USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=27 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 77:sc= 0.825 USER MOD Set 1.2: A 867 THR OG1 : rot 66:sc= 0.501 USER MOD Set 2.1: A 811 ASN : amide:sc= 0.65 K(o=1.7,f=-1.6!) USER MOD Set 2.2: A 825 GLN : amide:sc= 1.03 K(o=1.7,f=-4.7!) USER MOD Set 3.1: A 776 GLN : amide:sc= -0.0372 K(o=0.13,f=-2.4) USER MOD Set 3.2: A 779 ASN : amide:sc= 0.17 K(o=0.13,f=-2.4!) USER MOD Single : A 752 SER OG : rot 180:sc= 0.127 USER MOD Single : A 753 HIS : no HD1:sc= -0.0151 X(o=-0.015,f=0) USER MOD Single : A 754 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 755 GLN : amide:sc= -0.0115 X(o=-0.011,f=-0.29) USER MOD Single : A 758 THR OG1 : rot 180:sc= 0.107 USER MOD Single : A 762 GLN : amide:sc= -2.04! K(o=-2!,f=-1.1) USER MOD Single : A 772 THR OG1 : rot 70:sc= 1.18 USER MOD Single : A 775 THR OG1 : rot 76:sc= 1.08 USER MOD Single : A 783 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 784 HIS : no HE2:sc= -0.679 K(o=-0.68,f=-2.1) USER MOD Single : A 786 LYS NZ :NH3+ -134:sc= 1.24 (180deg=1.01) USER MOD Single : A 788 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 790 THR OG1 : rot 120:sc= 1.31 USER MOD Single : A 798 TYR OH : rot 180:sc= 0 USER MOD Single : A 800 GLN : amide:sc= -1.3! K(o=-1.3!,f=-0.026) USER MOD Single : A 802 THR OG1 : rot 51:sc= 0.519 USER MOD Single : A 804 THR OG1 : rot 66:sc= 0.358 USER MOD Single : A 807 THR OG1 : rot 86:sc= 1.25 USER MOD Single : A 809 THR OG1 : rot 180:sc=-0.00137 USER MOD Single : A 814 SER OG : rot 80:sc= 0.0171 USER MOD Single : A 815 SER OG : rot 77:sc= 1.28 USER MOD Single : A 816 MET CE :methyl 143:sc= -0.613 (180deg=-1.59) USER MOD Single : A 822 MET CE :methyl 159:sc= -0.323 (180deg=-0.901) USER MOD Single : A 831 GLN : amide:sc= -0.0951 X(o=-0.095,f=0) USER MOD Single : A 834 SER OG : rot 82:sc= 1.23 USER MOD Single : A 838 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 841 LYS NZ :NH3+ 158:sc= 1.2 (180deg=1.11) USER MOD Single : A 848 SER OG : rot 180:sc= 0 USER MOD Single : A 852 ASN : amide:sc= 1.12 K(o=1.1,f=-0.31) USER MOD Single : A 853 SER OG : rot -34:sc= 1.19 USER MOD Single : A 855 LYS NZ :NH3+ 151:sc= 0.988 (180deg=-0.9) USER MOD Single : A 858 SER OG : rot 180:sc= -0.124 USER MOD Single : A 861 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 869 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 870 MET CE :methyl -129:sc= -2.92! (180deg=-4.65!) USER MOD Single : A 875 LYS NZ :NH3+ 157:sc= 1.19 (180deg=0.556) USER MOD Single : A 880 HIS : no HD1:sc= -0.0925 X(o=-0.092,f=-0.44) USER MOD Single : A 883 SER OG : rot 180:sc= 0 USER MOD Single : A 886 GLN : amide:sc= 0 K(o=0,f=-0.96) USER MOD Single : A 887 GLN : amide:sc= -0.437 X(o=-0.44,f=-0.44) USER MOD Single : A 888 GLN : amide:sc= -4.31! C(o=-4.3!,f=-5.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 751 -11.229 16.202 16.754 1.00 0.00 N ATOM 2 CA GLY A 751 -10.017 15.358 16.888 1.00 0.00 C ATOM 3 C GLY A 751 -8.783 16.180 17.198 1.00 0.00 C ATOM 4 O GLY A 751 -8.149 16.730 16.296 1.00 0.00 O ATOM 0 HA2 GLY A 751 -10.172 14.625 17.679 1.00 0.00 H new ATOM 0 HA3 GLY A 751 -9.859 14.802 15.964 1.00 0.00 H new ATOM 10 N SER A 752 -8.441 16.271 18.474 1.00 0.00 N ATOM 11 CA SER A 752 -7.293 17.051 18.907 1.00 0.00 C ATOM 12 C SER A 752 -5.991 16.293 18.667 1.00 0.00 C ATOM 13 O SER A 752 -5.003 16.859 18.198 1.00 0.00 O ATOM 14 CB SER A 752 -7.437 17.383 20.390 1.00 0.00 C ATOM 15 OG SER A 752 -8.689 16.931 20.886 1.00 0.00 O ATOM 0 H SER A 752 -8.946 15.811 19.232 1.00 0.00 H new ATOM 0 HA SER A 752 -7.259 17.972 18.324 1.00 0.00 H new ATOM 0 HB2 SER A 752 -6.628 16.917 20.952 1.00 0.00 H new ATOM 0 HB3 SER A 752 -7.349 18.459 20.537 1.00 0.00 H new ATOM 0 HG SER A 752 -8.762 17.151 21.838 1.00 0.00 H new ATOM 21 N HIS A 753 -6.000 15.006 18.980 1.00 0.00 N ATOM 22 CA HIS A 753 -4.802 14.186 18.872 1.00 0.00 C ATOM 23 C HIS A 753 -4.992 13.082 17.842 1.00 0.00 C ATOM 24 O HIS A 753 -4.059 12.722 17.127 1.00 0.00 O ATOM 25 CB HIS A 753 -4.460 13.577 20.234 1.00 0.00 C ATOM 26 CG HIS A 753 -3.009 13.240 20.400 1.00 0.00 C ATOM 27 ND1 HIS A 753 -2.434 12.988 21.624 1.00 0.00 N ATOM 28 CD2 HIS A 753 -2.018 13.107 19.489 1.00 0.00 C ATOM 29 CE1 HIS A 753 -1.154 12.716 21.460 1.00 0.00 C ATOM 30 NE2 HIS A 753 -0.873 12.778 20.171 1.00 0.00 N ATOM 0 H HIS A 753 -6.825 14.506 19.311 1.00 0.00 H new ATOM 0 HA HIS A 753 -3.979 14.822 18.546 1.00 0.00 H new ATOM 0 HB2 HIS A 753 -4.753 14.276 21.018 1.00 0.00 H new ATOM 0 HB3 HIS A 753 -5.052 12.673 20.376 1.00 0.00 H new ATOM 0 HD2 HIS A 753 -2.111 13.236 18.421 1.00 0.00 H new ATOM 0 HE1 HIS A 753 -0.453 12.482 22.248 1.00 0.00 H new ATOM 0 HE2 HIS A 753 0.042 12.610 19.752 1.00 0.00 H new ATOM 39 N MET A 754 -6.199 12.547 17.773 1.00 0.00 N ATOM 40 CA MET A 754 -6.495 11.462 16.851 1.00 0.00 C ATOM 41 C MET A 754 -7.824 11.704 16.154 1.00 0.00 C ATOM 42 O MET A 754 -8.820 12.045 16.797 1.00 0.00 O ATOM 43 CB MET A 754 -6.526 10.123 17.599 1.00 0.00 C ATOM 44 CG MET A 754 -6.951 8.942 16.736 1.00 0.00 C ATOM 45 SD MET A 754 -5.669 8.426 15.576 1.00 0.00 S ATOM 46 CE MET A 754 -5.508 6.691 15.994 1.00 0.00 C ATOM 0 H MET A 754 -6.990 12.845 18.344 1.00 0.00 H new ATOM 0 HA MET A 754 -5.709 11.425 16.097 1.00 0.00 H new ATOM 0 HB2 MET A 754 -5.535 9.924 18.008 1.00 0.00 H new ATOM 0 HB3 MET A 754 -7.209 10.206 18.445 1.00 0.00 H new ATOM 0 HG2 MET A 754 -7.211 8.102 17.380 1.00 0.00 H new ATOM 0 HG3 MET A 754 -7.851 9.208 16.181 1.00 0.00 H new ATOM 0 HE1 MET A 754 -4.750 6.233 15.359 1.00 0.00 H new ATOM 0 HE2 MET A 754 -5.214 6.594 17.039 1.00 0.00 H new ATOM 0 HE3 MET A 754 -6.463 6.189 15.838 1.00 0.00 H new ATOM 56 N GLN A 755 -7.834 11.543 14.839 1.00 0.00 N ATOM 57 CA GLN A 755 -9.059 11.656 14.071 1.00 0.00 C ATOM 58 C GLN A 755 -9.835 10.349 14.165 1.00 0.00 C ATOM 59 O GLN A 755 -9.348 9.292 13.757 1.00 0.00 O ATOM 60 CB GLN A 755 -8.751 12.001 12.607 1.00 0.00 C ATOM 61 CG GLN A 755 -9.842 11.589 11.628 1.00 0.00 C ATOM 62 CD GLN A 755 -10.658 12.764 11.128 1.00 0.00 C ATOM 63 OE1 GLN A 755 -10.883 13.735 11.850 1.00 0.00 O ATOM 64 NE2 GLN A 755 -11.119 12.682 9.893 1.00 0.00 N ATOM 0 H GLN A 755 -7.005 11.333 14.283 1.00 0.00 H new ATOM 0 HA GLN A 755 -9.666 12.463 14.482 1.00 0.00 H new ATOM 0 HB2 GLN A 755 -8.591 13.076 12.524 1.00 0.00 H new ATOM 0 HB3 GLN A 755 -7.818 11.517 12.319 1.00 0.00 H new ATOM 0 HG2 GLN A 755 -9.387 11.080 10.778 1.00 0.00 H new ATOM 0 HG3 GLN A 755 -10.505 10.872 12.111 1.00 0.00 H new ATOM 0 HE21 GLN A 755 -10.911 11.861 9.325 1.00 0.00 H new ATOM 0 HE22 GLN A 755 -11.683 13.440 9.508 1.00 0.00 H new ATOM 73 N ALA A 756 -11.024 10.418 14.730 1.00 0.00 N ATOM 74 CA ALA A 756 -11.868 9.249 14.865 1.00 0.00 C ATOM 75 C ALA A 756 -13.004 9.291 13.853 1.00 0.00 C ATOM 76 O ALA A 756 -14.069 9.849 14.121 1.00 0.00 O ATOM 77 CB ALA A 756 -12.414 9.156 16.281 1.00 0.00 C ATOM 0 H ALA A 756 -11.428 11.276 15.105 1.00 0.00 H new ATOM 0 HA ALA A 756 -11.268 8.361 14.666 1.00 0.00 H new ATOM 0 HB1 ALA A 756 -13.047 8.273 16.370 1.00 0.00 H new ATOM 0 HB2 ALA A 756 -11.586 9.081 16.986 1.00 0.00 H new ATOM 0 HB3 ALA A 756 -13.001 10.047 16.504 1.00 0.00 H new ATOM 83 N ALA A 757 -12.759 8.731 12.677 1.00 0.00 N ATOM 84 CA ALA A 757 -13.785 8.638 11.653 1.00 0.00 C ATOM 85 C ALA A 757 -14.752 7.515 11.993 1.00 0.00 C ATOM 86 O ALA A 757 -14.368 6.345 12.024 1.00 0.00 O ATOM 87 CB ALA A 757 -13.160 8.415 10.282 1.00 0.00 C ATOM 0 H ALA A 757 -11.858 8.335 12.410 1.00 0.00 H new ATOM 0 HA ALA A 757 -14.336 9.578 11.620 1.00 0.00 H new ATOM 0 HB1 ALA A 757 -13.946 8.348 9.530 1.00 0.00 H new ATOM 0 HB2 ALA A 757 -12.499 9.249 10.043 1.00 0.00 H new ATOM 0 HB3 ALA A 757 -12.586 7.488 10.290 1.00 0.00 H new ATOM 93 N THR A 758 -15.996 7.878 12.264 1.00 0.00 N ATOM 94 CA THR A 758 -17.007 6.919 12.672 1.00 0.00 C ATOM 95 C THR A 758 -17.488 6.072 11.495 1.00 0.00 C ATOM 96 O THR A 758 -18.523 6.353 10.888 1.00 0.00 O ATOM 97 CB THR A 758 -18.199 7.639 13.312 1.00 0.00 C ATOM 98 OG1 THR A 758 -18.005 9.061 13.227 1.00 0.00 O ATOM 99 CG2 THR A 758 -18.360 7.228 14.766 1.00 0.00 C ATOM 0 H THR A 758 -16.330 8.840 12.207 1.00 0.00 H new ATOM 0 HA THR A 758 -16.549 6.254 13.404 1.00 0.00 H new ATOM 0 HB THR A 758 -19.104 7.360 12.773 1.00 0.00 H new ATOM 0 HG1 THR A 758 -18.769 9.520 13.635 1.00 0.00 H new ATOM 0 HG21 THR A 758 -19.212 7.751 15.200 1.00 0.00 H new ATOM 0 HG22 THR A 758 -18.527 6.152 14.824 1.00 0.00 H new ATOM 0 HG23 THR A 758 -17.456 7.485 15.319 1.00 0.00 H new ATOM 107 N GLU A 759 -16.714 5.047 11.175 1.00 0.00 N ATOM 108 CA GLU A 759 -17.060 4.116 10.117 1.00 0.00 C ATOM 109 C GLU A 759 -16.502 2.740 10.450 1.00 0.00 C ATOM 110 O GLU A 759 -15.621 2.613 11.305 1.00 0.00 O ATOM 111 CB GLU A 759 -16.498 4.594 8.774 1.00 0.00 C ATOM 112 CG GLU A 759 -17.561 4.834 7.710 1.00 0.00 C ATOM 113 CD GLU A 759 -18.614 3.745 7.669 1.00 0.00 C ATOM 114 OE1 GLU A 759 -18.255 2.561 7.506 1.00 0.00 O ATOM 115 OE2 GLU A 759 -19.811 4.066 7.801 1.00 0.00 O ATOM 0 H GLU A 759 -15.831 4.839 11.641 1.00 0.00 H new ATOM 0 HA GLU A 759 -18.146 4.061 10.037 1.00 0.00 H new ATOM 0 HB2 GLU A 759 -15.942 5.518 8.932 1.00 0.00 H new ATOM 0 HB3 GLU A 759 -15.788 3.854 8.404 1.00 0.00 H new ATOM 0 HG2 GLU A 759 -18.045 5.793 7.897 1.00 0.00 H new ATOM 0 HG3 GLU A 759 -17.081 4.905 6.734 1.00 0.00 H new ATOM 122 N ASP A 760 -17.009 1.723 9.775 1.00 0.00 N ATOM 123 CA ASP A 760 -16.549 0.358 9.976 1.00 0.00 C ATOM 124 C ASP A 760 -16.942 -0.504 8.780 1.00 0.00 C ATOM 125 O ASP A 760 -16.095 -0.771 7.927 1.00 0.00 O ATOM 126 CB ASP A 760 -17.105 -0.225 11.284 1.00 0.00 C ATOM 127 CG ASP A 760 -16.329 -1.441 11.749 1.00 0.00 C ATOM 128 OD1 ASP A 760 -16.550 -2.539 11.203 1.00 0.00 O ATOM 129 OD2 ASP A 760 -15.487 -1.306 12.665 1.00 0.00 O ATOM 0 H ASP A 760 -17.746 1.818 9.076 1.00 0.00 H new ATOM 0 HA ASP A 760 -15.462 0.365 10.058 1.00 0.00 H new ATOM 0 HB2 ASP A 760 -17.077 0.540 12.060 1.00 0.00 H new ATOM 0 HB3 ASP A 760 -18.151 -0.497 11.142 1.00 0.00 H new ATOM 134 N GLY A 761 -18.240 -0.864 8.715 1.00 0.00 N ATOM 135 CA GLY A 761 -18.807 -1.716 7.662 1.00 0.00 C ATOM 136 C GLY A 761 -17.788 -2.499 6.858 1.00 0.00 C ATOM 137 O GLY A 761 -17.318 -3.554 7.287 1.00 0.00 O ATOM 0 H GLY A 761 -18.929 -0.564 9.404 1.00 0.00 H new ATOM 0 HA2 GLY A 761 -19.505 -2.418 8.119 1.00 0.00 H new ATOM 0 HA3 GLY A 761 -19.384 -1.091 6.980 1.00 0.00 H new ATOM 141 N GLN A 762 -17.457 -1.980 5.686 1.00 0.00 N ATOM 142 CA GLN A 762 -16.419 -2.563 4.855 1.00 0.00 C ATOM 143 C GLN A 762 -15.346 -1.525 4.550 1.00 0.00 C ATOM 144 O GLN A 762 -14.219 -1.867 4.188 1.00 0.00 O ATOM 145 CB GLN A 762 -17.014 -3.119 3.556 1.00 0.00 C ATOM 146 CG GLN A 762 -17.599 -2.056 2.639 1.00 0.00 C ATOM 147 CD GLN A 762 -17.967 -2.601 1.274 1.00 0.00 C ATOM 148 OE1 GLN A 762 -19.144 -2.725 0.937 1.00 0.00 O ATOM 149 NE2 GLN A 762 -16.966 -2.945 0.480 1.00 0.00 N ATOM 0 H GLN A 762 -17.897 -1.150 5.288 1.00 0.00 H new ATOM 0 HA GLN A 762 -15.962 -3.389 5.400 1.00 0.00 H new ATOM 0 HB2 GLN A 762 -16.238 -3.663 3.017 1.00 0.00 H new ATOM 0 HB3 GLN A 762 -17.794 -3.839 3.805 1.00 0.00 H new ATOM 0 HG2 GLN A 762 -18.486 -1.627 3.106 1.00 0.00 H new ATOM 0 HG3 GLN A 762 -16.878 -1.247 2.521 1.00 0.00 H new ATOM 0 HE21 GLN A 762 -16.003 -2.828 0.794 1.00 0.00 H new ATOM 0 HE22 GLN A 762 -17.158 -3.327 -0.446 1.00 0.00 H new ATOM 158 N LEU A 763 -15.700 -0.255 4.726 1.00 0.00 N ATOM 159 CA LEU A 763 -14.789 0.843 4.437 1.00 0.00 C ATOM 160 C LEU A 763 -13.612 0.831 5.404 1.00 0.00 C ATOM 161 O LEU A 763 -12.473 0.593 5.012 1.00 0.00 O ATOM 162 CB LEU A 763 -15.530 2.181 4.529 1.00 0.00 C ATOM 163 CG LEU A 763 -15.922 2.811 3.189 1.00 0.00 C ATOM 164 CD1 LEU A 763 -14.726 2.874 2.254 1.00 0.00 C ATOM 165 CD2 LEU A 763 -17.064 2.039 2.545 1.00 0.00 C ATOM 0 H LEU A 763 -16.615 0.038 5.069 1.00 0.00 H new ATOM 0 HA LEU A 763 -14.407 0.717 3.424 1.00 0.00 H new ATOM 0 HB2 LEU A 763 -16.434 2.036 5.121 1.00 0.00 H new ATOM 0 HB3 LEU A 763 -14.903 2.887 5.073 1.00 0.00 H new ATOM 0 HG LEU A 763 -16.261 3.829 3.379 1.00 0.00 H new ATOM 0 HD11 LEU A 763 -15.027 3.325 1.308 1.00 0.00 H new ATOM 0 HD12 LEU A 763 -13.940 3.476 2.709 1.00 0.00 H new ATOM 0 HD13 LEU A 763 -14.352 1.866 2.073 1.00 0.00 H new ATOM 0 HD21 LEU A 763 -17.327 2.503 1.594 1.00 0.00 H new ATOM 0 HD22 LEU A 763 -16.754 1.008 2.372 1.00 0.00 H new ATOM 0 HD23 LEU A 763 -17.930 2.052 3.206 1.00 0.00 H new ATOM 177 N LEU A 764 -13.891 1.050 6.677 1.00 0.00 N ATOM 178 CA LEU A 764 -12.838 1.084 7.677 1.00 0.00 C ATOM 179 C LEU A 764 -12.392 -0.329 8.030 1.00 0.00 C ATOM 180 O LEU A 764 -11.286 -0.540 8.528 1.00 0.00 O ATOM 181 CB LEU A 764 -13.302 1.824 8.934 1.00 0.00 C ATOM 182 CG LEU A 764 -12.582 3.146 9.222 1.00 0.00 C ATOM 183 CD1 LEU A 764 -11.085 2.922 9.380 1.00 0.00 C ATOM 184 CD2 LEU A 764 -12.857 4.157 8.118 1.00 0.00 C ATOM 0 H LEU A 764 -14.831 1.206 7.041 1.00 0.00 H new ATOM 0 HA LEU A 764 -11.990 1.624 7.256 1.00 0.00 H new ATOM 0 HB2 LEU A 764 -14.370 2.023 8.844 1.00 0.00 H new ATOM 0 HB3 LEU A 764 -13.172 1.165 9.792 1.00 0.00 H new ATOM 0 HG LEU A 764 -12.968 3.546 10.160 1.00 0.00 H new ATOM 0 HD11 LEU A 764 -10.594 3.874 9.584 1.00 0.00 H new ATOM 0 HD12 LEU A 764 -10.905 2.236 10.208 1.00 0.00 H new ATOM 0 HD13 LEU A 764 -10.682 2.495 8.461 1.00 0.00 H new ATOM 0 HD21 LEU A 764 -12.337 5.089 8.340 1.00 0.00 H new ATOM 0 HD22 LEU A 764 -12.502 3.762 7.166 1.00 0.00 H new ATOM 0 HD23 LEU A 764 -13.929 4.345 8.056 1.00 0.00 H new ATOM 196 N ARG A 765 -13.261 -1.296 7.762 1.00 0.00 N ATOM 197 CA ARG A 765 -12.952 -2.694 8.018 1.00 0.00 C ATOM 198 C ARG A 765 -11.848 -3.187 7.089 1.00 0.00 C ATOM 199 O ARG A 765 -10.794 -3.626 7.546 1.00 0.00 O ATOM 200 CB ARG A 765 -14.201 -3.558 7.848 1.00 0.00 C ATOM 201 CG ARG A 765 -14.312 -4.674 8.870 1.00 0.00 C ATOM 202 CD ARG A 765 -14.016 -4.172 10.272 1.00 0.00 C ATOM 203 NE ARG A 765 -13.824 -5.268 11.215 1.00 0.00 N ATOM 204 CZ ARG A 765 -14.542 -5.428 12.325 1.00 0.00 C ATOM 205 NH1 ARG A 765 -15.504 -4.566 12.632 1.00 0.00 N ATOM 206 NH2 ARG A 765 -14.300 -6.455 13.127 1.00 0.00 N ATOM 0 H ARG A 765 -14.187 -1.135 7.366 1.00 0.00 H new ATOM 0 HA ARG A 765 -12.601 -2.777 9.047 1.00 0.00 H new ATOM 0 HB2 ARG A 765 -15.084 -2.923 7.919 1.00 0.00 H new ATOM 0 HB3 ARG A 765 -14.199 -3.991 6.848 1.00 0.00 H new ATOM 0 HG2 ARG A 765 -15.315 -5.100 8.838 1.00 0.00 H new ATOM 0 HG3 ARG A 765 -13.618 -5.474 8.614 1.00 0.00 H new ATOM 0 HD2 ARG A 765 -13.122 -3.549 10.253 1.00 0.00 H new ATOM 0 HD3 ARG A 765 -14.837 -3.541 10.612 1.00 0.00 H new ATOM 0 HE ARG A 765 -13.096 -5.953 11.012 1.00 0.00 H new ATOM 0 HH11 ARG A 765 -15.696 -3.776 12.016 1.00 0.00 H new ATOM 0 HH12 ARG A 765 -16.051 -4.694 13.484 1.00 0.00 H new ATOM 0 HH21 ARG A 765 -13.564 -7.122 12.894 1.00 0.00 H new ATOM 0 HH22 ARG A 765 -14.849 -6.578 13.977 1.00 0.00 H new ATOM 220 N GLY A 766 -12.088 -3.096 5.789 1.00 0.00 N ATOM 221 CA GLY A 766 -11.124 -3.591 4.829 1.00 0.00 C ATOM 222 C GLY A 766 -10.117 -2.536 4.429 1.00 0.00 C ATOM 223 O GLY A 766 -8.918 -2.691 4.670 1.00 0.00 O ATOM 0 H GLY A 766 -12.931 -2.689 5.383 1.00 0.00 H new ATOM 0 HA2 GLY A 766 -10.600 -4.448 5.253 1.00 0.00 H new ATOM 0 HA3 GLY A 766 -11.648 -3.945 3.941 1.00 0.00 H new ATOM 227 N VAL A 767 -10.605 -1.452 3.837 1.00 0.00 N ATOM 228 CA VAL A 767 -9.735 -0.394 3.336 1.00 0.00 C ATOM 229 C VAL A 767 -8.920 0.222 4.463 1.00 0.00 C ATOM 230 O VAL A 767 -7.729 0.473 4.306 1.00 0.00 O ATOM 231 CB VAL A 767 -10.528 0.724 2.628 1.00 0.00 C ATOM 232 CG1 VAL A 767 -9.661 1.414 1.587 1.00 0.00 C ATOM 233 CG2 VAL A 767 -11.799 0.176 1.998 1.00 0.00 C ATOM 0 H VAL A 767 -11.600 -1.282 3.692 1.00 0.00 H new ATOM 0 HA VAL A 767 -9.069 -0.862 2.611 1.00 0.00 H new ATOM 0 HB VAL A 767 -10.818 1.462 3.376 1.00 0.00 H new ATOM 0 HG11 VAL A 767 -10.236 2.200 1.097 1.00 0.00 H new ATOM 0 HG12 VAL A 767 -8.789 1.852 2.072 1.00 0.00 H new ATOM 0 HG13 VAL A 767 -9.336 0.686 0.844 1.00 0.00 H new ATOM 0 HG21 VAL A 767 -12.339 0.985 1.506 1.00 0.00 H new ATOM 0 HG22 VAL A 767 -11.541 -0.588 1.264 1.00 0.00 H new ATOM 0 HG23 VAL A 767 -12.429 -0.262 2.772 1.00 0.00 H new ATOM 243 N GLY A 768 -9.572 0.450 5.598 1.00 0.00 N ATOM 244 CA GLY A 768 -8.898 1.037 6.743 1.00 0.00 C ATOM 245 C GLY A 768 -7.694 0.232 7.188 1.00 0.00 C ATOM 246 O GLY A 768 -6.596 0.774 7.331 1.00 0.00 O ATOM 0 H GLY A 768 -10.559 0.238 5.746 1.00 0.00 H new ATOM 0 HA2 GLY A 768 -8.581 2.049 6.493 1.00 0.00 H new ATOM 0 HA3 GLY A 768 -9.602 1.119 7.571 1.00 0.00 H new ATOM 250 N ALA A 769 -7.891 -1.065 7.385 1.00 0.00 N ATOM 251 CA ALA A 769 -6.817 -1.944 7.829 1.00 0.00 C ATOM 252 C ALA A 769 -5.706 -2.016 6.786 1.00 0.00 C ATOM 253 O ALA A 769 -4.523 -1.894 7.111 1.00 0.00 O ATOM 254 CB ALA A 769 -7.365 -3.333 8.120 1.00 0.00 C ATOM 0 H ALA A 769 -8.787 -1.532 7.244 1.00 0.00 H new ATOM 0 HA ALA A 769 -6.393 -1.534 8.745 1.00 0.00 H new ATOM 0 HB1 ALA A 769 -6.554 -3.982 8.451 1.00 0.00 H new ATOM 0 HB2 ALA A 769 -8.121 -3.269 8.902 1.00 0.00 H new ATOM 0 HB3 ALA A 769 -7.813 -3.744 7.215 1.00 0.00 H new ATOM 260 N ALA A 770 -6.099 -2.186 5.530 1.00 0.00 N ATOM 261 CA ALA A 770 -5.147 -2.309 4.435 1.00 0.00 C ATOM 262 C ALA A 770 -4.340 -1.026 4.251 1.00 0.00 C ATOM 263 O ALA A 770 -3.124 -1.067 4.065 1.00 0.00 O ATOM 264 CB ALA A 770 -5.874 -2.669 3.151 1.00 0.00 C ATOM 0 H ALA A 770 -7.076 -2.242 5.244 1.00 0.00 H new ATOM 0 HA ALA A 770 -4.447 -3.107 4.683 1.00 0.00 H new ATOM 0 HB1 ALA A 770 -5.154 -2.759 2.338 1.00 0.00 H new ATOM 0 HB2 ALA A 770 -6.394 -3.618 3.281 1.00 0.00 H new ATOM 0 HB3 ALA A 770 -6.597 -1.889 2.911 1.00 0.00 H new ATOM 270 N ALA A 771 -5.020 0.114 4.313 1.00 0.00 N ATOM 271 CA ALA A 771 -4.366 1.404 4.146 1.00 0.00 C ATOM 272 C ALA A 771 -3.359 1.652 5.264 1.00 0.00 C ATOM 273 O ALA A 771 -2.243 2.116 5.022 1.00 0.00 O ATOM 274 CB ALA A 771 -5.397 2.518 4.097 1.00 0.00 C ATOM 0 H ALA A 771 -6.025 0.169 4.478 1.00 0.00 H new ATOM 0 HA ALA A 771 -3.824 1.392 3.201 1.00 0.00 H new ATOM 0 HB1 ALA A 771 -4.892 3.476 3.972 1.00 0.00 H new ATOM 0 HB2 ALA A 771 -6.073 2.352 3.258 1.00 0.00 H new ATOM 0 HB3 ALA A 771 -5.967 2.527 5.026 1.00 0.00 H new ATOM 280 N THR A 772 -3.755 1.322 6.487 1.00 0.00 N ATOM 281 CA THR A 772 -2.876 1.462 7.637 1.00 0.00 C ATOM 282 C THR A 772 -1.650 0.559 7.491 1.00 0.00 C ATOM 283 O THR A 772 -0.540 0.937 7.871 1.00 0.00 O ATOM 284 CB THR A 772 -3.616 1.128 8.948 1.00 0.00 C ATOM 285 OG1 THR A 772 -4.855 1.850 9.005 1.00 0.00 O ATOM 286 CG2 THR A 772 -2.766 1.475 10.162 1.00 0.00 C ATOM 0 H THR A 772 -4.681 0.955 6.706 1.00 0.00 H new ATOM 0 HA THR A 772 -2.550 2.501 7.679 1.00 0.00 H new ATOM 0 HB THR A 772 -3.814 0.056 8.963 1.00 0.00 H new ATOM 0 HG1 THR A 772 -5.475 1.489 8.337 1.00 0.00 H new ATOM 0 HG21 THR A 772 -3.313 1.229 11.072 1.00 0.00 H new ATOM 0 HG22 THR A 772 -1.838 0.904 10.131 1.00 0.00 H new ATOM 0 HG23 THR A 772 -2.537 2.541 10.153 1.00 0.00 H new ATOM 294 N ALA A 773 -1.854 -0.620 6.910 1.00 0.00 N ATOM 295 CA ALA A 773 -0.766 -1.561 6.681 1.00 0.00 C ATOM 296 C ALA A 773 0.286 -0.962 5.753 1.00 0.00 C ATOM 297 O ALA A 773 1.484 -1.050 6.024 1.00 0.00 O ATOM 298 CB ALA A 773 -1.305 -2.863 6.109 1.00 0.00 C ATOM 0 H ALA A 773 -2.766 -0.945 6.589 1.00 0.00 H new ATOM 0 HA ALA A 773 -0.290 -1.772 7.638 1.00 0.00 H new ATOM 0 HB1 ALA A 773 -0.481 -3.556 5.943 1.00 0.00 H new ATOM 0 HB2 ALA A 773 -2.014 -3.303 6.811 1.00 0.00 H new ATOM 0 HB3 ALA A 773 -1.808 -2.664 5.163 1.00 0.00 H new ATOM 304 N VAL A 774 -0.166 -0.340 4.668 1.00 0.00 N ATOM 305 CA VAL A 774 0.740 0.314 3.727 1.00 0.00 C ATOM 306 C VAL A 774 1.473 1.466 4.405 1.00 0.00 C ATOM 307 O VAL A 774 2.685 1.621 4.253 1.00 0.00 O ATOM 308 CB VAL A 774 -0.010 0.850 2.488 1.00 0.00 C ATOM 309 CG1 VAL A 774 0.948 1.528 1.519 1.00 0.00 C ATOM 310 CG2 VAL A 774 -0.757 -0.272 1.794 1.00 0.00 C ATOM 0 H VAL A 774 -1.153 -0.275 4.418 1.00 0.00 H new ATOM 0 HA VAL A 774 1.457 -0.438 3.398 1.00 0.00 H new ATOM 0 HB VAL A 774 -0.731 1.594 2.827 1.00 0.00 H new ATOM 0 HG11 VAL A 774 0.393 1.896 0.656 1.00 0.00 H new ATOM 0 HG12 VAL A 774 1.439 2.364 2.018 1.00 0.00 H new ATOM 0 HG13 VAL A 774 1.699 0.811 1.188 1.00 0.00 H new ATOM 0 HG21 VAL A 774 -1.280 0.123 0.923 1.00 0.00 H new ATOM 0 HG22 VAL A 774 -0.050 -1.038 1.476 1.00 0.00 H new ATOM 0 HG23 VAL A 774 -1.479 -0.709 2.483 1.00 0.00 H new ATOM 320 N THR A 775 0.725 2.259 5.165 1.00 0.00 N ATOM 321 CA THR A 775 1.289 3.389 5.892 1.00 0.00 C ATOM 322 C THR A 775 2.402 2.937 6.843 1.00 0.00 C ATOM 323 O THR A 775 3.473 3.547 6.902 1.00 0.00 O ATOM 324 CB THR A 775 0.193 4.129 6.689 1.00 0.00 C ATOM 325 OG1 THR A 775 -0.926 4.408 5.836 1.00 0.00 O ATOM 326 CG2 THR A 775 0.727 5.430 7.275 1.00 0.00 C ATOM 0 H THR A 775 -0.280 2.138 5.293 1.00 0.00 H new ATOM 0 HA THR A 775 1.716 4.071 5.156 1.00 0.00 H new ATOM 0 HB THR A 775 -0.124 3.486 7.510 1.00 0.00 H new ATOM 0 HG1 THR A 775 -1.440 3.586 5.691 1.00 0.00 H new ATOM 0 HG21 THR A 775 -0.065 5.931 7.831 1.00 0.00 H new ATOM 0 HG22 THR A 775 1.559 5.213 7.945 1.00 0.00 H new ATOM 0 HG23 THR A 775 1.070 6.078 6.469 1.00 0.00 H new ATOM 334 N GLN A 776 2.157 1.849 7.563 1.00 0.00 N ATOM 335 CA GLN A 776 3.127 1.334 8.518 1.00 0.00 C ATOM 336 C GLN A 776 4.294 0.659 7.802 1.00 0.00 C ATOM 337 O GLN A 776 5.438 0.747 8.247 1.00 0.00 O ATOM 338 CB GLN A 776 2.460 0.354 9.482 1.00 0.00 C ATOM 339 CG GLN A 776 2.398 0.859 10.914 1.00 0.00 C ATOM 340 CD GLN A 776 2.001 2.320 11.001 1.00 0.00 C ATOM 341 OE1 GLN A 776 2.814 3.178 11.351 1.00 0.00 O ATOM 342 NE2 GLN A 776 0.752 2.610 10.675 1.00 0.00 N ATOM 0 H GLN A 776 1.295 1.307 7.503 1.00 0.00 H new ATOM 0 HA GLN A 776 3.518 2.176 9.089 1.00 0.00 H new ATOM 0 HB2 GLN A 776 1.448 0.147 9.134 1.00 0.00 H new ATOM 0 HB3 GLN A 776 3.004 -0.590 9.461 1.00 0.00 H new ATOM 0 HG2 GLN A 776 1.683 0.258 11.477 1.00 0.00 H new ATOM 0 HG3 GLN A 776 3.371 0.722 11.386 1.00 0.00 H new ATOM 0 HE21 GLN A 776 0.113 1.867 10.391 1.00 0.00 H new ATOM 0 HE22 GLN A 776 0.428 3.577 10.708 1.00 0.00 H new ATOM 351 N ALA A 777 4.004 -0.008 6.691 1.00 0.00 N ATOM 352 CA ALA A 777 5.046 -0.631 5.885 1.00 0.00 C ATOM 353 C ALA A 777 5.974 0.431 5.310 1.00 0.00 C ATOM 354 O ALA A 777 7.190 0.244 5.249 1.00 0.00 O ATOM 355 CB ALA A 777 4.435 -1.469 4.771 1.00 0.00 C ATOM 0 H ALA A 777 3.058 -0.131 6.329 1.00 0.00 H new ATOM 0 HA ALA A 777 5.630 -1.292 6.525 1.00 0.00 H new ATOM 0 HB1 ALA A 777 5.230 -1.925 4.181 1.00 0.00 H new ATOM 0 HB2 ALA A 777 3.810 -2.250 5.204 1.00 0.00 H new ATOM 0 HB3 ALA A 777 3.826 -0.832 4.129 1.00 0.00 H new ATOM 361 N LEU A 778 5.388 1.549 4.895 1.00 0.00 N ATOM 362 CA LEU A 778 6.155 2.687 4.410 1.00 0.00 C ATOM 363 C LEU A 778 7.062 3.215 5.512 1.00 0.00 C ATOM 364 O LEU A 778 8.242 3.480 5.285 1.00 0.00 O ATOM 365 CB LEU A 778 5.217 3.797 3.934 1.00 0.00 C ATOM 366 CG LEU A 778 5.751 4.646 2.783 1.00 0.00 C ATOM 367 CD1 LEU A 778 5.027 4.300 1.496 1.00 0.00 C ATOM 368 CD2 LEU A 778 5.613 6.129 3.100 1.00 0.00 C ATOM 0 H LEU A 778 4.378 1.690 4.886 1.00 0.00 H new ATOM 0 HA LEU A 778 6.768 2.359 3.570 1.00 0.00 H new ATOM 0 HB2 LEU A 778 4.273 3.347 3.626 1.00 0.00 H new ATOM 0 HB3 LEU A 778 4.997 4.452 4.777 1.00 0.00 H new ATOM 0 HG LEU A 778 6.811 4.427 2.652 1.00 0.00 H new ATOM 0 HD11 LEU A 778 5.417 4.912 0.683 1.00 0.00 H new ATOM 0 HD12 LEU A 778 5.182 3.246 1.263 1.00 0.00 H new ATOM 0 HD13 LEU A 778 3.961 4.492 1.615 1.00 0.00 H new ATOM 0 HD21 LEU A 778 5.999 6.717 2.267 1.00 0.00 H new ATOM 0 HD22 LEU A 778 4.562 6.371 3.258 1.00 0.00 H new ATOM 0 HD23 LEU A 778 6.179 6.362 4.002 1.00 0.00 H new ATOM 380 N ASN A 779 6.495 3.353 6.706 1.00 0.00 N ATOM 381 CA ASN A 779 7.250 3.780 7.878 1.00 0.00 C ATOM 382 C ASN A 779 8.424 2.841 8.116 1.00 0.00 C ATOM 383 O ASN A 779 9.557 3.279 8.312 1.00 0.00 O ATOM 384 CB ASN A 779 6.347 3.788 9.113 1.00 0.00 C ATOM 385 CG ASN A 779 5.823 5.168 9.460 1.00 0.00 C ATOM 386 OD1 ASN A 779 6.412 6.185 9.092 1.00 0.00 O ATOM 387 ND2 ASN A 779 4.707 5.213 10.175 1.00 0.00 N ATOM 0 H ASN A 779 5.507 3.174 6.888 1.00 0.00 H new ATOM 0 HA ASN A 779 7.625 4.788 7.700 1.00 0.00 H new ATOM 0 HB2 ASN A 779 5.504 3.118 8.943 1.00 0.00 H new ATOM 0 HB3 ASN A 779 6.902 3.392 9.964 1.00 0.00 H new ATOM 0 HD21 ASN A 779 4.307 6.113 10.439 1.00 0.00 H new ATOM 0 HD22 ASN A 779 4.249 4.347 10.460 1.00 0.00 H new ATOM 394 N GLU A 780 8.139 1.545 8.077 1.00 0.00 N ATOM 395 CA GLU A 780 9.149 0.518 8.291 1.00 0.00 C ATOM 396 C GLU A 780 10.276 0.634 7.272 1.00 0.00 C ATOM 397 O GLU A 780 11.441 0.787 7.637 1.00 0.00 O ATOM 398 CB GLU A 780 8.509 -0.870 8.191 1.00 0.00 C ATOM 399 CG GLU A 780 8.843 -1.794 9.356 1.00 0.00 C ATOM 400 CD GLU A 780 10.333 -1.924 9.608 1.00 0.00 C ATOM 401 OE1 GLU A 780 10.888 -1.102 10.370 1.00 0.00 O ATOM 402 OE2 GLU A 780 10.954 -2.858 9.062 1.00 0.00 O ATOM 0 H GLU A 780 7.204 1.178 7.897 1.00 0.00 H new ATOM 0 HA GLU A 780 9.569 0.659 9.287 1.00 0.00 H new ATOM 0 HB2 GLU A 780 7.427 -0.756 8.130 1.00 0.00 H new ATOM 0 HB3 GLU A 780 8.832 -1.341 7.263 1.00 0.00 H new ATOM 0 HG2 GLU A 780 8.360 -1.419 10.258 1.00 0.00 H new ATOM 0 HG3 GLU A 780 8.427 -2.782 9.158 1.00 0.00 H new ATOM 409 N LEU A 781 9.917 0.575 5.999 1.00 0.00 N ATOM 410 CA LEU A 781 10.901 0.565 4.925 1.00 0.00 C ATOM 411 C LEU A 781 11.739 1.838 4.912 1.00 0.00 C ATOM 412 O LEU A 781 12.957 1.776 4.768 1.00 0.00 O ATOM 413 CB LEU A 781 10.204 0.394 3.579 1.00 0.00 C ATOM 414 CG LEU A 781 11.143 0.247 2.387 1.00 0.00 C ATOM 415 CD1 LEU A 781 11.190 -1.201 1.925 1.00 0.00 C ATOM 416 CD2 LEU A 781 10.706 1.165 1.259 1.00 0.00 C ATOM 0 H LEU A 781 8.948 0.533 5.683 1.00 0.00 H new ATOM 0 HA LEU A 781 11.572 -0.276 5.102 1.00 0.00 H new ATOM 0 HB2 LEU A 781 9.561 -0.485 3.628 1.00 0.00 H new ATOM 0 HB3 LEU A 781 9.556 1.254 3.409 1.00 0.00 H new ATOM 0 HG LEU A 781 12.149 0.537 2.692 1.00 0.00 H new ATOM 0 HD11 LEU A 781 11.865 -1.289 1.073 1.00 0.00 H new ATOM 0 HD12 LEU A 781 11.549 -1.831 2.739 1.00 0.00 H new ATOM 0 HD13 LEU A 781 10.191 -1.522 1.631 1.00 0.00 H new ATOM 0 HD21 LEU A 781 11.384 1.051 0.414 1.00 0.00 H new ATOM 0 HD22 LEU A 781 9.694 0.905 0.950 1.00 0.00 H new ATOM 0 HD23 LEU A 781 10.726 2.199 1.603 1.00 0.00 H new ATOM 428 N LEU A 782 11.090 2.986 5.073 1.00 0.00 N ATOM 429 CA LEU A 782 11.783 4.267 5.006 1.00 0.00 C ATOM 430 C LEU A 782 12.863 4.365 6.078 1.00 0.00 C ATOM 431 O LEU A 782 13.980 4.805 5.801 1.00 0.00 O ATOM 432 CB LEU A 782 10.794 5.425 5.138 1.00 0.00 C ATOM 433 CG LEU A 782 10.236 5.946 3.811 1.00 0.00 C ATOM 434 CD1 LEU A 782 9.183 7.014 4.055 1.00 0.00 C ATOM 435 CD2 LEU A 782 11.359 6.487 2.936 1.00 0.00 C ATOM 0 H LEU A 782 10.088 3.056 5.250 1.00 0.00 H new ATOM 0 HA LEU A 782 12.266 4.333 4.031 1.00 0.00 H new ATOM 0 HB2 LEU A 782 9.962 5.104 5.765 1.00 0.00 H new ATOM 0 HB3 LEU A 782 11.286 6.247 5.657 1.00 0.00 H new ATOM 0 HG LEU A 782 9.763 5.115 3.287 1.00 0.00 H new ATOM 0 HD11 LEU A 782 8.799 7.371 3.100 1.00 0.00 H new ATOM 0 HD12 LEU A 782 8.366 6.592 4.640 1.00 0.00 H new ATOM 0 HD13 LEU A 782 9.628 7.846 4.601 1.00 0.00 H new ATOM 0 HD21 LEU A 782 10.944 6.853 1.997 1.00 0.00 H new ATOM 0 HD22 LEU A 782 11.862 7.304 3.453 1.00 0.00 H new ATOM 0 HD23 LEU A 782 12.076 5.692 2.731 1.00 0.00 H new ATOM 447 N GLN A 783 12.536 3.940 7.290 1.00 0.00 N ATOM 448 CA GLN A 783 13.505 3.932 8.379 1.00 0.00 C ATOM 449 C GLN A 783 14.567 2.871 8.124 1.00 0.00 C ATOM 450 O GLN A 783 15.762 3.114 8.291 1.00 0.00 O ATOM 451 CB GLN A 783 12.815 3.661 9.716 1.00 0.00 C ATOM 452 CG GLN A 783 11.681 4.620 10.026 1.00 0.00 C ATOM 453 CD GLN A 783 11.291 4.601 11.489 1.00 0.00 C ATOM 454 OE1 GLN A 783 11.643 5.500 12.250 1.00 0.00 O ATOM 455 NE2 GLN A 783 10.559 3.578 11.894 1.00 0.00 N ATOM 0 H GLN A 783 11.610 3.597 7.545 1.00 0.00 H new ATOM 0 HA GLN A 783 13.978 4.913 8.424 1.00 0.00 H new ATOM 0 HB2 GLN A 783 12.427 2.643 9.714 1.00 0.00 H new ATOM 0 HB3 GLN A 783 13.555 3.718 10.514 1.00 0.00 H new ATOM 0 HG2 GLN A 783 11.977 5.631 9.745 1.00 0.00 H new ATOM 0 HG3 GLN A 783 10.814 4.361 9.418 1.00 0.00 H new ATOM 0 HE21 GLN A 783 10.287 2.852 11.232 1.00 0.00 H new ATOM 0 HE22 GLN A 783 10.266 3.515 12.869 1.00 0.00 H new ATOM 464 N HIS A 784 14.114 1.701 7.694 1.00 0.00 N ATOM 465 CA HIS A 784 14.996 0.568 7.445 1.00 0.00 C ATOM 466 C HIS A 784 16.039 0.887 6.371 1.00 0.00 C ATOM 467 O HIS A 784 17.207 0.537 6.514 1.00 0.00 O ATOM 468 CB HIS A 784 14.169 -0.654 7.035 1.00 0.00 C ATOM 469 CG HIS A 784 14.990 -1.860 6.695 1.00 0.00 C ATOM 470 ND1 HIS A 784 15.852 -2.457 7.584 1.00 0.00 N ATOM 471 CD2 HIS A 784 15.080 -2.572 5.551 1.00 0.00 C ATOM 472 CE1 HIS A 784 16.441 -3.483 7.003 1.00 0.00 C ATOM 473 NE2 HIS A 784 15.992 -3.578 5.768 1.00 0.00 N ATOM 0 H HIS A 784 13.129 1.511 7.509 1.00 0.00 H new ATOM 0 HA HIS A 784 15.533 0.351 8.369 1.00 0.00 H new ATOM 0 HB2 HIS A 784 13.488 -0.908 7.847 1.00 0.00 H new ATOM 0 HB3 HIS A 784 13.554 -0.391 6.174 1.00 0.00 H new ATOM 0 HD1 HIS A 784 16.011 -2.153 8.545 1.00 0.00 H new ATOM 0 HD2 HIS A 784 14.537 -2.386 4.636 1.00 0.00 H new ATOM 0 HE1 HIS A 784 17.169 -4.136 7.462 1.00 0.00 H new ATOM 482 N VAL A 785 15.614 1.536 5.296 1.00 0.00 N ATOM 483 CA VAL A 785 16.519 1.866 4.200 1.00 0.00 C ATOM 484 C VAL A 785 17.479 2.984 4.603 1.00 0.00 C ATOM 485 O VAL A 785 18.700 2.828 4.509 1.00 0.00 O ATOM 486 CB VAL A 785 15.748 2.287 2.925 1.00 0.00 C ATOM 487 CG1 VAL A 785 16.702 2.813 1.857 1.00 0.00 C ATOM 488 CG2 VAL A 785 14.932 1.123 2.382 1.00 0.00 C ATOM 0 H VAL A 785 14.652 1.844 5.158 1.00 0.00 H new ATOM 0 HA VAL A 785 17.088 0.963 3.978 1.00 0.00 H new ATOM 0 HB VAL A 785 15.065 3.092 3.197 1.00 0.00 H new ATOM 0 HG11 VAL A 785 16.134 3.102 0.972 1.00 0.00 H new ATOM 0 HG12 VAL A 785 17.238 3.680 2.243 1.00 0.00 H new ATOM 0 HG13 VAL A 785 17.416 2.034 1.591 1.00 0.00 H new ATOM 0 HG21 VAL A 785 14.398 1.440 1.486 1.00 0.00 H new ATOM 0 HG22 VAL A 785 15.598 0.296 2.134 1.00 0.00 H new ATOM 0 HG23 VAL A 785 14.215 0.798 3.136 1.00 0.00 H new ATOM 498 N LYS A 786 16.920 4.088 5.089 1.00 0.00 N ATOM 499 CA LYS A 786 17.704 5.283 5.395 1.00 0.00 C ATOM 500 C LYS A 786 18.716 5.031 6.513 1.00 0.00 C ATOM 501 O LYS A 786 19.718 5.738 6.624 1.00 0.00 O ATOM 502 CB LYS A 786 16.777 6.439 5.783 1.00 0.00 C ATOM 503 CG LYS A 786 16.171 7.162 4.588 1.00 0.00 C ATOM 504 CD LYS A 786 15.369 8.382 5.017 1.00 0.00 C ATOM 505 CE LYS A 786 13.871 8.121 4.948 1.00 0.00 C ATOM 506 NZ LYS A 786 13.097 9.363 4.674 1.00 0.00 N ATOM 0 H LYS A 786 15.922 4.181 5.281 1.00 0.00 H new ATOM 0 HA LYS A 786 18.260 5.547 4.496 1.00 0.00 H new ATOM 0 HB2 LYS A 786 15.973 6.054 6.410 1.00 0.00 H new ATOM 0 HB3 LYS A 786 17.336 7.155 6.385 1.00 0.00 H new ATOM 0 HG2 LYS A 786 16.965 7.469 3.907 1.00 0.00 H new ATOM 0 HG3 LYS A 786 15.526 6.478 4.037 1.00 0.00 H new ATOM 0 HD2 LYS A 786 15.644 8.659 6.035 1.00 0.00 H new ATOM 0 HD3 LYS A 786 15.621 9.227 4.377 1.00 0.00 H new ATOM 0 HE2 LYS A 786 13.667 7.388 4.168 1.00 0.00 H new ATOM 0 HE3 LYS A 786 13.536 7.686 5.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 786 12.284 9.415 5.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 786 13.708 10.192 4.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 786 12.757 9.350 3.691 1.00 0.00 H new ATOM 520 N ALA A 787 18.461 4.025 7.336 1.00 0.00 N ATOM 521 CA ALA A 787 19.345 3.719 8.453 1.00 0.00 C ATOM 522 C ALA A 787 20.108 2.415 8.232 1.00 0.00 C ATOM 523 O ALA A 787 20.558 1.783 9.187 1.00 0.00 O ATOM 524 CB ALA A 787 18.550 3.653 9.747 1.00 0.00 C ATOM 0 H ALA A 787 17.653 3.408 7.253 1.00 0.00 H new ATOM 0 HA ALA A 787 20.080 4.521 8.523 1.00 0.00 H new ATOM 0 HB1 ALA A 787 19.221 3.424 10.575 1.00 0.00 H new ATOM 0 HB2 ALA A 787 18.067 4.613 9.927 1.00 0.00 H new ATOM 0 HB3 ALA A 787 17.791 2.874 9.669 1.00 0.00 H new ATOM 530 N HIS A 788 20.259 2.007 6.978 1.00 0.00 N ATOM 531 CA HIS A 788 20.998 0.781 6.677 1.00 0.00 C ATOM 532 C HIS A 788 21.768 0.896 5.369 1.00 0.00 C ATOM 533 O HIS A 788 22.952 0.568 5.312 1.00 0.00 O ATOM 534 CB HIS A 788 20.057 -0.422 6.611 1.00 0.00 C ATOM 535 CG HIS A 788 19.957 -1.183 7.898 1.00 0.00 C ATOM 536 ND1 HIS A 788 20.986 -1.940 8.413 1.00 0.00 N ATOM 537 CD2 HIS A 788 18.929 -1.307 8.769 1.00 0.00 C ATOM 538 CE1 HIS A 788 20.595 -2.497 9.542 1.00 0.00 C ATOM 539 NE2 HIS A 788 19.351 -2.129 9.783 1.00 0.00 N ATOM 0 H HIS A 788 19.888 2.496 6.163 1.00 0.00 H new ATOM 0 HA HIS A 788 21.713 0.634 7.487 1.00 0.00 H new ATOM 0 HB2 HIS A 788 19.063 -0.079 6.325 1.00 0.00 H new ATOM 0 HB3 HIS A 788 20.399 -1.097 5.826 1.00 0.00 H new ATOM 0 HD2 HIS A 788 17.957 -0.845 8.682 1.00 0.00 H new ATOM 0 HE1 HIS A 788 21.193 -3.146 10.165 1.00 0.00 H new ATOM 0 HE2 HIS A 788 18.795 -2.410 10.591 1.00 0.00 H new ATOM 548 N ALA A 789 21.093 1.354 4.321 1.00 0.00 N ATOM 549 CA ALA A 789 21.719 1.485 3.011 1.00 0.00 C ATOM 550 C ALA A 789 22.812 2.546 3.048 1.00 0.00 C ATOM 551 O ALA A 789 23.919 2.340 2.542 1.00 0.00 O ATOM 552 CB ALA A 789 20.677 1.827 1.957 1.00 0.00 C ATOM 0 H ALA A 789 20.114 1.640 4.353 1.00 0.00 H new ATOM 0 HA ALA A 789 22.175 0.531 2.747 1.00 0.00 H new ATOM 0 HB1 ALA A 789 21.160 1.921 0.985 1.00 0.00 H new ATOM 0 HB2 ALA A 789 19.929 1.036 1.915 1.00 0.00 H new ATOM 0 HB3 ALA A 789 20.194 2.770 2.215 1.00 0.00 H new ATOM 558 N THR A 790 22.489 3.677 3.660 1.00 0.00 N ATOM 559 CA THR A 790 23.441 4.760 3.833 1.00 0.00 C ATOM 560 C THR A 790 24.607 4.318 4.714 1.00 0.00 C ATOM 561 O THR A 790 24.408 3.850 5.837 1.00 0.00 O ATOM 562 CB THR A 790 22.752 5.984 4.457 1.00 0.00 C ATOM 563 OG1 THR A 790 21.327 5.797 4.431 1.00 0.00 O ATOM 564 CG2 THR A 790 23.115 7.253 3.702 1.00 0.00 C ATOM 0 H THR A 790 21.565 3.867 4.048 1.00 0.00 H new ATOM 0 HA THR A 790 23.828 5.032 2.851 1.00 0.00 H new ATOM 0 HB THR A 790 23.093 6.087 5.487 1.00 0.00 H new ATOM 0 HG1 THR A 790 20.978 5.813 5.347 1.00 0.00 H new ATOM 0 HG21 THR A 790 22.615 8.106 4.162 1.00 0.00 H new ATOM 0 HG22 THR A 790 24.194 7.402 3.738 1.00 0.00 H new ATOM 0 HG23 THR A 790 22.796 7.163 2.664 1.00 0.00 H new ATOM 572 N GLY A 791 25.816 4.453 4.192 1.00 0.00 N ATOM 573 CA GLY A 791 26.994 4.020 4.915 1.00 0.00 C ATOM 574 C GLY A 791 27.587 2.765 4.314 1.00 0.00 C ATOM 575 O GLY A 791 28.806 2.587 4.300 1.00 0.00 O ATOM 0 H GLY A 791 26.004 4.857 3.275 1.00 0.00 H new ATOM 0 HA2 GLY A 791 27.739 4.815 4.907 1.00 0.00 H new ATOM 0 HA3 GLY A 791 26.735 3.837 5.958 1.00 0.00 H new ATOM 579 N ALA A 792 26.725 1.899 3.804 1.00 0.00 N ATOM 580 CA ALA A 792 27.168 0.674 3.159 1.00 0.00 C ATOM 581 C ALA A 792 27.496 0.937 1.699 1.00 0.00 C ATOM 582 O ALA A 792 28.598 0.643 1.231 1.00 0.00 O ATOM 583 CB ALA A 792 26.103 -0.405 3.280 1.00 0.00 C ATOM 0 H ALA A 792 25.713 2.023 3.825 1.00 0.00 H new ATOM 0 HA ALA A 792 28.071 0.324 3.660 1.00 0.00 H new ATOM 0 HB1 ALA A 792 26.450 -1.316 2.792 1.00 0.00 H new ATOM 0 HB2 ALA A 792 25.910 -0.609 4.333 1.00 0.00 H new ATOM 0 HB3 ALA A 792 25.184 -0.065 2.802 1.00 0.00 H new ATOM 589 N GLY A 793 26.542 1.514 0.987 1.00 0.00 N ATOM 590 CA GLY A 793 26.745 1.821 -0.411 1.00 0.00 C ATOM 591 C GLY A 793 26.213 3.190 -0.770 1.00 0.00 C ATOM 592 O GLY A 793 26.094 4.054 0.102 1.00 0.00 O ATOM 0 H GLY A 793 25.627 1.776 1.354 1.00 0.00 H new ATOM 0 HA2 GLY A 793 27.809 1.773 -0.643 1.00 0.00 H new ATOM 0 HA3 GLY A 793 26.251 1.067 -1.024 1.00 0.00 H new ATOM 596 N PRO A 794 25.873 3.417 -2.049 1.00 0.00 N ATOM 597 CA PRO A 794 25.343 4.701 -2.518 1.00 0.00 C ATOM 598 C PRO A 794 23.963 4.999 -1.946 1.00 0.00 C ATOM 599 O PRO A 794 23.519 6.151 -1.942 1.00 0.00 O ATOM 600 CB PRO A 794 25.263 4.537 -4.043 1.00 0.00 C ATOM 601 CG PRO A 794 26.077 3.326 -4.356 1.00 0.00 C ATOM 602 CD PRO A 794 25.991 2.447 -3.144 1.00 0.00 C ATOM 0 HA PRO A 794 25.973 5.533 -2.204 1.00 0.00 H new ATOM 0 HB2 PRO A 794 24.231 4.412 -4.371 1.00 0.00 H new ATOM 0 HB3 PRO A 794 25.655 5.416 -4.554 1.00 0.00 H new ATOM 0 HG2 PRO A 794 25.692 2.814 -5.238 1.00 0.00 H new ATOM 0 HG3 PRO A 794 27.111 3.595 -4.570 1.00 0.00 H new ATOM 0 HD2 PRO A 794 25.130 1.780 -3.188 1.00 0.00 H new ATOM 0 HD3 PRO A 794 26.876 1.820 -3.035 1.00 0.00 H new ATOM 610 N ALA A 795 23.311 3.948 -1.456 1.00 0.00 N ATOM 611 CA ALA A 795 21.975 4.037 -0.871 1.00 0.00 C ATOM 612 C ALA A 795 20.939 4.458 -1.908 1.00 0.00 C ATOM 613 O ALA A 795 20.712 5.651 -2.129 1.00 0.00 O ATOM 614 CB ALA A 795 21.963 4.992 0.318 1.00 0.00 C ATOM 0 H ALA A 795 23.697 3.004 -1.453 1.00 0.00 H new ATOM 0 HA ALA A 795 21.706 3.042 -0.515 1.00 0.00 H new ATOM 0 HB1 ALA A 795 20.957 5.041 0.736 1.00 0.00 H new ATOM 0 HB2 ALA A 795 22.655 4.633 1.080 1.00 0.00 H new ATOM 0 HB3 ALA A 795 22.268 5.986 -0.010 1.00 0.00 H new ATOM 620 N GLY A 796 20.325 3.468 -2.551 1.00 0.00 N ATOM 621 CA GLY A 796 19.252 3.742 -3.485 1.00 0.00 C ATOM 622 C GLY A 796 18.120 4.488 -2.817 1.00 0.00 C ATOM 623 O GLY A 796 17.527 3.994 -1.859 1.00 0.00 O ATOM 0 H GLY A 796 20.554 2.480 -2.440 1.00 0.00 H new ATOM 0 HA2 GLY A 796 19.635 4.329 -4.320 1.00 0.00 H new ATOM 0 HA3 GLY A 796 18.879 2.805 -3.899 1.00 0.00 H new ATOM 627 N ARG A 797 17.828 5.681 -3.302 1.00 0.00 N ATOM 628 CA ARG A 797 16.835 6.525 -2.662 1.00 0.00 C ATOM 629 C ARG A 797 15.512 6.484 -3.411 1.00 0.00 C ATOM 630 O ARG A 797 15.439 6.818 -4.592 1.00 0.00 O ATOM 631 CB ARG A 797 17.340 7.966 -2.564 1.00 0.00 C ATOM 632 CG ARG A 797 16.874 8.694 -1.314 1.00 0.00 C ATOM 633 CD ARG A 797 17.603 10.017 -1.145 1.00 0.00 C ATOM 634 NE ARG A 797 17.396 10.599 0.182 1.00 0.00 N ATOM 635 CZ ARG A 797 18.311 10.589 1.154 1.00 0.00 C ATOM 636 NH1 ARG A 797 19.482 9.990 0.963 1.00 0.00 N ATOM 637 NH2 ARG A 797 18.048 11.168 2.322 1.00 0.00 N ATOM 0 H ARG A 797 18.261 6.086 -4.132 1.00 0.00 H new ATOM 0 HA ARG A 797 16.668 6.139 -1.656 1.00 0.00 H new ATOM 0 HB2 ARG A 797 18.430 7.962 -2.586 1.00 0.00 H new ATOM 0 HB3 ARG A 797 17.006 8.519 -3.442 1.00 0.00 H new ATOM 0 HG2 ARG A 797 15.800 8.872 -1.373 1.00 0.00 H new ATOM 0 HG3 ARG A 797 17.046 8.067 -0.439 1.00 0.00 H new ATOM 0 HD2 ARG A 797 18.670 9.865 -1.311 1.00 0.00 H new ATOM 0 HD3 ARG A 797 17.259 10.719 -1.905 1.00 0.00 H new ATOM 0 HE ARG A 797 16.497 11.040 0.376 1.00 0.00 H new ATOM 0 HH11 ARG A 797 19.683 9.536 0.072 1.00 0.00 H new ATOM 0 HH12 ARG A 797 20.179 9.984 1.707 1.00 0.00 H new ATOM 0 HH21 ARG A 797 17.147 11.620 2.476 1.00 0.00 H new ATOM 0 HH22 ARG A 797 18.748 11.160 3.064 1.00 0.00 H new ATOM 651 N TYR A 798 14.473 6.064 -2.708 1.00 0.00 N ATOM 652 CA TYR A 798 13.126 6.018 -3.259 1.00 0.00 C ATOM 653 C TYR A 798 12.205 6.865 -2.394 1.00 0.00 C ATOM 654 O TYR A 798 11.007 6.607 -2.297 1.00 0.00 O ATOM 655 CB TYR A 798 12.616 4.571 -3.318 1.00 0.00 C ATOM 656 CG TYR A 798 13.684 3.536 -3.045 1.00 0.00 C ATOM 657 CD1 TYR A 798 13.968 3.129 -1.747 1.00 0.00 C ATOM 658 CD2 TYR A 798 14.416 2.976 -4.082 1.00 0.00 C ATOM 659 CE1 TYR A 798 14.950 2.193 -1.494 1.00 0.00 C ATOM 660 CE2 TYR A 798 15.398 2.036 -3.836 1.00 0.00 C ATOM 661 CZ TYR A 798 15.662 1.650 -2.542 1.00 0.00 C ATOM 662 OH TYR A 798 16.642 0.718 -2.293 1.00 0.00 O ATOM 0 H TYR A 798 14.538 5.746 -1.741 1.00 0.00 H new ATOM 0 HA TYR A 798 13.140 6.414 -4.275 1.00 0.00 H new ATOM 0 HB2 TYR A 798 11.811 4.449 -2.593 1.00 0.00 H new ATOM 0 HB3 TYR A 798 12.188 4.386 -4.303 1.00 0.00 H new ATOM 0 HD1 TYR A 798 13.412 3.552 -0.924 1.00 0.00 H new ATOM 0 HD2 TYR A 798 14.215 3.280 -5.099 1.00 0.00 H new ATOM 0 HE1 TYR A 798 15.160 1.887 -0.480 1.00 0.00 H new ATOM 0 HE2 TYR A 798 15.956 1.606 -4.655 1.00 0.00 H new ATOM 0 HH TYR A 798 17.047 0.435 -3.139 1.00 0.00 H new ATOM 672 N ASP A 799 12.795 7.886 -1.778 1.00 0.00 N ATOM 673 CA ASP A 799 12.099 8.743 -0.819 1.00 0.00 C ATOM 674 C ASP A 799 10.864 9.385 -1.444 1.00 0.00 C ATOM 675 O ASP A 799 9.799 9.445 -0.824 1.00 0.00 O ATOM 676 CB ASP A 799 13.051 9.829 -0.314 1.00 0.00 C ATOM 677 CG ASP A 799 12.669 10.362 1.051 1.00 0.00 C ATOM 678 OD1 ASP A 799 12.931 9.678 2.061 1.00 0.00 O ATOM 679 OD2 ASP A 799 12.125 11.484 1.123 1.00 0.00 O ATOM 0 H ASP A 799 13.770 8.144 -1.929 1.00 0.00 H new ATOM 0 HA ASP A 799 11.771 8.124 0.016 1.00 0.00 H new ATOM 0 HB2 ASP A 799 14.063 9.426 -0.271 1.00 0.00 H new ATOM 0 HB3 ASP A 799 13.066 10.652 -1.028 1.00 0.00 H new ATOM 684 N GLN A 800 11.013 9.845 -2.679 1.00 0.00 N ATOM 685 CA GLN A 800 9.913 10.457 -3.410 1.00 0.00 C ATOM 686 C GLN A 800 8.804 9.440 -3.659 1.00 0.00 C ATOM 687 O GLN A 800 7.628 9.733 -3.458 1.00 0.00 O ATOM 688 CB GLN A 800 10.407 11.019 -4.745 1.00 0.00 C ATOM 689 CG GLN A 800 10.389 12.536 -4.817 1.00 0.00 C ATOM 690 CD GLN A 800 8.985 13.106 -4.895 1.00 0.00 C ATOM 691 OE1 GLN A 800 8.721 14.200 -4.395 1.00 0.00 O ATOM 692 NE2 GLN A 800 8.076 12.378 -5.525 1.00 0.00 N ATOM 0 H GLN A 800 11.890 9.805 -3.198 1.00 0.00 H new ATOM 0 HA GLN A 800 9.515 11.272 -2.806 1.00 0.00 H new ATOM 0 HB2 GLN A 800 11.424 10.668 -4.922 1.00 0.00 H new ATOM 0 HB3 GLN A 800 9.788 10.619 -5.548 1.00 0.00 H new ATOM 0 HG2 GLN A 800 10.893 12.942 -3.940 1.00 0.00 H new ATOM 0 HG3 GLN A 800 10.956 12.860 -5.689 1.00 0.00 H new ATOM 0 HE21 GLN A 800 8.333 11.476 -5.926 1.00 0.00 H new ATOM 0 HE22 GLN A 800 7.118 12.719 -5.609 1.00 0.00 H new ATOM 701 N ALA A 801 9.192 8.243 -4.088 1.00 0.00 N ATOM 702 CA ALA A 801 8.236 7.182 -4.380 1.00 0.00 C ATOM 703 C ALA A 801 7.402 6.844 -3.150 1.00 0.00 C ATOM 704 O ALA A 801 6.179 6.714 -3.236 1.00 0.00 O ATOM 705 CB ALA A 801 8.956 5.941 -4.889 1.00 0.00 C ATOM 0 H ALA A 801 10.166 7.984 -4.241 1.00 0.00 H new ATOM 0 HA ALA A 801 7.563 7.540 -5.159 1.00 0.00 H new ATOM 0 HB1 ALA A 801 8.227 5.159 -5.102 1.00 0.00 H new ATOM 0 HB2 ALA A 801 9.503 6.185 -5.800 1.00 0.00 H new ATOM 0 HB3 ALA A 801 9.655 5.589 -4.130 1.00 0.00 H new ATOM 711 N THR A 802 8.062 6.715 -2.005 1.00 0.00 N ATOM 712 CA THR A 802 7.371 6.422 -0.759 1.00 0.00 C ATOM 713 C THR A 802 6.417 7.558 -0.394 1.00 0.00 C ATOM 714 O THR A 802 5.313 7.324 0.103 1.00 0.00 O ATOM 715 CB THR A 802 8.370 6.190 0.389 1.00 0.00 C ATOM 716 OG1 THR A 802 9.611 6.840 0.097 1.00 0.00 O ATOM 717 CG2 THR A 802 8.620 4.703 0.599 1.00 0.00 C ATOM 0 H THR A 802 9.074 6.809 -1.915 1.00 0.00 H new ATOM 0 HA THR A 802 6.796 5.508 -0.906 1.00 0.00 H new ATOM 0 HB THR A 802 7.941 6.607 1.300 1.00 0.00 H new ATOM 0 HG1 THR A 802 9.441 7.772 -0.154 1.00 0.00 H new ATOM 0 HG21 THR A 802 9.329 4.565 1.415 1.00 0.00 H new ATOM 0 HG22 THR A 802 7.681 4.208 0.846 1.00 0.00 H new ATOM 0 HG23 THR A 802 9.029 4.270 -0.314 1.00 0.00 H new ATOM 725 N ASP A 803 6.841 8.789 -0.670 1.00 0.00 N ATOM 726 CA ASP A 803 6.014 9.961 -0.408 1.00 0.00 C ATOM 727 C ASP A 803 4.744 9.920 -1.248 1.00 0.00 C ATOM 728 O ASP A 803 3.646 10.165 -0.744 1.00 0.00 O ATOM 729 CB ASP A 803 6.781 11.248 -0.712 1.00 0.00 C ATOM 730 CG ASP A 803 5.924 12.483 -0.518 1.00 0.00 C ATOM 731 OD1 ASP A 803 5.545 12.775 0.636 1.00 0.00 O ATOM 732 OD2 ASP A 803 5.623 13.167 -1.519 1.00 0.00 O ATOM 0 H ASP A 803 7.753 8.999 -1.075 1.00 0.00 H new ATOM 0 HA ASP A 803 5.747 9.948 0.649 1.00 0.00 H new ATOM 0 HB2 ASP A 803 7.656 11.309 -0.065 1.00 0.00 H new ATOM 0 HB3 ASP A 803 7.146 11.218 -1.739 1.00 0.00 H new ATOM 737 N THR A 804 4.903 9.589 -2.525 1.00 0.00 N ATOM 738 CA THR A 804 3.774 9.483 -3.438 1.00 0.00 C ATOM 739 C THR A 804 2.785 8.424 -2.955 1.00 0.00 C ATOM 740 O THR A 804 1.572 8.646 -2.962 1.00 0.00 O ATOM 741 CB THR A 804 4.259 9.122 -4.859 1.00 0.00 C ATOM 742 OG1 THR A 804 5.419 9.897 -5.187 1.00 0.00 O ATOM 743 CG2 THR A 804 3.168 9.373 -5.888 1.00 0.00 C ATOM 0 H THR A 804 5.808 9.389 -2.951 1.00 0.00 H new ATOM 0 HA THR A 804 3.273 10.451 -3.464 1.00 0.00 H new ATOM 0 HB THR A 804 4.510 8.061 -4.875 1.00 0.00 H new ATOM 0 HG1 THR A 804 6.163 9.635 -4.605 1.00 0.00 H new ATOM 0 HG21 THR A 804 3.536 9.111 -6.880 1.00 0.00 H new ATOM 0 HG22 THR A 804 2.297 8.762 -5.651 1.00 0.00 H new ATOM 0 HG23 THR A 804 2.888 10.426 -5.872 1.00 0.00 H new ATOM 751 N ILE A 805 3.311 7.289 -2.507 1.00 0.00 N ATOM 752 CA ILE A 805 2.482 6.206 -1.993 1.00 0.00 C ATOM 753 C ILE A 805 1.684 6.656 -0.775 1.00 0.00 C ATOM 754 O ILE A 805 0.457 6.580 -0.776 1.00 0.00 O ATOM 755 CB ILE A 805 3.330 4.978 -1.615 1.00 0.00 C ATOM 756 CG1 ILE A 805 3.953 4.361 -2.861 1.00 0.00 C ATOM 757 CG2 ILE A 805 2.492 3.944 -0.878 1.00 0.00 C ATOM 758 CD1 ILE A 805 5.186 3.548 -2.561 1.00 0.00 C ATOM 0 H ILE A 805 4.312 7.095 -2.490 1.00 0.00 H new ATOM 0 HA ILE A 805 1.794 5.928 -2.792 1.00 0.00 H new ATOM 0 HB ILE A 805 4.127 5.308 -0.949 1.00 0.00 H new ATOM 0 HG12 ILE A 805 3.216 3.726 -3.353 1.00 0.00 H new ATOM 0 HG13 ILE A 805 4.209 5.154 -3.563 1.00 0.00 H new ATOM 0 HG21 ILE A 805 3.114 3.087 -0.622 1.00 0.00 H new ATOM 0 HG22 ILE A 805 2.089 4.385 0.034 1.00 0.00 H new ATOM 0 HG23 ILE A 805 1.671 3.619 -1.517 1.00 0.00 H new ATOM 0 HD11 ILE A 805 5.584 3.135 -3.488 1.00 0.00 H new ATOM 0 HD12 ILE A 805 5.938 4.186 -2.096 1.00 0.00 H new ATOM 0 HD13 ILE A 805 4.929 2.735 -1.882 1.00 0.00 H new ATOM 770 N LEU A 806 2.389 7.127 0.255 1.00 0.00 N ATOM 771 CA LEU A 806 1.744 7.582 1.491 1.00 0.00 C ATOM 772 C LEU A 806 0.693 8.653 1.198 1.00 0.00 C ATOM 773 O LEU A 806 -0.387 8.646 1.785 1.00 0.00 O ATOM 774 CB LEU A 806 2.787 8.121 2.480 1.00 0.00 C ATOM 775 CG LEU A 806 2.615 7.673 3.941 1.00 0.00 C ATOM 776 CD1 LEU A 806 3.577 8.429 4.844 1.00 0.00 C ATOM 777 CD2 LEU A 806 1.184 7.877 4.415 1.00 0.00 C ATOM 0 H LEU A 806 3.406 7.204 0.259 1.00 0.00 H new ATOM 0 HA LEU A 806 1.245 6.725 1.942 1.00 0.00 H new ATOM 0 HB2 LEU A 806 3.776 7.815 2.139 1.00 0.00 H new ATOM 0 HB3 LEU A 806 2.762 9.210 2.448 1.00 0.00 H new ATOM 0 HG LEU A 806 2.842 6.608 3.993 1.00 0.00 H new ATOM 0 HD11 LEU A 806 3.443 8.101 5.875 1.00 0.00 H new ATOM 0 HD12 LEU A 806 4.602 8.231 4.531 1.00 0.00 H new ATOM 0 HD13 LEU A 806 3.377 9.498 4.775 1.00 0.00 H new ATOM 0 HD21 LEU A 806 1.094 7.551 5.451 1.00 0.00 H new ATOM 0 HD22 LEU A 806 0.924 8.933 4.343 1.00 0.00 H new ATOM 0 HD23 LEU A 806 0.507 7.293 3.791 1.00 0.00 H new ATOM 789 N THR A 807 1.006 9.562 0.282 1.00 0.00 N ATOM 790 CA THR A 807 0.052 10.584 -0.126 1.00 0.00 C ATOM 791 C THR A 807 -1.212 9.940 -0.691 1.00 0.00 C ATOM 792 O THR A 807 -2.324 10.367 -0.393 1.00 0.00 O ATOM 793 CB THR A 807 0.663 11.534 -1.175 1.00 0.00 C ATOM 794 OG1 THR A 807 1.831 12.165 -0.631 1.00 0.00 O ATOM 795 CG2 THR A 807 -0.337 12.597 -1.605 1.00 0.00 C ATOM 0 H THR A 807 1.909 9.612 -0.190 1.00 0.00 H new ATOM 0 HA THR A 807 -0.205 11.167 0.759 1.00 0.00 H new ATOM 0 HB THR A 807 0.933 10.945 -2.051 1.00 0.00 H new ATOM 0 HG1 THR A 807 2.609 11.584 -0.764 1.00 0.00 H new ATOM 0 HG21 THR A 807 0.123 13.252 -2.345 1.00 0.00 H new ATOM 0 HG22 THR A 807 -1.214 12.117 -2.040 1.00 0.00 H new ATOM 0 HG23 THR A 807 -0.638 13.185 -0.738 1.00 0.00 H new ATOM 803 N VAL A 808 -1.027 8.894 -1.484 1.00 0.00 N ATOM 804 CA VAL A 808 -2.142 8.156 -2.057 1.00 0.00 C ATOM 805 C VAL A 808 -2.987 7.509 -0.956 1.00 0.00 C ATOM 806 O VAL A 808 -4.215 7.612 -0.964 1.00 0.00 O ATOM 807 CB VAL A 808 -1.637 7.074 -3.041 1.00 0.00 C ATOM 808 CG1 VAL A 808 -2.616 5.916 -3.147 1.00 0.00 C ATOM 809 CG2 VAL A 808 -1.378 7.683 -4.410 1.00 0.00 C ATOM 0 H VAL A 808 -0.108 8.536 -1.746 1.00 0.00 H new ATOM 0 HA VAL A 808 -2.764 8.863 -2.606 1.00 0.00 H new ATOM 0 HB VAL A 808 -0.700 6.678 -2.650 1.00 0.00 H new ATOM 0 HG11 VAL A 808 -2.229 5.175 -3.847 1.00 0.00 H new ATOM 0 HG12 VAL A 808 -2.744 5.457 -2.167 1.00 0.00 H new ATOM 0 HG13 VAL A 808 -3.578 6.284 -3.504 1.00 0.00 H new ATOM 0 HG21 VAL A 808 -1.023 6.909 -5.091 1.00 0.00 H new ATOM 0 HG22 VAL A 808 -2.302 8.112 -4.798 1.00 0.00 H new ATOM 0 HG23 VAL A 808 -0.623 8.464 -4.324 1.00 0.00 H new ATOM 819 N THR A 809 -2.324 6.863 0.001 1.00 0.00 N ATOM 820 CA THR A 809 -3.017 6.212 1.105 1.00 0.00 C ATOM 821 C THR A 809 -3.769 7.239 1.946 1.00 0.00 C ATOM 822 O THR A 809 -4.924 7.028 2.329 1.00 0.00 O ATOM 823 CB THR A 809 -2.029 5.438 1.998 1.00 0.00 C ATOM 824 OG1 THR A 809 -0.747 5.374 1.361 1.00 0.00 O ATOM 825 CG2 THR A 809 -2.533 4.031 2.270 1.00 0.00 C ATOM 0 H THR A 809 -1.308 6.778 0.032 1.00 0.00 H new ATOM 0 HA THR A 809 -3.730 5.507 0.679 1.00 0.00 H new ATOM 0 HB THR A 809 -1.941 5.965 2.948 1.00 0.00 H new ATOM 0 HG1 THR A 809 -0.122 4.882 1.933 1.00 0.00 H new ATOM 0 HG21 THR A 809 -1.818 3.504 2.902 1.00 0.00 H new ATOM 0 HG22 THR A 809 -3.497 4.081 2.776 1.00 0.00 H new ATOM 0 HG23 THR A 809 -2.646 3.496 1.327 1.00 0.00 H new ATOM 833 N GLU A 810 -3.111 8.359 2.205 1.00 0.00 N ATOM 834 CA GLU A 810 -3.718 9.462 2.931 1.00 0.00 C ATOM 835 C GLU A 810 -4.907 10.022 2.150 1.00 0.00 C ATOM 836 O GLU A 810 -5.929 10.392 2.732 1.00 0.00 O ATOM 837 CB GLU A 810 -2.675 10.552 3.177 1.00 0.00 C ATOM 838 CG GLU A 810 -2.621 11.028 4.616 1.00 0.00 C ATOM 839 CD GLU A 810 -2.979 12.491 4.750 1.00 0.00 C ATOM 840 OE1 GLU A 810 -2.209 13.342 4.256 1.00 0.00 O ATOM 841 OE2 GLU A 810 -4.035 12.795 5.349 1.00 0.00 O ATOM 0 H GLU A 810 -2.146 8.528 1.919 1.00 0.00 H new ATOM 0 HA GLU A 810 -4.083 9.099 3.892 1.00 0.00 H new ATOM 0 HB2 GLU A 810 -1.693 10.175 2.891 1.00 0.00 H new ATOM 0 HB3 GLU A 810 -2.891 11.402 2.530 1.00 0.00 H new ATOM 0 HG2 GLU A 810 -3.306 10.432 5.220 1.00 0.00 H new ATOM 0 HG3 GLU A 810 -1.620 10.863 5.014 1.00 0.00 H new ATOM 848 N ASN A 811 -4.766 10.063 0.829 1.00 0.00 N ATOM 849 CA ASN A 811 -5.841 10.509 -0.053 1.00 0.00 C ATOM 850 C ASN A 811 -7.052 9.600 0.086 1.00 0.00 C ATOM 851 O ASN A 811 -8.178 10.074 0.227 1.00 0.00 O ATOM 852 CB ASN A 811 -5.380 10.507 -1.512 1.00 0.00 C ATOM 853 CG ASN A 811 -4.719 11.804 -1.930 1.00 0.00 C ATOM 854 OD1 ASN A 811 -4.910 12.847 -1.306 1.00 0.00 O ATOM 855 ND2 ASN A 811 -3.940 11.744 -2.996 1.00 0.00 N ATOM 0 H ASN A 811 -3.912 9.791 0.342 1.00 0.00 H new ATOM 0 HA ASN A 811 -6.112 11.524 0.237 1.00 0.00 H new ATOM 0 HB2 ASN A 811 -4.681 9.685 -1.664 1.00 0.00 H new ATOM 0 HB3 ASN A 811 -6.238 10.319 -2.157 1.00 0.00 H new ATOM 0 HD21 ASN A 811 -3.469 12.584 -3.331 1.00 0.00 H new ATOM 0 HD22 ASN A 811 -3.810 10.857 -3.483 1.00 0.00 H new ATOM 862 N ILE A 812 -6.809 8.293 0.046 1.00 0.00 N ATOM 863 CA ILE A 812 -7.871 7.305 0.207 1.00 0.00 C ATOM 864 C ILE A 812 -8.566 7.484 1.554 1.00 0.00 C ATOM 865 O ILE A 812 -9.792 7.445 1.637 1.00 0.00 O ATOM 866 CB ILE A 812 -7.324 5.860 0.082 1.00 0.00 C ATOM 867 CG1 ILE A 812 -7.020 5.536 -1.380 1.00 0.00 C ATOM 868 CG2 ILE A 812 -8.308 4.844 0.649 1.00 0.00 C ATOM 869 CD1 ILE A 812 -5.723 4.786 -1.579 1.00 0.00 C ATOM 0 H ILE A 812 -5.882 7.892 -0.097 1.00 0.00 H new ATOM 0 HA ILE A 812 -8.594 7.465 -0.593 1.00 0.00 H new ATOM 0 HB ILE A 812 -6.403 5.799 0.662 1.00 0.00 H new ATOM 0 HG12 ILE A 812 -7.838 4.944 -1.789 1.00 0.00 H new ATOM 0 HG13 ILE A 812 -6.983 6.465 -1.949 1.00 0.00 H new ATOM 0 HG21 ILE A 812 -7.895 3.841 0.546 1.00 0.00 H new ATOM 0 HG22 ILE A 812 -8.484 5.057 1.703 1.00 0.00 H new ATOM 0 HG23 ILE A 812 -9.250 4.906 0.104 1.00 0.00 H new ATOM 0 HD11 ILE A 812 -5.575 4.591 -2.641 1.00 0.00 H new ATOM 0 HD12 ILE A 812 -4.895 5.385 -1.201 1.00 0.00 H new ATOM 0 HD13 ILE A 812 -5.763 3.840 -1.039 1.00 0.00 H new ATOM 881 N PHE A 813 -7.777 7.710 2.599 1.00 0.00 N ATOM 882 CA PHE A 813 -8.314 7.936 3.937 1.00 0.00 C ATOM 883 C PHE A 813 -9.249 9.143 3.954 1.00 0.00 C ATOM 884 O PHE A 813 -10.288 9.133 4.614 1.00 0.00 O ATOM 885 CB PHE A 813 -7.177 8.151 4.937 1.00 0.00 C ATOM 886 CG PHE A 813 -6.690 6.886 5.583 1.00 0.00 C ATOM 887 CD1 PHE A 813 -7.588 5.939 6.049 1.00 0.00 C ATOM 888 CD2 PHE A 813 -5.333 6.645 5.725 1.00 0.00 C ATOM 889 CE1 PHE A 813 -7.141 4.776 6.644 1.00 0.00 C ATOM 890 CE2 PHE A 813 -4.881 5.484 6.320 1.00 0.00 C ATOM 891 CZ PHE A 813 -5.787 4.549 6.780 1.00 0.00 C ATOM 0 H PHE A 813 -6.759 7.742 2.545 1.00 0.00 H new ATOM 0 HA PHE A 813 -8.883 7.051 4.224 1.00 0.00 H new ATOM 0 HB2 PHE A 813 -6.343 8.631 4.426 1.00 0.00 H new ATOM 0 HB3 PHE A 813 -7.514 8.838 5.713 1.00 0.00 H new ATOM 0 HD1 PHE A 813 -8.649 6.113 5.946 1.00 0.00 H new ATOM 0 HD2 PHE A 813 -4.621 7.373 5.366 1.00 0.00 H new ATOM 0 HE1 PHE A 813 -7.850 4.045 7.003 1.00 0.00 H new ATOM 0 HE2 PHE A 813 -3.821 5.307 6.425 1.00 0.00 H new ATOM 0 HZ PHE A 813 -5.436 3.640 7.246 1.00 0.00 H new ATOM 901 N SER A 814 -8.876 10.178 3.213 1.00 0.00 N ATOM 902 CA SER A 814 -9.662 11.401 3.143 1.00 0.00 C ATOM 903 C SER A 814 -10.763 11.305 2.083 1.00 0.00 C ATOM 904 O SER A 814 -11.523 12.253 1.876 1.00 0.00 O ATOM 905 CB SER A 814 -8.739 12.585 2.854 1.00 0.00 C ATOM 906 OG SER A 814 -7.805 12.761 3.907 1.00 0.00 O ATOM 0 H SER A 814 -8.027 10.193 2.648 1.00 0.00 H new ATOM 0 HA SER A 814 -10.152 11.549 4.105 1.00 0.00 H new ATOM 0 HB2 SER A 814 -8.210 12.419 1.916 1.00 0.00 H new ATOM 0 HB3 SER A 814 -9.331 13.492 2.730 1.00 0.00 H new ATOM 0 HG SER A 814 -7.069 12.123 3.801 1.00 0.00 H new ATOM 912 N SER A 815 -10.851 10.157 1.422 1.00 0.00 N ATOM 913 CA SER A 815 -11.868 9.934 0.403 1.00 0.00 C ATOM 914 C SER A 815 -12.615 8.631 0.662 1.00 0.00 C ATOM 915 O SER A 815 -13.169 8.032 -0.258 1.00 0.00 O ATOM 916 CB SER A 815 -11.228 9.908 -0.987 1.00 0.00 C ATOM 917 OG SER A 815 -10.289 10.963 -1.132 1.00 0.00 O ATOM 0 H SER A 815 -10.228 9.364 1.575 1.00 0.00 H new ATOM 0 HA SER A 815 -12.583 10.755 0.447 1.00 0.00 H new ATOM 0 HB2 SER A 815 -10.732 8.950 -1.146 1.00 0.00 H new ATOM 0 HB3 SER A 815 -12.002 9.997 -1.750 1.00 0.00 H new ATOM 0 HG SER A 815 -9.462 10.733 -0.659 1.00 0.00 H new ATOM 923 N MET A 816 -12.621 8.204 1.921 1.00 0.00 N ATOM 924 CA MET A 816 -13.280 6.962 2.318 1.00 0.00 C ATOM 925 C MET A 816 -14.774 7.042 2.046 1.00 0.00 C ATOM 926 O MET A 816 -15.517 7.717 2.760 1.00 0.00 O ATOM 927 CB MET A 816 -13.032 6.680 3.799 1.00 0.00 C ATOM 928 CG MET A 816 -11.739 5.939 4.064 1.00 0.00 C ATOM 929 SD MET A 816 -11.982 4.168 4.288 1.00 0.00 S ATOM 930 CE MET A 816 -10.404 3.709 4.994 1.00 0.00 C ATOM 0 H MET A 816 -12.174 8.703 2.690 1.00 0.00 H new ATOM 0 HA MET A 816 -12.861 6.146 1.729 1.00 0.00 H new ATOM 0 HB2 MET A 816 -13.019 7.624 4.343 1.00 0.00 H new ATOM 0 HB3 MET A 816 -13.864 6.096 4.194 1.00 0.00 H new ATOM 0 HG2 MET A 816 -11.054 6.105 3.233 1.00 0.00 H new ATOM 0 HG3 MET A 816 -11.265 6.352 4.955 1.00 0.00 H new ATOM 0 HE1 MET A 816 -10.554 2.937 5.748 1.00 0.00 H new ATOM 0 HE2 MET A 816 -9.751 3.327 4.209 1.00 0.00 H new ATOM 0 HE3 MET A 816 -9.944 4.583 5.456 1.00 0.00 H new ATOM 940 N GLY A 817 -15.201 6.358 1.001 1.00 0.00 N ATOM 941 CA GLY A 817 -16.585 6.405 0.590 1.00 0.00 C ATOM 942 C GLY A 817 -16.696 6.693 -0.887 1.00 0.00 C ATOM 943 O GLY A 817 -17.563 6.152 -1.573 1.00 0.00 O ATOM 0 H GLY A 817 -14.606 5.764 0.423 1.00 0.00 H new ATOM 0 HA2 GLY A 817 -17.069 5.455 0.817 1.00 0.00 H new ATOM 0 HA3 GLY A 817 -17.111 7.174 1.156 1.00 0.00 H new ATOM 947 N ASP A 818 -15.795 7.531 -1.381 1.00 0.00 N ATOM 948 CA ASP A 818 -15.740 7.843 -2.802 1.00 0.00 C ATOM 949 C ASP A 818 -14.938 6.773 -3.521 1.00 0.00 C ATOM 950 O ASP A 818 -13.730 6.916 -3.730 1.00 0.00 O ATOM 951 CB ASP A 818 -15.118 9.222 -3.041 1.00 0.00 C ATOM 952 CG ASP A 818 -15.326 9.718 -4.463 1.00 0.00 C ATOM 953 OD1 ASP A 818 -16.003 9.026 -5.256 1.00 0.00 O ATOM 954 OD2 ASP A 818 -14.815 10.810 -4.793 1.00 0.00 O ATOM 0 H ASP A 818 -15.091 8.008 -0.817 1.00 0.00 H new ATOM 0 HA ASP A 818 -16.757 7.864 -3.195 1.00 0.00 H new ATOM 0 HB2 ASP A 818 -15.552 9.938 -2.343 1.00 0.00 H new ATOM 0 HB3 ASP A 818 -14.050 9.177 -2.828 1.00 0.00 H new ATOM 959 N ALA A 819 -15.625 5.698 -3.879 1.00 0.00 N ATOM 960 CA ALA A 819 -15.005 4.541 -4.512 1.00 0.00 C ATOM 961 C ALA A 819 -14.174 4.935 -5.728 1.00 0.00 C ATOM 962 O ALA A 819 -13.069 4.431 -5.923 1.00 0.00 O ATOM 963 CB ALA A 819 -16.078 3.546 -4.909 1.00 0.00 C ATOM 0 H ALA A 819 -16.631 5.602 -3.739 1.00 0.00 H new ATOM 0 HA ALA A 819 -14.327 4.084 -3.791 1.00 0.00 H new ATOM 0 HB1 ALA A 819 -15.614 2.681 -5.383 1.00 0.00 H new ATOM 0 HB2 ALA A 819 -16.623 3.225 -4.021 1.00 0.00 H new ATOM 0 HB3 ALA A 819 -16.769 4.016 -5.609 1.00 0.00 H new ATOM 969 N GLY A 820 -14.710 5.846 -6.533 1.00 0.00 N ATOM 970 CA GLY A 820 -14.019 6.298 -7.723 1.00 0.00 C ATOM 971 C GLY A 820 -12.660 6.891 -7.418 1.00 0.00 C ATOM 972 O GLY A 820 -11.675 6.570 -8.084 1.00 0.00 O ATOM 0 H GLY A 820 -15.619 6.282 -6.379 1.00 0.00 H new ATOM 0 HA2 GLY A 820 -13.900 5.460 -8.410 1.00 0.00 H new ATOM 0 HA3 GLY A 820 -14.630 7.043 -8.233 1.00 0.00 H new ATOM 976 N GLU A 821 -12.597 7.749 -6.409 1.00 0.00 N ATOM 977 CA GLU A 821 -11.336 8.356 -6.010 1.00 0.00 C ATOM 978 C GLU A 821 -10.447 7.325 -5.331 1.00 0.00 C ATOM 979 O GLU A 821 -9.245 7.267 -5.582 1.00 0.00 O ATOM 980 CB GLU A 821 -11.578 9.535 -5.068 1.00 0.00 C ATOM 981 CG GLU A 821 -10.344 10.395 -4.845 1.00 0.00 C ATOM 982 CD GLU A 821 -10.013 11.254 -6.048 1.00 0.00 C ATOM 983 OE1 GLU A 821 -10.902 12.002 -6.507 1.00 0.00 O ATOM 984 OE2 GLU A 821 -8.863 11.191 -6.537 1.00 0.00 O ATOM 0 H GLU A 821 -13.402 8.039 -5.854 1.00 0.00 H new ATOM 0 HA GLU A 821 -10.836 8.723 -6.906 1.00 0.00 H new ATOM 0 HB2 GLU A 821 -12.376 10.157 -5.474 1.00 0.00 H new ATOM 0 HB3 GLU A 821 -11.926 9.157 -4.107 1.00 0.00 H new ATOM 0 HG2 GLU A 821 -10.503 11.035 -3.977 1.00 0.00 H new ATOM 0 HG3 GLU A 821 -9.494 9.753 -4.616 1.00 0.00 H new ATOM 991 N MET A 822 -11.055 6.505 -4.483 1.00 0.00 N ATOM 992 CA MET A 822 -10.328 5.479 -3.747 1.00 0.00 C ATOM 993 C MET A 822 -9.624 4.521 -4.699 1.00 0.00 C ATOM 994 O MET A 822 -8.425 4.284 -4.572 1.00 0.00 O ATOM 995 CB MET A 822 -11.280 4.701 -2.841 1.00 0.00 C ATOM 996 CG MET A 822 -11.540 5.376 -1.505 1.00 0.00 C ATOM 997 SD MET A 822 -13.012 4.736 -0.682 1.00 0.00 S ATOM 998 CE MET A 822 -12.695 2.976 -0.764 1.00 0.00 C ATOM 0 H MET A 822 -12.056 6.531 -4.287 1.00 0.00 H new ATOM 0 HA MET A 822 -9.575 5.974 -3.134 1.00 0.00 H new ATOM 0 HB2 MET A 822 -12.229 4.563 -3.359 1.00 0.00 H new ATOM 0 HB3 MET A 822 -10.867 3.708 -2.662 1.00 0.00 H new ATOM 0 HG2 MET A 822 -10.675 5.236 -0.856 1.00 0.00 H new ATOM 0 HG3 MET A 822 -11.652 6.449 -1.660 1.00 0.00 H new ATOM 0 HE1 MET A 822 -13.284 2.464 -0.003 1.00 0.00 H new ATOM 0 HE2 MET A 822 -12.972 2.602 -1.750 1.00 0.00 H new ATOM 0 HE3 MET A 822 -11.636 2.789 -0.589 1.00 0.00 H new ATOM 1008 N VAL A 823 -10.371 3.984 -5.658 1.00 0.00 N ATOM 1009 CA VAL A 823 -9.812 3.059 -6.637 1.00 0.00 C ATOM 1010 C VAL A 823 -8.806 3.775 -7.534 1.00 0.00 C ATOM 1011 O VAL A 823 -7.784 3.203 -7.915 1.00 0.00 O ATOM 1012 CB VAL A 823 -10.916 2.406 -7.501 1.00 0.00 C ATOM 1013 CG1 VAL A 823 -10.318 1.542 -8.603 1.00 0.00 C ATOM 1014 CG2 VAL A 823 -11.850 1.579 -6.631 1.00 0.00 C ATOM 0 H VAL A 823 -11.366 4.174 -5.778 1.00 0.00 H new ATOM 0 HA VAL A 823 -9.303 2.268 -6.086 1.00 0.00 H new ATOM 0 HB VAL A 823 -11.487 3.205 -7.973 1.00 0.00 H new ATOM 0 HG11 VAL A 823 -11.120 1.097 -9.192 1.00 0.00 H new ATOM 0 HG12 VAL A 823 -9.692 2.158 -9.249 1.00 0.00 H new ATOM 0 HG13 VAL A 823 -9.714 0.752 -8.158 1.00 0.00 H new ATOM 0 HG21 VAL A 823 -12.621 1.126 -7.254 1.00 0.00 H new ATOM 0 HG22 VAL A 823 -11.282 0.795 -6.130 1.00 0.00 H new ATOM 0 HG23 VAL A 823 -12.317 2.222 -5.885 1.00 0.00 H new ATOM 1024 N ARG A 824 -9.095 5.034 -7.853 1.00 0.00 N ATOM 1025 CA ARG A 824 -8.179 5.855 -8.638 1.00 0.00 C ATOM 1026 C ARG A 824 -6.816 5.915 -7.957 1.00 0.00 C ATOM 1027 O ARG A 824 -5.791 5.605 -8.564 1.00 0.00 O ATOM 1028 CB ARG A 824 -8.742 7.271 -8.813 1.00 0.00 C ATOM 1029 CG ARG A 824 -7.885 8.174 -9.687 1.00 0.00 C ATOM 1030 CD ARG A 824 -7.094 9.171 -8.852 1.00 0.00 C ATOM 1031 NE ARG A 824 -7.649 10.522 -8.933 1.00 0.00 N ATOM 1032 CZ ARG A 824 -7.285 11.426 -9.844 1.00 0.00 C ATOM 1033 NH1 ARG A 824 -6.342 11.137 -10.733 1.00 0.00 N ATOM 1034 NH2 ARG A 824 -7.865 12.616 -9.862 1.00 0.00 N ATOM 0 H ARG A 824 -9.956 5.507 -7.580 1.00 0.00 H new ATOM 0 HA ARG A 824 -8.065 5.402 -9.623 1.00 0.00 H new ATOM 0 HB2 ARG A 824 -9.740 7.203 -9.247 1.00 0.00 H new ATOM 0 HB3 ARG A 824 -8.852 7.731 -7.831 1.00 0.00 H new ATOM 0 HG2 ARG A 824 -7.199 7.566 -10.277 1.00 0.00 H new ATOM 0 HG3 ARG A 824 -8.521 8.711 -10.391 1.00 0.00 H new ATOM 0 HD2 ARG A 824 -7.085 8.845 -7.812 1.00 0.00 H new ATOM 0 HD3 ARG A 824 -6.058 9.185 -9.190 1.00 0.00 H new ATOM 0 HE ARG A 824 -8.358 10.789 -8.251 1.00 0.00 H new ATOM 0 HH11 ARG A 824 -5.893 10.221 -10.721 1.00 0.00 H new ATOM 0 HH12 ARG A 824 -6.066 11.831 -11.428 1.00 0.00 H new ATOM 0 HH21 ARG A 824 -8.589 12.841 -9.180 1.00 0.00 H new ATOM 0 HH22 ARG A 824 -7.588 13.308 -10.558 1.00 0.00 H new ATOM 1048 N GLN A 825 -6.819 6.297 -6.686 1.00 0.00 N ATOM 1049 CA GLN A 825 -5.589 6.396 -5.918 1.00 0.00 C ATOM 1050 C GLN A 825 -4.970 5.019 -5.711 1.00 0.00 C ATOM 1051 O GLN A 825 -3.761 4.854 -5.834 1.00 0.00 O ATOM 1052 CB GLN A 825 -5.857 7.062 -4.569 1.00 0.00 C ATOM 1053 CG GLN A 825 -6.532 8.417 -4.687 1.00 0.00 C ATOM 1054 CD GLN A 825 -5.555 9.534 -4.989 1.00 0.00 C ATOM 1055 OE1 GLN A 825 -4.378 9.461 -4.638 1.00 0.00 O ATOM 1056 NE2 GLN A 825 -6.037 10.582 -5.636 1.00 0.00 N ATOM 0 H GLN A 825 -7.662 6.543 -6.167 1.00 0.00 H new ATOM 0 HA GLN A 825 -4.884 7.010 -6.479 1.00 0.00 H new ATOM 0 HB2 GLN A 825 -6.483 6.404 -3.966 1.00 0.00 H new ATOM 0 HB3 GLN A 825 -4.913 7.180 -4.037 1.00 0.00 H new ATOM 0 HG2 GLN A 825 -7.285 8.376 -5.474 1.00 0.00 H new ATOM 0 HG3 GLN A 825 -7.055 8.640 -3.757 1.00 0.00 H new ATOM 0 HE21 GLN A 825 -7.019 10.605 -5.910 1.00 0.00 H new ATOM 0 HE22 GLN A 825 -5.426 11.368 -5.861 1.00 0.00 H new ATOM 1065 N ALA A 826 -5.809 4.029 -5.419 1.00 0.00 N ATOM 1066 CA ALA A 826 -5.343 2.666 -5.191 1.00 0.00 C ATOM 1067 C ALA A 826 -4.611 2.114 -6.414 1.00 0.00 C ATOM 1068 O ALA A 826 -3.633 1.377 -6.284 1.00 0.00 O ATOM 1069 CB ALA A 826 -6.508 1.761 -4.816 1.00 0.00 C ATOM 0 H ALA A 826 -6.819 4.147 -5.335 1.00 0.00 H new ATOM 0 HA ALA A 826 -4.636 2.691 -4.362 1.00 0.00 H new ATOM 0 HB1 ALA A 826 -6.143 0.748 -4.649 1.00 0.00 H new ATOM 0 HB2 ALA A 826 -6.978 2.132 -3.905 1.00 0.00 H new ATOM 0 HB3 ALA A 826 -7.239 1.755 -5.625 1.00 0.00 H new ATOM 1075 N ARG A 827 -5.083 2.479 -7.601 1.00 0.00 N ATOM 1076 CA ARG A 827 -4.435 2.066 -8.838 1.00 0.00 C ATOM 1077 C ARG A 827 -3.059 2.715 -8.963 1.00 0.00 C ATOM 1078 O ARG A 827 -2.098 2.083 -9.402 1.00 0.00 O ATOM 1079 CB ARG A 827 -5.307 2.423 -10.040 1.00 0.00 C ATOM 1080 CG ARG A 827 -6.318 1.343 -10.386 1.00 0.00 C ATOM 1081 CD ARG A 827 -7.320 1.820 -11.424 1.00 0.00 C ATOM 1082 NE ARG A 827 -6.669 2.422 -12.587 1.00 0.00 N ATOM 1083 CZ ARG A 827 -7.198 3.415 -13.300 1.00 0.00 C ATOM 1084 NH1 ARG A 827 -8.399 3.893 -12.996 1.00 0.00 N ATOM 1085 NH2 ARG A 827 -6.540 3.918 -14.335 1.00 0.00 N ATOM 0 H ARG A 827 -5.911 3.060 -7.732 1.00 0.00 H new ATOM 0 HA ARG A 827 -4.304 0.984 -8.816 1.00 0.00 H new ATOM 0 HB2 ARG A 827 -5.835 3.354 -9.834 1.00 0.00 H new ATOM 0 HB3 ARG A 827 -4.668 2.604 -10.904 1.00 0.00 H new ATOM 0 HG2 ARG A 827 -5.796 0.463 -10.762 1.00 0.00 H new ATOM 0 HG3 ARG A 827 -6.847 1.038 -9.483 1.00 0.00 H new ATOM 0 HD2 ARG A 827 -7.933 0.979 -11.748 1.00 0.00 H new ATOM 0 HD3 ARG A 827 -7.992 2.548 -10.969 1.00 0.00 H new ATOM 0 HE ARG A 827 -5.758 2.061 -12.868 1.00 0.00 H new ATOM 0 HH11 ARG A 827 -8.921 3.500 -12.213 1.00 0.00 H new ATOM 0 HH12 ARG A 827 -8.799 4.654 -13.545 1.00 0.00 H new ATOM 0 HH21 ARG A 827 -5.625 3.545 -14.588 1.00 0.00 H new ATOM 0 HH22 ARG A 827 -6.949 4.678 -14.878 1.00 0.00 H new ATOM 1099 N ILE A 828 -2.969 3.978 -8.566 1.00 0.00 N ATOM 1100 CA ILE A 828 -1.689 4.675 -8.524 1.00 0.00 C ATOM 1101 C ILE A 828 -0.785 4.025 -7.483 1.00 0.00 C ATOM 1102 O ILE A 828 0.408 3.830 -7.712 1.00 0.00 O ATOM 1103 CB ILE A 828 -1.870 6.173 -8.182 1.00 0.00 C ATOM 1104 CG1 ILE A 828 -2.709 6.866 -9.254 1.00 0.00 C ATOM 1105 CG2 ILE A 828 -0.519 6.863 -8.035 1.00 0.00 C ATOM 1106 CD1 ILE A 828 -3.595 7.966 -8.708 1.00 0.00 C ATOM 0 H ILE A 828 -3.766 4.541 -8.269 1.00 0.00 H new ATOM 0 HA ILE A 828 -1.235 4.603 -9.512 1.00 0.00 H new ATOM 0 HB ILE A 828 -2.394 6.244 -7.229 1.00 0.00 H new ATOM 0 HG12 ILE A 828 -2.045 7.286 -10.009 1.00 0.00 H new ATOM 0 HG13 ILE A 828 -3.331 6.124 -9.754 1.00 0.00 H new ATOM 0 HG21 ILE A 828 -0.672 7.915 -7.795 1.00 0.00 H new ATOM 0 HG22 ILE A 828 0.048 6.387 -7.235 1.00 0.00 H new ATOM 0 HG23 ILE A 828 0.035 6.781 -8.970 1.00 0.00 H new ATOM 0 HD11 ILE A 828 -4.162 8.415 -9.523 1.00 0.00 H new ATOM 0 HD12 ILE A 828 -4.284 7.548 -7.974 1.00 0.00 H new ATOM 0 HD13 ILE A 828 -2.978 8.728 -8.233 1.00 0.00 H new ATOM 1118 N LEU A 829 -1.383 3.676 -6.349 1.00 0.00 N ATOM 1119 CA LEU A 829 -0.677 3.012 -5.261 1.00 0.00 C ATOM 1120 C LEU A 829 -0.039 1.710 -5.738 1.00 0.00 C ATOM 1121 O LEU A 829 1.147 1.477 -5.516 1.00 0.00 O ATOM 1122 CB LEU A 829 -1.669 2.736 -4.118 1.00 0.00 C ATOM 1123 CG LEU A 829 -1.240 1.705 -3.069 1.00 0.00 C ATOM 1124 CD1 LEU A 829 0.020 2.154 -2.350 1.00 0.00 C ATOM 1125 CD2 LEU A 829 -2.361 1.483 -2.073 1.00 0.00 C ATOM 0 H LEU A 829 -2.371 3.846 -6.159 1.00 0.00 H new ATOM 0 HA LEU A 829 0.123 3.661 -4.905 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -1.870 3.678 -3.607 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -2.610 2.404 -4.557 1.00 0.00 H new ATOM 0 HG LEU A 829 -1.023 0.766 -3.578 1.00 0.00 H new ATOM 0 HD11 LEU A 829 0.304 1.405 -1.611 1.00 0.00 H new ATOM 0 HD12 LEU A 829 0.827 2.275 -3.072 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -0.165 3.105 -1.850 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -2.048 0.749 -1.331 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -2.597 2.424 -1.576 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -3.245 1.117 -2.595 1.00 0.00 H new ATOM 1137 N ALA A 830 -0.820 0.890 -6.433 1.00 0.00 N ATOM 1138 CA ALA A 830 -0.330 -0.384 -6.947 1.00 0.00 C ATOM 1139 C ALA A 830 0.862 -0.178 -7.873 1.00 0.00 C ATOM 1140 O ALA A 830 1.838 -0.928 -7.825 1.00 0.00 O ATOM 1141 CB ALA A 830 -1.443 -1.128 -7.672 1.00 0.00 C ATOM 0 H ALA A 830 -1.797 1.085 -6.654 1.00 0.00 H new ATOM 0 HA ALA A 830 -0.001 -0.986 -6.100 1.00 0.00 H new ATOM 0 HB1 ALA A 830 -1.061 -2.076 -8.049 1.00 0.00 H new ATOM 0 HB2 ALA A 830 -2.265 -1.317 -6.981 1.00 0.00 H new ATOM 0 HB3 ALA A 830 -1.802 -0.524 -8.505 1.00 0.00 H new ATOM 1147 N GLN A 831 0.783 0.855 -8.697 1.00 0.00 N ATOM 1148 CA GLN A 831 1.846 1.176 -9.639 1.00 0.00 C ATOM 1149 C GLN A 831 3.077 1.718 -8.907 1.00 0.00 C ATOM 1150 O GLN A 831 4.205 1.289 -9.162 1.00 0.00 O ATOM 1151 CB GLN A 831 1.327 2.191 -10.667 1.00 0.00 C ATOM 1152 CG GLN A 831 2.409 3.035 -11.324 1.00 0.00 C ATOM 1153 CD GLN A 831 2.258 4.510 -11.012 1.00 0.00 C ATOM 1154 OE1 GLN A 831 3.191 5.151 -10.533 1.00 0.00 O ATOM 1155 NE2 GLN A 831 1.085 5.058 -11.289 1.00 0.00 N ATOM 0 H GLN A 831 -0.014 1.491 -8.733 1.00 0.00 H new ATOM 0 HA GLN A 831 2.148 0.267 -10.160 1.00 0.00 H new ATOM 0 HB2 GLN A 831 0.781 1.655 -11.443 1.00 0.00 H new ATOM 0 HB3 GLN A 831 0.615 2.854 -10.176 1.00 0.00 H new ATOM 0 HG2 GLN A 831 3.388 2.693 -10.987 1.00 0.00 H new ATOM 0 HG3 GLN A 831 2.375 2.889 -12.404 1.00 0.00 H new ATOM 0 HE21 GLN A 831 0.337 4.489 -11.686 1.00 0.00 H new ATOM 0 HE22 GLN A 831 0.929 6.049 -11.105 1.00 0.00 H new ATOM 1164 N ALA A 832 2.847 2.640 -7.979 1.00 0.00 N ATOM 1165 CA ALA A 832 3.929 3.288 -7.246 1.00 0.00 C ATOM 1166 C ALA A 832 4.723 2.287 -6.410 1.00 0.00 C ATOM 1167 O ALA A 832 5.955 2.287 -6.437 1.00 0.00 O ATOM 1168 CB ALA A 832 3.376 4.397 -6.363 1.00 0.00 C ATOM 0 H ALA A 832 1.914 2.957 -7.715 1.00 0.00 H new ATOM 0 HA ALA A 832 4.612 3.721 -7.976 1.00 0.00 H new ATOM 0 HB1 ALA A 832 4.194 4.873 -5.821 1.00 0.00 H new ATOM 0 HB2 ALA A 832 2.872 5.138 -6.983 1.00 0.00 H new ATOM 0 HB3 ALA A 832 2.666 3.976 -5.651 1.00 0.00 H new ATOM 1174 N THR A 833 4.024 1.432 -5.674 1.00 0.00 N ATOM 1175 CA THR A 833 4.686 0.438 -4.843 1.00 0.00 C ATOM 1176 C THR A 833 5.433 -0.591 -5.690 1.00 0.00 C ATOM 1177 O THR A 833 6.465 -1.114 -5.270 1.00 0.00 O ATOM 1178 CB THR A 833 3.692 -0.281 -3.916 1.00 0.00 C ATOM 1179 OG1 THR A 833 2.782 0.668 -3.350 1.00 0.00 O ATOM 1180 CG2 THR A 833 4.427 -1.008 -2.802 1.00 0.00 C ATOM 0 H THR A 833 3.005 1.408 -5.636 1.00 0.00 H new ATOM 0 HA THR A 833 5.407 0.977 -4.228 1.00 0.00 H new ATOM 0 HB THR A 833 3.138 -1.012 -4.505 1.00 0.00 H new ATOM 0 HG1 THR A 833 2.109 0.914 -4.018 1.00 0.00 H new ATOM 0 HG21 THR A 833 3.706 -1.510 -2.157 1.00 0.00 H new ATOM 0 HG22 THR A 833 5.103 -1.746 -3.233 1.00 0.00 H new ATOM 0 HG23 THR A 833 5.000 -0.290 -2.215 1.00 0.00 H new ATOM 1188 N SER A 834 4.920 -0.874 -6.886 1.00 0.00 N ATOM 1189 CA SER A 834 5.596 -1.788 -7.800 1.00 0.00 C ATOM 1190 C SER A 834 6.988 -1.259 -8.134 1.00 0.00 C ATOM 1191 O SER A 834 7.970 -2.000 -8.109 1.00 0.00 O ATOM 1192 CB SER A 834 4.775 -1.975 -9.078 1.00 0.00 C ATOM 1193 OG SER A 834 3.555 -2.655 -8.813 1.00 0.00 O ATOM 0 H SER A 834 4.046 -0.487 -7.241 1.00 0.00 H new ATOM 0 HA SER A 834 5.696 -2.758 -7.313 1.00 0.00 H new ATOM 0 HB2 SER A 834 4.563 -1.002 -9.522 1.00 0.00 H new ATOM 0 HB3 SER A 834 5.357 -2.538 -9.807 1.00 0.00 H new ATOM 0 HG SER A 834 2.893 -2.018 -8.472 1.00 0.00 H new ATOM 1199 N ASP A 835 7.061 0.038 -8.415 1.00 0.00 N ATOM 1200 CA ASP A 835 8.332 0.697 -8.699 1.00 0.00 C ATOM 1201 C ASP A 835 9.224 0.681 -7.462 1.00 0.00 C ATOM 1202 O ASP A 835 10.405 0.341 -7.537 1.00 0.00 O ATOM 1203 CB ASP A 835 8.085 2.141 -9.148 1.00 0.00 C ATOM 1204 CG ASP A 835 9.325 2.807 -9.717 1.00 0.00 C ATOM 1205 OD1 ASP A 835 10.202 2.097 -10.253 1.00 0.00 O ATOM 1206 OD2 ASP A 835 9.416 4.055 -9.649 1.00 0.00 O ATOM 0 H ASP A 835 6.251 0.657 -8.452 1.00 0.00 H new ATOM 0 HA ASP A 835 8.835 0.156 -9.501 1.00 0.00 H new ATOM 0 HB2 ASP A 835 7.296 2.152 -9.900 1.00 0.00 H new ATOM 0 HB3 ASP A 835 7.724 2.723 -8.300 1.00 0.00 H new ATOM 1211 N LEU A 836 8.634 1.033 -6.324 1.00 0.00 N ATOM 1212 CA LEU A 836 9.349 1.075 -5.050 1.00 0.00 C ATOM 1213 C LEU A 836 9.985 -0.275 -4.725 1.00 0.00 C ATOM 1214 O LEU A 836 11.186 -0.359 -4.463 1.00 0.00 O ATOM 1215 CB LEU A 836 8.385 1.490 -3.928 1.00 0.00 C ATOM 1216 CG LEU A 836 8.909 1.318 -2.496 1.00 0.00 C ATOM 1217 CD1 LEU A 836 10.024 2.310 -2.211 1.00 0.00 C ATOM 1218 CD2 LEU A 836 7.781 1.494 -1.495 1.00 0.00 C ATOM 0 H LEU A 836 7.651 1.296 -6.257 1.00 0.00 H new ATOM 0 HA LEU A 836 10.150 1.810 -5.132 1.00 0.00 H new ATOM 0 HB2 LEU A 836 8.118 2.537 -4.073 1.00 0.00 H new ATOM 0 HB3 LEU A 836 7.468 0.910 -4.031 1.00 0.00 H new ATOM 0 HG LEU A 836 9.310 0.309 -2.397 1.00 0.00 H new ATOM 0 HD11 LEU A 836 10.382 2.172 -1.191 1.00 0.00 H new ATOM 0 HD12 LEU A 836 10.845 2.145 -2.909 1.00 0.00 H new ATOM 0 HD13 LEU A 836 9.646 3.326 -2.329 1.00 0.00 H new ATOM 0 HD21 LEU A 836 8.169 1.369 -0.484 1.00 0.00 H new ATOM 0 HD22 LEU A 836 7.354 2.492 -1.599 1.00 0.00 H new ATOM 0 HD23 LEU A 836 7.009 0.748 -1.682 1.00 0.00 H new ATOM 1230 N VAL A 837 9.183 -1.331 -4.775 1.00 0.00 N ATOM 1231 CA VAL A 837 9.645 -2.662 -4.400 1.00 0.00 C ATOM 1232 C VAL A 837 10.682 -3.185 -5.391 1.00 0.00 C ATOM 1233 O VAL A 837 11.683 -3.782 -4.994 1.00 0.00 O ATOM 1234 CB VAL A 837 8.463 -3.652 -4.295 1.00 0.00 C ATOM 1235 CG1 VAL A 837 8.954 -5.079 -4.083 1.00 0.00 C ATOM 1236 CG2 VAL A 837 7.530 -3.237 -3.166 1.00 0.00 C ATOM 0 H VAL A 837 8.208 -1.292 -5.072 1.00 0.00 H new ATOM 0 HA VAL A 837 10.115 -2.580 -3.420 1.00 0.00 H new ATOM 0 HB VAL A 837 7.914 -3.625 -5.236 1.00 0.00 H new ATOM 0 HG11 VAL A 837 8.099 -5.751 -4.013 1.00 0.00 H new ATOM 0 HG12 VAL A 837 9.582 -5.376 -4.923 1.00 0.00 H new ATOM 0 HG13 VAL A 837 9.533 -5.131 -3.161 1.00 0.00 H new ATOM 0 HG21 VAL A 837 6.701 -3.942 -3.101 1.00 0.00 H new ATOM 0 HG22 VAL A 837 8.078 -3.234 -2.224 1.00 0.00 H new ATOM 0 HG23 VAL A 837 7.142 -2.238 -3.363 1.00 0.00 H new ATOM 1246 N ASN A 838 10.453 -2.939 -6.676 1.00 0.00 N ATOM 1247 CA ASN A 838 11.380 -3.380 -7.716 1.00 0.00 C ATOM 1248 C ASN A 838 12.736 -2.698 -7.556 1.00 0.00 C ATOM 1249 O ASN A 838 13.785 -3.318 -7.753 1.00 0.00 O ATOM 1250 CB ASN A 838 10.807 -3.087 -9.104 1.00 0.00 C ATOM 1251 CG ASN A 838 11.675 -3.632 -10.223 1.00 0.00 C ATOM 1252 OD1 ASN A 838 11.989 -4.825 -10.264 1.00 0.00 O ATOM 1253 ND2 ASN A 838 12.062 -2.766 -11.146 1.00 0.00 N ATOM 0 H ASN A 838 9.636 -2.438 -7.024 1.00 0.00 H new ATOM 0 HA ASN A 838 11.518 -4.456 -7.612 1.00 0.00 H new ATOM 0 HB2 ASN A 838 9.810 -3.520 -9.180 1.00 0.00 H new ATOM 0 HB3 ASN A 838 10.697 -2.010 -9.227 1.00 0.00 H new ATOM 0 HD21 ASN A 838 12.641 -3.077 -11.926 1.00 0.00 H new ATOM 0 HD22 ASN A 838 11.782 -1.788 -11.077 1.00 0.00 H new ATOM 1260 N ALA A 839 12.707 -1.422 -7.189 1.00 0.00 N ATOM 1261 CA ALA A 839 13.926 -0.661 -6.956 1.00 0.00 C ATOM 1262 C ALA A 839 14.723 -1.257 -5.800 1.00 0.00 C ATOM 1263 O ALA A 839 15.931 -1.479 -5.916 1.00 0.00 O ATOM 1264 CB ALA A 839 13.591 0.795 -6.682 1.00 0.00 C ATOM 0 H ALA A 839 11.847 -0.892 -7.046 1.00 0.00 H new ATOM 0 HA ALA A 839 14.543 -0.713 -7.853 1.00 0.00 H new ATOM 0 HB1 ALA A 839 14.511 1.354 -6.509 1.00 0.00 H new ATOM 0 HB2 ALA A 839 13.067 1.215 -7.540 1.00 0.00 H new ATOM 0 HB3 ALA A 839 12.955 0.862 -5.800 1.00 0.00 H new ATOM 1270 N ILE A 840 14.037 -1.524 -4.692 1.00 0.00 N ATOM 1271 CA ILE A 840 14.667 -2.131 -3.524 1.00 0.00 C ATOM 1272 C ILE A 840 15.191 -3.520 -3.862 1.00 0.00 C ATOM 1273 O ILE A 840 16.314 -3.870 -3.507 1.00 0.00 O ATOM 1274 CB ILE A 840 13.684 -2.239 -2.338 1.00 0.00 C ATOM 1275 CG1 ILE A 840 13.212 -0.851 -1.917 1.00 0.00 C ATOM 1276 CG2 ILE A 840 14.330 -2.955 -1.159 1.00 0.00 C ATOM 1277 CD1 ILE A 840 11.782 -0.822 -1.440 1.00 0.00 C ATOM 0 H ILE A 840 13.042 -1.329 -4.579 1.00 0.00 H new ATOM 0 HA ILE A 840 15.495 -1.484 -3.233 1.00 0.00 H new ATOM 0 HB ILE A 840 12.823 -2.824 -2.661 1.00 0.00 H new ATOM 0 HG12 ILE A 840 13.860 -0.481 -1.122 1.00 0.00 H new ATOM 0 HG13 ILE A 840 13.320 -0.168 -2.760 1.00 0.00 H new ATOM 0 HG21 ILE A 840 13.617 -3.018 -0.337 1.00 0.00 H new ATOM 0 HG22 ILE A 840 14.625 -3.960 -1.461 1.00 0.00 H new ATOM 0 HG23 ILE A 840 15.210 -2.400 -0.834 1.00 0.00 H new ATOM 0 HD11 ILE A 840 11.513 0.196 -1.157 1.00 0.00 H new ATOM 0 HD12 ILE A 840 11.125 -1.161 -2.240 1.00 0.00 H new ATOM 0 HD13 ILE A 840 11.673 -1.479 -0.577 1.00 0.00 H new ATOM 1289 N LYS A 841 14.372 -4.294 -4.565 1.00 0.00 N ATOM 1290 CA LYS A 841 14.735 -5.648 -4.962 1.00 0.00 C ATOM 1291 C LYS A 841 16.059 -5.659 -5.716 1.00 0.00 C ATOM 1292 O LYS A 841 16.942 -6.466 -5.430 1.00 0.00 O ATOM 1293 CB LYS A 841 13.637 -6.255 -5.838 1.00 0.00 C ATOM 1294 CG LYS A 841 12.922 -7.430 -5.195 1.00 0.00 C ATOM 1295 CD LYS A 841 13.359 -8.750 -5.811 1.00 0.00 C ATOM 1296 CE LYS A 841 13.653 -9.792 -4.746 1.00 0.00 C ATOM 1297 NZ LYS A 841 14.543 -10.868 -5.253 1.00 0.00 N ATOM 0 H LYS A 841 13.444 -4.003 -4.874 1.00 0.00 H new ATOM 0 HA LYS A 841 14.846 -6.246 -4.057 1.00 0.00 H new ATOM 0 HB2 LYS A 841 12.906 -5.482 -6.076 1.00 0.00 H new ATOM 0 HB3 LYS A 841 14.076 -6.580 -6.781 1.00 0.00 H new ATOM 0 HG2 LYS A 841 13.127 -7.441 -4.124 1.00 0.00 H new ATOM 0 HG3 LYS A 841 11.845 -7.311 -5.312 1.00 0.00 H new ATOM 0 HD2 LYS A 841 12.578 -9.118 -6.476 1.00 0.00 H new ATOM 0 HD3 LYS A 841 14.248 -8.591 -6.421 1.00 0.00 H new ATOM 0 HE2 LYS A 841 14.119 -9.311 -3.886 1.00 0.00 H new ATOM 0 HE3 LYS A 841 12.717 -10.229 -4.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 841 15.015 -11.334 -4.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 841 13.979 -11.567 -5.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 841 15.259 -10.457 -5.885 1.00 0.00 H new ATOM 1311 N ALA A 842 16.192 -4.753 -6.672 1.00 0.00 N ATOM 1312 CA ALA A 842 17.391 -4.682 -7.493 1.00 0.00 C ATOM 1313 C ALA A 842 18.588 -4.168 -6.696 1.00 0.00 C ATOM 1314 O ALA A 842 19.711 -4.639 -6.879 1.00 0.00 O ATOM 1315 CB ALA A 842 17.141 -3.802 -8.706 1.00 0.00 C ATOM 0 H ALA A 842 15.483 -4.055 -6.899 1.00 0.00 H new ATOM 0 HA ALA A 842 17.630 -5.691 -7.828 1.00 0.00 H new ATOM 0 HB1 ALA A 842 18.044 -3.755 -9.314 1.00 0.00 H new ATOM 0 HB2 ALA A 842 16.327 -4.221 -9.298 1.00 0.00 H new ATOM 0 HB3 ALA A 842 16.872 -2.798 -8.378 1.00 0.00 H new ATOM 1321 N ASP A 843 18.342 -3.211 -5.804 1.00 0.00 N ATOM 1322 CA ASP A 843 19.417 -2.594 -5.026 1.00 0.00 C ATOM 1323 C ASP A 843 19.916 -3.528 -3.929 1.00 0.00 C ATOM 1324 O ASP A 843 21.116 -3.589 -3.657 1.00 0.00 O ATOM 1325 CB ASP A 843 18.955 -1.270 -4.410 1.00 0.00 C ATOM 1326 CG ASP A 843 19.919 -0.133 -4.695 1.00 0.00 C ATOM 1327 OD1 ASP A 843 20.099 0.211 -5.884 1.00 0.00 O ATOM 1328 OD2 ASP A 843 20.501 0.423 -3.740 1.00 0.00 O ATOM 0 H ASP A 843 17.411 -2.846 -5.601 1.00 0.00 H new ATOM 0 HA ASP A 843 20.241 -2.397 -5.712 1.00 0.00 H new ATOM 0 HB2 ASP A 843 17.970 -1.014 -4.801 1.00 0.00 H new ATOM 0 HB3 ASP A 843 18.849 -1.391 -3.332 1.00 0.00 H new ATOM 1333 N ALA A 844 18.995 -4.253 -3.305 1.00 0.00 N ATOM 1334 CA ALA A 844 19.343 -5.192 -2.242 1.00 0.00 C ATOM 1335 C ALA A 844 20.048 -6.419 -2.808 1.00 0.00 C ATOM 1336 O ALA A 844 20.862 -7.050 -2.131 1.00 0.00 O ATOM 1337 CB ALA A 844 18.102 -5.604 -1.467 1.00 0.00 C ATOM 0 H ALA A 844 17.998 -4.209 -3.517 1.00 0.00 H new ATOM 0 HA ALA A 844 20.029 -4.690 -1.559 1.00 0.00 H new ATOM 0 HB1 ALA A 844 18.381 -6.304 -0.679 1.00 0.00 H new ATOM 0 HB2 ALA A 844 17.641 -4.722 -1.023 1.00 0.00 H new ATOM 0 HB3 ALA A 844 17.393 -6.082 -2.143 1.00 0.00 H new ATOM 1343 N GLU A 845 19.722 -6.757 -4.049 1.00 0.00 N ATOM 1344 CA GLU A 845 20.397 -7.838 -4.748 1.00 0.00 C ATOM 1345 C GLU A 845 21.810 -7.403 -5.114 1.00 0.00 C ATOM 1346 O GLU A 845 22.047 -6.843 -6.187 1.00 0.00 O ATOM 1347 CB GLU A 845 19.616 -8.232 -6.004 1.00 0.00 C ATOM 1348 CG GLU A 845 19.202 -9.693 -6.029 1.00 0.00 C ATOM 1349 CD GLU A 845 17.828 -9.921 -5.439 1.00 0.00 C ATOM 1350 OE1 GLU A 845 17.731 -10.126 -4.213 1.00 0.00 O ATOM 1351 OE2 GLU A 845 16.837 -9.918 -6.202 1.00 0.00 O ATOM 0 H GLU A 845 18.992 -6.295 -4.592 1.00 0.00 H new ATOM 0 HA GLU A 845 20.450 -8.708 -4.094 1.00 0.00 H new ATOM 0 HB2 GLU A 845 18.725 -7.609 -6.078 1.00 0.00 H new ATOM 0 HB3 GLU A 845 20.226 -8.021 -6.882 1.00 0.00 H new ATOM 0 HG2 GLU A 845 19.215 -10.052 -7.058 1.00 0.00 H new ATOM 0 HG3 GLU A 845 19.933 -10.283 -5.476 1.00 0.00 H new ATOM 1358 N GLY A 846 22.740 -7.656 -4.208 1.00 0.00 N ATOM 1359 CA GLY A 846 24.105 -7.203 -4.388 1.00 0.00 C ATOM 1360 C GLY A 846 24.546 -6.274 -3.272 1.00 0.00 C ATOM 1361 O GLY A 846 25.487 -5.490 -3.437 1.00 0.00 O ATOM 0 H GLY A 846 22.573 -8.171 -3.344 1.00 0.00 H new ATOM 0 HA2 GLY A 846 24.771 -8.065 -4.427 1.00 0.00 H new ATOM 0 HA3 GLY A 846 24.193 -6.688 -5.345 1.00 0.00 H new ATOM 1365 N GLU A 847 23.856 -6.355 -2.138 1.00 0.00 N ATOM 1366 CA GLU A 847 24.188 -5.547 -0.972 1.00 0.00 C ATOM 1367 C GLU A 847 25.508 -6.004 -0.357 1.00 0.00 C ATOM 1368 O GLU A 847 25.998 -7.097 -0.648 1.00 0.00 O ATOM 1369 CB GLU A 847 23.070 -5.634 0.071 1.00 0.00 C ATOM 1370 CG GLU A 847 22.641 -4.287 0.634 1.00 0.00 C ATOM 1371 CD GLU A 847 23.543 -3.813 1.754 1.00 0.00 C ATOM 1372 OE1 GLU A 847 24.583 -3.192 1.459 1.00 0.00 O ATOM 1373 OE2 GLU A 847 23.222 -4.070 2.930 1.00 0.00 O ATOM 0 H GLU A 847 23.059 -6.977 -2.003 1.00 0.00 H new ATOM 0 HA GLU A 847 24.294 -4.511 -1.295 1.00 0.00 H new ATOM 0 HB2 GLU A 847 22.204 -6.120 -0.379 1.00 0.00 H new ATOM 0 HB3 GLU A 847 23.402 -6.270 0.892 1.00 0.00 H new ATOM 0 HG2 GLU A 847 22.640 -3.546 -0.166 1.00 0.00 H new ATOM 0 HG3 GLU A 847 21.618 -4.360 1.002 1.00 0.00 H new ATOM 1380 N SER A 848 26.070 -5.164 0.497 1.00 0.00 N ATOM 1381 CA SER A 848 27.318 -5.471 1.168 1.00 0.00 C ATOM 1382 C SER A 848 27.053 -6.347 2.385 1.00 0.00 C ATOM 1383 O SER A 848 27.858 -7.214 2.727 1.00 0.00 O ATOM 1384 CB SER A 848 28.021 -4.175 1.571 1.00 0.00 C ATOM 1385 OG SER A 848 28.127 -3.301 0.458 1.00 0.00 O ATOM 0 H SER A 848 25.675 -4.256 0.742 1.00 0.00 H new ATOM 0 HA SER A 848 27.969 -6.020 0.488 1.00 0.00 H new ATOM 0 HB2 SER A 848 27.466 -3.687 2.372 1.00 0.00 H new ATOM 0 HB3 SER A 848 29.014 -4.399 1.961 1.00 0.00 H new ATOM 0 HG SER A 848 28.578 -2.475 0.732 1.00 0.00 H new ATOM 1391 N ASP A 849 25.916 -6.120 3.029 1.00 0.00 N ATOM 1392 CA ASP A 849 25.494 -6.949 4.147 1.00 0.00 C ATOM 1393 C ASP A 849 24.321 -7.822 3.730 1.00 0.00 C ATOM 1394 O ASP A 849 23.238 -7.322 3.417 1.00 0.00 O ATOM 1395 CB ASP A 849 25.111 -6.092 5.352 1.00 0.00 C ATOM 1396 CG ASP A 849 24.846 -6.928 6.586 1.00 0.00 C ATOM 1397 OD1 ASP A 849 25.815 -7.278 7.297 1.00 0.00 O ATOM 1398 OD2 ASP A 849 23.672 -7.247 6.852 1.00 0.00 O ATOM 0 H ASP A 849 25.269 -5.367 2.795 1.00 0.00 H new ATOM 0 HA ASP A 849 26.330 -7.585 4.437 1.00 0.00 H new ATOM 0 HB2 ASP A 849 25.912 -5.383 5.561 1.00 0.00 H new ATOM 0 HB3 ASP A 849 24.222 -5.508 5.113 1.00 0.00 H new ATOM 1403 N LEU A 850 24.540 -9.126 3.718 1.00 0.00 N ATOM 1404 CA LEU A 850 23.531 -10.064 3.250 1.00 0.00 C ATOM 1405 C LEU A 850 22.338 -10.105 4.196 1.00 0.00 C ATOM 1406 O LEU A 850 21.195 -10.233 3.758 1.00 0.00 O ATOM 1407 CB LEU A 850 24.134 -11.459 3.088 1.00 0.00 C ATOM 1408 CG LEU A 850 25.023 -11.634 1.855 1.00 0.00 C ATOM 1409 CD1 LEU A 850 25.547 -13.058 1.771 1.00 0.00 C ATOM 1410 CD2 LEU A 850 24.260 -11.273 0.590 1.00 0.00 C ATOM 0 H LEU A 850 25.409 -9.561 4.028 1.00 0.00 H new ATOM 0 HA LEU A 850 23.177 -9.721 2.278 1.00 0.00 H new ATOM 0 HB2 LEU A 850 24.720 -11.692 3.977 1.00 0.00 H new ATOM 0 HB3 LEU A 850 23.324 -12.187 3.041 1.00 0.00 H new ATOM 0 HG LEU A 850 25.874 -10.959 1.949 1.00 0.00 H new ATOM 0 HD11 LEU A 850 26.177 -13.162 0.888 1.00 0.00 H new ATOM 0 HD12 LEU A 850 26.132 -13.284 2.663 1.00 0.00 H new ATOM 0 HD13 LEU A 850 24.708 -13.751 1.702 1.00 0.00 H new ATOM 0 HD21 LEU A 850 24.909 -11.404 -0.276 1.00 0.00 H new ATOM 0 HD22 LEU A 850 23.389 -11.922 0.493 1.00 0.00 H new ATOM 0 HD23 LEU A 850 23.934 -10.234 0.646 1.00 0.00 H new ATOM 1422 N GLU A 851 22.602 -9.966 5.486 1.00 0.00 N ATOM 1423 CA GLU A 851 21.542 -9.993 6.481 1.00 0.00 C ATOM 1424 C GLU A 851 20.579 -8.830 6.258 1.00 0.00 C ATOM 1425 O GLU A 851 19.365 -9.026 6.181 1.00 0.00 O ATOM 1426 CB GLU A 851 22.134 -9.945 7.892 1.00 0.00 C ATOM 1427 CG GLU A 851 21.102 -9.748 8.992 1.00 0.00 C ATOM 1428 CD GLU A 851 20.358 -11.019 9.345 1.00 0.00 C ATOM 1429 OE1 GLU A 851 20.202 -11.896 8.471 1.00 0.00 O ATOM 1430 OE2 GLU A 851 19.904 -11.141 10.502 1.00 0.00 O ATOM 0 H GLU A 851 23.539 -9.834 5.867 1.00 0.00 H new ATOM 0 HA GLU A 851 20.986 -10.925 6.376 1.00 0.00 H new ATOM 0 HB2 GLU A 851 22.676 -10.872 8.079 1.00 0.00 H new ATOM 0 HB3 GLU A 851 22.862 -9.135 7.942 1.00 0.00 H new ATOM 0 HG2 GLU A 851 21.599 -9.366 9.884 1.00 0.00 H new ATOM 0 HG3 GLU A 851 20.385 -8.990 8.677 1.00 0.00 H new ATOM 1437 N ASN A 852 21.132 -7.630 6.114 1.00 0.00 N ATOM 1438 CA ASN A 852 20.328 -6.434 5.875 1.00 0.00 C ATOM 1439 C ASN A 852 19.562 -6.545 4.562 1.00 0.00 C ATOM 1440 O ASN A 852 18.386 -6.178 4.492 1.00 0.00 O ATOM 1441 CB ASN A 852 21.210 -5.181 5.849 1.00 0.00 C ATOM 1442 CG ASN A 852 20.480 -3.965 5.304 1.00 0.00 C ATOM 1443 OD1 ASN A 852 19.443 -3.554 5.830 1.00 0.00 O ATOM 1444 ND2 ASN A 852 21.011 -3.381 4.243 1.00 0.00 N ATOM 0 H ASN A 852 22.136 -7.459 6.159 1.00 0.00 H new ATOM 0 HA ASN A 852 19.614 -6.349 6.694 1.00 0.00 H new ATOM 0 HB2 ASN A 852 21.561 -4.967 6.858 1.00 0.00 H new ATOM 0 HB3 ASN A 852 22.092 -5.375 5.239 1.00 0.00 H new ATOM 0 HD21 ASN A 852 20.561 -2.562 3.833 1.00 0.00 H new ATOM 0 HD22 ASN A 852 21.870 -3.749 3.835 1.00 0.00 H new ATOM 1451 N SER A 853 20.227 -7.054 3.528 1.00 0.00 N ATOM 1452 CA SER A 853 19.605 -7.195 2.221 1.00 0.00 C ATOM 1453 C SER A 853 18.375 -8.096 2.302 1.00 0.00 C ATOM 1454 O SER A 853 17.362 -7.827 1.662 1.00 0.00 O ATOM 1455 CB SER A 853 20.607 -7.731 1.193 1.00 0.00 C ATOM 1456 OG SER A 853 20.886 -9.107 1.391 1.00 0.00 O ATOM 0 H SER A 853 21.194 -7.374 3.573 1.00 0.00 H new ATOM 0 HA SER A 853 19.282 -6.207 1.892 1.00 0.00 H new ATOM 0 HB2 SER A 853 20.211 -7.582 0.189 1.00 0.00 H new ATOM 0 HB3 SER A 853 21.533 -7.160 1.258 1.00 0.00 H new ATOM 0 HG SER A 853 20.864 -9.311 2.349 1.00 0.00 H new ATOM 1462 N ARG A 854 18.456 -9.143 3.119 1.00 0.00 N ATOM 1463 CA ARG A 854 17.332 -10.050 3.292 1.00 0.00 C ATOM 1464 C ARG A 854 16.166 -9.327 3.955 1.00 0.00 C ATOM 1465 O ARG A 854 15.032 -9.412 3.486 1.00 0.00 O ATOM 1466 CB ARG A 854 17.743 -11.264 4.123 1.00 0.00 C ATOM 1467 CG ARG A 854 18.173 -12.455 3.282 1.00 0.00 C ATOM 1468 CD ARG A 854 19.592 -12.886 3.614 1.00 0.00 C ATOM 1469 NE ARG A 854 20.363 -13.218 2.417 1.00 0.00 N ATOM 1470 CZ ARG A 854 21.440 -14.004 2.423 1.00 0.00 C ATOM 1471 NH1 ARG A 854 21.909 -14.478 3.573 1.00 0.00 N ATOM 1472 NH2 ARG A 854 22.062 -14.295 1.284 1.00 0.00 N ATOM 0 H ARG A 854 19.283 -9.381 3.667 1.00 0.00 H new ATOM 0 HA ARG A 854 17.016 -10.397 2.308 1.00 0.00 H new ATOM 0 HB2 ARG A 854 18.562 -10.981 4.785 1.00 0.00 H new ATOM 0 HB3 ARG A 854 16.908 -11.560 4.758 1.00 0.00 H new ATOM 0 HG2 ARG A 854 17.490 -13.287 3.451 1.00 0.00 H new ATOM 0 HG3 ARG A 854 18.107 -12.198 2.225 1.00 0.00 H new ATOM 0 HD2 ARG A 854 20.095 -12.086 4.158 1.00 0.00 H new ATOM 0 HD3 ARG A 854 19.562 -13.751 4.276 1.00 0.00 H new ATOM 0 HE ARG A 854 20.059 -12.826 1.526 1.00 0.00 H new ATOM 0 HH11 ARG A 854 21.445 -14.240 4.450 1.00 0.00 H new ATOM 0 HH12 ARG A 854 22.733 -15.079 3.579 1.00 0.00 H new ATOM 0 HH21 ARG A 854 21.715 -13.917 0.403 1.00 0.00 H new ATOM 0 HH22 ARG A 854 22.886 -14.897 1.292 1.00 0.00 H new ATOM 1486 N LYS A 855 16.468 -8.583 5.022 1.00 0.00 N ATOM 1487 CA LYS A 855 15.468 -7.783 5.736 1.00 0.00 C ATOM 1488 C LYS A 855 14.799 -6.800 4.792 1.00 0.00 C ATOM 1489 O LYS A 855 13.598 -6.534 4.879 1.00 0.00 O ATOM 1490 CB LYS A 855 16.124 -6.981 6.860 1.00 0.00 C ATOM 1491 CG LYS A 855 17.099 -7.778 7.711 1.00 0.00 C ATOM 1492 CD LYS A 855 16.417 -8.935 8.421 1.00 0.00 C ATOM 1493 CE LYS A 855 17.089 -9.242 9.748 1.00 0.00 C ATOM 1494 NZ LYS A 855 17.294 -10.703 9.943 1.00 0.00 N ATOM 0 H LYS A 855 17.407 -8.518 5.414 1.00 0.00 H new ATOM 0 HA LYS A 855 14.730 -8.472 6.147 1.00 0.00 H new ATOM 0 HB2 LYS A 855 16.650 -6.131 6.425 1.00 0.00 H new ATOM 0 HB3 LYS A 855 15.344 -6.576 7.505 1.00 0.00 H new ATOM 0 HG2 LYS A 855 17.902 -8.161 7.081 1.00 0.00 H new ATOM 0 HG3 LYS A 855 17.559 -7.120 8.448 1.00 0.00 H new ATOM 0 HD2 LYS A 855 15.368 -8.693 8.590 1.00 0.00 H new ATOM 0 HD3 LYS A 855 16.442 -9.820 7.785 1.00 0.00 H new ATOM 0 HE2 LYS A 855 18.051 -8.731 9.794 1.00 0.00 H new ATOM 0 HE3 LYS A 855 16.480 -8.849 10.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 855 18.129 -10.859 10.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 855 16.456 -11.113 10.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 855 17.440 -11.159 9.020 1.00 0.00 H new ATOM 1508 N LEU A 856 15.616 -6.254 3.911 1.00 0.00 N ATOM 1509 CA LEU A 856 15.189 -5.259 2.953 1.00 0.00 C ATOM 1510 C LEU A 856 14.033 -5.758 2.110 1.00 0.00 C ATOM 1511 O LEU A 856 13.006 -5.090 1.970 1.00 0.00 O ATOM 1512 CB LEU A 856 16.373 -4.915 2.057 1.00 0.00 C ATOM 1513 CG LEU A 856 17.114 -3.642 2.465 1.00 0.00 C ATOM 1514 CD1 LEU A 856 18.455 -3.534 1.753 1.00 0.00 C ATOM 1515 CD2 LEU A 856 16.263 -2.414 2.187 1.00 0.00 C ATOM 0 H LEU A 856 16.605 -6.493 3.842 1.00 0.00 H new ATOM 0 HA LEU A 856 14.844 -4.376 3.490 1.00 0.00 H new ATOM 0 HB2 LEU A 856 17.075 -5.749 2.064 1.00 0.00 H new ATOM 0 HB3 LEU A 856 16.019 -4.804 1.032 1.00 0.00 H new ATOM 0 HG LEU A 856 17.305 -3.696 3.537 1.00 0.00 H new ATOM 0 HD11 LEU A 856 18.959 -2.619 2.063 1.00 0.00 H new ATOM 0 HD12 LEU A 856 19.074 -4.394 2.010 1.00 0.00 H new ATOM 0 HD13 LEU A 856 18.294 -3.512 0.675 1.00 0.00 H new ATOM 0 HD21 LEU A 856 16.808 -1.518 2.484 1.00 0.00 H new ATOM 0 HD22 LEU A 856 16.035 -2.363 1.122 1.00 0.00 H new ATOM 0 HD23 LEU A 856 15.335 -2.479 2.755 1.00 0.00 H new ATOM 1527 N LEU A 857 14.205 -6.943 1.572 1.00 0.00 N ATOM 1528 CA LEU A 857 13.245 -7.510 0.655 1.00 0.00 C ATOM 1529 C LEU A 857 12.004 -8.024 1.379 1.00 0.00 C ATOM 1530 O LEU A 857 10.934 -8.109 0.781 1.00 0.00 O ATOM 1531 CB LEU A 857 13.924 -8.599 -0.160 1.00 0.00 C ATOM 1532 CG LEU A 857 15.266 -8.167 -0.758 1.00 0.00 C ATOM 1533 CD1 LEU A 857 16.240 -9.335 -0.778 1.00 0.00 C ATOM 1534 CD2 LEU A 857 15.067 -7.618 -2.158 1.00 0.00 C ATOM 0 H LEU A 857 15.012 -7.539 1.757 1.00 0.00 H new ATOM 0 HA LEU A 857 12.893 -6.731 -0.021 1.00 0.00 H new ATOM 0 HB2 LEU A 857 14.082 -9.471 0.474 1.00 0.00 H new ATOM 0 HB3 LEU A 857 13.258 -8.907 -0.966 1.00 0.00 H new ATOM 0 HG LEU A 857 15.686 -7.379 -0.133 1.00 0.00 H new ATOM 0 HD11 LEU A 857 17.188 -9.011 -1.206 1.00 0.00 H new ATOM 0 HD12 LEU A 857 16.404 -9.690 0.240 1.00 0.00 H new ATOM 0 HD13 LEU A 857 15.827 -10.143 -1.382 1.00 0.00 H new ATOM 0 HD21 LEU A 857 16.029 -7.315 -2.570 1.00 0.00 H new ATOM 0 HD22 LEU A 857 14.627 -8.388 -2.792 1.00 0.00 H new ATOM 0 HD23 LEU A 857 14.401 -6.756 -2.119 1.00 0.00 H new ATOM 1546 N SER A 858 12.133 -8.345 2.666 1.00 0.00 N ATOM 1547 CA SER A 858 10.964 -8.696 3.463 1.00 0.00 C ATOM 1548 C SER A 858 10.076 -7.468 3.630 1.00 0.00 C ATOM 1549 O SER A 858 8.860 -7.543 3.476 1.00 0.00 O ATOM 1550 CB SER A 858 11.370 -9.244 4.832 1.00 0.00 C ATOM 1551 OG SER A 858 12.773 -9.425 4.921 1.00 0.00 O ATOM 0 H SER A 858 13.020 -8.369 3.170 1.00 0.00 H new ATOM 0 HA SER A 858 10.412 -9.479 2.942 1.00 0.00 H new ATOM 0 HB2 SER A 858 11.040 -8.559 5.613 1.00 0.00 H new ATOM 0 HB3 SER A 858 10.867 -10.195 5.009 1.00 0.00 H new ATOM 0 HG SER A 858 13.002 -9.775 5.807 1.00 0.00 H new ATOM 1557 N ALA A 859 10.705 -6.331 3.915 1.00 0.00 N ATOM 1558 CA ALA A 859 9.985 -5.074 4.055 1.00 0.00 C ATOM 1559 C ALA A 859 9.312 -4.705 2.740 1.00 0.00 C ATOM 1560 O ALA A 859 8.160 -4.272 2.717 1.00 0.00 O ATOM 1561 CB ALA A 859 10.926 -3.967 4.505 1.00 0.00 C ATOM 0 H ALA A 859 11.713 -6.257 4.053 1.00 0.00 H new ATOM 0 HA ALA A 859 9.215 -5.196 4.817 1.00 0.00 H new ATOM 0 HB1 ALA A 859 10.370 -3.035 4.604 1.00 0.00 H new ATOM 0 HB2 ALA A 859 11.365 -4.232 5.467 1.00 0.00 H new ATOM 0 HB3 ALA A 859 11.718 -3.840 3.767 1.00 0.00 H new ATOM 1567 N ALA A 860 10.038 -4.901 1.644 1.00 0.00 N ATOM 1568 CA ALA A 860 9.500 -4.654 0.313 1.00 0.00 C ATOM 1569 C ALA A 860 8.326 -5.588 0.025 1.00 0.00 C ATOM 1570 O ALA A 860 7.370 -5.211 -0.654 1.00 0.00 O ATOM 1571 CB ALA A 860 10.588 -4.817 -0.737 1.00 0.00 C ATOM 0 H ALA A 860 11.003 -5.231 1.653 1.00 0.00 H new ATOM 0 HA ALA A 860 9.135 -3.628 0.273 1.00 0.00 H new ATOM 0 HB1 ALA A 860 10.170 -4.629 -1.726 1.00 0.00 H new ATOM 0 HB2 ALA A 860 11.391 -4.107 -0.542 1.00 0.00 H new ATOM 0 HB3 ALA A 860 10.983 -5.832 -0.697 1.00 0.00 H new ATOM 1577 N LYS A 861 8.402 -6.808 0.548 1.00 0.00 N ATOM 1578 CA LYS A 861 7.316 -7.767 0.412 1.00 0.00 C ATOM 1579 C LYS A 861 6.071 -7.263 1.133 1.00 0.00 C ATOM 1580 O LYS A 861 4.964 -7.345 0.601 1.00 0.00 O ATOM 1581 CB LYS A 861 7.730 -9.132 0.966 1.00 0.00 C ATOM 1582 CG LYS A 861 7.979 -10.174 -0.111 1.00 0.00 C ATOM 1583 CD LYS A 861 9.257 -10.953 0.152 1.00 0.00 C ATOM 1584 CE LYS A 861 9.592 -11.877 -1.008 1.00 0.00 C ATOM 1585 NZ LYS A 861 8.919 -13.197 -0.878 1.00 0.00 N ATOM 0 H LYS A 861 9.207 -7.154 1.070 1.00 0.00 H new ATOM 0 HA LYS A 861 7.088 -7.878 -0.648 1.00 0.00 H new ATOM 0 HB2 LYS A 861 8.635 -9.014 1.562 1.00 0.00 H new ATOM 0 HB3 LYS A 861 6.951 -9.494 1.637 1.00 0.00 H new ATOM 0 HG2 LYS A 861 7.135 -10.862 -0.155 1.00 0.00 H new ATOM 0 HG3 LYS A 861 8.043 -9.686 -1.083 1.00 0.00 H new ATOM 0 HD2 LYS A 861 10.081 -10.259 0.316 1.00 0.00 H new ATOM 0 HD3 LYS A 861 9.147 -11.538 1.065 1.00 0.00 H new ATOM 0 HE2 LYS A 861 9.292 -11.407 -1.945 1.00 0.00 H new ATOM 0 HE3 LYS A 861 10.671 -12.023 -1.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 861 9.173 -13.797 -1.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 861 9.224 -13.657 0.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 861 7.888 -13.061 -0.858 1.00 0.00 H new ATOM 1599 N ILE A 862 6.262 -6.727 2.339 1.00 0.00 N ATOM 1600 CA ILE A 862 5.166 -6.129 3.092 1.00 0.00 C ATOM 1601 C ILE A 862 4.548 -4.988 2.297 1.00 0.00 C ATOM 1602 O ILE A 862 3.327 -4.887 2.188 1.00 0.00 O ATOM 1603 CB ILE A 862 5.622 -5.582 4.464 1.00 0.00 C ATOM 1604 CG1 ILE A 862 6.466 -6.615 5.213 1.00 0.00 C ATOM 1605 CG2 ILE A 862 4.417 -5.179 5.302 1.00 0.00 C ATOM 1606 CD1 ILE A 862 7.316 -6.010 6.309 1.00 0.00 C ATOM 0 H ILE A 862 7.165 -6.696 2.812 1.00 0.00 H new ATOM 0 HA ILE A 862 4.436 -6.920 3.264 1.00 0.00 H new ATOM 0 HB ILE A 862 6.239 -4.701 4.288 1.00 0.00 H new ATOM 0 HG12 ILE A 862 5.807 -7.367 5.647 1.00 0.00 H new ATOM 0 HG13 ILE A 862 7.113 -7.130 4.503 1.00 0.00 H new ATOM 0 HG21 ILE A 862 4.755 -4.796 6.265 1.00 0.00 H new ATOM 0 HG22 ILE A 862 3.854 -4.405 4.781 1.00 0.00 H new ATOM 0 HG23 ILE A 862 3.778 -6.047 5.461 1.00 0.00 H new ATOM 0 HD11 ILE A 862 7.889 -6.796 6.800 1.00 0.00 H new ATOM 0 HD12 ILE A 862 7.999 -5.278 5.878 1.00 0.00 H new ATOM 0 HD13 ILE A 862 6.673 -5.519 7.039 1.00 0.00 H new ATOM 1618 N LEU A 863 5.409 -4.144 1.733 1.00 0.00 N ATOM 1619 CA LEU A 863 4.973 -3.027 0.900 1.00 0.00 C ATOM 1620 C LEU A 863 4.048 -3.514 -0.213 1.00 0.00 C ATOM 1621 O LEU A 863 2.930 -3.020 -0.369 1.00 0.00 O ATOM 1622 CB LEU A 863 6.188 -2.321 0.279 1.00 0.00 C ATOM 1623 CG LEU A 863 6.606 -0.996 0.929 1.00 0.00 C ATOM 1624 CD1 LEU A 863 5.394 -0.115 1.194 1.00 0.00 C ATOM 1625 CD2 LEU A 863 7.372 -1.256 2.217 1.00 0.00 C ATOM 0 H LEU A 863 6.421 -4.214 1.840 1.00 0.00 H new ATOM 0 HA LEU A 863 4.429 -2.325 1.532 1.00 0.00 H new ATOM 0 HB2 LEU A 863 7.037 -3.004 0.316 1.00 0.00 H new ATOM 0 HB3 LEU A 863 5.975 -2.134 -0.774 1.00 0.00 H new ATOM 0 HG LEU A 863 7.261 -0.468 0.237 1.00 0.00 H new ATOM 0 HD11 LEU A 863 5.717 0.818 1.655 1.00 0.00 H new ATOM 0 HD12 LEU A 863 4.888 0.101 0.253 1.00 0.00 H new ATOM 0 HD13 LEU A 863 4.708 -0.632 1.864 1.00 0.00 H new ATOM 0 HD21 LEU A 863 7.662 -0.306 2.666 1.00 0.00 H new ATOM 0 HD22 LEU A 863 6.739 -1.808 2.912 1.00 0.00 H new ATOM 0 HD23 LEU A 863 8.265 -1.841 1.997 1.00 0.00 H new ATOM 1637 N ALA A 864 4.518 -4.500 -0.966 1.00 0.00 N ATOM 1638 CA ALA A 864 3.775 -5.023 -2.107 1.00 0.00 C ATOM 1639 C ALA A 864 2.504 -5.747 -1.672 1.00 0.00 C ATOM 1640 O ALA A 864 1.450 -5.598 -2.296 1.00 0.00 O ATOM 1641 CB ALA A 864 4.660 -5.954 -2.920 1.00 0.00 C ATOM 0 H ALA A 864 5.416 -4.957 -0.806 1.00 0.00 H new ATOM 0 HA ALA A 864 3.475 -4.177 -2.725 1.00 0.00 H new ATOM 0 HB1 ALA A 864 4.098 -6.340 -3.770 1.00 0.00 H new ATOM 0 HB2 ALA A 864 5.531 -5.406 -3.280 1.00 0.00 H new ATOM 0 HB3 ALA A 864 4.987 -6.784 -2.294 1.00 0.00 H new ATOM 1647 N ASP A 865 2.604 -6.531 -0.605 1.00 0.00 N ATOM 1648 CA ASP A 865 1.466 -7.309 -0.120 1.00 0.00 C ATOM 1649 C ASP A 865 0.365 -6.396 0.400 1.00 0.00 C ATOM 1650 O ASP A 865 -0.804 -6.556 0.049 1.00 0.00 O ATOM 1651 CB ASP A 865 1.899 -8.274 0.983 1.00 0.00 C ATOM 1652 CG ASP A 865 1.136 -9.584 0.935 1.00 0.00 C ATOM 1653 OD1 ASP A 865 -0.038 -9.584 0.504 1.00 0.00 O ATOM 1654 OD2 ASP A 865 1.708 -10.625 1.317 1.00 0.00 O ATOM 0 H ASP A 865 3.458 -6.646 -0.059 1.00 0.00 H new ATOM 0 HA ASP A 865 1.077 -7.884 -0.960 1.00 0.00 H new ATOM 0 HB2 ASP A 865 2.966 -8.474 0.889 1.00 0.00 H new ATOM 0 HB3 ASP A 865 1.747 -7.803 1.954 1.00 0.00 H new ATOM 1659 N ALA A 866 0.748 -5.428 1.221 1.00 0.00 N ATOM 1660 CA ALA A 866 -0.207 -4.486 1.783 1.00 0.00 C ATOM 1661 C ALA A 866 -0.847 -3.646 0.685 1.00 0.00 C ATOM 1662 O ALA A 866 -2.021 -3.300 0.767 1.00 0.00 O ATOM 1663 CB ALA A 866 0.470 -3.594 2.814 1.00 0.00 C ATOM 0 H ALA A 866 1.714 -5.275 1.512 1.00 0.00 H new ATOM 0 HA ALA A 866 -0.995 -5.052 2.280 1.00 0.00 H new ATOM 0 HB1 ALA A 866 -0.259 -2.895 3.225 1.00 0.00 H new ATOM 0 HB2 ALA A 866 0.875 -4.209 3.617 1.00 0.00 H new ATOM 0 HB3 ALA A 866 1.279 -3.038 2.339 1.00 0.00 H new ATOM 1669 N THR A 867 -0.071 -3.332 -0.345 1.00 0.00 N ATOM 1670 CA THR A 867 -0.581 -2.574 -1.479 1.00 0.00 C ATOM 1671 C THR A 867 -1.657 -3.365 -2.222 1.00 0.00 C ATOM 1672 O THR A 867 -2.679 -2.809 -2.627 1.00 0.00 O ATOM 1673 CB THR A 867 0.554 -2.196 -2.448 1.00 0.00 C ATOM 1674 OG1 THR A 867 1.461 -1.299 -1.795 1.00 0.00 O ATOM 1675 CG2 THR A 867 0.015 -1.541 -3.708 1.00 0.00 C ATOM 0 H THR A 867 0.913 -3.591 -0.418 1.00 0.00 H new ATOM 0 HA THR A 867 -1.024 -1.658 -1.089 1.00 0.00 H new ATOM 0 HB THR A 867 1.072 -3.111 -2.736 1.00 0.00 H new ATOM 0 HG1 THR A 867 1.905 -1.764 -1.055 1.00 0.00 H new ATOM 0 HG21 THR A 867 0.844 -1.287 -4.369 1.00 0.00 H new ATOM 0 HG22 THR A 867 -0.658 -2.231 -4.217 1.00 0.00 H new ATOM 0 HG23 THR A 867 -0.528 -0.634 -3.443 1.00 0.00 H new ATOM 1683 N ALA A 868 -1.432 -4.664 -2.384 1.00 0.00 N ATOM 1684 CA ALA A 868 -2.419 -5.526 -3.019 1.00 0.00 C ATOM 1685 C ALA A 868 -3.679 -5.585 -2.174 1.00 0.00 C ATOM 1686 O ALA A 868 -4.787 -5.514 -2.692 1.00 0.00 O ATOM 1687 CB ALA A 868 -1.864 -6.924 -3.232 1.00 0.00 C ATOM 0 H ALA A 868 -0.580 -5.140 -2.086 1.00 0.00 H new ATOM 0 HA ALA A 868 -2.663 -5.106 -3.995 1.00 0.00 H new ATOM 0 HB1 ALA A 868 -2.621 -7.547 -3.708 1.00 0.00 H new ATOM 0 HB2 ALA A 868 -0.983 -6.872 -3.871 1.00 0.00 H new ATOM 0 HB3 ALA A 868 -1.589 -7.357 -2.270 1.00 0.00 H new ATOM 1693 N LYS A 869 -3.495 -5.704 -0.864 1.00 0.00 N ATOM 1694 CA LYS A 869 -4.610 -5.686 0.070 1.00 0.00 C ATOM 1695 C LYS A 869 -5.348 -4.356 -0.015 1.00 0.00 C ATOM 1696 O LYS A 869 -6.577 -4.315 0.007 1.00 0.00 O ATOM 1697 CB LYS A 869 -4.110 -5.923 1.498 1.00 0.00 C ATOM 1698 CG LYS A 869 -5.136 -6.583 2.406 1.00 0.00 C ATOM 1699 CD LYS A 869 -5.441 -8.005 1.965 1.00 0.00 C ATOM 1700 CE LYS A 869 -4.553 -9.017 2.668 1.00 0.00 C ATOM 1701 NZ LYS A 869 -4.053 -10.055 1.728 1.00 0.00 N ATOM 0 H LYS A 869 -2.581 -5.814 -0.426 1.00 0.00 H new ATOM 0 HA LYS A 869 -5.300 -6.487 -0.196 1.00 0.00 H new ATOM 0 HB2 LYS A 869 -3.217 -6.546 1.461 1.00 0.00 H new ATOM 0 HB3 LYS A 869 -3.815 -4.968 1.933 1.00 0.00 H new ATOM 0 HG2 LYS A 869 -4.764 -6.591 3.431 1.00 0.00 H new ATOM 0 HG3 LYS A 869 -6.055 -5.996 2.405 1.00 0.00 H new ATOM 0 HD2 LYS A 869 -6.487 -8.233 2.172 1.00 0.00 H new ATOM 0 HD3 LYS A 869 -5.304 -8.088 0.887 1.00 0.00 H new ATOM 0 HE2 LYS A 869 -3.708 -8.503 3.126 1.00 0.00 H new ATOM 0 HE3 LYS A 869 -5.111 -9.494 3.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 869 -3.450 -10.728 2.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 869 -4.859 -10.562 1.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 869 -3.499 -9.602 0.973 1.00 0.00 H new ATOM 1715 N MET A 870 -4.586 -3.276 -0.125 1.00 0.00 N ATOM 1716 CA MET A 870 -5.147 -1.938 -0.252 1.00 0.00 C ATOM 1717 C MET A 870 -5.993 -1.827 -1.512 1.00 0.00 C ATOM 1718 O MET A 870 -7.144 -1.392 -1.460 1.00 0.00 O ATOM 1719 CB MET A 870 -4.030 -0.891 -0.275 1.00 0.00 C ATOM 1720 CG MET A 870 -4.096 0.087 0.886 1.00 0.00 C ATOM 1721 SD MET A 870 -4.469 1.775 0.376 1.00 0.00 S ATOM 1722 CE MET A 870 -6.219 1.648 0.036 1.00 0.00 C ATOM 0 H MET A 870 -3.566 -3.302 -0.129 1.00 0.00 H new ATOM 0 HA MET A 870 -5.786 -1.753 0.612 1.00 0.00 H new ATOM 0 HB2 MET A 870 -3.066 -1.399 -0.258 1.00 0.00 H new ATOM 0 HB3 MET A 870 -4.082 -0.336 -1.212 1.00 0.00 H new ATOM 0 HG2 MET A 870 -4.856 -0.248 1.592 1.00 0.00 H new ATOM 0 HG3 MET A 870 -3.143 0.077 1.415 1.00 0.00 H new ATOM 0 HE1 MET A 870 -6.428 2.054 -0.954 1.00 0.00 H new ATOM 0 HE2 MET A 870 -6.521 0.601 0.070 1.00 0.00 H new ATOM 0 HE3 MET A 870 -6.777 2.211 0.784 1.00 0.00 H new ATOM 1732 N VAL A 871 -5.422 -2.237 -2.637 1.00 0.00 N ATOM 1733 CA VAL A 871 -6.129 -2.195 -3.908 1.00 0.00 C ATOM 1734 C VAL A 871 -7.335 -3.139 -3.888 1.00 0.00 C ATOM 1735 O VAL A 871 -8.402 -2.801 -4.395 1.00 0.00 O ATOM 1736 CB VAL A 871 -5.177 -2.517 -5.096 1.00 0.00 C ATOM 1737 CG1 VAL A 871 -5.387 -3.920 -5.653 1.00 0.00 C ATOM 1738 CG2 VAL A 871 -5.341 -1.482 -6.196 1.00 0.00 C ATOM 0 H VAL A 871 -4.471 -2.602 -2.694 1.00 0.00 H new ATOM 0 HA VAL A 871 -6.499 -1.180 -4.055 1.00 0.00 H new ATOM 0 HB VAL A 871 -4.159 -2.479 -4.709 1.00 0.00 H new ATOM 0 HG11 VAL A 871 -4.697 -4.090 -6.479 1.00 0.00 H new ATOM 0 HG12 VAL A 871 -5.203 -4.654 -4.869 1.00 0.00 H new ATOM 0 HG13 VAL A 871 -6.412 -4.020 -6.010 1.00 0.00 H new ATOM 0 HG21 VAL A 871 -4.669 -1.719 -7.021 1.00 0.00 H new ATOM 0 HG22 VAL A 871 -6.371 -1.490 -6.553 1.00 0.00 H new ATOM 0 HG23 VAL A 871 -5.100 -0.494 -5.804 1.00 0.00 H new ATOM 1748 N GLU A 872 -7.166 -4.300 -3.261 1.00 0.00 N ATOM 1749 CA GLU A 872 -8.226 -5.294 -3.170 1.00 0.00 C ATOM 1750 C GLU A 872 -9.393 -4.764 -2.341 1.00 0.00 C ATOM 1751 O GLU A 872 -10.555 -4.876 -2.738 1.00 0.00 O ATOM 1752 CB GLU A 872 -7.679 -6.582 -2.545 1.00 0.00 C ATOM 1753 CG GLU A 872 -8.372 -7.842 -3.032 1.00 0.00 C ATOM 1754 CD GLU A 872 -9.140 -8.541 -1.932 1.00 0.00 C ATOM 1755 OE1 GLU A 872 -8.559 -8.772 -0.849 1.00 0.00 O ATOM 1756 OE2 GLU A 872 -10.332 -8.862 -2.140 1.00 0.00 O ATOM 0 H GLU A 872 -6.296 -4.575 -2.805 1.00 0.00 H new ATOM 0 HA GLU A 872 -8.589 -5.508 -4.175 1.00 0.00 H new ATOM 0 HB2 GLU A 872 -6.614 -6.657 -2.764 1.00 0.00 H new ATOM 0 HB3 GLU A 872 -7.778 -6.520 -1.461 1.00 0.00 H new ATOM 0 HG2 GLU A 872 -9.055 -7.587 -3.843 1.00 0.00 H new ATOM 0 HG3 GLU A 872 -7.629 -8.526 -3.444 1.00 0.00 H new ATOM 1763 N ALA A 873 -9.075 -4.180 -1.195 1.00 0.00 N ATOM 1764 CA ALA A 873 -10.089 -3.649 -0.296 1.00 0.00 C ATOM 1765 C ALA A 873 -10.780 -2.433 -0.899 1.00 0.00 C ATOM 1766 O ALA A 873 -11.994 -2.280 -0.776 1.00 0.00 O ATOM 1767 CB ALA A 873 -9.469 -3.296 1.046 1.00 0.00 C ATOM 0 H ALA A 873 -8.117 -4.062 -0.864 1.00 0.00 H new ATOM 0 HA ALA A 873 -10.844 -4.421 -0.145 1.00 0.00 H new ATOM 0 HB1 ALA A 873 -10.238 -2.900 1.709 1.00 0.00 H new ATOM 0 HB2 ALA A 873 -9.031 -4.190 1.491 1.00 0.00 H new ATOM 0 HB3 ALA A 873 -8.692 -2.545 0.902 1.00 0.00 H new ATOM 1773 N ALA A 874 -10.003 -1.576 -1.556 1.00 0.00 N ATOM 1774 CA ALA A 874 -10.545 -0.371 -2.173 1.00 0.00 C ATOM 1775 C ALA A 874 -11.446 -0.715 -3.353 1.00 0.00 C ATOM 1776 O ALA A 874 -12.522 -0.141 -3.508 1.00 0.00 O ATOM 1777 CB ALA A 874 -9.422 0.554 -2.620 1.00 0.00 C ATOM 0 H ALA A 874 -8.997 -1.694 -1.674 1.00 0.00 H new ATOM 0 HA ALA A 874 -11.147 0.145 -1.425 1.00 0.00 H new ATOM 0 HB1 ALA A 874 -9.847 1.447 -3.078 1.00 0.00 H new ATOM 0 HB2 ALA A 874 -8.821 0.840 -1.757 1.00 0.00 H new ATOM 0 HB3 ALA A 874 -8.793 0.038 -3.346 1.00 0.00 H new ATOM 1783 N LYS A 875 -11.007 -1.661 -4.175 1.00 0.00 N ATOM 1784 CA LYS A 875 -11.780 -2.081 -5.335 1.00 0.00 C ATOM 1785 C LYS A 875 -13.043 -2.820 -4.901 1.00 0.00 C ATOM 1786 O LYS A 875 -14.097 -2.687 -5.525 1.00 0.00 O ATOM 1787 CB LYS A 875 -10.937 -2.976 -6.245 1.00 0.00 C ATOM 1788 CG LYS A 875 -10.177 -2.215 -7.321 1.00 0.00 C ATOM 1789 CD LYS A 875 -8.840 -2.874 -7.628 1.00 0.00 C ATOM 1790 CE LYS A 875 -8.747 -3.305 -9.084 1.00 0.00 C ATOM 1791 NZ LYS A 875 -8.657 -4.783 -9.220 1.00 0.00 N ATOM 0 H LYS A 875 -10.120 -2.151 -4.059 1.00 0.00 H new ATOM 0 HA LYS A 875 -12.071 -1.189 -5.890 1.00 0.00 H new ATOM 0 HB2 LYS A 875 -10.225 -3.531 -5.634 1.00 0.00 H new ATOM 0 HB3 LYS A 875 -11.588 -3.709 -6.722 1.00 0.00 H new ATOM 0 HG2 LYS A 875 -10.778 -2.168 -8.229 1.00 0.00 H new ATOM 0 HG3 LYS A 875 -10.012 -1.188 -6.995 1.00 0.00 H new ATOM 0 HD2 LYS A 875 -8.031 -2.179 -7.402 1.00 0.00 H new ATOM 0 HD3 LYS A 875 -8.705 -3.742 -6.982 1.00 0.00 H new ATOM 0 HE2 LYS A 875 -9.621 -2.943 -9.626 1.00 0.00 H new ATOM 0 HE3 LYS A 875 -7.873 -2.844 -9.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 875 -8.980 -5.065 -10.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 875 -7.671 -5.084 -9.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 875 -9.257 -5.235 -8.501 1.00 0.00 H new ATOM 1805 N GLY A 876 -12.932 -3.586 -3.821 1.00 0.00 N ATOM 1806 CA GLY A 876 -14.080 -4.296 -3.286 1.00 0.00 C ATOM 1807 C GLY A 876 -15.059 -3.364 -2.597 1.00 0.00 C ATOM 1808 O GLY A 876 -16.216 -3.719 -2.360 1.00 0.00 O ATOM 0 H GLY A 876 -12.064 -3.728 -3.305 1.00 0.00 H new ATOM 0 HA2 GLY A 876 -14.589 -4.822 -4.094 1.00 0.00 H new ATOM 0 HA3 GLY A 876 -13.740 -5.052 -2.578 1.00 0.00 H new ATOM 1812 N ALA A 877 -14.592 -2.163 -2.277 1.00 0.00 N ATOM 1813 CA ALA A 877 -15.429 -1.151 -1.652 1.00 0.00 C ATOM 1814 C ALA A 877 -15.973 -0.192 -2.702 1.00 0.00 C ATOM 1815 O ALA A 877 -16.440 0.901 -2.382 1.00 0.00 O ATOM 1816 CB ALA A 877 -14.645 -0.394 -0.589 1.00 0.00 C ATOM 0 H ALA A 877 -13.630 -1.867 -2.443 1.00 0.00 H new ATOM 0 HA ALA A 877 -16.271 -1.646 -1.168 1.00 0.00 H new ATOM 0 HB1 ALA A 877 -15.286 0.359 -0.131 1.00 0.00 H new ATOM 0 HB2 ALA A 877 -14.302 -1.091 0.175 1.00 0.00 H new ATOM 0 HB3 ALA A 877 -13.785 0.093 -1.049 1.00 0.00 H new ATOM 1822 N ALA A 878 -15.900 -0.611 -3.955 1.00 0.00 N ATOM 1823 CA ALA A 878 -16.400 0.187 -5.061 1.00 0.00 C ATOM 1824 C ALA A 878 -17.681 -0.421 -5.621 1.00 0.00 C ATOM 1825 O ALA A 878 -18.216 -1.378 -5.058 1.00 0.00 O ATOM 1826 CB ALA A 878 -15.340 0.299 -6.143 1.00 0.00 C ATOM 0 H ALA A 878 -15.496 -1.506 -4.232 1.00 0.00 H new ATOM 0 HA ALA A 878 -16.631 1.188 -4.697 1.00 0.00 H new ATOM 0 HB1 ALA A 878 -15.724 0.899 -6.968 1.00 0.00 H new ATOM 0 HB2 ALA A 878 -14.450 0.775 -5.732 1.00 0.00 H new ATOM 0 HB3 ALA A 878 -15.085 -0.696 -6.507 1.00 0.00 H new ATOM 1832 N ALA A 879 -18.162 0.121 -6.733 1.00 0.00 N ATOM 1833 CA ALA A 879 -19.391 -0.363 -7.349 1.00 0.00 C ATOM 1834 C ALA A 879 -19.106 -1.515 -8.312 1.00 0.00 C ATOM 1835 O ALA A 879 -19.524 -1.490 -9.473 1.00 0.00 O ATOM 1836 CB ALA A 879 -20.105 0.773 -8.068 1.00 0.00 C ATOM 0 H ALA A 879 -17.720 0.896 -7.227 1.00 0.00 H new ATOM 0 HA ALA A 879 -20.042 -0.740 -6.560 1.00 0.00 H new ATOM 0 HB1 ALA A 879 -21.021 0.397 -8.523 1.00 0.00 H new ATOM 0 HB2 ALA A 879 -20.351 1.558 -7.353 1.00 0.00 H new ATOM 0 HB3 ALA A 879 -19.455 1.179 -8.843 1.00 0.00 H new ATOM 1842 N HIS A 880 -18.379 -2.515 -7.830 1.00 0.00 N ATOM 1843 CA HIS A 880 -18.057 -3.694 -8.626 1.00 0.00 C ATOM 1844 C HIS A 880 -17.436 -4.772 -7.755 1.00 0.00 C ATOM 1845 O HIS A 880 -16.696 -4.469 -6.823 1.00 0.00 O ATOM 1846 CB HIS A 880 -17.101 -3.362 -9.788 1.00 0.00 C ATOM 1847 CG HIS A 880 -15.933 -2.487 -9.427 1.00 0.00 C ATOM 1848 ND1 HIS A 880 -14.761 -2.964 -8.870 1.00 0.00 N ATOM 1849 CD2 HIS A 880 -15.755 -1.154 -9.580 1.00 0.00 C ATOM 1850 CE1 HIS A 880 -13.921 -1.960 -8.696 1.00 0.00 C ATOM 1851 NE2 HIS A 880 -14.499 -0.853 -9.119 1.00 0.00 N ATOM 0 H HIS A 880 -17.998 -2.533 -6.884 1.00 0.00 H new ATOM 0 HA HIS A 880 -18.993 -4.058 -9.049 1.00 0.00 H new ATOM 0 HB2 HIS A 880 -16.720 -4.296 -10.202 1.00 0.00 H new ATOM 0 HB3 HIS A 880 -17.671 -2.872 -10.577 1.00 0.00 H new ATOM 0 HD2 HIS A 880 -16.470 -0.456 -9.990 1.00 0.00 H new ATOM 0 HE1 HIS A 880 -12.928 -2.033 -8.278 1.00 0.00 H new ATOM 0 HE2 HIS A 880 -14.080 0.077 -9.106 1.00 0.00 H new ATOM 1860 N PRO A 881 -17.723 -6.048 -8.057 1.00 0.00 N ATOM 1861 CA PRO A 881 -17.129 -7.189 -7.357 1.00 0.00 C ATOM 1862 C PRO A 881 -15.689 -7.421 -7.796 1.00 0.00 C ATOM 1863 O PRO A 881 -15.036 -8.365 -7.344 1.00 0.00 O ATOM 1864 CB PRO A 881 -18.009 -8.381 -7.771 1.00 0.00 C ATOM 1865 CG PRO A 881 -19.143 -7.805 -8.560 1.00 0.00 C ATOM 1866 CD PRO A 881 -18.660 -6.488 -9.094 1.00 0.00 C ATOM 0 HA PRO A 881 -17.095 -7.035 -6.278 1.00 0.00 H new ATOM 0 HB2 PRO A 881 -17.442 -9.095 -8.368 1.00 0.00 H new ATOM 0 HB3 PRO A 881 -18.376 -8.917 -6.896 1.00 0.00 H new ATOM 0 HG2 PRO A 881 -19.429 -8.472 -9.373 1.00 0.00 H new ATOM 0 HG3 PRO A 881 -20.024 -7.670 -7.933 1.00 0.00 H new ATOM 0 HD2 PRO A 881 -18.171 -6.598 -10.062 1.00 0.00 H new ATOM 0 HD3 PRO A 881 -19.478 -5.780 -9.228 1.00 0.00 H new ATOM 1874 N ASP A 882 -15.227 -6.554 -8.705 1.00 0.00 N ATOM 1875 CA ASP A 882 -13.883 -6.615 -9.291 1.00 0.00 C ATOM 1876 C ASP A 882 -13.798 -7.728 -10.319 1.00 0.00 C ATOM 1877 O ASP A 882 -13.257 -7.551 -11.411 1.00 0.00 O ATOM 1878 CB ASP A 882 -12.800 -6.782 -8.225 1.00 0.00 C ATOM 1879 CG ASP A 882 -11.737 -5.717 -8.339 1.00 0.00 C ATOM 1880 OD1 ASP A 882 -12.044 -4.622 -8.851 1.00 0.00 O ATOM 1881 OD2 ASP A 882 -10.590 -5.966 -7.919 1.00 0.00 O ATOM 0 H ASP A 882 -15.786 -5.778 -9.060 1.00 0.00 H new ATOM 0 HA ASP A 882 -13.703 -5.662 -9.789 1.00 0.00 H new ATOM 0 HB2 ASP A 882 -13.254 -6.739 -7.235 1.00 0.00 H new ATOM 0 HB3 ASP A 882 -12.341 -7.766 -8.323 1.00 0.00 H new ATOM 1886 N SER A 883 -14.337 -8.869 -9.953 1.00 0.00 N ATOM 1887 CA SER A 883 -14.509 -9.974 -10.868 1.00 0.00 C ATOM 1888 C SER A 883 -15.628 -9.653 -11.852 1.00 0.00 C ATOM 1889 O SER A 883 -16.743 -9.309 -11.447 1.00 0.00 O ATOM 1890 CB SER A 883 -14.844 -11.239 -10.081 1.00 0.00 C ATOM 1891 OG SER A 883 -13.940 -11.419 -9.001 1.00 0.00 O ATOM 0 H SER A 883 -14.670 -9.057 -9.007 1.00 0.00 H new ATOM 0 HA SER A 883 -13.586 -10.137 -11.424 1.00 0.00 H new ATOM 0 HB2 SER A 883 -15.863 -11.176 -9.700 1.00 0.00 H new ATOM 0 HB3 SER A 883 -14.804 -12.105 -10.742 1.00 0.00 H new ATOM 0 HG SER A 883 -14.175 -12.234 -8.510 1.00 0.00 H new ATOM 1897 N GLU A 884 -15.335 -9.766 -13.137 1.00 0.00 N ATOM 1898 CA GLU A 884 -16.302 -9.435 -14.174 1.00 0.00 C ATOM 1899 C GLU A 884 -17.240 -10.610 -14.428 1.00 0.00 C ATOM 1900 O GLU A 884 -17.358 -11.102 -15.554 1.00 0.00 O ATOM 1901 CB GLU A 884 -15.590 -9.037 -15.467 1.00 0.00 C ATOM 1902 CG GLU A 884 -14.323 -8.229 -15.247 1.00 0.00 C ATOM 1903 CD GLU A 884 -13.479 -8.142 -16.497 1.00 0.00 C ATOM 1904 OE1 GLU A 884 -14.024 -7.777 -17.563 1.00 0.00 O ATOM 1905 OE2 GLU A 884 -12.269 -8.448 -16.429 1.00 0.00 O ATOM 0 H GLU A 884 -14.433 -10.085 -13.489 1.00 0.00 H new ATOM 0 HA GLU A 884 -16.894 -8.587 -13.829 1.00 0.00 H new ATOM 0 HB2 GLU A 884 -15.342 -9.939 -16.026 1.00 0.00 H new ATOM 0 HB3 GLU A 884 -16.276 -8.458 -16.085 1.00 0.00 H new ATOM 0 HG2 GLU A 884 -14.587 -7.224 -14.918 1.00 0.00 H new ATOM 0 HG3 GLU A 884 -13.739 -8.683 -14.447 1.00 0.00 H new ATOM 1912 N GLU A 885 -17.889 -11.060 -13.368 1.00 0.00 N ATOM 1913 CA GLU A 885 -18.853 -12.143 -13.447 1.00 0.00 C ATOM 1914 C GLU A 885 -19.997 -11.876 -12.480 1.00 0.00 C ATOM 1915 O GLU A 885 -20.451 -12.767 -11.760 1.00 0.00 O ATOM 1916 CB GLU A 885 -18.183 -13.482 -13.137 1.00 0.00 C ATOM 1917 CG GLU A 885 -17.933 -14.330 -14.373 1.00 0.00 C ATOM 1918 CD GLU A 885 -17.989 -15.815 -14.089 1.00 0.00 C ATOM 1919 OE1 GLU A 885 -18.887 -16.251 -13.336 1.00 0.00 O ATOM 1920 OE2 GLU A 885 -17.128 -16.556 -14.608 1.00 0.00 O ATOM 0 H GLU A 885 -17.762 -10.684 -12.428 1.00 0.00 H new ATOM 0 HA GLU A 885 -19.251 -12.195 -14.461 1.00 0.00 H new ATOM 0 HB2 GLU A 885 -17.234 -13.297 -12.634 1.00 0.00 H new ATOM 0 HB3 GLU A 885 -18.809 -14.041 -12.442 1.00 0.00 H new ATOM 0 HG2 GLU A 885 -18.674 -14.082 -15.133 1.00 0.00 H new ATOM 0 HG3 GLU A 885 -16.956 -14.081 -14.787 1.00 0.00 H new ATOM 1927 N GLN A 886 -20.449 -10.630 -12.468 1.00 0.00 N ATOM 1928 CA GLN A 886 -21.528 -10.210 -11.583 1.00 0.00 C ATOM 1929 C GLN A 886 -22.869 -10.617 -12.171 1.00 0.00 C ATOM 1930 O GLN A 886 -23.793 -10.986 -11.450 1.00 0.00 O ATOM 1931 CB GLN A 886 -21.487 -8.694 -11.362 1.00 0.00 C ATOM 1932 CG GLN A 886 -21.018 -7.908 -12.578 1.00 0.00 C ATOM 1933 CD GLN A 886 -21.273 -6.420 -12.451 1.00 0.00 C ATOM 1934 OE1 GLN A 886 -20.997 -5.816 -11.414 1.00 0.00 O ATOM 1935 NE2 GLN A 886 -21.803 -5.821 -13.507 1.00 0.00 N ATOM 0 H GLN A 886 -20.083 -9.888 -13.065 1.00 0.00 H new ATOM 0 HA GLN A 886 -21.397 -10.701 -10.619 1.00 0.00 H new ATOM 0 HB2 GLN A 886 -22.482 -8.350 -11.081 1.00 0.00 H new ATOM 0 HB3 GLN A 886 -20.826 -8.476 -10.523 1.00 0.00 H new ATOM 0 HG2 GLN A 886 -19.951 -8.078 -12.725 1.00 0.00 H new ATOM 0 HG3 GLN A 886 -21.526 -8.284 -13.466 1.00 0.00 H new ATOM 0 HE21 GLN A 886 -22.016 -6.361 -14.346 1.00 0.00 H new ATOM 0 HE22 GLN A 886 -21.998 -4.820 -13.481 1.00 0.00 H new ATOM 1944 N GLN A 887 -22.955 -10.555 -13.489 1.00 0.00 N ATOM 1945 CA GLN A 887 -24.152 -10.948 -14.209 1.00 0.00 C ATOM 1946 C GLN A 887 -23.776 -11.311 -15.635 1.00 0.00 C ATOM 1947 O GLN A 887 -23.405 -10.445 -16.428 1.00 0.00 O ATOM 1948 CB GLN A 887 -25.186 -9.819 -14.202 1.00 0.00 C ATOM 1949 CG GLN A 887 -26.621 -10.312 -14.117 1.00 0.00 C ATOM 1950 CD GLN A 887 -26.868 -11.171 -12.893 1.00 0.00 C ATOM 1951 OE1 GLN A 887 -27.072 -12.382 -12.997 1.00 0.00 O ATOM 1952 NE2 GLN A 887 -26.845 -10.553 -11.724 1.00 0.00 N ATOM 0 H GLN A 887 -22.197 -10.231 -14.089 1.00 0.00 H new ATOM 0 HA GLN A 887 -24.598 -11.812 -13.717 1.00 0.00 H new ATOM 0 HB2 GLN A 887 -24.986 -9.159 -13.358 1.00 0.00 H new ATOM 0 HB3 GLN A 887 -25.068 -9.223 -15.107 1.00 0.00 H new ATOM 0 HG2 GLN A 887 -27.295 -9.456 -14.098 1.00 0.00 H new ATOM 0 HG3 GLN A 887 -26.859 -10.885 -15.013 1.00 0.00 H new ATOM 0 HE21 GLN A 887 -26.673 -9.549 -11.681 1.00 0.00 H new ATOM 0 HE22 GLN A 887 -27.000 -11.081 -10.865 1.00 0.00 H new ATOM 1961 N GLN A 888 -23.854 -12.591 -15.947 1.00 0.00 N ATOM 1962 CA GLN A 888 -23.399 -13.087 -17.233 1.00 0.00 C ATOM 1963 C GLN A 888 -24.491 -12.961 -18.284 1.00 0.00 C ATOM 1964 O GLN A 888 -25.682 -13.015 -17.972 1.00 0.00 O ATOM 1965 CB GLN A 888 -22.946 -14.541 -17.106 1.00 0.00 C ATOM 1966 CG GLN A 888 -21.674 -14.708 -16.289 1.00 0.00 C ATOM 1967 CD GLN A 888 -20.632 -13.655 -16.608 1.00 0.00 C ATOM 1968 OE1 GLN A 888 -20.542 -12.629 -15.933 1.00 0.00 O ATOM 1969 NE2 GLN A 888 -19.840 -13.898 -17.637 1.00 0.00 N ATOM 0 H GLN A 888 -24.229 -13.308 -15.326 1.00 0.00 H new ATOM 0 HA GLN A 888 -22.552 -12.480 -17.553 1.00 0.00 H new ATOM 0 HB2 GLN A 888 -23.744 -15.124 -16.645 1.00 0.00 H new ATOM 0 HB3 GLN A 888 -22.786 -14.952 -18.103 1.00 0.00 H new ATOM 0 HG2 GLN A 888 -21.920 -14.661 -15.228 1.00 0.00 H new ATOM 0 HG3 GLN A 888 -21.255 -15.697 -16.475 1.00 0.00 H new ATOM 0 HE21 GLN A 888 -19.947 -14.761 -18.171 1.00 0.00 H new ATOM 0 HE22 GLN A 888 -19.121 -13.223 -17.898 1.00 0.00 H new ATOM 1978 N ARG A 889 -24.075 -12.765 -19.522 1.00 0.00 N ATOM 1979 CA ARG A 889 -24.999 -12.672 -20.640 1.00 0.00 C ATOM 1980 C ARG A 889 -24.411 -13.401 -21.838 1.00 0.00 C ATOM 1981 O ARG A 889 -24.598 -12.936 -22.983 1.00 0.00 O ATOM 1982 CB ARG A 889 -25.294 -11.207 -20.999 1.00 0.00 C ATOM 1983 CG ARG A 889 -24.499 -10.192 -20.192 1.00 0.00 C ATOM 1984 CD ARG A 889 -23.964 -9.077 -21.072 1.00 0.00 C ATOM 1985 NE ARG A 889 -22.955 -8.273 -20.383 1.00 0.00 N ATOM 1986 CZ ARG A 889 -21.646 -8.346 -20.628 1.00 0.00 C ATOM 1987 NH1 ARG A 889 -21.185 -9.197 -21.540 1.00 0.00 N ATOM 1988 NH2 ARG A 889 -20.797 -7.579 -19.953 1.00 0.00 N ATOM 1989 OXT ARG A 889 -23.736 -14.428 -21.626 1.00 0.00 O ATOM 0 H ARG A 889 -23.093 -12.666 -19.781 1.00 0.00 H new ATOM 0 HA ARG A 889 -25.942 -13.137 -20.354 1.00 0.00 H new ATOM 0 HB2 ARG A 889 -25.085 -11.056 -22.058 1.00 0.00 H new ATOM 0 HB3 ARG A 889 -26.357 -11.017 -20.854 1.00 0.00 H new ATOM 0 HG2 ARG A 889 -25.132 -9.769 -19.412 1.00 0.00 H new ATOM 0 HG3 ARG A 889 -23.669 -10.692 -19.692 1.00 0.00 H new ATOM 0 HD2 ARG A 889 -23.531 -9.505 -21.977 1.00 0.00 H new ATOM 0 HD3 ARG A 889 -24.787 -8.435 -21.385 1.00 0.00 H new ATOM 0 HE ARG A 889 -23.272 -7.615 -19.671 1.00 0.00 H new ATOM 0 HH11 ARG A 889 -21.833 -9.795 -22.053 1.00 0.00 H new ATOM 0 HH12 ARG A 889 -20.184 -9.252 -21.726 1.00 0.00 H new ATOM 0 HH21 ARG A 889 -21.146 -6.932 -19.245 1.00 0.00 H new ATOM 0 HH22 ARG A 889 -19.796 -7.637 -20.142 1.00 0.00 H new TER 2003 ARG A 889