USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 996 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 80:sc= 0.781 USER MOD Set 1.2: A 867 THR OG1 : rot 63:sc= 0.689 USER MOD Set 2.1: A 811 ASN : amide:sc= 0.852 K(o=2.9,f=-0.88!) USER MOD Set 2.2: A 825 GLN : amide:sc= 2.05 K(o=2.9,f=-3.7) USER MOD Set 3.1: A 784 HIS : no HE2:sc= -3.39! C(o=-5.1!,f=-7.3!) USER MOD Set 3.2: A 852 ASN : amide:sc= -1.74 K(o=-5.1,f=-7.7!) USER MOD Single : A 752 SER OG : rot 180:sc= 0.126 USER MOD Single : A 753 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 754 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 755 GLN : amide:sc= -0.0278 X(o=-0.028,f=0.039) USER MOD Single : A 758 THR OG1 : rot 180:sc= 0 USER MOD Single : A 762 GLN : amide:sc= -0.17 K(o=-0.17,f=-2.2) USER MOD Single : A 772 THR OG1 : rot 90:sc= 1.27 USER MOD Single : A 775 THR OG1 : rot 73:sc= 0.99 USER MOD Single : A 776 GLN : amide:sc= -0.743 K(o=-0.74,f=-1.7!) USER MOD Single : A 779 ASN : amide:sc= -0.135 K(o=-0.14,f=-0.71) USER MOD Single : A 783 GLN : amide:sc= 0.746 K(o=0.75,f=0) USER MOD Single : A 786 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 788 HIS : no HD1:sc= -0.365 X(o=-0.37,f=-0.041) USER MOD Single : A 790 THR OG1 : rot -150:sc= 0 USER MOD Single : A 798 TYR OH : rot -79:sc= 0.843 USER MOD Single : A 800 GLN : amide:sc= 1.05 K(o=1,f=-8!) USER MOD Single : A 802 THR OG1 : rot -77:sc= 0.812 USER MOD Single : A 804 THR OG1 : rot 66:sc= 1.23 USER MOD Single : A 807 THR OG1 : rot 97:sc= 1.25 USER MOD Single : A 809 THR OG1 : rot 79:sc= 1.16 USER MOD Single : A 814 SER OG : rot 180:sc= 0.0771 USER MOD Single : A 815 SER OG : rot 83:sc= 1.24 USER MOD Single : A 816 MET CE :methyl 171:sc= -0.646 (180deg=-0.97) USER MOD Single : A 822 MET CE :methyl 162:sc= -0.276 (180deg=-0.82) USER MOD Single : A 831 GLN : amide:sc= 0 X(o=0,f=-0.045) USER MOD Single : A 834 SER OG : rot 95:sc= 1.28 USER MOD Single : A 838 ASN : amide:sc= 0 X(o=0,f=0) 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 853 SER OG : rot 104:sc= 1.22 USER MOD Single : A 855 LYS NZ :NH3+ 136:sc= 1.21 (180deg=1.02) USER MOD Single : A 858 SER OG : rot 60:sc= 1.21 USER MOD Single : A 861 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 869 LYS NZ :NH3+ -168:sc= 1.36 (180deg=1.1) USER MOD Single : A 870 MET CE :methyl 144:sc= -3.3! (180deg=-4.7!) USER MOD Single : A 875 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 880 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 883 SER OG : rot 180:sc= 0.161 USER MOD Single : A 886 GLN : amide:sc= 0.676 K(o=0.68,f=-0.094) USER MOD Single : A 887 GLN : amide:sc= 0.863 K(o=0.86,f=0) USER MOD Single : A 888 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 751 -26.239 2.943 -0.686 1.00 0.00 N ATOM 2 CA GLY A 751 -27.328 3.327 -1.611 1.00 0.00 C ATOM 3 C GLY A 751 -28.134 4.483 -1.066 1.00 0.00 C ATOM 4 O GLY A 751 -28.154 4.709 0.144 1.00 0.00 O ATOM 0 HA2 GLY A 751 -26.906 3.600 -2.578 1.00 0.00 H new ATOM 0 HA3 GLY A 751 -27.983 2.472 -1.779 1.00 0.00 H new ATOM 10 N SER A 752 -28.805 5.206 -1.946 1.00 0.00 N ATOM 11 CA SER A 752 -29.564 6.386 -1.558 1.00 0.00 C ATOM 12 C SER A 752 -30.698 6.033 -0.598 1.00 0.00 C ATOM 13 O SER A 752 -31.003 6.787 0.327 1.00 0.00 O ATOM 14 CB SER A 752 -30.125 7.053 -2.811 1.00 0.00 C ATOM 15 OG SER A 752 -29.628 6.415 -3.981 1.00 0.00 O ATOM 0 H SER A 752 -28.840 4.995 -2.943 1.00 0.00 H new ATOM 0 HA SER A 752 -28.896 7.072 -1.037 1.00 0.00 H new ATOM 0 HB2 SER A 752 -31.214 7.006 -2.799 1.00 0.00 H new ATOM 0 HB3 SER A 752 -29.852 8.108 -2.821 1.00 0.00 H new ATOM 0 HG SER A 752 -29.999 6.854 -4.775 1.00 0.00 H new ATOM 21 N HIS A 753 -31.313 4.879 -0.812 1.00 0.00 N ATOM 22 CA HIS A 753 -32.453 4.463 -0.009 1.00 0.00 C ATOM 23 C HIS A 753 -32.083 3.323 0.931 1.00 0.00 C ATOM 24 O HIS A 753 -32.939 2.797 1.644 1.00 0.00 O ATOM 25 CB HIS A 753 -33.601 4.030 -0.919 1.00 0.00 C ATOM 26 CG HIS A 753 -34.956 4.298 -0.347 1.00 0.00 C ATOM 27 ND1 HIS A 753 -35.816 3.299 0.051 1.00 0.00 N ATOM 28 CD2 HIS A 753 -35.601 5.462 -0.109 1.00 0.00 C ATOM 29 CE1 HIS A 753 -36.931 3.836 0.508 1.00 0.00 C ATOM 30 NE2 HIS A 753 -36.825 5.148 0.423 1.00 0.00 N ATOM 0 H HIS A 753 -31.041 4.214 -1.536 1.00 0.00 H new ATOM 0 HA HIS A 753 -32.766 5.314 0.596 1.00 0.00 H new ATOM 0 HB2 HIS A 753 -33.511 4.548 -1.874 1.00 0.00 H new ATOM 0 HB3 HIS A 753 -33.508 2.964 -1.124 1.00 0.00 H new ATOM 0 HD2 HIS A 753 -35.222 6.455 -0.302 1.00 0.00 H new ATOM 0 HE1 HIS A 753 -37.785 3.294 0.887 1.00 0.00 H new ATOM 0 HE2 HIS A 753 -37.538 5.820 0.707 1.00 0.00 H new ATOM 39 N MET A 754 -30.813 2.946 0.938 1.00 0.00 N ATOM 40 CA MET A 754 -30.362 1.835 1.763 1.00 0.00 C ATOM 41 C MET A 754 -28.847 1.836 1.919 1.00 0.00 C ATOM 42 O MET A 754 -28.107 1.663 0.949 1.00 0.00 O ATOM 43 CB MET A 754 -30.820 0.502 1.164 1.00 0.00 C ATOM 44 CG MET A 754 -30.339 -0.716 1.938 1.00 0.00 C ATOM 45 SD MET A 754 -31.633 -1.952 2.156 1.00 0.00 S ATOM 46 CE MET A 754 -30.648 -3.441 2.308 1.00 0.00 C ATOM 0 H MET A 754 -30.080 3.390 0.385 1.00 0.00 H new ATOM 0 HA MET A 754 -30.807 1.958 2.750 1.00 0.00 H new ATOM 0 HB2 MET A 754 -31.909 0.488 1.123 1.00 0.00 H new ATOM 0 HB3 MET A 754 -30.461 0.433 0.137 1.00 0.00 H new ATOM 0 HG2 MET A 754 -29.496 -1.166 1.413 1.00 0.00 H new ATOM 0 HG3 MET A 754 -29.974 -0.400 2.916 1.00 0.00 H new ATOM 0 HE1 MET A 754 -31.305 -4.299 2.449 1.00 0.00 H new ATOM 0 HE2 MET A 754 -30.058 -3.581 1.402 1.00 0.00 H new ATOM 0 HE3 MET A 754 -29.981 -3.350 3.165 1.00 0.00 H new ATOM 56 N GLN A 755 -28.396 2.042 3.144 1.00 0.00 N ATOM 57 CA GLN A 755 -26.980 1.962 3.472 1.00 0.00 C ATOM 58 C GLN A 755 -26.771 0.887 4.529 1.00 0.00 C ATOM 59 O GLN A 755 -25.684 0.758 5.096 1.00 0.00 O ATOM 60 CB GLN A 755 -26.466 3.307 3.994 1.00 0.00 C ATOM 61 CG GLN A 755 -26.867 4.495 3.136 1.00 0.00 C ATOM 62 CD GLN A 755 -28.079 5.226 3.678 1.00 0.00 C ATOM 63 OE1 GLN A 755 -29.145 5.238 3.061 1.00 0.00 O ATOM 64 NE2 GLN A 755 -27.926 5.843 4.837 1.00 0.00 N ATOM 0 H GLN A 755 -28.996 2.268 3.937 1.00 0.00 H new ATOM 0 HA GLN A 755 -26.423 1.709 2.570 1.00 0.00 H new ATOM 0 HB2 GLN A 755 -26.840 3.460 5.006 1.00 0.00 H new ATOM 0 HB3 GLN A 755 -25.379 3.269 4.059 1.00 0.00 H new ATOM 0 HG2 GLN A 755 -26.029 5.189 3.069 1.00 0.00 H new ATOM 0 HG3 GLN A 755 -27.078 4.152 2.123 1.00 0.00 H new ATOM 0 HE21 GLN A 755 -27.027 5.810 5.318 1.00 0.00 H new ATOM 0 HE22 GLN A 755 -28.707 6.352 5.251 1.00 0.00 H new ATOM 73 N ALA A 756 -27.848 0.133 4.781 1.00 0.00 N ATOM 74 CA ALA A 756 -27.888 -0.903 5.815 1.00 0.00 C ATOM 75 C ALA A 756 -27.865 -0.280 7.206 1.00 0.00 C ATOM 76 O ALA A 756 -28.858 -0.327 7.934 1.00 0.00 O ATOM 77 CB ALA A 756 -26.750 -1.904 5.651 1.00 0.00 C ATOM 0 H ALA A 756 -28.724 0.228 4.267 1.00 0.00 H new ATOM 0 HA ALA A 756 -28.824 -1.449 5.698 1.00 0.00 H new ATOM 0 HB1 ALA A 756 -26.812 -2.658 6.436 1.00 0.00 H new ATOM 0 HB2 ALA A 756 -26.828 -2.387 4.677 1.00 0.00 H new ATOM 0 HB3 ALA A 756 -25.795 -1.384 5.722 1.00 0.00 H new ATOM 83 N ALA A 757 -26.736 0.322 7.549 1.00 0.00 N ATOM 84 CA ALA A 757 -26.544 0.959 8.841 1.00 0.00 C ATOM 85 C ALA A 757 -25.204 1.686 8.850 1.00 0.00 C ATOM 86 O ALA A 757 -24.805 2.270 7.843 1.00 0.00 O ATOM 87 CB ALA A 757 -26.608 -0.070 9.964 1.00 0.00 C ATOM 0 H ALA A 757 -25.924 0.382 6.935 1.00 0.00 H new ATOM 0 HA ALA A 757 -27.344 1.681 9.007 1.00 0.00 H new ATOM 0 HB1 ALA A 757 -26.462 0.428 10.923 1.00 0.00 H new ATOM 0 HB2 ALA A 757 -27.582 -0.559 9.954 1.00 0.00 H new ATOM 0 HB3 ALA A 757 -25.826 -0.815 9.819 1.00 0.00 H new ATOM 93 N THR A 758 -24.507 1.641 9.971 1.00 0.00 N ATOM 94 CA THR A 758 -23.184 2.228 10.063 1.00 0.00 C ATOM 95 C THR A 758 -22.120 1.135 10.072 1.00 0.00 C ATOM 96 O THR A 758 -22.351 0.049 10.615 1.00 0.00 O ATOM 97 CB THR A 758 -23.051 3.095 11.320 1.00 0.00 C ATOM 98 OG1 THR A 758 -24.353 3.452 11.807 1.00 0.00 O ATOM 99 CG2 THR A 758 -22.255 4.354 11.025 1.00 0.00 C ATOM 0 H THR A 758 -24.836 1.203 10.831 1.00 0.00 H new ATOM 0 HA THR A 758 -23.038 2.864 9.190 1.00 0.00 H new ATOM 0 HB THR A 758 -22.523 2.519 12.079 1.00 0.00 H new ATOM 0 HG1 THR A 758 -24.261 4.004 12.611 1.00 0.00 H new ATOM 0 HG21 THR A 758 -22.174 4.954 11.932 1.00 0.00 H new ATOM 0 HG22 THR A 758 -21.258 4.081 10.679 1.00 0.00 H new ATOM 0 HG23 THR A 758 -22.761 4.932 10.252 1.00 0.00 H new ATOM 107 N GLU A 759 -20.975 1.421 9.451 1.00 0.00 N ATOM 108 CA GLU A 759 -19.860 0.476 9.362 1.00 0.00 C ATOM 109 C GLU A 759 -20.232 -0.727 8.498 1.00 0.00 C ATOM 110 O GLU A 759 -19.877 -1.869 8.805 1.00 0.00 O ATOM 111 CB GLU A 759 -19.417 0.015 10.756 1.00 0.00 C ATOM 112 CG GLU A 759 -18.954 1.151 11.655 1.00 0.00 C ATOM 113 CD GLU A 759 -18.164 0.655 12.847 1.00 0.00 C ATOM 114 OE1 GLU A 759 -18.786 0.307 13.872 1.00 0.00 O ATOM 115 OE2 GLU A 759 -16.918 0.604 12.759 1.00 0.00 O ATOM 0 H GLU A 759 -20.794 2.315 8.995 1.00 0.00 H new ATOM 0 HA GLU A 759 -19.024 0.993 8.891 1.00 0.00 H new ATOM 0 HB2 GLU A 759 -20.245 -0.504 11.238 1.00 0.00 H new ATOM 0 HB3 GLU A 759 -18.607 -0.707 10.650 1.00 0.00 H new ATOM 0 HG2 GLU A 759 -18.340 1.842 11.077 1.00 0.00 H new ATOM 0 HG3 GLU A 759 -19.821 1.711 12.004 1.00 0.00 H new ATOM 122 N ASP A 760 -20.951 -0.460 7.415 1.00 0.00 N ATOM 123 CA ASP A 760 -21.359 -1.509 6.484 1.00 0.00 C ATOM 124 C ASP A 760 -20.278 -1.744 5.431 1.00 0.00 C ATOM 125 O ASP A 760 -19.436 -0.875 5.182 1.00 0.00 O ATOM 126 CB ASP A 760 -22.694 -1.153 5.813 1.00 0.00 C ATOM 127 CG ASP A 760 -22.524 -0.509 4.447 1.00 0.00 C ATOM 128 OD1 ASP A 760 -22.145 0.682 4.394 1.00 0.00 O ATOM 129 OD2 ASP A 760 -22.767 -1.189 3.422 1.00 0.00 O ATOM 0 H ASP A 760 -21.265 0.476 7.158 1.00 0.00 H new ATOM 0 HA ASP A 760 -21.496 -2.430 7.050 1.00 0.00 H new ATOM 0 HB2 ASP A 760 -23.294 -2.057 5.709 1.00 0.00 H new ATOM 0 HB3 ASP A 760 -23.249 -0.475 6.461 1.00 0.00 H new ATOM 134 N GLY A 761 -20.304 -2.922 4.825 1.00 0.00 N ATOM 135 CA GLY A 761 -19.318 -3.264 3.821 1.00 0.00 C ATOM 136 C GLY A 761 -17.933 -3.442 4.411 1.00 0.00 C ATOM 137 O GLY A 761 -17.778 -3.580 5.626 1.00 0.00 O ATOM 0 H GLY A 761 -20.994 -3.650 5.012 1.00 0.00 H new ATOM 0 HA2 GLY A 761 -19.618 -4.184 3.319 1.00 0.00 H new ATOM 0 HA3 GLY A 761 -19.289 -2.482 3.062 1.00 0.00 H new ATOM 141 N GLN A 762 -16.924 -3.428 3.554 1.00 0.00 N ATOM 142 CA GLN A 762 -15.549 -3.587 4.001 1.00 0.00 C ATOM 143 C GLN A 762 -14.794 -2.264 3.911 1.00 0.00 C ATOM 144 O GLN A 762 -13.594 -2.240 3.631 1.00 0.00 O ATOM 145 CB GLN A 762 -14.840 -4.655 3.168 1.00 0.00 C ATOM 146 CG GLN A 762 -14.357 -5.832 3.992 1.00 0.00 C ATOM 147 CD GLN A 762 -13.304 -6.655 3.279 1.00 0.00 C ATOM 148 OE1 GLN A 762 -12.434 -6.117 2.595 1.00 0.00 O ATOM 149 NE2 GLN A 762 -13.374 -7.967 3.436 1.00 0.00 N ATOM 0 H GLN A 762 -17.031 -3.308 2.547 1.00 0.00 H new ATOM 0 HA GLN A 762 -15.564 -3.905 5.044 1.00 0.00 H new ATOM 0 HB2 GLN A 762 -15.520 -5.015 2.396 1.00 0.00 H new ATOM 0 HB3 GLN A 762 -13.989 -4.203 2.658 1.00 0.00 H new ATOM 0 HG2 GLN A 762 -13.949 -5.467 4.935 1.00 0.00 H new ATOM 0 HG3 GLN A 762 -15.206 -6.470 4.238 1.00 0.00 H new ATOM 0 HE21 GLN A 762 -14.111 -8.373 4.012 1.00 0.00 H new ATOM 0 HE22 GLN A 762 -12.690 -8.572 2.981 1.00 0.00 H new ATOM 158 N LEU A 763 -15.506 -1.171 4.161 1.00 0.00 N ATOM 159 CA LEU A 763 -14.924 0.165 4.085 1.00 0.00 C ATOM 160 C LEU A 763 -13.757 0.309 5.059 1.00 0.00 C ATOM 161 O LEU A 763 -12.612 0.489 4.651 1.00 0.00 O ATOM 162 CB LEU A 763 -15.987 1.229 4.380 1.00 0.00 C ATOM 163 CG LEU A 763 -16.490 2.010 3.162 1.00 0.00 C ATOM 164 CD1 LEU A 763 -15.323 2.560 2.354 1.00 0.00 C ATOM 165 CD2 LEU A 763 -17.378 1.131 2.293 1.00 0.00 C ATOM 0 H LEU A 763 -16.493 -1.184 4.419 1.00 0.00 H new ATOM 0 HA LEU A 763 -14.548 0.311 3.072 1.00 0.00 H new ATOM 0 HB2 LEU A 763 -16.839 0.745 4.857 1.00 0.00 H new ATOM 0 HB3 LEU A 763 -15.578 1.937 5.101 1.00 0.00 H new ATOM 0 HG LEU A 763 -17.083 2.852 3.518 1.00 0.00 H new ATOM 0 HD11 LEU A 763 -15.704 3.111 1.494 1.00 0.00 H new ATOM 0 HD12 LEU A 763 -14.730 3.228 2.979 1.00 0.00 H new ATOM 0 HD13 LEU A 763 -14.698 1.736 2.009 1.00 0.00 H new ATOM 0 HD21 LEU A 763 -17.726 1.703 1.433 1.00 0.00 H new ATOM 0 HD22 LEU A 763 -16.809 0.267 1.949 1.00 0.00 H new ATOM 0 HD23 LEU A 763 -18.236 0.793 2.874 1.00 0.00 H new ATOM 177 N LEU A 764 -14.039 0.215 6.345 1.00 0.00 N ATOM 178 CA LEU A 764 -12.994 0.344 7.344 1.00 0.00 C ATOM 179 C LEU A 764 -12.369 -1.011 7.644 1.00 0.00 C ATOM 180 O LEU A 764 -11.178 -1.104 7.941 1.00 0.00 O ATOM 181 CB LEU A 764 -13.542 0.973 8.628 1.00 0.00 C ATOM 182 CG LEU A 764 -13.151 2.437 8.856 1.00 0.00 C ATOM 183 CD1 LEU A 764 -11.647 2.620 8.724 1.00 0.00 C ATOM 184 CD2 LEU A 764 -13.889 3.343 7.881 1.00 0.00 C ATOM 0 H LEU A 764 -14.973 0.051 6.720 1.00 0.00 H new ATOM 0 HA LEU A 764 -12.223 1.001 6.942 1.00 0.00 H new ATOM 0 HB2 LEU A 764 -14.630 0.902 8.613 1.00 0.00 H new ATOM 0 HB3 LEU A 764 -13.196 0.385 9.478 1.00 0.00 H new ATOM 0 HG LEU A 764 -13.439 2.714 9.870 1.00 0.00 H new ATOM 0 HD11 LEU A 764 -11.392 3.667 8.890 1.00 0.00 H new ATOM 0 HD12 LEU A 764 -11.139 2.001 9.464 1.00 0.00 H new ATOM 0 HD13 LEU A 764 -11.331 2.323 7.724 1.00 0.00 H new ATOM 0 HD21 LEU A 764 -13.600 4.379 8.057 1.00 0.00 H new ATOM 0 HD22 LEU A 764 -13.633 3.063 6.859 1.00 0.00 H new ATOM 0 HD23 LEU A 764 -14.964 3.237 8.028 1.00 0.00 H new ATOM 196 N ARG A 765 -13.176 -2.062 7.543 1.00 0.00 N ATOM 197 CA ARG A 765 -12.707 -3.417 7.811 1.00 0.00 C ATOM 198 C ARG A 765 -11.620 -3.825 6.822 1.00 0.00 C ATOM 199 O ARG A 765 -10.614 -4.427 7.197 1.00 0.00 O ATOM 200 CB ARG A 765 -13.867 -4.406 7.733 1.00 0.00 C ATOM 201 CG ARG A 765 -14.766 -4.385 8.955 1.00 0.00 C ATOM 202 CD ARG A 765 -16.123 -4.994 8.650 1.00 0.00 C ATOM 203 NE ARG A 765 -16.130 -6.439 8.859 1.00 0.00 N ATOM 204 CZ ARG A 765 -17.071 -7.085 9.546 1.00 0.00 C ATOM 205 NH1 ARG A 765 -18.075 -6.414 10.102 1.00 0.00 N ATOM 206 NH2 ARG A 765 -16.999 -8.403 9.688 1.00 0.00 N ATOM 0 H ARG A 765 -14.159 -2.001 7.277 1.00 0.00 H new ATOM 0 HA ARG A 765 -12.287 -3.432 8.817 1.00 0.00 H new ATOM 0 HB2 ARG A 765 -14.464 -4.184 6.849 1.00 0.00 H new ATOM 0 HB3 ARG A 765 -13.468 -5.412 7.603 1.00 0.00 H new ATOM 0 HG2 ARG A 765 -14.292 -4.935 9.768 1.00 0.00 H new ATOM 0 HG3 ARG A 765 -14.894 -3.358 9.298 1.00 0.00 H new ATOM 0 HD2 ARG A 765 -16.879 -4.532 9.284 1.00 0.00 H new ATOM 0 HD3 ARG A 765 -16.396 -4.775 7.618 1.00 0.00 H new ATOM 0 HE ARG A 765 -15.370 -6.986 8.455 1.00 0.00 H new ATOM 0 HH11 ARG A 765 -18.127 -5.400 10.004 1.00 0.00 H new ATOM 0 HH12 ARG A 765 -18.793 -6.913 10.627 1.00 0.00 H new ATOM 0 HH21 ARG A 765 -16.224 -8.919 9.271 1.00 0.00 H new ATOM 0 HH22 ARG A 765 -17.719 -8.899 10.214 1.00 0.00 H new ATOM 220 N GLY A 766 -11.830 -3.488 5.559 1.00 0.00 N ATOM 221 CA GLY A 766 -10.874 -3.844 4.536 1.00 0.00 C ATOM 222 C GLY A 766 -9.941 -2.702 4.199 1.00 0.00 C ATOM 223 O GLY A 766 -8.744 -2.771 4.482 1.00 0.00 O ATOM 0 H GLY A 766 -12.646 -2.974 5.226 1.00 0.00 H new ATOM 0 HA2 GLY A 766 -10.289 -4.701 4.871 1.00 0.00 H new ATOM 0 HA3 GLY A 766 -11.406 -4.153 3.636 1.00 0.00 H new ATOM 227 N VAL A 767 -10.492 -1.641 3.618 1.00 0.00 N ATOM 228 CA VAL A 767 -9.690 -0.515 3.143 1.00 0.00 C ATOM 229 C VAL A 767 -8.935 0.154 4.281 1.00 0.00 C ATOM 230 O VAL A 767 -7.728 0.351 4.195 1.00 0.00 O ATOM 231 CB VAL A 767 -10.547 0.549 2.431 1.00 0.00 C ATOM 232 CG1 VAL A 767 -9.691 1.390 1.498 1.00 0.00 C ATOM 233 CG2 VAL A 767 -11.692 -0.097 1.673 1.00 0.00 C ATOM 0 H VAL A 767 -11.495 -1.536 3.464 1.00 0.00 H new ATOM 0 HA VAL A 767 -8.980 -0.935 2.430 1.00 0.00 H new ATOM 0 HB VAL A 767 -10.972 1.205 3.190 1.00 0.00 H new ATOM 0 HG11 VAL A 767 -10.315 2.135 1.005 1.00 0.00 H new ATOM 0 HG12 VAL A 767 -8.912 1.891 2.072 1.00 0.00 H new ATOM 0 HG13 VAL A 767 -9.232 0.747 0.747 1.00 0.00 H new ATOM 0 HG21 VAL A 767 -12.282 0.675 1.179 1.00 0.00 H new ATOM 0 HG22 VAL A 767 -11.293 -0.783 0.926 1.00 0.00 H new ATOM 0 HG23 VAL A 767 -12.325 -0.648 2.369 1.00 0.00 H new ATOM 243 N GLY A 768 -9.654 0.499 5.343 1.00 0.00 N ATOM 244 CA GLY A 768 -9.037 1.164 6.479 1.00 0.00 C ATOM 245 C GLY A 768 -7.842 0.406 7.024 1.00 0.00 C ATOM 246 O GLY A 768 -6.764 0.977 7.203 1.00 0.00 O ATOM 0 H GLY A 768 -10.655 0.330 5.439 1.00 0.00 H new ATOM 0 HA2 GLY A 768 -8.723 2.164 6.182 1.00 0.00 H new ATOM 0 HA3 GLY A 768 -9.777 1.284 7.270 1.00 0.00 H new ATOM 250 N ALA A 769 -8.025 -0.884 7.261 1.00 0.00 N ATOM 251 CA ALA A 769 -6.966 -1.720 7.809 1.00 0.00 C ATOM 252 C ALA A 769 -5.814 -1.882 6.819 1.00 0.00 C ATOM 253 O ALA A 769 -4.645 -1.787 7.195 1.00 0.00 O ATOM 254 CB ALA A 769 -7.521 -3.077 8.206 1.00 0.00 C ATOM 0 H ALA A 769 -8.900 -1.377 7.082 1.00 0.00 H new ATOM 0 HA ALA A 769 -6.572 -1.225 8.697 1.00 0.00 H new ATOM 0 HB1 ALA A 769 -6.719 -3.693 8.614 1.00 0.00 H new ATOM 0 HB2 ALA A 769 -8.298 -2.946 8.959 1.00 0.00 H new ATOM 0 HB3 ALA A 769 -7.945 -3.567 7.330 1.00 0.00 H new ATOM 260 N ALA A 770 -6.149 -2.112 5.552 1.00 0.00 N ATOM 261 CA ALA A 770 -5.139 -2.316 4.518 1.00 0.00 C ATOM 262 C ALA A 770 -4.339 -1.043 4.273 1.00 0.00 C ATOM 263 O ALA A 770 -3.116 -1.085 4.136 1.00 0.00 O ATOM 264 CB ALA A 770 -5.788 -2.790 3.226 1.00 0.00 C ATOM 0 H ALA A 770 -7.111 -2.162 5.217 1.00 0.00 H new ATOM 0 HA ALA A 770 -4.451 -3.086 4.868 1.00 0.00 H new ATOM 0 HB1 ALA A 770 -5.021 -2.937 2.466 1.00 0.00 H new ATOM 0 HB2 ALA A 770 -6.308 -3.731 3.404 1.00 0.00 H new ATOM 0 HB3 ALA A 770 -6.501 -2.041 2.881 1.00 0.00 H new ATOM 270 N ALA A 771 -5.032 0.087 4.231 1.00 0.00 N ATOM 271 CA ALA A 771 -4.387 1.376 4.023 1.00 0.00 C ATOM 272 C ALA A 771 -3.409 1.677 5.154 1.00 0.00 C ATOM 273 O ALA A 771 -2.289 2.137 4.920 1.00 0.00 O ATOM 274 CB ALA A 771 -5.430 2.477 3.908 1.00 0.00 C ATOM 0 H ALA A 771 -6.045 0.137 4.339 1.00 0.00 H new ATOM 0 HA ALA A 771 -3.825 1.334 3.090 1.00 0.00 H new ATOM 0 HB1 ALA A 771 -4.933 3.434 3.753 1.00 0.00 H new ATOM 0 HB2 ALA A 771 -6.088 2.269 3.064 1.00 0.00 H new ATOM 0 HB3 ALA A 771 -6.018 2.518 4.825 1.00 0.00 H new ATOM 280 N THR A 772 -3.831 1.402 6.382 1.00 0.00 N ATOM 281 CA THR A 772 -2.970 1.584 7.541 1.00 0.00 C ATOM 282 C THR A 772 -1.761 0.650 7.461 1.00 0.00 C ATOM 283 O THR A 772 -0.645 1.031 7.819 1.00 0.00 O ATOM 284 CB THR A 772 -3.741 1.331 8.853 1.00 0.00 C ATOM 285 OG1 THR A 772 -4.982 2.054 8.834 1.00 0.00 O ATOM 286 CG2 THR A 772 -2.922 1.761 10.060 1.00 0.00 C ATOM 0 H THR A 772 -4.764 1.052 6.600 1.00 0.00 H new ATOM 0 HA THR A 772 -2.624 2.618 7.539 1.00 0.00 H new ATOM 0 HB THR A 772 -3.937 0.262 8.932 1.00 0.00 H new ATOM 0 HG1 THR A 772 -5.683 1.490 8.445 1.00 0.00 H new ATOM 0 HG21 THR A 772 -3.490 1.571 10.971 1.00 0.00 H new ATOM 0 HG22 THR A 772 -1.991 1.195 10.088 1.00 0.00 H new ATOM 0 HG23 THR A 772 -2.698 2.825 9.987 1.00 0.00 H new ATOM 294 N ALA A 773 -1.987 -0.562 6.963 1.00 0.00 N ATOM 295 CA ALA A 773 -0.915 -1.534 6.792 1.00 0.00 C ATOM 296 C ALA A 773 0.135 -1.021 5.810 1.00 0.00 C ATOM 297 O ALA A 773 1.332 -1.146 6.056 1.00 0.00 O ATOM 298 CB ALA A 773 -1.476 -2.869 6.324 1.00 0.00 C ATOM 0 H ALA A 773 -2.906 -0.894 6.670 1.00 0.00 H new ATOM 0 HA ALA A 773 -0.432 -1.680 7.758 1.00 0.00 H new ATOM 0 HB1 ALA A 773 -0.662 -3.583 6.201 1.00 0.00 H new ATOM 0 HB2 ALA A 773 -2.181 -3.247 7.064 1.00 0.00 H new ATOM 0 HB3 ALA A 773 -1.987 -2.735 5.371 1.00 0.00 H new ATOM 304 N VAL A 774 -0.323 -0.437 4.704 1.00 0.00 N ATOM 305 CA VAL A 774 0.583 0.148 3.716 1.00 0.00 C ATOM 306 C VAL A 774 1.385 1.287 4.336 1.00 0.00 C ATOM 307 O VAL A 774 2.604 1.358 4.181 1.00 0.00 O ATOM 308 CB VAL A 774 -0.180 0.682 2.483 1.00 0.00 C ATOM 309 CG1 VAL A 774 0.776 1.336 1.495 1.00 0.00 C ATOM 310 CG2 VAL A 774 -0.952 -0.436 1.808 1.00 0.00 C ATOM 0 H VAL A 774 -1.312 -0.356 4.470 1.00 0.00 H new ATOM 0 HA VAL A 774 1.256 -0.645 3.390 1.00 0.00 H new ATOM 0 HB VAL A 774 -0.888 1.437 2.825 1.00 0.00 H new ATOM 0 HG11 VAL A 774 0.216 1.704 0.636 1.00 0.00 H new ATOM 0 HG12 VAL A 774 1.286 2.169 1.979 1.00 0.00 H new ATOM 0 HG13 VAL A 774 1.512 0.604 1.162 1.00 0.00 H new ATOM 0 HG21 VAL A 774 -1.483 -0.040 0.942 1.00 0.00 H new ATOM 0 HG22 VAL A 774 -0.259 -1.213 1.485 1.00 0.00 H new ATOM 0 HG23 VAL A 774 -1.669 -0.859 2.511 1.00 0.00 H new ATOM 320 N THR A 775 0.690 2.162 5.052 1.00 0.00 N ATOM 321 CA THR A 775 1.326 3.291 5.719 1.00 0.00 C ATOM 322 C THR A 775 2.416 2.818 6.683 1.00 0.00 C ATOM 323 O THR A 775 3.510 3.383 6.726 1.00 0.00 O ATOM 324 CB THR A 775 0.289 4.138 6.483 1.00 0.00 C ATOM 325 OG1 THR A 775 -0.862 4.368 5.655 1.00 0.00 O ATOM 326 CG2 THR A 775 0.882 5.473 6.910 1.00 0.00 C ATOM 0 H THR A 775 -0.320 2.111 5.186 1.00 0.00 H new ATOM 0 HA THR A 775 1.785 3.909 4.947 1.00 0.00 H new ATOM 0 HB THR A 775 -0.006 3.587 7.376 1.00 0.00 H new ATOM 0 HG1 THR A 775 -1.383 3.541 5.582 1.00 0.00 H new ATOM 0 HG21 THR A 775 0.129 6.050 7.447 1.00 0.00 H new ATOM 0 HG22 THR A 775 1.739 5.299 7.561 1.00 0.00 H new ATOM 0 HG23 THR A 775 1.204 6.027 6.028 1.00 0.00 H new ATOM 334 N GLN A 776 2.121 1.766 7.439 1.00 0.00 N ATOM 335 CA GLN A 776 3.074 1.228 8.399 1.00 0.00 C ATOM 336 C GLN A 776 4.233 0.536 7.690 1.00 0.00 C ATOM 337 O GLN A 776 5.390 0.701 8.076 1.00 0.00 O ATOM 338 CB GLN A 776 2.382 0.255 9.356 1.00 0.00 C ATOM 339 CG GLN A 776 2.358 0.743 10.797 1.00 0.00 C ATOM 340 CD GLN A 776 1.949 2.200 10.910 1.00 0.00 C ATOM 341 OE1 GLN A 776 2.787 3.103 10.838 1.00 0.00 O ATOM 342 NE2 GLN A 776 0.663 2.436 11.094 1.00 0.00 N ATOM 0 H GLN A 776 1.230 1.270 7.405 1.00 0.00 H new ATOM 0 HA GLN A 776 3.475 2.061 8.976 1.00 0.00 H new ATOM 0 HB2 GLN A 776 1.359 0.090 9.018 1.00 0.00 H new ATOM 0 HB3 GLN A 776 2.890 -0.708 9.314 1.00 0.00 H new ATOM 0 HG2 GLN A 776 1.666 0.129 11.374 1.00 0.00 H new ATOM 0 HG3 GLN A 776 3.346 0.611 11.239 1.00 0.00 H new ATOM 0 HE21 GLN A 776 0.004 1.659 11.148 1.00 0.00 H new ATOM 0 HE22 GLN A 776 0.328 3.395 11.183 1.00 0.00 H new ATOM 351 N ALA A 777 3.918 -0.222 6.643 1.00 0.00 N ATOM 352 CA ALA A 777 4.936 -0.918 5.864 1.00 0.00 C ATOM 353 C ALA A 777 5.918 0.072 5.249 1.00 0.00 C ATOM 354 O ALA A 777 7.134 -0.111 5.325 1.00 0.00 O ATOM 355 CB ALA A 777 4.285 -1.762 4.778 1.00 0.00 C ATOM 0 H ALA A 777 2.964 -0.370 6.315 1.00 0.00 H new ATOM 0 HA ALA A 777 5.489 -1.576 6.534 1.00 0.00 H new ATOM 0 HB1 ALA A 777 5.057 -2.276 4.205 1.00 0.00 H new ATOM 0 HB2 ALA A 777 3.624 -2.497 5.236 1.00 0.00 H new ATOM 0 HB3 ALA A 777 3.708 -1.118 4.114 1.00 0.00 H new ATOM 361 N LEU A 778 5.380 1.129 4.652 1.00 0.00 N ATOM 362 CA LEU A 778 6.201 2.168 4.047 1.00 0.00 C ATOM 363 C LEU A 778 7.042 2.869 5.106 1.00 0.00 C ATOM 364 O LEU A 778 8.229 3.121 4.901 1.00 0.00 O ATOM 365 CB LEU A 778 5.319 3.185 3.322 1.00 0.00 C ATOM 366 CG LEU A 778 6.078 4.222 2.497 1.00 0.00 C ATOM 367 CD1 LEU A 778 6.299 3.715 1.083 1.00 0.00 C ATOM 368 CD2 LEU A 778 5.326 5.542 2.480 1.00 0.00 C ATOM 0 H LEU A 778 4.376 1.288 4.574 1.00 0.00 H new ATOM 0 HA LEU A 778 6.869 1.700 3.324 1.00 0.00 H new ATOM 0 HB2 LEU A 778 4.636 2.648 2.664 1.00 0.00 H new ATOM 0 HB3 LEU A 778 4.708 3.705 4.060 1.00 0.00 H new ATOM 0 HG LEU A 778 7.051 4.388 2.959 1.00 0.00 H new ATOM 0 HD11 LEU A 778 6.841 4.466 0.508 1.00 0.00 H new ATOM 0 HD12 LEU A 778 6.879 2.793 1.114 1.00 0.00 H new ATOM 0 HD13 LEU A 778 5.336 3.522 0.611 1.00 0.00 H new ATOM 0 HD21 LEU A 778 5.881 6.269 1.888 1.00 0.00 H new ATOM 0 HD22 LEU A 778 4.340 5.393 2.041 1.00 0.00 H new ATOM 0 HD23 LEU A 778 5.217 5.912 3.500 1.00 0.00 H new ATOM 380 N ASN A 779 6.416 3.172 6.238 1.00 0.00 N ATOM 381 CA ASN A 779 7.102 3.805 7.361 1.00 0.00 C ATOM 382 C ASN A 779 8.266 2.941 7.832 1.00 0.00 C ATOM 383 O ASN A 779 9.358 3.441 8.103 1.00 0.00 O ATOM 384 CB ASN A 779 6.124 4.023 8.517 1.00 0.00 C ATOM 385 CG ASN A 779 6.028 5.473 8.950 1.00 0.00 C ATOM 386 OD1 ASN A 779 6.993 6.232 8.854 1.00 0.00 O ATOM 387 ND2 ASN A 779 4.859 5.864 9.434 1.00 0.00 N ATOM 0 H ASN A 779 5.427 2.988 6.404 1.00 0.00 H new ATOM 0 HA ASN A 779 7.490 4.768 7.029 1.00 0.00 H new ATOM 0 HB2 ASN A 779 5.136 3.673 8.220 1.00 0.00 H new ATOM 0 HB3 ASN A 779 6.435 3.416 9.367 1.00 0.00 H new ATOM 0 HD21 ASN A 779 4.732 6.827 9.745 1.00 0.00 H new ATOM 0 HD22 ASN A 779 4.085 5.202 9.496 1.00 0.00 H new ATOM 394 N GLU A 780 8.017 1.640 7.921 1.00 0.00 N ATOM 395 CA GLU A 780 9.034 0.669 8.308 1.00 0.00 C ATOM 396 C GLU A 780 10.213 0.712 7.345 1.00 0.00 C ATOM 397 O GLU A 780 11.371 0.842 7.755 1.00 0.00 O ATOM 398 CB GLU A 780 8.430 -0.736 8.307 1.00 0.00 C ATOM 399 CG GLU A 780 9.449 -1.839 8.535 1.00 0.00 C ATOM 400 CD GLU A 780 9.239 -2.565 9.844 1.00 0.00 C ATOM 401 OE1 GLU A 780 8.537 -2.025 10.726 1.00 0.00 O ATOM 402 OE2 GLU A 780 9.772 -3.683 9.996 1.00 0.00 O ATOM 0 H GLU A 780 7.104 1.228 7.727 1.00 0.00 H new ATOM 0 HA GLU A 780 9.388 0.919 9.308 1.00 0.00 H new ATOM 0 HB2 GLU A 780 7.666 -0.794 9.082 1.00 0.00 H new ATOM 0 HB3 GLU A 780 7.930 -0.906 7.353 1.00 0.00 H new ATOM 0 HG2 GLU A 780 9.394 -2.554 7.714 1.00 0.00 H new ATOM 0 HG3 GLU A 780 10.451 -1.411 8.518 1.00 0.00 H new ATOM 409 N LEU A 781 9.900 0.602 6.063 1.00 0.00 N ATOM 410 CA LEU A 781 10.908 0.570 5.017 1.00 0.00 C ATOM 411 C LEU A 781 11.700 1.870 4.972 1.00 0.00 C ATOM 412 O LEU A 781 12.905 1.850 4.758 1.00 0.00 O ATOM 413 CB LEU A 781 10.241 0.317 3.668 1.00 0.00 C ATOM 414 CG LEU A 781 11.196 0.190 2.485 1.00 0.00 C ATOM 415 CD1 LEU A 781 11.364 -1.269 2.094 1.00 0.00 C ATOM 416 CD2 LEU A 781 10.692 1.013 1.312 1.00 0.00 C ATOM 0 H LEU A 781 8.942 0.533 5.720 1.00 0.00 H new ATOM 0 HA LEU A 781 11.604 -0.239 5.238 1.00 0.00 H new ATOM 0 HB2 LEU A 781 9.651 -0.597 3.738 1.00 0.00 H new ATOM 0 HB3 LEU A 781 9.545 1.131 3.467 1.00 0.00 H new ATOM 0 HG LEU A 781 12.172 0.576 2.778 1.00 0.00 H new ATOM 0 HD11 LEU A 781 12.048 -1.343 1.249 1.00 0.00 H new ATOM 0 HD12 LEU A 781 11.769 -1.828 2.938 1.00 0.00 H new ATOM 0 HD13 LEU A 781 10.396 -1.685 1.814 1.00 0.00 H new ATOM 0 HD21 LEU A 781 11.383 0.914 0.474 1.00 0.00 H new ATOM 0 HD22 LEU A 781 9.706 0.656 1.014 1.00 0.00 H new ATOM 0 HD23 LEU A 781 10.625 2.061 1.605 1.00 0.00 H new ATOM 428 N LEU A 782 11.021 2.990 5.189 1.00 0.00 N ATOM 429 CA LEU A 782 11.658 4.302 5.129 1.00 0.00 C ATOM 430 C LEU A 782 12.830 4.399 6.101 1.00 0.00 C ATOM 431 O LEU A 782 13.944 4.757 5.708 1.00 0.00 O ATOM 432 CB LEU A 782 10.641 5.403 5.431 1.00 0.00 C ATOM 433 CG LEU A 782 10.109 6.143 4.203 1.00 0.00 C ATOM 434 CD1 LEU A 782 9.110 7.211 4.616 1.00 0.00 C ATOM 435 CD2 LEU A 782 11.257 6.758 3.415 1.00 0.00 C ATOM 0 H LEU A 782 10.025 3.017 5.409 1.00 0.00 H new ATOM 0 HA LEU A 782 12.043 4.435 4.118 1.00 0.00 H new ATOM 0 HB2 LEU A 782 9.799 4.963 5.965 1.00 0.00 H new ATOM 0 HB3 LEU A 782 11.101 6.128 6.103 1.00 0.00 H new ATOM 0 HG LEU A 782 9.597 5.426 3.562 1.00 0.00 H new ATOM 0 HD11 LEU A 782 8.742 7.727 3.729 1.00 0.00 H new ATOM 0 HD12 LEU A 782 8.274 6.745 5.138 1.00 0.00 H new ATOM 0 HD13 LEU A 782 9.596 7.928 5.278 1.00 0.00 H new ATOM 0 HD21 LEU A 782 10.862 7.281 2.544 1.00 0.00 H new ATOM 0 HD22 LEU A 782 11.796 7.463 4.048 1.00 0.00 H new ATOM 0 HD23 LEU A 782 11.937 5.971 3.088 1.00 0.00 H new ATOM 447 N GLN A 783 12.579 4.067 7.364 1.00 0.00 N ATOM 448 CA GLN A 783 13.624 4.102 8.385 1.00 0.00 C ATOM 449 C GLN A 783 14.722 3.110 8.041 1.00 0.00 C ATOM 450 O GLN A 783 15.914 3.408 8.159 1.00 0.00 O ATOM 451 CB GLN A 783 13.058 3.763 9.767 1.00 0.00 C ATOM 452 CG GLN A 783 11.726 4.420 10.076 1.00 0.00 C ATOM 453 CD GLN A 783 10.976 3.705 11.182 1.00 0.00 C ATOM 454 OE1 GLN A 783 11.469 3.572 12.301 1.00 0.00 O ATOM 455 NE2 GLN A 783 9.779 3.238 10.875 1.00 0.00 N ATOM 0 H GLN A 783 11.664 3.771 7.705 1.00 0.00 H new ATOM 0 HA GLN A 783 14.031 5.113 8.410 1.00 0.00 H new ATOM 0 HB2 GLN A 783 12.943 2.682 9.844 1.00 0.00 H new ATOM 0 HB3 GLN A 783 13.781 4.061 10.526 1.00 0.00 H new ATOM 0 HG2 GLN A 783 11.893 5.458 10.365 1.00 0.00 H new ATOM 0 HG3 GLN A 783 11.113 4.435 9.175 1.00 0.00 H new ATOM 0 HE21 GLN A 783 9.406 3.369 9.935 1.00 0.00 H new ATOM 0 HE22 GLN A 783 9.228 2.746 11.578 1.00 0.00 H new ATOM 464 N HIS A 784 14.301 1.933 7.600 1.00 0.00 N ATOM 465 CA HIS A 784 15.217 0.860 7.250 1.00 0.00 C ATOM 466 C HIS A 784 16.122 1.264 6.084 1.00 0.00 C ATOM 467 O HIS A 784 17.334 1.094 6.150 1.00 0.00 O ATOM 468 CB HIS A 784 14.425 -0.404 6.898 1.00 0.00 C ATOM 469 CG HIS A 784 15.279 -1.552 6.459 1.00 0.00 C ATOM 470 ND1 HIS A 784 16.221 -2.140 7.268 1.00 0.00 N ATOM 471 CD2 HIS A 784 15.337 -2.207 5.279 1.00 0.00 C ATOM 472 CE1 HIS A 784 16.827 -3.104 6.606 1.00 0.00 C ATOM 473 NE2 HIS A 784 16.311 -3.170 5.393 1.00 0.00 N ATOM 0 H HIS A 784 13.317 1.697 7.475 1.00 0.00 H new ATOM 0 HA HIS A 784 15.854 0.657 8.111 1.00 0.00 H new ATOM 0 HB2 HIS A 784 13.842 -0.709 7.767 1.00 0.00 H new ATOM 0 HB3 HIS A 784 13.716 -0.167 6.105 1.00 0.00 H new ATOM 0 HD1 HIS A 784 16.420 -1.872 8.232 1.00 0.00 H new ATOM 0 HD2 HIS A 784 14.730 -2.010 4.407 1.00 0.00 H new ATOM 0 HE1 HIS A 784 17.614 -3.735 6.991 1.00 0.00 H new ATOM 482 N VAL A 785 15.523 1.804 5.031 1.00 0.00 N ATOM 483 CA VAL A 785 16.255 2.167 3.820 1.00 0.00 C ATOM 484 C VAL A 785 17.255 3.287 4.092 1.00 0.00 C ATOM 485 O VAL A 785 18.406 3.213 3.670 1.00 0.00 O ATOM 486 CB VAL A 785 15.286 2.599 2.691 1.00 0.00 C ATOM 487 CG1 VAL A 785 16.010 3.373 1.597 1.00 0.00 C ATOM 488 CG2 VAL A 785 14.578 1.390 2.099 1.00 0.00 C ATOM 0 H VAL A 785 14.523 2.003 4.989 1.00 0.00 H new ATOM 0 HA VAL A 785 16.801 1.281 3.497 1.00 0.00 H new ATOM 0 HB VAL A 785 14.542 3.261 3.134 1.00 0.00 H new ATOM 0 HG11 VAL A 785 15.299 3.659 0.822 1.00 0.00 H new ATOM 0 HG12 VAL A 785 16.462 4.268 2.023 1.00 0.00 H new ATOM 0 HG13 VAL A 785 16.788 2.746 1.161 1.00 0.00 H new ATOM 0 HG21 VAL A 785 13.902 1.715 1.308 1.00 0.00 H new ATOM 0 HG22 VAL A 785 15.316 0.702 1.686 1.00 0.00 H new ATOM 0 HG23 VAL A 785 14.008 0.885 2.878 1.00 0.00 H new ATOM 498 N LYS A 786 16.817 4.304 4.830 1.00 0.00 N ATOM 499 CA LYS A 786 17.635 5.492 5.077 1.00 0.00 C ATOM 500 C LYS A 786 18.948 5.149 5.778 1.00 0.00 C ATOM 501 O LYS A 786 19.929 5.887 5.673 1.00 0.00 O ATOM 502 CB LYS A 786 16.852 6.510 5.904 1.00 0.00 C ATOM 503 CG LYS A 786 16.100 7.526 5.059 1.00 0.00 C ATOM 504 CD LYS A 786 15.541 8.654 5.909 1.00 0.00 C ATOM 505 CE LYS A 786 14.031 8.751 5.777 1.00 0.00 C ATOM 506 NZ LYS A 786 13.618 9.994 5.077 1.00 0.00 N ATOM 0 H LYS A 786 15.897 4.330 5.270 1.00 0.00 H new ATOM 0 HA LYS A 786 17.882 5.924 4.107 1.00 0.00 H new ATOM 0 HB2 LYS A 786 16.142 5.981 6.540 1.00 0.00 H new ATOM 0 HB3 LYS A 786 17.541 7.037 6.565 1.00 0.00 H new ATOM 0 HG2 LYS A 786 16.768 7.937 4.302 1.00 0.00 H new ATOM 0 HG3 LYS A 786 15.286 7.030 4.531 1.00 0.00 H new ATOM 0 HD2 LYS A 786 15.807 8.491 6.953 1.00 0.00 H new ATOM 0 HD3 LYS A 786 15.995 9.598 5.608 1.00 0.00 H new ATOM 0 HE2 LYS A 786 13.657 7.885 5.231 1.00 0.00 H new ATOM 0 HE3 LYS A 786 13.577 8.723 6.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 786 12.581 10.024 5.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 786 13.953 10.821 5.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 786 14.031 10.008 4.123 1.00 0.00 H new ATOM 520 N ALA A 787 18.968 4.037 6.493 1.00 0.00 N ATOM 521 CA ALA A 787 20.174 3.612 7.184 1.00 0.00 C ATOM 522 C ALA A 787 20.806 2.402 6.503 1.00 0.00 C ATOM 523 O ALA A 787 22.009 2.171 6.619 1.00 0.00 O ATOM 524 CB ALA A 787 19.860 3.301 8.637 1.00 0.00 C ATOM 0 H ALA A 787 18.168 3.415 6.610 1.00 0.00 H new ATOM 0 HA ALA A 787 20.894 4.429 7.144 1.00 0.00 H new ATOM 0 HB1 ALA A 787 20.770 2.983 9.146 1.00 0.00 H new ATOM 0 HB2 ALA A 787 19.465 4.193 9.123 1.00 0.00 H new ATOM 0 HB3 ALA A 787 19.119 2.503 8.686 1.00 0.00 H new ATOM 530 N HIS A 788 19.991 1.632 5.793 1.00 0.00 N ATOM 531 CA HIS A 788 20.458 0.409 5.148 1.00 0.00 C ATOM 532 C HIS A 788 19.843 0.266 3.762 1.00 0.00 C ATOM 533 O HIS A 788 18.648 -0.002 3.630 1.00 0.00 O ATOM 534 CB HIS A 788 20.106 -0.836 5.979 1.00 0.00 C ATOM 535 CG HIS A 788 20.083 -0.626 7.462 1.00 0.00 C ATOM 536 ND1 HIS A 788 21.180 -0.816 8.270 1.00 0.00 N ATOM 537 CD2 HIS A 788 19.079 -0.237 8.280 1.00 0.00 C ATOM 538 CE1 HIS A 788 20.851 -0.552 9.522 1.00 0.00 C ATOM 539 NE2 HIS A 788 19.581 -0.196 9.553 1.00 0.00 N ATOM 0 H HIS A 788 19.001 1.832 5.648 1.00 0.00 H new ATOM 0 HA HIS A 788 21.542 0.484 5.066 1.00 0.00 H new ATOM 0 HB2 HIS A 788 19.128 -1.199 5.664 1.00 0.00 H new ATOM 0 HB3 HIS A 788 20.826 -1.622 5.750 1.00 0.00 H new ATOM 0 HD2 HIS A 788 18.067 -0.002 7.984 1.00 0.00 H new ATOM 0 HE1 HIS A 788 21.510 -0.617 10.375 1.00 0.00 H new ATOM 0 HE2 HIS A 788 19.059 0.067 10.389 1.00 0.00 H new ATOM 548 N ALA A 789 20.671 0.429 2.742 1.00 0.00 N ATOM 549 CA ALA A 789 20.233 0.328 1.356 1.00 0.00 C ATOM 550 C ALA A 789 21.437 0.187 0.437 1.00 0.00 C ATOM 551 O ALA A 789 21.654 -0.861 -0.170 1.00 0.00 O ATOM 552 CB ALA A 789 19.407 1.545 0.962 1.00 0.00 C ATOM 0 H ALA A 789 21.664 0.635 2.850 1.00 0.00 H new ATOM 0 HA ALA A 789 19.606 -0.558 1.255 1.00 0.00 H new ATOM 0 HB1 ALA A 789 19.090 1.449 -0.077 1.00 0.00 H new ATOM 0 HB2 ALA A 789 18.529 1.612 1.604 1.00 0.00 H new ATOM 0 HB3 ALA A 789 20.010 2.446 1.076 1.00 0.00 H new ATOM 558 N THR A 790 22.224 1.249 0.344 1.00 0.00 N ATOM 559 CA THR A 790 23.434 1.241 -0.458 1.00 0.00 C ATOM 560 C THR A 790 24.658 1.476 0.419 1.00 0.00 C ATOM 561 O THR A 790 25.485 2.345 0.129 1.00 0.00 O ATOM 562 CB THR A 790 23.381 2.328 -1.543 1.00 0.00 C ATOM 563 OG1 THR A 790 22.276 3.210 -1.293 1.00 0.00 O ATOM 564 CG2 THR A 790 23.251 1.711 -2.925 1.00 0.00 C ATOM 0 H THR A 790 22.042 2.133 0.819 1.00 0.00 H new ATOM 0 HA THR A 790 23.507 0.263 -0.934 1.00 0.00 H new ATOM 0 HB THR A 790 24.312 2.894 -1.509 1.00 0.00 H new ATOM 0 HG1 THR A 790 21.944 3.567 -2.143 1.00 0.00 H new ATOM 0 HG21 THR A 790 23.216 2.502 -3.675 1.00 0.00 H new ATOM 0 HG22 THR A 790 24.109 1.066 -3.118 1.00 0.00 H new ATOM 0 HG23 THR A 790 22.335 1.122 -2.976 1.00 0.00 H new ATOM 572 N GLY A 791 24.765 0.707 1.496 1.00 0.00 N ATOM 573 CA GLY A 791 25.828 0.922 2.454 1.00 0.00 C ATOM 574 C GLY A 791 25.641 2.235 3.180 1.00 0.00 C ATOM 575 O GLY A 791 26.563 3.045 3.263 1.00 0.00 O ATOM 0 H GLY A 791 24.133 -0.061 1.721 1.00 0.00 H new ATOM 0 HA2 GLY A 791 25.846 0.103 3.173 1.00 0.00 H new ATOM 0 HA3 GLY A 791 26.791 0.918 1.943 1.00 0.00 H new ATOM 579 N ALA A 792 24.431 2.436 3.698 1.00 0.00 N ATOM 580 CA ALA A 792 24.035 3.701 4.309 1.00 0.00 C ATOM 581 C ALA A 792 24.148 4.841 3.291 1.00 0.00 C ATOM 582 O ALA A 792 23.502 4.800 2.240 1.00 0.00 O ATOM 583 CB ALA A 792 24.854 3.976 5.568 1.00 0.00 C ATOM 0 H ALA A 792 23.698 1.726 3.706 1.00 0.00 H new ATOM 0 HA ALA A 792 22.991 3.633 4.615 1.00 0.00 H new ATOM 0 HB1 ALA A 792 24.541 4.924 6.006 1.00 0.00 H new ATOM 0 HB2 ALA A 792 24.695 3.174 6.288 1.00 0.00 H new ATOM 0 HB3 ALA A 792 25.912 4.027 5.310 1.00 0.00 H new ATOM 589 N GLY A 793 24.971 5.844 3.591 1.00 0.00 N ATOM 590 CA GLY A 793 25.151 6.960 2.681 1.00 0.00 C ATOM 591 C GLY A 793 23.859 7.713 2.430 1.00 0.00 C ATOM 592 O GLY A 793 23.087 7.948 3.361 1.00 0.00 O ATOM 0 H GLY A 793 25.517 5.902 4.451 1.00 0.00 H new ATOM 0 HA2 GLY A 793 25.894 7.644 3.091 1.00 0.00 H new ATOM 0 HA3 GLY A 793 25.545 6.593 1.733 1.00 0.00 H new ATOM 596 N PRO A 794 23.592 8.099 1.173 1.00 0.00 N ATOM 597 CA PRO A 794 22.353 8.785 0.803 1.00 0.00 C ATOM 598 C PRO A 794 21.175 7.823 0.703 1.00 0.00 C ATOM 599 O PRO A 794 20.026 8.248 0.555 1.00 0.00 O ATOM 600 CB PRO A 794 22.682 9.379 -0.565 1.00 0.00 C ATOM 601 CG PRO A 794 23.685 8.443 -1.146 1.00 0.00 C ATOM 602 CD PRO A 794 24.486 7.911 0.013 1.00 0.00 C ATOM 0 HA PRO A 794 22.051 9.527 1.542 1.00 0.00 H new ATOM 0 HB2 PRO A 794 21.793 9.448 -1.192 1.00 0.00 H new ATOM 0 HB3 PRO A 794 23.086 10.387 -0.473 1.00 0.00 H new ATOM 0 HG2 PRO A 794 23.194 7.632 -1.684 1.00 0.00 H new ATOM 0 HG3 PRO A 794 24.328 8.957 -1.860 1.00 0.00 H new ATOM 0 HD2 PRO A 794 24.744 6.861 -0.127 1.00 0.00 H new ATOM 0 HD3 PRO A 794 25.422 8.456 0.136 1.00 0.00 H new ATOM 610 N ALA A 795 21.480 6.530 0.795 1.00 0.00 N ATOM 611 CA ALA A 795 20.475 5.473 0.742 1.00 0.00 C ATOM 612 C ALA A 795 19.639 5.554 -0.532 1.00 0.00 C ATOM 613 O ALA A 795 18.407 5.613 -0.475 1.00 0.00 O ATOM 614 CB ALA A 795 19.585 5.530 1.974 1.00 0.00 C ATOM 0 H ALA A 795 22.434 6.186 0.909 1.00 0.00 H new ATOM 0 HA ALA A 795 20.997 4.516 0.729 1.00 0.00 H new ATOM 0 HB1 ALA A 795 18.840 4.736 1.922 1.00 0.00 H new ATOM 0 HB2 ALA A 795 20.193 5.398 2.869 1.00 0.00 H new ATOM 0 HB3 ALA A 795 19.083 6.497 2.016 1.00 0.00 H new ATOM 620 N GLY A 796 20.319 5.552 -1.677 1.00 0.00 N ATOM 621 CA GLY A 796 19.639 5.653 -2.957 1.00 0.00 C ATOM 622 C GLY A 796 18.763 6.886 -3.043 1.00 0.00 C ATOM 623 O GLY A 796 19.137 7.955 -2.556 1.00 0.00 O ATOM 0 H GLY A 796 21.335 5.482 -1.740 1.00 0.00 H new ATOM 0 HA2 GLY A 796 20.378 5.677 -3.758 1.00 0.00 H new ATOM 0 HA3 GLY A 796 19.028 4.764 -3.113 1.00 0.00 H new ATOM 627 N ARG A 797 17.594 6.744 -3.654 1.00 0.00 N ATOM 628 CA ARG A 797 16.638 7.836 -3.725 1.00 0.00 C ATOM 629 C ARG A 797 15.221 7.299 -3.888 1.00 0.00 C ATOM 630 O ARG A 797 14.749 7.072 -5.000 1.00 0.00 O ATOM 631 CB ARG A 797 16.985 8.787 -4.874 1.00 0.00 C ATOM 632 CG ARG A 797 16.381 10.175 -4.722 1.00 0.00 C ATOM 633 CD ARG A 797 16.228 10.867 -6.068 1.00 0.00 C ATOM 634 NE ARG A 797 15.120 10.316 -6.848 1.00 0.00 N ATOM 635 CZ ARG A 797 15.273 9.494 -7.886 1.00 0.00 C ATOM 636 NH1 ARG A 797 16.489 9.138 -8.285 1.00 0.00 N ATOM 637 NH2 ARG A 797 14.208 9.031 -8.531 1.00 0.00 N ATOM 0 H ARG A 797 17.287 5.883 -4.107 1.00 0.00 H new ATOM 0 HA ARG A 797 16.690 8.394 -2.790 1.00 0.00 H new ATOM 0 HB2 ARG A 797 18.069 8.878 -4.944 1.00 0.00 H new ATOM 0 HB3 ARG A 797 16.640 8.351 -5.812 1.00 0.00 H new ATOM 0 HG2 ARG A 797 15.407 10.098 -4.238 1.00 0.00 H new ATOM 0 HG3 ARG A 797 17.013 10.779 -4.071 1.00 0.00 H new ATOM 0 HD2 ARG A 797 16.065 11.933 -5.910 1.00 0.00 H new ATOM 0 HD3 ARG A 797 17.154 10.767 -6.634 1.00 0.00 H new ATOM 0 HE ARG A 797 14.171 10.577 -6.581 1.00 0.00 H new ATOM 0 HH11 ARG A 797 17.311 9.494 -7.796 1.00 0.00 H new ATOM 0 HH12 ARG A 797 16.601 8.509 -9.080 1.00 0.00 H new ATOM 0 HH21 ARG A 797 13.272 9.305 -8.232 1.00 0.00 H new ATOM 0 HH22 ARG A 797 14.326 8.402 -9.325 1.00 0.00 H new ATOM 651 N TYR A 798 14.549 7.100 -2.763 1.00 0.00 N ATOM 652 CA TYR A 798 13.212 6.514 -2.751 1.00 0.00 C ATOM 653 C TYR A 798 12.195 7.579 -2.360 1.00 0.00 C ATOM 654 O TYR A 798 11.040 7.275 -2.067 1.00 0.00 O ATOM 655 CB TYR A 798 13.129 5.334 -1.757 1.00 0.00 C ATOM 656 CG TYR A 798 14.220 4.277 -1.895 1.00 0.00 C ATOM 657 CD1 TYR A 798 15.556 4.631 -2.001 1.00 0.00 C ATOM 658 CD2 TYR A 798 13.908 2.922 -1.905 1.00 0.00 C ATOM 659 CE1 TYR A 798 16.548 3.689 -2.116 1.00 0.00 C ATOM 660 CE2 TYR A 798 14.899 1.962 -2.021 1.00 0.00 C ATOM 661 CZ TYR A 798 16.220 2.353 -2.125 1.00 0.00 C ATOM 662 OH TYR A 798 17.214 1.407 -2.234 1.00 0.00 O ATOM 0 H TYR A 798 14.910 7.337 -1.839 1.00 0.00 H new ATOM 0 HA TYR A 798 12.994 6.137 -3.750 1.00 0.00 H new ATOM 0 HB2 TYR A 798 13.161 5.733 -0.743 1.00 0.00 H new ATOM 0 HB3 TYR A 798 12.161 4.848 -1.877 1.00 0.00 H new ATOM 0 HD1 TYR A 798 15.824 5.677 -1.993 1.00 0.00 H new ATOM 0 HD2 TYR A 798 12.876 2.614 -1.821 1.00 0.00 H new ATOM 0 HE1 TYR A 798 17.580 3.995 -2.199 1.00 0.00 H new ATOM 0 HE2 TYR A 798 14.641 0.913 -2.030 1.00 0.00 H new ATOM 0 HH TYR A 798 17.495 1.334 -3.170 1.00 0.00 H new ATOM 672 N ASP A 799 12.649 8.829 -2.380 1.00 0.00 N ATOM 673 CA ASP A 799 11.866 9.967 -1.895 1.00 0.00 C ATOM 674 C ASP A 799 10.530 10.101 -2.617 1.00 0.00 C ATOM 675 O ASP A 799 9.485 10.213 -1.980 1.00 0.00 O ATOM 676 CB ASP A 799 12.676 11.259 -2.050 1.00 0.00 C ATOM 677 CG ASP A 799 11.822 12.507 -1.952 1.00 0.00 C ATOM 678 OD1 ASP A 799 11.393 12.860 -0.833 1.00 0.00 O ATOM 679 OD2 ASP A 799 11.591 13.158 -2.993 1.00 0.00 O ATOM 0 H ASP A 799 13.571 9.084 -2.733 1.00 0.00 H new ATOM 0 HA ASP A 799 11.649 9.789 -0.842 1.00 0.00 H new ATOM 0 HB2 ASP A 799 13.448 11.292 -1.281 1.00 0.00 H new ATOM 0 HB3 ASP A 799 13.186 11.249 -3.013 1.00 0.00 H new ATOM 684 N GLN A 800 10.562 10.075 -3.941 1.00 0.00 N ATOM 685 CA GLN A 800 9.357 10.274 -4.733 1.00 0.00 C ATOM 686 C GLN A 800 8.438 9.068 -4.624 1.00 0.00 C ATOM 687 O GLN A 800 7.214 9.207 -4.598 1.00 0.00 O ATOM 688 CB GLN A 800 9.713 10.525 -6.196 1.00 0.00 C ATOM 689 CG GLN A 800 10.338 11.886 -6.443 1.00 0.00 C ATOM 690 CD GLN A 800 11.755 11.789 -6.966 1.00 0.00 C ATOM 691 OE1 GLN A 800 12.608 11.137 -6.364 1.00 0.00 O ATOM 692 NE2 GLN A 800 12.016 12.438 -8.089 1.00 0.00 N ATOM 0 H GLN A 800 11.408 9.918 -4.489 1.00 0.00 H new ATOM 0 HA GLN A 800 8.836 11.148 -4.342 1.00 0.00 H new ATOM 0 HB2 GLN A 800 10.403 9.751 -6.532 1.00 0.00 H new ATOM 0 HB3 GLN A 800 8.812 10.433 -6.802 1.00 0.00 H new ATOM 0 HG2 GLN A 800 9.728 12.438 -7.158 1.00 0.00 H new ATOM 0 HG3 GLN A 800 10.336 12.457 -5.514 1.00 0.00 H new ATOM 0 HE21 GLN A 800 11.279 12.967 -8.556 1.00 0.00 H new ATOM 0 HE22 GLN A 800 12.954 12.410 -8.488 1.00 0.00 H new ATOM 701 N ALA A 801 9.036 7.890 -4.546 1.00 0.00 N ATOM 702 CA ALA A 801 8.279 6.653 -4.443 1.00 0.00 C ATOM 703 C ALA A 801 7.489 6.610 -3.142 1.00 0.00 C ATOM 704 O ALA A 801 6.275 6.400 -3.150 1.00 0.00 O ATOM 705 CB ALA A 801 9.209 5.456 -4.546 1.00 0.00 C ATOM 0 H ALA A 801 10.048 7.764 -4.552 1.00 0.00 H new ATOM 0 HA ALA A 801 7.570 6.613 -5.270 1.00 0.00 H new ATOM 0 HB1 ALA A 801 8.629 4.537 -4.467 1.00 0.00 H new ATOM 0 HB2 ALA A 801 9.726 5.478 -5.506 1.00 0.00 H new ATOM 0 HB3 ALA A 801 9.941 5.493 -3.739 1.00 0.00 H new ATOM 711 N THR A 802 8.171 6.842 -2.025 1.00 0.00 N ATOM 712 CA THR A 802 7.527 6.804 -0.723 1.00 0.00 C ATOM 713 C THR A 802 6.520 7.940 -0.590 1.00 0.00 C ATOM 714 O THR A 802 5.436 7.767 -0.030 1.00 0.00 O ATOM 715 CB THR A 802 8.560 6.888 0.417 1.00 0.00 C ATOM 716 OG1 THR A 802 9.461 7.980 0.189 1.00 0.00 O ATOM 717 CG2 THR A 802 9.349 5.592 0.522 1.00 0.00 C ATOM 0 H THR A 802 9.168 7.058 -1.998 1.00 0.00 H new ATOM 0 HA THR A 802 7.004 5.851 -0.644 1.00 0.00 H new ATOM 0 HB THR A 802 8.023 7.051 1.352 1.00 0.00 H new ATOM 0 HG1 THR A 802 10.112 7.729 -0.499 1.00 0.00 H new ATOM 0 HG21 THR A 802 10.073 5.672 1.333 1.00 0.00 H new ATOM 0 HG22 THR A 802 8.667 4.766 0.724 1.00 0.00 H new ATOM 0 HG23 THR A 802 9.873 5.408 -0.416 1.00 0.00 H new ATOM 725 N ASP A 803 6.883 9.097 -1.134 1.00 0.00 N ATOM 726 CA ASP A 803 6.020 10.273 -1.105 1.00 0.00 C ATOM 727 C ASP A 803 4.717 10.012 -1.849 1.00 0.00 C ATOM 728 O ASP A 803 3.637 10.338 -1.356 1.00 0.00 O ATOM 729 CB ASP A 803 6.740 11.470 -1.723 1.00 0.00 C ATOM 730 CG ASP A 803 6.028 12.777 -1.461 1.00 0.00 C ATOM 731 OD1 ASP A 803 5.827 13.121 -0.278 1.00 0.00 O ATOM 732 OD2 ASP A 803 5.679 13.471 -2.436 1.00 0.00 O ATOM 0 H ASP A 803 7.776 9.246 -1.604 1.00 0.00 H new ATOM 0 HA ASP A 803 5.784 10.494 -0.064 1.00 0.00 H new ATOM 0 HB2 ASP A 803 7.752 11.526 -1.323 1.00 0.00 H new ATOM 0 HB3 ASP A 803 6.830 11.319 -2.799 1.00 0.00 H new ATOM 737 N THR A 804 4.824 9.415 -3.030 1.00 0.00 N ATOM 738 CA THR A 804 3.652 9.089 -3.829 1.00 0.00 C ATOM 739 C THR A 804 2.738 8.114 -3.083 1.00 0.00 C ATOM 740 O THR A 804 1.531 8.337 -2.986 1.00 0.00 O ATOM 741 CB THR A 804 4.051 8.494 -5.198 1.00 0.00 C ATOM 742 OG1 THR A 804 4.861 9.432 -5.919 1.00 0.00 O ATOM 743 CG2 THR A 804 2.821 8.149 -6.026 1.00 0.00 C ATOM 0 H THR A 804 5.712 9.147 -3.455 1.00 0.00 H new ATOM 0 HA THR A 804 3.109 10.018 -4.004 1.00 0.00 H new ATOM 0 HB THR A 804 4.615 7.579 -5.017 1.00 0.00 H new ATOM 0 HG1 THR A 804 5.712 9.559 -5.449 1.00 0.00 H new ATOM 0 HG21 THR A 804 3.132 7.732 -6.984 1.00 0.00 H new ATOM 0 HG22 THR A 804 2.216 7.417 -5.491 1.00 0.00 H new ATOM 0 HG23 THR A 804 2.233 9.051 -6.197 1.00 0.00 H new ATOM 751 N ILE A 805 3.325 7.053 -2.533 1.00 0.00 N ATOM 752 CA ILE A 805 2.561 6.050 -1.799 1.00 0.00 C ATOM 753 C ILE A 805 1.843 6.671 -0.608 1.00 0.00 C ATOM 754 O ILE A 805 0.624 6.564 -0.493 1.00 0.00 O ATOM 755 CB ILE A 805 3.464 4.896 -1.308 1.00 0.00 C ATOM 756 CG1 ILE A 805 3.822 3.984 -2.475 1.00 0.00 C ATOM 757 CG2 ILE A 805 2.789 4.093 -0.201 1.00 0.00 C ATOM 758 CD1 ILE A 805 5.252 3.517 -2.441 1.00 0.00 C ATOM 0 H ILE A 805 4.327 6.867 -2.582 1.00 0.00 H new ATOM 0 HA ILE A 805 1.822 5.646 -2.491 1.00 0.00 H new ATOM 0 HB ILE A 805 4.375 5.331 -0.897 1.00 0.00 H new ATOM 0 HG12 ILE A 805 3.162 3.116 -2.466 1.00 0.00 H new ATOM 0 HG13 ILE A 805 3.641 4.513 -3.411 1.00 0.00 H new ATOM 0 HG21 ILE A 805 3.451 3.289 0.121 1.00 0.00 H new ATOM 0 HG22 ILE A 805 2.574 4.747 0.644 1.00 0.00 H new ATOM 0 HG23 ILE A 805 1.858 3.668 -0.576 1.00 0.00 H new ATOM 0 HD11 ILE A 805 5.444 2.871 -3.298 1.00 0.00 H new ATOM 0 HD12 ILE A 805 5.917 4.379 -2.480 1.00 0.00 H new ATOM 0 HD13 ILE A 805 5.432 2.961 -1.521 1.00 0.00 H new ATOM 770 N LEU A 806 2.598 7.325 0.269 1.00 0.00 N ATOM 771 CA LEU A 806 2.023 7.927 1.471 1.00 0.00 C ATOM 772 C LEU A 806 0.876 8.863 1.124 1.00 0.00 C ATOM 773 O LEU A 806 -0.219 8.724 1.659 1.00 0.00 O ATOM 774 CB LEU A 806 3.078 8.692 2.265 1.00 0.00 C ATOM 775 CG LEU A 806 3.309 8.183 3.691 1.00 0.00 C ATOM 776 CD1 LEU A 806 4.282 9.084 4.427 1.00 0.00 C ATOM 777 CD2 LEU A 806 1.994 8.094 4.450 1.00 0.00 C ATOM 0 H LEU A 806 3.605 7.452 0.172 1.00 0.00 H new ATOM 0 HA LEU A 806 1.641 7.111 2.084 1.00 0.00 H new ATOM 0 HB2 LEU A 806 4.022 8.648 1.722 1.00 0.00 H new ATOM 0 HB3 LEU A 806 2.786 9.741 2.312 1.00 0.00 H new ATOM 0 HG LEU A 806 3.740 7.184 3.630 1.00 0.00 H new ATOM 0 HD11 LEU A 806 4.434 8.707 5.438 1.00 0.00 H new ATOM 0 HD12 LEU A 806 5.235 9.099 3.898 1.00 0.00 H new ATOM 0 HD13 LEU A 806 3.877 10.095 4.474 1.00 0.00 H new ATOM 0 HD21 LEU A 806 2.181 7.730 5.460 1.00 0.00 H new ATOM 0 HD22 LEU A 806 1.535 9.081 4.499 1.00 0.00 H new ATOM 0 HD23 LEU A 806 1.323 7.406 3.935 1.00 0.00 H new ATOM 789 N THR A 807 1.129 9.799 0.219 1.00 0.00 N ATOM 790 CA THR A 807 0.112 10.756 -0.191 1.00 0.00 C ATOM 791 C THR A 807 -1.118 10.040 -0.746 1.00 0.00 C ATOM 792 O THR A 807 -2.247 10.389 -0.411 1.00 0.00 O ATOM 793 CB THR A 807 0.665 11.740 -1.238 1.00 0.00 C ATOM 794 OG1 THR A 807 1.906 12.283 -0.771 1.00 0.00 O ATOM 795 CG2 THR A 807 -0.319 12.871 -1.507 1.00 0.00 C ATOM 0 H THR A 807 2.030 9.915 -0.245 1.00 0.00 H new ATOM 0 HA THR A 807 -0.181 11.322 0.693 1.00 0.00 H new ATOM 0 HB THR A 807 0.821 11.198 -2.170 1.00 0.00 H new ATOM 0 HG1 THR A 807 2.651 11.784 -1.167 1.00 0.00 H new ATOM 0 HG21 THR A 807 0.100 13.549 -2.250 1.00 0.00 H new ATOM 0 HG22 THR A 807 -1.256 12.457 -1.881 1.00 0.00 H new ATOM 0 HG23 THR A 807 -0.507 13.417 -0.583 1.00 0.00 H new ATOM 803 N VAL A 808 -0.886 9.019 -1.562 1.00 0.00 N ATOM 804 CA VAL A 808 -1.970 8.252 -2.163 1.00 0.00 C ATOM 805 C VAL A 808 -2.775 7.501 -1.096 1.00 0.00 C ATOM 806 O VAL A 808 -3.999 7.616 -1.042 1.00 0.00 O ATOM 807 CB VAL A 808 -1.421 7.258 -3.217 1.00 0.00 C ATOM 808 CG1 VAL A 808 -2.269 5.999 -3.301 1.00 0.00 C ATOM 809 CG2 VAL A 808 -1.330 7.928 -4.577 1.00 0.00 C ATOM 0 H VAL A 808 0.048 8.702 -1.824 1.00 0.00 H new ATOM 0 HA VAL A 808 -2.637 8.956 -2.661 1.00 0.00 H new ATOM 0 HB VAL A 808 -0.422 6.960 -2.900 1.00 0.00 H new ATOM 0 HG11 VAL A 808 -1.851 5.328 -4.051 1.00 0.00 H new ATOM 0 HG12 VAL A 808 -2.277 5.500 -2.332 1.00 0.00 H new ATOM 0 HG13 VAL A 808 -3.289 6.265 -3.580 1.00 0.00 H new ATOM 0 HG21 VAL A 808 -0.943 7.218 -5.307 1.00 0.00 H new ATOM 0 HG22 VAL A 808 -2.321 8.262 -4.885 1.00 0.00 H new ATOM 0 HG23 VAL A 808 -0.661 8.786 -4.516 1.00 0.00 H new ATOM 819 N THR A 809 -2.085 6.750 -0.241 1.00 0.00 N ATOM 820 CA THR A 809 -2.751 5.971 0.799 1.00 0.00 C ATOM 821 C THR A 809 -3.476 6.884 1.777 1.00 0.00 C ATOM 822 O THR A 809 -4.605 6.608 2.186 1.00 0.00 O ATOM 823 CB THR A 809 -1.758 5.083 1.574 1.00 0.00 C ATOM 824 OG1 THR A 809 -0.702 4.649 0.707 1.00 0.00 O ATOM 825 CG2 THR A 809 -2.463 3.871 2.155 1.00 0.00 C ATOM 0 H THR A 809 -1.069 6.665 -0.248 1.00 0.00 H new ATOM 0 HA THR A 809 -3.473 5.326 0.298 1.00 0.00 H new ATOM 0 HB THR A 809 -1.339 5.673 2.389 1.00 0.00 H new ATOM 0 HG1 THR A 809 -0.051 5.373 0.597 1.00 0.00 H new ATOM 0 HG21 THR A 809 -1.744 3.257 2.698 1.00 0.00 H new ATOM 0 HG22 THR A 809 -3.248 4.199 2.836 1.00 0.00 H new ATOM 0 HG23 THR A 809 -2.904 3.285 1.348 1.00 0.00 H new ATOM 833 N GLU A 810 -2.826 7.984 2.128 1.00 0.00 N ATOM 834 CA GLU A 810 -3.407 8.962 3.028 1.00 0.00 C ATOM 835 C GLU A 810 -4.615 9.634 2.370 1.00 0.00 C ATOM 836 O GLU A 810 -5.567 10.024 3.047 1.00 0.00 O ATOM 837 CB GLU A 810 -2.339 9.986 3.439 1.00 0.00 C ATOM 838 CG GLU A 810 -2.887 11.187 4.193 1.00 0.00 C ATOM 839 CD GLU A 810 -3.273 10.853 5.620 1.00 0.00 C ATOM 840 OE1 GLU A 810 -2.567 10.049 6.264 1.00 0.00 O ATOM 841 OE2 GLU A 810 -4.282 11.403 6.107 1.00 0.00 O ATOM 0 H GLU A 810 -1.890 8.220 1.799 1.00 0.00 H new ATOM 0 HA GLU A 810 -3.761 8.464 3.931 1.00 0.00 H new ATOM 0 HB2 GLU A 810 -1.595 9.489 4.061 1.00 0.00 H new ATOM 0 HB3 GLU A 810 -1.824 10.336 2.545 1.00 0.00 H new ATOM 0 HG2 GLU A 810 -2.139 11.980 4.199 1.00 0.00 H new ATOM 0 HG3 GLU A 810 -3.759 11.575 3.666 1.00 0.00 H new ATOM 848 N ASN A 811 -4.585 9.732 1.042 1.00 0.00 N ATOM 849 CA ASN A 811 -5.697 10.299 0.280 1.00 0.00 C ATOM 850 C ASN A 811 -6.938 9.429 0.417 1.00 0.00 C ATOM 851 O ASN A 811 -8.054 9.934 0.504 1.00 0.00 O ATOM 852 CB ASN A 811 -5.342 10.417 -1.204 1.00 0.00 C ATOM 853 CG ASN A 811 -4.709 11.742 -1.575 1.00 0.00 C ATOM 854 OD1 ASN A 811 -4.757 12.712 -0.817 1.00 0.00 O ATOM 855 ND2 ASN A 811 -4.109 11.786 -2.753 1.00 0.00 N ATOM 0 H ASN A 811 -3.799 9.425 0.469 1.00 0.00 H new ATOM 0 HA ASN A 811 -5.896 11.292 0.683 1.00 0.00 H new ATOM 0 HB2 ASN A 811 -4.659 9.611 -1.470 1.00 0.00 H new ATOM 0 HB3 ASN A 811 -6.246 10.278 -1.797 1.00 0.00 H new ATOM 0 HD21 ASN A 811 -3.662 12.648 -3.066 1.00 0.00 H new ATOM 0 HD22 ASN A 811 -4.093 10.958 -3.349 1.00 0.00 H new ATOM 862 N ILE A 812 -6.738 8.113 0.430 1.00 0.00 N ATOM 863 CA ILE A 812 -7.848 7.171 0.546 1.00 0.00 C ATOM 864 C ILE A 812 -8.575 7.356 1.877 1.00 0.00 C ATOM 865 O ILE A 812 -9.790 7.192 1.954 1.00 0.00 O ATOM 866 CB ILE A 812 -7.372 5.703 0.400 1.00 0.00 C ATOM 867 CG1 ILE A 812 -6.860 5.451 -1.019 1.00 0.00 C ATOM 868 CG2 ILE A 812 -8.497 4.727 0.728 1.00 0.00 C ATOM 869 CD1 ILE A 812 -5.501 4.788 -1.068 1.00 0.00 C ATOM 0 H ILE A 812 -5.819 7.676 0.362 1.00 0.00 H new ATOM 0 HA ILE A 812 -8.539 7.383 -0.270 1.00 0.00 H new ATOM 0 HB ILE A 812 -6.559 5.540 1.108 1.00 0.00 H new ATOM 0 HG12 ILE A 812 -7.578 4.826 -1.549 1.00 0.00 H new ATOM 0 HG13 ILE A 812 -6.810 6.401 -1.552 1.00 0.00 H new ATOM 0 HG21 ILE A 812 -8.136 3.705 0.617 1.00 0.00 H new ATOM 0 HG22 ILE A 812 -8.829 4.886 1.754 1.00 0.00 H new ATOM 0 HG23 ILE A 812 -9.332 4.892 0.047 1.00 0.00 H new ATOM 0 HD11 ILE A 812 -5.205 4.642 -2.107 1.00 0.00 H new ATOM 0 HD12 ILE A 812 -4.769 5.422 -0.568 1.00 0.00 H new ATOM 0 HD13 ILE A 812 -5.549 3.822 -0.565 1.00 0.00 H new ATOM 881 N PHE A 813 -7.831 7.722 2.916 1.00 0.00 N ATOM 882 CA PHE A 813 -8.425 7.987 4.223 1.00 0.00 C ATOM 883 C PHE A 813 -9.324 9.219 4.163 1.00 0.00 C ATOM 884 O PHE A 813 -10.380 9.265 4.794 1.00 0.00 O ATOM 885 CB PHE A 813 -7.335 8.197 5.277 1.00 0.00 C ATOM 886 CG PHE A 813 -6.663 6.928 5.713 1.00 0.00 C ATOM 887 CD1 PHE A 813 -7.380 5.927 6.347 1.00 0.00 C ATOM 888 CD2 PHE A 813 -5.311 6.740 5.491 1.00 0.00 C ATOM 889 CE1 PHE A 813 -6.758 4.759 6.747 1.00 0.00 C ATOM 890 CE2 PHE A 813 -4.684 5.577 5.888 1.00 0.00 C ATOM 891 CZ PHE A 813 -5.408 4.586 6.518 1.00 0.00 C ATOM 0 H PHE A 813 -6.819 7.842 2.879 1.00 0.00 H new ATOM 0 HA PHE A 813 -9.026 7.122 4.502 1.00 0.00 H new ATOM 0 HB2 PHE A 813 -6.583 8.877 4.878 1.00 0.00 H new ATOM 0 HB3 PHE A 813 -7.774 8.683 6.148 1.00 0.00 H new ATOM 0 HD1 PHE A 813 -8.436 6.060 6.531 1.00 0.00 H new ATOM 0 HD2 PHE A 813 -4.739 7.514 5.001 1.00 0.00 H new ATOM 0 HE1 PHE A 813 -7.327 3.983 7.238 1.00 0.00 H new ATOM 0 HE2 PHE A 813 -3.628 5.443 5.706 1.00 0.00 H new ATOM 0 HZ PHE A 813 -4.919 3.676 6.832 1.00 0.00 H new ATOM 901 N SER A 814 -8.902 10.212 3.393 1.00 0.00 N ATOM 902 CA SER A 814 -9.663 11.442 3.240 1.00 0.00 C ATOM 903 C SER A 814 -10.843 11.238 2.293 1.00 0.00 C ATOM 904 O SER A 814 -11.902 11.839 2.461 1.00 0.00 O ATOM 905 CB SER A 814 -8.749 12.547 2.711 1.00 0.00 C ATOM 906 OG SER A 814 -7.387 12.160 2.809 1.00 0.00 O ATOM 0 H SER A 814 -8.031 10.188 2.862 1.00 0.00 H new ATOM 0 HA SER A 814 -10.057 11.732 4.214 1.00 0.00 H new ATOM 0 HB2 SER A 814 -8.997 12.765 1.672 1.00 0.00 H new ATOM 0 HB3 SER A 814 -8.913 13.464 3.277 1.00 0.00 H new ATOM 0 HG SER A 814 -6.817 12.879 2.464 1.00 0.00 H new ATOM 912 N SER A 815 -10.660 10.368 1.311 1.00 0.00 N ATOM 913 CA SER A 815 -11.678 10.136 0.297 1.00 0.00 C ATOM 914 C SER A 815 -12.438 8.839 0.558 1.00 0.00 C ATOM 915 O SER A 815 -13.063 8.288 -0.349 1.00 0.00 O ATOM 916 CB SER A 815 -11.032 10.098 -1.088 1.00 0.00 C ATOM 917 OG SER A 815 -9.898 10.952 -1.144 1.00 0.00 O ATOM 0 H SER A 815 -9.814 9.810 1.195 1.00 0.00 H new ATOM 0 HA SER A 815 -12.394 10.957 0.341 1.00 0.00 H new ATOM 0 HB2 SER A 815 -10.735 9.077 -1.327 1.00 0.00 H new ATOM 0 HB3 SER A 815 -11.759 10.403 -1.841 1.00 0.00 H new ATOM 0 HG SER A 815 -9.118 10.485 -0.778 1.00 0.00 H new ATOM 923 N MET A 816 -12.379 8.356 1.797 1.00 0.00 N ATOM 924 CA MET A 816 -13.077 7.133 2.179 1.00 0.00 C ATOM 925 C MET A 816 -14.580 7.334 2.068 1.00 0.00 C ATOM 926 O MET A 816 -15.213 7.908 2.955 1.00 0.00 O ATOM 927 CB MET A 816 -12.705 6.718 3.605 1.00 0.00 C ATOM 928 CG MET A 816 -12.411 5.233 3.746 1.00 0.00 C ATOM 929 SD MET A 816 -11.490 4.841 5.244 1.00 0.00 S ATOM 930 CE MET A 816 -9.983 4.179 4.540 1.00 0.00 C ATOM 0 H MET A 816 -11.854 8.794 2.554 1.00 0.00 H new ATOM 0 HA MET A 816 -12.773 6.337 1.500 1.00 0.00 H new ATOM 0 HB2 MET A 816 -11.831 7.285 3.924 1.00 0.00 H new ATOM 0 HB3 MET A 816 -13.521 6.984 4.277 1.00 0.00 H new ATOM 0 HG2 MET A 816 -13.350 4.680 3.748 1.00 0.00 H new ATOM 0 HG3 MET A 816 -11.844 4.896 2.878 1.00 0.00 H new ATOM 0 HE1 MET A 816 -9.244 4.037 5.329 1.00 0.00 H new ATOM 0 HE2 MET A 816 -10.194 3.221 4.064 1.00 0.00 H new ATOM 0 HE3 MET A 816 -9.592 4.875 3.798 1.00 0.00 H new ATOM 940 N GLY A 817 -15.136 6.870 0.968 1.00 0.00 N ATOM 941 CA GLY A 817 -16.534 7.088 0.687 1.00 0.00 C ATOM 942 C GLY A 817 -16.753 7.339 -0.784 1.00 0.00 C ATOM 943 O GLY A 817 -17.806 7.016 -1.332 1.00 0.00 O ATOM 0 H GLY A 817 -14.637 6.339 0.254 1.00 0.00 H new ATOM 0 HA2 GLY A 817 -17.112 6.220 1.002 1.00 0.00 H new ATOM 0 HA3 GLY A 817 -16.897 7.939 1.263 1.00 0.00 H new ATOM 947 N ASP A 818 -15.744 7.915 -1.427 1.00 0.00 N ATOM 948 CA ASP A 818 -15.778 8.113 -2.866 1.00 0.00 C ATOM 949 C ASP A 818 -15.131 6.927 -3.554 1.00 0.00 C ATOM 950 O ASP A 818 -13.908 6.769 -3.533 1.00 0.00 O ATOM 951 CB ASP A 818 -15.071 9.405 -3.280 1.00 0.00 C ATOM 952 CG ASP A 818 -15.324 9.749 -4.738 1.00 0.00 C ATOM 953 OD1 ASP A 818 -14.804 9.044 -5.625 1.00 0.00 O ATOM 954 OD2 ASP A 818 -16.057 10.724 -5.007 1.00 0.00 O ATOM 0 H ASP A 818 -14.895 8.252 -0.973 1.00 0.00 H new ATOM 0 HA ASP A 818 -16.821 8.198 -3.170 1.00 0.00 H new ATOM 0 HB2 ASP A 818 -15.415 10.225 -2.649 1.00 0.00 H new ATOM 0 HB3 ASP A 818 -13.999 9.302 -3.112 1.00 0.00 H new ATOM 959 N ALA A 819 -15.965 6.098 -4.155 1.00 0.00 N ATOM 960 CA ALA A 819 -15.520 4.872 -4.797 1.00 0.00 C ATOM 961 C ALA A 819 -14.487 5.149 -5.882 1.00 0.00 C ATOM 962 O ALA A 819 -13.437 4.508 -5.931 1.00 0.00 O ATOM 963 CB ALA A 819 -16.714 4.149 -5.392 1.00 0.00 C ATOM 0 H ALA A 819 -16.971 6.255 -4.212 1.00 0.00 H new ATOM 0 HA ALA A 819 -15.046 4.246 -4.041 1.00 0.00 H new ATOM 0 HB1 ALA A 819 -16.380 3.230 -5.873 1.00 0.00 H new ATOM 0 HB2 ALA A 819 -17.424 3.907 -4.601 1.00 0.00 H new ATOM 0 HB3 ALA A 819 -17.197 4.790 -6.130 1.00 0.00 H new ATOM 969 N GLY A 820 -14.787 6.121 -6.734 1.00 0.00 N ATOM 970 CA GLY A 820 -13.930 6.410 -7.863 1.00 0.00 C ATOM 971 C GLY A 820 -12.568 6.920 -7.443 1.00 0.00 C ATOM 972 O GLY A 820 -11.548 6.469 -7.962 1.00 0.00 O ATOM 0 H GLY A 820 -15.613 6.716 -6.661 1.00 0.00 H new ATOM 0 HA2 GLY A 820 -13.807 5.508 -8.462 1.00 0.00 H new ATOM 0 HA3 GLY A 820 -14.412 7.152 -8.500 1.00 0.00 H new ATOM 976 N GLU A 821 -12.548 7.852 -6.499 1.00 0.00 N ATOM 977 CA GLU A 821 -11.299 8.413 -6.009 1.00 0.00 C ATOM 978 C GLU A 821 -10.492 7.354 -5.273 1.00 0.00 C ATOM 979 O GLU A 821 -9.282 7.242 -5.460 1.00 0.00 O ATOM 980 CB GLU A 821 -11.569 9.602 -5.083 1.00 0.00 C ATOM 981 CG GLU A 821 -10.320 10.387 -4.718 1.00 0.00 C ATOM 982 CD GLU A 821 -9.635 10.983 -5.930 1.00 0.00 C ATOM 983 OE1 GLU A 821 -8.822 10.283 -6.566 1.00 0.00 O ATOM 984 OE2 GLU A 821 -9.913 12.154 -6.256 1.00 0.00 O ATOM 0 H GLU A 821 -13.384 8.235 -6.058 1.00 0.00 H new ATOM 0 HA GLU A 821 -10.723 8.761 -6.866 1.00 0.00 H new ATOM 0 HB2 GLU A 821 -12.281 10.272 -5.565 1.00 0.00 H new ATOM 0 HB3 GLU A 821 -12.040 9.240 -4.169 1.00 0.00 H new ATOM 0 HG2 GLU A 821 -10.586 11.186 -4.026 1.00 0.00 H new ATOM 0 HG3 GLU A 821 -9.623 9.732 -4.196 1.00 0.00 H new ATOM 991 N MET A 822 -11.168 6.567 -4.449 1.00 0.00 N ATOM 992 CA MET A 822 -10.504 5.528 -3.679 1.00 0.00 C ATOM 993 C MET A 822 -9.852 4.503 -4.602 1.00 0.00 C ATOM 994 O MET A 822 -8.705 4.109 -4.391 1.00 0.00 O ATOM 995 CB MET A 822 -11.493 4.842 -2.741 1.00 0.00 C ATOM 996 CG MET A 822 -11.603 5.515 -1.383 1.00 0.00 C ATOM 997 SD MET A 822 -13.001 4.911 -0.417 1.00 0.00 S ATOM 998 CE MET A 822 -12.979 3.179 -0.859 1.00 0.00 C ATOM 0 H MET A 822 -12.175 6.629 -4.297 1.00 0.00 H new ATOM 0 HA MET A 822 -9.723 5.997 -3.080 1.00 0.00 H new ATOM 0 HB2 MET A 822 -12.476 4.826 -3.211 1.00 0.00 H new ATOM 0 HB3 MET A 822 -11.189 3.805 -2.601 1.00 0.00 H new ATOM 0 HG2 MET A 822 -10.682 5.349 -0.824 1.00 0.00 H new ATOM 0 HG3 MET A 822 -11.701 6.592 -1.523 1.00 0.00 H new ATOM 0 HE1 MET A 822 -13.553 2.610 -0.128 1.00 0.00 H new ATOM 0 HE2 MET A 822 -13.421 3.050 -1.847 1.00 0.00 H new ATOM 0 HE3 MET A 822 -11.950 2.820 -0.872 1.00 0.00 H new ATOM 1008 N VAL A 823 -10.582 4.087 -5.634 1.00 0.00 N ATOM 1009 CA VAL A 823 -10.046 3.156 -6.619 1.00 0.00 C ATOM 1010 C VAL A 823 -8.929 3.822 -7.421 1.00 0.00 C ATOM 1011 O VAL A 823 -7.916 3.195 -7.732 1.00 0.00 O ATOM 1012 CB VAL A 823 -11.150 2.641 -7.575 1.00 0.00 C ATOM 1013 CG1 VAL A 823 -10.553 1.928 -8.782 1.00 0.00 C ATOM 1014 CG2 VAL A 823 -12.100 1.716 -6.833 1.00 0.00 C ATOM 0 H VAL A 823 -11.543 4.380 -5.808 1.00 0.00 H new ATOM 0 HA VAL A 823 -9.642 2.299 -6.080 1.00 0.00 H new ATOM 0 HB VAL A 823 -11.707 3.505 -7.939 1.00 0.00 H new ATOM 0 HG11 VAL A 823 -11.355 1.579 -9.432 1.00 0.00 H new ATOM 0 HG12 VAL A 823 -9.914 2.618 -9.333 1.00 0.00 H new ATOM 0 HG13 VAL A 823 -9.962 1.076 -8.446 1.00 0.00 H new ATOM 0 HG21 VAL A 823 -12.871 1.361 -7.517 1.00 0.00 H new ATOM 0 HG22 VAL A 823 -11.545 0.865 -6.439 1.00 0.00 H new ATOM 0 HG23 VAL A 823 -12.566 2.258 -6.010 1.00 0.00 H new ATOM 1024 N ARG A 824 -9.120 5.101 -7.737 1.00 0.00 N ATOM 1025 CA ARG A 824 -8.111 5.883 -8.443 1.00 0.00 C ATOM 1026 C ARG A 824 -6.794 5.867 -7.680 1.00 0.00 C ATOM 1027 O ARG A 824 -5.757 5.488 -8.225 1.00 0.00 O ATOM 1028 CB ARG A 824 -8.585 7.328 -8.622 1.00 0.00 C ATOM 1029 CG ARG A 824 -7.550 8.230 -9.272 1.00 0.00 C ATOM 1030 CD ARG A 824 -8.204 9.337 -10.079 1.00 0.00 C ATOM 1031 NE ARG A 824 -8.672 10.433 -9.234 1.00 0.00 N ATOM 1032 CZ ARG A 824 -9.033 11.630 -9.697 1.00 0.00 C ATOM 1033 NH1 ARG A 824 -8.938 11.908 -10.991 1.00 0.00 N ATOM 1034 NH2 ARG A 824 -9.489 12.552 -8.862 1.00 0.00 N ATOM 0 H ARG A 824 -9.970 5.619 -7.513 1.00 0.00 H new ATOM 0 HA ARG A 824 -7.957 5.434 -9.424 1.00 0.00 H new ATOM 0 HB2 ARG A 824 -9.491 7.332 -9.228 1.00 0.00 H new ATOM 0 HB3 ARG A 824 -8.852 7.738 -7.648 1.00 0.00 H new ATOM 0 HG2 ARG A 824 -6.913 8.667 -8.503 1.00 0.00 H new ATOM 0 HG3 ARG A 824 -6.906 7.637 -9.921 1.00 0.00 H new ATOM 0 HD2 ARG A 824 -7.492 9.722 -10.809 1.00 0.00 H new ATOM 0 HD3 ARG A 824 -9.045 8.928 -10.639 1.00 0.00 H new ATOM 0 HE ARG A 824 -8.726 10.273 -8.228 1.00 0.00 H new ATOM 0 HH11 ARG A 824 -8.587 11.203 -11.640 1.00 0.00 H new ATOM 0 HH12 ARG A 824 -9.216 12.826 -11.337 1.00 0.00 H new ATOM 0 HH21 ARG A 824 -9.564 12.346 -7.866 1.00 0.00 H new ATOM 0 HH22 ARG A 824 -9.765 13.468 -9.215 1.00 0.00 H new ATOM 1048 N GLN A 825 -6.846 6.262 -6.414 1.00 0.00 N ATOM 1049 CA GLN A 825 -5.657 6.299 -5.579 1.00 0.00 C ATOM 1050 C GLN A 825 -5.076 4.901 -5.418 1.00 0.00 C ATOM 1051 O GLN A 825 -3.866 4.714 -5.506 1.00 0.00 O ATOM 1052 CB GLN A 825 -5.981 6.900 -4.213 1.00 0.00 C ATOM 1053 CG GLN A 825 -6.674 8.248 -4.293 1.00 0.00 C ATOM 1054 CD GLN A 825 -5.737 9.374 -4.676 1.00 0.00 C ATOM 1055 OE1 GLN A 825 -4.587 9.422 -4.235 1.00 0.00 O ATOM 1056 NE2 GLN A 825 -6.222 10.287 -5.499 1.00 0.00 N ATOM 0 H GLN A 825 -7.701 6.561 -5.945 1.00 0.00 H new ATOM 0 HA GLN A 825 -4.914 6.929 -6.067 1.00 0.00 H new ATOM 0 HB2 GLN A 825 -6.615 6.206 -3.661 1.00 0.00 H new ATOM 0 HB3 GLN A 825 -5.057 7.008 -3.644 1.00 0.00 H new ATOM 0 HG2 GLN A 825 -7.482 8.192 -5.022 1.00 0.00 H new ATOM 0 HG3 GLN A 825 -7.129 8.474 -3.329 1.00 0.00 H new ATOM 0 HE21 GLN A 825 -7.180 10.209 -5.840 1.00 0.00 H new ATOM 0 HE22 GLN A 825 -5.638 11.070 -5.793 1.00 0.00 H new ATOM 1065 N ALA A 826 -5.944 3.916 -5.212 1.00 0.00 N ATOM 1066 CA ALA A 826 -5.514 2.529 -5.075 1.00 0.00 C ATOM 1067 C ALA A 826 -4.722 2.076 -6.303 1.00 0.00 C ATOM 1068 O ALA A 826 -3.751 1.326 -6.189 1.00 0.00 O ATOM 1069 CB ALA A 826 -6.714 1.620 -4.850 1.00 0.00 C ATOM 0 H ALA A 826 -6.952 4.053 -5.136 1.00 0.00 H new ATOM 0 HA ALA A 826 -4.858 2.462 -4.207 1.00 0.00 H new ATOM 0 HB1 ALA A 826 -6.376 0.589 -4.750 1.00 0.00 H new ATOM 0 HB2 ALA A 826 -7.233 1.921 -3.940 1.00 0.00 H new ATOM 0 HB3 ALA A 826 -7.394 1.698 -5.699 1.00 0.00 H new ATOM 1075 N ARG A 827 -5.133 2.553 -7.473 1.00 0.00 N ATOM 1076 CA ARG A 827 -4.441 2.235 -8.717 1.00 0.00 C ATOM 1077 C ARG A 827 -3.050 2.859 -8.734 1.00 0.00 C ATOM 1078 O ARG A 827 -2.068 2.202 -9.084 1.00 0.00 O ATOM 1079 CB ARG A 827 -5.247 2.730 -9.919 1.00 0.00 C ATOM 1080 CG ARG A 827 -6.383 1.803 -10.312 1.00 0.00 C ATOM 1081 CD ARG A 827 -7.202 2.383 -11.451 1.00 0.00 C ATOM 1082 NE ARG A 827 -6.422 2.501 -12.683 1.00 0.00 N ATOM 1083 CZ ARG A 827 -6.948 2.763 -13.878 1.00 0.00 C ATOM 1084 NH1 ARG A 827 -8.256 2.949 -14.011 1.00 0.00 N ATOM 1085 NH2 ARG A 827 -6.158 2.846 -14.942 1.00 0.00 N ATOM 0 H ARG A 827 -5.943 3.162 -7.586 1.00 0.00 H new ATOM 0 HA ARG A 827 -4.340 1.152 -8.781 1.00 0.00 H new ATOM 0 HB2 ARG A 827 -5.655 3.715 -9.692 1.00 0.00 H new ATOM 0 HB3 ARG A 827 -4.577 2.851 -10.770 1.00 0.00 H new ATOM 0 HG2 ARG A 827 -5.979 0.835 -10.608 1.00 0.00 H new ATOM 0 HG3 ARG A 827 -7.027 1.629 -9.450 1.00 0.00 H new ATOM 0 HD2 ARG A 827 -8.071 1.750 -11.631 1.00 0.00 H new ATOM 0 HD3 ARG A 827 -7.577 3.365 -11.164 1.00 0.00 H new ATOM 0 HE ARG A 827 -5.412 2.375 -12.623 1.00 0.00 H new ATOM 0 HH11 ARG A 827 -8.865 2.892 -13.195 1.00 0.00 H new ATOM 0 HH12 ARG A 827 -8.652 3.149 -14.929 1.00 0.00 H new ATOM 0 HH21 ARG A 827 -5.152 2.709 -14.842 1.00 0.00 H new ATOM 0 HH22 ARG A 827 -6.557 3.046 -15.859 1.00 0.00 H new ATOM 1099 N ILE A 828 -2.971 4.127 -8.343 1.00 0.00 N ATOM 1100 CA ILE A 828 -1.693 4.827 -8.272 1.00 0.00 C ATOM 1101 C ILE A 828 -0.798 4.199 -7.203 1.00 0.00 C ATOM 1102 O ILE A 828 0.423 4.160 -7.344 1.00 0.00 O ATOM 1103 CB ILE A 828 -1.876 6.331 -7.970 1.00 0.00 C ATOM 1104 CG1 ILE A 828 -2.985 6.924 -8.844 1.00 0.00 C ATOM 1105 CG2 ILE A 828 -0.572 7.083 -8.195 1.00 0.00 C ATOM 1106 CD1 ILE A 828 -3.702 8.095 -8.205 1.00 0.00 C ATOM 0 H ILE A 828 -3.776 4.691 -8.071 1.00 0.00 H new ATOM 0 HA ILE A 828 -1.220 4.731 -9.249 1.00 0.00 H new ATOM 0 HB ILE A 828 -2.163 6.437 -6.924 1.00 0.00 H new ATOM 0 HG12 ILE A 828 -2.555 7.246 -9.792 1.00 0.00 H new ATOM 0 HG13 ILE A 828 -3.712 6.144 -9.072 1.00 0.00 H new ATOM 0 HG21 ILE A 828 -0.720 8.141 -7.977 1.00 0.00 H new ATOM 0 HG22 ILE A 828 0.198 6.681 -7.536 1.00 0.00 H new ATOM 0 HG23 ILE A 828 -0.259 6.966 -9.233 1.00 0.00 H new ATOM 0 HD11 ILE A 828 -4.473 8.463 -8.882 1.00 0.00 H new ATOM 0 HD12 ILE A 828 -4.162 7.774 -7.270 1.00 0.00 H new ATOM 0 HD13 ILE A 828 -2.987 8.893 -8.002 1.00 0.00 H new ATOM 1118 N LEU A 829 -1.423 3.704 -6.140 1.00 0.00 N ATOM 1119 CA LEU A 829 -0.709 3.004 -5.078 1.00 0.00 C ATOM 1120 C LEU A 829 -0.001 1.778 -5.636 1.00 0.00 C ATOM 1121 O LEU A 829 1.188 1.572 -5.397 1.00 0.00 O ATOM 1122 CB LEU A 829 -1.689 2.589 -3.972 1.00 0.00 C ATOM 1123 CG LEU A 829 -1.058 2.051 -2.683 1.00 0.00 C ATOM 1124 CD1 LEU A 829 0.204 2.822 -2.326 1.00 0.00 C ATOM 1125 CD2 LEU A 829 -2.061 2.120 -1.543 1.00 0.00 C ATOM 0 H LEU A 829 -2.429 3.775 -5.991 1.00 0.00 H new ATOM 0 HA LEU A 829 0.038 3.676 -4.656 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -2.306 3.451 -3.719 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -2.356 1.826 -4.373 1.00 0.00 H new ATOM 0 HG LEU A 829 -0.779 1.010 -2.849 1.00 0.00 H new ATOM 0 HD11 LEU A 829 0.629 2.418 -1.407 1.00 0.00 H new ATOM 0 HD12 LEU A 829 0.929 2.727 -3.134 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -0.041 3.874 -2.180 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -1.603 1.735 -0.632 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -2.365 3.155 -1.388 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -2.936 1.519 -1.791 1.00 0.00 H new ATOM 1137 N ALA A 830 -0.736 0.979 -6.403 1.00 0.00 N ATOM 1138 CA ALA A 830 -0.178 -0.218 -7.017 1.00 0.00 C ATOM 1139 C ALA A 830 0.971 0.142 -7.949 1.00 0.00 C ATOM 1140 O ALA A 830 1.980 -0.561 -8.011 1.00 0.00 O ATOM 1141 CB ALA A 830 -1.259 -0.981 -7.766 1.00 0.00 C ATOM 0 H ALA A 830 -1.721 1.140 -6.614 1.00 0.00 H new ATOM 0 HA ALA A 830 0.214 -0.860 -6.228 1.00 0.00 H new ATOM 0 HB1 ALA A 830 -0.827 -1.873 -8.220 1.00 0.00 H new ATOM 0 HB2 ALA A 830 -2.047 -1.272 -7.071 1.00 0.00 H new ATOM 0 HB3 ALA A 830 -1.680 -0.345 -8.545 1.00 0.00 H new ATOM 1147 N GLN A 831 0.812 1.251 -8.657 1.00 0.00 N ATOM 1148 CA GLN A 831 1.844 1.748 -9.555 1.00 0.00 C ATOM 1149 C GLN A 831 3.093 2.158 -8.774 1.00 0.00 C ATOM 1150 O GLN A 831 4.209 1.749 -9.097 1.00 0.00 O ATOM 1151 CB GLN A 831 1.303 2.942 -10.350 1.00 0.00 C ATOM 1152 CG GLN A 831 2.313 3.556 -11.305 1.00 0.00 C ATOM 1153 CD GLN A 831 2.621 2.651 -12.477 1.00 0.00 C ATOM 1154 OE1 GLN A 831 1.721 2.214 -13.193 1.00 0.00 O ATOM 1155 NE2 GLN A 831 3.893 2.361 -12.681 1.00 0.00 N ATOM 0 H GLN A 831 -0.029 1.827 -8.626 1.00 0.00 H new ATOM 0 HA GLN A 831 2.121 0.950 -10.244 1.00 0.00 H new ATOM 0 HB2 GLN A 831 0.429 2.622 -10.918 1.00 0.00 H new ATOM 0 HB3 GLN A 831 0.966 3.708 -9.652 1.00 0.00 H new ATOM 0 HG2 GLN A 831 1.929 4.507 -11.675 1.00 0.00 H new ATOM 0 HG3 GLN A 831 3.235 3.773 -10.765 1.00 0.00 H new ATOM 0 HE21 GLN A 831 4.609 2.744 -12.064 1.00 0.00 H new ATOM 0 HE22 GLN A 831 4.160 1.754 -13.456 1.00 0.00 H new ATOM 1164 N ALA A 832 2.885 2.947 -7.729 1.00 0.00 N ATOM 1165 CA ALA A 832 3.980 3.515 -6.957 1.00 0.00 C ATOM 1166 C ALA A 832 4.786 2.444 -6.231 1.00 0.00 C ATOM 1167 O ALA A 832 6.016 2.416 -6.322 1.00 0.00 O ATOM 1168 CB ALA A 832 3.446 4.537 -5.966 1.00 0.00 C ATOM 0 H ALA A 832 1.958 3.210 -7.394 1.00 0.00 H new ATOM 0 HA ALA A 832 4.654 4.008 -7.657 1.00 0.00 H new ATOM 0 HB1 ALA A 832 4.274 4.956 -5.394 1.00 0.00 H new ATOM 0 HB2 ALA A 832 2.937 5.336 -6.506 1.00 0.00 H new ATOM 0 HB3 ALA A 832 2.744 4.053 -5.287 1.00 0.00 H new ATOM 1174 N THR A 833 4.097 1.561 -5.516 1.00 0.00 N ATOM 1175 CA THR A 833 4.770 0.534 -4.732 1.00 0.00 C ATOM 1176 C THR A 833 5.528 -0.453 -5.617 1.00 0.00 C ATOM 1177 O THR A 833 6.570 -0.975 -5.217 1.00 0.00 O ATOM 1178 CB THR A 833 3.778 -0.234 -3.843 1.00 0.00 C ATOM 1179 OG1 THR A 833 2.847 0.679 -3.252 1.00 0.00 O ATOM 1180 CG2 THR A 833 4.514 -0.988 -2.748 1.00 0.00 C ATOM 0 H THR A 833 3.079 1.536 -5.464 1.00 0.00 H new ATOM 0 HA THR A 833 5.489 1.053 -4.097 1.00 0.00 H new ATOM 0 HB THR A 833 3.242 -0.951 -4.464 1.00 0.00 H new ATOM 0 HG1 THR A 833 2.149 0.902 -3.903 1.00 0.00 H new ATOM 0 HG21 THR A 833 3.795 -1.525 -2.130 1.00 0.00 H new ATOM 0 HG22 THR A 833 5.207 -1.698 -3.198 1.00 0.00 H new ATOM 0 HG23 THR A 833 5.068 -0.282 -2.130 1.00 0.00 H new ATOM 1188 N SER A 834 5.023 -0.693 -6.820 1.00 0.00 N ATOM 1189 CA SER A 834 5.674 -1.614 -7.742 1.00 0.00 C ATOM 1190 C SER A 834 7.078 -1.121 -8.087 1.00 0.00 C ATOM 1191 O SER A 834 8.027 -1.907 -8.137 1.00 0.00 O ATOM 1192 CB SER A 834 4.834 -1.785 -9.008 1.00 0.00 C ATOM 1193 OG SER A 834 3.644 -2.504 -8.727 1.00 0.00 O ATOM 0 H SER A 834 4.169 -0.265 -7.179 1.00 0.00 H new ATOM 0 HA SER A 834 5.763 -2.586 -7.257 1.00 0.00 H new ATOM 0 HB2 SER A 834 4.585 -0.807 -9.420 1.00 0.00 H new ATOM 0 HB3 SER A 834 5.413 -2.312 -9.766 1.00 0.00 H new ATOM 0 HG SER A 834 2.914 -1.873 -8.554 1.00 0.00 H new ATOM 1199 N ASP A 835 7.210 0.188 -8.293 1.00 0.00 N ATOM 1200 CA ASP A 835 8.509 0.790 -8.572 1.00 0.00 C ATOM 1201 C ASP A 835 9.373 0.792 -7.319 1.00 0.00 C ATOM 1202 O ASP A 835 10.572 0.513 -7.377 1.00 0.00 O ATOM 1203 CB ASP A 835 8.351 2.222 -9.086 1.00 0.00 C ATOM 1204 CG ASP A 835 9.642 2.772 -9.663 1.00 0.00 C ATOM 1205 OD1 ASP A 835 10.104 2.250 -10.699 1.00 0.00 O ATOM 1206 OD2 ASP A 835 10.203 3.729 -9.086 1.00 0.00 O ATOM 0 H ASP A 835 6.434 0.850 -8.272 1.00 0.00 H new ATOM 0 HA ASP A 835 8.994 0.193 -9.344 1.00 0.00 H new ATOM 0 HB2 ASP A 835 7.574 2.248 -9.850 1.00 0.00 H new ATOM 0 HB3 ASP A 835 8.018 2.864 -8.270 1.00 0.00 H new ATOM 1211 N LEU A 836 8.748 1.094 -6.184 1.00 0.00 N ATOM 1212 CA LEU A 836 9.448 1.130 -4.906 1.00 0.00 C ATOM 1213 C LEU A 836 10.073 -0.226 -4.596 1.00 0.00 C ATOM 1214 O LEU A 836 11.270 -0.320 -4.330 1.00 0.00 O ATOM 1215 CB LEU A 836 8.479 1.528 -3.784 1.00 0.00 C ATOM 1216 CG LEU A 836 9.023 1.389 -2.358 1.00 0.00 C ATOM 1217 CD1 LEU A 836 10.107 2.423 -2.097 1.00 0.00 C ATOM 1218 CD2 LEU A 836 7.899 1.530 -1.346 1.00 0.00 C ATOM 0 H LEU A 836 7.755 1.318 -6.125 1.00 0.00 H new ATOM 0 HA LEU A 836 10.244 1.872 -4.971 1.00 0.00 H new ATOM 0 HB2 LEU A 836 8.178 2.564 -3.939 1.00 0.00 H new ATOM 0 HB3 LEU A 836 7.580 0.918 -3.872 1.00 0.00 H new ATOM 0 HG LEU A 836 9.462 0.397 -2.252 1.00 0.00 H new ATOM 0 HD11 LEU A 836 10.481 2.309 -1.080 1.00 0.00 H new ATOM 0 HD12 LEU A 836 10.925 2.279 -2.803 1.00 0.00 H new ATOM 0 HD13 LEU A 836 9.693 3.424 -2.221 1.00 0.00 H new ATOM 0 HD21 LEU A 836 8.302 1.429 -0.338 1.00 0.00 H new ATOM 0 HD22 LEU A 836 7.433 2.509 -1.454 1.00 0.00 H new ATOM 0 HD23 LEU A 836 7.154 0.753 -1.519 1.00 0.00 H new ATOM 1230 N VAL A 837 9.264 -1.274 -4.675 1.00 0.00 N ATOM 1231 CA VAL A 837 9.720 -2.621 -4.361 1.00 0.00 C ATOM 1232 C VAL A 837 10.767 -3.082 -5.371 1.00 0.00 C ATOM 1233 O VAL A 837 11.729 -3.761 -5.014 1.00 0.00 O ATOM 1234 CB VAL A 837 8.537 -3.615 -4.320 1.00 0.00 C ATOM 1235 CG1 VAL A 837 9.021 -5.051 -4.174 1.00 0.00 C ATOM 1236 CG2 VAL A 837 7.589 -3.255 -3.185 1.00 0.00 C ATOM 0 H VAL A 837 8.285 -1.216 -4.955 1.00 0.00 H new ATOM 0 HA VAL A 837 10.176 -2.597 -3.371 1.00 0.00 H new ATOM 0 HB VAL A 837 8.002 -3.541 -5.267 1.00 0.00 H new ATOM 0 HG11 VAL A 837 8.163 -5.723 -4.149 1.00 0.00 H new ATOM 0 HG12 VAL A 837 9.658 -5.308 -5.020 1.00 0.00 H new ATOM 0 HG13 VAL A 837 9.588 -5.151 -3.249 1.00 0.00 H new ATOM 0 HG21 VAL A 837 6.760 -3.962 -3.166 1.00 0.00 H new ATOM 0 HG22 VAL A 837 8.124 -3.298 -2.236 1.00 0.00 H new ATOM 0 HG23 VAL A 837 7.203 -2.247 -3.339 1.00 0.00 H new ATOM 1246 N ASN A 838 10.590 -2.685 -6.627 1.00 0.00 N ATOM 1247 CA ASN A 838 11.539 -3.031 -7.683 1.00 0.00 C ATOM 1248 C ASN A 838 12.918 -2.455 -7.378 1.00 0.00 C ATOM 1249 O ASN A 838 13.935 -3.139 -7.524 1.00 0.00 O ATOM 1250 CB ASN A 838 11.051 -2.516 -9.038 1.00 0.00 C ATOM 1251 CG ASN A 838 12.004 -2.866 -10.166 1.00 0.00 C ATOM 1252 OD1 ASN A 838 12.225 -4.038 -10.463 1.00 0.00 O ATOM 1253 ND2 ASN A 838 12.575 -1.855 -10.800 1.00 0.00 N ATOM 0 H ASN A 838 9.798 -2.123 -6.940 1.00 0.00 H new ATOM 0 HA ASN A 838 11.613 -4.118 -7.725 1.00 0.00 H new ATOM 0 HB2 ASN A 838 10.069 -2.937 -9.252 1.00 0.00 H new ATOM 0 HB3 ASN A 838 10.930 -1.434 -8.990 1.00 0.00 H new ATOM 0 HD21 ASN A 838 13.225 -2.035 -11.565 1.00 0.00 H new ATOM 0 HD22 ASN A 838 12.365 -0.896 -10.523 1.00 0.00 H new ATOM 1260 N ALA A 839 12.941 -1.200 -6.943 1.00 0.00 N ATOM 1261 CA ALA A 839 14.185 -0.536 -6.576 1.00 0.00 C ATOM 1262 C ALA A 839 14.861 -1.265 -5.422 1.00 0.00 C ATOM 1263 O ALA A 839 16.059 -1.542 -5.468 1.00 0.00 O ATOM 1264 CB ALA A 839 13.919 0.914 -6.205 1.00 0.00 C ATOM 0 H ALA A 839 12.108 -0.621 -6.836 1.00 0.00 H new ATOM 0 HA ALA A 839 14.855 -0.558 -7.435 1.00 0.00 H new ATOM 0 HB1 ALA A 839 14.857 1.398 -5.933 1.00 0.00 H new ATOM 0 HB2 ALA A 839 13.477 1.432 -7.056 1.00 0.00 H new ATOM 0 HB3 ALA A 839 13.232 0.953 -5.360 1.00 0.00 H new ATOM 1270 N ILE A 840 14.079 -1.594 -4.400 1.00 0.00 N ATOM 1271 CA ILE A 840 14.590 -2.309 -3.236 1.00 0.00 C ATOM 1272 C ILE A 840 15.132 -3.679 -3.634 1.00 0.00 C ATOM 1273 O ILE A 840 16.186 -4.101 -3.158 1.00 0.00 O ATOM 1274 CB ILE A 840 13.498 -2.484 -2.159 1.00 0.00 C ATOM 1275 CG1 ILE A 840 13.002 -1.123 -1.681 1.00 0.00 C ATOM 1276 CG2 ILE A 840 14.022 -3.297 -0.983 1.00 0.00 C ATOM 1277 CD1 ILE A 840 11.527 -1.104 -1.351 1.00 0.00 C ATOM 0 H ILE A 840 13.084 -1.376 -4.354 1.00 0.00 H new ATOM 0 HA ILE A 840 15.399 -1.709 -2.820 1.00 0.00 H new ATOM 0 HB ILE A 840 12.664 -3.026 -2.605 1.00 0.00 H new ATOM 0 HG12 ILE A 840 13.568 -0.828 -0.798 1.00 0.00 H new ATOM 0 HG13 ILE A 840 13.204 -0.380 -2.452 1.00 0.00 H new ATOM 0 HG21 ILE A 840 13.235 -3.407 -0.237 1.00 0.00 H new ATOM 0 HG22 ILE A 840 14.332 -4.282 -1.331 1.00 0.00 H new ATOM 0 HG23 ILE A 840 14.875 -2.785 -0.538 1.00 0.00 H new ATOM 0 HD11 ILE A 840 11.242 -0.106 -1.018 1.00 0.00 H new ATOM 0 HD12 ILE A 840 10.952 -1.368 -2.239 1.00 0.00 H new ATOM 0 HD13 ILE A 840 11.322 -1.824 -0.558 1.00 0.00 H new ATOM 1289 N LYS A 841 14.410 -4.361 -4.517 1.00 0.00 N ATOM 1290 CA LYS A 841 14.816 -5.678 -4.992 1.00 0.00 C ATOM 1291 C LYS A 841 16.212 -5.628 -5.605 1.00 0.00 C ATOM 1292 O LYS A 841 17.083 -6.426 -5.253 1.00 0.00 O ATOM 1293 CB LYS A 841 13.815 -6.204 -6.023 1.00 0.00 C ATOM 1294 CG LYS A 841 12.624 -6.917 -5.404 1.00 0.00 C ATOM 1295 CD LYS A 841 12.781 -8.426 -5.479 1.00 0.00 C ATOM 1296 CE LYS A 841 11.609 -9.072 -6.194 1.00 0.00 C ATOM 1297 NZ LYS A 841 10.563 -9.527 -5.242 1.00 0.00 N ATOM 0 H LYS A 841 13.537 -4.021 -4.920 1.00 0.00 H new ATOM 0 HA LYS A 841 14.836 -6.354 -4.137 1.00 0.00 H new ATOM 0 HB2 LYS A 841 13.456 -5.371 -6.627 1.00 0.00 H new ATOM 0 HB3 LYS A 841 14.327 -6.889 -6.698 1.00 0.00 H new ATOM 0 HG2 LYS A 841 12.516 -6.612 -4.363 1.00 0.00 H new ATOM 0 HG3 LYS A 841 11.711 -6.619 -5.920 1.00 0.00 H new ATOM 0 HD2 LYS A 841 13.706 -8.671 -6.000 1.00 0.00 H new ATOM 0 HD3 LYS A 841 12.864 -8.835 -4.472 1.00 0.00 H new ATOM 0 HE2 LYS A 841 11.176 -8.361 -6.897 1.00 0.00 H new ATOM 0 HE3 LYS A 841 11.963 -9.922 -6.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 841 9.780 -9.963 -5.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 841 10.970 -10.225 -4.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 841 10.207 -8.712 -4.703 1.00 0.00 H new ATOM 1311 N ALA A 842 16.422 -4.678 -6.507 1.00 0.00 N ATOM 1312 CA ALA A 842 17.708 -4.527 -7.172 1.00 0.00 C ATOM 1313 C ALA A 842 18.783 -4.094 -6.181 1.00 0.00 C ATOM 1314 O ALA A 842 19.907 -4.599 -6.204 1.00 0.00 O ATOM 1315 CB ALA A 842 17.597 -3.522 -8.310 1.00 0.00 C ATOM 0 H ALA A 842 15.717 -4.000 -6.795 1.00 0.00 H new ATOM 0 HA ALA A 842 17.997 -5.493 -7.585 1.00 0.00 H new ATOM 0 HB1 ALA A 842 18.565 -3.418 -8.799 1.00 0.00 H new ATOM 0 HB2 ALA A 842 16.861 -3.872 -9.034 1.00 0.00 H new ATOM 0 HB3 ALA A 842 17.285 -2.556 -7.913 1.00 0.00 H new ATOM 1321 N ASP A 843 18.420 -3.172 -5.299 1.00 0.00 N ATOM 1322 CA ASP A 843 19.355 -2.628 -4.320 1.00 0.00 C ATOM 1323 C ASP A 843 19.813 -3.696 -3.338 1.00 0.00 C ATOM 1324 O ASP A 843 21.002 -3.819 -3.049 1.00 0.00 O ATOM 1325 CB ASP A 843 18.712 -1.473 -3.556 1.00 0.00 C ATOM 1326 CG ASP A 843 19.225 -0.125 -4.009 1.00 0.00 C ATOM 1327 OD1 ASP A 843 20.424 0.159 -3.816 1.00 0.00 O ATOM 1328 OD2 ASP A 843 18.432 0.665 -4.559 1.00 0.00 O ATOM 0 H ASP A 843 17.479 -2.783 -5.241 1.00 0.00 H new ATOM 0 HA ASP A 843 20.226 -2.263 -4.864 1.00 0.00 H new ATOM 0 HB2 ASP A 843 17.631 -1.510 -3.689 1.00 0.00 H new ATOM 0 HB3 ASP A 843 18.906 -1.593 -2.490 1.00 0.00 H new ATOM 1333 N ALA A 844 18.863 -4.471 -2.831 1.00 0.00 N ATOM 1334 CA ALA A 844 19.161 -5.513 -1.857 1.00 0.00 C ATOM 1335 C ALA A 844 19.970 -6.640 -2.483 1.00 0.00 C ATOM 1336 O ALA A 844 20.804 -7.256 -1.820 1.00 0.00 O ATOM 1337 CB ALA A 844 17.878 -6.052 -1.251 1.00 0.00 C ATOM 0 H ALA A 844 17.876 -4.397 -3.079 1.00 0.00 H new ATOM 0 HA ALA A 844 19.764 -5.070 -1.065 1.00 0.00 H new ATOM 0 HB1 ALA A 844 18.117 -6.830 -0.525 1.00 0.00 H new ATOM 0 HB2 ALA A 844 17.343 -5.243 -0.753 1.00 0.00 H new ATOM 0 HB3 ALA A 844 17.252 -6.471 -2.039 1.00 0.00 H new ATOM 1343 N GLU A 845 19.729 -6.913 -3.759 1.00 0.00 N ATOM 1344 CA GLU A 845 20.509 -7.913 -4.472 1.00 0.00 C ATOM 1345 C GLU A 845 21.956 -7.449 -4.596 1.00 0.00 C ATOM 1346 O GLU A 845 22.889 -8.243 -4.473 1.00 0.00 O ATOM 1347 CB GLU A 845 19.918 -8.177 -5.857 1.00 0.00 C ATOM 1348 CG GLU A 845 19.986 -9.638 -6.274 1.00 0.00 C ATOM 1349 CD GLU A 845 19.406 -10.570 -5.229 1.00 0.00 C ATOM 1350 OE1 GLU A 845 18.168 -10.607 -5.079 1.00 0.00 O ATOM 1351 OE2 GLU A 845 20.187 -11.277 -4.551 1.00 0.00 O ATOM 0 H GLU A 845 19.005 -6.459 -4.317 1.00 0.00 H new ATOM 0 HA GLU A 845 20.479 -8.844 -3.907 1.00 0.00 H new ATOM 0 HB2 GLU A 845 18.878 -7.852 -5.868 1.00 0.00 H new ATOM 0 HB3 GLU A 845 20.449 -7.572 -6.592 1.00 0.00 H new ATOM 0 HG2 GLU A 845 19.447 -9.770 -7.212 1.00 0.00 H new ATOM 0 HG3 GLU A 845 21.025 -9.910 -6.462 1.00 0.00 H new ATOM 1358 N GLY A 846 22.131 -6.150 -4.807 1.00 0.00 N ATOM 1359 CA GLY A 846 23.459 -5.581 -4.913 1.00 0.00 C ATOM 1360 C GLY A 846 24.019 -5.151 -3.569 1.00 0.00 C ATOM 1361 O GLY A 846 24.999 -4.404 -3.508 1.00 0.00 O ATOM 0 H GLY A 846 21.371 -5.478 -4.907 1.00 0.00 H new ATOM 0 HA2 GLY A 846 24.129 -6.313 -5.364 1.00 0.00 H new ATOM 0 HA3 GLY A 846 23.429 -4.721 -5.582 1.00 0.00 H new ATOM 1365 N GLU A 847 23.397 -5.610 -2.490 1.00 0.00 N ATOM 1366 CA GLU A 847 23.874 -5.307 -1.146 1.00 0.00 C ATOM 1367 C GLU A 847 25.058 -6.200 -0.792 1.00 0.00 C ATOM 1368 O GLU A 847 25.387 -7.134 -1.525 1.00 0.00 O ATOM 1369 CB GLU A 847 22.754 -5.487 -0.118 1.00 0.00 C ATOM 1370 CG GLU A 847 22.388 -4.206 0.619 1.00 0.00 C ATOM 1371 CD GLU A 847 23.442 -3.784 1.625 1.00 0.00 C ATOM 1372 OE1 GLU A 847 24.142 -4.665 2.166 1.00 0.00 O ATOM 1373 OE2 GLU A 847 23.580 -2.569 1.879 1.00 0.00 O ATOM 0 H GLU A 847 22.561 -6.194 -2.519 1.00 0.00 H new ATOM 0 HA GLU A 847 24.196 -4.266 -1.125 1.00 0.00 H new ATOM 0 HB2 GLU A 847 21.868 -5.871 -0.623 1.00 0.00 H new ATOM 0 HB3 GLU A 847 23.058 -6.240 0.609 1.00 0.00 H new ATOM 0 HG2 GLU A 847 22.242 -3.405 -0.105 1.00 0.00 H new ATOM 0 HG3 GLU A 847 21.437 -4.347 1.133 1.00 0.00 H new ATOM 1380 N SER A 848 25.687 -5.915 0.333 1.00 0.00 N ATOM 1381 CA SER A 848 26.869 -6.648 0.750 1.00 0.00 C ATOM 1382 C SER A 848 26.526 -7.644 1.853 1.00 0.00 C ATOM 1383 O SER A 848 27.089 -8.739 1.915 1.00 0.00 O ATOM 1384 CB SER A 848 27.943 -5.670 1.229 1.00 0.00 C ATOM 1385 OG SER A 848 27.704 -4.360 0.726 1.00 0.00 O ATOM 0 H SER A 848 25.398 -5.178 0.977 1.00 0.00 H new ATOM 0 HA SER A 848 27.253 -7.207 -0.103 1.00 0.00 H new ATOM 0 HB2 SER A 848 27.959 -5.647 2.319 1.00 0.00 H new ATOM 0 HB3 SER A 848 28.924 -6.015 0.903 1.00 0.00 H new ATOM 0 HG SER A 848 28.403 -3.753 1.048 1.00 0.00 H new ATOM 1391 N ASP A 849 25.586 -7.272 2.710 1.00 0.00 N ATOM 1392 CA ASP A 849 25.206 -8.121 3.829 1.00 0.00 C ATOM 1393 C ASP A 849 23.956 -8.928 3.496 1.00 0.00 C ATOM 1394 O ASP A 849 23.042 -8.432 2.835 1.00 0.00 O ATOM 1395 CB ASP A 849 24.969 -7.280 5.083 1.00 0.00 C ATOM 1396 CG ASP A 849 24.587 -8.128 6.277 1.00 0.00 C ATOM 1397 OD1 ASP A 849 25.408 -8.963 6.710 1.00 0.00 O ATOM 1398 OD2 ASP A 849 23.462 -7.966 6.786 1.00 0.00 O ATOM 0 H ASP A 849 25.074 -6.391 2.652 1.00 0.00 H new ATOM 0 HA ASP A 849 26.025 -8.814 4.021 1.00 0.00 H new ATOM 0 HB2 ASP A 849 25.872 -6.715 5.315 1.00 0.00 H new ATOM 0 HB3 ASP A 849 24.180 -6.554 4.888 1.00 0.00 H new ATOM 1403 N LEU A 850 23.927 -10.175 3.950 1.00 0.00 N ATOM 1404 CA LEU A 850 22.807 -11.063 3.673 1.00 0.00 C ATOM 1405 C LEU A 850 21.598 -10.699 4.527 1.00 0.00 C ATOM 1406 O LEU A 850 20.483 -10.583 4.019 1.00 0.00 O ATOM 1407 CB LEU A 850 23.205 -12.518 3.927 1.00 0.00 C ATOM 1408 CG LEU A 850 23.252 -13.405 2.683 1.00 0.00 C ATOM 1409 CD1 LEU A 850 24.070 -14.656 2.954 1.00 0.00 C ATOM 1410 CD2 LEU A 850 21.845 -13.772 2.238 1.00 0.00 C ATOM 0 H LEU A 850 24.668 -10.594 4.512 1.00 0.00 H new ATOM 0 HA LEU A 850 22.536 -10.946 2.624 1.00 0.00 H new ATOM 0 HB2 LEU A 850 24.186 -12.532 4.401 1.00 0.00 H new ATOM 0 HB3 LEU A 850 22.501 -12.952 4.637 1.00 0.00 H new ATOM 0 HG LEU A 850 23.732 -12.848 1.879 1.00 0.00 H new ATOM 0 HD11 LEU A 850 24.093 -15.277 2.058 1.00 0.00 H new ATOM 0 HD12 LEU A 850 25.087 -14.374 3.227 1.00 0.00 H new ATOM 0 HD13 LEU A 850 23.617 -15.217 3.772 1.00 0.00 H new ATOM 0 HD21 LEU A 850 21.897 -14.404 1.351 1.00 0.00 H new ATOM 0 HD22 LEU A 850 21.339 -14.312 3.039 1.00 0.00 H new ATOM 0 HD23 LEU A 850 21.289 -12.864 2.005 1.00 0.00 H new ATOM 1422 N GLU A 851 21.828 -10.513 5.821 1.00 0.00 N ATOM 1423 CA GLU A 851 20.755 -10.195 6.756 1.00 0.00 C ATOM 1424 C GLU A 851 20.065 -8.890 6.376 1.00 0.00 C ATOM 1425 O GLU A 851 18.837 -8.814 6.344 1.00 0.00 O ATOM 1426 CB GLU A 851 21.299 -10.106 8.180 1.00 0.00 C ATOM 1427 CG GLU A 851 20.797 -11.216 9.086 1.00 0.00 C ATOM 1428 CD GLU A 851 19.304 -11.437 8.961 1.00 0.00 C ATOM 1429 OE1 GLU A 851 18.534 -10.595 9.462 1.00 0.00 O ATOM 1430 OE2 GLU A 851 18.896 -12.457 8.366 1.00 0.00 O ATOM 0 H GLU A 851 22.752 -10.577 6.248 1.00 0.00 H new ATOM 0 HA GLU A 851 20.019 -10.997 6.707 1.00 0.00 H new ATOM 0 HB2 GLU A 851 22.388 -10.137 8.148 1.00 0.00 H new ATOM 0 HB3 GLU A 851 21.020 -9.143 8.608 1.00 0.00 H new ATOM 0 HG2 GLU A 851 21.319 -12.142 8.845 1.00 0.00 H new ATOM 0 HG3 GLU A 851 21.040 -10.974 10.121 1.00 0.00 H new ATOM 1437 N ASN A 852 20.860 -7.867 6.089 1.00 0.00 N ATOM 1438 CA ASN A 852 20.325 -6.581 5.653 1.00 0.00 C ATOM 1439 C ASN A 852 19.516 -6.742 4.371 1.00 0.00 C ATOM 1440 O ASN A 852 18.443 -6.153 4.224 1.00 0.00 O ATOM 1441 CB ASN A 852 21.450 -5.569 5.428 1.00 0.00 C ATOM 1442 CG ASN A 852 20.915 -4.198 5.059 1.00 0.00 C ATOM 1443 OD1 ASN A 852 19.860 -3.784 5.541 1.00 0.00 O ATOM 1444 ND2 ASN A 852 21.635 -3.488 4.206 1.00 0.00 N ATOM 0 H ASN A 852 21.878 -7.902 6.150 1.00 0.00 H new ATOM 0 HA ASN A 852 19.671 -6.209 6.442 1.00 0.00 H new ATOM 0 HB2 ASN A 852 22.054 -5.491 6.332 1.00 0.00 H new ATOM 0 HB3 ASN A 852 22.107 -5.927 4.635 1.00 0.00 H new ATOM 0 HD21 ASN A 852 21.322 -2.559 3.924 1.00 0.00 H new ATOM 0 HD22 ASN A 852 22.503 -3.869 3.831 1.00 0.00 H new ATOM 1451 N SER A 853 20.034 -7.549 3.452 1.00 0.00 N ATOM 1452 CA SER A 853 19.342 -7.834 2.207 1.00 0.00 C ATOM 1453 C SER A 853 17.983 -8.478 2.492 1.00 0.00 C ATOM 1454 O SER A 853 16.954 -8.020 1.996 1.00 0.00 O ATOM 1455 CB SER A 853 20.199 -8.750 1.329 1.00 0.00 C ATOM 1456 OG SER A 853 19.646 -8.891 0.034 1.00 0.00 O ATOM 0 H SER A 853 20.935 -8.018 3.549 1.00 0.00 H new ATOM 0 HA SER A 853 19.174 -6.899 1.673 1.00 0.00 H new ATOM 0 HB2 SER A 853 21.208 -8.344 1.253 1.00 0.00 H new ATOM 0 HB3 SER A 853 20.285 -9.730 1.798 1.00 0.00 H new ATOM 0 HG SER A 853 20.161 -8.352 -0.602 1.00 0.00 H new ATOM 1462 N ARG A 854 17.987 -9.519 3.322 1.00 0.00 N ATOM 1463 CA ARG A 854 16.758 -10.219 3.688 1.00 0.00 C ATOM 1464 C ARG A 854 15.759 -9.256 4.316 1.00 0.00 C ATOM 1465 O ARG A 854 14.579 -9.256 3.968 1.00 0.00 O ATOM 1466 CB ARG A 854 17.060 -11.360 4.658 1.00 0.00 C ATOM 1467 CG ARG A 854 17.479 -12.644 3.970 1.00 0.00 C ATOM 1468 CD ARG A 854 18.799 -13.161 4.517 1.00 0.00 C ATOM 1469 NE ARG A 854 18.670 -13.675 5.880 1.00 0.00 N ATOM 1470 CZ ARG A 854 18.509 -14.962 6.178 1.00 0.00 C ATOM 1471 NH1 ARG A 854 18.483 -15.874 5.211 1.00 0.00 N ATOM 1472 NH2 ARG A 854 18.385 -15.335 7.444 1.00 0.00 N ATOM 0 H ARG A 854 18.830 -9.897 3.755 1.00 0.00 H new ATOM 0 HA ARG A 854 16.321 -10.635 2.780 1.00 0.00 H new ATOM 0 HB2 ARG A 854 17.851 -11.047 5.339 1.00 0.00 H new ATOM 0 HB3 ARG A 854 16.176 -11.554 5.265 1.00 0.00 H new ATOM 0 HG2 ARG A 854 16.706 -13.400 4.106 1.00 0.00 H new ATOM 0 HG3 ARG A 854 17.571 -12.471 2.898 1.00 0.00 H new ATOM 0 HD2 ARG A 854 19.175 -13.951 3.867 1.00 0.00 H new ATOM 0 HD3 ARG A 854 19.536 -12.358 4.502 1.00 0.00 H new ATOM 0 HE ARG A 854 18.706 -13.006 6.649 1.00 0.00 H new ATOM 0 HH11 ARG A 854 18.587 -15.588 4.237 1.00 0.00 H new ATOM 0 HH12 ARG A 854 18.359 -16.860 5.443 1.00 0.00 H new ATOM 0 HH21 ARG A 854 18.413 -14.636 8.187 1.00 0.00 H new ATOM 0 HH22 ARG A 854 18.261 -16.321 7.676 1.00 0.00 H new ATOM 1486 N LYS A 855 16.252 -8.430 5.231 1.00 0.00 N ATOM 1487 CA LYS A 855 15.452 -7.393 5.869 1.00 0.00 C ATOM 1488 C LYS A 855 14.795 -6.495 4.832 1.00 0.00 C ATOM 1489 O LYS A 855 13.616 -6.157 4.925 1.00 0.00 O ATOM 1490 CB LYS A 855 16.353 -6.549 6.765 1.00 0.00 C ATOM 1491 CG LYS A 855 15.976 -6.607 8.232 1.00 0.00 C ATOM 1492 CD LYS A 855 16.763 -7.684 8.964 1.00 0.00 C ATOM 1493 CE LYS A 855 18.018 -7.125 9.615 1.00 0.00 C ATOM 1494 NZ LYS A 855 18.728 -8.154 10.418 1.00 0.00 N ATOM 0 H LYS A 855 17.220 -8.461 5.552 1.00 0.00 H new ATOM 0 HA LYS A 855 14.669 -7.871 6.458 1.00 0.00 H new ATOM 0 HB2 LYS A 855 17.383 -6.885 6.650 1.00 0.00 H new ATOM 0 HB3 LYS A 855 16.316 -5.512 6.430 1.00 0.00 H new ATOM 0 HG2 LYS A 855 16.163 -5.639 8.696 1.00 0.00 H new ATOM 0 HG3 LYS A 855 14.909 -6.806 8.328 1.00 0.00 H new ATOM 0 HD2 LYS A 855 16.131 -8.141 9.726 1.00 0.00 H new ATOM 0 HD3 LYS A 855 17.038 -8.472 8.263 1.00 0.00 H new ATOM 0 HE2 LYS A 855 18.686 -6.740 8.845 1.00 0.00 H new ATOM 0 HE3 LYS A 855 17.752 -6.284 10.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 855 19.749 -8.097 10.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 855 18.552 -7.987 11.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 855 18.380 -9.099 10.157 1.00 0.00 H new ATOM 1508 N LEU A 856 15.582 -6.130 3.835 1.00 0.00 N ATOM 1509 CA LEU A 856 15.154 -5.206 2.801 1.00 0.00 C ATOM 1510 C LEU A 856 14.018 -5.778 1.974 1.00 0.00 C ATOM 1511 O LEU A 856 12.979 -5.142 1.786 1.00 0.00 O ATOM 1512 CB LEU A 856 16.346 -4.916 1.898 1.00 0.00 C ATOM 1513 CG LEU A 856 17.091 -3.624 2.236 1.00 0.00 C ATOM 1514 CD1 LEU A 856 18.509 -3.661 1.686 1.00 0.00 C ATOM 1515 CD2 LEU A 856 16.343 -2.408 1.708 1.00 0.00 C ATOM 0 H LEU A 856 16.538 -6.467 3.720 1.00 0.00 H new ATOM 0 HA LEU A 856 14.790 -4.293 3.273 1.00 0.00 H new ATOM 0 HB2 LEU A 856 17.044 -5.751 1.958 1.00 0.00 H new ATOM 0 HB3 LEU A 856 16.001 -4.863 0.866 1.00 0.00 H new ATOM 0 HG LEU A 856 17.145 -3.542 3.322 1.00 0.00 H new ATOM 0 HD11 LEU A 856 19.021 -2.732 1.938 1.00 0.00 H new ATOM 0 HD12 LEU A 856 19.047 -4.502 2.123 1.00 0.00 H new ATOM 0 HD13 LEU A 856 18.476 -3.775 0.602 1.00 0.00 H new ATOM 0 HD21 LEU A 856 16.895 -1.503 1.962 1.00 0.00 H new ATOM 0 HD22 LEU A 856 16.247 -2.482 0.625 1.00 0.00 H new ATOM 0 HD23 LEU A 856 15.351 -2.367 2.158 1.00 0.00 H new ATOM 1527 N LEU A 857 14.210 -6.995 1.514 1.00 0.00 N ATOM 1528 CA LEU A 857 13.266 -7.631 0.620 1.00 0.00 C ATOM 1529 C LEU A 857 12.021 -8.109 1.356 1.00 0.00 C ATOM 1530 O LEU A 857 10.950 -8.227 0.760 1.00 0.00 O ATOM 1531 CB LEU A 857 13.959 -8.768 -0.111 1.00 0.00 C ATOM 1532 CG LEU A 857 15.265 -8.354 -0.787 1.00 0.00 C ATOM 1533 CD1 LEU A 857 16.300 -9.463 -0.670 1.00 0.00 C ATOM 1534 CD2 LEU A 857 15.017 -8.010 -2.248 1.00 0.00 C ATOM 0 H LEU A 857 15.020 -7.569 1.747 1.00 0.00 H new ATOM 0 HA LEU A 857 12.923 -6.897 -0.110 1.00 0.00 H new ATOM 0 HB2 LEU A 857 14.164 -9.572 0.596 1.00 0.00 H new ATOM 0 HB3 LEU A 857 13.282 -9.171 -0.864 1.00 0.00 H new ATOM 0 HG LEU A 857 15.651 -7.468 -0.282 1.00 0.00 H new ATOM 0 HD11 LEU A 857 17.224 -9.151 -1.157 1.00 0.00 H new ATOM 0 HD12 LEU A 857 16.496 -9.668 0.382 1.00 0.00 H new ATOM 0 HD13 LEU A 857 15.923 -10.365 -1.152 1.00 0.00 H new ATOM 0 HD21 LEU A 857 15.956 -7.717 -2.717 1.00 0.00 H new ATOM 0 HD22 LEU A 857 14.610 -8.880 -2.763 1.00 0.00 H new ATOM 0 HD23 LEU A 857 14.307 -7.186 -2.312 1.00 0.00 H new ATOM 1546 N SER A 858 12.159 -8.375 2.649 1.00 0.00 N ATOM 1547 CA SER A 858 11.014 -8.746 3.468 1.00 0.00 C ATOM 1548 C SER A 858 10.123 -7.532 3.702 1.00 0.00 C ATOM 1549 O SER A 858 8.900 -7.629 3.638 1.00 0.00 O ATOM 1550 CB SER A 858 11.475 -9.339 4.798 1.00 0.00 C ATOM 1551 OG SER A 858 12.307 -10.472 4.584 1.00 0.00 O ATOM 0 H SER A 858 13.047 -8.341 3.150 1.00 0.00 H new ATOM 0 HA SER A 858 10.437 -9.505 2.939 1.00 0.00 H new ATOM 0 HB2 SER A 858 12.018 -8.586 5.368 1.00 0.00 H new ATOM 0 HB3 SER A 858 10.608 -9.626 5.393 1.00 0.00 H new ATOM 0 HG SER A 858 13.091 -10.207 4.059 1.00 0.00 H new ATOM 1557 N ALA A 859 10.744 -6.385 3.952 1.00 0.00 N ATOM 1558 CA ALA A 859 10.005 -5.141 4.112 1.00 0.00 C ATOM 1559 C ALA A 859 9.295 -4.780 2.812 1.00 0.00 C ATOM 1560 O ALA A 859 8.135 -4.366 2.817 1.00 0.00 O ATOM 1561 CB ALA A 859 10.938 -4.020 4.546 1.00 0.00 C ATOM 0 H ALA A 859 11.755 -6.292 4.048 1.00 0.00 H new ATOM 0 HA ALA A 859 9.253 -5.277 4.889 1.00 0.00 H new ATOM 0 HB1 ALA A 859 10.369 -3.097 4.661 1.00 0.00 H new ATOM 0 HB2 ALA A 859 11.402 -4.281 5.497 1.00 0.00 H new ATOM 0 HB3 ALA A 859 11.712 -3.878 3.791 1.00 0.00 H new ATOM 1567 N ALA A 860 9.998 -4.959 1.698 1.00 0.00 N ATOM 1568 CA ALA A 860 9.428 -4.719 0.379 1.00 0.00 C ATOM 1569 C ALA A 860 8.291 -5.698 0.089 1.00 0.00 C ATOM 1570 O ALA A 860 7.345 -5.372 -0.627 1.00 0.00 O ATOM 1571 CB ALA A 860 10.506 -4.822 -0.689 1.00 0.00 C ATOM 0 H ALA A 860 10.969 -5.271 1.684 1.00 0.00 H new ATOM 0 HA ALA A 860 9.016 -3.710 0.363 1.00 0.00 H new ATOM 0 HB1 ALA A 860 10.065 -4.640 -1.669 1.00 0.00 H new ATOM 0 HB2 ALA A 860 11.281 -4.080 -0.496 1.00 0.00 H new ATOM 0 HB3 ALA A 860 10.945 -5.819 -0.668 1.00 0.00 H new ATOM 1577 N LYS A 861 8.388 -6.896 0.656 1.00 0.00 N ATOM 1578 CA LYS A 861 7.341 -7.900 0.512 1.00 0.00 C ATOM 1579 C LYS A 861 6.048 -7.404 1.145 1.00 0.00 C ATOM 1580 O LYS A 861 4.973 -7.518 0.555 1.00 0.00 O ATOM 1581 CB LYS A 861 7.770 -9.217 1.160 1.00 0.00 C ATOM 1582 CG LYS A 861 7.345 -10.445 0.375 1.00 0.00 C ATOM 1583 CD LYS A 861 8.420 -11.518 0.396 1.00 0.00 C ATOM 1584 CE LYS A 861 9.628 -11.112 -0.434 1.00 0.00 C ATOM 1585 NZ LYS A 861 10.706 -12.133 -0.380 1.00 0.00 N ATOM 0 H LYS A 861 9.183 -7.195 1.221 1.00 0.00 H new ATOM 0 HA LYS A 861 7.172 -8.074 -0.551 1.00 0.00 H new ATOM 0 HB2 LYS A 861 8.855 -9.223 1.269 1.00 0.00 H new ATOM 0 HB3 LYS A 861 7.348 -9.273 2.164 1.00 0.00 H new ATOM 0 HG2 LYS A 861 6.422 -10.845 0.795 1.00 0.00 H new ATOM 0 HG3 LYS A 861 7.131 -10.163 -0.656 1.00 0.00 H new ATOM 0 HD2 LYS A 861 8.730 -11.704 1.424 1.00 0.00 H new ATOM 0 HD3 LYS A 861 8.011 -12.452 0.012 1.00 0.00 H new ATOM 0 HE2 LYS A 861 9.323 -10.961 -1.469 1.00 0.00 H new ATOM 0 HE3 LYS A 861 10.013 -10.158 -0.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 861 11.511 -11.819 -0.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 861 11.015 -12.259 0.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 861 10.347 -13.037 -0.749 1.00 0.00 H new ATOM 1599 N ILE A 862 6.163 -6.842 2.345 1.00 0.00 N ATOM 1600 CA ILE A 862 5.013 -6.261 3.025 1.00 0.00 C ATOM 1601 C ILE A 862 4.471 -5.084 2.225 1.00 0.00 C ATOM 1602 O ILE A 862 3.262 -4.938 2.069 1.00 0.00 O ATOM 1603 CB ILE A 862 5.355 -5.783 4.455 1.00 0.00 C ATOM 1604 CG1 ILE A 862 6.287 -6.775 5.154 1.00 0.00 C ATOM 1605 CG2 ILE A 862 4.082 -5.595 5.269 1.00 0.00 C ATOM 1606 CD1 ILE A 862 7.103 -6.157 6.269 1.00 0.00 C ATOM 0 H ILE A 862 7.039 -6.777 2.864 1.00 0.00 H new ATOM 0 HA ILE A 862 4.261 -7.046 3.102 1.00 0.00 H new ATOM 0 HB ILE A 862 5.870 -4.825 4.379 1.00 0.00 H new ATOM 0 HG12 ILE A 862 5.693 -7.594 5.560 1.00 0.00 H new ATOM 0 HG13 ILE A 862 6.963 -7.207 4.416 1.00 0.00 H new ATOM 0 HG21 ILE A 862 4.339 -5.258 6.273 1.00 0.00 H new ATOM 0 HG22 ILE A 862 3.449 -4.850 4.787 1.00 0.00 H new ATOM 0 HG23 ILE A 862 3.546 -6.542 5.330 1.00 0.00 H new ATOM 0 HD11 ILE A 862 7.740 -6.919 6.719 1.00 0.00 H new ATOM 0 HD12 ILE A 862 7.723 -5.357 5.865 1.00 0.00 H new ATOM 0 HD13 ILE A 862 6.434 -5.750 7.027 1.00 0.00 H new ATOM 1618 N LEU A 863 5.384 -4.265 1.705 1.00 0.00 N ATOM 1619 CA LEU A 863 5.023 -3.119 0.874 1.00 0.00 C ATOM 1620 C LEU A 863 4.123 -3.547 -0.284 1.00 0.00 C ATOM 1621 O LEU A 863 3.009 -3.042 -0.442 1.00 0.00 O ATOM 1622 CB LEU A 863 6.286 -2.453 0.317 1.00 0.00 C ATOM 1623 CG LEU A 863 6.610 -1.062 0.869 1.00 0.00 C ATOM 1624 CD1 LEU A 863 5.340 -0.249 1.081 1.00 0.00 C ATOM 1625 CD2 LEU A 863 7.397 -1.180 2.164 1.00 0.00 C ATOM 0 H LEU A 863 6.388 -4.376 1.847 1.00 0.00 H new ATOM 0 HA LEU A 863 4.479 -2.409 1.497 1.00 0.00 H new ATOM 0 HB2 LEU A 863 7.135 -3.107 0.514 1.00 0.00 H new ATOM 0 HB3 LEU A 863 6.186 -2.378 -0.766 1.00 0.00 H new ATOM 0 HG LEU A 863 7.223 -0.537 0.137 1.00 0.00 H new ATOM 0 HD11 LEU A 863 5.599 0.734 1.474 1.00 0.00 H new ATOM 0 HD12 LEU A 863 4.818 -0.135 0.131 1.00 0.00 H new ATOM 0 HD13 LEU A 863 4.693 -0.764 1.791 1.00 0.00 H new ATOM 0 HD21 LEU A 863 7.621 -0.184 2.546 1.00 0.00 H new ATOM 0 HD22 LEU A 863 6.807 -1.727 2.900 1.00 0.00 H new ATOM 0 HD23 LEU A 863 8.328 -1.714 1.976 1.00 0.00 H new ATOM 1637 N ALA A 864 4.614 -4.488 -1.084 1.00 0.00 N ATOM 1638 CA ALA A 864 3.891 -4.954 -2.262 1.00 0.00 C ATOM 1639 C ALA A 864 2.589 -5.651 -1.881 1.00 0.00 C ATOM 1640 O ALA A 864 1.532 -5.362 -2.447 1.00 0.00 O ATOM 1641 CB ALA A 864 4.769 -5.889 -3.081 1.00 0.00 C ATOM 0 H ALA A 864 5.514 -4.945 -0.937 1.00 0.00 H new ATOM 0 HA ALA A 864 3.637 -4.082 -2.864 1.00 0.00 H new ATOM 0 HB1 ALA A 864 4.218 -6.230 -3.958 1.00 0.00 H new ATOM 0 HB2 ALA A 864 5.667 -5.359 -3.400 1.00 0.00 H new ATOM 0 HB3 ALA A 864 5.052 -6.748 -2.473 1.00 0.00 H new ATOM 1647 N ASP A 865 2.666 -6.553 -0.908 1.00 0.00 N ATOM 1648 CA ASP A 865 1.507 -7.342 -0.502 1.00 0.00 C ATOM 1649 C ASP A 865 0.408 -6.460 0.080 1.00 0.00 C ATOM 1650 O ASP A 865 -0.765 -6.610 -0.265 1.00 0.00 O ATOM 1651 CB ASP A 865 1.908 -8.407 0.518 1.00 0.00 C ATOM 1652 CG ASP A 865 0.724 -9.230 0.981 1.00 0.00 C ATOM 1653 OD1 ASP A 865 0.213 -10.049 0.187 1.00 0.00 O ATOM 1654 OD2 ASP A 865 0.301 -9.065 2.140 1.00 0.00 O ATOM 0 H ASP A 865 3.518 -6.756 -0.386 1.00 0.00 H new ATOM 0 HA ASP A 865 1.118 -7.831 -1.395 1.00 0.00 H new ATOM 0 HB2 ASP A 865 2.656 -9.066 0.078 1.00 0.00 H new ATOM 0 HB3 ASP A 865 2.373 -7.926 1.379 1.00 0.00 H new ATOM 1659 N ALA A 866 0.789 -5.534 0.954 1.00 0.00 N ATOM 1660 CA ALA A 866 -0.170 -4.617 1.555 1.00 0.00 C ATOM 1661 C ALA A 866 -0.822 -3.753 0.485 1.00 0.00 C ATOM 1662 O ALA A 866 -1.998 -3.417 0.580 1.00 0.00 O ATOM 1663 CB ALA A 866 0.499 -3.748 2.610 1.00 0.00 C ATOM 0 H ALA A 866 1.753 -5.400 1.261 1.00 0.00 H new ATOM 0 HA ALA A 866 -0.945 -5.207 2.044 1.00 0.00 H new ATOM 0 HB1 ALA A 866 -0.237 -3.072 3.044 1.00 0.00 H new ATOM 0 HB2 ALA A 866 0.916 -4.382 3.393 1.00 0.00 H new ATOM 0 HB3 ALA A 866 1.298 -3.167 2.150 1.00 0.00 H new ATOM 1669 N THR A 867 -0.057 -3.416 -0.546 1.00 0.00 N ATOM 1670 CA THR A 867 -0.573 -2.628 -1.655 1.00 0.00 C ATOM 1671 C THR A 867 -1.632 -3.410 -2.433 1.00 0.00 C ATOM 1672 O THR A 867 -2.682 -2.867 -2.779 1.00 0.00 O ATOM 1673 CB THR A 867 0.563 -2.193 -2.599 1.00 0.00 C ATOM 1674 OG1 THR A 867 1.489 -1.363 -1.885 1.00 0.00 O ATOM 1675 CG2 THR A 867 0.021 -1.435 -3.800 1.00 0.00 C ATOM 0 H THR A 867 0.925 -3.677 -0.636 1.00 0.00 H new ATOM 0 HA THR A 867 -1.037 -1.734 -1.238 1.00 0.00 H new ATOM 0 HB THR A 867 1.068 -3.089 -2.961 1.00 0.00 H new ATOM 0 HG1 THR A 867 1.895 -1.878 -1.156 1.00 0.00 H new ATOM 0 HG21 THR A 867 0.847 -1.141 -4.448 1.00 0.00 H new ATOM 0 HG22 THR A 867 -0.665 -2.075 -4.355 1.00 0.00 H new ATOM 0 HG23 THR A 867 -0.508 -0.545 -3.460 1.00 0.00 H new ATOM 1683 N ALA A 868 -1.365 -4.687 -2.691 1.00 0.00 N ATOM 1684 CA ALA A 868 -2.337 -5.539 -3.364 1.00 0.00 C ATOM 1685 C ALA A 868 -3.581 -5.701 -2.508 1.00 0.00 C ATOM 1686 O ALA A 868 -4.699 -5.687 -3.014 1.00 0.00 O ATOM 1687 CB ALA A 868 -1.749 -6.901 -3.679 1.00 0.00 C ATOM 0 H ALA A 868 -0.490 -5.151 -2.446 1.00 0.00 H new ATOM 0 HA ALA A 868 -2.608 -5.057 -4.303 1.00 0.00 H new ATOM 0 HB1 ALA A 868 -2.498 -7.514 -4.181 1.00 0.00 H new ATOM 0 HB2 ALA A 868 -0.883 -6.782 -4.330 1.00 0.00 H new ATOM 0 HB3 ALA A 868 -1.443 -7.388 -2.753 1.00 0.00 H new ATOM 1693 N LYS A 869 -3.376 -5.858 -1.205 1.00 0.00 N ATOM 1694 CA LYS A 869 -4.484 -5.957 -0.267 1.00 0.00 C ATOM 1695 C LYS A 869 -5.269 -4.654 -0.242 1.00 0.00 C ATOM 1696 O LYS A 869 -6.489 -4.657 -0.094 1.00 0.00 O ATOM 1697 CB LYS A 869 -3.973 -6.288 1.137 1.00 0.00 C ATOM 1698 CG LYS A 869 -4.148 -7.749 1.521 1.00 0.00 C ATOM 1699 CD LYS A 869 -3.218 -8.647 0.725 1.00 0.00 C ATOM 1700 CE LYS A 869 -2.921 -9.943 1.461 1.00 0.00 C ATOM 1701 NZ LYS A 869 -2.278 -10.943 0.570 1.00 0.00 N ATOM 0 H LYS A 869 -2.453 -5.919 -0.776 1.00 0.00 H new ATOM 0 HA LYS A 869 -5.142 -6.761 -0.596 1.00 0.00 H new ATOM 0 HB2 LYS A 869 -2.916 -6.029 1.200 1.00 0.00 H new ATOM 0 HB3 LYS A 869 -4.498 -5.665 1.862 1.00 0.00 H new ATOM 0 HG2 LYS A 869 -3.952 -7.873 2.586 1.00 0.00 H new ATOM 0 HG3 LYS A 869 -5.181 -8.050 1.350 1.00 0.00 H new ATOM 0 HD2 LYS A 869 -3.669 -8.873 -0.241 1.00 0.00 H new ATOM 0 HD3 LYS A 869 -2.285 -8.120 0.526 1.00 0.00 H new ATOM 0 HE2 LYS A 869 -2.269 -9.739 2.310 1.00 0.00 H new ATOM 0 HE3 LYS A 869 -3.847 -10.355 1.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 869 -2.274 -11.872 1.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 869 -2.809 -11.006 -0.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 869 -1.300 -10.652 0.370 1.00 0.00 H new ATOM 1715 N MET A 870 -4.556 -3.547 -0.396 1.00 0.00 N ATOM 1716 CA MET A 870 -5.171 -2.227 -0.443 1.00 0.00 C ATOM 1717 C MET A 870 -6.010 -2.069 -1.704 1.00 0.00 C ATOM 1718 O MET A 870 -7.166 -1.650 -1.640 1.00 0.00 O ATOM 1719 CB MET A 870 -4.097 -1.138 -0.386 1.00 0.00 C ATOM 1720 CG MET A 870 -4.341 -0.099 0.694 1.00 0.00 C ATOM 1721 SD MET A 870 -6.092 0.189 1.000 1.00 0.00 S ATOM 1722 CE MET A 870 -6.392 1.563 -0.103 1.00 0.00 C ATOM 0 H MET A 870 -3.541 -3.538 -0.491 1.00 0.00 H new ATOM 0 HA MET A 870 -5.825 -2.123 0.423 1.00 0.00 H new ATOM 0 HB2 MET A 870 -3.127 -1.605 -0.217 1.00 0.00 H new ATOM 0 HB3 MET A 870 -4.046 -0.639 -1.354 1.00 0.00 H new ATOM 0 HG2 MET A 870 -3.864 -0.423 1.619 1.00 0.00 H new ATOM 0 HG3 MET A 870 -3.868 0.839 0.403 1.00 0.00 H new ATOM 0 HE1 MET A 870 -7.390 1.474 -0.532 1.00 0.00 H new ATOM 0 HE2 MET A 870 -6.318 2.498 0.452 1.00 0.00 H new ATOM 0 HE3 MET A 870 -5.651 1.556 -0.903 1.00 0.00 H new ATOM 1732 N VAL A 871 -5.428 -2.416 -2.847 1.00 0.00 N ATOM 1733 CA VAL A 871 -6.139 -2.343 -4.118 1.00 0.00 C ATOM 1734 C VAL A 871 -7.347 -3.280 -4.103 1.00 0.00 C ATOM 1735 O VAL A 871 -8.423 -2.933 -4.588 1.00 0.00 O ATOM 1736 CB VAL A 871 -5.195 -2.659 -5.315 1.00 0.00 C ATOM 1737 CG1 VAL A 871 -5.480 -4.014 -5.953 1.00 0.00 C ATOM 1738 CG2 VAL A 871 -5.287 -1.560 -6.359 1.00 0.00 C ATOM 0 H VAL A 871 -4.467 -2.750 -2.919 1.00 0.00 H new ATOM 0 HA VAL A 871 -6.497 -1.322 -4.251 1.00 0.00 H new ATOM 0 HB VAL A 871 -4.182 -2.704 -4.915 1.00 0.00 H new ATOM 0 HG11 VAL A 871 -4.791 -4.178 -6.781 1.00 0.00 H new ATOM 0 HG12 VAL A 871 -5.349 -4.801 -5.210 1.00 0.00 H new ATOM 0 HG13 VAL A 871 -6.505 -4.033 -6.324 1.00 0.00 H new ATOM 0 HG21 VAL A 871 -4.622 -1.792 -7.191 1.00 0.00 H new ATOM 0 HG22 VAL A 871 -6.312 -1.488 -6.722 1.00 0.00 H new ATOM 0 HG23 VAL A 871 -4.993 -0.610 -5.914 1.00 0.00 H new ATOM 1748 N GLU A 872 -7.166 -4.452 -3.503 1.00 0.00 N ATOM 1749 CA GLU A 872 -8.227 -5.441 -3.406 1.00 0.00 C ATOM 1750 C GLU A 872 -9.332 -4.957 -2.471 1.00 0.00 C ATOM 1751 O GLU A 872 -10.517 -5.185 -2.719 1.00 0.00 O ATOM 1752 CB GLU A 872 -7.654 -6.775 -2.914 1.00 0.00 C ATOM 1753 CG GLU A 872 -8.166 -7.978 -3.689 1.00 0.00 C ATOM 1754 CD GLU A 872 -8.425 -7.661 -5.148 1.00 0.00 C ATOM 1755 OE1 GLU A 872 -7.462 -7.338 -5.872 1.00 0.00 O ATOM 1756 OE2 GLU A 872 -9.595 -7.732 -5.578 1.00 0.00 O ATOM 0 H GLU A 872 -6.286 -4.739 -3.074 1.00 0.00 H new ATOM 0 HA GLU A 872 -8.660 -5.586 -4.396 1.00 0.00 H new ATOM 0 HB2 GLU A 872 -6.567 -6.743 -2.986 1.00 0.00 H new ATOM 0 HB3 GLU A 872 -7.901 -6.900 -1.860 1.00 0.00 H new ATOM 0 HG2 GLU A 872 -7.439 -8.787 -3.620 1.00 0.00 H new ATOM 0 HG3 GLU A 872 -9.087 -8.337 -3.230 1.00 0.00 H new ATOM 1763 N ALA A 873 -8.938 -4.277 -1.403 1.00 0.00 N ATOM 1764 CA ALA A 873 -9.886 -3.746 -0.435 1.00 0.00 C ATOM 1765 C ALA A 873 -10.664 -2.574 -1.016 1.00 0.00 C ATOM 1766 O ALA A 873 -11.891 -2.552 -0.969 1.00 0.00 O ATOM 1767 CB ALA A 873 -9.165 -3.318 0.831 1.00 0.00 C ATOM 0 H ALA A 873 -7.961 -4.080 -1.185 1.00 0.00 H new ATOM 0 HA ALA A 873 -10.594 -4.537 -0.189 1.00 0.00 H new ATOM 0 HB1 ALA A 873 -9.887 -2.923 1.545 1.00 0.00 H new ATOM 0 HB2 ALA A 873 -8.655 -4.177 1.268 1.00 0.00 H new ATOM 0 HB3 ALA A 873 -8.434 -2.546 0.590 1.00 0.00 H new ATOM 1773 N ALA A 874 -9.940 -1.609 -1.572 1.00 0.00 N ATOM 1774 CA ALA A 874 -10.551 -0.403 -2.117 1.00 0.00 C ATOM 1775 C ALA A 874 -11.541 -0.733 -3.228 1.00 0.00 C ATOM 1776 O ALA A 874 -12.619 -0.152 -3.297 1.00 0.00 O ATOM 1777 CB ALA A 874 -9.479 0.547 -2.627 1.00 0.00 C ATOM 0 H ALA A 874 -8.924 -1.639 -1.657 1.00 0.00 H new ATOM 0 HA ALA A 874 -11.103 0.085 -1.314 1.00 0.00 H new ATOM 0 HB1 ALA A 874 -9.950 1.443 -3.031 1.00 0.00 H new ATOM 0 HB2 ALA A 874 -8.817 0.823 -1.806 1.00 0.00 H new ATOM 0 HB3 ALA A 874 -8.901 0.056 -3.410 1.00 0.00 H new ATOM 1783 N LYS A 875 -11.177 -1.679 -4.087 1.00 0.00 N ATOM 1784 CA LYS A 875 -12.040 -2.077 -5.192 1.00 0.00 C ATOM 1785 C LYS A 875 -13.221 -2.907 -4.694 1.00 0.00 C ATOM 1786 O LYS A 875 -14.277 -2.947 -5.328 1.00 0.00 O ATOM 1787 CB LYS A 875 -11.246 -2.872 -6.228 1.00 0.00 C ATOM 1788 CG LYS A 875 -10.479 -2.002 -7.209 1.00 0.00 C ATOM 1789 CD LYS A 875 -9.200 -2.683 -7.668 1.00 0.00 C ATOM 1790 CE LYS A 875 -9.380 -3.358 -9.018 1.00 0.00 C ATOM 1791 NZ LYS A 875 -9.576 -4.826 -8.888 1.00 0.00 N ATOM 0 H LYS A 875 -10.292 -2.183 -4.039 1.00 0.00 H new ATOM 0 HA LYS A 875 -12.428 -1.171 -5.658 1.00 0.00 H new ATOM 0 HB2 LYS A 875 -10.544 -3.526 -5.711 1.00 0.00 H new ATOM 0 HB3 LYS A 875 -11.930 -3.514 -6.783 1.00 0.00 H new ATOM 0 HG2 LYS A 875 -11.107 -1.783 -8.073 1.00 0.00 H new ATOM 0 HG3 LYS A 875 -10.238 -1.048 -6.741 1.00 0.00 H new ATOM 0 HD2 LYS A 875 -8.398 -1.947 -7.732 1.00 0.00 H new ATOM 0 HD3 LYS A 875 -8.895 -3.423 -6.928 1.00 0.00 H new ATOM 0 HE2 LYS A 875 -10.238 -2.922 -9.529 1.00 0.00 H new ATOM 0 HE3 LYS A 875 -8.506 -3.163 -9.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 875 -9.695 -5.245 -9.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 875 -8.746 -5.247 -8.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 875 -10.425 -5.014 -8.317 1.00 0.00 H new ATOM 1805 N GLY A 876 -13.039 -3.566 -3.558 1.00 0.00 N ATOM 1806 CA GLY A 876 -14.095 -4.390 -2.999 1.00 0.00 C ATOM 1807 C GLY A 876 -15.021 -3.610 -2.089 1.00 0.00 C ATOM 1808 O GLY A 876 -16.100 -4.084 -1.729 1.00 0.00 O ATOM 0 H GLY A 876 -12.178 -3.545 -3.012 1.00 0.00 H new ATOM 0 HA2 GLY A 876 -14.675 -4.831 -3.810 1.00 0.00 H new ATOM 0 HA3 GLY A 876 -13.651 -5.214 -2.440 1.00 0.00 H new ATOM 1812 N ALA A 877 -14.597 -2.416 -1.707 1.00 0.00 N ATOM 1813 CA ALA A 877 -15.398 -1.559 -0.846 1.00 0.00 C ATOM 1814 C ALA A 877 -15.666 -0.221 -1.515 1.00 0.00 C ATOM 1815 O ALA A 877 -15.956 0.775 -0.851 1.00 0.00 O ATOM 1816 CB ALA A 877 -14.704 -1.353 0.489 1.00 0.00 C ATOM 0 H ALA A 877 -13.699 -2.017 -1.981 1.00 0.00 H new ATOM 0 HA ALA A 877 -16.355 -2.051 -0.670 1.00 0.00 H new ATOM 0 HB1 ALA A 877 -15.316 -0.710 1.122 1.00 0.00 H new ATOM 0 HB2 ALA A 877 -14.564 -2.317 0.979 1.00 0.00 H new ATOM 0 HB3 ALA A 877 -13.733 -0.884 0.326 1.00 0.00 H new ATOM 1822 N ALA A 878 -15.573 -0.206 -2.835 1.00 0.00 N ATOM 1823 CA ALA A 878 -15.823 1.003 -3.603 1.00 0.00 C ATOM 1824 C ALA A 878 -17.318 1.196 -3.814 1.00 0.00 C ATOM 1825 O ALA A 878 -17.789 1.254 -4.954 1.00 0.00 O ATOM 1826 CB ALA A 878 -15.094 0.943 -4.940 1.00 0.00 C ATOM 0 H ALA A 878 -15.326 -1.020 -3.398 1.00 0.00 H new ATOM 0 HA ALA A 878 -15.442 1.857 -3.043 1.00 0.00 H new ATOM 0 HB1 ALA A 878 -15.291 1.855 -5.503 1.00 0.00 H new ATOM 0 HB2 ALA A 878 -14.022 0.848 -4.766 1.00 0.00 H new ATOM 0 HB3 ALA A 878 -15.447 0.082 -5.508 1.00 0.00 H new ATOM 1832 N ALA A 879 -18.051 1.287 -2.704 1.00 0.00 N ATOM 1833 CA ALA A 879 -19.502 1.439 -2.730 1.00 0.00 C ATOM 1834 C ALA A 879 -20.129 0.416 -3.682 1.00 0.00 C ATOM 1835 O ALA A 879 -19.893 -0.786 -3.548 1.00 0.00 O ATOM 1836 CB ALA A 879 -19.873 2.870 -3.109 1.00 0.00 C ATOM 0 H ALA A 879 -17.655 1.257 -1.765 1.00 0.00 H new ATOM 0 HA ALA A 879 -19.902 1.246 -1.734 1.00 0.00 H new ATOM 0 HB1 ALA A 879 -20.958 2.972 -3.125 1.00 0.00 H new ATOM 0 HB2 ALA A 879 -19.454 3.560 -2.377 1.00 0.00 H new ATOM 0 HB3 ALA A 879 -19.472 3.101 -4.096 1.00 0.00 H new ATOM 1842 N HIS A 880 -20.918 0.883 -4.637 1.00 0.00 N ATOM 1843 CA HIS A 880 -21.468 0.010 -5.662 1.00 0.00 C ATOM 1844 C HIS A 880 -21.189 0.604 -7.034 1.00 0.00 C ATOM 1845 O HIS A 880 -21.075 1.824 -7.165 1.00 0.00 O ATOM 1846 CB HIS A 880 -22.976 -0.174 -5.468 1.00 0.00 C ATOM 1847 CG HIS A 880 -23.360 -0.704 -4.120 1.00 0.00 C ATOM 1848 ND1 HIS A 880 -23.055 -1.978 -3.688 1.00 0.00 N ATOM 1849 CD2 HIS A 880 -24.028 -0.117 -3.102 1.00 0.00 C ATOM 1850 CE1 HIS A 880 -23.521 -2.147 -2.465 1.00 0.00 C ATOM 1851 NE2 HIS A 880 -24.114 -1.032 -2.087 1.00 0.00 N ATOM 0 H HIS A 880 -21.192 1.862 -4.724 1.00 0.00 H new ATOM 0 HA HIS A 880 -20.993 -0.968 -5.583 1.00 0.00 H new ATOM 0 HB2 HIS A 880 -23.471 0.785 -5.624 1.00 0.00 H new ATOM 0 HB3 HIS A 880 -23.350 -0.854 -6.234 1.00 0.00 H new ATOM 0 HD2 HIS A 880 -24.422 0.889 -3.091 1.00 0.00 H new ATOM 0 HE1 HIS A 880 -23.432 -3.046 -1.874 1.00 0.00 H new ATOM 0 HE2 HIS A 880 -24.564 -0.876 -1.185 1.00 0.00 H new ATOM 1860 N PRO A 881 -21.056 -0.239 -8.072 1.00 0.00 N ATOM 1861 CA PRO A 881 -20.818 0.220 -9.448 1.00 0.00 C ATOM 1862 C PRO A 881 -22.057 0.873 -10.073 1.00 0.00 C ATOM 1863 O PRO A 881 -22.511 0.482 -11.150 1.00 0.00 O ATOM 1864 CB PRO A 881 -20.452 -1.066 -10.191 1.00 0.00 C ATOM 1865 CG PRO A 881 -21.127 -2.150 -9.423 1.00 0.00 C ATOM 1866 CD PRO A 881 -21.110 -1.712 -7.985 1.00 0.00 C ATOM 0 HA PRO A 881 -20.046 0.988 -9.493 1.00 0.00 H new ATOM 0 HB2 PRO A 881 -20.797 -1.038 -11.224 1.00 0.00 H new ATOM 0 HB3 PRO A 881 -19.372 -1.214 -10.219 1.00 0.00 H new ATOM 0 HG2 PRO A 881 -22.148 -2.299 -9.773 1.00 0.00 H new ATOM 0 HG3 PRO A 881 -20.606 -3.099 -9.548 1.00 0.00 H new ATOM 0 HD2 PRO A 881 -21.999 -2.050 -7.452 1.00 0.00 H new ATOM 0 HD3 PRO A 881 -20.248 -2.114 -7.453 1.00 0.00 H new ATOM 1874 N ASP A 882 -22.589 1.871 -9.384 1.00 0.00 N ATOM 1875 CA ASP A 882 -23.776 2.592 -9.833 1.00 0.00 C ATOM 1876 C ASP A 882 -23.382 3.974 -10.335 1.00 0.00 C ATOM 1877 O ASP A 882 -24.229 4.843 -10.556 1.00 0.00 O ATOM 1878 CB ASP A 882 -24.780 2.715 -8.682 1.00 0.00 C ATOM 1879 CG ASP A 882 -26.223 2.704 -9.148 1.00 0.00 C ATOM 1880 OD1 ASP A 882 -26.513 2.092 -10.197 1.00 0.00 O ATOM 1881 OD2 ASP A 882 -27.081 3.292 -8.450 1.00 0.00 O ATOM 0 H ASP A 882 -22.212 2.206 -8.497 1.00 0.00 H new ATOM 0 HA ASP A 882 -24.242 2.039 -10.649 1.00 0.00 H new ATOM 0 HB2 ASP A 882 -24.624 1.894 -7.982 1.00 0.00 H new ATOM 0 HB3 ASP A 882 -24.587 3.639 -8.137 1.00 0.00 H new ATOM 1886 N SER A 883 -22.082 4.160 -10.512 1.00 0.00 N ATOM 1887 CA SER A 883 -21.522 5.433 -10.924 1.00 0.00 C ATOM 1888 C SER A 883 -21.836 5.729 -12.387 1.00 0.00 C ATOM 1889 O SER A 883 -21.701 4.861 -13.254 1.00 0.00 O ATOM 1890 CB SER A 883 -20.012 5.407 -10.699 1.00 0.00 C ATOM 1891 OG SER A 883 -19.602 4.140 -10.202 1.00 0.00 O ATOM 0 H SER A 883 -21.386 3.428 -10.373 1.00 0.00 H new ATOM 0 HA SER A 883 -21.971 6.226 -10.327 1.00 0.00 H new ATOM 0 HB2 SER A 883 -19.496 5.621 -11.635 1.00 0.00 H new ATOM 0 HB3 SER A 883 -19.730 6.189 -9.994 1.00 0.00 H new ATOM 0 HG SER A 883 -18.632 4.141 -10.065 1.00 0.00 H new ATOM 1897 N GLU A 884 -22.247 6.958 -12.655 1.00 0.00 N ATOM 1898 CA GLU A 884 -22.576 7.377 -14.006 1.00 0.00 C ATOM 1899 C GLU A 884 -21.381 8.071 -14.645 1.00 0.00 C ATOM 1900 O GLU A 884 -21.238 9.295 -14.560 1.00 0.00 O ATOM 1901 CB GLU A 884 -23.788 8.308 -13.996 1.00 0.00 C ATOM 1902 CG GLU A 884 -24.989 7.743 -14.732 1.00 0.00 C ATOM 1903 CD GLU A 884 -25.171 8.359 -16.103 1.00 0.00 C ATOM 1904 OE1 GLU A 884 -24.441 7.972 -17.039 1.00 0.00 O ATOM 1905 OE2 GLU A 884 -26.051 9.229 -16.256 1.00 0.00 O ATOM 0 H GLU A 884 -22.361 7.686 -11.950 1.00 0.00 H new ATOM 0 HA GLU A 884 -22.824 6.494 -14.594 1.00 0.00 H new ATOM 0 HB2 GLU A 884 -24.069 8.515 -12.963 1.00 0.00 H new ATOM 0 HB3 GLU A 884 -23.509 9.260 -14.448 1.00 0.00 H new ATOM 0 HG2 GLU A 884 -24.874 6.664 -14.834 1.00 0.00 H new ATOM 0 HG3 GLU A 884 -25.888 7.913 -14.139 1.00 0.00 H new ATOM 1912 N GLU A 885 -20.514 7.284 -15.265 1.00 0.00 N ATOM 1913 CA GLU A 885 -19.336 7.826 -15.918 1.00 0.00 C ATOM 1914 C GLU A 885 -19.686 8.348 -17.303 1.00 0.00 C ATOM 1915 O GLU A 885 -20.179 7.607 -18.156 1.00 0.00 O ATOM 1916 CB GLU A 885 -18.235 6.771 -16.019 1.00 0.00 C ATOM 1917 CG GLU A 885 -16.837 7.344 -15.849 1.00 0.00 C ATOM 1918 CD GLU A 885 -16.103 7.501 -17.165 1.00 0.00 C ATOM 1919 OE1 GLU A 885 -16.626 8.180 -18.076 1.00 0.00 O ATOM 1920 OE2 GLU A 885 -14.996 6.938 -17.299 1.00 0.00 O ATOM 0 H GLU A 885 -20.605 6.270 -15.329 1.00 0.00 H new ATOM 0 HA GLU A 885 -18.967 8.654 -15.312 1.00 0.00 H new ATOM 0 HB2 GLU A 885 -18.402 6.007 -15.259 1.00 0.00 H new ATOM 0 HB3 GLU A 885 -18.302 6.277 -16.988 1.00 0.00 H new ATOM 0 HG2 GLU A 885 -16.904 8.315 -15.358 1.00 0.00 H new ATOM 0 HG3 GLU A 885 -16.260 6.693 -15.192 1.00 0.00 H new ATOM 1927 N GLN A 886 -19.428 9.624 -17.517 1.00 0.00 N ATOM 1928 CA GLN A 886 -19.691 10.259 -18.796 1.00 0.00 C ATOM 1929 C GLN A 886 -18.549 11.201 -19.114 1.00 0.00 C ATOM 1930 O GLN A 886 -18.740 12.246 -19.742 1.00 0.00 O ATOM 1931 CB GLN A 886 -21.015 11.023 -18.753 1.00 0.00 C ATOM 1932 CG GLN A 886 -22.202 10.210 -19.234 1.00 0.00 C ATOM 1933 CD GLN A 886 -23.499 10.989 -19.180 1.00 0.00 C ATOM 1934 OE1 GLN A 886 -23.568 12.133 -19.632 1.00 0.00 O ATOM 1935 NE2 GLN A 886 -24.530 10.387 -18.614 1.00 0.00 N ATOM 0 H GLN A 886 -19.032 10.248 -16.814 1.00 0.00 H new ATOM 0 HA GLN A 886 -19.768 9.498 -19.573 1.00 0.00 H new ATOM 0 HB2 GLN A 886 -21.201 11.353 -17.731 1.00 0.00 H new ATOM 0 HB3 GLN A 886 -20.927 11.920 -19.366 1.00 0.00 H new ATOM 0 HG2 GLN A 886 -22.022 9.881 -20.257 1.00 0.00 H new ATOM 0 HG3 GLN A 886 -22.295 9.313 -18.622 1.00 0.00 H new ATOM 0 HE21 GLN A 886 -24.431 9.439 -18.252 1.00 0.00 H new ATOM 0 HE22 GLN A 886 -25.425 10.871 -18.539 1.00 0.00 H new ATOM 1944 N GLN A 887 -17.353 10.805 -18.673 1.00 0.00 N ATOM 1945 CA GLN A 887 -16.184 11.668 -18.721 1.00 0.00 C ATOM 1946 C GLN A 887 -16.507 12.971 -17.995 1.00 0.00 C ATOM 1947 O GLN A 887 -16.786 12.960 -16.796 1.00 0.00 O ATOM 1948 CB GLN A 887 -15.753 11.929 -20.173 1.00 0.00 C ATOM 1949 CG GLN A 887 -15.686 10.672 -21.028 1.00 0.00 C ATOM 1950 CD GLN A 887 -14.447 9.841 -20.756 1.00 0.00 C ATOM 1951 OE1 GLN A 887 -13.365 10.129 -21.268 1.00 0.00 O ATOM 1952 NE2 GLN A 887 -14.590 8.812 -19.935 1.00 0.00 N ATOM 0 H GLN A 887 -17.174 9.883 -18.276 1.00 0.00 H new ATOM 0 HA GLN A 887 -15.346 11.178 -18.224 1.00 0.00 H new ATOM 0 HB2 GLN A 887 -16.451 12.631 -20.629 1.00 0.00 H new ATOM 0 HB3 GLN A 887 -14.774 12.409 -20.171 1.00 0.00 H new ATOM 0 HG2 GLN A 887 -16.572 10.065 -20.844 1.00 0.00 H new ATOM 0 HG3 GLN A 887 -15.705 10.953 -22.081 1.00 0.00 H new ATOM 0 HE21 GLN A 887 -15.503 8.605 -19.531 1.00 0.00 H new ATOM 0 HE22 GLN A 887 -13.787 8.226 -19.707 1.00 0.00 H new ATOM 1961 N GLN A 888 -16.499 14.076 -18.719 1.00 0.00 N ATOM 1962 CA GLN A 888 -16.935 15.347 -18.170 1.00 0.00 C ATOM 1963 C GLN A 888 -17.438 16.241 -19.289 1.00 0.00 C ATOM 1964 O GLN A 888 -17.072 17.413 -19.395 1.00 0.00 O ATOM 1965 CB GLN A 888 -15.810 16.024 -17.393 1.00 0.00 C ATOM 1966 CG GLN A 888 -15.931 15.824 -15.893 1.00 0.00 C ATOM 1967 CD GLN A 888 -14.587 15.729 -15.209 1.00 0.00 C ATOM 1968 OE1 GLN A 888 -13.955 16.742 -14.905 1.00 0.00 O ATOM 1969 NE2 GLN A 888 -14.140 14.511 -14.957 1.00 0.00 N ATOM 0 H GLN A 888 -16.194 14.118 -19.692 1.00 0.00 H new ATOM 0 HA GLN A 888 -17.751 15.166 -17.470 1.00 0.00 H new ATOM 0 HB2 GLN A 888 -14.852 15.630 -17.732 1.00 0.00 H new ATOM 0 HB3 GLN A 888 -15.812 17.091 -17.614 1.00 0.00 H new ATOM 0 HG2 GLN A 888 -16.495 16.652 -15.464 1.00 0.00 H new ATOM 0 HG3 GLN A 888 -16.500 14.915 -15.696 1.00 0.00 H new ATOM 0 HE21 GLN A 888 -14.695 13.698 -15.225 1.00 0.00 H new ATOM 0 HE22 GLN A 888 -13.240 14.384 -14.494 1.00 0.00 H new ATOM 1978 N ARG A 889 -18.271 15.662 -20.136 1.00 0.00 N ATOM 1979 CA ARG A 889 -18.842 16.379 -21.259 1.00 0.00 C ATOM 1980 C ARG A 889 -20.294 16.715 -20.966 1.00 0.00 C ATOM 1981 O ARG A 889 -20.914 15.992 -20.154 1.00 0.00 O ATOM 1982 CB ARG A 889 -18.740 15.543 -22.539 1.00 0.00 C ATOM 1983 CG ARG A 889 -17.391 14.867 -22.724 1.00 0.00 C ATOM 1984 CD ARG A 889 -16.607 15.493 -23.867 1.00 0.00 C ATOM 1985 NE ARG A 889 -15.867 16.681 -23.441 1.00 0.00 N ATOM 1986 CZ ARG A 889 -15.758 17.788 -24.176 1.00 0.00 C ATOM 1987 NH1 ARG A 889 -16.348 17.861 -25.362 1.00 0.00 N ATOM 1988 NH2 ARG A 889 -15.070 18.828 -23.719 1.00 0.00 N ATOM 1989 OXT ARG A 889 -20.807 17.699 -21.535 1.00 0.00 O ATOM 0 H ARG A 889 -18.568 14.689 -20.065 1.00 0.00 H new ATOM 0 HA ARG A 889 -18.283 17.303 -21.408 1.00 0.00 H new ATOM 0 HB2 ARG A 889 -19.519 14.781 -22.527 1.00 0.00 H new ATOM 0 HB3 ARG A 889 -18.935 16.185 -23.398 1.00 0.00 H new ATOM 0 HG2 ARG A 889 -16.815 14.943 -21.802 1.00 0.00 H new ATOM 0 HG3 ARG A 889 -17.539 13.805 -22.921 1.00 0.00 H new ATOM 0 HD2 ARG A 889 -15.911 14.759 -24.273 1.00 0.00 H new ATOM 0 HD3 ARG A 889 -17.292 15.762 -24.671 1.00 0.00 H new ATOM 0 HE ARG A 889 -15.408 16.661 -22.530 1.00 0.00 H new ATOM 0 HH11 ARG A 889 -16.886 17.069 -25.713 1.00 0.00 H new ATOM 0 HH12 ARG A 889 -16.263 18.709 -25.922 1.00 0.00 H new ATOM 0 HH21 ARG A 889 -14.623 18.781 -22.803 1.00 0.00 H new ATOM 0 HH22 ARG A 889 -14.988 19.673 -24.284 1.00 0.00 H new TER 2003 ARG A 889