00 H new ATOM 0 HD21 ASN A 857 4.260 2.281 -6.923 1.00 0.00 H new ATOM 0 HD22 ASN A 857 5.739 1.718 -6.140 1.00 0.00 H new ATOM 902 N GLN A 858 4.903 3.691 -2.090 1.00 0.00 N ATOM 903 CA GLN A 858 3.686 3.334 -1.370 1.00 0.00 C ATOM 904 C GLN A 858 3.268 4.451 -0.420 1.00 0.00 C ATOM 905 O GLN A 858 2.082 4.753 -0.283 1.00 0.00 O ATOM 906 CB GLN A 858 3.894 2.035 -0.589 1.00 0.00 C ATOM 907 CG GLN A 858 3.829 0.787 -1.455 1.00 0.00 C ATOM 908 CD GLN A 858 3.695 -0.483 -0.640 1.00 0.00 C ATOM 909 OE1 GLN A 858 4.491 -1.412 -0.780 1.00 0.00 O ATOM 910 NE2 GLN A 858 2.684 -0.531 0.220 1.00 0.00 N ATOM 0 H GLN A 858 5.747 3.232 -1.747 1.00 0.00 H new ATOM 0 HA GLN A 858 2.891 3.187 -2.101 1.00 0.00 H new ATOM 0 HB2 GLN A 858 4.863 2.071 -0.091 1.00 0.00 H new ATOM 0 HB3 GLN A 858 3.137 1.965 0.192 1.00 0.00 H new ATOM 0 HG2 GLN A 858 2.983 0.867 -2.138 1.00 0.00 H new ATOM 0 HG3 GLN A 858 4.728 0.728 -2.068 1.00 0.00 H new ATOM 0 HE21 GLN A 858 2.048 0.262 0.304 1.00 0.00 H new ATOM 0 HE22 GLN A 858 2.544 -1.361 0.797 1.00 0.00 H new ATOM 919 N LEU A 859 4.250 5.062 0.235 1.00 0.00 N ATOM 920 CA LEU A 859 3.984 6.146 1.174 1.00 0.00 C ATOM 921 C LEU A 859 3.828 7.475 0.441 1.00 0.00 C ATOM 922 O LEU A 859 4.652 7.832 -0.401 1.00 0.00 O ATOM 923 CB LEU A 859 5.113 6.246 2.201 1.00 0.00 C ATOM 924 CG LEU A 859 5.518 4.939 2.882 1.00 0.00 C ATOM 925 CD1 LEU A 859 6.479 5.210 4.030 1.00 0.00 C ATOM 926 CD2 LEU A 859 4.289 4.193 3.379 1.00 0.00 C ATOM 0 H LEU A 859 5.237 4.825 0.133 1.00 0.00 H new ATOM 0 HA LEU A 859 3.050 5.925 1.691 1.00 0.00 H new ATOM 0 HB2 LEU A 859 5.991 6.662 1.707 1.00 0.00 H new ATOM 0 HB3 LEU A 859 4.814 6.957 2.972 1.00 0.00 H new ATOM 0 HG LEU A 859 6.027 4.313 2.149 1.00 0.00 H new ATOM 0 HD11 LEU A 859 6.756 4.268 4.503 1.00 0.00 H new ATOM 0 HD12 LEU A 859 7.374 5.701 3.647 1.00 0.00 H new ATOM 0 HD13 LEU A 859 5.997 5.856 4.764 1.00 0.00 H new ATOM 0 HD21 LEU A 859 4.597 3.265 3.861 1.00 0.00 H new ATOM 0 HD22 LEU A 859 3.752 4.814 4.096 1.00 0.00 H new ATOM 0 HD23 LEU A 859 3.636 3.965 2.536 1.00 0.00 H new ATOM 938 N LYS A 860 2.768 8.205 0.769 1.00 0.00 N ATOM 939 CA LYS A 860 2.505 9.496 0.145 1.00 0.00 C ATOM 940 C LYS A 860 3.558 10.522 0.552 1.00 0.00 C ATOM 941 O LYS A 860 3.846 11.459 -0.192 1.00 0.00 O ATOM 942 CB LYS A 860 1.112 9.999 0.532 1.00 0.00 C ATOM 943 CG LYS A 860 0.681 11.241 -0.228 1.00 0.00 C ATOM 944 CD LYS A 860 0.383 10.928 -1.684 1.00 0.00 C ATOM 945 CE LYS A 860 -0.959 10.228 -1.841 1.00 0.00 C ATOM 946 NZ LYS A 860 -1.205 9.810 -3.249 1.00 0.00 N ATOM 0 H LYS A 860 2.076 7.924 1.464 1.00 0.00 H new ATOM 0 HA LYS A 860 2.550 9.364 -0.936 1.00 0.00 H new ATOM 0 HB2 LYS A 860 0.386 9.205 0.355 1.00 0.00 H new ATOM 0 HB3 LYS A 860 1.096 10.213 1.601 1.00 0.00 H new ATOM 0 HG2 LYS A 860 -0.205 11.667 0.242 1.00 0.00 H new ATOM 0 HG3 LYS A 860 1.466 11.995 -0.170 1.00 0.00 H new ATOM 0 HD2 LYS A 860 0.383 11.852 -2.263 1.00 0.00 H new ATOM 0 HD3 LYS A 860 1.173 10.297 -2.091 1.00 0.00 H new ATOM 0 HE2 LYS A 860 -0.990 9.353 -1.192 1.00 0.00 H new ATOM 0 HE3 LYS A 860 -1.757 10.895 -1.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 860 -2.129 9.337 -3.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 860 -1.200 10.647 -3.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 860 -0.458 9.153 -3.552 1.00 0.00 H new ATOM 960 N PHE A 861 4.130 10.336 1.737 1.00 0.00 N ATOM 961 CA PHE A 861 5.153 11.245 2.243 1.00 0.00 C ATOM 962 C PHE A 861 6.517 10.564 2.278 1.00 0.00 C ATOM 963 O PHE A 861 6.631 9.357 2.498 1.00 0.00 O ATOM 964 CB PHE A 861 4.780 11.738 3.642 1.00 0.00 C ATOM 965 CG PHE A 861 4.650 10.634 4.652 1.00 0.00 C ATOM 966 CD1 PHE A 861 5.768 10.131 5.297 1.00 0.00 C ATOM 967 CD2 PHE A 861 3.409 10.098 4.956 1.00 0.00 C ATOM 968 CE1 PHE A 861 5.652 9.115 6.227 1.00 0.00 C ATOM 969 CE2 PHE A 861 3.286 9.082 5.885 1.00 0.00 C ATOM 970 CZ PHE A 861 4.410 8.589 6.521 1.00 0.00 C ATOM 0 H PHE A 861 3.903 9.565 2.365 1.00 0.00 H new ATOM 0 HA PHE A 861 5.211 12.099 1.568 1.00 0.00 H new ATOM 0 HB2 PHE A 861 5.537 12.444 3.983 1.00 0.00 H new ATOM 0 HB3 PHE A 861 3.837 12.282 3.587 1.00 0.00 H new ATOM 0 HD1 PHE A 861 6.742 10.538 5.070 1.00 0.00 H new ATOM 0 HD2 PHE A 861 2.528 10.478 4.461 1.00 0.00 H new ATOM 0 HE1 PHE A 861 6.532 8.733 6.723 1.00 0.00 H new ATOM 0 HE2 PHE A 861 2.313 8.674 6.114 1.00 0.00 H new ATOM 0 HZ PHE A 861 4.317 7.794 7.246 1.00 0.00 H new ATOM 980 N PRO A 862 7.579 11.353 2.056 1.00 0.00 N ATOM 981 CA PRO A 862 8.955 10.848 2.057 1.00 0.00 C ATOM 982 C PRO A 862 9.423 10.445 3.451 1.00 0.00 C ATOM 983 O PRO A 862 9.020 11.042 4.450 1.00 0.00 O ATOM 984 CB PRO A 862 9.769 12.038 1.543 1.00 0.00 C ATOM 985 CG PRO A 862 8.953 13.234 1.890 1.00 0.00 C ATOM 986 CD PRO A 862 7.517 12.800 1.787 1.00 0.00 C ATOM 0 HA PRO A 862 9.060 9.948 1.451 1.00 0.00 H new ATOM 0 HB2 PRO A 862 10.751 12.079 2.014 1.00 0.00 H new ATOM 0 HB3 PRO A 862 9.934 11.970 0.468 1.00 0.00 H new ATOM 0 HG2 PRO A 862 9.183 13.585 2.896 1.00 0.00 H new ATOM 0 HG3 PRO A 862 9.161 14.059 1.209 1.00 0.00 H new ATOM 0 HD2 PRO A 862 6.888 13.317 2.511 1.00 0.00 H new ATOM 0 HD3 PRO A 862 7.104 13.008 0.800 1.00 0.00 H new ATOM 994 N VAL A 863 10.278 9.429 3.513 1.00 0.00 N ATOM 995 CA VAL A 863 10.802 8.946 4.785 1.00 0.00 C ATOM 996 C VAL A 863 12.318 9.102 4.848 1.00 0.00 C ATOM 997 O VAL A 863 13.033 8.704 3.929 1.00 0.00 O ATOM 998 CB VAL A 863 10.438 7.468 5.018 1.00 0.00 C ATOM 999 CG1 VAL A 863 11.033 6.972 6.327 1.00 0.00 C ATOM 1000 CG2 VAL A 863 8.929 7.283 5.004 1.00 0.00 C ATOM 0 H VAL A 863 10.623 8.924 2.696 1.00 0.00 H new ATOM 0 HA VAL A 863 10.344 9.551 5.567 1.00 0.00 H new ATOM 0 HB VAL A 863 10.861 6.875 4.207 1.00 0.00 H new ATOM 0 HG11 VAL A 863 10.765 5.926 6.475 1.00 0.00 H new ATOM 0 HG12 VAL A 863 12.118 7.068 6.293 1.00 0.00 H new ATOM 0 HG13 VAL A 863 10.642 7.567 7.153 1.00 0.00 H new ATOM 0 HG21 VAL A 863 8.690 6.233 5.170 1.00 0.00 H new ATOM 0 HG22 VAL A 863 8.481 7.887 5.793 1.00 0.00 H new ATOM 0 HG23 VAL A 863 8.533 7.597 4.038 1.00 0.00 H new ATOM 1010 N LYS A 864 12.802 9.683 5.941 1.00 0.00 N ATOM 1011 CA LYS A 864 14.233 9.890 6.127 1.00 0.00 C ATOM 1012 C LYS A 864 14.985 8.564 6.084 1.00 0.00 C ATOM 1013 O LYS A 864 14.426 7.497 6.339 1.00 0.00 O ATOM 1014 CB LYS A 864 14.498 10.596 7.459 1.00 0.00 C ATOM 1015 CG LYS A 864 14.230 12.090 7.419 1.00 0.00 C ATOM 1016 CD LYS A 864 14.822 12.795 8.629 1.00 0.00 C ATOM 1017 CE LYS A 864 16.250 13.247 8.366 1.00 0.00 C ATOM 1018 NZ LYS A 864 16.999 13.481 9.632 1.00 0.00 N ATOM 0 H LYS A 864 12.224 10.019 6.711 1.00 0.00 H new ATOM 0 HA LYS A 864 14.593 10.518 5.312 1.00 0.00 H new ATOM 0 HB2 LYS A 864 13.875 10.144 8.230 1.00 0.00 H new ATOM 0 HB3 LYS A 864 15.535 10.429 7.749 1.00 0.00 H new ATOM 0 HG2 LYS A 864 14.653 12.512 6.508 1.00 0.00 H new ATOM 0 HG3 LYS A 864 13.155 12.267 7.383 1.00 0.00 H new ATOM 0 HD2 LYS A 864 14.207 13.658 8.886 1.00 0.00 H new ATOM 0 HD3 LYS A 864 14.804 12.124 9.488 1.00 0.00 H new ATOM 0 HE2 LYS A 864 16.766 12.493 7.772 1.00 0.00 H new ATOM 0 HE3 LYS A 864 16.238 14.164 7.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 864 17.968 13.788 9.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 864 16.521 14.219 10.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 864 17.032 12.600 10.184 1.00 0.00 H new ATOM 1032 N PRO A 865 16.284 8.629 5.756 1.00 0.00 N ATOM 1033 CA PRO A 865 17.140 7.442 5.674 1.00 0.00 C ATOM 1034 C PRO A 865 17.417 6.831 7.044 1.00 0.00 C ATOM 1035 O PRO A 865 17.462 5.610 7.191 1.00 0.00 O ATOM 1036 CB PRO A 865 18.434 7.980 5.058 1.00 0.00 C ATOM 1037 CG PRO A 865 18.454 9.425 5.420 1.00 0.00 C ATOM 1038 CD PRO A 865 17.016 9.867 5.440 1.00 0.00 C ATOM 0 HA PRO A 865 16.675 6.644 5.095 1.00 0.00 H new ATOM 0 HB2 PRO A 865 19.307 7.461 5.454 1.00 0.00 H new ATOM 0 HB3 PRO A 865 18.445 7.843 3.977 1.00 0.00 H new ATOM 0 HG2 PRO A 865 18.923 9.577 6.392 1.00 0.00 H new ATOM 0 HG3 PRO A 865 19.029 10.001 4.695 1.00 0.00 H new ATOM 0 HD2 PRO A 865 16.843 10.639 6.190 1.00 0.00 H new ATOM 0 HD3 PRO A 865 16.709 10.281 4.480 1.00 0.00 H new ATOM 1046 N ALA A 866 17.600 7.688 8.043 1.00 0.00 N ATOM 1047 CA ALA A 866 17.869 7.232 9.401 1.00 0.00 C ATOM 1048 C ALA A 866 16.723 6.377 9.930 1.00 0.00 C ATOM 1049 O ALA A 866 16.915 5.213 10.283 1.00 0.00 O ATOM 1050 CB ALA A 866 18.111 8.421 10.319 1.00 0.00 C ATOM 0 H ALA A 866 17.567 8.702 7.937 1.00 0.00 H new ATOM 0 HA ALA A 866 18.767 6.615 9.379 1.00 0.00 H new ATOM 0 HB1 ALA A 866 18.311 8.065 11.330 1.00 0.00 H new ATOM 0 HB2 ALA A 866 18.968 8.990 9.959 1.00 0.00 H new ATOM 0 HB3 ALA A 866 17.228 9.060 10.327 1.00 0.00 H new ATOM 1056 N ASP A 867 15.531 6.961 9.983 1.00 0.00 N ATOM 1057 CA ASP A 867 14.353 6.252 10.470 1.00 0.00 C ATOM 1058 C ASP A 867 14.125 4.969 9.677 1.00 0.00 C ATOM 1059 O ASP A 867 14.152 3.870 10.233 1.00 0.00 O ATOM 1060 CB ASP A 867 13.117 7.149 10.377 1.00 0.00 C ATOM 1061 CG ASP A 867 13.108 8.233 11.437 1.00 0.00 C ATOM 1062 OD1 ASP A 867 14.137 8.924 11.588 1.00 0.00 O ATOM 1063 OD2 ASP A 867 12.072 8.390 12.117 1.00 0.00 O ATOM 0 H ASP A 867 15.355 7.923 9.695 1.00 0.00 H new ATOM 0 HA ASP A 867 14.524 5.988 11.514 1.00 0.00 H new ATOM 0 HB2 ASP A 867 13.079 7.610 9.390 1.00 0.00 H new ATOM 0 HB3 ASP A 867 12.220 6.538 10.478 1.00 0.00 H new ATOM 1068 N LEU A 868 13.901 5.115 8.376 1.00 0.00 N ATOM 1069 CA LEU A 868 13.668 3.967 7.506 1.00 0.00 C ATOM 1070 C LEU A 868 14.615 2.822 7.850 1.00 0.00 C ATOM 1071 O LEU A 868 14.179 1.704 8.126 1.00 0.00 O ATOM 1072 CB LEU A 868 13.846 4.369 6.041 1.00 0.00 C ATOM 1073 CG LEU A 868 13.347 3.362 5.004 1.00 0.00 C ATOM 1074 CD1 LEU A 868 11.833 3.233 5.071 1.00 0.00 C ATOM 1075 CD2 LEU A 868 13.788 3.773 3.606 1.00 0.00 C ATOM 0 H LEU A 868 13.876 6.017 7.900 1.00 0.00 H new ATOM 0 HA LEU A 868 12.644 3.626 7.661 1.00 0.00 H new ATOM 0 HB2 LEU A 868 13.328 5.314 5.879 1.00 0.00 H new ATOM 0 HB3 LEU A 868 14.906 4.551 5.861 1.00 0.00 H new ATOM 0 HG LEU A 868 13.784 2.390 5.230 1.00 0.00 H new ATOM 0 HD11 LEU A 868 11.496 2.512 4.326 1.00 0.00 H new ATOM 0 HD12 LEU A 868 11.540 2.892 6.064 1.00 0.00 H new ATOM 0 HD13 LEU A 868 11.376 4.202 4.871 1.00 0.00 H new ATOM 0 HD21 LEU A 868 13.424 3.045 2.881 1.00 0.00 H new ATOM 0 HD22 LEU A 868 13.380 4.756 3.370 1.00 0.00 H new ATOM 0 HD23 LEU A 868 14.876 3.813 3.565 1.00 0.00 H new ATOM 1087 N LYS A 869 15.912 3.108 7.835 1.00 0.00 N ATOM 1088 CA LYS A 869 16.922 2.104 8.148 1.00 0.00 C ATOM 1089 C LYS A 869 16.611 1.415 9.473 1.00 0.00 C ATOM 1090 O LYS A 869 16.655 0.189 9.573 1.00 0.00 O ATOM 1091 CB LYS A 869 18.309 2.747 8.209 1.00 0.00 C ATOM 1092 CG LYS A 869 18.970 2.897 6.850 1.00 0.00 C ATOM 1093 CD LYS A 869 19.787 1.667 6.489 1.00 0.00 C ATOM 1094 CE LYS A 869 20.854 1.991 5.454 1.00 0.00 C ATOM 1095 NZ LYS A 869 22.020 2.692 6.060 1.00 0.00 N ATOM 0 H LYS A 869 16.289 4.028 7.609 1.00 0.00 H new ATOM 0 HA LYS A 869 16.911 1.354 7.357 1.00 0.00 H new ATOM 0 HB2 LYS A 869 18.225 3.730 8.673 1.00 0.00 H new ATOM 0 HB3 LYS A 869 18.951 2.145 8.852 1.00 0.00 H new ATOM 0 HG2 LYS A 869 18.207 3.064 6.090 1.00 0.00 H new ATOM 0 HG3 LYS A 869 19.615 3.776 6.853 1.00 0.00 H new ATOM 0 HD2 LYS A 869 20.259 1.266 7.386 1.00 0.00 H new ATOM 0 HD3 LYS A 869 19.127 0.891 6.102 1.00 0.00 H new ATOM 0 HE2 LYS A 869 21.191 1.070 4.979 1.00 0.00 H new ATOM 0 HE3 LYS A 869 20.423 2.614 4.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 869 22.774 2.790 5.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 869 21.727 3.635 6.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 869 22.375 2.141 6.868 1.00 0.00 H new ATOM 1109 N LYS A 870 16.294 2.212 10.489 1.00 0.00 N ATOM 1110 CA LYS A 870 15.972 1.679 11.808 1.00 0.00 C ATOM 1111 C LYS A 870 14.799 0.708 11.731 1.00 0.00 C ATOM 1112 O LYS A 870 14.830 -0.367 12.330 1.00 0.00 O ATOM 1113 CB LYS A 870 15.642 2.819 12.774 1.00 0.00 C ATOM 1114 CG LYS A 870 16.861 3.607 13.224 1.00 0.00 C ATOM 1115 CD LYS A 870 16.470 4.960 13.795 1.00 0.00 C ATOM 1116 CE LYS A 870 17.686 5.728 14.289 1.00 0.00 C ATOM 1117 NZ LYS A 870 17.320 7.079 14.797 1.00 0.00 N ATOM 0 H LYS A 870 16.253 3.229 10.424 1.00 0.00 H new ATOM 0 HA LYS A 870 16.844 1.139 12.177 1.00 0.00 H new ATOM 0 HB2 LYS A 870 14.937 3.498 12.294 1.00 0.00 H new ATOM 0 HB3 LYS A 870 15.142 2.408 13.651 1.00 0.00 H new ATOM 0 HG2 LYS A 870 17.406 3.037 13.976 1.00 0.00 H new ATOM 0 HG3 LYS A 870 17.536 3.748 12.380 1.00 0.00 H new ATOM 0 HD2 LYS A 870 15.955 5.543 13.032 1.00 0.00 H new ATOM 0 HD3 LYS A 870 15.768 4.820 14.617 1.00 0.00 H new ATOM 0 HE2 LYS A 870 18.175 5.162 15.082 1.00 0.00 H new ATOM 0 HE3 LYS A 870 18.407 5.828 13.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 870 18.176 7.570 15.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 870 16.876 7.628 14.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 870 16.652 6.983 15.588 1.00 0.00 H new ATOM 1131 N ARG A 871 13.765 1.093 10.989 1.00 0.00 N ATOM 1132 CA ARG A 871 12.582 0.256 10.834 1.00 0.00 C ATOM 1133 C ARG A 871 12.949 -1.098 10.233 1.00 0.00 C ATOM 1134 O ARG A 871 12.612 -2.145 10.786 1.00 0.00 O ATOM 1135 CB ARG A 871 11.548 0.955 9.950 1.00 0.00 C ATOM 1136 CG ARG A 871 11.229 2.374 10.392 1.00 0.00 C ATOM 1137 CD ARG A 871 10.434 2.387 11.689 1.00 0.00 C ATOM 1138 NE ARG A 871 9.191 1.628 11.577 1.00 0.00 N ATOM 1139 CZ ARG A 871 8.433 1.302 12.618 1.00 0.00 C ATOM 1140 NH1 ARG A 871 8.789 1.668 13.842 1.00 0.00 N ATOM 1141 NH2 ARG A 871 7.316 0.610 12.436 1.00 0.00 N ATOM 0 H ARG A 871 13.723 1.979 10.486 1.00 0.00 H new ATOM 0 HA ARG A 871 12.153 0.091 11.822 1.00 0.00 H new ATOM 0 HB2 ARG A 871 11.915 0.977 8.924 1.00 0.00 H new ATOM 0 HB3 ARG A 871 10.629 0.369 9.947 1.00 0.00 H new ATOM 0 HG2 ARG A 871 12.156 2.932 10.526 1.00 0.00 H new ATOM 0 HG3 ARG A 871 10.662 2.881 9.611 1.00 0.00 H new ATOM 0 HD2 ARG A 871 11.042 1.970 12.491 1.00 0.00 H new ATOM 0 HD3 ARG A 871 10.206 3.417 11.964 1.00 0.00 H new ATOM 0 HE ARG A 871 8.889 1.332 10.649 1.00 0.00 H new ATOM 0 HH11 ARG A 871 9.647 2.201 13.986 1.00 0.00 H new ATOM 0 HH12 ARG A 871 8.205 1.416 14.640 1.00 0.00 H new ATOM 0 HH21 ARG A 871 7.038 0.328 11.496 1.00 0.00 H new ATOM 0 HH22 ARG A 871 6.735 0.360 13.236 1.00 0.00 H new ATOM 1155 N ILE A 872 13.640 -1.068 9.098 1.00 0.00 N ATOM 1156 CA ILE A 872 14.052 -2.292 8.423 1.00 0.00 C ATOM 1157 C ILE A 872 14.845 -3.197 9.360 1.00 0.00 C ATOM 1158 O ILE A 872 14.429 -4.316 9.657 1.00 0.00 O ATOM 1159 CB ILE A 872 14.906 -1.988 7.178 1.00 0.00 C ATOM 1160 CG1 ILE A 872 14.139 -1.076 6.217 1.00 0.00 C ATOM 1161 CG2 ILE A 872 15.308 -3.280 6.483 1.00 0.00 C ATOM 1162 CD1 ILE A 872 14.997 -0.510 5.108 1.00 0.00 C ATOM 0 H ILE A 872 13.926 -0.210 8.627 1.00 0.00 H new ATOM 0 HA ILE A 872 13.140 -2.803 8.113 1.00 0.00 H new ATOM 0 HB ILE A 872 15.812 -1.471 7.494 1.00 0.00 H new ATOM 0 HG12 ILE A 872 13.314 -1.637 5.777 1.00 0.00 H new ATOM 0 HG13 ILE A 872 13.700 -0.253 6.782 1.00 0.00 H new ATOM 0 HG21 ILE A 872 15.911 -3.048 5.605 1.00 0.00 H new ATOM 0 HG22 ILE A 872 15.888 -3.897 7.169 1.00 0.00 H new ATOM 0 HG23 ILE A 872 14.413 -3.822 6.176 1.00 0.00 H new ATOM 0 HD11 ILE A 872 14.388 0.126 4.466 1.00 0.00 H new ATOM 0 HD12 ILE A 872 15.807 0.078 5.539 1.00 0.00 H new ATOM 0 HD13 ILE A 872 15.415 -1.326 4.519 1.00 0.00 H new ATOM 1174 N GLU A 873 15.988 -2.702 9.825 1.00 0.00 N ATOM 1175 CA GLU A 873 16.839 -3.466 10.730 1.00 0.00 C ATOM 1176 C GLU A 873 16.000 -4.220 11.758 1.00 0.00 C ATOM 1177 O GLU A 873 16.100 -5.440 11.882 1.00 0.00 O ATOM 1178 CB GLU A 873 17.827 -2.539 11.441 1.00 0.00 C ATOM 1179 CG GLU A 873 18.762 -1.804 10.496 1.00 0.00 C ATOM 1180 CD GLU A 873 19.500 -0.666 11.173 1.00 0.00 C ATOM 1181 OE1 GLU A 873 18.830 0.263 11.670 1.00 0.00 O ATOM 1182 OE2 GLU A 873 20.748 -0.704 11.205 1.00 0.00 O ATOM 0 H GLU A 873 16.346 -1.776 9.590 1.00 0.00 H new ATOM 0 HA GLU A 873 17.396 -4.192 10.138 1.00 0.00 H new ATOM 0 HB2 GLU A 873 17.269 -1.809 12.027 1.00 0.00 H new ATOM 0 HB3 GLU A 873 18.421 -3.125 12.143 1.00 0.00 H new ATOM 0 HG2 GLU A 873 19.486 -2.509 10.086 1.00 0.00 H new ATOM 0 HG3 GLU A 873 18.189 -1.411 9.656 1.00 0.00 H new ATOM 1189 N SER A 874 15.175 -3.483 12.494 1.00 0.00 N ATOM 1190 CA SER A 874 14.321 -4.080 13.515 1.00 0.00 C ATOM 1191 C SER A 874 13.562 -5.279 12.955 1.00 0.00 C ATOM 1192 O SER A 874 13.583 -6.367 13.533 1.00 0.00 O ATOM 1193 CB SER A 874 13.334 -3.043 14.055 1.00 0.00 C ATOM 1194 OG SER A 874 12.367 -3.649 14.894 1.00 0.00 O ATOM 0 H SER A 874 15.079 -2.472 12.403 1.00 0.00 H new ATOM 0 HA SER A 874 14.957 -4.424 14.330 1.00 0.00 H new ATOM 0 HB2 SER A 874 13.874 -2.277 14.612 1.00 0.00 H new ATOM 0 HB3 SER A 874 12.837 -2.542 13.224 1.00 0.00 H new ATOM 0 HG SER A 874 11.749 -2.966 15.228 1.00 0.00 H new ATOM 1200 N LEU A 875 12.892 -5.072 11.827 1.00 0.00 N ATOM 1201 CA LEU A 875 12.125 -6.136 11.187 1.00 0.00 C ATOM 1202 C LEU A 875 12.990 -7.371 10.961 1.00 0.00 C ATOM 1203 O LEU A 875 12.577 -8.493 11.257 1.00 0.00 O ATOM 1204 CB LEU A 875 11.555 -5.648 9.854 1.00 0.00 C ATOM 1205 CG LEU A 875 10.324 -4.745 9.940 1.00 0.00 C ATOM 1206 CD1 LEU A 875 10.111 -4.006 8.629 1.00 0.00 C ATOM 1207 CD2 LEU A 875 9.090 -5.559 10.302 1.00 0.00 C ATOM 0 H LEU A 875 12.864 -4.178 11.337 1.00 0.00 H new ATOM 0 HA LEU A 875 11.303 -6.408 11.850 1.00 0.00 H new ATOM 0 HB2 LEU A 875 12.339 -5.109 9.322 1.00 0.00 H new ATOM 0 HB3 LEU A 875 11.300 -6.519 9.250 1.00 0.00 H new ATOM 0 HG LEU A 875 10.492 -4.008 10.725 1.00 0.00 H new ATOM 0 HD11 LEU A 875 9.231 -3.369 8.710 1.00 0.00 H new ATOM 0 HD12 LEU A 875 10.985 -3.392 8.411 1.00 0.00 H new ATOM 0 HD13 LEU A 875 9.965 -4.727 7.825 1.00 0.00 H new ATOM 0 HD21 LEU A 875 8.223 -4.900 10.359 1.00 0.00 H new ATOM 0 HD22 LEU A 875 8.919 -6.319 9.540 1.00 0.00 H new ATOM 0 HD23 LEU A 875 9.243 -6.042 11.267 1.00 0.00 H new ATOM 1219 N ILE A 876 14.193 -7.158 10.439 1.00 0.00 N ATOM 1220 CA ILE A 876 15.117 -8.254 10.177 1.00 0.00 C ATOM 1221 C ILE A 876 15.376 -9.068 11.441 1.00 0.00 C ATOM 1222 O ILE A 876 15.484 -10.293 11.391 1.00 0.00 O ATOM 1223 CB ILE A 876 16.461 -7.739 9.628 1.00 0.00 C ATOM 1224 CG1 ILE A 876 16.238 -6.944 8.340 1.00 0.00 C ATOM 1225 CG2 ILE A 876 17.413 -8.900 9.382 1.00 0.00 C ATOM 1226 CD1 ILE A 876 17.511 -6.372 7.755 1.00 0.00 C ATOM 0 H ILE A 876 14.551 -6.236 10.189 1.00 0.00 H new ATOM 0 HA ILE A 876 14.647 -8.890 9.427 1.00 0.00 H new ATOM 0 HB ILE A 876 16.910 -7.078 10.369 1.00 0.00 H new ATOM 0 HG12 ILE A 876 15.766 -7.591 7.600 1.00 0.00 H new ATOM 0 HG13 ILE A 876 15.542 -6.130 8.541 1.00 0.00 H new ATOM 0 HG21 ILE A 876 18.358 -8.520 8.994 1.00 0.00 H new ATOM 0 HG22 ILE A 876 17.591 -9.429 10.318 1.00 0.00 H new ATOM 0 HG23 ILE A 876 16.972 -9.584 8.657 1.00 0.00 H new ATOM 0 HD11 ILE A 876 17.277 -5.821 6.844 1.00 0.00 H new ATOM 0 HD12 ILE A 876 17.973 -5.699 8.477 1.00 0.00 H new ATOM 0 HD13 ILE A 876 18.201 -7.183 7.522 1.00 0.00 H new ATOM 1238 N ASP A 877 15.474 -8.378 12.572 1.00 0.00 N ATOM 1239 CA ASP A 877 15.717 -9.037 13.850 1.00 0.00 C ATOM 1240 C ASP A 877 14.413 -9.549 14.455 1.00 0.00 C ATOM 1241 O ASP A 877 14.423 -10.348 15.391 1.00 0.00 O ATOM 1242 CB ASP A 877 16.401 -8.075 14.822 1.00 0.00 C ATOM 1243 CG ASP A 877 17.165 -8.800 15.913 1.00 0.00 C ATOM 1244 OD1 ASP A 877 17.802 -9.829 15.608 1.00 0.00 O ATOM 1245 OD2 ASP A 877 17.125 -8.336 17.072 1.00 0.00 O ATOM 0 H ASP A 877 15.389 -7.363 12.630 1.00 0.00 H new ATOM 0 HA ASP A 877 16.373 -9.889 13.672 1.00 0.00 H new ATOM 0 HB2 ASP A 877 17.085 -7.431 14.270 1.00 0.00 H new ATOM 0 HB3 ASP A 877 15.651 -7.428 15.276 1.00 0.00 H new ATOM 1250 N ARG A 878 13.293 -9.081 13.914 1.00 0.00 N ATOM 1251 CA ARG A 878 11.981 -9.489 14.402 1.00 0.00 C ATOM 1252 C ARG A 878 11.551 -10.808 13.767 1.00 0.00 C ATOM 1253 O ARG A 878 10.376 -11.175 13.810 1.00 0.00 O ATOM 1254 CB ARG A 878 10.943 -8.405 14.105 1.00 0.00 C ATOM 1255 CG ARG A 878 10.824 -7.359 15.201 1.00 0.00 C ATOM 1256 CD ARG A 878 10.129 -6.103 14.699 1.00 0.00 C ATOM 1257 NE ARG A 878 8.717 -6.337 14.410 1.00 0.00 N ATOM 1258 CZ ARG A 878 7.813 -5.368 14.328 1.00 0.00 C ATOM 1259 NH1 ARG A 878 8.172 -4.105 14.512 1.00 0.00 N ATOM 1260 NH2 ARG A 878 6.547 -5.660 14.060 1.00 0.00 N ATOM 0 H ARG A 878 13.268 -8.419 13.138 1.00 0.00 H new ATOM 0 HA ARG A 878 12.050 -9.630 15.481 1.00 0.00 H new ATOM 0 HB2 ARG A 878 11.204 -7.910 13.169 1.00 0.00 H new ATOM 0 HB3 ARG A 878 9.971 -8.876 13.956 1.00 0.00 H new ATOM 0 HG2 ARG A 878 10.267 -7.773 16.042 1.00 0.00 H new ATOM 0 HG3 ARG A 878 11.817 -7.104 15.571 1.00 0.00 H new ATOM 0 HD2 ARG A 878 10.220 -5.315 15.447 1.00 0.00 H new ATOM 0 HD3 ARG A 878 10.629 -5.747 13.798 1.00 0.00 H new ATOM 0 HE ARG A 878 8.408 -7.298 14.263 1.00 0.00 H new ATOM 0 HH11 ARG A 878 9.145 -3.876 14.717 1.00 0.00 H new ATOM 0 HH12 ARG A 878 7.476 -3.362 14.448 1.00 0.00 H new ATOM 0 HH21 ARG A 878 6.267 -6.630 13.917 1.00 0.00 H new ATOM 0 HH22 ARG A 878 5.854 -4.914 13.997 1.00 0.00 H new ATOM 1274 N ASP A 879 12.509 -11.515 13.178 1.00 0.00 N ATOM 1275 CA ASP A 879 12.230 -12.793 12.534 1.00 0.00 C ATOM 1276 C ASP A 879 11.301 -12.608 11.338 1.00 0.00 C ATOM 1277 O ASP A 879 10.282 -13.289 11.219 1.00 0.00 O ATOM 1278 CB ASP A 879 11.605 -13.767 13.534 1.00 0.00 C ATOM 1279 CG ASP A 879 11.324 -15.125 12.922 1.00 0.00 C ATOM 1280 OD1 ASP A 879 12.192 -15.634 12.182 1.00 0.00 O ATOM 1281 OD2 ASP A 879 10.236 -15.680 13.184 1.00 0.00 O ATOM 0 H ASP A 879 13.486 -11.225 13.133 1.00 0.00 H new ATOM 0 HA ASP A 879 13.174 -13.205 12.178 1.00 0.00 H new ATOM 0 HB2 ASP A 879 12.274 -13.887 14.386 1.00 0.00 H new ATOM 0 HB3 ASP A 879 10.676 -13.345 13.916 1.00 0.00 H new ATOM 1286 N TYR A 880 11.660 -11.683 10.455 1.00 0.00 N ATOM 1287 CA TYR A 880 10.857 -11.405 9.270 1.00 0.00 C ATOM 1288 C TYR A 880 11.710 -11.473 8.006 1.00 0.00 C ATOM 1289 O TYR A 880 11.220 -11.820 6.932 1.00 0.00 O ATOM 1290 CB TYR A 880 10.202 -10.027 9.383 1.00 0.00 C ATOM 1291 CG TYR A 880 8.978 -10.010 10.269 1.00 0.00 C ATOM 1292 CD1 TYR A 880 7.721 -10.306 9.757 1.00 0.00 C ATOM 1293 CD2 TYR A 880 9.078 -9.698 11.620 1.00 0.00 C ATOM 1294 CE1 TYR A 880 6.599 -10.291 10.563 1.00 0.00 C ATOM 1295 CE2 TYR A 880 7.962 -9.682 12.434 1.00 0.00 C ATOM 1296 CZ TYR A 880 6.725 -9.978 11.901 1.00 0.00 C ATOM 1297 OH TYR A 880 5.610 -9.963 12.707 1.00 0.00 O ATOM 0 H TYR A 880 12.502 -11.113 10.537 1.00 0.00 H new ATOM 0 HA TYR A 880 10.079 -12.165 9.203 1.00 0.00 H new ATOM 0 HB2 TYR A 880 10.932 -9.318 9.773 1.00 0.00 H new ATOM 0 HB3 TYR A 880 9.924 -9.683 8.387 1.00 0.00 H new ATOM 0 HD1 TYR A 880 7.619 -10.552 8.710 1.00 0.00 H new ATOM 0 HD2 TYR A 880 10.045 -9.464 12.040 1.00 0.00 H new ATOM 0 HE1 TYR A 880 5.629 -10.523 10.148 1.00 0.00 H new ATOM 0 HE2 TYR A 880 8.058 -9.439 13.482 1.00 0.00 H new ATOM 0 HH TYR A 880 5.870 -9.725 13.621 1.00 0.00 H new ATOM 1307 N MET A 881 12.989 -11.140 8.145 1.00 0.00 N ATOM 1308 CA MET A 881 13.911 -11.165 7.015 1.00 0.00 C ATOM 1309 C MET A 881 15.318 -11.541 7.470 1.00 0.00 C ATOM 1310 O MET A 881 15.724 -11.223 8.587 1.00 0.00 O ATOM 1311 CB MET A 881 13.936 -9.803 6.319 1.00 0.00 C ATOM 1312 CG MET A 881 12.583 -9.375 5.772 1.00 0.00 C ATOM 1313 SD MET A 881 12.035 -10.402 4.395 1.00 0.00 S ATOM 1314 CE MET A 881 12.958 -9.675 3.043 1.00 0.00 C ATOM 0 H MET A 881 13.410 -10.850 9.028 1.00 0.00 H new ATOM 0 HA MET A 881 13.561 -11.919 6.310 1.00 0.00 H new ATOM 0 HB2 MET A 881 14.288 -9.050 7.024 1.00 0.00 H new ATOM 0 HB3 MET A 881 14.656 -9.835 5.501 1.00 0.00 H new ATOM 0 HG2 MET A 881 11.842 -9.419 6.570 1.00 0.00 H new ATOM 0 HG3 MET A 881 12.639 -8.336 5.446 1.00 0.00 H new ATOM 0 HE1 MET A 881 13.276 -10.459 2.356 1.00 0.00 H new ATOM 0 HE2 MET A 881 12.326 -8.963 2.513 1.00 0.00 H new ATOM 0 HE3 MET A 881 13.834 -9.160 3.436 1.00 0.00 H new ATOM 1324 N GLU A 882 16.055 -12.221 6.598 1.00 0.00 N ATOM 1325 CA GLU A 882 17.415 -12.641 6.912 1.00 0.00 C ATOM 1326 C GLU A 882 18.414 -12.032 5.932 1.00 0.00 C ATOM 1327 O GLU A 882 18.170 -11.991 4.726 1.00 0.00 O ATOM 1328 CB GLU A 882 17.521 -14.167 6.881 1.00 0.00 C ATOM 1329 CG GLU A 882 17.257 -14.768 5.511 1.00 0.00 C ATOM 1330 CD GLU A 882 17.599 -16.244 5.446 1.00 0.00 C ATOM 1331 OE1 GLU A 882 16.790 -17.062 5.931 1.00 0.00 O ATOM 1332 OE2 GLU A 882 18.676 -16.581 4.910 1.00 0.00 O ATOM 0 H GLU A 882 15.733 -12.493 5.669 1.00 0.00 H new ATOM 0 HA GLU A 882 17.654 -12.287 7.915 1.00 0.00 H new ATOM 0 HB2 GLU A 882 18.518 -14.460 7.211 1.00 0.00 H new ATOM 0 HB3 GLU A 882 16.812 -14.587 7.595 1.00 0.00 H new ATOM 0 HG2 GLU A 882 16.207 -14.631 5.254 1.00 0.00 H new ATOM 0 HG3 GLU A 882 17.841 -14.230 4.764 1.00 0.00 H new ATOM 1339 N ARG A 883 19.537 -11.557 6.459 1.00 0.00 N ATOM 1340 CA ARG A 883 20.572 -10.948 5.632 1.00 0.00 C ATOM 1341 C ARG A 883 21.363 -12.013 4.878 1.00 0.00 C ATOM 1342 O ARG A 883 21.949 -12.910 5.485 1.00 0.00 O ATOM 1343 CB ARG A 883 21.517 -10.110 6.495 1.00 0.00 C ATOM 1344 CG ARG A 883 20.984 -8.723 6.812 1.00 0.00 C ATOM 1345 CD ARG A 883 21.925 -7.962 7.733 1.00 0.00 C ATOM 1346 NE ARG A 883 22.173 -8.683 8.979 1.00 0.00 N ATOM 1347 CZ ARG A 883 23.160 -8.384 9.816 1.00 0.00 C ATOM 1348 NH1 ARG A 883 23.986 -7.384 9.543 1.00 0.00 N ATOM 1349 NH2 ARG A 883 23.322 -9.087 10.930 1.00 0.00 N ATOM 0 H ARG A 883 19.754 -11.582 7.455 1.00 0.00 H new ATOM 0 HA ARG A 883 20.085 -10.299 4.904 1.00 0.00 H new ATOM 0 HB2 ARG A 883 21.707 -10.639 7.429 1.00 0.00 H new ATOM 0 HB3 ARG A 883 22.474 -10.014 5.982 1.00 0.00 H new ATOM 0 HG2 ARG A 883 20.848 -8.164 5.886 1.00 0.00 H new ATOM 0 HG3 ARG A 883 20.003 -8.807 7.281 1.00 0.00 H new ATOM 0 HD2 ARG A 883 22.871 -7.787 7.221 1.00 0.00 H new ATOM 0 HD3 ARG A 883 21.499 -6.984 7.958 1.00 0.00 H new ATOM 0 HE ARG A 883 21.555 -9.458 9.219 1.00 0.00 H new ATOM 0 HH11 ARG A 883 23.865 -6.841 8.688 1.00 0.00 H new ATOM 0 HH12 ARG A 883 24.743 -7.157 10.188 1.00 0.00 H new ATOM 0 HH21 ARG A 883 22.688 -9.857 11.144 1.00 0.00 H new ATOM 0 HH22 ARG A 883 24.080 -8.857 11.572 1.00 0.00 H new ATOM 1363 N ASP A 884 21.375 -11.907 3.554 1.00 0.00 N ATOM 1364 CA ASP A 884 22.094 -12.861 2.718 1.00 0.00 C ATOM 1365 C ASP A 884 23.554 -12.967 3.146 1.00 0.00 C ATOM 1366 O ASP A 884 24.306 -11.994 3.077 1.00 0.00 O ATOM 1367 CB ASP A 884 22.010 -12.447 1.248 1.00 0.00 C ATOM 1368 CG ASP A 884 22.530 -13.521 0.313 1.00 0.00 C ATOM 1369 OD1 ASP A 884 22.848 -14.627 0.798 1.00 0.00 O ATOM 1370 OD2 ASP A 884 22.617 -13.257 -0.904 1.00 0.00 O ATOM 0 H ASP A 884 20.895 -11.170 3.037 1.00 0.00 H new ATOM 0 HA ASP A 884 21.627 -13.838 2.840 1.00 0.00 H new ATOM 0 HB2 ASP A 884 20.974 -12.221 0.996 1.00 0.00 H new ATOM 0 HB3 ASP A 884 22.582 -11.531 1.098 1.00 0.00 H new ATOM 1375 N LYS A 885 23.950 -14.155 3.591 1.00 0.00 N ATOM 1376 CA LYS A 885 25.320 -14.389 4.032 1.00 0.00 C ATOM 1377 C LYS A 885 26.317 -13.736 3.080 1.00 0.00 C ATOM 1378 O LYS A 885 27.429 -13.387 3.476 1.00 0.00 O ATOM 1379 CB LYS A 885 25.597 -15.891 4.125 1.00 0.00 C ATOM 1380 CG LYS A 885 25.797 -16.558 2.775 1.00 0.00 C ATOM 1381 CD LYS A 885 26.778 -17.715 2.865 1.00 0.00 C ATOM 1382 CE LYS A 885 27.498 -17.940 1.544 1.00 0.00 C ATOM 1383 NZ LYS A 885 28.747 -17.135 1.450 1.00 0.00 N ATOM 0 H LYS A 885 23.341 -14.971 3.656 1.00 0.00 H new ATOM 0 HA LYS A 885 25.440 -13.941 5.019 1.00 0.00 H new ATOM 0 HB2 LYS A 885 26.486 -16.051 4.735 1.00 0.00 H new ATOM 0 HB3 LYS A 885 24.766 -16.374 4.640 1.00 0.00 H new ATOM 0 HG2 LYS A 885 24.839 -16.920 2.402 1.00 0.00 H new ATOM 0 HG3 LYS A 885 26.163 -15.825 2.056 1.00 0.00 H new ATOM 0 HD2 LYS A 885 27.508 -17.514 3.649 1.00 0.00 H new ATOM 0 HD3 LYS A 885 26.246 -18.623 3.150 1.00 0.00 H new ATOM 0 HE2 LYS A 885 27.739 -18.998 1.437 1.00 0.00 H new ATOM 0 HE3 LYS A 885 26.835 -17.679 0.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 885 29.209 -17.316 0.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 885 28.515 -16.124 1.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 885 29.391 -17.402 2.222 1.00 0.00 H new ATOM 1397 N GLU A 886 25.911 -13.572 1.825 1.00 0.00 N ATOM 1398 CA GLU A 886 26.770 -12.959 0.819 1.00 0.00 C ATOM 1399 C GLU A 886 26.962 -11.472 1.100 1.00 0.00 C ATOM 1400 O GLU A 886 28.089 -10.984 1.170 1.00 0.00 O ATOM 1401 CB GLU A 886 26.175 -13.153 -0.578 1.00 0.00 C ATOM 1402 CG GLU A 886 26.639 -14.425 -1.266 1.00 0.00 C ATOM 1403 CD GLU A 886 26.678 -14.290 -2.776 1.00 0.00 C ATOM 1404 OE1 GLU A 886 25.603 -14.103 -3.383 1.00 0.00 O ATOM 1405 OE2 GLU A 886 27.784 -14.372 -3.351 1.00 0.00 O ATOM 0 H GLU A 886 24.993 -13.855 1.481 1.00 0.00 H new ATOM 0 HA GLU A 886 27.743 -13.448 0.863 1.00 0.00 H new ATOM 0 HB2 GLU A 886 25.088 -13.167 -0.502 1.00 0.00 H new ATOM 0 HB3 GLU A 886 26.440 -12.297 -1.199 1.00 0.00 H new ATOM 0 HG2 GLU A 886 27.632 -14.689 -0.903 1.00 0.00 H new ATOM 0 HG3 GLU A 886 25.973 -15.244 -0.995 1.00 0.00 H new ATOM 1412 N ASN A 887 25.853 -10.758 1.260 1.00 0.00 N ATOM 1413 CA ASN A 887 25.899 -9.326 1.532 1.00 0.00 C ATOM 1414 C ASN A 887 24.625 -8.865 2.235 1.00 0.00 C ATOM 1415 O ASN A 887 23.527 -9.353 1.967 1.00 0.00 O ATOM 1416 CB ASN A 887 26.088 -8.544 0.231 1.00 0.00 C ATOM 1417 CG ASN A 887 27.248 -9.066 -0.594 1.00 0.00 C ATOM 1418 OD1 ASN A 887 26.969 -10.030 -1.464 1.00 0.00 O flip ATOM 1419 ND2 ASN A 887 28.382 -8.608 -0.451 1.00 0.00 N flip ATOM 0 H ASN A 887 24.912 -11.147 1.206 1.00 0.00 H new ATOM 0 HA ASN A 887 26.747 -9.133 2.190 1.00 0.00 H new ATOM 0 HB2 ASN A 887 25.173 -8.598 -0.359 1.00 0.00 H new ATOM 0 HB3 ASN A 887 26.255 -7.492 0.463 1.00 0.00 H new ATOM 0 HD21 ASN A 887 28.551 -7.867 0.230 1.00 0.00 H new ATOM 0 HD22 ASN A 887 29.153 -8.969 -1.013 1.00 0.00 H new ATOM 1426 N PRO A 888 24.774 -7.901 3.156 1.00 0.00 N ATOM 1427 CA PRO A 888 23.646 -7.352 3.915 1.00 0.00 C ATOM 1428 C PRO A 888 22.715 -6.513 3.046 1.00 0.00 C ATOM 1429 O PRO A 888 21.704 -5.999 3.521 1.00 0.00 O ATOM 1430 CB PRO A 888 24.324 -6.476 4.972 1.00 0.00 C ATOM 1431 CG PRO A 888 25.634 -6.101 4.371 1.00 0.00 C ATOM 1432 CD PRO A 888 26.053 -7.273 3.527 1.00 0.00 C ATOM 0 HA PRO A 888 23.015 -8.137 4.332 1.00 0.00 H new ATOM 0 HB2 PRO A 888 23.725 -5.594 5.198 1.00 0.00 H new ATOM 0 HB3 PRO A 888 24.459 -7.018 5.908 1.00 0.00 H new ATOM 0 HG2 PRO A 888 25.542 -5.198 3.767 1.00 0.00 H new ATOM 0 HG3 PRO A 888 26.373 -5.893 5.145 1.00 0.00 H new ATOM 0 HD2 PRO A 888 26.614 -6.955 2.648 1.00 0.00 H new ATOM 0 HD3 PRO A 888 26.692 -7.960 4.082 1.00 0.00 H new ATOM 1440 N ASN A 889 23.064 -6.381 1.771 1.00 0.00 N ATOM 1441 CA ASN A 889 22.258 -5.605 0.835 1.00 0.00 C ATOM 1442 C ASN A 889 21.047 -6.405 0.365 1.00 0.00 C ATOM 1443 O ASN A 889 20.016 -5.836 0.009 1.00 0.00 O ATOM 1444 CB ASN A 889 23.103 -5.182 -0.369 1.00 0.00 C ATOM 1445 CG ASN A 889 24.307 -4.352 0.032 1.00 0.00 C ATOM 1446 OD1 ASN A 889 24.166 -3.261 0.586 1.00 0.00 O ATOM 1447 ND2 ASN A 889 25.499 -4.865 -0.247 1.00 0.00 N ATOM 0 H ASN A 889 23.899 -6.801 1.362 1.00 0.00 H new ATOM 0 HA ASN A 889 21.903 -4.714 1.353 1.00 0.00 H new ATOM 0 HB2 ASN A 889 23.439 -6.071 -0.903 1.00 0.00 H new ATOM 0 HB3 ASN A 889 22.485 -4.609 -1.060 1.00 0.00 H new ATOM 0 HD21 ASN A 889 26.345 -4.352 -0.001 1.00 0.00 H new ATOM 0 HD22 ASN A 889 25.569 -5.773 -0.707 1.00 0.00 H new ATOM 1454 N GLN A 890 21.181 -7.727 0.368 1.00 0.00 N ATOM 1455 CA GLN A 890 20.098 -8.605 -0.058 1.00 0.00 C ATOM 1456 C GLN A 890 19.406 -9.239 1.145 1.00 0.00 C ATOM 1457 O GLN A 890 20.062 -9.757 2.049 1.00 0.00 O ATOM 1458 CB GLN A 890 20.633 -9.696 -0.987 1.00 0.00 C ATOM 1459 CG GLN A 890 19.610 -10.772 -1.315 1.00 0.00 C ATOM 1460 CD GLN A 890 19.826 -11.384 -2.685 1.00 0.00 C ATOM 1461 OE1 GLN A 890 19.976 -10.672 -3.679 1.00 0.00 O ATOM 1462 NE2 GLN A 890 19.843 -12.710 -2.745 1.00 0.00 N ATOM 0 H GLN A 890 22.028 -8.213 0.661 1.00 0.00 H new ATOM 0 HA GLN A 890 19.368 -8.003 -0.599 1.00 0.00 H new ATOM 0 HB2 GLN A 890 20.975 -9.236 -1.914 1.00 0.00 H new ATOM 0 HB3 GLN A 890 21.502 -10.162 -0.523 1.00 0.00 H new ATOM 0 HG2 GLN A 890 19.658 -11.556 -0.559 1.00 0.00 H new ATOM 0 HG3 GLN A 890 18.609 -10.343 -1.266 1.00 0.00 H new ATOM 0 HE21 GLN A 890 19.715 -13.261 -1.896 1.00 0.00 H new ATOM 0 HE22 GLN A 890 19.985 -13.178 -3.640 1.00 0.00 H new ATOM 1471 N TYR A 891 18.079 -9.194 1.149 1.00 0.00 N ATOM 1472 CA TYR A 891 17.298 -9.761 2.241 1.00 0.00 C ATOM 1473 C TYR A 891 16.373 -10.864 1.735 1.00 0.00 C ATOM 1474 O TYR A 891 15.795 -10.757 0.655 1.00 0.00 O ATOM 1475 CB TYR A 891 16.478 -8.669 2.931 1.00 0.00 C ATOM 1476 CG TYR A 891 17.267 -7.413 3.223 1.00 0.00 C ATOM 1477 CD1 TYR A 891 18.358 -7.438 4.083 1.00 0.00 C ATOM 1478 CD2 TYR A 891 16.922 -6.201 2.637 1.00 0.00 C ATOM 1479 CE1 TYR A 891 19.081 -6.292 4.353 1.00 0.00 C ATOM 1480 CE2 TYR A 891 17.640 -5.050 2.900 1.00 0.00 C ATOM 1481 CZ TYR A 891 18.718 -5.101 3.759 1.00 0.00 C ATOM 1482 OH TYR A 891 19.437 -3.958 4.024 1.00 0.00 O ATOM 0 H TYR A 891 17.521 -8.770 0.408 1.00 0.00 H new ATOM 0 HA TYR A 891 17.991 -10.195 2.961 1.00 0.00 H new ATOM 0 HB2 TYR A 891 15.625 -8.414 2.302 1.00 0.00 H new ATOM 0 HB3 TYR A 891 16.078 -9.062 3.866 1.00 0.00 H new ATOM 0 HD1 TYR A 891 18.646 -8.369 4.548 1.00 0.00 H new ATOM 0 HD2 TYR A 891 16.078 -6.158 1.964 1.00 0.00 H new ATOM 0 HE1 TYR A 891 19.925 -6.328 5.025 1.00 0.00 H new ATOM 0 HE2 TYR A 891 17.359 -4.116 2.436 1.00 0.00 H new ATOM 0 HH TYR A 891 20.395 -4.151 3.955 1.00 0.00 H new ATOM 1492 N ASN A 892 16.239 -11.924 2.526 1.00 0.00 N ATOM 1493 CA ASN A 892 15.385 -13.048 2.159 1.00 0.00 C ATOM 1494 C ASN A 892 14.157 -13.115 3.063 1.00 0.00 C ATOM 1495 O ASN A 892 14.186 -12.651 4.203 1.00 0.00 O ATOM 1496 CB ASN A 892 16.168 -14.359 2.244 1.00 0.00 C ATOM 1497 CG ASN A 892 17.482 -14.298 1.490 1.00 0.00 C ATOM 1498 OD1 ASN A 892 17.555 -14.666 0.318 1.00 0.00 O ATOM 1499 ND2 ASN A 892 18.528 -13.832 2.162 1.00 0.00 N ATOM 0 H ASN A 892 16.710 -12.028 3.424 1.00 0.00 H new ATOM 0 HA ASN A 892 15.051 -12.899 1.132 1.00 0.00 H new ATOM 0 HB2 ASN A 892 16.363 -14.595 3.290 1.00 0.00 H new ATOM 0 HB3 ASN A 892 15.559 -15.169 1.843 1.00 0.00 H new ATOM 0 HD21 ASN A 892 19.439 -13.768 1.707 1.00 0.00 H new ATOM 0 HD22 ASN A 892 18.421 -13.538 3.133 1.00 0.00 H new ATOM 1506 N TYR A 893 13.081 -13.697 2.546 1.00 0.00 N ATOM 1507 CA TYR A 893 11.843 -13.825 3.305 1.00 0.00 C ATOM 1508 C TYR A 893 11.873 -15.065 4.193 1.00 0.00 C ATOM 1509 O TYR A 893 12.135 -16.173 3.722 1.00 0.00 O ATOM 1510 CB TYR A 893 10.644 -13.892 2.358 1.00 0.00 C ATOM 1511 CG TYR A 893 9.309 -13.823 3.064 1.00 0.00 C ATOM 1512 CD1 TYR A 893 8.990 -12.749 3.887 1.00 0.00 C ATOM 1513 CD2 TYR A 893 8.366 -14.832 2.911 1.00 0.00 C ATOM 1514 CE1 TYR A 893 7.772 -12.683 4.535 1.00 0.00 C ATOM 1515 CE2 TYR A 893 7.145 -14.773 3.554 1.00 0.00 C ATOM 1516 CZ TYR A 893 6.853 -13.697 4.365 1.00 0.00 C ATOM 1517 OH TYR A 893 5.638 -13.635 5.009 1.00 0.00 O ATOM 0 H TYR A 893 13.041 -14.088 1.605 1.00 0.00 H new ATOM 0 HA TYR A 893 11.746 -12.946 3.942 1.00 0.00 H new ATOM 0 HB2 TYR A 893 10.710 -13.072 1.643 1.00 0.00 H new ATOM 0 HB3 TYR A 893 10.695 -14.818 1.786 1.00 0.00 H new ATOM 0 HD1 TYR A 893 9.707 -11.953 4.022 1.00 0.00 H new ATOM 0 HD2 TYR A 893 8.592 -15.677 2.278 1.00 0.00 H new ATOM 0 HE1 TYR A 893 7.541 -11.842 5.171 1.00 0.00 H new ATOM 0 HE2 TYR A 893 6.423 -15.565 3.422 1.00 0.00 H new ATOM 0 HH TYR A 893 5.107 -14.427 4.782 1.00 0.00 H new ATOM 1527 N ILE A 894 11.603 -14.871 5.479 1.00 0.00 N ATOM 1528 CA ILE A 894 11.597 -15.973 6.433 1.00 0.00 C ATOM 1529 C ILE A 894 10.236 -16.108 7.109 1.00 0.00 C ATOM 1530 O ILE A 894 9.795 -17.213 7.423 1.00 0.00 O ATOM 1531 CB ILE A 894 12.678 -15.787 7.514 1.00 0.00 C ATOM 1532 CG1 ILE A 894 12.632 -14.363 8.074 1.00 0.00 C ATOM 1533 CG2 ILE A 894 14.055 -16.094 6.945 1.00 0.00 C ATOM 1534 CD1 ILE A 894 13.739 -14.065 9.061 1.00 0.00 C ATOM 0 H ILE A 894 11.385 -13.961 5.885 1.00 0.00 H new ATOM 0 HA ILE A 894 11.811 -16.880 5.868 1.00 0.00 H new ATOM 0 HB ILE A 894 12.479 -16.484 8.328 1.00 0.00 H new ATOM 0 HG12 ILE A 894 12.693 -13.654 7.248 1.00 0.00 H new ATOM 0 HG13 ILE A 894 11.670 -14.204 8.561 1.00 0.00 H new ATOM 0 HG21 ILE A 894 14.808 -15.958 7.721 1.00 0.00 H new ATOM 0 HG22 ILE A 894 14.081 -17.125 6.591 1.00 0.00 H new ATOM 0 HG23 ILE A 894 14.264 -15.420 6.114 1.00 0.00 H new ATOM 0 HD11 ILE A 894 13.644 -13.039 9.416 1.00 0.00 H new ATOM 0 HD12 ILE A 894 13.667 -14.750 9.906 1.00 0.00 H new ATOM 0 HD13 ILE A 894 14.705 -14.192 8.573 1.00 0.00 H new ATOM 1546 N ALA A 895 9.575 -14.976 7.327 1.00 0.00 N ATOM 1547 CA ALA A 895 8.263 -14.968 7.961 1.00 0.00 C ATOM 1548 C ALA A 895 7.401 -16.120 7.455 1.00 0.00 C ATOM 1549 O ALA A 895 7.343 -16.382 6.253 1.00 0.00 O ATOM 1550 CB ALA A 895 7.566 -13.638 7.717 1.00 0.00 C ATOM 0 H ALA A 895 9.927 -14.053 7.074 1.00 0.00 H new ATOM 0 HA ALA A 895 8.405 -15.099 9.034 1.00 0.00 H new ATOM 0 HB1 ALA A 895 6.587 -13.647 8.196 1.00 0.00 H new ATOM 0 HB2 ALA A 895 8.167 -12.830 8.134 1.00 0.00 H new ATOM 0 HB3 ALA A 895 7.444 -13.483 6.645 1.00 0.00 H new ATOM 1556 N SER A 896 6.734 -16.805 8.378 1.00 0.00 N ATOM 1557 CA SER A 896 5.879 -17.932 8.025 1.00 0.00 C ATOM 1558 C SER A 896 4.411 -17.601 8.280 1.00 0.00 C ATOM 1559 O SER A 896 4.050 -17.119 9.353 1.00 0.00 O ATOM 1560 CB SER A 896 6.280 -19.174 8.822 1.00 0.00 C ATOM 1561 OG SER A 896 5.337 -20.217 8.650 1.00 0.00 O ATOM 0 H SER A 896 6.769 -16.599 9.376 1.00 0.00 H new ATOM 0 HA SER A 896 6.008 -18.135 6.962 1.00 0.00 H new ATOM 0 HB2 SER A 896 7.265 -19.513 8.501 1.00 0.00 H new ATOM 0 HB3 SER A 896 6.359 -18.922 9.879 1.00 0.00 H new ATOM 0 HG SER A 896 5.617 -21.000 9.168 1.00 0.00 H new ATOM 1567 N GLY A 897 3.570 -17.865 7.286 1.00 0.00 N ATOM 1568 CA GLY A 897 2.151 -17.589 7.421 1.00 0.00 C ATOM 1569 C GLY A 897 1.306 -18.419 6.475 1.00 0.00 C ATOM 1570 O GLY A 897 1.821 -19.142 5.621 1.00 0.00 O ATOM 0 H GLY A 897 3.845 -18.265 6.389 1.00 0.00 H new ATOM 0 HA2 GLY A 897 1.842 -17.786 8.447 1.00 0.00 H new ATOM 0 HA3 GLY A 897 1.970 -16.531 7.231 1.00 0.00 H new ATOM 1574 N PRO A 898 -0.023 -18.320 6.621 1.00 0.00 N ATOM 1575 CA PRO A 898 -0.969 -19.061 5.781 1.00 0.00 C ATOM 1576 C PRO A 898 -0.991 -18.551 4.344 1.00 0.00 C ATOM 1577 O PRO A 898 -1.816 -17.710 3.987 1.00 0.00 O ATOM 1578 CB PRO A 898 -2.318 -18.808 6.459 1.00 0.00 C ATOM 1579 CG PRO A 898 -2.144 -17.516 7.180 1.00 0.00 C ATOM 1580 CD PRO A 898 -0.706 -17.477 7.617 1.00 0.00 C ATOM 0 HA PRO A 898 -0.706 -20.116 5.704 1.00 0.00 H new ATOM 0 HB2 PRO A 898 -3.124 -18.747 5.727 1.00 0.00 H new ATOM 0 HB3 PRO A 898 -2.572 -19.614 7.147 1.00 0.00 H new ATOM 0 HG2 PRO A 898 -2.378 -16.672 6.531 1.00 0.00 H new ATOM 0 HG3 PRO A 898 -2.814 -17.454 8.037 1.00 0.00 H new ATOM 0 HD2 PRO A 898 -0.314 -16.460 7.619 1.00 0.00 H new ATOM 0 HD3 PRO A 898 -0.582 -17.868 8.627 1.00 0.00 H new ATOM 1588 N SER A 899 -0.080 -19.066 3.525 1.00 0.00 N ATOM 1589 CA SER A 899 0.007 -18.660 2.127 1.00 0.00 C ATOM 1590 C SER A 899 -0.542 -19.749 1.210 1.00 0.00 C ATOM 1591 O SER A 899 -0.148 -20.912 1.304 1.00 0.00 O ATOM 1592 CB SER A 899 1.457 -18.347 1.754 1.00 0.00 C ATOM 1593 OG SER A 899 1.522 -17.550 0.584 1.00 0.00 O ATOM 0 H SER A 899 0.608 -19.765 3.805 1.00 0.00 H new ATOM 0 HA SER A 899 -0.596 -17.761 1.997 1.00 0.00 H new ATOM 0 HB2 SER A 899 1.944 -17.827 2.579 1.00 0.00 H new ATOM 0 HB3 SER A 899 2.004 -19.277 1.595 1.00 0.00 H new ATOM 0 HG SER A 899 2.459 -17.362 0.368 1.00 0.00 H new ATOM 1599 N SER A 900 -1.453 -19.364 0.323 1.00 0.00 N ATOM 1600 CA SER A 900 -2.060 -20.307 -0.609 1.00 0.00 C ATOM 1601 C SER A 900 -1.027 -21.307 -1.120 1.00 0.00 C ATOM 1602 O SER A 900 -1.203 -22.518 -0.993 1.00 0.00 O ATOM 1603 CB SER A 900 -2.688 -19.560 -1.787 1.00 0.00 C ATOM 1604 OG SER A 900 -3.576 -18.551 -1.336 1.00 0.00 O ATOM 0 H SER A 900 -1.787 -18.405 0.230 1.00 0.00 H new ATOM 0 HA SER A 900 -2.839 -20.854 -0.078 1.00 0.00 H new ATOM 0 HB2 SER A 900 -1.904 -19.112 -2.398 1.00 0.00 H new ATOM 0 HB3 SER A 900 -3.225 -20.264 -2.423 1.00 0.00 H new ATOM 0 HG SER A 900 -3.963 -18.087 -2.108 1.00 0.00 H new ATOM 1610 N GLY A 901 0.053 -20.789 -1.698 1.00 0.00 N ATOM 1611 CA GLY A 901 1.099 -21.650 -2.219 1.00 0.00 C ATOM 1612 C GLY A 901 2.455 -20.971 -2.232 1.00 0.00 C ATOM 1613 O GLY A 901 2.694 -20.062 -3.026 1.00 0.00 O ATOM 0 H GLY A 901 0.222 -19.790 -1.815 1.00 0.00 H new ATOM 0 HA2 GLY A 901 1.155 -22.555 -1.615 1.00 0.00 H new ATOM 0 HA3 GLY A 901 0.841 -21.959 -3.232 1.00 0.00 H new TER 1617 GLY A 901