USER MOD reduce.3.24.130724 H: found=0, std=0, add=945, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 946 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 833 THR OG1 : rot 78:sc= 0.267 USER MOD Set 1.2: A 867 THR OG1 : rot 57:sc= -0.528! USER MOD Set 2.1: A 811 ASN :FLIP amide:sc= 0.5 F(o=-1.5,f=0.88) USER MOD Set 2.2: A 825 GLN :FLIP amide:sc= 0.375 F(o=-3.6!,f=0.88) USER MOD Set 3.1: A 816 MET CE :methyl 167:sc= -1.3 (180deg=-1.62!) USER MOD Set 3.2: A 887 GLN : amide:sc= 0.15 K(o=-1.1,f=-3.3) USER MOD Single : A 786 THR OG1 : rot 180:sc= 0 USER MOD Single : A 788 HIS : no HD1:sc= -0.0109 X(o=-0.011,f=-0.026) USER MOD Single : A 790 THR OG1 : rot 19:sc= 0.798 USER MOD Single : A 798 TYR OH : rot 65:sc= -1.24 USER MOD Single : A 800 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 802 THR OG1 : rot -75:sc= -0.987 USER MOD Single : A 804 THR OG1 : rot 180:sc= 0 USER MOD Single : A 807 THR OG1 : rot 81:sc= 1.24 USER MOD Single : A 809 THR OG1 : rot 56:sc= 1.26 USER MOD Single : A 814 SER OG : rot 180:sc= 0 USER MOD Single : A 815 SER OG : rot -80:sc= 0.793 USER MOD Single : A 822 MET CE :methyl 160:sc= -0.178 (180deg=-0.722) USER MOD Single : A 831 GLN : amide:sc= 0.357 X(o=0.36,f=-0.084) USER MOD Single : A 834 SER OG : rot 89:sc= 1.26 USER MOD Single : A 838 ASN : amide:sc= 1.21 K(o=1.2,f=-0.14) USER MOD Single : A 841 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 848 SER OG : rot 180:sc= 0 USER MOD Single : A 852 ASN : amide:sc= -1.46 K(o=-1.5,f=-2.2!) USER MOD Single : A 853 SER OG : rot 71:sc= 1.12 USER MOD Single : A 855 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 858 SER OG : rot 180:sc= 0 USER MOD Single : A 861 LYS NZ :NH3+ 169:sc=-0.00772 (180deg=-0.152) USER MOD Single : A 869 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 870 MET CE :methyl 169:sc= -0.236 (180deg=-0.521) USER MOD Single : A 875 LYS NZ :NH3+ -145:sc= -2! (180deg=-4.4!) USER MOD Single : A 880 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 883 SER OG : rot -147:sc= -2.82! USER MOD Single : A 886 GLN :FLIP amide:sc= -0.283 F(o=-1.4,f=-0.28) USER MOD Single : A 888 GLN : amide:sc= -0.0697 K(o=-0.07,f=-0.59) USER MOD Single : A 899 MET CE :methyl 158:sc= -0.154 (180deg=-0.842) USER MOD Single : A 901 THR OG1 : rot 83:sc= 0.758 USER MOD Single : A 902 ASN : amide:sc= -0.266 X(o=-0.27,f=-0.0058) USER MOD Single : A 906 GLN :FLIP amide:sc= -0.136 F(o=-0.86,f=-0.14) USER MOD Single : A 907 ASN : amide:sc= -0.443 K(o=-0.44,f=-2.6!) USER MOD Single : A 910 LYS NZ :NH3+ 155:sc= 1.86! (180deg=0.328) USER MOD Single : A 911 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 781 25.509 -29.444 -11.006 1.00 0.00 N ATOM 2 CA GLY A 781 25.904 -29.491 -9.578 1.00 0.00 C ATOM 3 C GLY A 781 25.626 -28.178 -8.886 1.00 0.00 C ATOM 4 O GLY A 781 24.570 -27.582 -9.078 1.00 0.00 O ATOM 0 HA2 GLY A 781 25.361 -30.291 -9.075 1.00 0.00 H new ATOM 0 HA3 GLY A 781 26.965 -29.728 -9.500 1.00 0.00 H new ATOM 10 N ILE A 782 26.580 -27.710 -8.098 1.00 0.00 N ATOM 11 CA ILE A 782 26.448 -26.430 -7.416 1.00 0.00 C ATOM 12 C ILE A 782 27.129 -25.347 -8.255 1.00 0.00 C ATOM 13 O ILE A 782 27.430 -24.250 -7.787 1.00 0.00 O ATOM 14 CB ILE A 782 27.069 -26.486 -5.998 1.00 0.00 C ATOM 15 CG1 ILE A 782 26.672 -27.791 -5.302 1.00 0.00 C ATOM 16 CG2 ILE A 782 26.617 -25.291 -5.167 1.00 0.00 C ATOM 17 CD1 ILE A 782 27.301 -27.971 -3.936 1.00 0.00 C ATOM 0 H ILE A 782 27.457 -28.198 -7.914 1.00 0.00 H new ATOM 0 HA ILE A 782 25.390 -26.196 -7.302 1.00 0.00 H new ATOM 0 HB ILE A 782 28.154 -26.450 -6.094 1.00 0.00 H new ATOM 0 HG12 ILE A 782 25.587 -27.822 -5.199 1.00 0.00 H new ATOM 0 HG13 ILE A 782 26.956 -28.631 -5.936 1.00 0.00 H new ATOM 0 HG21 ILE A 782 27.064 -25.348 -4.174 1.00 0.00 H new ATOM 0 HG22 ILE A 782 26.933 -24.369 -5.654 1.00 0.00 H new ATOM 0 HG23 ILE A 782 25.531 -25.300 -5.077 1.00 0.00 H new ATOM 0 HD11 ILE A 782 26.973 -28.917 -3.506 1.00 0.00 H new ATOM 0 HD12 ILE A 782 28.387 -27.974 -4.033 1.00 0.00 H new ATOM 0 HD13 ILE A 782 26.997 -27.152 -3.285 1.00 0.00 H new ATOM 29 N ASP A 783 27.355 -25.679 -9.515 1.00 0.00 N ATOM 30 CA ASP A 783 27.997 -24.778 -10.458 1.00 0.00 C ATOM 31 C ASP A 783 26.993 -23.756 -10.982 1.00 0.00 C ATOM 32 O ASP A 783 25.784 -23.973 -10.899 1.00 0.00 O ATOM 33 CB ASP A 783 28.599 -25.581 -11.618 1.00 0.00 C ATOM 34 CG ASP A 783 27.553 -26.273 -12.472 1.00 0.00 C ATOM 35 OD1 ASP A 783 26.891 -27.218 -11.979 1.00 0.00 O ATOM 36 OD2 ASP A 783 27.405 -25.893 -13.653 1.00 0.00 O ATOM 0 H ASP A 783 27.098 -26.582 -9.914 1.00 0.00 H new ATOM 0 HA ASP A 783 28.797 -24.242 -9.948 1.00 0.00 H new ATOM 0 HB2 ASP A 783 29.188 -24.913 -12.247 1.00 0.00 H new ATOM 0 HB3 ASP A 783 29.284 -26.328 -11.217 1.00 0.00 H new ATOM 41 N PRO A 784 27.477 -22.616 -11.500 1.00 0.00 N ATOM 42 CA PRO A 784 26.616 -21.561 -12.051 1.00 0.00 C ATOM 43 C PRO A 784 25.750 -22.053 -13.205 1.00 0.00 C ATOM 44 O PRO A 784 26.202 -22.818 -14.061 1.00 0.00 O ATOM 45 CB PRO A 784 27.607 -20.502 -12.551 1.00 0.00 C ATOM 46 CG PRO A 784 28.874 -20.775 -11.819 1.00 0.00 C ATOM 47 CD PRO A 784 28.903 -22.256 -11.575 1.00 0.00 C ATOM 0 HA PRO A 784 25.915 -21.191 -11.303 1.00 0.00 H new ATOM 0 HB2 PRO A 784 27.751 -20.576 -13.629 1.00 0.00 H new ATOM 0 HB3 PRO A 784 27.243 -19.495 -12.346 1.00 0.00 H new ATOM 0 HG2 PRO A 784 29.738 -20.459 -12.404 1.00 0.00 H new ATOM 0 HG3 PRO A 784 28.907 -20.224 -10.879 1.00 0.00 H new ATOM 0 HD2 PRO A 784 29.410 -22.786 -12.381 1.00 0.00 H new ATOM 0 HD3 PRO A 784 29.429 -22.501 -10.652 1.00 0.00 H new ATOM 55 N PHE A 785 24.507 -21.608 -13.216 1.00 0.00 N ATOM 56 CA PHE A 785 23.574 -21.927 -14.286 1.00 0.00 C ATOM 57 C PHE A 785 23.261 -20.660 -15.071 1.00 0.00 C ATOM 58 O PHE A 785 23.837 -19.603 -14.802 1.00 0.00 O ATOM 59 CB PHE A 785 22.275 -22.509 -13.715 1.00 0.00 C ATOM 60 CG PHE A 785 22.441 -23.821 -13.004 1.00 0.00 C ATOM 61 CD1 PHE A 785 22.413 -25.013 -13.709 1.00 0.00 C ATOM 62 CD2 PHE A 785 22.616 -23.864 -11.632 1.00 0.00 C ATOM 63 CE1 PHE A 785 22.558 -26.221 -13.059 1.00 0.00 C ATOM 64 CE2 PHE A 785 22.760 -25.070 -10.976 1.00 0.00 C ATOM 65 CZ PHE A 785 22.732 -26.251 -11.690 1.00 0.00 C ATOM 0 H PHE A 785 24.114 -21.015 -12.485 1.00 0.00 H new ATOM 0 HA PHE A 785 24.029 -22.670 -14.941 1.00 0.00 H new ATOM 0 HB2 PHE A 785 21.842 -21.787 -13.023 1.00 0.00 H new ATOM 0 HB3 PHE A 785 21.561 -22.639 -14.529 1.00 0.00 H new ATOM 0 HD1 PHE A 785 22.276 -24.996 -14.780 1.00 0.00 H new ATOM 0 HD2 PHE A 785 22.640 -22.943 -11.068 1.00 0.00 H new ATOM 0 HE1 PHE A 785 22.535 -27.143 -13.621 1.00 0.00 H new ATOM 0 HE2 PHE A 785 22.895 -25.090 -9.905 1.00 0.00 H new ATOM 0 HZ PHE A 785 22.846 -27.196 -11.179 1.00 0.00 H new ATOM 75 N THR A 786 22.361 -20.759 -16.040 1.00 0.00 N ATOM 76 CA THR A 786 21.869 -19.576 -16.725 1.00 0.00 C ATOM 77 C THR A 786 21.091 -18.720 -15.733 1.00 0.00 C ATOM 78 O THR A 786 21.171 -17.493 -15.749 1.00 0.00 O ATOM 79 CB THR A 786 20.971 -19.946 -17.924 1.00 0.00 C ATOM 80 OG1 THR A 786 21.614 -20.949 -18.724 1.00 0.00 O ATOM 81 CG2 THR A 786 20.684 -18.726 -18.788 1.00 0.00 C ATOM 0 H THR A 786 21.961 -21.639 -16.366 1.00 0.00 H new ATOM 0 HA THR A 786 22.721 -19.020 -17.115 1.00 0.00 H new ATOM 0 HB THR A 786 20.028 -20.330 -17.534 1.00 0.00 H new ATOM 0 HG1 THR A 786 21.038 -21.181 -19.483 1.00 0.00 H new ATOM 0 HG21 THR A 786 20.049 -19.015 -19.626 1.00 0.00 H new ATOM 0 HG22 THR A 786 20.175 -17.969 -18.191 1.00 0.00 H new ATOM 0 HG23 THR A 786 21.622 -18.319 -19.167 1.00 0.00 H new ATOM 89 N ALA A 787 20.365 -19.413 -14.862 1.00 0.00 N ATOM 90 CA ALA A 787 19.645 -18.811 -13.741 1.00 0.00 C ATOM 91 C ALA A 787 18.634 -17.763 -14.199 1.00 0.00 C ATOM 92 O ALA A 787 18.970 -16.591 -14.384 1.00 0.00 O ATOM 93 CB ALA A 787 20.621 -18.218 -12.731 1.00 0.00 C ATOM 0 H ALA A 787 20.257 -20.426 -14.914 1.00 0.00 H new ATOM 0 HA ALA A 787 19.081 -19.607 -13.256 1.00 0.00 H new ATOM 0 HB1 ALA A 787 20.065 -17.775 -11.905 1.00 0.00 H new ATOM 0 HB2 ALA A 787 21.273 -19.004 -12.350 1.00 0.00 H new ATOM 0 HB3 ALA A 787 21.224 -17.450 -13.215 1.00 0.00 H new ATOM 99 N HIS A 788 17.393 -18.189 -14.385 1.00 0.00 N ATOM 100 CA HIS A 788 16.326 -17.271 -14.774 1.00 0.00 C ATOM 101 C HIS A 788 15.425 -16.987 -13.582 1.00 0.00 C ATOM 102 O HIS A 788 14.506 -16.173 -13.656 1.00 0.00 O ATOM 103 CB HIS A 788 15.505 -17.815 -15.957 1.00 0.00 C ATOM 104 CG HIS A 788 14.891 -19.164 -15.731 1.00 0.00 C ATOM 105 ND1 HIS A 788 13.643 -19.342 -15.180 1.00 0.00 N ATOM 106 CD2 HIS A 788 15.358 -20.402 -16.008 1.00 0.00 C ATOM 107 CE1 HIS A 788 13.370 -20.632 -15.127 1.00 0.00 C ATOM 108 NE2 HIS A 788 14.393 -21.298 -15.623 1.00 0.00 N ATOM 0 H HIS A 788 17.098 -19.159 -14.274 1.00 0.00 H new ATOM 0 HA HIS A 788 16.788 -16.340 -15.103 1.00 0.00 H new ATOM 0 HB2 HIS A 788 14.711 -17.104 -16.187 1.00 0.00 H new ATOM 0 HB3 HIS A 788 16.150 -17.868 -16.834 1.00 0.00 H new ATOM 0 HD2 HIS A 788 16.314 -20.641 -16.450 1.00 0.00 H new ATOM 0 HE1 HIS A 788 12.460 -21.069 -14.742 1.00 0.00 H new ATOM 0 HE2 HIS A 788 14.457 -22.313 -15.707 1.00 0.00 H new ATOM 116 N ALA A 789 15.700 -17.670 -12.480 1.00 0.00 N ATOM 117 CA ALA A 789 14.982 -17.432 -11.241 1.00 0.00 C ATOM 118 C ALA A 789 15.486 -16.157 -10.585 1.00 0.00 C ATOM 119 O ALA A 789 16.675 -15.841 -10.670 1.00 0.00 O ATOM 120 CB ALA A 789 15.137 -18.616 -10.301 1.00 0.00 C ATOM 0 H ALA A 789 16.416 -18.394 -12.421 1.00 0.00 H new ATOM 0 HA ALA A 789 13.922 -17.313 -11.466 1.00 0.00 H new ATOM 0 HB1 ALA A 789 14.593 -18.421 -9.377 1.00 0.00 H new ATOM 0 HB2 ALA A 789 14.737 -19.512 -10.776 1.00 0.00 H new ATOM 0 HB3 ALA A 789 16.193 -18.766 -10.075 1.00 0.00 H new ATOM 126 N THR A 790 14.579 -15.430 -9.938 1.00 0.00 N ATOM 127 CA THR A 790 14.882 -14.145 -9.304 1.00 0.00 C ATOM 128 C THR A 790 15.648 -13.216 -10.247 1.00 0.00 C ATOM 129 O THR A 790 16.600 -12.547 -9.844 1.00 0.00 O ATOM 130 CB THR A 790 15.666 -14.316 -7.981 1.00 0.00 C ATOM 131 OG1 THR A 790 16.847 -15.105 -8.177 1.00 0.00 O ATOM 132 CG2 THR A 790 14.794 -14.968 -6.918 1.00 0.00 C ATOM 0 H THR A 790 13.605 -15.716 -9.837 1.00 0.00 H new ATOM 0 HA THR A 790 13.920 -13.688 -9.070 1.00 0.00 H new ATOM 0 HB THR A 790 15.959 -13.321 -7.645 1.00 0.00 H new ATOM 0 HG1 THR A 790 17.072 -15.126 -9.131 1.00 0.00 H new ATOM 0 HG21 THR A 790 15.365 -15.079 -5.996 1.00 0.00 H new ATOM 0 HG22 THR A 790 13.920 -14.344 -6.731 1.00 0.00 H new ATOM 0 HG23 THR A 790 14.471 -15.950 -7.264 1.00 0.00 H new ATOM 140 N GLY A 791 15.220 -13.178 -11.502 1.00 0.00 N ATOM 141 CA GLY A 791 15.866 -12.333 -12.485 1.00 0.00 C ATOM 142 C GLY A 791 14.906 -11.897 -13.570 1.00 0.00 C ATOM 143 O GLY A 791 15.283 -11.777 -14.738 1.00 0.00 O ATOM 0 H GLY A 791 14.433 -13.721 -11.857 1.00 0.00 H new ATOM 0 HA2 GLY A 791 16.281 -11.454 -11.992 1.00 0.00 H new ATOM 0 HA3 GLY A 791 16.701 -12.871 -12.934 1.00 0.00 H new ATOM 147 N ALA A 792 13.661 -11.662 -13.181 1.00 0.00 N ATOM 148 CA ALA A 792 12.628 -11.267 -14.128 1.00 0.00 C ATOM 149 C ALA A 792 12.062 -9.895 -13.777 1.00 0.00 C ATOM 150 O ALA A 792 11.330 -9.292 -14.566 1.00 0.00 O ATOM 151 CB ALA A 792 11.519 -12.307 -14.157 1.00 0.00 C ATOM 0 H ALA A 792 13.341 -11.738 -12.215 1.00 0.00 H new ATOM 0 HA ALA A 792 13.078 -11.203 -15.119 1.00 0.00 H new ATOM 0 HB1 ALA A 792 10.752 -12.001 -14.869 1.00 0.00 H new ATOM 0 HB2 ALA A 792 11.931 -13.270 -14.459 1.00 0.00 H new ATOM 0 HB3 ALA A 792 11.078 -12.396 -13.164 1.00 0.00 H new ATOM 157 N GLY A 793 12.402 -9.412 -12.592 1.00 0.00 N ATOM 158 CA GLY A 793 11.944 -8.109 -12.157 1.00 0.00 C ATOM 159 C GLY A 793 12.795 -7.567 -11.027 1.00 0.00 C ATOM 160 O GLY A 793 13.226 -8.324 -10.159 1.00 0.00 O ATOM 0 H GLY A 793 12.991 -9.903 -11.919 1.00 0.00 H new ATOM 0 HA2 GLY A 793 11.969 -7.415 -12.997 1.00 0.00 H new ATOM 0 HA3 GLY A 793 10.906 -8.178 -11.831 1.00 0.00 H new ATOM 164 N PRO A 794 13.075 -6.257 -11.020 1.00 0.00 N ATOM 165 CA PRO A 794 13.879 -5.625 -9.980 1.00 0.00 C ATOM 166 C PRO A 794 13.075 -5.356 -8.709 1.00 0.00 C ATOM 167 O PRO A 794 12.164 -4.526 -8.700 1.00 0.00 O ATOM 168 CB PRO A 794 14.332 -4.300 -10.618 1.00 0.00 C ATOM 169 CG PRO A 794 13.779 -4.295 -12.011 1.00 0.00 C ATOM 170 CD PRO A 794 12.652 -5.286 -12.026 1.00 0.00 C ATOM 0 HA PRO A 794 14.706 -6.263 -9.668 1.00 0.00 H new ATOM 0 HB2 PRO A 794 13.961 -3.447 -10.049 1.00 0.00 H new ATOM 0 HB3 PRO A 794 15.419 -4.226 -10.631 1.00 0.00 H new ATOM 0 HG2 PRO A 794 13.425 -3.301 -12.284 1.00 0.00 H new ATOM 0 HG3 PRO A 794 14.547 -4.570 -12.734 1.00 0.00 H new ATOM 0 HD2 PRO A 794 11.700 -4.822 -11.768 1.00 0.00 H new ATOM 0 HD3 PRO A 794 12.528 -5.745 -13.007 1.00 0.00 H new ATOM 178 N ALA A 795 13.398 -6.079 -7.647 1.00 0.00 N ATOM 179 CA ALA A 795 12.775 -5.859 -6.351 1.00 0.00 C ATOM 180 C ALA A 795 13.768 -5.200 -5.402 1.00 0.00 C ATOM 181 O ALA A 795 14.820 -5.769 -5.099 1.00 0.00 O ATOM 182 CB ALA A 795 12.266 -7.170 -5.771 1.00 0.00 C ATOM 0 H ALA A 795 14.092 -6.827 -7.658 1.00 0.00 H new ATOM 0 HA ALA A 795 11.921 -5.194 -6.481 1.00 0.00 H new ATOM 0 HB1 ALA A 795 11.804 -6.984 -4.802 1.00 0.00 H new ATOM 0 HB2 ALA A 795 11.530 -7.605 -6.447 1.00 0.00 H new ATOM 0 HB3 ALA A 795 13.100 -7.862 -5.648 1.00 0.00 H new ATOM 188 N GLY A 796 13.441 -4.002 -4.945 1.00 0.00 N ATOM 189 CA GLY A 796 14.358 -3.257 -4.117 1.00 0.00 C ATOM 190 C GLY A 796 13.910 -3.142 -2.677 1.00 0.00 C ATOM 191 O GLY A 796 13.639 -4.147 -2.019 1.00 0.00 O ATOM 0 H GLY A 796 12.555 -3.533 -5.134 1.00 0.00 H new ATOM 0 HA2 GLY A 796 15.336 -3.737 -4.148 1.00 0.00 H new ATOM 0 HA3 GLY A 796 14.481 -2.257 -4.533 1.00 0.00 H new ATOM 195 N ARG A 797 13.805 -1.908 -2.202 1.00 0.00 N ATOM 196 CA ARG A 797 13.627 -1.645 -0.780 1.00 0.00 C ATOM 197 C ARG A 797 12.162 -1.701 -0.348 1.00 0.00 C ATOM 198 O ARG A 797 11.835 -2.340 0.650 1.00 0.00 O ATOM 199 CB ARG A 797 14.248 -0.292 -0.433 1.00 0.00 C ATOM 200 CG ARG A 797 14.278 0.017 1.054 1.00 0.00 C ATOM 201 CD ARG A 797 15.434 0.942 1.404 1.00 0.00 C ATOM 202 NE ARG A 797 15.380 2.217 0.685 1.00 0.00 N ATOM 203 CZ ARG A 797 16.150 2.527 -0.359 1.00 0.00 C ATOM 204 NH1 ARG A 797 16.988 1.630 -0.867 1.00 0.00 N ATOM 205 NH2 ARG A 797 16.076 3.740 -0.887 1.00 0.00 N ATOM 0 H ARG A 797 13.840 -1.070 -2.783 1.00 0.00 H new ATOM 0 HA ARG A 797 14.136 -2.435 -0.228 1.00 0.00 H new ATOM 0 HB2 ARG A 797 15.267 -0.263 -0.819 1.00 0.00 H new ATOM 0 HB3 ARG A 797 13.691 0.493 -0.944 1.00 0.00 H new ATOM 0 HG2 ARG A 797 13.337 0.480 1.350 1.00 0.00 H new ATOM 0 HG3 ARG A 797 14.368 -0.911 1.619 1.00 0.00 H new ATOM 0 HD2 ARG A 797 15.427 1.135 2.477 1.00 0.00 H new ATOM 0 HD3 ARG A 797 16.375 0.442 1.176 1.00 0.00 H new ATOM 0 HE ARG A 797 14.708 2.915 1.004 1.00 0.00 H new ATOM 0 HH11 ARG A 797 17.046 0.697 -0.459 1.00 0.00 H new ATOM 0 HH12 ARG A 797 17.574 1.874 -1.666 1.00 0.00 H new ATOM 0 HH21 ARG A 797 15.434 4.429 -0.495 1.00 0.00 H new ATOM 0 HH22 ARG A 797 16.661 3.985 -1.685 1.00 0.00 H new ATOM 219 N TYR A 798 11.273 -1.042 -1.084 1.00 0.00 N ATOM 220 CA TYR A 798 9.862 -1.018 -0.696 1.00 0.00 C ATOM 221 C TYR A 798 9.093 -2.120 -1.412 1.00 0.00 C ATOM 222 O TYR A 798 7.942 -2.393 -1.083 1.00 0.00 O ATOM 223 CB TYR A 798 9.199 0.328 -1.022 1.00 0.00 C ATOM 224 CG TYR A 798 9.836 1.550 -0.388 1.00 0.00 C ATOM 225 CD1 TYR A 798 10.760 1.448 0.647 1.00 0.00 C ATOM 226 CD2 TYR A 798 9.514 2.820 -0.849 1.00 0.00 C ATOM 227 CE1 TYR A 798 11.336 2.577 1.203 1.00 0.00 C ATOM 228 CE2 TYR A 798 10.086 3.949 -0.302 1.00 0.00 C ATOM 229 CZ TYR A 798 10.995 3.823 0.720 1.00 0.00 C ATOM 230 OH TYR A 798 11.567 4.949 1.259 1.00 0.00 O ATOM 0 H TYR A 798 11.495 -0.526 -1.936 1.00 0.00 H new ATOM 0 HA TYR A 798 9.831 -1.173 0.382 1.00 0.00 H new ATOM 0 HB2 TYR A 798 9.202 0.460 -2.104 1.00 0.00 H new ATOM 0 HB3 TYR A 798 8.156 0.282 -0.710 1.00 0.00 H new ATOM 0 HD1 TYR A 798 11.032 0.473 1.022 1.00 0.00 H new ATOM 0 HD2 TYR A 798 8.801 2.925 -1.653 1.00 0.00 H new ATOM 0 HE1 TYR A 798 12.048 2.483 2.010 1.00 0.00 H new ATOM 0 HE2 TYR A 798 9.821 4.927 -0.675 1.00 0.00 H new ATOM 0 HH TYR A 798 12.530 4.946 1.077 1.00 0.00 H new ATOM 240 N ASP A 799 9.756 -2.774 -2.360 1.00 0.00 N ATOM 241 CA ASP A 799 9.089 -3.703 -3.271 1.00 0.00 C ATOM 242 C ASP A 799 8.574 -4.940 -2.549 1.00 0.00 C ATOM 243 O ASP A 799 7.577 -5.532 -2.959 1.00 0.00 O ATOM 244 CB ASP A 799 10.039 -4.127 -4.391 1.00 0.00 C ATOM 245 CG ASP A 799 10.431 -2.978 -5.298 1.00 0.00 C ATOM 246 OD1 ASP A 799 11.352 -2.222 -4.946 1.00 0.00 O ATOM 247 OD2 ASP A 799 9.799 -2.814 -6.366 1.00 0.00 O ATOM 0 H ASP A 799 10.759 -2.678 -2.519 1.00 0.00 H new ATOM 0 HA ASP A 799 8.233 -3.177 -3.693 1.00 0.00 H new ATOM 0 HB2 ASP A 799 10.938 -4.561 -3.953 1.00 0.00 H new ATOM 0 HB3 ASP A 799 9.566 -4.908 -4.986 1.00 0.00 H new ATOM 252 N GLN A 800 9.250 -5.333 -1.482 1.00 0.00 N ATOM 253 CA GLN A 800 8.820 -6.487 -0.702 1.00 0.00 C ATOM 254 C GLN A 800 7.567 -6.153 0.104 1.00 0.00 C ATOM 255 O GLN A 800 6.708 -7.008 0.327 1.00 0.00 O ATOM 256 CB GLN A 800 9.940 -6.954 0.226 1.00 0.00 C ATOM 257 CG GLN A 800 9.633 -8.256 0.946 1.00 0.00 C ATOM 258 CD GLN A 800 10.807 -8.766 1.758 1.00 0.00 C ATOM 259 OE1 GLN A 800 11.616 -7.986 2.261 1.00 0.00 O ATOM 260 NE2 GLN A 800 10.911 -10.078 1.879 1.00 0.00 N ATOM 0 H GLN A 800 10.093 -4.875 -1.136 1.00 0.00 H new ATOM 0 HA GLN A 800 8.582 -7.297 -1.392 1.00 0.00 H new ATOM 0 HB2 GLN A 800 10.854 -7.077 -0.355 1.00 0.00 H new ATOM 0 HB3 GLN A 800 10.135 -6.177 0.965 1.00 0.00 H new ATOM 0 HG2 GLN A 800 8.777 -8.109 1.605 1.00 0.00 H new ATOM 0 HG3 GLN A 800 9.346 -9.012 0.215 1.00 0.00 H new ATOM 0 HE21 GLN A 800 10.217 -10.687 1.445 1.00 0.00 H new ATOM 0 HE22 GLN A 800 11.685 -10.482 2.406 1.00 0.00 H new ATOM 269 N ALA A 801 7.465 -4.901 0.529 1.00 0.00 N ATOM 270 CA ALA A 801 6.326 -4.449 1.313 1.00 0.00 C ATOM 271 C ALA A 801 5.134 -4.147 0.412 1.00 0.00 C ATOM 272 O ALA A 801 3.999 -4.518 0.719 1.00 0.00 O ATOM 273 CB ALA A 801 6.704 -3.229 2.135 1.00 0.00 C ATOM 0 H ALA A 801 8.161 -4.179 0.343 1.00 0.00 H new ATOM 0 HA ALA A 801 6.037 -5.249 1.995 1.00 0.00 H new ATOM 0 HB1 ALA A 801 5.843 -2.901 2.717 1.00 0.00 H new ATOM 0 HB2 ALA A 801 7.522 -3.484 2.809 1.00 0.00 H new ATOM 0 HB3 ALA A 801 7.019 -2.425 1.470 1.00 0.00 H new ATOM 279 N THR A 802 5.398 -3.486 -0.712 1.00 0.00 N ATOM 280 CA THR A 802 4.356 -3.176 -1.678 1.00 0.00 C ATOM 281 C THR A 802 3.785 -4.450 -2.274 1.00 0.00 C ATOM 282 O THR A 802 2.598 -4.521 -2.576 1.00 0.00 O ATOM 283 CB THR A 802 4.880 -2.277 -2.810 1.00 0.00 C ATOM 284 OG1 THR A 802 6.142 -2.765 -3.274 1.00 0.00 O ATOM 285 CG2 THR A 802 5.016 -0.839 -2.343 1.00 0.00 C ATOM 0 H THR A 802 6.327 -3.156 -0.974 1.00 0.00 H new ATOM 0 HA THR A 802 3.573 -2.638 -1.144 1.00 0.00 H new ATOM 0 HB THR A 802 4.161 -2.301 -3.629 1.00 0.00 H new ATOM 0 HG1 THR A 802 6.840 -2.536 -2.625 1.00 0.00 H new ATOM 0 HG21 THR A 802 5.388 -0.224 -3.162 1.00 0.00 H new ATOM 0 HG22 THR A 802 4.043 -0.467 -2.023 1.00 0.00 H new ATOM 0 HG23 THR A 802 5.715 -0.792 -1.508 1.00 0.00 H new ATOM 293 N ASP A 803 4.647 -5.451 -2.433 1.00 0.00 N ATOM 294 CA ASP A 803 4.231 -6.770 -2.900 1.00 0.00 C ATOM 295 C ASP A 803 3.082 -7.296 -2.052 1.00 0.00 C ATOM 296 O ASP A 803 2.095 -7.814 -2.572 1.00 0.00 O ATOM 297 CB ASP A 803 5.409 -7.745 -2.839 1.00 0.00 C ATOM 298 CG ASP A 803 5.008 -9.172 -3.148 1.00 0.00 C ATOM 299 OD1 ASP A 803 4.853 -9.504 -4.341 1.00 0.00 O ATOM 300 OD2 ASP A 803 4.852 -9.969 -2.201 1.00 0.00 O ATOM 0 H ASP A 803 5.646 -5.372 -2.243 1.00 0.00 H new ATOM 0 HA ASP A 803 3.894 -6.681 -3.933 1.00 0.00 H new ATOM 0 HB2 ASP A 803 6.175 -7.427 -3.546 1.00 0.00 H new ATOM 0 HB3 ASP A 803 5.856 -7.705 -1.846 1.00 0.00 H new ATOM 305 N THR A 804 3.213 -7.134 -0.744 1.00 0.00 N ATOM 306 CA THR A 804 2.180 -7.553 0.185 1.00 0.00 C ATOM 307 C THR A 804 0.892 -6.763 -0.047 1.00 0.00 C ATOM 308 O THR A 804 -0.163 -7.345 -0.287 1.00 0.00 O ATOM 309 CB THR A 804 2.657 -7.375 1.639 1.00 0.00 C ATOM 310 OG1 THR A 804 3.893 -8.078 1.826 1.00 0.00 O ATOM 311 CG2 THR A 804 1.619 -7.889 2.628 1.00 0.00 C ATOM 0 H THR A 804 4.030 -6.713 -0.302 1.00 0.00 H new ATOM 0 HA THR A 804 1.975 -8.609 0.011 1.00 0.00 H new ATOM 0 HB THR A 804 2.803 -6.311 1.824 1.00 0.00 H new ATOM 0 HG1 THR A 804 4.198 -7.964 2.750 1.00 0.00 H new ATOM 0 HG21 THR A 804 1.985 -7.749 3.645 1.00 0.00 H new ATOM 0 HG22 THR A 804 0.688 -7.337 2.498 1.00 0.00 H new ATOM 0 HG23 THR A 804 1.440 -8.949 2.449 1.00 0.00 H new ATOM 319 N ILE A 805 0.994 -5.439 -0.012 1.00 0.00 N ATOM 320 CA ILE A 805 -0.168 -4.572 -0.192 1.00 0.00 C ATOM 321 C ILE A 805 -0.847 -4.829 -1.540 1.00 0.00 C ATOM 322 O ILE A 805 -2.059 -5.028 -1.606 1.00 0.00 O ATOM 323 CB ILE A 805 0.222 -3.082 -0.087 1.00 0.00 C ATOM 324 CG1 ILE A 805 0.769 -2.771 1.311 1.00 0.00 C ATOM 325 CG2 ILE A 805 -0.970 -2.191 -0.411 1.00 0.00 C ATOM 326 CD1 ILE A 805 1.224 -1.338 1.480 1.00 0.00 C ATOM 0 H ILE A 805 1.871 -4.940 0.140 1.00 0.00 H new ATOM 0 HA ILE A 805 -0.870 -4.809 0.608 1.00 0.00 H new ATOM 0 HB ILE A 805 1.006 -2.877 -0.816 1.00 0.00 H new ATOM 0 HG12 ILE A 805 -0.002 -2.988 2.050 1.00 0.00 H new ATOM 0 HG13 ILE A 805 1.607 -3.436 1.520 1.00 0.00 H new ATOM 0 HG21 ILE A 805 -0.675 -1.145 -0.331 1.00 0.00 H new ATOM 0 HG22 ILE A 805 -1.312 -2.395 -1.426 1.00 0.00 H new ATOM 0 HG23 ILE A 805 -1.778 -2.394 0.292 1.00 0.00 H new ATOM 0 HD11 ILE A 805 1.598 -1.192 2.493 1.00 0.00 H new ATOM 0 HD12 ILE A 805 2.018 -1.122 0.765 1.00 0.00 H new ATOM 0 HD13 ILE A 805 0.384 -0.666 1.303 1.00 0.00 H new ATOM 338 N LEU A 806 -0.052 -4.851 -2.603 1.00 0.00 N ATOM 339 CA LEU A 806 -0.562 -5.072 -3.955 1.00 0.00 C ATOM 340 C LEU A 806 -1.315 -6.398 -4.055 1.00 0.00 C ATOM 341 O LEU A 806 -2.408 -6.456 -4.619 1.00 0.00 O ATOM 342 CB LEU A 806 0.592 -5.040 -4.963 1.00 0.00 C ATOM 343 CG LEU A 806 0.732 -3.744 -5.773 1.00 0.00 C ATOM 344 CD1 LEU A 806 0.551 -2.519 -4.892 1.00 0.00 C ATOM 345 CD2 LEU A 806 2.086 -3.700 -6.462 1.00 0.00 C ATOM 0 H LEU A 806 0.958 -4.717 -2.556 1.00 0.00 H new ATOM 0 HA LEU A 806 -1.264 -4.271 -4.187 1.00 0.00 H new ATOM 0 HB2 LEU A 806 1.524 -5.214 -4.426 1.00 0.00 H new ATOM 0 HB3 LEU A 806 0.466 -5.870 -5.659 1.00 0.00 H new ATOM 0 HG LEU A 806 -0.054 -3.733 -6.528 1.00 0.00 H new ATOM 0 HD11 LEU A 806 0.656 -1.618 -5.496 1.00 0.00 H new ATOM 0 HD12 LEU A 806 -0.441 -2.539 -4.440 1.00 0.00 H new ATOM 0 HD13 LEU A 806 1.308 -2.520 -4.107 1.00 0.00 H new ATOM 0 HD21 LEU A 806 2.174 -2.776 -7.034 1.00 0.00 H new ATOM 0 HD22 LEU A 806 2.877 -3.740 -5.713 1.00 0.00 H new ATOM 0 HD23 LEU A 806 2.180 -4.553 -7.134 1.00 0.00 H new ATOM 357 N THR A 807 -0.740 -7.450 -3.481 1.00 0.00 N ATOM 358 CA THR A 807 -1.355 -8.771 -3.521 1.00 0.00 C ATOM 359 C THR A 807 -2.614 -8.822 -2.651 1.00 0.00 C ATOM 360 O THR A 807 -3.640 -9.361 -3.064 1.00 0.00 O ATOM 361 CB THR A 807 -0.364 -9.863 -3.065 1.00 0.00 C ATOM 362 OG1 THR A 807 0.848 -9.775 -3.831 1.00 0.00 O ATOM 363 CG2 THR A 807 -0.963 -11.252 -3.231 1.00 0.00 C ATOM 0 H THR A 807 0.150 -7.413 -2.983 1.00 0.00 H new ATOM 0 HA THR A 807 -1.636 -8.963 -4.556 1.00 0.00 H new ATOM 0 HB THR A 807 -0.148 -9.701 -2.009 1.00 0.00 H new ATOM 0 HG1 THR A 807 1.417 -9.067 -3.463 1.00 0.00 H new ATOM 0 HG21 THR A 807 -0.242 -12.001 -2.902 1.00 0.00 H new ATOM 0 HG22 THR A 807 -1.869 -11.332 -2.630 1.00 0.00 H new ATOM 0 HG23 THR A 807 -1.207 -11.420 -4.280 1.00 0.00 H new ATOM 371 N VAL A 808 -2.540 -8.245 -1.454 1.00 0.00 N ATOM 372 CA VAL A 808 -3.684 -8.232 -0.546 1.00 0.00 C ATOM 373 C VAL A 808 -4.821 -7.386 -1.116 1.00 0.00 C ATOM 374 O VAL A 808 -5.991 -7.675 -0.883 1.00 0.00 O ATOM 375 CB VAL A 808 -3.297 -7.723 0.864 1.00 0.00 C ATOM 376 CG1 VAL A 808 -4.522 -7.615 1.763 1.00 0.00 C ATOM 377 CG2 VAL A 808 -2.265 -8.647 1.497 1.00 0.00 C ATOM 0 H VAL A 808 -1.706 -7.783 -1.092 1.00 0.00 H new ATOM 0 HA VAL A 808 -4.025 -9.263 -0.447 1.00 0.00 H new ATOM 0 HB VAL A 808 -2.864 -6.729 0.755 1.00 0.00 H new ATOM 0 HG11 VAL A 808 -4.221 -7.255 2.747 1.00 0.00 H new ATOM 0 HG12 VAL A 808 -5.235 -6.917 1.324 1.00 0.00 H new ATOM 0 HG13 VAL A 808 -4.988 -8.595 1.862 1.00 0.00 H new ATOM 0 HG21 VAL A 808 -2.003 -8.276 2.488 1.00 0.00 H new ATOM 0 HG22 VAL A 808 -2.680 -9.651 1.584 1.00 0.00 H new ATOM 0 HG23 VAL A 808 -1.372 -8.677 0.873 1.00 0.00 H new ATOM 387 N THR A 809 -4.479 -6.355 -1.879 1.00 0.00 N ATOM 388 CA THR A 809 -5.482 -5.531 -2.543 1.00 0.00 C ATOM 389 C THR A 809 -6.368 -6.383 -3.453 1.00 0.00 C ATOM 390 O THR A 809 -7.594 -6.231 -3.465 1.00 0.00 O ATOM 391 CB THR A 809 -4.834 -4.412 -3.373 1.00 0.00 C ATOM 392 OG1 THR A 809 -4.086 -3.534 -2.522 1.00 0.00 O ATOM 393 CG2 THR A 809 -5.897 -3.628 -4.121 1.00 0.00 C ATOM 0 H THR A 809 -3.515 -6.070 -2.053 1.00 0.00 H new ATOM 0 HA THR A 809 -6.092 -5.078 -1.761 1.00 0.00 H new ATOM 0 HB THR A 809 -4.156 -4.865 -4.097 1.00 0.00 H new ATOM 0 HG1 THR A 809 -3.431 -4.054 -2.011 1.00 0.00 H new ATOM 0 HG21 THR A 809 -5.424 -2.839 -4.705 1.00 0.00 H new ATOM 0 HG22 THR A 809 -6.440 -4.297 -4.789 1.00 0.00 H new ATOM 0 HG23 THR A 809 -6.592 -3.185 -3.408 1.00 0.00 H new ATOM 401 N GLU A 810 -5.740 -7.296 -4.188 1.00 0.00 N ATOM 402 CA GLU A 810 -6.462 -8.226 -5.052 1.00 0.00 C ATOM 403 C GLU A 810 -7.488 -9.014 -4.237 1.00 0.00 C ATOM 404 O GLU A 810 -8.554 -9.383 -4.733 1.00 0.00 O ATOM 405 CB GLU A 810 -5.486 -9.212 -5.698 1.00 0.00 C ATOM 406 CG GLU A 810 -4.342 -8.571 -6.471 1.00 0.00 C ATOM 407 CD GLU A 810 -4.774 -7.922 -7.770 1.00 0.00 C ATOM 408 OE1 GLU A 810 -5.632 -8.496 -8.479 1.00 0.00 O ATOM 409 OE2 GLU A 810 -4.228 -6.854 -8.111 1.00 0.00 O ATOM 0 H GLU A 810 -4.727 -7.412 -4.203 1.00 0.00 H new ATOM 0 HA GLU A 810 -6.970 -7.650 -5.826 1.00 0.00 H new ATOM 0 HB2 GLU A 810 -5.067 -9.848 -4.919 1.00 0.00 H new ATOM 0 HB3 GLU A 810 -6.043 -9.861 -6.374 1.00 0.00 H new ATOM 0 HG2 GLU A 810 -3.865 -7.820 -5.841 1.00 0.00 H new ATOM 0 HG3 GLU A 810 -3.590 -9.330 -6.687 1.00 0.00 H new ATOM 416 N ASN A 811 -7.162 -9.234 -2.966 1.00 0.00 N ATOM 417 CA ASN A 811 -7.960 -10.086 -2.096 1.00 0.00 C ATOM 418 C ASN A 811 -9.329 -9.489 -1.808 1.00 0.00 C ATOM 419 O ASN A 811 -10.295 -10.225 -1.642 1.00 0.00 O ATOM 420 CB ASN A 811 -7.242 -10.360 -0.770 1.00 0.00 C ATOM 421 CG ASN A 811 -6.116 -11.377 -0.877 1.00 0.00 C ATOM 422 OD1 ASN A 811 -5.479 -11.461 -2.032 1.00 0.00 O flip ATOM 423 ND2 ASN A 811 -5.822 -12.082 0.086 1.00 0.00 N flip ATOM 0 H ASN A 811 -6.342 -8.829 -2.515 1.00 0.00 H new ATOM 0 HA ASN A 811 -8.097 -11.025 -2.633 1.00 0.00 H new ATOM 0 HB2 ASN A 811 -6.837 -9.423 -0.387 1.00 0.00 H new ATOM 0 HB3 ASN A 811 -7.970 -10.714 -0.040 1.00 0.00 H new ATOM 0 HD21 ASN A 811 -6.336 -11.989 0.962 1.00 0.00 H new ATOM 0 HD22 ASN A 811 -5.064 -12.760 0.009 1.00 0.00 H new ATOM 430 N ILE A 812 -9.422 -8.166 -1.749 1.00 0.00 N ATOM 431 CA ILE A 812 -10.704 -7.519 -1.464 1.00 0.00 C ATOM 432 C ILE A 812 -11.700 -7.803 -2.587 1.00 0.00 C ATOM 433 O ILE A 812 -12.889 -8.007 -2.347 1.00 0.00 O ATOM 434 CB ILE A 812 -10.567 -5.987 -1.254 1.00 0.00 C ATOM 435 CG1 ILE A 812 -9.766 -5.678 0.012 1.00 0.00 C ATOM 436 CG2 ILE A 812 -11.936 -5.327 -1.175 1.00 0.00 C ATOM 437 CD1 ILE A 812 -8.269 -5.717 -0.185 1.00 0.00 C ATOM 0 H ILE A 812 -8.641 -7.526 -1.892 1.00 0.00 H new ATOM 0 HA ILE A 812 -11.071 -7.942 -0.529 1.00 0.00 H new ATOM 0 HB ILE A 812 -10.032 -5.582 -2.113 1.00 0.00 H new ATOM 0 HG12 ILE A 812 -10.049 -4.691 0.377 1.00 0.00 H new ATOM 0 HG13 ILE A 812 -10.039 -6.394 0.787 1.00 0.00 H new ATOM 0 HG21 ILE A 812 -11.815 -4.254 -1.028 1.00 0.00 H new ATOM 0 HG22 ILE A 812 -12.481 -5.507 -2.102 1.00 0.00 H new ATOM 0 HG23 ILE A 812 -12.495 -5.747 -0.339 1.00 0.00 H new ATOM 0 HD11 ILE A 812 -7.772 -5.487 0.757 1.00 0.00 H new ATOM 0 HD12 ILE A 812 -7.972 -6.711 -0.519 1.00 0.00 H new ATOM 0 HD13 ILE A 812 -7.981 -4.981 -0.936 1.00 0.00 H new ATOM 449 N PHE A 813 -11.198 -7.849 -3.811 1.00 0.00 N ATOM 450 CA PHE A 813 -12.032 -8.151 -4.962 1.00 0.00 C ATOM 451 C PHE A 813 -12.336 -9.645 -5.028 1.00 0.00 C ATOM 452 O PHE A 813 -13.362 -10.060 -5.569 1.00 0.00 O ATOM 453 CB PHE A 813 -11.365 -7.667 -6.248 1.00 0.00 C ATOM 454 CG PHE A 813 -11.290 -6.168 -6.335 1.00 0.00 C ATOM 455 CD1 PHE A 813 -12.322 -5.437 -6.902 1.00 0.00 C ATOM 456 CD2 PHE A 813 -10.177 -5.492 -5.859 1.00 0.00 C ATOM 457 CE1 PHE A 813 -12.245 -4.060 -6.993 1.00 0.00 C ATOM 458 CE2 PHE A 813 -10.096 -4.116 -5.945 1.00 0.00 C ATOM 459 CZ PHE A 813 -11.173 -3.395 -6.477 1.00 0.00 C ATOM 0 H PHE A 813 -10.217 -7.681 -4.032 1.00 0.00 H new ATOM 0 HA PHE A 813 -12.978 -7.621 -4.853 1.00 0.00 H new ATOM 0 HB2 PHE A 813 -10.358 -8.081 -6.308 1.00 0.00 H new ATOM 0 HB3 PHE A 813 -11.919 -8.049 -7.106 1.00 0.00 H new ATOM 0 HD1 PHE A 813 -13.196 -5.949 -7.277 1.00 0.00 H new ATOM 0 HD2 PHE A 813 -9.364 -6.048 -5.416 1.00 0.00 H new ATOM 0 HE1 PHE A 813 -13.038 -3.508 -7.475 1.00 0.00 H new ATOM 0 HE2 PHE A 813 -9.210 -3.600 -5.605 1.00 0.00 H new ATOM 0 HZ PHE A 813 -11.154 -2.315 -6.478 1.00 0.00 H new ATOM 469 N SER A 814 -11.444 -10.448 -4.469 1.00 0.00 N ATOM 470 CA SER A 814 -11.645 -11.888 -4.406 1.00 0.00 C ATOM 471 C SER A 814 -12.640 -12.246 -3.295 1.00 0.00 C ATOM 472 O SER A 814 -13.418 -13.189 -3.422 1.00 0.00 O ATOM 473 CB SER A 814 -10.303 -12.591 -4.174 1.00 0.00 C ATOM 474 OG SER A 814 -10.416 -13.995 -4.349 1.00 0.00 O ATOM 0 H SER A 814 -10.571 -10.126 -4.051 1.00 0.00 H new ATOM 0 HA SER A 814 -12.061 -12.227 -5.355 1.00 0.00 H new ATOM 0 HB2 SER A 814 -9.559 -12.195 -4.866 1.00 0.00 H new ATOM 0 HB3 SER A 814 -9.947 -12.376 -3.166 1.00 0.00 H new ATOM 0 HG SER A 814 -9.544 -14.415 -4.196 1.00 0.00 H new ATOM 480 N SER A 815 -12.617 -11.474 -2.214 1.00 0.00 N ATOM 481 CA SER A 815 -13.492 -11.716 -1.071 1.00 0.00 C ATOM 482 C SER A 815 -14.875 -11.106 -1.279 1.00 0.00 C ATOM 483 O SER A 815 -15.751 -11.256 -0.429 1.00 0.00 O ATOM 484 CB SER A 815 -12.853 -11.167 0.208 1.00 0.00 C ATOM 485 OG SER A 815 -12.370 -9.849 0.018 1.00 0.00 O ATOM 0 H SER A 815 -11.998 -10.671 -2.105 1.00 0.00 H new ATOM 0 HA SER A 815 -13.621 -12.794 -0.973 1.00 0.00 H new ATOM 0 HB2 SER A 815 -13.585 -11.175 1.015 1.00 0.00 H new ATOM 0 HB3 SER A 815 -12.033 -11.816 0.515 1.00 0.00 H new ATOM 0 HG SER A 815 -11.501 -9.881 -0.434 1.00 0.00 H new ATOM 491 N MET A 816 -15.051 -10.413 -2.408 1.00 0.00 N ATOM 492 CA MET A 816 -16.316 -9.755 -2.752 1.00 0.00 C ATOM 493 C MET A 816 -17.528 -10.627 -2.439 1.00 0.00 C ATOM 494 O MET A 816 -17.813 -11.593 -3.149 1.00 0.00 O ATOM 495 CB MET A 816 -16.327 -9.388 -4.233 1.00 0.00 C ATOM 496 CG MET A 816 -15.736 -8.024 -4.515 1.00 0.00 C ATOM 497 SD MET A 816 -16.799 -6.692 -3.946 1.00 0.00 S ATOM 498 CE MET A 816 -15.745 -5.291 -4.277 1.00 0.00 C ATOM 0 H MET A 816 -14.321 -10.292 -3.110 1.00 0.00 H new ATOM 0 HA MET A 816 -16.386 -8.856 -2.140 1.00 0.00 H new ATOM 0 HB2 MET A 816 -15.770 -10.140 -4.791 1.00 0.00 H new ATOM 0 HB3 MET A 816 -17.353 -9.415 -4.599 1.00 0.00 H new ATOM 0 HG2 MET A 816 -14.764 -7.944 -4.028 1.00 0.00 H new ATOM 0 HG3 MET A 816 -15.566 -7.918 -5.586 1.00 0.00 H new ATOM 0 HE1 MET A 816 -16.327 -4.372 -4.202 1.00 0.00 H new ATOM 0 HE2 MET A 816 -14.933 -5.267 -3.550 1.00 0.00 H new ATOM 0 HE3 MET A 816 -15.331 -5.377 -5.282 1.00 0.00 H new ATOM 508 N GLY A 817 -18.233 -10.281 -1.372 1.00 0.00 N ATOM 509 CA GLY A 817 -19.392 -11.047 -0.967 1.00 0.00 C ATOM 510 C GLY A 817 -19.321 -11.466 0.485 1.00 0.00 C ATOM 511 O GLY A 817 -20.346 -11.717 1.119 1.00 0.00 O ATOM 0 H GLY A 817 -18.021 -9.480 -0.778 1.00 0.00 H new ATOM 0 HA2 GLY A 817 -20.292 -10.454 -1.129 1.00 0.00 H new ATOM 0 HA3 GLY A 817 -19.477 -11.933 -1.595 1.00 0.00 H new ATOM 515 N ASP A 818 -18.110 -11.549 1.013 1.00 0.00 N ATOM 516 CA ASP A 818 -17.916 -11.899 2.412 1.00 0.00 C ATOM 517 C ASP A 818 -17.704 -10.630 3.225 1.00 0.00 C ATOM 518 O ASP A 818 -16.645 -10.004 3.154 1.00 0.00 O ATOM 519 CB ASP A 818 -16.717 -12.836 2.579 1.00 0.00 C ATOM 520 CG ASP A 818 -16.661 -13.476 3.953 1.00 0.00 C ATOM 521 OD1 ASP A 818 -16.605 -12.741 4.960 1.00 0.00 O ATOM 522 OD2 ASP A 818 -16.675 -14.723 4.033 1.00 0.00 O ATOM 0 H ASP A 818 -17.248 -11.379 0.495 1.00 0.00 H new ATOM 0 HA ASP A 818 -18.804 -12.419 2.770 1.00 0.00 H new ATOM 0 HB2 ASP A 818 -16.763 -13.617 1.820 1.00 0.00 H new ATOM 0 HB3 ASP A 818 -15.797 -12.277 2.405 1.00 0.00 H new ATOM 527 N ALA A 819 -18.716 -10.258 3.994 1.00 0.00 N ATOM 528 CA ALA A 819 -18.713 -9.001 4.729 1.00 0.00 C ATOM 529 C ALA A 819 -17.633 -8.985 5.803 1.00 0.00 C ATOM 530 O ALA A 819 -17.081 -7.937 6.134 1.00 0.00 O ATOM 531 CB ALA A 819 -20.082 -8.759 5.342 1.00 0.00 C ATOM 0 H ALA A 819 -19.560 -10.816 4.126 1.00 0.00 H new ATOM 0 HA ALA A 819 -18.488 -8.197 4.029 1.00 0.00 H new ATOM 0 HB1 ALA A 819 -20.074 -7.817 5.891 1.00 0.00 H new ATOM 0 HB2 ALA A 819 -20.831 -8.712 4.552 1.00 0.00 H new ATOM 0 HB3 ALA A 819 -20.325 -9.574 6.024 1.00 0.00 H new ATOM 537 N GLY A 820 -17.348 -10.148 6.358 1.00 0.00 N ATOM 538 CA GLY A 820 -16.310 -10.254 7.359 1.00 0.00 C ATOM 539 C GLY A 820 -14.918 -10.222 6.759 1.00 0.00 C ATOM 540 O GLY A 820 -14.055 -9.463 7.206 1.00 0.00 O ATOM 0 H GLY A 820 -17.818 -11.025 6.133 1.00 0.00 H new ATOM 0 HA2 GLY A 820 -16.413 -9.436 8.073 1.00 0.00 H new ATOM 0 HA3 GLY A 820 -16.441 -11.182 7.916 1.00 0.00 H new ATOM 544 N GLU A 821 -14.706 -11.033 5.732 1.00 0.00 N ATOM 545 CA GLU A 821 -13.387 -11.195 5.136 1.00 0.00 C ATOM 546 C GLU A 821 -12.922 -9.925 4.427 1.00 0.00 C ATOM 547 O GLU A 821 -11.750 -9.568 4.511 1.00 0.00 O ATOM 548 CB GLU A 821 -13.390 -12.376 4.168 1.00 0.00 C ATOM 549 CG GLU A 821 -12.013 -12.743 3.644 1.00 0.00 C ATOM 550 CD GLU A 821 -12.023 -14.033 2.857 1.00 0.00 C ATOM 551 OE1 GLU A 821 -12.071 -15.111 3.484 1.00 0.00 O ATOM 552 OE2 GLU A 821 -11.991 -13.981 1.611 1.00 0.00 O ATOM 0 H GLU A 821 -15.436 -11.593 5.292 1.00 0.00 H new ATOM 0 HA GLU A 821 -12.681 -11.393 5.942 1.00 0.00 H new ATOM 0 HB2 GLU A 821 -13.821 -13.243 4.669 1.00 0.00 H new ATOM 0 HB3 GLU A 821 -14.039 -12.140 3.324 1.00 0.00 H new ATOM 0 HG2 GLU A 821 -11.641 -11.937 3.011 1.00 0.00 H new ATOM 0 HG3 GLU A 821 -11.321 -12.836 4.481 1.00 0.00 H new ATOM 559 N MET A 822 -13.831 -9.238 3.739 1.00 0.00 N ATOM 560 CA MET A 822 -13.471 -8.006 3.036 1.00 0.00 C ATOM 561 C MET A 822 -12.900 -6.972 4.005 1.00 0.00 C ATOM 562 O MET A 822 -11.922 -6.289 3.698 1.00 0.00 O ATOM 563 CB MET A 822 -14.674 -7.417 2.299 1.00 0.00 C ATOM 564 CG MET A 822 -15.131 -8.236 1.104 1.00 0.00 C ATOM 565 SD MET A 822 -16.601 -7.548 0.312 1.00 0.00 S ATOM 566 CE MET A 822 -16.003 -5.920 -0.148 1.00 0.00 C ATOM 0 H MET A 822 -14.811 -9.508 3.653 1.00 0.00 H new ATOM 0 HA MET A 822 -12.706 -8.261 2.302 1.00 0.00 H new ATOM 0 HB2 MET A 822 -15.504 -7.321 2.999 1.00 0.00 H new ATOM 0 HB3 MET A 822 -14.423 -6.411 1.962 1.00 0.00 H new ATOM 0 HG2 MET A 822 -14.322 -8.291 0.375 1.00 0.00 H new ATOM 0 HG3 MET A 822 -15.340 -9.256 1.426 1.00 0.00 H new ATOM 0 HE1 MET A 822 -16.636 -5.509 -0.935 1.00 0.00 H new ATOM 0 HE2 MET A 822 -16.032 -5.263 0.721 1.00 0.00 H new ATOM 0 HE3 MET A 822 -14.978 -5.998 -0.510 1.00 0.00 H new ATOM 576 N VAL A 823 -13.505 -6.875 5.184 1.00 0.00 N ATOM 577 CA VAL A 823 -13.010 -5.976 6.220 1.00 0.00 C ATOM 578 C VAL A 823 -11.678 -6.485 6.761 1.00 0.00 C ATOM 579 O VAL A 823 -10.752 -5.708 7.001 1.00 0.00 O ATOM 580 CB VAL A 823 -14.016 -5.833 7.384 1.00 0.00 C ATOM 581 CG1 VAL A 823 -13.504 -4.853 8.427 1.00 0.00 C ATOM 582 CG2 VAL A 823 -15.375 -5.395 6.866 1.00 0.00 C ATOM 0 H VAL A 823 -14.336 -7.406 5.445 1.00 0.00 H new ATOM 0 HA VAL A 823 -12.876 -4.995 5.765 1.00 0.00 H new ATOM 0 HB VAL A 823 -14.124 -6.809 7.858 1.00 0.00 H new ATOM 0 HG11 VAL A 823 -14.230 -4.770 9.236 1.00 0.00 H new ATOM 0 HG12 VAL A 823 -12.555 -5.210 8.827 1.00 0.00 H new ATOM 0 HG13 VAL A 823 -13.359 -3.875 7.968 1.00 0.00 H new ATOM 0 HG21 VAL A 823 -16.069 -5.300 7.701 1.00 0.00 H new ATOM 0 HG22 VAL A 823 -15.280 -4.433 6.362 1.00 0.00 H new ATOM 0 HG23 VAL A 823 -15.753 -6.137 6.163 1.00 0.00 H new ATOM 592 N ARG A 824 -11.593 -7.800 6.930 1.00 0.00 N ATOM 593 CA ARG A 824 -10.372 -8.448 7.391 1.00 0.00 C ATOM 594 C ARG A 824 -9.195 -8.106 6.479 1.00 0.00 C ATOM 595 O ARG A 824 -8.106 -7.776 6.957 1.00 0.00 O ATOM 596 CB ARG A 824 -10.578 -9.966 7.444 1.00 0.00 C ATOM 597 CG ARG A 824 -9.333 -10.745 7.834 1.00 0.00 C ATOM 598 CD ARG A 824 -9.579 -12.245 7.788 1.00 0.00 C ATOM 599 NE ARG A 824 -8.364 -13.008 8.064 1.00 0.00 N ATOM 600 CZ ARG A 824 -8.234 -14.315 7.839 1.00 0.00 C ATOM 601 NH1 ARG A 824 -9.252 -15.022 7.364 1.00 0.00 N ATOM 602 NH2 ARG A 824 -7.080 -14.914 8.086 1.00 0.00 N ATOM 0 H ARG A 824 -12.364 -8.443 6.752 1.00 0.00 H new ATOM 0 HA ARG A 824 -10.142 -8.082 8.392 1.00 0.00 H new ATOM 0 HB2 ARG A 824 -11.372 -10.190 8.156 1.00 0.00 H new ATOM 0 HB3 ARG A 824 -10.919 -10.310 6.468 1.00 0.00 H new ATOM 0 HG2 ARG A 824 -8.516 -10.488 7.160 1.00 0.00 H new ATOM 0 HG3 ARG A 824 -9.021 -10.457 8.838 1.00 0.00 H new ATOM 0 HD2 ARG A 824 -10.346 -12.509 8.516 1.00 0.00 H new ATOM 0 HD3 ARG A 824 -9.964 -12.519 6.806 1.00 0.00 H new ATOM 0 HE ARG A 824 -7.565 -12.509 8.454 1.00 0.00 H new ATOM 0 HH11 ARG A 824 -10.143 -14.565 7.168 1.00 0.00 H new ATOM 0 HH12 ARG A 824 -9.143 -16.022 7.195 1.00 0.00 H new ATOM 0 HH21 ARG A 824 -6.293 -14.375 8.448 1.00 0.00 H new ATOM 0 HH22 ARG A 824 -6.978 -15.914 7.915 1.00 0.00 H new ATOM 616 N GLN A 825 -9.422 -8.165 5.169 1.00 0.00 N ATOM 617 CA GLN A 825 -8.370 -7.890 4.196 1.00 0.00 C ATOM 618 C GLN A 825 -7.994 -6.409 4.205 1.00 0.00 C ATOM 619 O GLN A 825 -6.821 -6.057 4.076 1.00 0.00 O ATOM 620 CB GLN A 825 -8.806 -8.318 2.790 1.00 0.00 C ATOM 621 CG GLN A 825 -9.296 -9.757 2.710 1.00 0.00 C ATOM 622 CD GLN A 825 -8.320 -10.753 3.310 1.00 0.00 C ATOM 623 OE1 GLN A 825 -7.429 -11.279 2.491 1.00 0.00 O flip ATOM 624 NE2 GLN A 825 -8.376 -11.056 4.503 1.00 0.00 N flip ATOM 0 H GLN A 825 -10.325 -8.401 4.758 1.00 0.00 H new ATOM 0 HA GLN A 825 -7.492 -8.470 4.479 1.00 0.00 H new ATOM 0 HB2 GLN A 825 -9.600 -7.654 2.448 1.00 0.00 H new ATOM 0 HB3 GLN A 825 -7.967 -8.191 2.105 1.00 0.00 H new ATOM 0 HG2 GLN A 825 -10.252 -9.838 3.227 1.00 0.00 H new ATOM 0 HG3 GLN A 825 -9.475 -10.016 1.666 1.00 0.00 H new ATOM 0 HE21 GLN A 825 -9.079 -10.628 5.105 1.00 0.00 H new ATOM 0 HE22 GLN A 825 -7.719 -11.735 4.888 1.00 0.00 H new ATOM 633 N ALA A 826 -8.994 -5.545 4.359 1.00 0.00 N ATOM 634 CA ALA A 826 -8.757 -4.109 4.483 1.00 0.00 C ATOM 635 C ALA A 826 -7.858 -3.805 5.679 1.00 0.00 C ATOM 636 O ALA A 826 -6.983 -2.941 5.609 1.00 0.00 O ATOM 637 CB ALA A 826 -10.076 -3.364 4.614 1.00 0.00 C ATOM 0 H ALA A 826 -9.977 -5.814 4.401 1.00 0.00 H new ATOM 0 HA ALA A 826 -8.249 -3.771 3.580 1.00 0.00 H new ATOM 0 HB1 ALA A 826 -9.883 -2.295 4.706 1.00 0.00 H new ATOM 0 HB2 ALA A 826 -10.687 -3.548 3.730 1.00 0.00 H new ATOM 0 HB3 ALA A 826 -10.605 -3.714 5.500 1.00 0.00 H new ATOM 643 N ARG A 827 -8.075 -4.530 6.772 1.00 0.00 N ATOM 644 CA ARG A 827 -7.256 -4.374 7.972 1.00 0.00 C ATOM 645 C ARG A 827 -5.815 -4.796 7.700 1.00 0.00 C ATOM 646 O ARG A 827 -4.878 -4.236 8.271 1.00 0.00 O ATOM 647 CB ARG A 827 -7.832 -5.192 9.128 1.00 0.00 C ATOM 648 CG ARG A 827 -9.193 -4.710 9.600 1.00 0.00 C ATOM 649 CD ARG A 827 -9.735 -5.592 10.712 1.00 0.00 C ATOM 650 NE ARG A 827 -11.057 -5.160 11.167 1.00 0.00 N ATOM 651 CZ ARG A 827 -12.056 -5.997 11.448 1.00 0.00 C ATOM 652 NH1 ARG A 827 -11.894 -7.308 11.305 1.00 0.00 N ATOM 653 NH2 ARG A 827 -13.222 -5.524 11.867 1.00 0.00 N ATOM 0 H ARG A 827 -8.811 -5.232 6.853 1.00 0.00 H new ATOM 0 HA ARG A 827 -7.264 -3.320 8.251 1.00 0.00 H new ATOM 0 HB2 ARG A 827 -7.913 -6.234 8.819 1.00 0.00 H new ATOM 0 HB3 ARG A 827 -7.135 -5.161 9.966 1.00 0.00 H new ATOM 0 HG2 ARG A 827 -9.115 -3.682 9.954 1.00 0.00 H new ATOM 0 HG3 ARG A 827 -9.891 -4.707 8.763 1.00 0.00 H new ATOM 0 HD2 ARG A 827 -9.793 -6.622 10.361 1.00 0.00 H new ATOM 0 HD3 ARG A 827 -9.042 -5.580 11.553 1.00 0.00 H new ATOM 0 HE ARG A 827 -11.224 -4.160 11.276 1.00 0.00 H new ATOM 0 HH11 ARG A 827 -11.002 -7.679 10.979 1.00 0.00 H new ATOM 0 HH12 ARG A 827 -12.662 -7.943 11.522 1.00 0.00 H new ATOM 0 HH21 ARG A 827 -13.355 -4.519 11.975 1.00 0.00 H new ATOM 0 HH22 ARG A 827 -13.985 -6.166 12.082 1.00 0.00 H new ATOM 667 N ILE A 828 -5.644 -5.784 6.824 1.00 0.00 N ATOM 668 CA ILE A 828 -4.315 -6.231 6.425 1.00 0.00 C ATOM 669 C ILE A 828 -3.600 -5.122 5.661 1.00 0.00 C ATOM 670 O ILE A 828 -2.413 -4.868 5.876 1.00 0.00 O ATOM 671 CB ILE A 828 -4.377 -7.496 5.541 1.00 0.00 C ATOM 672 CG1 ILE A 828 -5.135 -8.615 6.259 1.00 0.00 C ATOM 673 CG2 ILE A 828 -2.971 -7.959 5.177 1.00 0.00 C ATOM 674 CD1 ILE A 828 -5.326 -9.859 5.417 1.00 0.00 C ATOM 0 H ILE A 828 -6.410 -6.289 6.378 1.00 0.00 H new ATOM 0 HA ILE A 828 -3.766 -6.475 7.334 1.00 0.00 H new ATOM 0 HB ILE A 828 -4.911 -7.249 4.623 1.00 0.00 H new ATOM 0 HG12 ILE A 828 -4.596 -8.882 7.168 1.00 0.00 H new ATOM 0 HG13 ILE A 828 -6.112 -8.241 6.566 1.00 0.00 H new ATOM 0 HG21 ILE A 828 -3.032 -8.851 4.554 1.00 0.00 H new ATOM 0 HG22 ILE A 828 -2.458 -7.168 4.630 1.00 0.00 H new ATOM 0 HG23 ILE A 828 -2.417 -8.189 6.087 1.00 0.00 H new ATOM 0 HD11 ILE A 828 -5.871 -10.608 5.992 1.00 0.00 H new ATOM 0 HD12 ILE A 828 -5.892 -9.608 4.520 1.00 0.00 H new ATOM 0 HD13 ILE A 828 -4.353 -10.258 5.132 1.00 0.00 H new ATOM 686 N LEU A 829 -4.338 -4.459 4.776 1.00 0.00 N ATOM 687 CA LEU A 829 -3.804 -3.330 4.023 1.00 0.00 C ATOM 688 C LEU A 829 -3.384 -2.211 4.959 1.00 0.00 C ATOM 689 O LEU A 829 -2.267 -1.713 4.871 1.00 0.00 O ATOM 690 CB LEU A 829 -4.837 -2.798 3.029 1.00 0.00 C ATOM 691 CG LEU A 829 -5.107 -3.695 1.827 1.00 0.00 C ATOM 692 CD1 LEU A 829 -6.127 -3.048 0.907 1.00 0.00 C ATOM 693 CD2 LEU A 829 -3.815 -3.971 1.077 1.00 0.00 C ATOM 0 H LEU A 829 -5.310 -4.685 4.563 1.00 0.00 H new ATOM 0 HA LEU A 829 -2.932 -3.684 3.473 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -5.776 -2.635 3.558 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -4.502 -1.826 2.668 1.00 0.00 H new ATOM 0 HG LEU A 829 -5.512 -4.643 2.181 1.00 0.00 H new ATOM 0 HD11 LEU A 829 -6.311 -3.699 0.052 1.00 0.00 H new ATOM 0 HD12 LEU A 829 -7.059 -2.891 1.450 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -5.745 -2.089 0.557 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -4.021 -4.613 0.221 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -3.387 -3.030 0.731 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -3.108 -4.468 1.741 1.00 0.00 H new ATOM 705 N ALA A 830 -4.283 -1.834 5.859 1.00 0.00 N ATOM 706 CA ALA A 830 -4.010 -0.772 6.820 1.00 0.00 C ATOM 707 C ALA A 830 -2.736 -1.064 7.607 1.00 0.00 C ATOM 708 O ALA A 830 -1.870 -0.199 7.751 1.00 0.00 O ATOM 709 CB ALA A 830 -5.191 -0.597 7.763 1.00 0.00 C ATOM 0 H ALA A 830 -5.211 -2.249 5.944 1.00 0.00 H new ATOM 0 HA ALA A 830 -3.862 0.157 6.270 1.00 0.00 H new ATOM 0 HB1 ALA A 830 -4.973 0.199 8.475 1.00 0.00 H new ATOM 0 HB2 ALA A 830 -6.080 -0.337 7.188 1.00 0.00 H new ATOM 0 HB3 ALA A 830 -5.367 -1.528 8.302 1.00 0.00 H new ATOM 715 N GLN A 831 -2.614 -2.295 8.083 1.00 0.00 N ATOM 716 CA GLN A 831 -1.452 -2.713 8.853 1.00 0.00 C ATOM 717 C GLN A 831 -0.186 -2.684 7.994 1.00 0.00 C ATOM 718 O GLN A 831 0.862 -2.195 8.426 1.00 0.00 O ATOM 719 CB GLN A 831 -1.678 -4.116 9.426 1.00 0.00 C ATOM 720 CG GLN A 831 -0.546 -4.619 10.308 1.00 0.00 C ATOM 721 CD GLN A 831 -0.254 -3.694 11.473 1.00 0.00 C ATOM 722 OE1 GLN A 831 -0.842 -3.822 12.547 1.00 0.00 O ATOM 723 NE2 GLN A 831 0.658 -2.759 11.268 1.00 0.00 N ATOM 0 H GLN A 831 -3.312 -3.027 7.948 1.00 0.00 H new ATOM 0 HA GLN A 831 -1.316 -2.012 9.677 1.00 0.00 H new ATOM 0 HB2 GLN A 831 -2.602 -4.115 10.005 1.00 0.00 H new ATOM 0 HB3 GLN A 831 -1.819 -4.815 8.601 1.00 0.00 H new ATOM 0 HG2 GLN A 831 -0.801 -5.608 10.690 1.00 0.00 H new ATOM 0 HG3 GLN A 831 0.355 -4.733 9.705 1.00 0.00 H new ATOM 0 HE21 GLN A 831 1.121 -2.688 10.362 1.00 0.00 H new ATOM 0 HE22 GLN A 831 0.898 -2.108 12.016 1.00 0.00 H new ATOM 732 N ALA A 832 -0.297 -3.186 6.769 1.00 0.00 N ATOM 733 CA ALA A 832 0.836 -3.237 5.852 1.00 0.00 C ATOM 734 C ALA A 832 1.283 -1.840 5.456 1.00 0.00 C ATOM 735 O ALA A 832 2.478 -1.530 5.477 1.00 0.00 O ATOM 736 CB ALA A 832 0.474 -4.042 4.617 1.00 0.00 C ATOM 0 H ALA A 832 -1.164 -3.565 6.387 1.00 0.00 H new ATOM 0 HA ALA A 832 1.665 -3.725 6.364 1.00 0.00 H new ATOM 0 HB1 ALA A 832 1.328 -4.073 3.940 1.00 0.00 H new ATOM 0 HB2 ALA A 832 0.206 -5.057 4.910 1.00 0.00 H new ATOM 0 HB3 ALA A 832 -0.372 -3.575 4.113 1.00 0.00 H new ATOM 742 N THR A 833 0.320 -1.004 5.101 1.00 0.00 N ATOM 743 CA THR A 833 0.596 0.371 4.737 1.00 0.00 C ATOM 744 C THR A 833 1.277 1.106 5.885 1.00 0.00 C ATOM 745 O THR A 833 2.220 1.865 5.671 1.00 0.00 O ATOM 746 CB THR A 833 -0.698 1.116 4.342 1.00 0.00 C ATOM 747 OG1 THR A 833 -1.260 0.532 3.162 1.00 0.00 O ATOM 748 CG2 THR A 833 -0.426 2.595 4.103 1.00 0.00 C ATOM 0 H THR A 833 -0.667 -1.260 5.058 1.00 0.00 H new ATOM 0 HA THR A 833 1.264 0.353 3.876 1.00 0.00 H new ATOM 0 HB THR A 833 -1.406 1.024 5.166 1.00 0.00 H new ATOM 0 HG1 THR A 833 -1.723 -0.299 3.397 1.00 0.00 H new ATOM 0 HG21 THR A 833 -1.354 3.096 3.826 1.00 0.00 H new ATOM 0 HG22 THR A 833 -0.029 3.044 5.014 1.00 0.00 H new ATOM 0 HG23 THR A 833 0.300 2.706 3.298 1.00 0.00 H new ATOM 756 N SER A 834 0.817 0.846 7.102 1.00 0.00 N ATOM 757 CA SER A 834 1.373 1.504 8.279 1.00 0.00 C ATOM 758 C SER A 834 2.867 1.207 8.397 1.00 0.00 C ATOM 759 O SER A 834 3.673 2.106 8.642 1.00 0.00 O ATOM 760 CB SER A 834 0.638 1.055 9.546 1.00 0.00 C ATOM 761 OG SER A 834 -0.736 1.410 9.490 1.00 0.00 O ATOM 0 H SER A 834 0.064 0.187 7.300 1.00 0.00 H new ATOM 0 HA SER A 834 1.239 2.580 8.167 1.00 0.00 H new ATOM 0 HB2 SER A 834 0.734 -0.024 9.663 1.00 0.00 H new ATOM 0 HB3 SER A 834 1.100 1.513 10.421 1.00 0.00 H new ATOM 0 HG SER A 834 -1.242 0.691 9.058 1.00 0.00 H new ATOM 767 N ASP A 835 3.229 -0.050 8.181 1.00 0.00 N ATOM 768 CA ASP A 835 4.625 -0.467 8.246 1.00 0.00 C ATOM 769 C ASP A 835 5.431 0.172 7.116 1.00 0.00 C ATOM 770 O ASP A 835 6.573 0.592 7.312 1.00 0.00 O ATOM 771 CB ASP A 835 4.724 -1.993 8.169 1.00 0.00 C ATOM 772 CG ASP A 835 6.153 -2.491 8.250 1.00 0.00 C ATOM 773 OD1 ASP A 835 6.655 -2.691 9.375 1.00 0.00 O ATOM 774 OD2 ASP A 835 6.783 -2.682 7.186 1.00 0.00 O ATOM 0 H ASP A 835 2.575 -0.801 7.959 1.00 0.00 H new ATOM 0 HA ASP A 835 5.041 -0.134 9.197 1.00 0.00 H new ATOM 0 HB2 ASP A 835 4.144 -2.432 8.981 1.00 0.00 H new ATOM 0 HB3 ASP A 835 4.277 -2.335 7.236 1.00 0.00 H new ATOM 779 N LEU A 836 4.819 0.264 5.942 1.00 0.00 N ATOM 780 CA LEU A 836 5.482 0.826 4.771 1.00 0.00 C ATOM 781 C LEU A 836 5.710 2.327 4.946 1.00 0.00 C ATOM 782 O LEU A 836 6.803 2.827 4.689 1.00 0.00 O ATOM 783 CB LEU A 836 4.647 0.572 3.514 1.00 0.00 C ATOM 784 CG LEU A 836 5.429 0.085 2.290 1.00 0.00 C ATOM 785 CD1 LEU A 836 4.506 -0.058 1.094 1.00 0.00 C ATOM 786 CD2 LEU A 836 6.581 1.021 1.960 1.00 0.00 C ATOM 0 H LEU A 836 3.861 -0.044 5.775 1.00 0.00 H new ATOM 0 HA LEU A 836 6.450 0.336 4.662 1.00 0.00 H new ATOM 0 HB2 LEU A 836 3.881 -0.166 3.751 1.00 0.00 H new ATOM 0 HB3 LEU A 836 4.130 1.495 3.250 1.00 0.00 H new ATOM 0 HG LEU A 836 5.849 -0.892 2.530 1.00 0.00 H new ATOM 0 HD11 LEU A 836 5.077 -0.405 0.233 1.00 0.00 H new ATOM 0 HD12 LEU A 836 3.722 -0.780 1.324 1.00 0.00 H new ATOM 0 HD13 LEU A 836 4.055 0.907 0.865 1.00 0.00 H new ATOM 0 HD21 LEU A 836 7.115 0.647 1.087 1.00 0.00 H new ATOM 0 HD22 LEU A 836 6.191 2.017 1.748 1.00 0.00 H new ATOM 0 HD23 LEU A 836 7.263 1.072 2.809 1.00 0.00 H new ATOM 798 N VAL A 837 4.680 3.039 5.390 1.00 0.00 N ATOM 799 CA VAL A 837 4.760 4.487 5.571 1.00 0.00 C ATOM 800 C VAL A 837 5.890 4.863 6.533 1.00 0.00 C ATOM 801 O VAL A 837 6.621 5.825 6.294 1.00 0.00 O ATOM 802 CB VAL A 837 3.417 5.069 6.071 1.00 0.00 C ATOM 803 CG1 VAL A 837 3.543 6.553 6.379 1.00 0.00 C ATOM 804 CG2 VAL A 837 2.325 4.846 5.038 1.00 0.00 C ATOM 0 H VAL A 837 3.775 2.636 5.633 1.00 0.00 H new ATOM 0 HA VAL A 837 4.978 4.922 4.595 1.00 0.00 H new ATOM 0 HB VAL A 837 3.150 4.549 6.991 1.00 0.00 H new ATOM 0 HG11 VAL A 837 2.584 6.935 6.728 1.00 0.00 H new ATOM 0 HG12 VAL A 837 4.296 6.701 7.153 1.00 0.00 H new ATOM 0 HG13 VAL A 837 3.840 7.088 5.477 1.00 0.00 H new ATOM 0 HG21 VAL A 837 1.386 5.261 5.405 1.00 0.00 H new ATOM 0 HG22 VAL A 837 2.600 5.339 4.106 1.00 0.00 H new ATOM 0 HG23 VAL A 837 2.204 3.777 4.861 1.00 0.00 H new ATOM 814 N ASN A 838 6.043 4.087 7.605 1.00 0.00 N ATOM 815 CA ASN A 838 7.140 4.298 8.555 1.00 0.00 C ATOM 816 C ASN A 838 8.486 4.169 7.861 1.00 0.00 C ATOM 817 O ASN A 838 9.419 4.922 8.141 1.00 0.00 O ATOM 818 CB ASN A 838 7.074 3.290 9.706 1.00 0.00 C ATOM 819 CG ASN A 838 6.128 3.717 10.812 1.00 0.00 C ATOM 820 OD1 ASN A 838 6.527 4.398 11.756 1.00 0.00 O ATOM 821 ND2 ASN A 838 4.874 3.318 10.711 1.00 0.00 N ATOM 0 H ASN A 838 5.426 3.309 7.839 1.00 0.00 H new ATOM 0 HA ASN A 838 7.033 5.306 8.956 1.00 0.00 H new ATOM 0 HB2 ASN A 838 6.757 2.322 9.317 1.00 0.00 H new ATOM 0 HB3 ASN A 838 8.073 3.155 10.121 1.00 0.00 H new ATOM 0 HD21 ASN A 838 4.198 3.573 11.431 1.00 0.00 H new ATOM 0 HD22 ASN A 838 4.581 2.754 9.913 1.00 0.00 H new ATOM 828 N ALA A 839 8.575 3.209 6.956 1.00 0.00 N ATOM 829 CA ALA A 839 9.804 2.962 6.225 1.00 0.00 C ATOM 830 C ALA A 839 10.097 4.099 5.259 1.00 0.00 C ATOM 831 O ALA A 839 11.216 4.598 5.202 1.00 0.00 O ATOM 832 CB ALA A 839 9.717 1.640 5.485 1.00 0.00 C ATOM 0 H ALA A 839 7.806 2.586 6.710 1.00 0.00 H new ATOM 0 HA ALA A 839 10.625 2.908 6.940 1.00 0.00 H new ATOM 0 HB1 ALA A 839 10.645 1.466 4.940 1.00 0.00 H new ATOM 0 HB2 ALA A 839 9.559 0.833 6.200 1.00 0.00 H new ATOM 0 HB3 ALA A 839 8.884 1.670 4.782 1.00 0.00 H new ATOM 838 N ILE A 840 9.075 4.520 4.519 1.00 0.00 N ATOM 839 CA ILE A 840 9.224 5.589 3.539 1.00 0.00 C ATOM 840 C ILE A 840 9.664 6.887 4.210 1.00 0.00 C ATOM 841 O ILE A 840 10.596 7.540 3.755 1.00 0.00 O ATOM 842 CB ILE A 840 7.915 5.839 2.759 1.00 0.00 C ATOM 843 CG1 ILE A 840 7.431 4.549 2.095 1.00 0.00 C ATOM 844 CG2 ILE A 840 8.127 6.924 1.711 1.00 0.00 C ATOM 845 CD1 ILE A 840 6.113 4.696 1.366 1.00 0.00 C ATOM 0 H ILE A 840 8.132 4.135 4.581 1.00 0.00 H new ATOM 0 HA ILE A 840 9.991 5.265 2.835 1.00 0.00 H new ATOM 0 HB ILE A 840 7.151 6.173 3.462 1.00 0.00 H new ATOM 0 HG12 ILE A 840 8.189 4.207 1.391 1.00 0.00 H new ATOM 0 HG13 ILE A 840 7.331 3.775 2.856 1.00 0.00 H new ATOM 0 HG21 ILE A 840 7.197 7.091 1.167 1.00 0.00 H new ATOM 0 HG22 ILE A 840 8.432 7.848 2.201 1.00 0.00 H new ATOM 0 HG23 ILE A 840 8.903 6.609 1.014 1.00 0.00 H new ATOM 0 HD11 ILE A 840 5.835 3.741 0.921 1.00 0.00 H new ATOM 0 HD12 ILE A 840 5.341 5.007 2.070 1.00 0.00 H new ATOM 0 HD13 ILE A 840 6.213 5.446 0.581 1.00 0.00 H new ATOM 857 N LYS A 841 8.998 7.248 5.305 1.00 0.00 N ATOM 858 CA LYS A 841 9.337 8.466 6.036 1.00 0.00 C ATOM 859 C LYS A 841 10.785 8.434 6.510 1.00 0.00 C ATOM 860 O LYS A 841 11.533 9.395 6.323 1.00 0.00 O ATOM 861 CB LYS A 841 8.402 8.656 7.235 1.00 0.00 C ATOM 862 CG LYS A 841 6.970 8.992 6.849 1.00 0.00 C ATOM 863 CD LYS A 841 6.080 9.137 8.072 1.00 0.00 C ATOM 864 CE LYS A 841 4.654 9.486 7.680 1.00 0.00 C ATOM 865 NZ LYS A 841 3.740 9.510 8.852 1.00 0.00 N ATOM 0 H LYS A 841 8.224 6.717 5.704 1.00 0.00 H new ATOM 0 HA LYS A 841 9.213 9.307 5.354 1.00 0.00 H new ATOM 0 HB2 LYS A 841 8.403 7.745 7.833 1.00 0.00 H new ATOM 0 HB3 LYS A 841 8.794 9.452 7.867 1.00 0.00 H new ATOM 0 HG2 LYS A 841 6.955 9.919 6.276 1.00 0.00 H new ATOM 0 HG3 LYS A 841 6.574 8.210 6.201 1.00 0.00 H new ATOM 0 HD2 LYS A 841 6.086 8.207 8.641 1.00 0.00 H new ATOM 0 HD3 LYS A 841 6.480 9.913 8.725 1.00 0.00 H new ATOM 0 HE2 LYS A 841 4.641 10.460 7.191 1.00 0.00 H new ATOM 0 HE3 LYS A 841 4.291 8.760 6.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 841 2.779 9.752 8.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 841 3.731 8.574 9.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 841 4.070 10.221 9.535 1.00 0.00 H new ATOM 879 N ALA A 842 11.178 7.315 7.099 1.00 0.00 N ATOM 880 CA ALA A 842 12.517 7.167 7.648 1.00 0.00 C ATOM 881 C ALA A 842 13.572 7.131 6.547 1.00 0.00 C ATOM 882 O ALA A 842 14.646 7.720 6.683 1.00 0.00 O ATOM 883 CB ALA A 842 12.596 5.910 8.493 1.00 0.00 C ATOM 0 H ALA A 842 10.585 6.492 7.209 1.00 0.00 H new ATOM 0 HA ALA A 842 12.721 8.035 8.275 1.00 0.00 H new ATOM 0 HB1 ALA A 842 13.602 5.808 8.900 1.00 0.00 H new ATOM 0 HB2 ALA A 842 11.879 5.976 9.311 1.00 0.00 H new ATOM 0 HB3 ALA A 842 12.364 5.042 7.876 1.00 0.00 H new ATOM 889 N ASP A 843 13.260 6.447 5.458 1.00 0.00 N ATOM 890 CA ASP A 843 14.194 6.308 4.351 1.00 0.00 C ATOM 891 C ASP A 843 14.314 7.631 3.602 1.00 0.00 C ATOM 892 O ASP A 843 15.375 7.968 3.078 1.00 0.00 O ATOM 893 CB ASP A 843 13.729 5.186 3.420 1.00 0.00 C ATOM 894 CG ASP A 843 14.727 4.843 2.334 1.00 0.00 C ATOM 895 OD1 ASP A 843 15.912 4.607 2.656 1.00 0.00 O ATOM 896 OD2 ASP A 843 14.318 4.753 1.156 1.00 0.00 O ATOM 0 H ASP A 843 12.365 5.978 5.316 1.00 0.00 H new ATOM 0 HA ASP A 843 15.180 6.047 4.736 1.00 0.00 H new ATOM 0 HB2 ASP A 843 13.529 4.293 4.013 1.00 0.00 H new ATOM 0 HB3 ASP A 843 12.787 5.478 2.956 1.00 0.00 H new ATOM 901 N ALA A 844 13.224 8.390 3.585 1.00 0.00 N ATOM 902 CA ALA A 844 13.220 9.718 2.983 1.00 0.00 C ATOM 903 C ALA A 844 14.093 10.678 3.780 1.00 0.00 C ATOM 904 O ALA A 844 14.859 11.448 3.207 1.00 0.00 O ATOM 905 CB ALA A 844 11.804 10.260 2.881 1.00 0.00 C ATOM 0 H ALA A 844 12.329 8.107 3.983 1.00 0.00 H new ATOM 0 HA ALA A 844 13.632 9.630 1.978 1.00 0.00 H new ATOM 0 HB1 ALA A 844 11.826 11.252 2.429 1.00 0.00 H new ATOM 0 HB2 ALA A 844 11.203 9.593 2.264 1.00 0.00 H new ATOM 0 HB3 ALA A 844 11.367 10.325 3.877 1.00 0.00 H new ATOM 911 N GLU A 845 13.990 10.626 5.104 1.00 0.00 N ATOM 912 CA GLU A 845 14.802 11.488 5.957 1.00 0.00 C ATOM 913 C GLU A 845 16.258 11.030 5.959 1.00 0.00 C ATOM 914 O GLU A 845 17.156 11.768 6.363 1.00 0.00 O ATOM 915 CB GLU A 845 14.254 11.519 7.385 1.00 0.00 C ATOM 916 CG GLU A 845 12.871 12.142 7.486 1.00 0.00 C ATOM 917 CD GLU A 845 12.416 12.332 8.916 1.00 0.00 C ATOM 918 OE1 GLU A 845 11.789 11.409 9.476 1.00 0.00 O ATOM 919 OE2 GLU A 845 12.675 13.410 9.492 1.00 0.00 O ATOM 0 H GLU A 845 13.358 10.002 5.607 1.00 0.00 H new ATOM 0 HA GLU A 845 14.756 12.498 5.550 1.00 0.00 H new ATOM 0 HB2 GLU A 845 14.216 10.501 7.774 1.00 0.00 H new ATOM 0 HB3 GLU A 845 14.943 12.077 8.019 1.00 0.00 H new ATOM 0 HG2 GLU A 845 12.875 13.107 6.980 1.00 0.00 H new ATOM 0 HG3 GLU A 845 12.154 11.510 6.962 1.00 0.00 H new ATOM 926 N GLY A 846 16.483 9.806 5.498 1.00 0.00 N ATOM 927 CA GLY A 846 17.834 9.293 5.364 1.00 0.00 C ATOM 928 C GLY A 846 18.403 9.561 3.983 1.00 0.00 C ATOM 929 O GLY A 846 19.562 9.246 3.704 1.00 0.00 O ATOM 0 H GLY A 846 15.750 9.156 5.213 1.00 0.00 H new ATOM 0 HA2 GLY A 846 18.474 9.753 6.117 1.00 0.00 H new ATOM 0 HA3 GLY A 846 17.836 8.220 5.556 1.00 0.00 H new ATOM 933 N GLU A 847 17.582 10.146 3.122 1.00 0.00 N ATOM 934 CA GLU A 847 17.982 10.480 1.763 1.00 0.00 C ATOM 935 C GLU A 847 18.837 11.749 1.759 1.00 0.00 C ATOM 936 O GLU A 847 18.658 12.629 2.600 1.00 0.00 O ATOM 937 CB GLU A 847 16.727 10.657 0.896 1.00 0.00 C ATOM 938 CG GLU A 847 16.990 11.176 -0.508 1.00 0.00 C ATOM 939 CD GLU A 847 17.858 10.251 -1.332 1.00 0.00 C ATOM 940 OE1 GLU A 847 17.328 9.284 -1.912 1.00 0.00 O ATOM 941 OE2 GLU A 847 19.077 10.495 -1.407 1.00 0.00 O ATOM 0 H GLU A 847 16.620 10.402 3.346 1.00 0.00 H new ATOM 0 HA GLU A 847 18.585 9.672 1.349 1.00 0.00 H new ATOM 0 HB2 GLU A 847 16.214 9.698 0.823 1.00 0.00 H new ATOM 0 HB3 GLU A 847 16.048 11.344 1.401 1.00 0.00 H new ATOM 0 HG2 GLU A 847 16.038 11.322 -1.019 1.00 0.00 H new ATOM 0 HG3 GLU A 847 17.470 12.153 -0.444 1.00 0.00 H new ATOM 948 N SER A 848 19.768 11.830 0.822 1.00 0.00 N ATOM 949 CA SER A 848 20.654 12.977 0.722 1.00 0.00 C ATOM 950 C SER A 848 20.038 14.050 -0.169 1.00 0.00 C ATOM 951 O SER A 848 20.308 15.241 -0.005 1.00 0.00 O ATOM 952 CB SER A 848 22.007 12.539 0.163 1.00 0.00 C ATOM 953 OG SER A 848 22.510 11.415 0.868 1.00 0.00 O ATOM 0 H SER A 848 19.930 11.111 0.117 1.00 0.00 H new ATOM 0 HA SER A 848 20.799 13.397 1.717 1.00 0.00 H new ATOM 0 HB2 SER A 848 21.905 12.294 -0.894 1.00 0.00 H new ATOM 0 HB3 SER A 848 22.717 13.363 0.232 1.00 0.00 H new ATOM 0 HG SER A 848 23.376 11.153 0.491 1.00 0.00 H new ATOM 959 N ASP A 849 19.205 13.626 -1.111 1.00 0.00 N ATOM 960 CA ASP A 849 18.539 14.561 -2.011 1.00 0.00 C ATOM 961 C ASP A 849 17.255 15.060 -1.374 1.00 0.00 C ATOM 962 O ASP A 849 16.306 14.294 -1.196 1.00 0.00 O ATOM 963 CB ASP A 849 18.222 13.899 -3.351 1.00 0.00 C ATOM 964 CG ASP A 849 17.833 14.915 -4.405 1.00 0.00 C ATOM 965 OD1 ASP A 849 16.636 15.254 -4.498 1.00 0.00 O ATOM 966 OD2 ASP A 849 18.728 15.384 -5.143 1.00 0.00 O ATOM 0 H ASP A 849 18.975 12.645 -1.272 1.00 0.00 H new ATOM 0 HA ASP A 849 19.211 15.400 -2.191 1.00 0.00 H new ATOM 0 HB2 ASP A 849 19.091 13.336 -3.692 1.00 0.00 H new ATOM 0 HB3 ASP A 849 17.410 13.183 -3.219 1.00 0.00 H new ATOM 971 N LEU A 850 17.220 16.341 -1.038 1.00 0.00 N ATOM 972 CA LEU A 850 16.103 16.914 -0.295 1.00 0.00 C ATOM 973 C LEU A 850 14.814 16.840 -1.111 1.00 0.00 C ATOM 974 O LEU A 850 13.746 16.527 -0.579 1.00 0.00 O ATOM 975 CB LEU A 850 16.427 18.368 0.086 1.00 0.00 C ATOM 976 CG LEU A 850 15.586 18.987 1.216 1.00 0.00 C ATOM 977 CD1 LEU A 850 14.189 19.352 0.738 1.00 0.00 C ATOM 978 CD2 LEU A 850 15.513 18.041 2.406 1.00 0.00 C ATOM 0 H LEU A 850 17.956 17.008 -1.269 1.00 0.00 H new ATOM 0 HA LEU A 850 15.951 16.336 0.617 1.00 0.00 H new ATOM 0 HB2 LEU A 850 17.477 18.419 0.375 1.00 0.00 H new ATOM 0 HB3 LEU A 850 16.311 18.987 -0.803 1.00 0.00 H new ATOM 0 HG LEU A 850 16.079 19.907 1.529 1.00 0.00 H new ATOM 0 HD11 LEU A 850 13.624 19.786 1.563 1.00 0.00 H new ATOM 0 HD12 LEU A 850 14.260 20.076 -0.074 1.00 0.00 H new ATOM 0 HD13 LEU A 850 13.681 18.456 0.382 1.00 0.00 H new ATOM 0 HD21 LEU A 850 14.914 18.495 3.196 1.00 0.00 H new ATOM 0 HD22 LEU A 850 15.054 17.102 2.097 1.00 0.00 H new ATOM 0 HD23 LEU A 850 16.519 17.847 2.779 1.00 0.00 H new ATOM 990 N GLU A 851 14.916 17.099 -2.403 1.00 0.00 N ATOM 991 CA GLU A 851 13.740 17.114 -3.258 1.00 0.00 C ATOM 992 C GLU A 851 13.212 15.697 -3.462 1.00 0.00 C ATOM 993 O GLU A 851 12.001 15.470 -3.446 1.00 0.00 O ATOM 994 CB GLU A 851 14.053 17.790 -4.594 1.00 0.00 C ATOM 995 CG GLU A 851 14.659 19.175 -4.423 1.00 0.00 C ATOM 996 CD GLU A 851 14.421 20.086 -5.610 1.00 0.00 C ATOM 997 OE1 GLU A 851 15.233 20.072 -6.555 1.00 0.00 O ATOM 998 OE2 GLU A 851 13.425 20.841 -5.590 1.00 0.00 O ATOM 0 H GLU A 851 15.794 17.301 -2.881 1.00 0.00 H new ATOM 0 HA GLU A 851 12.959 17.695 -2.768 1.00 0.00 H new ATOM 0 HB2 GLU A 851 14.742 17.164 -5.161 1.00 0.00 H new ATOM 0 HB3 GLU A 851 13.137 17.868 -5.180 1.00 0.00 H new ATOM 0 HG2 GLU A 851 14.241 19.638 -3.529 1.00 0.00 H new ATOM 0 HG3 GLU A 851 15.732 19.076 -4.259 1.00 0.00 H new ATOM 1005 N ASN A 852 14.124 14.745 -3.621 1.00 0.00 N ATOM 1006 CA ASN A 852 13.753 13.337 -3.720 1.00 0.00 C ATOM 1007 C ASN A 852 13.206 12.838 -2.383 1.00 0.00 C ATOM 1008 O ASN A 852 12.414 11.900 -2.339 1.00 0.00 O ATOM 1009 CB ASN A 852 14.951 12.488 -4.163 1.00 0.00 C ATOM 1010 CG ASN A 852 14.589 11.034 -4.405 1.00 0.00 C ATOM 1011 OD1 ASN A 852 14.096 10.672 -5.473 1.00 0.00 O ATOM 1012 ND2 ASN A 852 14.860 10.182 -3.429 1.00 0.00 N ATOM 0 H ASN A 852 15.127 14.922 -3.684 1.00 0.00 H new ATOM 0 HA ASN A 852 12.972 13.239 -4.474 1.00 0.00 H new ATOM 0 HB2 ASN A 852 15.370 12.909 -5.077 1.00 0.00 H new ATOM 0 HB3 ASN A 852 15.729 12.541 -3.401 1.00 0.00 H new ATOM 0 HD21 ASN A 852 14.660 9.189 -3.549 1.00 0.00 H new ATOM 0 HD22 ASN A 852 15.269 10.518 -2.557 1.00 0.00 H new ATOM 1019 N SER A 853 13.613 13.485 -1.295 1.00 0.00 N ATOM 1020 CA SER A 853 13.080 13.163 0.024 1.00 0.00 C ATOM 1021 C SER A 853 11.590 13.499 0.080 1.00 0.00 C ATOM 1022 O SER A 853 10.779 12.696 0.540 1.00 0.00 O ATOM 1023 CB SER A 853 13.832 13.927 1.116 1.00 0.00 C ATOM 1024 OG SER A 853 15.215 13.618 1.097 1.00 0.00 O ATOM 0 H SER A 853 14.307 14.232 -1.300 1.00 0.00 H new ATOM 0 HA SER A 853 13.214 12.096 0.199 1.00 0.00 H new ATOM 0 HB2 SER A 853 13.694 14.999 0.974 1.00 0.00 H new ATOM 0 HB3 SER A 853 13.414 13.678 2.091 1.00 0.00 H new ATOM 0 HG SER A 853 15.629 14.019 0.304 1.00 0.00 H new ATOM 1030 N ARG A 854 11.234 14.682 -0.415 1.00 0.00 N ATOM 1031 CA ARG A 854 9.834 15.093 -0.490 1.00 0.00 C ATOM 1032 C ARG A 854 9.086 14.193 -1.463 1.00 0.00 C ATOM 1033 O ARG A 854 7.921 13.861 -1.256 1.00 0.00 O ATOM 1034 CB ARG A 854 9.712 16.539 -0.964 1.00 0.00 C ATOM 1035 CG ARG A 854 10.517 17.536 -0.149 1.00 0.00 C ATOM 1036 CD ARG A 854 10.338 18.943 -0.687 1.00 0.00 C ATOM 1037 NE ARG A 854 10.518 18.994 -2.140 1.00 0.00 N ATOM 1038 CZ ARG A 854 11.281 19.881 -2.771 1.00 0.00 C ATOM 1039 NH1 ARG A 854 11.942 20.809 -2.091 1.00 0.00 N ATOM 1040 NH2 ARG A 854 11.377 19.838 -4.095 1.00 0.00 N ATOM 0 H ARG A 854 11.895 15.373 -0.770 1.00 0.00 H new ATOM 0 HA ARG A 854 9.404 15.010 0.508 1.00 0.00 H new ATOM 0 HB2 ARG A 854 10.032 16.596 -2.004 1.00 0.00 H new ATOM 0 HB3 ARG A 854 8.662 16.830 -0.937 1.00 0.00 H new ATOM 0 HG2 ARG A 854 10.202 17.498 0.894 1.00 0.00 H new ATOM 0 HG3 ARG A 854 11.572 17.264 -0.173 1.00 0.00 H new ATOM 0 HD2 ARG A 854 9.343 19.307 -0.430 1.00 0.00 H new ATOM 0 HD3 ARG A 854 11.055 19.610 -0.208 1.00 0.00 H new ATOM 0 HE ARG A 854 10.025 18.303 -2.705 1.00 0.00 H new ATOM 0 HH11 ARG A 854 11.867 20.846 -1.074 1.00 0.00 H new ATOM 0 HH12 ARG A 854 12.525 21.485 -2.585 1.00 0.00 H new ATOM 0 HH21 ARG A 854 10.867 19.128 -4.620 1.00 0.00 H new ATOM 0 HH22 ARG A 854 11.960 20.515 -4.586 1.00 0.00 H new ATOM 1054 N LYS A 855 9.779 13.826 -2.530 1.00 0.00 N ATOM 1055 CA LYS A 855 9.268 12.897 -3.529 1.00 0.00 C ATOM 1056 C LYS A 855 8.860 11.573 -2.878 1.00 0.00 C ATOM 1057 O LYS A 855 7.761 11.066 -3.119 1.00 0.00 O ATOM 1058 CB LYS A 855 10.348 12.685 -4.589 1.00 0.00 C ATOM 1059 CG LYS A 855 10.059 11.580 -5.579 1.00 0.00 C ATOM 1060 CD LYS A 855 11.153 11.504 -6.624 1.00 0.00 C ATOM 1061 CE LYS A 855 11.038 10.243 -7.452 1.00 0.00 C ATOM 1062 NZ LYS A 855 12.046 10.205 -8.543 1.00 0.00 N ATOM 0 H LYS A 855 10.720 14.167 -2.730 1.00 0.00 H new ATOM 0 HA LYS A 855 8.376 13.310 -4.000 1.00 0.00 H new ATOM 0 HB2 LYS A 855 10.487 13.617 -5.137 1.00 0.00 H new ATOM 0 HB3 LYS A 855 11.291 12.467 -4.088 1.00 0.00 H new ATOM 0 HG2 LYS A 855 9.981 10.627 -5.056 1.00 0.00 H new ATOM 0 HG3 LYS A 855 9.098 11.759 -6.062 1.00 0.00 H new ATOM 0 HD2 LYS A 855 11.097 12.376 -7.276 1.00 0.00 H new ATOM 0 HD3 LYS A 855 12.127 11.533 -6.136 1.00 0.00 H new ATOM 0 HE2 LYS A 855 11.166 9.373 -6.808 1.00 0.00 H new ATOM 0 HE3 LYS A 855 10.037 10.179 -7.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 855 11.935 9.326 -9.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 855 11.908 11.022 -9.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 855 13.002 10.241 -8.134 1.00 0.00 H new ATOM 1076 N LEU A 856 9.750 11.027 -2.056 1.00 0.00 N ATOM 1077 CA LEU A 856 9.453 9.829 -1.273 1.00 0.00 C ATOM 1078 C LEU A 856 8.287 10.075 -0.316 1.00 0.00 C ATOM 1079 O LEU A 856 7.335 9.295 -0.272 1.00 0.00 O ATOM 1080 CB LEU A 856 10.691 9.388 -0.485 1.00 0.00 C ATOM 1081 CG LEU A 856 11.816 8.770 -1.320 1.00 0.00 C ATOM 1082 CD1 LEU A 856 13.082 8.639 -0.489 1.00 0.00 C ATOM 1083 CD2 LEU A 856 11.395 7.409 -1.849 1.00 0.00 C ATOM 0 H LEU A 856 10.690 11.397 -1.913 1.00 0.00 H new ATOM 0 HA LEU A 856 9.169 9.036 -1.965 1.00 0.00 H new ATOM 0 HB2 LEU A 856 11.089 10.252 0.047 1.00 0.00 H new ATOM 0 HB3 LEU A 856 10.382 8.664 0.269 1.00 0.00 H new ATOM 0 HG LEU A 856 12.019 9.427 -2.166 1.00 0.00 H new ATOM 0 HD11 LEU A 856 13.872 8.198 -1.097 1.00 0.00 H new ATOM 0 HD12 LEU A 856 13.396 9.625 -0.146 1.00 0.00 H new ATOM 0 HD13 LEU A 856 12.887 8.000 0.372 1.00 0.00 H new ATOM 0 HD21 LEU A 856 12.205 6.982 -2.441 1.00 0.00 H new ATOM 0 HD22 LEU A 856 11.169 6.748 -1.013 1.00 0.00 H new ATOM 0 HD23 LEU A 856 10.509 7.520 -2.474 1.00 0.00 H new ATOM 1095 N LEU A 857 8.363 11.170 0.438 1.00 0.00 N ATOM 1096 CA LEU A 857 7.321 11.520 1.405 1.00 0.00 C ATOM 1097 C LEU A 857 5.957 11.660 0.730 1.00 0.00 C ATOM 1098 O LEU A 857 4.932 11.316 1.317 1.00 0.00 O ATOM 1099 CB LEU A 857 7.679 12.820 2.131 1.00 0.00 C ATOM 1100 CG LEU A 857 8.893 12.736 3.061 1.00 0.00 C ATOM 1101 CD1 LEU A 857 9.217 14.105 3.637 1.00 0.00 C ATOM 1102 CD2 LEU A 857 8.640 11.734 4.178 1.00 0.00 C ATOM 0 H LEU A 857 9.137 11.833 0.399 1.00 0.00 H new ATOM 0 HA LEU A 857 7.260 10.709 2.131 1.00 0.00 H new ATOM 0 HB2 LEU A 857 7.865 13.594 1.386 1.00 0.00 H new ATOM 0 HB3 LEU A 857 6.816 13.141 2.715 1.00 0.00 H new ATOM 0 HG LEU A 857 9.750 12.395 2.480 1.00 0.00 H new ATOM 0 HD11 LEU A 857 10.082 14.027 4.296 1.00 0.00 H new ATOM 0 HD12 LEU A 857 9.440 14.798 2.825 1.00 0.00 H new ATOM 0 HD13 LEU A 857 8.362 14.473 4.204 1.00 0.00 H new ATOM 0 HD21 LEU A 857 9.513 11.687 4.829 1.00 0.00 H new ATOM 0 HD22 LEU A 857 7.771 12.047 4.757 1.00 0.00 H new ATOM 0 HD23 LEU A 857 8.454 10.750 3.749 1.00 0.00 H new ATOM 1114 N SER A 858 5.957 12.159 -0.501 1.00 0.00 N ATOM 1115 CA SER A 858 4.734 12.306 -1.274 1.00 0.00 C ATOM 1116 C SER A 858 4.048 10.955 -1.442 1.00 0.00 C ATOM 1117 O SER A 858 2.851 10.824 -1.194 1.00 0.00 O ATOM 1118 CB SER A 858 5.050 12.916 -2.644 1.00 0.00 C ATOM 1119 OG SER A 858 3.873 13.124 -3.407 1.00 0.00 O ATOM 0 H SER A 858 6.799 12.470 -0.986 1.00 0.00 H new ATOM 0 HA SER A 858 4.058 12.973 -0.739 1.00 0.00 H new ATOM 0 HB2 SER A 858 5.569 13.865 -2.509 1.00 0.00 H new ATOM 0 HB3 SER A 858 5.726 12.257 -3.189 1.00 0.00 H new ATOM 0 HG SER A 858 4.110 13.515 -4.274 1.00 0.00 H new ATOM 1125 N ALA A 859 4.828 9.947 -1.823 1.00 0.00 N ATOM 1126 CA ALA A 859 4.303 8.603 -2.021 1.00 0.00 C ATOM 1127 C ALA A 859 3.664 8.075 -0.742 1.00 0.00 C ATOM 1128 O ALA A 859 2.578 7.499 -0.773 1.00 0.00 O ATOM 1129 CB ALA A 859 5.410 7.669 -2.490 1.00 0.00 C ATOM 0 H ALA A 859 5.828 10.038 -2.001 1.00 0.00 H new ATOM 0 HA ALA A 859 3.532 8.646 -2.790 1.00 0.00 H new ATOM 0 HB1 ALA A 859 5.004 6.668 -2.634 1.00 0.00 H new ATOM 0 HB2 ALA A 859 5.819 8.034 -3.432 1.00 0.00 H new ATOM 0 HB3 ALA A 859 6.200 7.636 -1.740 1.00 0.00 H new ATOM 1135 N ALA A 860 4.336 8.298 0.382 1.00 0.00 N ATOM 1136 CA ALA A 860 3.832 7.861 1.680 1.00 0.00 C ATOM 1137 C ALA A 860 2.541 8.589 2.040 1.00 0.00 C ATOM 1138 O ALA A 860 1.583 7.973 2.510 1.00 0.00 O ATOM 1139 CB ALA A 860 4.880 8.088 2.757 1.00 0.00 C ATOM 0 H ALA A 860 5.234 8.780 0.421 1.00 0.00 H new ATOM 0 HA ALA A 860 3.615 6.795 1.616 1.00 0.00 H new ATOM 0 HB1 ALA A 860 4.490 7.757 3.720 1.00 0.00 H new ATOM 0 HB2 ALA A 860 5.779 7.521 2.515 1.00 0.00 H new ATOM 0 HB3 ALA A 860 5.124 9.149 2.809 1.00 0.00 H new ATOM 1145 N LYS A 861 2.525 9.896 1.807 1.00 0.00 N ATOM 1146 CA LYS A 861 1.367 10.723 2.121 1.00 0.00 C ATOM 1147 C LYS A 861 0.158 10.285 1.300 1.00 0.00 C ATOM 1148 O LYS A 861 -0.941 10.107 1.832 1.00 0.00 O ATOM 1149 CB LYS A 861 1.680 12.196 1.837 1.00 0.00 C ATOM 1150 CG LYS A 861 0.635 13.162 2.375 1.00 0.00 C ATOM 1151 CD LYS A 861 0.623 13.180 3.897 1.00 0.00 C ATOM 1152 CE LYS A 861 1.953 13.661 4.461 1.00 0.00 C ATOM 1153 NZ LYS A 861 2.252 15.063 4.070 1.00 0.00 N ATOM 0 H LYS A 861 3.307 10.408 1.399 1.00 0.00 H new ATOM 0 HA LYS A 861 1.134 10.603 3.179 1.00 0.00 H new ATOM 0 HB2 LYS A 861 2.648 12.443 2.274 1.00 0.00 H new ATOM 0 HB3 LYS A 861 1.771 12.337 0.760 1.00 0.00 H new ATOM 0 HG2 LYS A 861 0.838 14.165 2.000 1.00 0.00 H new ATOM 0 HG3 LYS A 861 -0.350 12.877 2.006 1.00 0.00 H new ATOM 0 HD2 LYS A 861 -0.178 13.830 4.248 1.00 0.00 H new ATOM 0 HD3 LYS A 861 0.408 12.179 4.272 1.00 0.00 H new ATOM 0 HE2 LYS A 861 1.934 13.585 5.548 1.00 0.00 H new ATOM 0 HE3 LYS A 861 2.752 13.009 4.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 861 3.063 15.411 4.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 861 2.480 15.100 3.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 861 1.423 15.661 4.260 1.00 0.00 H new ATOM 1167 N ILE A 862 0.379 10.108 0.003 1.00 0.00 N ATOM 1168 CA ILE A 862 -0.669 9.669 -0.908 1.00 0.00 C ATOM 1169 C ILE A 862 -1.145 8.269 -0.538 1.00 0.00 C ATOM 1170 O ILE A 862 -2.349 8.004 -0.488 1.00 0.00 O ATOM 1171 CB ILE A 862 -0.177 9.677 -2.372 1.00 0.00 C ATOM 1172 CG1 ILE A 862 0.241 11.091 -2.780 1.00 0.00 C ATOM 1173 CG2 ILE A 862 -1.259 9.150 -3.308 1.00 0.00 C ATOM 1174 CD1 ILE A 862 0.918 11.158 -4.130 1.00 0.00 C ATOM 0 H ILE A 862 1.283 10.264 -0.444 1.00 0.00 H new ATOM 0 HA ILE A 862 -1.500 10.369 -0.817 1.00 0.00 H new ATOM 0 HB ILE A 862 0.689 9.019 -2.449 1.00 0.00 H new ATOM 0 HG12 ILE A 862 -0.641 11.732 -2.793 1.00 0.00 H new ATOM 0 HG13 ILE A 862 0.916 11.493 -2.024 1.00 0.00 H new ATOM 0 HG21 ILE A 862 -0.891 9.164 -4.334 1.00 0.00 H new ATOM 0 HG22 ILE A 862 -1.515 8.128 -3.029 1.00 0.00 H new ATOM 0 HG23 ILE A 862 -2.145 9.780 -3.231 1.00 0.00 H new ATOM 0 HD11 ILE A 862 1.186 12.191 -4.352 1.00 0.00 H new ATOM 0 HD12 ILE A 862 1.819 10.545 -4.116 1.00 0.00 H new ATOM 0 HD13 ILE A 862 0.238 10.787 -4.897 1.00 0.00 H new ATOM 1186 N LEU A 863 -0.191 7.386 -0.260 1.00 0.00 N ATOM 1187 CA LEU A 863 -0.491 6.011 0.107 1.00 0.00 C ATOM 1188 C LEU A 863 -1.343 5.936 1.369 1.00 0.00 C ATOM 1189 O LEU A 863 -2.437 5.368 1.351 1.00 0.00 O ATOM 1190 CB LEU A 863 0.807 5.221 0.301 1.00 0.00 C ATOM 1191 CG LEU A 863 0.664 3.906 1.069 1.00 0.00 C ATOM 1192 CD1 LEU A 863 -0.447 3.057 0.475 1.00 0.00 C ATOM 1193 CD2 LEU A 863 1.982 3.149 1.076 1.00 0.00 C ATOM 0 H LEU A 863 0.805 7.604 -0.283 1.00 0.00 H new ATOM 0 HA LEU A 863 -1.065 5.570 -0.708 1.00 0.00 H new ATOM 0 HB2 LEU A 863 1.232 5.006 -0.679 1.00 0.00 H new ATOM 0 HB3 LEU A 863 1.523 5.853 0.826 1.00 0.00 H new ATOM 0 HG LEU A 863 0.398 4.135 2.101 1.00 0.00 H new ATOM 0 HD11 LEU A 863 -0.533 2.126 1.035 1.00 0.00 H new ATOM 0 HD12 LEU A 863 -1.390 3.601 0.530 1.00 0.00 H new ATOM 0 HD13 LEU A 863 -0.217 2.834 -0.567 1.00 0.00 H new ATOM 0 HD21 LEU A 863 1.863 2.216 1.627 1.00 0.00 H new ATOM 0 HD22 LEU A 863 2.281 2.930 0.051 1.00 0.00 H new ATOM 0 HD23 LEU A 863 2.749 3.758 1.555 1.00 0.00 H new ATOM 1205 N ALA A 864 -0.844 6.512 2.455 1.00 0.00 N ATOM 1206 CA ALA A 864 -1.528 6.442 3.740 1.00 0.00 C ATOM 1207 C ALA A 864 -2.950 6.974 3.629 1.00 0.00 C ATOM 1208 O ALA A 864 -3.863 6.498 4.304 1.00 0.00 O ATOM 1209 CB ALA A 864 -0.747 7.210 4.793 1.00 0.00 C ATOM 0 H ALA A 864 0.033 7.033 2.472 1.00 0.00 H new ATOM 0 HA ALA A 864 -1.585 5.396 4.043 1.00 0.00 H new ATOM 0 HB1 ALA A 864 -1.268 7.150 5.748 1.00 0.00 H new ATOM 0 HB2 ALA A 864 0.248 6.778 4.895 1.00 0.00 H new ATOM 0 HB3 ALA A 864 -0.660 8.254 4.492 1.00 0.00 H new ATOM 1215 N ASP A 865 -3.136 7.934 2.736 1.00 0.00 N ATOM 1216 CA ASP A 865 -4.439 8.541 2.536 1.00 0.00 C ATOM 1217 C ASP A 865 -5.341 7.663 1.691 1.00 0.00 C ATOM 1218 O ASP A 865 -6.524 7.496 2.001 1.00 0.00 O ATOM 1219 CB ASP A 865 -4.287 9.925 1.903 1.00 0.00 C ATOM 1220 CG ASP A 865 -5.601 10.513 1.423 1.00 0.00 C ATOM 1221 OD1 ASP A 865 -6.351 11.063 2.254 1.00 0.00 O ATOM 1222 OD2 ASP A 865 -5.877 10.442 0.208 1.00 0.00 O ATOM 0 H ASP A 865 -2.399 8.309 2.139 1.00 0.00 H new ATOM 0 HA ASP A 865 -4.910 8.649 3.513 1.00 0.00 H new ATOM 0 HB2 ASP A 865 -3.838 10.602 2.630 1.00 0.00 H new ATOM 0 HB3 ASP A 865 -3.598 9.858 1.061 1.00 0.00 H new ATOM 1227 N ALA A 866 -4.785 7.092 0.639 1.00 0.00 N ATOM 1228 CA ALA A 866 -5.528 6.172 -0.199 1.00 0.00 C ATOM 1229 C ALA A 866 -5.966 4.961 0.615 1.00 0.00 C ATOM 1230 O ALA A 866 -6.982 4.335 0.324 1.00 0.00 O ATOM 1231 CB ALA A 866 -4.686 5.749 -1.388 1.00 0.00 C ATOM 0 H ALA A 866 -3.821 7.250 0.345 1.00 0.00 H new ATOM 0 HA ALA A 866 -6.420 6.674 -0.575 1.00 0.00 H new ATOM 0 HB1 ALA A 866 -5.255 5.058 -2.010 1.00 0.00 H new ATOM 0 HB2 ALA A 866 -4.417 6.628 -1.974 1.00 0.00 H new ATOM 0 HB3 ALA A 866 -3.780 5.257 -1.035 1.00 0.00 H new ATOM 1237 N THR A 867 -5.204 4.663 1.662 1.00 0.00 N ATOM 1238 CA THR A 867 -5.502 3.539 2.532 1.00 0.00 C ATOM 1239 C THR A 867 -6.711 3.834 3.415 1.00 0.00 C ATOM 1240 O THR A 867 -7.612 3.009 3.527 1.00 0.00 O ATOM 1241 CB THR A 867 -4.293 3.177 3.418 1.00 0.00 C ATOM 1242 OG1 THR A 867 -3.111 3.079 2.616 1.00 0.00 O ATOM 1243 CG2 THR A 867 -4.521 1.854 4.134 1.00 0.00 C ATOM 0 H THR A 867 -4.372 5.190 1.927 1.00 0.00 H new ATOM 0 HA THR A 867 -5.731 2.689 1.889 1.00 0.00 H new ATOM 0 HB THR A 867 -4.172 3.965 4.162 1.00 0.00 H new ATOM 0 HG1 THR A 867 -2.968 3.923 2.140 1.00 0.00 H new ATOM 0 HG21 THR A 867 -3.654 1.621 4.752 1.00 0.00 H new ATOM 0 HG22 THR A 867 -5.407 1.929 4.765 1.00 0.00 H new ATOM 0 HG23 THR A 867 -4.665 1.062 3.399 1.00 0.00 H new ATOM 1251 N ALA A 868 -6.730 5.012 4.030 1.00 0.00 N ATOM 1252 CA ALA A 868 -7.852 5.420 4.872 1.00 0.00 C ATOM 1253 C ALA A 868 -9.161 5.381 4.089 1.00 0.00 C ATOM 1254 O ALA A 868 -10.174 4.877 4.575 1.00 0.00 O ATOM 1255 CB ALA A 868 -7.608 6.809 5.437 1.00 0.00 C ATOM 0 H ALA A 868 -5.982 5.702 3.962 1.00 0.00 H new ATOM 0 HA ALA A 868 -7.934 4.716 5.700 1.00 0.00 H new ATOM 0 HB1 ALA A 868 -8.452 7.101 6.062 1.00 0.00 H new ATOM 0 HB2 ALA A 868 -6.697 6.803 6.036 1.00 0.00 H new ATOM 0 HB3 ALA A 868 -7.500 7.521 4.619 1.00 0.00 H new ATOM 1261 N LYS A 869 -9.128 5.901 2.866 1.00 0.00 N ATOM 1262 CA LYS A 869 -10.283 5.848 1.981 1.00 0.00 C ATOM 1263 C LYS A 869 -10.651 4.400 1.678 1.00 0.00 C ATOM 1264 O LYS A 869 -11.805 3.999 1.820 1.00 0.00 O ATOM 1265 CB LYS A 869 -9.988 6.595 0.679 1.00 0.00 C ATOM 1266 CG LYS A 869 -9.924 8.104 0.841 1.00 0.00 C ATOM 1267 CD LYS A 869 -11.308 8.712 1.001 1.00 0.00 C ATOM 1268 CE LYS A 869 -12.153 8.505 -0.247 1.00 0.00 C ATOM 1269 NZ LYS A 869 -13.496 9.126 -0.118 1.00 0.00 N ATOM 0 H LYS A 869 -8.312 6.364 2.466 1.00 0.00 H new ATOM 0 HA LYS A 869 -11.124 6.328 2.480 1.00 0.00 H new ATOM 0 HB2 LYS A 869 -9.040 6.241 0.275 1.00 0.00 H new ATOM 0 HB3 LYS A 869 -10.758 6.349 -0.053 1.00 0.00 H new ATOM 0 HG2 LYS A 869 -9.315 8.351 1.711 1.00 0.00 H new ATOM 0 HG3 LYS A 869 -9.432 8.543 -0.027 1.00 0.00 H new ATOM 0 HD2 LYS A 869 -11.808 8.262 1.859 1.00 0.00 H new ATOM 0 HD3 LYS A 869 -11.217 9.778 1.208 1.00 0.00 H new ATOM 0 HE2 LYS A 869 -11.638 8.930 -1.108 1.00 0.00 H new ATOM 0 HE3 LYS A 869 -12.264 7.437 -0.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 869 -14.039 8.962 -0.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 869 -13.998 8.703 0.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 869 -13.392 10.149 0.038 1.00 0.00 H new ATOM 1283 N MET A 870 -9.643 3.630 1.281 1.00 0.00 N ATOM 1284 CA MET A 870 -9.798 2.217 0.959 1.00 0.00 C ATOM 1285 C MET A 870 -10.426 1.437 2.109 1.00 0.00 C ATOM 1286 O MET A 870 -11.405 0.718 1.922 1.00 0.00 O ATOM 1287 CB MET A 870 -8.427 1.632 0.613 1.00 0.00 C ATOM 1288 CG MET A 870 -8.395 0.121 0.536 1.00 0.00 C ATOM 1289 SD MET A 870 -9.575 -0.535 -0.648 1.00 0.00 S ATOM 1290 CE MET A 870 -9.187 -2.273 -0.538 1.00 0.00 C ATOM 0 H MET A 870 -8.688 3.972 1.173 1.00 0.00 H new ATOM 0 HA MET A 870 -10.471 2.131 0.106 1.00 0.00 H new ATOM 0 HB2 MET A 870 -8.102 2.040 -0.344 1.00 0.00 H new ATOM 0 HB3 MET A 870 -7.705 1.961 1.361 1.00 0.00 H new ATOM 0 HG2 MET A 870 -7.391 -0.204 0.261 1.00 0.00 H new ATOM 0 HG3 MET A 870 -8.606 -0.294 1.522 1.00 0.00 H new ATOM 0 HE1 MET A 870 -9.951 -2.850 -1.058 1.00 0.00 H new ATOM 0 HE2 MET A 870 -8.216 -2.459 -0.998 1.00 0.00 H new ATOM 0 HE3 MET A 870 -9.156 -2.573 0.509 1.00 0.00 H new ATOM 1300 N VAL A 871 -9.860 1.595 3.295 1.00 0.00 N ATOM 1301 CA VAL A 871 -10.300 0.859 4.471 1.00 0.00 C ATOM 1302 C VAL A 871 -11.776 1.110 4.778 1.00 0.00 C ATOM 1303 O VAL A 871 -12.544 0.162 4.934 1.00 0.00 O ATOM 1304 CB VAL A 871 -9.423 1.209 5.695 1.00 0.00 C ATOM 1305 CG1 VAL A 871 -10.048 0.725 6.992 1.00 0.00 C ATOM 1306 CG2 VAL A 871 -8.041 0.605 5.523 1.00 0.00 C ATOM 0 H VAL A 871 -9.085 2.235 3.470 1.00 0.00 H new ATOM 0 HA VAL A 871 -10.186 -0.203 4.252 1.00 0.00 H new ATOM 0 HB VAL A 871 -9.344 2.295 5.754 1.00 0.00 H new ATOM 0 HG11 VAL A 871 -9.401 0.990 7.829 1.00 0.00 H new ATOM 0 HG12 VAL A 871 -11.023 1.195 7.124 1.00 0.00 H new ATOM 0 HG13 VAL A 871 -10.169 -0.358 6.956 1.00 0.00 H new ATOM 0 HG21 VAL A 871 -7.425 0.853 6.387 1.00 0.00 H new ATOM 0 HG22 VAL A 871 -8.126 -0.478 5.437 1.00 0.00 H new ATOM 0 HG23 VAL A 871 -7.579 1.006 4.621 1.00 0.00 H new ATOM 1316 N GLU A 872 -12.175 2.375 4.843 1.00 0.00 N ATOM 1317 CA GLU A 872 -13.564 2.709 5.140 1.00 0.00 C ATOM 1318 C GLU A 872 -14.495 2.202 4.041 1.00 0.00 C ATOM 1319 O GLU A 872 -15.594 1.722 4.319 1.00 0.00 O ATOM 1320 CB GLU A 872 -13.740 4.216 5.317 1.00 0.00 C ATOM 1321 CG GLU A 872 -12.911 4.802 6.447 1.00 0.00 C ATOM 1322 CD GLU A 872 -13.207 6.268 6.680 1.00 0.00 C ATOM 1323 OE1 GLU A 872 -12.877 7.093 5.802 1.00 0.00 O ATOM 1324 OE2 GLU A 872 -13.770 6.603 7.745 1.00 0.00 O ATOM 0 H GLU A 872 -11.565 3.179 4.696 1.00 0.00 H new ATOM 0 HA GLU A 872 -13.827 2.216 6.076 1.00 0.00 H new ATOM 0 HB2 GLU A 872 -13.472 4.715 4.386 1.00 0.00 H new ATOM 0 HB3 GLU A 872 -14.793 4.430 5.502 1.00 0.00 H new ATOM 0 HG2 GLU A 872 -13.106 4.245 7.363 1.00 0.00 H new ATOM 0 HG3 GLU A 872 -11.852 4.680 6.218 1.00 0.00 H new ATOM 1331 N ALA A 873 -14.043 2.298 2.796 1.00 0.00 N ATOM 1332 CA ALA A 873 -14.835 1.841 1.663 1.00 0.00 C ATOM 1333 C ALA A 873 -15.021 0.331 1.711 1.00 0.00 C ATOM 1334 O ALA A 873 -16.126 -0.172 1.513 1.00 0.00 O ATOM 1335 CB ALA A 873 -14.182 2.255 0.355 1.00 0.00 C ATOM 0 H ALA A 873 -13.134 2.688 2.547 1.00 0.00 H new ATOM 0 HA ALA A 873 -15.818 2.309 1.722 1.00 0.00 H new ATOM 0 HB1 ALA A 873 -14.788 1.905 -0.481 1.00 0.00 H new ATOM 0 HB2 ALA A 873 -14.103 3.341 0.316 1.00 0.00 H new ATOM 0 HB3 ALA A 873 -13.186 1.816 0.290 1.00 0.00 H new ATOM 1341 N ALA A 874 -13.934 -0.381 1.988 1.00 0.00 N ATOM 1342 CA ALA A 874 -13.970 -1.833 2.112 1.00 0.00 C ATOM 1343 C ALA A 874 -14.881 -2.252 3.256 1.00 0.00 C ATOM 1344 O ALA A 874 -15.688 -3.163 3.108 1.00 0.00 O ATOM 1345 CB ALA A 874 -12.565 -2.380 2.323 1.00 0.00 C ATOM 0 H ALA A 874 -13.011 0.028 2.132 1.00 0.00 H new ATOM 0 HA ALA A 874 -14.370 -2.248 1.187 1.00 0.00 H new ATOM 0 HB1 ALA A 874 -12.607 -3.465 2.414 1.00 0.00 H new ATOM 0 HB2 ALA A 874 -11.938 -2.111 1.473 1.00 0.00 H new ATOM 0 HB3 ALA A 874 -12.142 -1.956 3.234 1.00 0.00 H new ATOM 1351 N LYS A 875 -14.754 -1.573 4.391 1.00 0.00 N ATOM 1352 CA LYS A 875 -15.589 -1.861 5.552 1.00 0.00 C ATOM 1353 C LYS A 875 -17.067 -1.676 5.223 1.00 0.00 C ATOM 1354 O LYS A 875 -17.895 -2.542 5.519 1.00 0.00 O ATOM 1355 CB LYS A 875 -15.202 -0.965 6.732 1.00 0.00 C ATOM 1356 CG LYS A 875 -13.826 -1.266 7.305 1.00 0.00 C ATOM 1357 CD LYS A 875 -13.468 -0.344 8.466 1.00 0.00 C ATOM 1358 CE LYS A 875 -14.225 -0.689 9.746 1.00 0.00 C ATOM 1359 NZ LYS A 875 -15.679 -0.381 9.659 1.00 0.00 N ATOM 0 H LYS A 875 -14.081 -0.820 4.532 1.00 0.00 H new ATOM 0 HA LYS A 875 -15.423 -2.902 5.830 1.00 0.00 H new ATOM 0 HB2 LYS A 875 -15.232 0.076 6.411 1.00 0.00 H new ATOM 0 HB3 LYS A 875 -15.946 -1.077 7.521 1.00 0.00 H new ATOM 0 HG2 LYS A 875 -13.794 -2.302 7.643 1.00 0.00 H new ATOM 0 HG3 LYS A 875 -13.077 -1.164 6.519 1.00 0.00 H new ATOM 0 HD2 LYS A 875 -12.396 -0.404 8.655 1.00 0.00 H new ATOM 0 HD3 LYS A 875 -13.685 0.687 8.187 1.00 0.00 H new ATOM 0 HE2 LYS A 875 -14.096 -1.749 9.964 1.00 0.00 H new ATOM 0 HE3 LYS A 875 -13.791 -0.137 10.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 875 -16.022 -0.059 10.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 875 -15.834 0.367 8.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 875 -16.199 -1.236 9.376 1.00 0.00 H new ATOM 1373 N GLY A 876 -17.386 -0.553 4.593 1.00 0.00 N ATOM 1374 CA GLY A 876 -18.761 -0.259 4.250 1.00 0.00 C ATOM 1375 C GLY A 876 -19.306 -1.177 3.173 1.00 0.00 C ATOM 1376 O GLY A 876 -20.450 -1.616 3.257 1.00 0.00 O ATOM 0 H GLY A 876 -16.713 0.161 4.313 1.00 0.00 H new ATOM 0 HA2 GLY A 876 -19.380 -0.346 5.143 1.00 0.00 H new ATOM 0 HA3 GLY A 876 -18.833 0.774 3.911 1.00 0.00 H new ATOM 1380 N ALA A 877 -18.488 -1.476 2.168 1.00 0.00 N ATOM 1381 CA ALA A 877 -18.915 -2.318 1.055 1.00 0.00 C ATOM 1382 C ALA A 877 -19.051 -3.767 1.489 1.00 0.00 C ATOM 1383 O ALA A 877 -19.815 -4.534 0.907 1.00 0.00 O ATOM 1384 CB ALA A 877 -17.936 -2.208 -0.102 1.00 0.00 C ATOM 0 H ALA A 877 -17.525 -1.147 2.102 1.00 0.00 H new ATOM 0 HA ALA A 877 -19.892 -1.966 0.724 1.00 0.00 H new ATOM 0 HB1 ALA A 877 -18.270 -2.842 -0.923 1.00 0.00 H new ATOM 0 HB2 ALA A 877 -17.887 -1.173 -0.440 1.00 0.00 H new ATOM 0 HB3 ALA A 877 -16.948 -2.530 0.226 1.00 0.00 H new ATOM 1390 N ALA A 878 -18.295 -4.140 2.505 1.00 0.00 N ATOM 1391 CA ALA A 878 -18.357 -5.485 3.036 1.00 0.00 C ATOM 1392 C ALA A 878 -19.609 -5.676 3.871 1.00 0.00 C ATOM 1393 O ALA A 878 -20.493 -6.447 3.506 1.00 0.00 O ATOM 1394 CB ALA A 878 -17.123 -5.781 3.864 1.00 0.00 C ATOM 0 H ALA A 878 -17.630 -3.528 2.978 1.00 0.00 H new ATOM 0 HA ALA A 878 -18.394 -6.182 2.199 1.00 0.00 H new ATOM 0 HB1 ALA A 878 -17.183 -6.796 4.257 1.00 0.00 H new ATOM 0 HB2 ALA A 878 -16.235 -5.686 3.240 1.00 0.00 H new ATOM 0 HB3 ALA A 878 -17.062 -5.074 4.692 1.00 0.00 H new ATOM 1400 N ALA A 879 -19.689 -4.951 4.983 1.00 0.00 N ATOM 1401 CA ALA A 879 -20.793 -5.106 5.921 1.00 0.00 C ATOM 1402 C ALA A 879 -22.121 -4.725 5.275 1.00 0.00 C ATOM 1403 O ALA A 879 -23.177 -5.240 5.651 1.00 0.00 O ATOM 1404 CB ALA A 879 -20.535 -4.288 7.172 1.00 0.00 C ATOM 0 H ALA A 879 -19.000 -4.250 5.256 1.00 0.00 H new ATOM 0 HA ALA A 879 -20.860 -6.156 6.206 1.00 0.00 H new ATOM 0 HB1 ALA A 879 -21.367 -4.412 7.866 1.00 0.00 H new ATOM 0 HB2 ALA A 879 -19.614 -4.628 7.646 1.00 0.00 H new ATOM 0 HB3 ALA A 879 -20.439 -3.236 6.905 1.00 0.00 H new ATOM 1410 N HIS A 880 -22.067 -3.803 4.324 1.00 0.00 N ATOM 1411 CA HIS A 880 -23.215 -3.510 3.474 1.00 0.00 C ATOM 1412 C HIS A 880 -22.965 -4.068 2.075 1.00 0.00 C ATOM 1413 O HIS A 880 -22.547 -3.339 1.175 1.00 0.00 O ATOM 1414 CB HIS A 880 -23.488 -2.006 3.407 1.00 0.00 C ATOM 1415 CG HIS A 880 -23.966 -1.420 4.696 1.00 0.00 C ATOM 1416 ND1 HIS A 880 -25.277 -1.062 4.922 1.00 0.00 N ATOM 1417 CD2 HIS A 880 -23.297 -1.120 5.835 1.00 0.00 C ATOM 1418 CE1 HIS A 880 -25.394 -0.571 6.140 1.00 0.00 C ATOM 1419 NE2 HIS A 880 -24.209 -0.596 6.713 1.00 0.00 N ATOM 0 H HIS A 880 -21.239 -3.243 4.121 1.00 0.00 H new ATOM 0 HA HIS A 880 -24.096 -3.985 3.904 1.00 0.00 H new ATOM 0 HB2 HIS A 880 -22.575 -1.494 3.103 1.00 0.00 H new ATOM 0 HB3 HIS A 880 -24.233 -1.816 2.634 1.00 0.00 H new ATOM 0 HD2 HIS A 880 -22.243 -1.266 6.017 1.00 0.00 H new ATOM 0 HE1 HIS A 880 -26.307 -0.210 6.591 1.00 0.00 H new ATOM 0 HE2 HIS A 880 -24.003 -0.276 7.659 1.00 0.00 H new ATOM 1427 N PRO A 881 -23.207 -5.375 1.881 1.00 0.00 N ATOM 1428 CA PRO A 881 -22.812 -6.080 0.658 1.00 0.00 C ATOM 1429 C PRO A 881 -23.560 -5.589 -0.578 1.00 0.00 C ATOM 1430 O PRO A 881 -22.957 -5.292 -1.610 1.00 0.00 O ATOM 1431 CB PRO A 881 -23.172 -7.546 0.946 1.00 0.00 C ATOM 1432 CG PRO A 881 -23.390 -7.621 2.417 1.00 0.00 C ATOM 1433 CD PRO A 881 -23.891 -6.269 2.825 1.00 0.00 C ATOM 0 HA PRO A 881 -21.758 -5.920 0.433 1.00 0.00 H new ATOM 0 HB2 PRO A 881 -24.068 -7.844 0.401 1.00 0.00 H new ATOM 0 HB3 PRO A 881 -22.371 -8.216 0.633 1.00 0.00 H new ATOM 0 HG2 PRO A 881 -24.113 -8.398 2.666 1.00 0.00 H new ATOM 0 HG3 PRO A 881 -22.465 -7.869 2.937 1.00 0.00 H new ATOM 0 HD2 PRO A 881 -24.975 -6.196 2.739 1.00 0.00 H new ATOM 0 HD3 PRO A 881 -23.636 -6.038 3.859 1.00 0.00 H new ATOM 1441 N ASP A 882 -24.879 -5.504 -0.464 1.00 0.00 N ATOM 1442 CA ASP A 882 -25.733 -5.161 -1.599 1.00 0.00 C ATOM 1443 C ASP A 882 -25.696 -3.669 -1.919 1.00 0.00 C ATOM 1444 O ASP A 882 -26.247 -3.241 -2.932 1.00 0.00 O ATOM 1445 CB ASP A 882 -27.179 -5.591 -1.334 1.00 0.00 C ATOM 1446 CG ASP A 882 -27.823 -4.813 -0.206 1.00 0.00 C ATOM 1447 OD1 ASP A 882 -27.616 -5.178 0.971 1.00 0.00 O ATOM 1448 OD2 ASP A 882 -28.540 -3.830 -0.492 1.00 0.00 O ATOM 0 H ASP A 882 -25.385 -5.668 0.406 1.00 0.00 H new ATOM 0 HA ASP A 882 -25.342 -5.700 -2.462 1.00 0.00 H new ATOM 0 HB2 ASP A 882 -27.766 -5.458 -2.243 1.00 0.00 H new ATOM 0 HB3 ASP A 882 -27.199 -6.654 -1.094 1.00 0.00 H new ATOM 1453 N SER A 883 -25.056 -2.881 -1.064 1.00 0.00 N ATOM 1454 CA SER A 883 -25.017 -1.436 -1.248 1.00 0.00 C ATOM 1455 C SER A 883 -24.201 -1.054 -2.482 1.00 0.00 C ATOM 1456 O SER A 883 -22.973 -1.173 -2.496 1.00 0.00 O ATOM 1457 CB SER A 883 -24.451 -0.763 -0.002 1.00 0.00 C ATOM 1458 OG SER A 883 -25.255 -1.050 1.126 1.00 0.00 O ATOM 0 H SER A 883 -24.559 -3.217 -0.239 1.00 0.00 H new ATOM 0 HA SER A 883 -26.038 -1.087 -1.406 1.00 0.00 H new ATOM 0 HB2 SER A 883 -23.432 -1.108 0.173 1.00 0.00 H new ATOM 0 HB3 SER A 883 -24.401 0.315 -0.155 1.00 0.00 H new ATOM 0 HG SER A 883 -25.246 -0.284 1.738 1.00 0.00 H new ATOM 1464 N GLU A 884 -24.906 -0.598 -3.509 1.00 0.00 N ATOM 1465 CA GLU A 884 -24.305 -0.238 -4.788 1.00 0.00 C ATOM 1466 C GLU A 884 -23.231 0.826 -4.607 1.00 0.00 C ATOM 1467 O GLU A 884 -22.117 0.695 -5.118 1.00 0.00 O ATOM 1468 CB GLU A 884 -25.366 0.298 -5.762 1.00 0.00 C ATOM 1469 CG GLU A 884 -26.735 -0.358 -5.642 1.00 0.00 C ATOM 1470 CD GLU A 884 -27.541 0.179 -4.475 1.00 0.00 C ATOM 1471 OE1 GLU A 884 -28.052 1.316 -4.570 1.00 0.00 O ATOM 1472 OE2 GLU A 884 -27.666 -0.532 -3.455 1.00 0.00 O ATOM 0 H GLU A 884 -25.917 -0.466 -3.479 1.00 0.00 H new ATOM 0 HA GLU A 884 -23.856 -1.143 -5.197 1.00 0.00 H new ATOM 0 HB2 GLU A 884 -25.478 1.370 -5.601 1.00 0.00 H new ATOM 0 HB3 GLU A 884 -25.003 0.165 -6.781 1.00 0.00 H new ATOM 0 HG2 GLU A 884 -27.291 -0.200 -6.566 1.00 0.00 H new ATOM 0 HG3 GLU A 884 -26.609 -1.434 -5.526 1.00 0.00 H new ATOM 1479 N GLU A 885 -23.567 1.868 -3.859 1.00 0.00 N ATOM 1480 CA GLU A 885 -22.677 3.003 -3.693 1.00 0.00 C ATOM 1481 C GLU A 885 -21.439 2.606 -2.903 1.00 0.00 C ATOM 1482 O GLU A 885 -20.343 3.083 -3.181 1.00 0.00 O ATOM 1483 CB GLU A 885 -23.404 4.156 -3.005 1.00 0.00 C ATOM 1484 CG GLU A 885 -22.582 5.430 -2.921 1.00 0.00 C ATOM 1485 CD GLU A 885 -23.374 6.594 -2.372 1.00 0.00 C ATOM 1486 OE1 GLU A 885 -24.121 7.229 -3.146 1.00 0.00 O ATOM 1487 OE2 GLU A 885 -23.255 6.879 -1.163 1.00 0.00 O ATOM 0 H GLU A 885 -24.452 1.948 -3.358 1.00 0.00 H new ATOM 0 HA GLU A 885 -22.359 3.335 -4.681 1.00 0.00 H new ATOM 0 HB2 GLU A 885 -24.328 4.365 -3.544 1.00 0.00 H new ATOM 0 HB3 GLU A 885 -23.685 3.848 -1.998 1.00 0.00 H new ATOM 0 HG2 GLU A 885 -21.712 5.256 -2.288 1.00 0.00 H new ATOM 0 HG3 GLU A 885 -22.209 5.684 -3.913 1.00 0.00 H new ATOM 1494 N GLN A 886 -21.610 1.720 -1.932 1.00 0.00 N ATOM 1495 CA GLN A 886 -20.484 1.245 -1.139 1.00 0.00 C ATOM 1496 C GLN A 886 -19.517 0.461 -2.012 1.00 0.00 C ATOM 1497 O GLN A 886 -18.300 0.609 -1.893 1.00 0.00 O ATOM 1498 CB GLN A 886 -20.962 0.386 0.029 1.00 0.00 C ATOM 1499 CG GLN A 886 -21.688 1.179 1.099 1.00 0.00 C ATOM 1500 CD GLN A 886 -20.826 2.272 1.706 1.00 0.00 C ATOM 1501 OE1 GLN A 886 -19.523 2.035 1.789 1.00 0.00 O flip ATOM 1502 NE2 GLN A 886 -21.330 3.318 2.104 1.00 0.00 N flip ATOM 0 H GLN A 886 -22.511 1.317 -1.675 1.00 0.00 H new ATOM 0 HA GLN A 886 -19.965 2.113 -0.731 1.00 0.00 H new ATOM 0 HB2 GLN A 886 -21.625 -0.393 -0.349 1.00 0.00 H new ATOM 0 HB3 GLN A 886 -20.104 -0.115 0.477 1.00 0.00 H new ATOM 0 HG2 GLN A 886 -22.584 1.626 0.669 1.00 0.00 H new ATOM 0 HG3 GLN A 886 -22.017 0.502 1.887 1.00 0.00 H new ATOM 0 HE21 GLN A 886 -22.336 3.463 2.023 1.00 0.00 H new ATOM 0 HE22 GLN A 886 -20.742 4.043 2.516 1.00 0.00 H new ATOM 1511 N GLN A 887 -20.068 -0.360 -2.899 1.00 0.00 N ATOM 1512 CA GLN A 887 -19.260 -1.101 -3.857 1.00 0.00 C ATOM 1513 C GLN A 887 -18.522 -0.136 -4.775 1.00 0.00 C ATOM 1514 O GLN A 887 -17.333 -0.301 -5.046 1.00 0.00 O ATOM 1515 CB GLN A 887 -20.138 -2.047 -4.683 1.00 0.00 C ATOM 1516 CG GLN A 887 -20.821 -3.120 -3.852 1.00 0.00 C ATOM 1517 CD GLN A 887 -19.831 -3.994 -3.112 1.00 0.00 C ATOM 1518 OE1 GLN A 887 -18.714 -4.208 -3.575 1.00 0.00 O ATOM 1519 NE2 GLN A 887 -20.238 -4.508 -1.965 1.00 0.00 N ATOM 0 H GLN A 887 -21.071 -0.528 -2.974 1.00 0.00 H new ATOM 0 HA GLN A 887 -18.531 -1.697 -3.308 1.00 0.00 H new ATOM 0 HB2 GLN A 887 -20.897 -1.463 -5.204 1.00 0.00 H new ATOM 0 HB3 GLN A 887 -19.525 -2.525 -5.447 1.00 0.00 H new ATOM 0 HG2 GLN A 887 -21.492 -2.648 -3.134 1.00 0.00 H new ATOM 0 HG3 GLN A 887 -21.436 -3.742 -4.502 1.00 0.00 H new ATOM 0 HE21 GLN A 887 -21.175 -4.303 -1.618 1.00 0.00 H new ATOM 0 HE22 GLN A 887 -19.615 -5.110 -1.426 1.00 0.00 H new ATOM 1528 N GLN A 888 -19.236 0.888 -5.228 1.00 0.00 N ATOM 1529 CA GLN A 888 -18.658 1.917 -6.083 1.00 0.00 C ATOM 1530 C GLN A 888 -17.529 2.653 -5.360 1.00 0.00 C ATOM 1531 O GLN A 888 -16.452 2.860 -5.926 1.00 0.00 O ATOM 1532 CB GLN A 888 -19.742 2.901 -6.524 1.00 0.00 C ATOM 1533 CG GLN A 888 -19.225 4.002 -7.429 1.00 0.00 C ATOM 1534 CD GLN A 888 -18.594 3.472 -8.703 1.00 0.00 C ATOM 1535 OE1 GLN A 888 -18.983 2.426 -9.222 1.00 0.00 O ATOM 1536 NE2 GLN A 888 -17.604 4.192 -9.206 1.00 0.00 N ATOM 0 H GLN A 888 -20.224 1.028 -5.015 1.00 0.00 H new ATOM 0 HA GLN A 888 -18.237 1.437 -6.967 1.00 0.00 H new ATOM 0 HB2 GLN A 888 -20.529 2.354 -7.043 1.00 0.00 H new ATOM 0 HB3 GLN A 888 -20.195 3.350 -5.640 1.00 0.00 H new ATOM 0 HG2 GLN A 888 -20.047 4.669 -7.687 1.00 0.00 H new ATOM 0 HG3 GLN A 888 -18.491 4.597 -6.886 1.00 0.00 H new ATOM 0 HE21 GLN A 888 -17.313 5.053 -8.743 1.00 0.00 H new ATOM 0 HE22 GLN A 888 -17.132 3.886 -10.056 1.00 0.00 H new ATOM 1545 N ARG A 889 -17.778 3.034 -4.107 1.00 0.00 N ATOM 1546 CA ARG A 889 -16.763 3.685 -3.281 1.00 0.00 C ATOM 1547 C ARG A 889 -15.510 2.827 -3.208 1.00 0.00 C ATOM 1548 O ARG A 889 -14.394 3.327 -3.342 1.00 0.00 O ATOM 1549 CB ARG A 889 -17.279 3.926 -1.858 1.00 0.00 C ATOM 1550 CG ARG A 889 -18.436 4.905 -1.763 1.00 0.00 C ATOM 1551 CD ARG A 889 -18.913 5.042 -0.326 1.00 0.00 C ATOM 1552 NE ARG A 889 -20.089 5.902 -0.214 1.00 0.00 N ATOM 1553 CZ ARG A 889 -20.485 6.479 0.920 1.00 0.00 C ATOM 1554 NH1 ARG A 889 -19.805 6.287 2.047 1.00 0.00 N ATOM 1555 NH2 ARG A 889 -21.573 7.233 0.929 1.00 0.00 N ATOM 0 H ARG A 889 -18.676 2.902 -3.642 1.00 0.00 H new ATOM 0 HA ARG A 889 -16.530 4.644 -3.744 1.00 0.00 H new ATOM 0 HB2 ARG A 889 -17.591 2.972 -1.432 1.00 0.00 H new ATOM 0 HB3 ARG A 889 -16.457 4.295 -1.245 1.00 0.00 H new ATOM 0 HG2 ARG A 889 -18.126 5.879 -2.142 1.00 0.00 H new ATOM 0 HG3 ARG A 889 -19.258 4.565 -2.393 1.00 0.00 H new ATOM 0 HD2 ARG A 889 -19.148 4.055 0.073 1.00 0.00 H new ATOM 0 HD3 ARG A 889 -18.108 5.449 0.285 1.00 0.00 H new ATOM 0 HE ARG A 889 -20.640 6.071 -1.055 1.00 0.00 H new ATOM 0 HH11 ARG A 889 -18.974 5.695 2.047 1.00 0.00 H new ATOM 0 HH12 ARG A 889 -20.114 6.732 2.911 1.00 0.00 H new ATOM 0 HH21 ARG A 889 -22.105 7.371 0.070 1.00 0.00 H new ATOM 0 HH22 ARG A 889 -21.879 7.676 1.795 1.00 0.00 H new ATOM 1569 N LEU A 890 -15.707 1.532 -3.005 1.00 0.00 N ATOM 1570 CA LEU A 890 -14.600 0.598 -2.886 1.00 0.00 C ATOM 1571 C LEU A 890 -13.832 0.483 -4.197 1.00 0.00 C ATOM 1572 O LEU A 890 -12.606 0.458 -4.197 1.00 0.00 O ATOM 1573 CB LEU A 890 -15.109 -0.775 -2.445 1.00 0.00 C ATOM 1574 CG LEU A 890 -14.027 -1.843 -2.263 1.00 0.00 C ATOM 1575 CD1 LEU A 890 -12.965 -1.371 -1.282 1.00 0.00 C ATOM 1576 CD2 LEU A 890 -14.650 -3.141 -1.783 1.00 0.00 C ATOM 0 H LEU A 890 -16.629 1.104 -2.919 1.00 0.00 H new ATOM 0 HA LEU A 890 -13.916 0.981 -2.129 1.00 0.00 H new ATOM 0 HB2 LEU A 890 -15.646 -0.661 -1.503 1.00 0.00 H new ATOM 0 HB3 LEU A 890 -15.829 -1.132 -3.181 1.00 0.00 H new ATOM 0 HG LEU A 890 -13.548 -2.018 -3.226 1.00 0.00 H new ATOM 0 HD11 LEU A 890 -12.206 -2.145 -1.167 1.00 0.00 H new ATOM 0 HD12 LEU A 890 -12.500 -0.460 -1.659 1.00 0.00 H new ATOM 0 HD13 LEU A 890 -13.427 -1.169 -0.315 1.00 0.00 H new ATOM 0 HD21 LEU A 890 -13.872 -3.893 -1.657 1.00 0.00 H new ATOM 0 HD22 LEU A 890 -15.151 -2.973 -0.829 1.00 0.00 H new ATOM 0 HD23 LEU A 890 -15.376 -3.490 -2.518 1.00 0.00 H new ATOM 1588 N ARG A 891 -14.551 0.433 -5.312 1.00 0.00 N ATOM 1589 CA ARG A 891 -13.910 0.329 -6.621 1.00 0.00 C ATOM 1590 C ARG A 891 -13.020 1.539 -6.891 1.00 0.00 C ATOM 1591 O ARG A 891 -11.999 1.432 -7.569 1.00 0.00 O ATOM 1592 CB ARG A 891 -14.952 0.190 -7.731 1.00 0.00 C ATOM 1593 CG ARG A 891 -15.779 -1.080 -7.629 1.00 0.00 C ATOM 1594 CD ARG A 891 -16.673 -1.261 -8.844 1.00 0.00 C ATOM 1595 NE ARG A 891 -15.902 -1.521 -10.061 1.00 0.00 N ATOM 1596 CZ ARG A 891 -16.454 -1.759 -11.253 1.00 0.00 C ATOM 1597 NH1 ARG A 891 -17.775 -1.734 -11.392 1.00 0.00 N ATOM 1598 NH2 ARG A 891 -15.689 -2.023 -12.305 1.00 0.00 N ATOM 0 H ARG A 891 -15.570 0.462 -5.339 1.00 0.00 H new ATOM 0 HA ARG A 891 -13.288 -0.566 -6.613 1.00 0.00 H new ATOM 0 HB2 ARG A 891 -15.619 1.052 -7.703 1.00 0.00 H new ATOM 0 HB3 ARG A 891 -14.447 0.209 -8.697 1.00 0.00 H new ATOM 0 HG2 ARG A 891 -15.116 -1.940 -7.532 1.00 0.00 H new ATOM 0 HG3 ARG A 891 -16.391 -1.046 -6.728 1.00 0.00 H new ATOM 0 HD2 ARG A 891 -17.361 -2.088 -8.667 1.00 0.00 H new ATOM 0 HD3 ARG A 891 -17.280 -0.366 -8.984 1.00 0.00 H new ATOM 0 HE ARG A 891 -14.884 -1.520 -9.994 1.00 0.00 H new ATOM 0 HH11 ARG A 891 -18.369 -1.533 -10.587 1.00 0.00 H new ATOM 0 HH12 ARG A 891 -18.195 -1.916 -12.303 1.00 0.00 H new ATOM 0 HH21 ARG A 891 -14.674 -2.045 -12.205 1.00 0.00 H new ATOM 0 HH22 ARG A 891 -16.116 -2.204 -13.213 1.00 0.00 H new ATOM 1612 N GLU A 892 -13.406 2.688 -6.358 1.00 0.00 N ATOM 1613 CA GLU A 892 -12.599 3.890 -6.487 1.00 0.00 C ATOM 1614 C GLU A 892 -11.454 3.890 -5.478 1.00 0.00 C ATOM 1615 O GLU A 892 -10.301 4.147 -5.832 1.00 0.00 O ATOM 1616 CB GLU A 892 -13.460 5.138 -6.299 1.00 0.00 C ATOM 1617 CG GLU A 892 -14.389 5.417 -7.467 1.00 0.00 C ATOM 1618 CD GLU A 892 -13.637 5.567 -8.774 1.00 0.00 C ATOM 1619 OE1 GLU A 892 -12.922 6.578 -8.945 1.00 0.00 O ATOM 1620 OE2 GLU A 892 -13.741 4.666 -9.628 1.00 0.00 O ATOM 0 H GLU A 892 -14.272 2.813 -5.833 1.00 0.00 H new ATOM 0 HA GLU A 892 -12.175 3.902 -7.491 1.00 0.00 H new ATOM 0 HB2 GLU A 892 -14.054 5.026 -5.392 1.00 0.00 H new ATOM 0 HB3 GLU A 892 -12.809 5.999 -6.150 1.00 0.00 H new ATOM 0 HG2 GLU A 892 -15.111 4.605 -7.556 1.00 0.00 H new ATOM 0 HG3 GLU A 892 -14.955 6.327 -7.269 1.00 0.00 H new ATOM 1627 N ALA A 893 -11.777 3.582 -4.231 1.00 0.00 N ATOM 1628 CA ALA A 893 -10.805 3.623 -3.147 1.00 0.00 C ATOM 1629 C ALA A 893 -9.717 2.570 -3.318 1.00 0.00 C ATOM 1630 O ALA A 893 -8.534 2.858 -3.129 1.00 0.00 O ATOM 1631 CB ALA A 893 -11.504 3.444 -1.812 1.00 0.00 C ATOM 0 H ALA A 893 -12.713 3.298 -3.942 1.00 0.00 H new ATOM 0 HA ALA A 893 -10.322 4.600 -3.174 1.00 0.00 H new ATOM 0 HB1 ALA A 893 -10.768 3.476 -1.009 1.00 0.00 H new ATOM 0 HB2 ALA A 893 -12.230 4.245 -1.671 1.00 0.00 H new ATOM 0 HB3 ALA A 893 -12.017 2.482 -1.796 1.00 0.00 H new ATOM 1637 N ALA A 894 -10.114 1.356 -3.682 1.00 0.00 N ATOM 1638 CA ALA A 894 -9.165 0.262 -3.839 1.00 0.00 C ATOM 1639 C ALA A 894 -8.183 0.552 -4.961 1.00 0.00 C ATOM 1640 O ALA A 894 -6.990 0.311 -4.818 1.00 0.00 O ATOM 1641 CB ALA A 894 -9.884 -1.057 -4.087 1.00 0.00 C ATOM 0 H ALA A 894 -11.084 1.106 -3.873 1.00 0.00 H new ATOM 0 HA ALA A 894 -8.605 0.173 -2.908 1.00 0.00 H new ATOM 0 HB1 ALA A 894 -9.151 -1.855 -4.200 1.00 0.00 H new ATOM 0 HB2 ALA A 894 -10.536 -1.280 -3.243 1.00 0.00 H new ATOM 0 HB3 ALA A 894 -10.481 -0.981 -4.996 1.00 0.00 H new ATOM 1647 N GLU A 895 -8.685 1.087 -6.068 1.00 0.00 N ATOM 1648 CA GLU A 895 -7.830 1.468 -7.186 1.00 0.00 C ATOM 1649 C GLU A 895 -6.902 2.610 -6.785 1.00 0.00 C ATOM 1650 O GLU A 895 -5.766 2.689 -7.248 1.00 0.00 O ATOM 1651 CB GLU A 895 -8.670 1.870 -8.397 1.00 0.00 C ATOM 1652 CG GLU A 895 -9.378 0.704 -9.068 1.00 0.00 C ATOM 1653 CD GLU A 895 -8.420 -0.246 -9.760 1.00 0.00 C ATOM 1654 OE1 GLU A 895 -8.030 0.021 -10.913 1.00 0.00 O ATOM 1655 OE2 GLU A 895 -8.033 -1.258 -9.142 1.00 0.00 O ATOM 0 H GLU A 895 -9.678 1.267 -6.215 1.00 0.00 H new ATOM 0 HA GLU A 895 -7.223 0.605 -7.459 1.00 0.00 H new ATOM 0 HB2 GLU A 895 -9.414 2.603 -8.084 1.00 0.00 H new ATOM 0 HB3 GLU A 895 -8.026 2.361 -9.127 1.00 0.00 H new ATOM 0 HG2 GLU A 895 -9.951 0.155 -8.321 1.00 0.00 H new ATOM 0 HG3 GLU A 895 -10.091 1.089 -9.797 1.00 0.00 H new ATOM 1662 N GLY A 896 -7.391 3.488 -5.918 1.00 0.00 N ATOM 1663 CA GLY A 896 -6.568 4.567 -5.408 1.00 0.00 C ATOM 1664 C GLY A 896 -5.439 4.043 -4.545 1.00 0.00 C ATOM 1665 O GLY A 896 -4.275 4.381 -4.759 1.00 0.00 O ATOM 0 H GLY A 896 -8.345 3.471 -5.558 1.00 0.00 H new ATOM 0 HA2 GLY A 896 -6.156 5.137 -6.241 1.00 0.00 H new ATOM 0 HA3 GLY A 896 -7.184 5.252 -4.826 1.00 0.00 H new ATOM 1669 N LEU A 897 -5.795 3.203 -3.579 1.00 0.00 N ATOM 1670 CA LEU A 897 -4.821 2.543 -2.713 1.00 0.00 C ATOM 1671 C LEU A 897 -3.834 1.744 -3.561 1.00 0.00 C ATOM 1672 O LEU A 897 -2.618 1.810 -3.364 1.00 0.00 O ATOM 1673 CB LEU A 897 -5.574 1.636 -1.720 1.00 0.00 C ATOM 1674 CG LEU A 897 -4.734 0.870 -0.682 1.00 0.00 C ATOM 1675 CD1 LEU A 897 -4.152 -0.406 -1.274 1.00 0.00 C ATOM 1676 CD2 LEU A 897 -3.627 1.753 -0.130 1.00 0.00 C ATOM 0 H LEU A 897 -6.764 2.960 -3.373 1.00 0.00 H new ATOM 0 HA LEU A 897 -4.251 3.282 -2.149 1.00 0.00 H new ATOM 0 HB2 LEU A 897 -6.295 2.252 -1.182 1.00 0.00 H new ATOM 0 HB3 LEU A 897 -6.144 0.907 -2.296 1.00 0.00 H new ATOM 0 HG LEU A 897 -5.395 0.589 0.137 1.00 0.00 H new ATOM 0 HD11 LEU A 897 -3.564 -0.924 -0.516 1.00 0.00 H new ATOM 0 HD12 LEU A 897 -4.962 -1.053 -1.610 1.00 0.00 H new ATOM 0 HD13 LEU A 897 -3.512 -0.156 -2.120 1.00 0.00 H new ATOM 0 HD21 LEU A 897 -3.045 1.192 0.602 1.00 0.00 H new ATOM 0 HD22 LEU A 897 -2.976 2.072 -0.944 1.00 0.00 H new ATOM 0 HD23 LEU A 897 -4.065 2.629 0.349 1.00 0.00 H new ATOM 1688 N ARG A 898 -4.386 1.009 -4.510 1.00 0.00 N ATOM 1689 CA ARG A 898 -3.618 0.195 -5.438 1.00 0.00 C ATOM 1690 C ARG A 898 -2.589 1.046 -6.178 1.00 0.00 C ATOM 1691 O ARG A 898 -1.399 0.744 -6.159 1.00 0.00 O ATOM 1692 CB ARG A 898 -4.597 -0.425 -6.428 1.00 0.00 C ATOM 1693 CG ARG A 898 -4.127 -1.688 -7.116 1.00 0.00 C ATOM 1694 CD ARG A 898 -5.248 -2.220 -7.991 1.00 0.00 C ATOM 1695 NE ARG A 898 -4.997 -3.559 -8.508 1.00 0.00 N ATOM 1696 CZ ARG A 898 -5.661 -4.076 -9.538 1.00 0.00 C ATOM 1697 NH1 ARG A 898 -6.598 -3.364 -10.150 1.00 0.00 N ATOM 1698 NH2 ARG A 898 -5.426 -5.317 -9.937 1.00 0.00 N ATOM 0 H ARG A 898 -5.394 0.959 -4.661 1.00 0.00 H new ATOM 0 HA ARG A 898 -3.076 -0.580 -4.897 1.00 0.00 H new ATOM 0 HB2 ARG A 898 -5.526 -0.645 -5.902 1.00 0.00 H new ATOM 0 HB3 ARG A 898 -4.831 0.317 -7.192 1.00 0.00 H new ATOM 0 HG2 ARG A 898 -3.244 -1.481 -7.720 1.00 0.00 H new ATOM 0 HG3 ARG A 898 -3.840 -2.435 -6.376 1.00 0.00 H new ATOM 0 HD2 ARG A 898 -6.174 -2.229 -7.416 1.00 0.00 H new ATOM 0 HD3 ARG A 898 -5.399 -1.538 -8.828 1.00 0.00 H new ATOM 0 HE ARG A 898 -4.278 -4.127 -8.059 1.00 0.00 H new ATOM 0 HH11 ARG A 898 -6.810 -2.419 -9.831 1.00 0.00 H new ATOM 0 HH12 ARG A 898 -7.106 -3.762 -10.940 1.00 0.00 H new ATOM 0 HH21 ARG A 898 -4.731 -5.885 -9.453 1.00 0.00 H new ATOM 0 HH22 ARG A 898 -5.940 -5.704 -10.728 1.00 0.00 H new ATOM 1712 N MET A 899 -3.060 2.123 -6.801 1.00 0.00 N ATOM 1713 CA MET A 899 -2.201 3.011 -7.576 1.00 0.00 C ATOM 1714 C MET A 899 -1.156 3.683 -6.693 1.00 0.00 C ATOM 1715 O MET A 899 0.014 3.759 -7.058 1.00 0.00 O ATOM 1716 CB MET A 899 -3.039 4.076 -8.286 1.00 0.00 C ATOM 1717 CG MET A 899 -2.218 5.063 -9.101 1.00 0.00 C ATOM 1718 SD MET A 899 -3.227 6.349 -9.864 1.00 0.00 S ATOM 1719 CE MET A 899 -3.942 7.127 -8.416 1.00 0.00 C ATOM 0 H MET A 899 -4.041 2.403 -6.783 1.00 0.00 H new ATOM 0 HA MET A 899 -1.683 2.404 -8.319 1.00 0.00 H new ATOM 0 HB2 MET A 899 -3.754 3.583 -8.944 1.00 0.00 H new ATOM 0 HB3 MET A 899 -3.616 4.625 -7.542 1.00 0.00 H new ATOM 0 HG2 MET A 899 -1.472 5.528 -8.456 1.00 0.00 H new ATOM 0 HG3 MET A 899 -1.676 4.524 -9.878 1.00 0.00 H new ATOM 0 HE1 MET A 899 -4.258 8.140 -8.666 1.00 0.00 H new ATOM 0 HE2 MET A 899 -4.804 6.550 -8.081 1.00 0.00 H new ATOM 0 HE3 MET A 899 -3.199 7.165 -7.619 1.00 0.00 H new ATOM 1729 N ALA A 900 -1.584 4.167 -5.533 1.00 0.00 N ATOM 1730 CA ALA A 900 -0.683 4.846 -4.605 1.00 0.00 C ATOM 1731 C ALA A 900 0.446 3.923 -4.168 1.00 0.00 C ATOM 1732 O ALA A 900 1.615 4.308 -4.167 1.00 0.00 O ATOM 1733 CB ALA A 900 -1.454 5.349 -3.395 1.00 0.00 C ATOM 0 H ALA A 900 -2.550 4.103 -5.211 1.00 0.00 H new ATOM 0 HA ALA A 900 -0.242 5.699 -5.121 1.00 0.00 H new ATOM 0 HB1 ALA A 900 -0.770 5.853 -2.712 1.00 0.00 H new ATOM 0 HB2 ALA A 900 -2.224 6.049 -3.719 1.00 0.00 H new ATOM 0 HB3 ALA A 900 -1.921 4.506 -2.885 1.00 0.00 H new ATOM 1739 N THR A 901 0.089 2.697 -3.811 1.00 0.00 N ATOM 1740 CA THR A 901 1.069 1.713 -3.390 1.00 0.00 C ATOM 1741 C THR A 901 1.943 1.285 -4.564 1.00 0.00 C ATOM 1742 O THR A 901 3.157 1.147 -4.431 1.00 0.00 O ATOM 1743 CB THR A 901 0.389 0.473 -2.789 1.00 0.00 C ATOM 1744 OG1 THR A 901 -0.583 0.869 -1.817 1.00 0.00 O ATOM 1745 CG2 THR A 901 1.421 -0.431 -2.136 1.00 0.00 C ATOM 0 H THR A 901 -0.875 2.362 -3.806 1.00 0.00 H new ATOM 0 HA THR A 901 1.691 2.181 -2.626 1.00 0.00 H new ATOM 0 HB THR A 901 -0.106 -0.074 -3.592 1.00 0.00 H new ATOM 0 HG1 THR A 901 -1.418 1.111 -2.269 1.00 0.00 H new ATOM 0 HG21 THR A 901 0.924 -1.305 -1.715 1.00 0.00 H new ATOM 0 HG22 THR A 901 2.148 -0.751 -2.882 1.00 0.00 H new ATOM 0 HG23 THR A 901 1.932 0.114 -1.342 1.00 0.00 H new ATOM 1753 N ASN A 902 1.310 1.084 -5.713 1.00 0.00 N ATOM 1754 CA ASN A 902 2.009 0.677 -6.920 1.00 0.00 C ATOM 1755 C ASN A 902 3.037 1.734 -7.323 1.00 0.00 C ATOM 1756 O ASN A 902 4.164 1.412 -7.701 1.00 0.00 O ATOM 1757 CB ASN A 902 1.011 0.456 -8.058 1.00 0.00 C ATOM 1758 CG ASN A 902 1.669 -0.100 -9.304 1.00 0.00 C ATOM 1759 OD1 ASN A 902 2.112 0.647 -10.178 1.00 0.00 O ATOM 1760 ND2 ASN A 902 1.722 -1.417 -9.403 1.00 0.00 N ATOM 0 H ASN A 902 0.303 1.198 -5.832 1.00 0.00 H new ATOM 0 HA ASN A 902 2.531 -0.259 -6.720 1.00 0.00 H new ATOM 0 HB2 ASN A 902 0.231 -0.229 -7.726 1.00 0.00 H new ATOM 0 HB3 ASN A 902 0.524 1.401 -8.299 1.00 0.00 H new ATOM 0 HD21 ASN A 902 2.141 -1.850 -10.226 1.00 0.00 H new ATOM 0 HD22 ASN A 902 1.344 -2.000 -8.657 1.00 0.00 H new ATOM 1767 N ALA A 903 2.639 2.999 -7.226 1.00 0.00 N ATOM 1768 CA ALA A 903 3.536 4.108 -7.512 1.00 0.00 C ATOM 1769 C ALA A 903 4.698 4.119 -6.537 1.00 0.00 C ATOM 1770 O ALA A 903 5.845 4.226 -6.947 1.00 0.00 O ATOM 1771 CB ALA A 903 2.793 5.431 -7.450 1.00 0.00 C ATOM 0 H ALA A 903 1.698 3.280 -6.950 1.00 0.00 H new ATOM 0 HA ALA A 903 3.926 3.975 -8.521 1.00 0.00 H new ATOM 0 HB1 ALA A 903 3.483 6.246 -7.667 1.00 0.00 H new ATOM 0 HB2 ALA A 903 1.988 5.431 -8.185 1.00 0.00 H new ATOM 0 HB3 ALA A 903 2.374 5.566 -6.453 1.00 0.00 H new ATOM 1777 N ALA A 904 4.395 3.994 -5.246 1.00 0.00 N ATOM 1778 CA ALA A 904 5.427 3.953 -4.212 1.00 0.00 C ATOM 1779 C ALA A 904 6.379 2.787 -4.451 1.00 0.00 C ATOM 1780 O ALA A 904 7.580 2.883 -4.192 1.00 0.00 O ATOM 1781 CB ALA A 904 4.792 3.850 -2.832 1.00 0.00 C ATOM 0 H ALA A 904 3.442 3.919 -4.891 1.00 0.00 H new ATOM 0 HA ALA A 904 6.001 4.879 -4.260 1.00 0.00 H new ATOM 0 HB1 ALA A 904 5.574 3.820 -2.073 1.00 0.00 H new ATOM 0 HB2 ALA A 904 4.152 4.716 -2.660 1.00 0.00 H new ATOM 0 HB3 ALA A 904 4.195 2.940 -2.773 1.00 0.00 H new ATOM 1787 N ALA A 905 5.828 1.694 -4.961 1.00 0.00 N ATOM 1788 CA ALA A 905 6.606 0.515 -5.313 1.00 0.00 C ATOM 1789 C ALA A 905 7.661 0.850 -6.359 1.00 0.00 C ATOM 1790 O ALA A 905 8.849 0.599 -6.167 1.00 0.00 O ATOM 1791 CB ALA A 905 5.686 -0.576 -5.838 1.00 0.00 C ATOM 0 H ALA A 905 4.829 1.600 -5.142 1.00 0.00 H new ATOM 0 HA ALA A 905 7.113 0.160 -4.416 1.00 0.00 H new ATOM 0 HB1 ALA A 905 6.276 -1.455 -6.099 1.00 0.00 H new ATOM 0 HB2 ALA A 905 4.960 -0.841 -5.069 1.00 0.00 H new ATOM 0 HB3 ALA A 905 5.161 -0.215 -6.723 1.00 0.00 H new ATOM 1797 N GLN A 906 7.213 1.437 -7.460 1.00 0.00 N ATOM 1798 CA GLN A 906 8.094 1.767 -8.568 1.00 0.00 C ATOM 1799 C GLN A 906 8.932 3.005 -8.247 1.00 0.00 C ATOM 1800 O GLN A 906 10.003 3.217 -8.819 1.00 0.00 O ATOM 1801 CB GLN A 906 7.264 1.988 -9.833 1.00 0.00 C ATOM 1802 CG GLN A 906 8.094 2.107 -11.096 1.00 0.00 C ATOM 1803 CD GLN A 906 8.950 0.878 -11.361 1.00 0.00 C ATOM 1804 OE1 GLN A 906 8.455 -0.293 -10.985 1.00 0.00 O flip ATOM 1805 NE2 GLN A 906 10.045 0.980 -11.917 1.00 0.00 N flip ATOM 0 H GLN A 906 6.238 1.695 -7.609 1.00 0.00 H new ATOM 0 HA GLN A 906 8.780 0.936 -8.734 1.00 0.00 H new ATOM 0 HB2 GLN A 906 6.564 1.160 -9.946 1.00 0.00 H new ATOM 0 HB3 GLN A 906 6.670 2.894 -9.713 1.00 0.00 H new ATOM 0 HG2 GLN A 906 7.431 2.272 -11.946 1.00 0.00 H new ATOM 0 HG3 GLN A 906 8.739 2.983 -11.020 1.00 0.00 H new ATOM 0 HE21 GLN A 906 10.394 1.898 -12.192 1.00 0.00 H new ATOM 0 HE22 GLN A 906 10.603 0.146 -12.102 1.00 0.00 H new ATOM 1814 N ASN A 907 8.423 3.821 -7.336 1.00 0.00 N ATOM 1815 CA ASN A 907 9.122 5.013 -6.870 1.00 0.00 C ATOM 1816 C ASN A 907 10.384 4.610 -6.126 1.00 0.00 C ATOM 1817 O ASN A 907 11.441 5.225 -6.277 1.00 0.00 O ATOM 1818 CB ASN A 907 8.213 5.808 -5.932 1.00 0.00 C ATOM 1819 CG ASN A 907 8.461 7.304 -5.964 1.00 0.00 C ATOM 1820 OD1 ASN A 907 9.584 7.764 -6.169 1.00 0.00 O ATOM 1821 ND2 ASN A 907 7.399 8.072 -5.768 1.00 0.00 N ATOM 0 H ASN A 907 7.513 3.677 -6.898 1.00 0.00 H new ATOM 0 HA ASN A 907 9.388 5.630 -7.728 1.00 0.00 H new ATOM 0 HB2 ASN A 907 7.174 5.615 -6.198 1.00 0.00 H new ATOM 0 HB3 ASN A 907 8.353 5.447 -4.913 1.00 0.00 H new ATOM 0 HD21 ASN A 907 7.494 9.087 -5.784 1.00 0.00 H new ATOM 0 HD22 ASN A 907 6.487 7.648 -5.602 1.00 0.00 H new ATOM 1828 N ALA A 908 10.250 3.561 -5.327 1.00 0.00 N ATOM 1829 CA ALA A 908 11.348 3.041 -4.535 1.00 0.00 C ATOM 1830 C ALA A 908 12.485 2.557 -5.412 1.00 0.00 C ATOM 1831 O ALA A 908 12.306 1.654 -6.228 1.00 0.00 O ATOM 1832 CB ALA A 908 10.868 1.901 -3.662 1.00 0.00 C ATOM 0 H ALA A 908 9.376 3.049 -5.212 1.00 0.00 H new ATOM 0 HA ALA A 908 11.717 3.854 -3.910 1.00 0.00 H new ATOM 0 HB1 ALA A 908 11.701 1.519 -3.072 1.00 0.00 H new ATOM 0 HB2 ALA A 908 10.085 2.259 -2.994 1.00 0.00 H new ATOM 0 HB3 ALA A 908 10.472 1.103 -4.290 1.00 0.00 H new ATOM 1838 N ILE A 909 13.643 3.171 -5.244 1.00 0.00 N ATOM 1839 CA ILE A 909 14.858 2.696 -5.888 1.00 0.00 C ATOM 1840 C ILE A 909 15.098 1.237 -5.506 1.00 0.00 C ATOM 1841 O ILE A 909 14.984 0.868 -4.332 1.00 0.00 O ATOM 1842 CB ILE A 909 16.081 3.553 -5.484 1.00 0.00 C ATOM 1843 CG1 ILE A 909 15.847 5.024 -5.848 1.00 0.00 C ATOM 1844 CG2 ILE A 909 17.350 3.036 -6.151 1.00 0.00 C ATOM 1845 CD1 ILE A 909 15.606 5.259 -7.327 1.00 0.00 C ATOM 0 H ILE A 909 13.769 4.002 -4.666 1.00 0.00 H new ATOM 0 HA ILE A 909 14.731 2.781 -6.967 1.00 0.00 H new ATOM 0 HB ILE A 909 16.208 3.477 -4.404 1.00 0.00 H new ATOM 0 HG12 ILE A 909 14.990 5.395 -5.286 1.00 0.00 H new ATOM 0 HG13 ILE A 909 16.712 5.608 -5.533 1.00 0.00 H new ATOM 0 HG21 ILE A 909 18.196 3.654 -5.852 1.00 0.00 H new ATOM 0 HG22 ILE A 909 17.528 2.005 -5.845 1.00 0.00 H new ATOM 0 HG23 ILE A 909 17.235 3.078 -7.234 1.00 0.00 H new ATOM 0 HD11 ILE A 909 15.449 6.323 -7.506 1.00 0.00 H new ATOM 0 HD12 ILE A 909 16.472 4.920 -7.895 1.00 0.00 H new ATOM 0 HD13 ILE A 909 14.724 4.704 -7.645 1.00 0.00 H new ATOM 1857 N LYS A 910 15.413 0.407 -6.489 1.00 0.00 N ATOM 1858 CA LYS A 910 15.534 -1.027 -6.261 1.00 0.00 C ATOM 1859 C LYS A 910 16.921 -1.402 -5.767 1.00 0.00 C ATOM 1860 O LYS A 910 17.530 -2.364 -6.242 1.00 0.00 O ATOM 1861 CB LYS A 910 15.181 -1.821 -7.526 1.00 0.00 C ATOM 1862 CG LYS A 910 13.694 -1.842 -7.852 1.00 0.00 C ATOM 1863 CD LYS A 910 13.218 -0.532 -8.456 1.00 0.00 C ATOM 1864 CE LYS A 910 11.705 -0.503 -8.599 1.00 0.00 C ATOM 1865 NZ LYS A 910 11.024 -0.550 -7.277 1.00 0.00 N ATOM 0 H LYS A 910 15.589 0.700 -7.450 1.00 0.00 H new ATOM 0 HA LYS A 910 14.820 -1.289 -5.480 1.00 0.00 H new ATOM 0 HB2 LYS A 910 15.721 -1.396 -8.372 1.00 0.00 H new ATOM 0 HB3 LYS A 910 15.531 -2.847 -7.408 1.00 0.00 H new ATOM 0 HG2 LYS A 910 13.488 -2.656 -8.547 1.00 0.00 H new ATOM 0 HG3 LYS A 910 13.128 -2.048 -6.943 1.00 0.00 H new ATOM 0 HD2 LYS A 910 13.541 0.298 -7.828 1.00 0.00 H new ATOM 0 HD3 LYS A 910 13.680 -0.391 -9.433 1.00 0.00 H new ATOM 0 HE2 LYS A 910 11.407 0.402 -9.129 1.00 0.00 H new ATOM 0 HE3 LYS A 910 11.381 -1.349 -9.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 910 10.081 -0.118 -7.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 910 10.926 -1.539 -6.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 910 11.587 -0.026 -6.577 1.00 0.00 H new ATOM 1879 N LYS A 911 17.391 -0.647 -4.792 1.00 0.00 N ATOM 1880 CA LYS A 911 18.668 -0.897 -4.143 1.00 0.00 C ATOM 1881 C LYS A 911 18.866 0.108 -3.018 1.00 0.00 C ATOM 1882 O LYS A 911 19.450 -0.263 -1.981 1.00 0.00 O ATOM 1883 CB LYS A 911 19.841 -0.830 -5.128 1.00 0.00 C ATOM 1884 CG LYS A 911 20.082 0.545 -5.734 1.00 0.00 C ATOM 1885 CD LYS A 911 21.368 0.565 -6.542 1.00 0.00 C ATOM 1886 CE LYS A 911 22.562 0.178 -5.682 1.00 0.00 C ATOM 1887 NZ LYS A 911 23.817 0.085 -6.469 1.00 0.00 N ATOM 1888 OXT LYS A 911 18.395 1.257 -3.162 1.00 0.00 O ATOM 0 H LYS A 911 16.894 0.164 -4.424 1.00 0.00 H new ATOM 0 HA LYS A 911 18.648 -1.909 -3.739 1.00 0.00 H new ATOM 0 HB2 LYS A 911 20.748 -1.150 -4.615 1.00 0.00 H new ATOM 0 HB3 LYS A 911 19.662 -1.542 -5.934 1.00 0.00 H new ATOM 0 HG2 LYS A 911 19.242 0.817 -6.373 1.00 0.00 H new ATOM 0 HG3 LYS A 911 20.134 1.292 -4.942 1.00 0.00 H new ATOM 0 HD2 LYS A 911 21.283 -0.123 -7.383 1.00 0.00 H new ATOM 0 HD3 LYS A 911 21.524 1.560 -6.959 1.00 0.00 H new ATOM 0 HE2 LYS A 911 22.688 0.913 -4.887 1.00 0.00 H new ATOM 0 HE3 LYS A 911 22.365 -0.780 -5.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 911 24.602 -0.181 -5.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 911 23.709 -0.635 -7.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 911 24.021 1.006 -6.907 1.00 0.00 H new TER 1902 LYS A 911