USER MOD reduce.3.24.130724 H: found=0, std=0, add=726, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 732 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 867 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 872 SER OG : rot 180:sc= -0.164 USER MOD Set 2.1: A 841 ASN : amide:sc= 1.13 K(o=0.71,f=-2.8) USER MOD Set 2.2: A 880 MET CE :methyl 140:sc= -0.424 (180deg=-1.07) USER MOD Set 3.1: A 830 MET CE :methyl -124:sc= 0 (180deg=-0.0368) USER MOD Set 3.2: A 879 TYR OH : rot 38:sc= 0.535 USER MOD Single : A 823 THR OG1 : rot -37:sc= 0.817 USER MOD Single : A 825 THR OG1 : rot 180:sc= 0 USER MOD Single : A 828 GLN : amide:sc= -0.0513 X(o=-0.051,f=-0.43) USER MOD Single : A 832 SER OG : rot 82:sc= 1.3 USER MOD Single : A 834 LYS NZ :NH3+ -176:sc= 1.27 (180deg=1.18) USER MOD Single : A 840 LYS NZ :NH3+ -176:sc= 0.807 (180deg=0.795) USER MOD Single : A 842 TYR OH : rot 30:sc= 0 USER MOD Single : A 844 THR OG1 : rot 180:sc= 0.122 USER MOD Single : A 845 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 856 GLN : amide:sc=-0.00137 X(o=-0.0014,f=-0.022) USER MOD Single : A 859 TYR OH : rot 180:sc= 0 USER MOD Single : A 860 CYS SG : rot -70:sc= 0.467 USER MOD Single : A 864 MET CE :methyl -166:sc= 0 (180deg=-0.25) USER MOD Single : A 868 THR OG1 : rot 62:sc= 1.27 USER MOD Single : A 881 SER OG : rot -120:sc= -0.643 USER MOD Single : A 883 SER OG : rot -167:sc= 1.52 USER MOD Single : A 884 THR OG1 : rot 73:sc= 1.24 USER MOD Single : A 887 TYR OH : rot 180:sc= 0 USER MOD Single : A 890 SER OG : rot 180:sc= 0 USER MOD Single : B1647 LYS NZ :NH3+ -137:sc= 2.49 (180deg=1.78) USER MOD Single : B1649 TYR OH : rot 180:sc= 0 USER MOD Single : B1651 THR OG1 : rot 180:sc= -0.0592 USER MOD Single : B1655 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B1657 TYR OH : rot 180:sc= 0 USER MOD Single : B1660 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B1662 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0718) USER MOD Single : B1663 LYS NZ :NH3+ 158:sc= -0.155 (180deg=-0.654) USER MOD Single : B1665 LYS NZ :NH3+ 147:sc= 1.17 (180deg=-1.68!) USER MOD Single : B1667 GLN : amide:sc= -0.101 X(o=-0.1,f=-0.14) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 822 -14.844 -8.361 -5.820 1.00 10.00 N ATOM 2 CA ASP A 822 -16.149 -8.429 -6.522 1.00 10.00 C ATOM 3 C ASP A 822 -16.532 -7.060 -7.101 1.00 10.00 C ATOM 4 O ASP A 822 -16.175 -6.733 -8.236 1.00 10.00 O ATOM 5 CB ASP A 822 -17.235 -8.947 -5.569 1.00 10.00 C ATOM 6 CG ASP A 822 -18.551 -9.206 -6.278 1.00 10.00 C ATOM 7 OD1 ASP A 822 -18.804 -10.365 -6.675 1.00 10.00 O ATOM 8 OD2 ASP A 822 -19.339 -8.253 -6.449 1.00 10.00 O ATOM 0 HA ASP A 822 -16.059 -9.126 -7.355 1.00 10.00 H new ATOM 0 HB2 ASP A 822 -16.892 -9.868 -5.098 1.00 10.00 H new ATOM 0 HB3 ASP A 822 -17.392 -8.220 -4.772 1.00 10.00 H new ATOM 15 N THR A 823 -17.250 -6.258 -6.323 1.00 10.00 N ATOM 16 CA THR A 823 -17.661 -4.927 -6.764 1.00 10.00 C ATOM 17 C THR A 823 -16.620 -3.898 -6.347 1.00 10.00 C ATOM 18 O THR A 823 -16.673 -2.730 -6.743 1.00 10.00 O ATOM 19 CB THR A 823 -19.034 -4.542 -6.175 1.00 10.00 C ATOM 20 OG1 THR A 823 -19.690 -5.704 -5.628 1.00 10.00 O ATOM 21 CG2 THR A 823 -19.912 -3.905 -7.245 1.00 10.00 C ATOM 0 H THR A 823 -17.560 -6.505 -5.383 1.00 10.00 H new ATOM 0 HA THR A 823 -17.746 -4.944 -7.851 1.00 10.00 H new ATOM 0 HB THR A 823 -18.874 -3.819 -5.375 1.00 10.00 H new ATOM 0 HG1 THR A 823 -19.501 -6.482 -6.193 1.00 10.00 H new ATOM 0 HG21 THR A 823 -20.877 -3.639 -6.813 1.00 10.00 H new ATOM 0 HG22 THR A 823 -19.426 -3.007 -7.627 1.00 10.00 H new ATOM 0 HG23 THR A 823 -20.062 -4.612 -8.061 1.00 10.00 H new ATOM 29 N ASP A 824 -15.668 -4.356 -5.556 1.00 10.00 N ATOM 30 CA ASP A 824 -14.594 -3.505 -5.074 1.00 10.00 C ATOM 31 C ASP A 824 -13.464 -3.402 -6.094 1.00 10.00 C ATOM 32 O ASP A 824 -13.601 -3.832 -7.239 1.00 10.00 O ATOM 33 CB ASP A 824 -14.054 -4.069 -3.764 1.00 10.00 C ATOM 34 CG ASP A 824 -13.350 -5.411 -3.944 1.00 10.00 C ATOM 35 OD1 ASP A 824 -14.032 -6.413 -4.247 1.00 10.00 O ATOM 36 OD2 ASP A 824 -12.102 -5.461 -3.779 1.00 10.00 O ATOM 0 H ASP A 824 -15.616 -5.321 -5.231 1.00 10.00 H new ATOM 0 HA ASP A 824 -14.995 -2.504 -4.915 1.00 10.00 H new ATOM 0 HB2 ASP A 824 -13.357 -3.354 -3.326 1.00 10.00 H new ATOM 0 HB3 ASP A 824 -14.876 -4.187 -3.058 1.00 10.00 H new ATOM 41 N THR A 825 -12.334 -2.874 -5.662 1.00 10.00 N ATOM 42 CA THR A 825 -11.187 -2.728 -6.535 1.00 10.00 C ATOM 43 C THR A 825 -9.929 -3.146 -5.795 1.00 10.00 C ATOM 44 O THR A 825 -8.809 -2.990 -6.271 1.00 10.00 O ATOM 45 CB THR A 825 -11.045 -1.269 -7.032 1.00 10.00 C ATOM 46 OG1 THR A 825 -12.341 -0.658 -7.166 1.00 10.00 O ATOM 47 CG2 THR A 825 -10.311 -1.207 -8.373 1.00 10.00 C ATOM 0 H THR A 825 -12.187 -2.539 -4.710 1.00 10.00 H new ATOM 0 HA THR A 825 -11.333 -3.369 -7.405 1.00 10.00 H new ATOM 0 HB THR A 825 -10.460 -0.724 -6.292 1.00 10.00 H new ATOM 0 HG1 THR A 825 -12.237 0.265 -7.479 1.00 10.00 H new ATOM 0 HG21 THR A 825 -10.228 -0.169 -8.695 1.00 10.00 H new ATOM 0 HG22 THR A 825 -9.314 -1.634 -8.262 1.00 10.00 H new ATOM 0 HG23 THR A 825 -10.868 -1.774 -9.119 1.00 10.00 H new ATOM 55 N ALA A 826 -10.120 -3.732 -4.601 1.00 10.00 N ATOM 56 CA ALA A 826 -9.006 -4.193 -3.781 1.00 10.00 C ATOM 57 C ALA A 826 -8.566 -5.563 -4.247 1.00 10.00 C ATOM 58 O ALA A 826 -7.374 -5.809 -4.428 1.00 10.00 O ATOM 59 CB ALA A 826 -9.380 -4.221 -2.308 1.00 10.00 C ATOM 0 H ALA A 826 -11.039 -3.894 -4.189 1.00 10.00 H new ATOM 0 HA ALA A 826 -8.178 -3.493 -3.894 1.00 10.00 H new ATOM 0 HB1 ALA A 826 -8.529 -4.569 -1.723 1.00 10.00 H new ATOM 0 HB2 ALA A 826 -9.657 -3.218 -1.984 1.00 10.00 H new ATOM 0 HB3 ALA A 826 -10.223 -4.896 -2.159 1.00 10.00 H new ATOM 65 N ASP A 827 -9.544 -6.445 -4.452 1.00 10.00 N ATOM 66 CA ASP A 827 -9.261 -7.801 -4.944 1.00 10.00 C ATOM 67 C ASP A 827 -8.495 -7.707 -6.246 1.00 10.00 C ATOM 68 O ASP A 827 -7.532 -8.441 -6.488 1.00 10.00 O ATOM 69 CB ASP A 827 -10.560 -8.589 -5.156 1.00 10.00 C ATOM 70 CG ASP A 827 -10.406 -9.729 -6.151 1.00 10.00 C ATOM 71 OD1 ASP A 827 -10.834 -9.570 -7.316 1.00 10.00 O ATOM 72 OD2 ASP A 827 -9.863 -10.789 -5.771 1.00 10.00 O ATOM 0 H ASP A 827 -10.532 -6.251 -4.288 1.00 10.00 H new ATOM 0 HA ASP A 827 -8.664 -8.329 -4.200 1.00 10.00 H new ATOM 0 HB2 ASP A 827 -10.895 -8.991 -4.200 1.00 10.00 H new ATOM 0 HB3 ASP A 827 -11.338 -7.910 -5.507 1.00 10.00 H new ATOM 77 N GLN A 828 -8.931 -6.761 -7.072 1.00 10.00 N ATOM 78 CA GLN A 828 -8.304 -6.515 -8.355 1.00 10.00 C ATOM 79 C GLN A 828 -6.869 -6.030 -8.176 1.00 10.00 C ATOM 80 O GLN A 828 -5.964 -6.491 -8.874 1.00 10.00 O ATOM 81 CB GLN A 828 -9.125 -5.512 -9.165 1.00 10.00 C ATOM 82 CG GLN A 828 -10.394 -6.120 -9.746 1.00 10.00 C ATOM 83 CD GLN A 828 -10.133 -7.372 -10.552 1.00 10.00 C ATOM 84 OE1 GLN A 828 -9.854 -7.307 -11.746 1.00 10.00 O ATOM 85 NE2 GLN A 828 -10.234 -8.523 -9.902 1.00 10.00 N ATOM 0 H GLN A 828 -9.723 -6.151 -6.868 1.00 10.00 H new ATOM 0 HA GLN A 828 -8.270 -7.454 -8.907 1.00 10.00 H new ATOM 0 HB2 GLN A 828 -9.391 -4.668 -8.528 1.00 10.00 H new ATOM 0 HB3 GLN A 828 -8.512 -5.119 -9.976 1.00 10.00 H new ATOM 0 HG2 GLN A 828 -11.083 -6.354 -8.934 1.00 10.00 H new ATOM 0 HG3 GLN A 828 -10.887 -5.383 -10.380 1.00 10.00 H new ATOM 0 HE21 GLN A 828 -10.468 -8.529 -8.909 1.00 10.00 H new ATOM 0 HE22 GLN A 828 -10.078 -9.402 -10.395 1.00 10.00 H new ATOM 94 N VAL A 829 -6.665 -5.098 -7.243 1.00 10.00 N ATOM 95 CA VAL A 829 -5.332 -4.573 -6.956 1.00 10.00 C ATOM 96 C VAL A 829 -4.438 -5.701 -6.465 1.00 10.00 C ATOM 97 O VAL A 829 -3.279 -5.796 -6.844 1.00 10.00 O ATOM 98 CB VAL A 829 -5.375 -3.452 -5.889 1.00 10.00 C ATOM 99 CG1 VAL A 829 -4.000 -3.219 -5.280 1.00 10.00 C ATOM 100 CG2 VAL A 829 -5.912 -2.161 -6.483 1.00 10.00 C ATOM 0 H VAL A 829 -7.408 -4.692 -6.674 1.00 10.00 H new ATOM 0 HA VAL A 829 -4.934 -4.147 -7.877 1.00 10.00 H new ATOM 0 HB VAL A 829 -6.049 -3.777 -5.096 1.00 10.00 H new ATOM 0 HG11 VAL A 829 -4.062 -2.426 -4.534 1.00 10.00 H new ATOM 0 HG12 VAL A 829 -3.652 -4.137 -4.806 1.00 10.00 H new ATOM 0 HG13 VAL A 829 -3.300 -2.927 -6.063 1.00 10.00 H new ATOM 0 HG21 VAL A 829 -5.933 -1.388 -5.715 1.00 10.00 H new ATOM 0 HG22 VAL A 829 -5.267 -1.841 -7.302 1.00 10.00 H new ATOM 0 HG23 VAL A 829 -6.922 -2.326 -6.859 1.00 10.00 H new ATOM 110 N MET A 830 -5.002 -6.565 -5.636 1.00 10.00 N ATOM 111 CA MET A 830 -4.260 -7.690 -5.086 1.00 10.00 C ATOM 112 C MET A 830 -3.785 -8.632 -6.181 1.00 10.00 C ATOM 113 O MET A 830 -2.624 -9.052 -6.183 1.00 10.00 O ATOM 114 CB MET A 830 -5.124 -8.442 -4.080 1.00 10.00 C ATOM 115 CG MET A 830 -5.064 -7.851 -2.682 1.00 10.00 C ATOM 116 SD MET A 830 -3.586 -8.341 -1.781 1.00 10.00 S ATOM 117 CE MET A 830 -4.049 -9.987 -1.265 1.00 10.00 C ATOM 0 H MET A 830 -5.973 -6.509 -5.328 1.00 10.00 H new ATOM 0 HA MET A 830 -3.378 -7.298 -4.580 1.00 10.00 H new ATOM 0 HB2 MET A 830 -6.158 -8.439 -4.425 1.00 10.00 H new ATOM 0 HB3 MET A 830 -4.803 -9.483 -4.042 1.00 10.00 H new ATOM 0 HG2 MET A 830 -5.099 -6.764 -2.750 1.00 10.00 H new ATOM 0 HG3 MET A 830 -5.946 -8.163 -2.122 1.00 10.00 H new ATOM 0 HE1 MET A 830 -3.967 -10.065 -0.181 1.00 10.00 H new ATOM 0 HE2 MET A 830 -5.077 -10.187 -1.567 1.00 10.00 H new ATOM 0 HE3 MET A 830 -3.386 -10.715 -1.732 1.00 10.00 H new ATOM 127 N ALA A 831 -4.679 -8.961 -7.104 1.00 10.00 N ATOM 128 CA ALA A 831 -4.340 -9.837 -8.218 1.00 10.00 C ATOM 129 C ALA A 831 -3.309 -9.165 -9.108 1.00 10.00 C ATOM 130 O ALA A 831 -2.354 -9.795 -9.560 1.00 10.00 O ATOM 131 CB ALA A 831 -5.589 -10.204 -9.013 1.00 10.00 C ATOM 0 H ALA A 831 -5.645 -8.634 -7.103 1.00 10.00 H new ATOM 0 HA ALA A 831 -3.912 -10.759 -7.825 1.00 10.00 H new ATOM 0 HB1 ALA A 831 -5.314 -10.858 -9.840 1.00 10.00 H new ATOM 0 HB2 ALA A 831 -6.296 -10.719 -8.362 1.00 10.00 H new ATOM 0 HB3 ALA A 831 -6.050 -9.298 -9.405 1.00 10.00 H new ATOM 137 N SER A 832 -3.507 -7.875 -9.339 1.00 10.00 N ATOM 138 CA SER A 832 -2.596 -7.099 -10.161 1.00 10.00 C ATOM 139 C SER A 832 -1.226 -7.011 -9.509 1.00 10.00 C ATOM 140 O SER A 832 -0.211 -7.107 -10.190 1.00 10.00 O ATOM 141 CB SER A 832 -3.163 -5.704 -10.411 1.00 10.00 C ATOM 142 OG SER A 832 -4.465 -5.783 -10.971 1.00 10.00 O ATOM 0 H SER A 832 -4.294 -7.344 -8.966 1.00 10.00 H new ATOM 0 HA SER A 832 -2.483 -7.604 -11.121 1.00 10.00 H new ATOM 0 HB2 SER A 832 -3.198 -5.147 -9.474 1.00 10.00 H new ATOM 0 HB3 SER A 832 -2.505 -5.154 -11.084 1.00 10.00 H new ATOM 0 HG SER A 832 -5.120 -5.932 -10.257 1.00 10.00 H new ATOM 148 N PHE A 833 -1.202 -6.823 -8.196 1.00 10.00 N ATOM 149 CA PHE A 833 0.050 -6.768 -7.462 1.00 10.00 C ATOM 150 C PHE A 833 0.752 -8.108 -7.604 1.00 10.00 C ATOM 151 O PHE A 833 1.944 -8.173 -7.920 1.00 10.00 O ATOM 152 CB PHE A 833 -0.209 -6.477 -5.985 1.00 10.00 C ATOM 153 CG PHE A 833 0.392 -5.183 -5.487 1.00 10.00 C ATOM 154 CD1 PHE A 833 1.692 -4.829 -5.810 1.00 10.00 C ATOM 155 CD2 PHE A 833 -0.344 -4.327 -4.685 1.00 10.00 C ATOM 156 CE1 PHE A 833 2.237 -3.638 -5.353 1.00 10.00 C ATOM 157 CE2 PHE A 833 0.197 -3.136 -4.225 1.00 10.00 C ATOM 158 CZ PHE A 833 1.493 -2.796 -4.554 1.00 10.00 C ATOM 0 H PHE A 833 -2.036 -6.706 -7.620 1.00 10.00 H new ATOM 0 HA PHE A 833 0.673 -5.970 -7.865 1.00 10.00 H new ATOM 0 HB2 PHE A 833 -1.286 -6.452 -5.816 1.00 10.00 H new ATOM 0 HB3 PHE A 833 0.188 -7.300 -5.390 1.00 10.00 H new ATOM 0 HD1 PHE A 833 2.288 -5.488 -6.424 1.00 10.00 H new ATOM 0 HD2 PHE A 833 -1.355 -4.591 -4.413 1.00 10.00 H new ATOM 0 HE1 PHE A 833 3.247 -3.369 -5.624 1.00 10.00 H new ATOM 0 HE2 PHE A 833 -0.396 -2.475 -3.610 1.00 10.00 H new ATOM 0 HZ PHE A 833 1.922 -1.875 -4.188 1.00 10.00 H new ATOM 168 N LYS A 834 0.007 -9.174 -7.301 1.00 10.00 N ATOM 169 CA LYS A 834 0.505 -10.530 -7.451 1.00 10.00 C ATOM 170 C LYS A 834 1.140 -10.705 -8.816 1.00 10.00 C ATOM 171 O LYS A 834 2.260 -11.201 -8.916 1.00 10.00 O ATOM 172 CB LYS A 834 -0.619 -11.549 -7.258 1.00 10.00 C ATOM 173 CG LYS A 834 -0.281 -12.614 -6.225 1.00 10.00 C ATOM 174 CD LYS A 834 -1.080 -13.891 -6.438 1.00 10.00 C ATOM 175 CE LYS A 834 -0.827 -14.882 -5.323 1.00 10.00 C ATOM 176 NZ LYS A 834 -0.843 -16.277 -5.820 1.00 10.00 N ATOM 0 H LYS A 834 -0.948 -9.116 -6.949 1.00 10.00 H new ATOM 0 HA LYS A 834 1.259 -10.704 -6.683 1.00 10.00 H new ATOM 0 HB2 LYS A 834 -1.526 -11.028 -6.952 1.00 10.00 H new ATOM 0 HB3 LYS A 834 -0.834 -12.030 -8.212 1.00 10.00 H new ATOM 0 HG2 LYS A 834 0.784 -12.841 -6.274 1.00 10.00 H new ATOM 0 HG3 LYS A 834 -0.479 -12.225 -5.226 1.00 10.00 H new ATOM 0 HD2 LYS A 834 -2.143 -13.655 -6.485 1.00 10.00 H new ATOM 0 HD3 LYS A 834 -0.810 -14.338 -7.395 1.00 10.00 H new ATOM 0 HE2 LYS A 834 0.137 -14.671 -4.860 1.00 10.00 H new ATOM 0 HE3 LYS A 834 -1.586 -14.762 -4.550 1.00 10.00 H new ATOM 0 HZ1 LYS A 834 -0.734 -16.932 -5.020 1.00 10.00 H new ATOM 0 HZ2 LYS A 834 -1.746 -16.464 -6.300 1.00 10.00 H new ATOM 0 HZ3 LYS A 834 -0.060 -16.416 -6.490 1.00 10.00 H new ATOM 190 N ILE A 835 0.425 -10.298 -9.864 1.00 10.00 N ATOM 191 CA ILE A 835 0.932 -10.395 -11.231 1.00 10.00 C ATOM 192 C ILE A 835 2.160 -9.499 -11.419 1.00 10.00 C ATOM 193 O ILE A 835 3.159 -9.921 -12.001 1.00 10.00 O ATOM 194 CB ILE A 835 -0.153 -9.972 -12.255 1.00 10.00 C ATOM 195 CG1 ILE A 835 -1.315 -10.959 -12.247 1.00 10.00 C ATOM 196 CG2 ILE A 835 0.429 -9.867 -13.664 1.00 10.00 C ATOM 197 CD1 ILE A 835 -2.604 -10.373 -12.787 1.00 10.00 C ATOM 0 H ILE A 835 -0.510 -9.897 -9.791 1.00 10.00 H new ATOM 0 HA ILE A 835 1.208 -11.435 -11.403 1.00 10.00 H new ATOM 0 HB ILE A 835 -0.520 -8.989 -11.959 1.00 10.00 H new ATOM 0 HG12 ILE A 835 -1.045 -11.832 -12.840 1.00 10.00 H new ATOM 0 HG13 ILE A 835 -1.481 -11.306 -11.227 1.00 10.00 H new ATOM 0 HG21 ILE A 835 -0.355 -9.569 -14.360 1.00 10.00 H new ATOM 0 HG22 ILE A 835 1.226 -9.123 -13.674 1.00 10.00 H new ATOM 0 HG23 ILE A 835 0.832 -10.834 -13.964 1.00 10.00 H new ATOM 0 HD11 ILE A 835 -3.389 -11.128 -12.753 1.00 10.00 H new ATOM 0 HD12 ILE A 835 -2.897 -9.517 -12.179 1.00 10.00 H new ATOM 0 HD13 ILE A 835 -2.454 -10.052 -13.818 1.00 10.00 H new ATOM 209 N LEU A 836 2.059 -8.269 -10.915 1.00 10.00 N ATOM 210 CA LEU A 836 3.127 -7.265 -11.011 1.00 10.00 C ATOM 211 C LEU A 836 4.469 -7.811 -10.550 1.00 10.00 C ATOM 212 O LEU A 836 5.483 -7.646 -11.230 1.00 10.00 O ATOM 213 CB LEU A 836 2.775 -6.039 -10.162 1.00 10.00 C ATOM 214 CG LEU A 836 3.520 -4.757 -10.531 1.00 10.00 C ATOM 215 CD1 LEU A 836 2.860 -4.084 -11.716 1.00 10.00 C ATOM 216 CD2 LEU A 836 3.595 -3.815 -9.334 1.00 10.00 C ATOM 0 H LEU A 836 1.229 -7.936 -10.424 1.00 10.00 H new ATOM 0 HA LEU A 836 3.211 -6.989 -12.062 1.00 10.00 H new ATOM 0 HB2 LEU A 836 1.704 -5.855 -10.245 1.00 10.00 H new ATOM 0 HB3 LEU A 836 2.978 -6.270 -9.116 1.00 10.00 H new ATOM 0 HG LEU A 836 4.540 -5.017 -10.815 1.00 10.00 H new ATOM 0 HD11 LEU A 836 3.403 -3.173 -11.966 1.00 10.00 H new ATOM 0 HD12 LEU A 836 2.872 -4.760 -12.571 1.00 10.00 H new ATOM 0 HD13 LEU A 836 1.829 -3.835 -11.465 1.00 10.00 H new ATOM 0 HD21 LEU A 836 4.129 -2.908 -9.618 1.00 10.00 H new ATOM 0 HD22 LEU A 836 2.587 -3.556 -9.011 1.00 10.00 H new ATOM 0 HD23 LEU A 836 4.123 -4.306 -8.517 1.00 10.00 H new ATOM 228 N ALA A 837 4.475 -8.452 -9.394 1.00 10.00 N ATOM 229 CA ALA A 837 5.701 -9.018 -8.858 1.00 10.00 C ATOM 230 C ALA A 837 6.010 -10.353 -9.526 1.00 10.00 C ATOM 231 O ALA A 837 7.168 -10.690 -9.757 1.00 10.00 O ATOM 232 CB ALA A 837 5.602 -9.186 -7.355 1.00 10.00 C ATOM 0 H ALA A 837 3.650 -8.593 -8.811 1.00 10.00 H new ATOM 0 HA ALA A 837 6.517 -8.328 -9.071 1.00 10.00 H new ATOM 0 HB1 ALA A 837 6.531 -9.611 -6.974 1.00 10.00 H new ATOM 0 HB2 ALA A 837 5.431 -8.215 -6.891 1.00 10.00 H new ATOM 0 HB3 ALA A 837 4.773 -9.853 -7.117 1.00 10.00 H new ATOM 238 N GLY A 838 4.964 -11.110 -9.837 1.00 10.00 N ATOM 239 CA GLY A 838 5.143 -12.398 -10.486 1.00 10.00 C ATOM 240 C GLY A 838 4.812 -13.548 -9.560 1.00 10.00 C ATOM 241 O GLY A 838 5.680 -14.368 -9.242 1.00 10.00 O ATOM 0 H GLY A 838 3.994 -10.856 -9.652 1.00 10.00 H new ATOM 0 HA2 GLY A 838 4.508 -12.450 -11.371 1.00 10.00 H new ATOM 0 HA3 GLY A 838 6.174 -12.492 -10.828 1.00 10.00 H new ATOM 245 N ASP A 839 3.546 -13.594 -9.136 1.00 10.00 N ATOM 246 CA ASP A 839 3.051 -14.604 -8.211 1.00 10.00 C ATOM 247 C ASP A 839 3.916 -14.638 -6.956 1.00 10.00 C ATOM 248 O ASP A 839 4.226 -15.705 -6.414 1.00 10.00 O ATOM 249 CB ASP A 839 3.004 -15.978 -8.857 1.00 10.00 C ATOM 250 CG ASP A 839 1.974 -16.869 -8.208 1.00 10.00 C ATOM 251 OD1 ASP A 839 0.833 -16.414 -7.993 1.00 10.00 O ATOM 252 OD2 ASP A 839 2.299 -18.026 -7.899 1.00 10.00 O ATOM 0 H ASP A 839 2.835 -12.924 -9.430 1.00 10.00 H new ATOM 0 HA ASP A 839 2.032 -14.333 -7.935 1.00 10.00 H new ATOM 0 HB2 ASP A 839 2.777 -15.873 -9.918 1.00 10.00 H new ATOM 0 HB3 ASP A 839 3.986 -16.446 -8.786 1.00 10.00 H new ATOM 257 N LYS A 840 4.308 -13.464 -6.502 1.00 10.00 N ATOM 258 CA LYS A 840 5.142 -13.340 -5.323 1.00 10.00 C ATOM 259 C LYS A 840 4.386 -12.625 -4.219 1.00 10.00 C ATOM 260 O LYS A 840 3.717 -11.617 -4.460 1.00 10.00 O ATOM 261 CB LYS A 840 6.420 -12.564 -5.651 1.00 10.00 C ATOM 262 CG LYS A 840 7.269 -13.223 -6.718 1.00 10.00 C ATOM 263 CD LYS A 840 8.347 -12.283 -7.221 1.00 10.00 C ATOM 264 CE LYS A 840 9.131 -12.912 -8.366 1.00 10.00 C ATOM 265 NZ LYS A 840 9.730 -11.893 -9.274 1.00 10.00 N ATOM 0 H LYS A 840 4.060 -12.575 -6.936 1.00 10.00 H new ATOM 0 HA LYS A 840 5.410 -14.342 -4.986 1.00 10.00 H new ATOM 0 HB2 LYS A 840 6.152 -11.560 -5.980 1.00 10.00 H new ATOM 0 HB3 LYS A 840 7.012 -12.454 -4.743 1.00 10.00 H new ATOM 0 HG2 LYS A 840 7.729 -14.125 -6.314 1.00 10.00 H new ATOM 0 HG3 LYS A 840 6.636 -13.533 -7.550 1.00 10.00 H new ATOM 0 HD2 LYS A 840 7.893 -11.350 -7.556 1.00 10.00 H new ATOM 0 HD3 LYS A 840 9.026 -12.033 -6.405 1.00 10.00 H new ATOM 0 HE2 LYS A 840 9.922 -13.541 -7.958 1.00 10.00 H new ATOM 0 HE3 LYS A 840 8.471 -13.563 -8.940 1.00 10.00 H new ATOM 0 HZ1 LYS A 840 10.195 -12.370 -10.073 1.00 10.00 H new ATOM 0 HZ2 LYS A 840 8.982 -11.266 -9.633 1.00 10.00 H new ATOM 0 HZ3 LYS A 840 10.432 -11.331 -8.751 1.00 10.00 H new ATOM 279 N ASN A 841 4.484 -13.169 -3.020 1.00 10.00 N ATOM 280 CA ASN A 841 3.834 -12.591 -1.855 1.00 10.00 C ATOM 281 C ASN A 841 4.653 -11.417 -1.353 1.00 10.00 C ATOM 282 O ASN A 841 4.152 -10.517 -0.679 1.00 10.00 O ATOM 283 CB ASN A 841 3.684 -13.657 -0.767 1.00 10.00 C ATOM 284 CG ASN A 841 3.177 -13.085 0.542 1.00 10.00 C ATOM 285 OD1 ASN A 841 1.977 -12.874 0.712 1.00 10.00 O ATOM 286 ND2 ASN A 841 4.081 -12.866 1.487 1.00 10.00 N ATOM 0 H ASN A 841 5.013 -14.019 -2.825 1.00 10.00 H new ATOM 0 HA ASN A 841 2.840 -12.233 -2.124 1.00 10.00 H new ATOM 0 HB2 ASN A 841 2.997 -14.429 -1.112 1.00 10.00 H new ATOM 0 HB3 ASN A 841 4.647 -14.139 -0.600 1.00 10.00 H new ATOM 0 HD21 ASN A 841 3.791 -12.509 2.397 1.00 10.00 H new ATOM 0 HD22 ASN A 841 5.066 -13.055 1.304 1.00 10.00 H new ATOM 293 N TYR A 842 5.916 -11.439 -1.718 1.00 10.00 N ATOM 294 CA TYR A 842 6.848 -10.386 -1.346 1.00 10.00 C ATOM 295 C TYR A 842 7.330 -9.655 -2.596 1.00 10.00 C ATOM 296 O TYR A 842 7.885 -10.273 -3.505 1.00 10.00 O ATOM 297 CB TYR A 842 8.042 -10.944 -0.557 1.00 10.00 C ATOM 298 CG TYR A 842 8.134 -12.454 -0.527 1.00 10.00 C ATOM 299 CD1 TYR A 842 8.855 -13.138 -1.491 1.00 10.00 C ATOM 300 CD2 TYR A 842 7.512 -13.193 0.468 1.00 10.00 C ATOM 301 CE1 TYR A 842 8.958 -14.517 -1.465 1.00 10.00 C ATOM 302 CE2 TYR A 842 7.609 -14.572 0.498 1.00 10.00 C ATOM 303 CZ TYR A 842 8.332 -15.230 -0.470 1.00 10.00 C ATOM 304 OH TYR A 842 8.434 -16.609 -0.433 1.00 10.00 O ATOM 0 H TYR A 842 6.330 -12.183 -2.280 1.00 10.00 H new ATOM 0 HA TYR A 842 6.325 -9.683 -0.697 1.00 10.00 H new ATOM 0 HB2 TYR A 842 8.961 -10.547 -0.987 1.00 10.00 H new ATOM 0 HB3 TYR A 842 7.985 -10.577 0.468 1.00 10.00 H new ATOM 0 HD1 TYR A 842 9.346 -12.585 -2.278 1.00 10.00 H new ATOM 0 HD2 TYR A 842 6.943 -12.683 1.231 1.00 10.00 H new ATOM 0 HE1 TYR A 842 9.528 -15.032 -2.224 1.00 10.00 H new ATOM 0 HE2 TYR A 842 7.118 -15.132 1.280 1.00 10.00 H new ATOM 0 HH TYR A 842 9.291 -16.884 -0.820 1.00 10.00 H new ATOM 314 N ILE A 843 7.103 -8.344 -2.640 1.00 10.00 N ATOM 315 CA ILE A 843 7.502 -7.523 -3.777 1.00 10.00 C ATOM 316 C ILE A 843 8.758 -6.713 -3.453 1.00 10.00 C ATOM 317 O ILE A 843 9.007 -6.363 -2.298 1.00 10.00 O ATOM 318 CB ILE A 843 6.358 -6.565 -4.213 1.00 10.00 C ATOM 319 CG1 ILE A 843 6.745 -5.806 -5.486 1.00 10.00 C ATOM 320 CG2 ILE A 843 6.021 -5.594 -3.089 1.00 10.00 C ATOM 321 CD1 ILE A 843 5.584 -5.092 -6.156 1.00 10.00 C ATOM 0 H ILE A 843 6.641 -7.825 -1.893 1.00 10.00 H new ATOM 0 HA ILE A 843 7.721 -8.200 -4.603 1.00 10.00 H new ATOM 0 HB ILE A 843 5.472 -7.162 -4.429 1.00 10.00 H new ATOM 0 HG12 ILE A 843 7.515 -5.075 -5.241 1.00 10.00 H new ATOM 0 HG13 ILE A 843 7.185 -6.507 -6.195 1.00 10.00 H new ATOM 0 HG21 ILE A 843 5.218 -4.930 -3.410 1.00 10.00 H new ATOM 0 HG22 ILE A 843 5.700 -6.153 -2.210 1.00 10.00 H new ATOM 0 HG23 ILE A 843 6.903 -5.003 -2.842 1.00 10.00 H new ATOM 0 HD11 ILE A 843 5.939 -4.579 -7.049 1.00 10.00 H new ATOM 0 HD12 ILE A 843 4.821 -5.819 -6.435 1.00 10.00 H new ATOM 0 HD13 ILE A 843 5.157 -4.365 -5.465 1.00 10.00 H new ATOM 333 N THR A 844 9.549 -6.429 -4.477 1.00 10.00 N ATOM 334 CA THR A 844 10.766 -5.658 -4.318 1.00 10.00 C ATOM 335 C THR A 844 10.418 -4.207 -3.970 1.00 10.00 C ATOM 336 O THR A 844 9.491 -3.637 -4.557 1.00 10.00 O ATOM 337 CB THR A 844 11.608 -5.720 -5.602 1.00 10.00 C ATOM 338 OG1 THR A 844 10.903 -6.464 -6.606 1.00 10.00 O ATOM 339 CG2 THR A 844 12.944 -6.380 -5.346 1.00 10.00 C ATOM 0 H THR A 844 9.364 -6.726 -5.435 1.00 10.00 H new ATOM 0 HA THR A 844 11.354 -6.083 -3.504 1.00 10.00 H new ATOM 0 HB THR A 844 11.782 -4.699 -5.942 1.00 10.00 H new ATOM 0 HG1 THR A 844 11.441 -6.501 -7.424 1.00 10.00 H new ATOM 0 HG21 THR A 844 13.518 -6.410 -6.272 1.00 10.00 H new ATOM 0 HG22 THR A 844 13.493 -5.810 -4.596 1.00 10.00 H new ATOM 0 HG23 THR A 844 12.785 -7.396 -4.985 1.00 10.00 H new ATOM 347 N MET A 845 11.164 -3.634 -3.031 1.00 10.00 N ATOM 348 CA MET A 845 10.909 -2.268 -2.561 1.00 10.00 C ATOM 349 C MET A 845 11.066 -1.241 -3.687 1.00 10.00 C ATOM 350 O MET A 845 10.222 -0.359 -3.845 1.00 10.00 O ATOM 351 CB MET A 845 11.808 -1.899 -1.376 1.00 10.00 C ATOM 352 CG MET A 845 13.282 -1.771 -1.712 1.00 10.00 C ATOM 353 SD MET A 845 14.126 -0.590 -0.640 1.00 10.00 S ATOM 354 CE MET A 845 14.161 -1.488 0.910 1.00 10.00 C ATOM 0 H MET A 845 11.954 -4.092 -2.576 1.00 10.00 H new ATOM 0 HA MET A 845 9.873 -2.244 -2.222 1.00 10.00 H new ATOM 0 HB2 MET A 845 11.462 -0.955 -0.956 1.00 10.00 H new ATOM 0 HB3 MET A 845 11.691 -2.655 -0.600 1.00 10.00 H new ATOM 0 HG2 MET A 845 13.759 -2.747 -1.622 1.00 10.00 H new ATOM 0 HG3 MET A 845 13.390 -1.458 -2.751 1.00 10.00 H new ATOM 0 HE1 MET A 845 14.654 -0.882 1.670 1.00 10.00 H new ATOM 0 HE2 MET A 845 13.141 -1.708 1.226 1.00 10.00 H new ATOM 0 HE3 MET A 845 14.709 -2.421 0.778 1.00 10.00 H new ATOM 364 N ASP A 846 12.130 -1.363 -4.474 1.00 10.00 N ATOM 365 CA ASP A 846 12.383 -0.422 -5.566 1.00 10.00 C ATOM 366 C ASP A 846 11.371 -0.569 -6.696 1.00 10.00 C ATOM 367 O ASP A 846 10.997 0.418 -7.324 1.00 10.00 O ATOM 368 CB ASP A 846 13.801 -0.588 -6.114 1.00 10.00 C ATOM 369 CG ASP A 846 14.355 0.731 -6.604 1.00 10.00 C ATOM 370 OD1 ASP A 846 14.387 0.955 -7.833 1.00 10.00 O ATOM 371 OD2 ASP A 846 14.739 1.564 -5.753 1.00 10.00 O ATOM 0 H ASP A 846 12.829 -2.099 -4.379 1.00 10.00 H new ATOM 0 HA ASP A 846 12.276 0.579 -5.148 1.00 10.00 H new ATOM 0 HB2 ASP A 846 14.449 -0.992 -5.336 1.00 10.00 H new ATOM 0 HB3 ASP A 846 13.796 -1.310 -6.931 1.00 10.00 H new ATOM 376 N GLU A 847 10.913 -1.793 -6.943 1.00 10.00 N ATOM 377 CA GLU A 847 9.941 -2.041 -8.007 1.00 10.00 C ATOM 378 C GLU A 847 8.644 -1.309 -7.727 1.00 10.00 C ATOM 379 O GLU A 847 8.141 -0.583 -8.577 1.00 10.00 O ATOM 380 CB GLU A 847 9.675 -3.536 -8.164 1.00 10.00 C ATOM 381 CG GLU A 847 10.426 -4.162 -9.332 1.00 10.00 C ATOM 382 CD GLU A 847 10.003 -3.604 -10.681 1.00 10.00 C ATOM 383 OE1 GLU A 847 10.855 -3.004 -11.372 1.00 10.00 O ATOM 384 OE2 GLU A 847 8.824 -3.777 -11.063 1.00 10.00 O ATOM 0 H GLU A 847 11.196 -2.625 -6.425 1.00 10.00 H new ATOM 0 HA GLU A 847 10.362 -1.665 -8.939 1.00 10.00 H new ATOM 0 HB2 GLU A 847 9.958 -4.047 -7.244 1.00 10.00 H new ATOM 0 HB3 GLU A 847 8.605 -3.695 -8.301 1.00 10.00 H new ATOM 0 HG2 GLU A 847 11.495 -3.999 -9.198 1.00 10.00 H new ATOM 0 HG3 GLU A 847 10.264 -5.240 -9.324 1.00 10.00 H new ATOM 391 N LEU A 848 8.124 -1.477 -6.516 1.00 10.00 N ATOM 392 CA LEU A 848 6.878 -0.825 -6.134 1.00 10.00 C ATOM 393 C LEU A 848 7.068 0.689 -6.086 1.00 10.00 C ATOM 394 O LEU A 848 6.127 1.447 -6.312 1.00 10.00 O ATOM 395 CB LEU A 848 6.365 -1.362 -4.782 1.00 10.00 C ATOM 396 CG LEU A 848 6.996 -0.739 -3.532 1.00 10.00 C ATOM 397 CD1 LEU A 848 6.037 0.250 -2.889 1.00 10.00 C ATOM 398 CD2 LEU A 848 7.381 -1.825 -2.537 1.00 10.00 C ATOM 0 H LEU A 848 8.543 -2.055 -5.787 1.00 10.00 H new ATOM 0 HA LEU A 848 6.124 -1.054 -6.887 1.00 10.00 H new ATOM 0 HB2 LEU A 848 5.287 -1.207 -4.737 1.00 10.00 H new ATOM 0 HB3 LEU A 848 6.534 -2.438 -4.753 1.00 10.00 H new ATOM 0 HG LEU A 848 7.897 -0.203 -3.830 1.00 10.00 H new ATOM 0 HD11 LEU A 848 6.501 0.683 -2.003 1.00 10.00 H new ATOM 0 HD12 LEU A 848 5.801 1.043 -3.599 1.00 10.00 H new ATOM 0 HD13 LEU A 848 5.120 -0.266 -2.603 1.00 10.00 H new ATOM 0 HD21 LEU A 848 7.828 -1.368 -1.654 1.00 10.00 H new ATOM 0 HD22 LEU A 848 6.491 -2.383 -2.245 1.00 10.00 H new ATOM 0 HD23 LEU A 848 8.100 -2.503 -2.998 1.00 10.00 H new ATOM 410 N ARG A 849 8.292 1.123 -5.805 1.00 10.00 N ATOM 411 CA ARG A 849 8.611 2.545 -5.750 1.00 10.00 C ATOM 412 C ARG A 849 8.685 3.120 -7.164 1.00 10.00 C ATOM 413 O ARG A 849 8.473 4.312 -7.377 1.00 10.00 O ATOM 414 CB ARG A 849 9.929 2.760 -5.007 1.00 10.00 C ATOM 415 CG ARG A 849 10.306 4.230 -4.832 1.00 10.00 C ATOM 416 CD ARG A 849 11.387 4.424 -3.776 1.00 10.00 C ATOM 417 NE ARG A 849 12.487 3.479 -3.954 1.00 10.00 N ATOM 418 CZ ARG A 849 13.113 2.873 -2.944 1.00 10.00 C ATOM 419 NH1 ARG A 849 12.747 3.119 -1.691 1.00 10.00 N ATOM 420 NH2 ARG A 849 14.106 2.023 -3.185 1.00 10.00 N ATOM 0 H ARG A 849 9.082 0.508 -5.611 1.00 10.00 H new ATOM 0 HA ARG A 849 7.823 3.067 -5.207 1.00 10.00 H new ATOM 0 HB2 ARG A 849 9.862 2.292 -4.025 1.00 10.00 H new ATOM 0 HB3 ARG A 849 10.727 2.252 -5.548 1.00 10.00 H new ATOM 0 HG2 ARG A 849 10.654 4.630 -5.784 1.00 10.00 H new ATOM 0 HG3 ARG A 849 9.420 4.800 -4.552 1.00 10.00 H new ATOM 0 HD2 ARG A 849 11.770 5.443 -3.829 1.00 10.00 H new ATOM 0 HD3 ARG A 849 10.954 4.297 -2.784 1.00 10.00 H new ATOM 0 HE ARG A 849 12.794 3.271 -4.904 1.00 10.00 H new ATOM 0 HH11 ARG A 849 11.987 3.772 -1.501 1.00 10.00 H new ATOM 0 HH12 ARG A 849 13.226 2.655 -0.919 1.00 10.00 H new ATOM 0 HH21 ARG A 849 14.392 1.832 -4.145 1.00 10.00 H new ATOM 0 HH22 ARG A 849 14.582 1.562 -2.410 1.00 10.00 H new ATOM 434 N ARG A 850 8.986 2.264 -8.126 1.00 10.00 N ATOM 435 CA ARG A 850 9.060 2.675 -9.518 1.00 10.00 C ATOM 436 C ARG A 850 7.648 2.808 -10.091 1.00 10.00 C ATOM 437 O ARG A 850 7.392 3.605 -11.003 1.00 10.00 O ATOM 438 CB ARG A 850 9.849 1.651 -10.340 1.00 10.00 C ATOM 439 CG ARG A 850 11.175 2.174 -10.875 1.00 10.00 C ATOM 440 CD ARG A 850 12.161 2.472 -9.755 1.00 10.00 C ATOM 441 NE ARG A 850 12.014 3.832 -9.233 1.00 10.00 N ATOM 442 CZ ARG A 850 12.739 4.325 -8.230 1.00 10.00 C ATOM 443 NH1 ARG A 850 13.656 3.580 -7.637 1.00 10.00 N ATOM 444 NH2 ARG A 850 12.547 5.563 -7.808 1.00 10.00 N ATOM 0 H ARG A 850 9.184 1.276 -7.967 1.00 10.00 H new ATOM 0 HA ARG A 850 9.571 3.637 -9.570 1.00 10.00 H new ATOM 0 HB2 ARG A 850 10.039 0.774 -9.722 1.00 10.00 H new ATOM 0 HB3 ARG A 850 9.235 1.323 -11.179 1.00 10.00 H new ATOM 0 HG2 ARG A 850 11.608 1.439 -11.554 1.00 10.00 H new ATOM 0 HG3 ARG A 850 11.000 3.080 -11.455 1.00 10.00 H new ATOM 0 HD2 ARG A 850 12.015 1.757 -8.946 1.00 10.00 H new ATOM 0 HD3 ARG A 850 13.178 2.334 -10.123 1.00 10.00 H new ATOM 0 HE ARG A 850 11.315 4.438 -9.663 1.00 10.00 H new ATOM 0 HH11 ARG A 850 13.812 2.621 -7.947 1.00 10.00 H new ATOM 0 HH12 ARG A 850 14.207 3.964 -6.870 1.00 10.00 H new ATOM 0 HH21 ARG A 850 11.839 6.149 -8.251 1.00 10.00 H new ATOM 0 HH22 ARG A 850 13.107 5.932 -7.039 1.00 10.00 H new ATOM 458 N GLU A 851 6.743 2.014 -9.523 1.00 10.00 N ATOM 459 CA GLU A 851 5.354 1.981 -9.939 1.00 10.00 C ATOM 460 C GLU A 851 4.557 3.108 -9.296 1.00 10.00 C ATOM 461 O GLU A 851 4.121 4.037 -9.982 1.00 10.00 O ATOM 462 CB GLU A 851 4.735 0.624 -9.585 1.00 10.00 C ATOM 463 CG GLU A 851 5.390 -0.535 -10.317 1.00 10.00 C ATOM 464 CD GLU A 851 5.397 -0.341 -11.822 1.00 10.00 C ATOM 465 OE1 GLU A 851 4.302 -0.240 -12.417 1.00 10.00 O ATOM 466 OE2 GLU A 851 6.496 -0.300 -12.420 1.00 10.00 O ATOM 0 H GLU A 851 6.960 1.375 -8.758 1.00 10.00 H new ATOM 0 HA GLU A 851 5.319 2.122 -11.019 1.00 10.00 H new ATOM 0 HB2 GLU A 851 4.818 0.462 -8.510 1.00 10.00 H new ATOM 0 HB3 GLU A 851 3.671 0.643 -9.823 1.00 10.00 H new ATOM 0 HG2 GLU A 851 6.415 -0.651 -9.964 1.00 10.00 H new ATOM 0 HG3 GLU A 851 4.863 -1.458 -10.075 1.00 10.00 H new ATOM 473 N LEU A 852 4.366 3.019 -7.983 1.00 10.00 N ATOM 474 CA LEU A 852 3.619 4.028 -7.237 1.00 10.00 C ATOM 475 C LEU A 852 4.484 5.256 -6.996 1.00 10.00 C ATOM 476 O LEU A 852 5.711 5.153 -6.998 1.00 10.00 O ATOM 477 CB LEU A 852 3.148 3.444 -5.901 1.00 10.00 C ATOM 478 CG LEU A 852 2.195 2.250 -6.022 1.00 10.00 C ATOM 479 CD1 LEU A 852 2.266 1.388 -4.773 1.00 10.00 C ATOM 480 CD2 LEU A 852 0.763 2.726 -6.261 1.00 10.00 C ATOM 0 H LEU A 852 4.721 2.253 -7.410 1.00 10.00 H new ATOM 0 HA LEU A 852 2.749 4.326 -7.822 1.00 10.00 H new ATOM 0 HB2 LEU A 852 4.022 3.137 -5.327 1.00 10.00 H new ATOM 0 HB3 LEU A 852 2.652 4.230 -5.331 1.00 10.00 H new ATOM 0 HG LEU A 852 2.504 1.649 -6.877 1.00 10.00 H new ATOM 0 HD11 LEU A 852 1.584 0.544 -4.874 1.00 10.00 H new ATOM 0 HD12 LEU A 852 3.283 1.019 -4.643 1.00 10.00 H new ATOM 0 HD13 LEU A 852 1.982 1.982 -3.904 1.00 10.00 H new ATOM 0 HD21 LEU A 852 0.102 1.863 -6.344 1.00 10.00 H new ATOM 0 HD22 LEU A 852 0.443 3.350 -5.426 1.00 10.00 H new ATOM 0 HD23 LEU A 852 0.721 3.305 -7.183 1.00 10.00 H new ATOM 492 N PRO A 853 3.871 6.445 -6.825 1.00 10.00 N ATOM 493 CA PRO A 853 4.624 7.674 -6.568 1.00 10.00 C ATOM 494 C PRO A 853 5.489 7.529 -5.319 1.00 10.00 C ATOM 495 O PRO A 853 5.154 6.751 -4.424 1.00 10.00 O ATOM 496 CB PRO A 853 3.535 8.747 -6.377 1.00 10.00 C ATOM 497 CG PRO A 853 2.282 7.984 -6.121 1.00 10.00 C ATOM 498 CD PRO A 853 2.418 6.698 -6.877 1.00 10.00 C ATOM 0 HA PRO A 853 5.313 7.924 -7.375 1.00 10.00 H new ATOM 0 HB2 PRO A 853 3.773 9.406 -5.542 1.00 10.00 H new ATOM 0 HB3 PRO A 853 3.440 9.375 -7.263 1.00 10.00 H new ATOM 0 HG2 PRO A 853 2.150 7.798 -5.055 1.00 10.00 H new ATOM 0 HG3 PRO A 853 1.409 8.544 -6.457 1.00 10.00 H new ATOM 0 HD2 PRO A 853 1.850 5.893 -6.412 1.00 10.00 H new ATOM 0 HD3 PRO A 853 2.059 6.791 -7.902 1.00 10.00 H new ATOM 506 N PRO A 854 6.602 8.274 -5.235 1.00 10.00 N ATOM 507 CA PRO A 854 7.530 8.193 -4.097 1.00 10.00 C ATOM 508 C PRO A 854 6.830 8.201 -2.735 1.00 10.00 C ATOM 509 O PRO A 854 6.973 7.269 -1.949 1.00 10.00 O ATOM 510 CB PRO A 854 8.384 9.450 -4.267 1.00 10.00 C ATOM 511 CG PRO A 854 8.367 9.737 -5.726 1.00 10.00 C ATOM 512 CD PRO A 854 7.035 9.274 -6.232 1.00 10.00 C ATOM 0 HA PRO A 854 8.091 7.258 -4.102 1.00 10.00 H new ATOM 0 HB2 PRO A 854 7.975 10.284 -3.697 1.00 10.00 H new ATOM 0 HB3 PRO A 854 9.401 9.287 -3.909 1.00 10.00 H new ATOM 0 HG2 PRO A 854 8.505 10.802 -5.914 1.00 10.00 H new ATOM 0 HG3 PRO A 854 9.178 9.216 -6.234 1.00 10.00 H new ATOM 0 HD2 PRO A 854 6.326 10.099 -6.303 1.00 10.00 H new ATOM 0 HD3 PRO A 854 7.116 8.836 -7.227 1.00 10.00 H new ATOM 520 N ASP A 855 6.048 9.238 -2.472 1.00 10.00 N ATOM 521 CA ASP A 855 5.348 9.371 -1.196 1.00 10.00 C ATOM 522 C ASP A 855 4.457 8.172 -0.892 1.00 10.00 C ATOM 523 O ASP A 855 4.381 7.718 0.252 1.00 10.00 O ATOM 524 CB ASP A 855 4.505 10.642 -1.193 1.00 10.00 C ATOM 525 CG ASP A 855 5.315 11.873 -0.884 1.00 10.00 C ATOM 526 OD1 ASP A 855 5.963 12.409 -1.810 1.00 10.00 O ATOM 527 OD2 ASP A 855 5.303 12.315 0.285 1.00 10.00 O ATOM 0 H ASP A 855 5.880 10.003 -3.125 1.00 10.00 H new ATOM 0 HA ASP A 855 6.110 9.422 -0.418 1.00 10.00 H new ATOM 0 HB2 ASP A 855 4.029 10.760 -2.166 1.00 10.00 H new ATOM 0 HB3 ASP A 855 3.707 10.543 -0.457 1.00 10.00 H new ATOM 532 N GLN A 856 3.782 7.666 -1.913 1.00 10.00 N ATOM 533 CA GLN A 856 2.891 6.533 -1.749 1.00 10.00 C ATOM 534 C GLN A 856 3.691 5.263 -1.504 1.00 10.00 C ATOM 535 O GLN A 856 3.451 4.544 -0.537 1.00 10.00 O ATOM 536 CB GLN A 856 2.003 6.356 -2.982 1.00 10.00 C ATOM 537 CG GLN A 856 0.887 5.342 -2.783 1.00 10.00 C ATOM 538 CD GLN A 856 -0.267 5.889 -1.961 1.00 10.00 C ATOM 539 OE1 GLN A 856 -0.253 5.829 -0.731 1.00 10.00 O ATOM 540 NE2 GLN A 856 -1.275 6.415 -2.641 1.00 10.00 N ATOM 0 H GLN A 856 3.836 8.025 -2.866 1.00 10.00 H new ATOM 0 HA GLN A 856 2.254 6.726 -0.886 1.00 10.00 H new ATOM 0 HB2 GLN A 856 1.566 7.319 -3.247 1.00 10.00 H new ATOM 0 HB3 GLN A 856 2.621 6.044 -3.824 1.00 10.00 H new ATOM 0 HG2 GLN A 856 0.514 5.023 -3.756 1.00 10.00 H new ATOM 0 HG3 GLN A 856 1.290 4.457 -2.291 1.00 10.00 H new ATOM 0 HE21 GLN A 856 -1.243 6.443 -3.660 1.00 10.00 H new ATOM 0 HE22 GLN A 856 -2.083 6.792 -2.145 1.00 10.00 H new ATOM 549 N ALA A 857 4.630 4.979 -2.406 1.00 10.00 N ATOM 550 CA ALA A 857 5.473 3.795 -2.298 1.00 10.00 C ATOM 551 C ALA A 857 6.227 3.747 -0.968 1.00 10.00 C ATOM 552 O ALA A 857 6.281 2.708 -0.316 1.00 10.00 O ATOM 553 CB ALA A 857 6.457 3.743 -3.460 1.00 10.00 C ATOM 0 H ALA A 857 4.824 5.558 -3.223 1.00 10.00 H new ATOM 0 HA ALA A 857 4.819 2.924 -2.336 1.00 10.00 H new ATOM 0 HB1 ALA A 857 7.081 2.854 -3.369 1.00 10.00 H new ATOM 0 HB2 ALA A 857 5.908 3.705 -4.401 1.00 10.00 H new ATOM 0 HB3 ALA A 857 7.087 4.632 -3.443 1.00 10.00 H new ATOM 559 N GLU A 858 6.788 4.870 -0.560 1.00 10.00 N ATOM 560 CA GLU A 858 7.510 4.933 0.700 1.00 10.00 C ATOM 561 C GLU A 858 6.575 4.617 1.864 1.00 10.00 C ATOM 562 O GLU A 858 6.955 3.937 2.819 1.00 10.00 O ATOM 563 CB GLU A 858 8.140 6.301 0.875 1.00 10.00 C ATOM 564 CG GLU A 858 9.320 6.555 -0.066 1.00 10.00 C ATOM 565 CD GLU A 858 10.557 5.746 0.287 1.00 10.00 C ATOM 566 OE1 GLU A 858 11.076 5.006 -0.585 1.00 10.00 O ATOM 567 OE2 GLU A 858 11.033 5.866 1.433 1.00 10.00 O ATOM 0 H GLU A 858 6.759 5.748 -1.079 1.00 10.00 H new ATOM 0 HA GLU A 858 8.304 4.187 0.687 1.00 10.00 H new ATOM 0 HB2 GLU A 858 7.381 7.066 0.708 1.00 10.00 H new ATOM 0 HB3 GLU A 858 8.478 6.407 1.906 1.00 10.00 H new ATOM 0 HG2 GLU A 858 9.019 6.318 -1.087 1.00 10.00 H new ATOM 0 HG3 GLU A 858 9.570 7.616 -0.045 1.00 10.00 H new ATOM 574 N TYR A 859 5.348 5.103 1.768 1.00 10.00 N ATOM 575 CA TYR A 859 4.340 4.847 2.789 1.00 10.00 C ATOM 576 C TYR A 859 3.964 3.367 2.777 1.00 10.00 C ATOM 577 O TYR A 859 3.847 2.732 3.826 1.00 10.00 O ATOM 578 CB TYR A 859 3.103 5.716 2.535 1.00 10.00 C ATOM 579 CG TYR A 859 1.922 5.402 3.428 1.00 10.00 C ATOM 580 CD1 TYR A 859 1.905 5.804 4.756 1.00 10.00 C ATOM 581 CD2 TYR A 859 0.823 4.697 2.940 1.00 10.00 C ATOM 582 CE1 TYR A 859 0.831 5.518 5.573 1.00 10.00 C ATOM 583 CE2 TYR A 859 -0.256 4.408 3.754 1.00 10.00 C ATOM 584 CZ TYR A 859 -0.243 4.819 5.071 1.00 10.00 C ATOM 585 OH TYR A 859 -1.307 4.534 5.891 1.00 10.00 O ATOM 0 H TYR A 859 5.023 5.679 0.991 1.00 10.00 H new ATOM 0 HA TYR A 859 4.745 5.101 3.769 1.00 10.00 H new ATOM 0 HB2 TYR A 859 3.376 6.763 2.669 1.00 10.00 H new ATOM 0 HB3 TYR A 859 2.798 5.597 1.495 1.00 10.00 H new ATOM 0 HD1 TYR A 859 2.746 6.350 5.157 1.00 10.00 H new ATOM 0 HD2 TYR A 859 0.814 4.372 1.910 1.00 10.00 H new ATOM 0 HE1 TYR A 859 0.833 5.842 6.603 1.00 10.00 H new ATOM 0 HE2 TYR A 859 -1.103 3.865 3.362 1.00 10.00 H new ATOM 0 HH TYR A 859 -1.984 4.037 5.387 1.00 10.00 H new ATOM 595 N CYS A 860 3.776 2.821 1.582 1.00 10.00 N ATOM 596 CA CYS A 860 3.429 1.416 1.427 1.00 10.00 C ATOM 597 C CYS A 860 4.548 0.528 1.967 1.00 10.00 C ATOM 598 O CYS A 860 4.290 -0.475 2.625 1.00 10.00 O ATOM 599 CB CYS A 860 3.176 1.098 -0.043 1.00 10.00 C ATOM 600 SG CYS A 860 1.857 2.075 -0.805 1.00 10.00 S ATOM 0 H CYS A 860 3.859 3.333 0.704 1.00 10.00 H new ATOM 0 HA CYS A 860 2.520 1.218 1.995 1.00 10.00 H new ATOM 0 HB2 CYS A 860 4.099 1.259 -0.601 1.00 10.00 H new ATOM 0 HB3 CYS A 860 2.928 0.041 -0.136 1.00 10.00 H new ATOM 0 HG CYS A 860 0.709 1.710 -0.316 1.00 10.00 H new ATOM 606 N ILE A 861 5.789 0.932 1.704 1.00 10.00 N ATOM 607 CA ILE A 861 6.965 0.206 2.166 1.00 10.00 C ATOM 608 C ILE A 861 6.979 0.123 3.704 1.00 10.00 C ATOM 609 O ILE A 861 7.368 -0.896 4.288 1.00 10.00 O ATOM 610 CB ILE A 861 8.257 0.910 1.666 1.00 10.00 C ATOM 611 CG1 ILE A 861 8.522 0.551 0.205 1.00 10.00 C ATOM 612 CG2 ILE A 861 9.460 0.552 2.529 1.00 10.00 C ATOM 613 CD1 ILE A 861 9.673 1.308 -0.413 1.00 10.00 C ATOM 0 H ILE A 861 6.005 1.771 1.165 1.00 10.00 H new ATOM 0 HA ILE A 861 6.927 -0.805 1.761 1.00 10.00 H new ATOM 0 HB ILE A 861 8.103 1.986 1.745 1.00 10.00 H new ATOM 0 HG12 ILE A 861 8.724 -0.518 0.135 1.00 10.00 H new ATOM 0 HG13 ILE A 861 7.620 0.744 -0.376 1.00 10.00 H new ATOM 0 HG21 ILE A 861 10.345 1.063 2.149 1.00 10.00 H new ATOM 0 HG22 ILE A 861 9.275 0.862 3.557 1.00 10.00 H new ATOM 0 HG23 ILE A 861 9.622 -0.525 2.499 1.00 10.00 H new ATOM 0 HD11 ILE A 861 9.798 0.997 -1.450 1.00 10.00 H new ATOM 0 HD12 ILE A 861 9.466 2.378 -0.377 1.00 10.00 H new ATOM 0 HD13 ILE A 861 10.587 1.096 0.141 1.00 10.00 H new ATOM 625 N ALA A 862 6.551 1.199 4.357 1.00 10.00 N ATOM 626 CA ALA A 862 6.520 1.248 5.813 1.00 10.00 C ATOM 627 C ALA A 862 5.310 0.518 6.383 1.00 10.00 C ATOM 628 O ALA A 862 5.289 0.162 7.561 1.00 10.00 O ATOM 629 CB ALA A 862 6.542 2.697 6.282 1.00 10.00 C ATOM 0 H ALA A 862 6.221 2.049 3.900 1.00 10.00 H new ATOM 0 HA ALA A 862 7.407 0.735 6.184 1.00 10.00 H new ATOM 0 HB1 ALA A 862 6.519 2.727 7.371 1.00 10.00 H new ATOM 0 HB2 ALA A 862 7.451 3.181 5.925 1.00 10.00 H new ATOM 0 HB3 ALA A 862 5.672 3.221 5.886 1.00 10.00 H new ATOM 635 N ARG A 863 4.311 0.282 5.548 1.00 10.00 N ATOM 636 CA ARG A 863 3.097 -0.387 5.990 1.00 10.00 C ATOM 637 C ARG A 863 3.072 -1.853 5.559 1.00 10.00 C ATOM 638 O ARG A 863 2.013 -2.477 5.485 1.00 10.00 O ATOM 639 CB ARG A 863 1.864 0.351 5.462 1.00 10.00 C ATOM 640 CG ARG A 863 1.638 1.729 6.085 1.00 10.00 C ATOM 641 CD ARG A 863 1.372 1.643 7.588 1.00 10.00 C ATOM 642 NE ARG A 863 -0.033 1.343 7.888 1.00 10.00 N ATOM 643 CZ ARG A 863 -0.432 0.484 8.838 1.00 10.00 C ATOM 644 NH1 ARG A 863 0.464 -0.169 9.567 1.00 10.00 N ATOM 645 NH2 ARG A 863 -1.731 0.271 9.061 1.00 10.00 N ATOM 0 H ARG A 863 4.316 0.543 4.562 1.00 10.00 H new ATOM 0 HA ARG A 863 3.082 -0.367 7.080 1.00 10.00 H new ATOM 0 HB2 ARG A 863 1.959 0.465 4.382 1.00 10.00 H new ATOM 0 HB3 ARG A 863 0.983 -0.265 5.642 1.00 10.00 H new ATOM 0 HG2 ARG A 863 2.513 2.355 5.907 1.00 10.00 H new ATOM 0 HG3 ARG A 863 0.794 2.214 5.595 1.00 10.00 H new ATOM 0 HD2 ARG A 863 2.007 0.872 8.024 1.00 10.00 H new ATOM 0 HD3 ARG A 863 1.648 2.587 8.058 1.00 10.00 H new ATOM 0 HE ARG A 863 -0.751 1.817 7.340 1.00 10.00 H new ATOM 0 HH11 ARG A 863 1.460 -0.019 9.406 1.00 10.00 H new ATOM 0 HH12 ARG A 863 0.157 -0.821 10.288 1.00 10.00 H new ATOM 0 HH21 ARG A 863 -2.431 0.764 8.506 1.00 10.00 H new ATOM 0 HH22 ARG A 863 -2.023 -0.384 9.786 1.00 10.00 H new ATOM 659 N MET A 864 4.247 -2.398 5.281 1.00 10.00 N ATOM 660 CA MET A 864 4.366 -3.793 4.869 1.00 10.00 C ATOM 661 C MET A 864 4.999 -4.615 5.978 1.00 10.00 C ATOM 662 O MET A 864 5.257 -4.116 7.075 1.00 10.00 O ATOM 663 CB MET A 864 5.192 -3.925 3.577 1.00 10.00 C ATOM 664 CG MET A 864 4.410 -3.576 2.328 1.00 10.00 C ATOM 665 SD MET A 864 5.418 -3.649 0.838 1.00 10.00 S ATOM 666 CE MET A 864 4.204 -3.227 -0.409 1.00 10.00 C ATOM 0 H MET A 864 5.134 -1.897 5.333 1.00 10.00 H new ATOM 0 HA MET A 864 3.363 -4.171 4.670 1.00 10.00 H new ATOM 0 HB2 MET A 864 6.065 -3.276 3.644 1.00 10.00 H new ATOM 0 HB3 MET A 864 5.561 -4.947 3.493 1.00 10.00 H new ATOM 0 HG2 MET A 864 3.569 -4.262 2.227 1.00 10.00 H new ATOM 0 HG3 MET A 864 3.994 -2.574 2.432 1.00 10.00 H new ATOM 0 HE1 MET A 864 4.598 -3.468 -1.396 1.00 10.00 H new ATOM 0 HE2 MET A 864 3.290 -3.795 -0.234 1.00 10.00 H new ATOM 0 HE3 MET A 864 3.984 -2.161 -0.356 1.00 10.00 H new ATOM 676 N ALA A 865 5.253 -5.892 5.704 1.00 10.00 N ATOM 677 CA ALA A 865 5.865 -6.765 6.678 1.00 10.00 C ATOM 678 C ALA A 865 7.112 -7.405 6.075 1.00 10.00 C ATOM 679 O ALA A 865 7.176 -7.613 4.866 1.00 10.00 O ATOM 680 CB ALA A 865 4.898 -7.837 7.125 1.00 10.00 C ATOM 0 H ALA A 865 5.041 -6.337 4.811 1.00 10.00 H new ATOM 0 HA ALA A 865 6.143 -6.174 7.551 1.00 10.00 H new ATOM 0 HB1 ALA A 865 5.383 -8.481 7.858 1.00 10.00 H new ATOM 0 HB2 ALA A 865 4.021 -7.371 7.575 1.00 10.00 H new ATOM 0 HB3 ALA A 865 4.592 -8.432 6.265 1.00 10.00 H new ATOM 686 N PRO A 866 8.125 -7.717 6.909 1.00 10.00 N ATOM 687 CA PRO A 866 9.373 -8.333 6.451 1.00 10.00 C ATOM 688 C PRO A 866 9.140 -9.658 5.716 1.00 10.00 C ATOM 689 O PRO A 866 8.981 -10.686 6.364 1.00 10.00 O ATOM 690 CB PRO A 866 10.168 -8.569 7.749 1.00 10.00 C ATOM 691 CG PRO A 866 9.168 -8.469 8.841 1.00 10.00 C ATOM 692 CD PRO A 866 8.136 -7.494 8.357 1.00 10.00 C ATOM 0 HA PRO A 866 9.891 -7.698 5.732 1.00 10.00 H new ATOM 0 HB2 PRO A 866 10.649 -9.547 7.744 1.00 10.00 H new ATOM 0 HB3 PRO A 866 10.957 -7.826 7.868 1.00 10.00 H new ATOM 0 HG2 PRO A 866 8.721 -9.440 9.053 1.00 10.00 H new ATOM 0 HG3 PRO A 866 9.631 -8.123 9.765 1.00 10.00 H new ATOM 0 HD2 PRO A 866 7.160 -7.686 8.802 1.00 10.00 H new ATOM 0 HD3 PRO A 866 8.403 -6.467 8.605 1.00 10.00 H new ATOM 700 N TYR A 867 9.115 -9.581 4.367 1.00 10.00 N ATOM 701 CA TYR A 867 8.909 -10.716 3.436 1.00 10.00 C ATOM 702 C TYR A 867 8.164 -11.941 4.031 1.00 10.00 C ATOM 703 O TYR A 867 6.975 -12.095 3.738 1.00 10.00 O ATOM 704 CB TYR A 867 10.208 -11.126 2.699 1.00 10.00 C ATOM 705 CG TYR A 867 11.487 -11.254 3.517 1.00 10.00 C ATOM 706 CD1 TYR A 867 11.906 -10.236 4.367 1.00 10.00 C ATOM 707 CD2 TYR A 867 12.298 -12.384 3.403 1.00 10.00 C ATOM 708 CE1 TYR A 867 13.079 -10.339 5.090 1.00 10.00 C ATOM 709 CE2 TYR A 867 13.470 -12.491 4.126 1.00 10.00 C ATOM 710 CZ TYR A 867 13.855 -11.473 4.968 1.00 10.00 C ATOM 711 OH TYR A 867 15.020 -11.587 5.687 1.00 10.00 O ATOM 0 H TYR A 867 9.242 -8.695 3.877 1.00 10.00 H new ATOM 0 HA TYR A 867 8.219 -10.316 2.693 1.00 10.00 H new ATOM 0 HB2 TYR A 867 10.027 -12.084 2.212 1.00 10.00 H new ATOM 0 HB3 TYR A 867 10.388 -10.396 1.910 1.00 10.00 H new ATOM 0 HD1 TYR A 867 11.302 -9.346 4.464 1.00 10.00 H new ATOM 0 HD2 TYR A 867 12.005 -13.185 2.741 1.00 10.00 H new ATOM 0 HE1 TYR A 867 13.386 -9.538 5.746 1.00 10.00 H new ATOM 0 HE2 TYR A 867 14.084 -13.374 4.030 1.00 10.00 H new ATOM 0 HH TYR A 867 15.445 -12.447 5.486 1.00 10.00 H new ATOM 721 N THR A 868 8.843 -12.769 4.816 1.00 10.00 N ATOM 722 CA THR A 868 8.213 -13.944 5.435 1.00 10.00 C ATOM 723 C THR A 868 7.805 -14.987 4.388 1.00 10.00 C ATOM 724 O THR A 868 6.787 -14.850 3.713 1.00 10.00 O ATOM 725 CB THR A 868 6.981 -13.533 6.271 1.00 10.00 C ATOM 726 OG1 THR A 868 7.344 -12.526 7.229 1.00 10.00 O ATOM 727 CG2 THR A 868 6.384 -14.726 7.003 1.00 10.00 C ATOM 0 H THR A 868 9.831 -12.654 5.043 1.00 10.00 H new ATOM 0 HA THR A 868 8.956 -14.394 6.093 1.00 10.00 H new ATOM 0 HB THR A 868 6.234 -13.137 5.583 1.00 10.00 H new ATOM 0 HG1 THR A 868 7.666 -11.728 6.759 1.00 10.00 H new ATOM 0 HG21 THR A 868 5.519 -14.402 7.582 1.00 10.00 H new ATOM 0 HG22 THR A 868 6.075 -15.480 6.279 1.00 10.00 H new ATOM 0 HG23 THR A 868 7.130 -15.152 7.674 1.00 10.00 H new ATOM 735 N GLY A 869 8.613 -16.027 4.274 1.00 10.00 N ATOM 736 CA GLY A 869 8.340 -17.091 3.322 1.00 10.00 C ATOM 737 C GLY A 869 9.420 -18.156 3.352 1.00 10.00 C ATOM 738 O GLY A 869 10.410 -17.998 4.056 1.00 10.00 O ATOM 0 H GLY A 869 9.460 -16.158 4.826 1.00 10.00 H new ATOM 0 HA2 GLY A 869 7.375 -17.544 3.548 1.00 10.00 H new ATOM 0 HA3 GLY A 869 8.268 -16.673 2.318 1.00 10.00 H new ATOM 742 N PRO A 870 9.268 -19.255 2.590 1.00 10.00 N ATOM 743 CA PRO A 870 10.259 -20.339 2.533 1.00 10.00 C ATOM 744 C PRO A 870 11.519 -19.935 1.775 1.00 10.00 C ATOM 745 O PRO A 870 12.430 -20.738 1.576 1.00 10.00 O ATOM 746 CB PRO A 870 9.546 -21.460 1.763 1.00 10.00 C ATOM 747 CG PRO A 870 8.112 -21.052 1.689 1.00 10.00 C ATOM 748 CD PRO A 870 8.107 -19.555 1.749 1.00 10.00 C ATOM 0 HA PRO A 870 10.585 -20.623 3.534 1.00 10.00 H new ATOM 0 HB2 PRO A 870 9.970 -21.581 0.766 1.00 10.00 H new ATOM 0 HB3 PRO A 870 9.655 -22.416 2.274 1.00 10.00 H new ATOM 0 HG2 PRO A 870 7.652 -21.407 0.767 1.00 10.00 H new ATOM 0 HG3 PRO A 870 7.542 -21.478 2.515 1.00 10.00 H new ATOM 0 HD2 PRO A 870 8.201 -19.111 0.758 1.00 10.00 H new ATOM 0 HD3 PRO A 870 7.184 -19.172 2.184 1.00 10.00 H new ATOM 756 N ASP A 871 11.580 -18.669 1.392 1.00 10.00 N ATOM 757 CA ASP A 871 12.704 -18.143 0.641 1.00 10.00 C ATOM 758 C ASP A 871 12.969 -16.701 1.058 1.00 10.00 C ATOM 759 O ASP A 871 12.175 -15.798 0.780 1.00 10.00 O ATOM 760 CB ASP A 871 12.425 -18.226 -0.868 1.00 10.00 C ATOM 761 CG ASP A 871 13.638 -17.866 -1.712 1.00 10.00 C ATOM 762 OD1 ASP A 871 14.685 -18.526 -1.557 1.00 10.00 O ATOM 763 OD2 ASP A 871 13.544 -16.938 -2.545 1.00 10.00 O ATOM 0 H ASP A 871 10.854 -17.982 1.593 1.00 10.00 H new ATOM 0 HA ASP A 871 13.589 -18.742 0.857 1.00 10.00 H new ATOM 0 HB2 ASP A 871 12.101 -19.236 -1.118 1.00 10.00 H new ATOM 0 HB3 ASP A 871 11.602 -17.556 -1.118 1.00 10.00 H new ATOM 768 N SER A 872 14.065 -16.493 1.779 1.00 10.00 N ATOM 769 CA SER A 872 14.439 -15.168 2.258 1.00 10.00 C ATOM 770 C SER A 872 14.864 -14.273 1.105 1.00 10.00 C ATOM 771 O SER A 872 16.033 -14.239 0.718 1.00 10.00 O ATOM 772 CB SER A 872 15.568 -15.285 3.286 1.00 10.00 C ATOM 773 OG SER A 872 16.181 -14.029 3.546 1.00 10.00 O ATOM 0 H SER A 872 14.715 -17.232 2.046 1.00 10.00 H new ATOM 0 HA SER A 872 13.569 -14.714 2.734 1.00 10.00 H new ATOM 0 HB2 SER A 872 15.172 -15.695 4.215 1.00 10.00 H new ATOM 0 HB3 SER A 872 16.319 -15.987 2.923 1.00 10.00 H new ATOM 0 HG SER A 872 16.895 -14.144 4.207 1.00 10.00 H new ATOM 779 N VAL A 873 13.898 -13.560 0.563 1.00 10.00 N ATOM 780 CA VAL A 873 14.134 -12.655 -0.548 1.00 10.00 C ATOM 781 C VAL A 873 14.742 -11.337 -0.079 1.00 10.00 C ATOM 782 O VAL A 873 14.198 -10.657 0.797 1.00 10.00 O ATOM 783 CB VAL A 873 12.826 -12.361 -1.312 1.00 10.00 C ATOM 784 CG1 VAL A 873 12.389 -13.570 -2.119 1.00 10.00 C ATOM 785 CG2 VAL A 873 11.727 -11.948 -0.337 1.00 10.00 C ATOM 0 H VAL A 873 12.928 -13.590 0.878 1.00 10.00 H new ATOM 0 HA VAL A 873 14.839 -13.152 -1.214 1.00 10.00 H new ATOM 0 HB VAL A 873 13.010 -11.539 -2.003 1.00 10.00 H new ATOM 0 HG11 VAL A 873 11.465 -13.339 -2.649 1.00 10.00 H new ATOM 0 HG12 VAL A 873 13.166 -13.827 -2.839 1.00 10.00 H new ATOM 0 HG13 VAL A 873 12.222 -14.414 -1.449 1.00 10.00 H new ATOM 0 HG21 VAL A 873 10.809 -11.743 -0.889 1.00 10.00 H new ATOM 0 HG22 VAL A 873 11.550 -12.754 0.375 1.00 10.00 H new ATOM 0 HG23 VAL A 873 12.035 -11.051 0.200 1.00 10.00 H new ATOM 795 N PRO A 874 15.906 -10.981 -0.628 1.00 10.00 N ATOM 796 CA PRO A 874 16.580 -9.733 -0.288 1.00 10.00 C ATOM 797 C PRO A 874 16.025 -8.547 -1.075 1.00 10.00 C ATOM 798 O PRO A 874 15.873 -8.614 -2.301 1.00 10.00 O ATOM 799 CB PRO A 874 18.026 -10.014 -0.683 1.00 10.00 C ATOM 800 CG PRO A 874 17.917 -10.953 -1.838 1.00 10.00 C ATOM 801 CD PRO A 874 16.683 -11.786 -1.601 1.00 10.00 C ATOM 0 HA PRO A 874 16.452 -9.459 0.759 1.00 10.00 H new ATOM 0 HB2 PRO A 874 18.547 -9.098 -0.963 1.00 10.00 H new ATOM 0 HB3 PRO A 874 18.584 -10.460 0.141 1.00 10.00 H new ATOM 0 HG2 PRO A 874 17.840 -10.405 -2.777 1.00 10.00 H new ATOM 0 HG3 PRO A 874 18.803 -11.584 -1.909 1.00 10.00 H new ATOM 0 HD2 PRO A 874 16.125 -11.949 -2.523 1.00 10.00 H new ATOM 0 HD3 PRO A 874 16.932 -12.769 -1.201 1.00 10.00 H new ATOM 809 N GLY A 875 15.714 -7.468 -0.366 1.00 10.00 N ATOM 810 CA GLY A 875 15.192 -6.276 -1.014 1.00 10.00 C ATOM 811 C GLY A 875 13.704 -6.366 -1.332 1.00 10.00 C ATOM 812 O GLY A 875 13.158 -5.516 -2.041 1.00 10.00 O ATOM 0 H GLY A 875 15.814 -7.396 0.647 1.00 10.00 H new ATOM 0 HA2 GLY A 875 15.367 -5.414 -0.370 1.00 10.00 H new ATOM 0 HA3 GLY A 875 15.744 -6.101 -1.938 1.00 10.00 H new ATOM 816 N ALA A 876 13.043 -7.388 -0.816 1.00 10.00 N ATOM 817 CA ALA A 876 11.622 -7.571 -1.062 1.00 10.00 C ATOM 818 C ALA A 876 10.886 -7.753 0.251 1.00 10.00 C ATOM 819 O ALA A 876 11.409 -8.373 1.178 1.00 10.00 O ATOM 820 CB ALA A 876 11.393 -8.757 -1.979 1.00 10.00 C ATOM 0 H ALA A 876 13.466 -8.103 -0.225 1.00 10.00 H new ATOM 0 HA ALA A 876 11.231 -6.681 -1.556 1.00 10.00 H new ATOM 0 HB1 ALA A 876 10.324 -8.881 -2.154 1.00 10.00 H new ATOM 0 HB2 ALA A 876 11.898 -8.585 -2.929 1.00 10.00 H new ATOM 0 HB3 ALA A 876 11.792 -9.659 -1.514 1.00 10.00 H new ATOM 826 N LEU A 877 9.679 -7.213 0.327 1.00 10.00 N ATOM 827 CA LEU A 877 8.886 -7.300 1.539 1.00 10.00 C ATOM 828 C LEU A 877 7.477 -7.810 1.245 1.00 10.00 C ATOM 829 O LEU A 877 6.988 -7.687 0.125 1.00 10.00 O ATOM 830 CB LEU A 877 8.809 -5.937 2.227 1.00 10.00 C ATOM 831 CG LEU A 877 9.351 -5.919 3.656 1.00 10.00 C ATOM 832 CD1 LEU A 877 10.862 -6.069 3.667 1.00 10.00 C ATOM 833 CD2 LEU A 877 8.938 -4.643 4.370 1.00 10.00 C ATOM 0 H LEU A 877 9.229 -6.710 -0.438 1.00 10.00 H new ATOM 0 HA LEU A 877 9.377 -8.011 2.204 1.00 10.00 H new ATOM 0 HB2 LEU A 877 9.364 -5.212 1.632 1.00 10.00 H new ATOM 0 HB3 LEU A 877 7.770 -5.609 2.242 1.00 10.00 H new ATOM 0 HG LEU A 877 8.922 -6.768 4.189 1.00 10.00 H new ATOM 0 HD11 LEU A 877 11.222 -6.053 4.696 1.00 10.00 H new ATOM 0 HD12 LEU A 877 11.137 -7.015 3.201 1.00 10.00 H new ATOM 0 HD13 LEU A 877 11.313 -5.247 3.112 1.00 10.00 H new ATOM 0 HD21 LEU A 877 9.334 -4.650 5.386 1.00 10.00 H new ATOM 0 HD22 LEU A 877 9.333 -3.781 3.832 1.00 10.00 H new ATOM 0 HD23 LEU A 877 7.850 -4.581 4.405 1.00 10.00 H new ATOM 845 N ASP A 878 6.846 -8.396 2.255 1.00 10.00 N ATOM 846 CA ASP A 878 5.487 -8.939 2.135 1.00 10.00 C ATOM 847 C ASP A 878 4.482 -7.842 1.767 1.00 10.00 C ATOM 848 O ASP A 878 4.293 -6.875 2.510 1.00 10.00 O ATOM 849 CB ASP A 878 5.097 -9.614 3.454 1.00 10.00 C ATOM 850 CG ASP A 878 3.724 -10.253 3.421 1.00 10.00 C ATOM 851 OD1 ASP A 878 3.622 -11.480 3.662 1.00 10.00 O ATOM 852 OD2 ASP A 878 2.736 -9.531 3.182 1.00 10.00 O ATOM 0 H ASP A 878 7.256 -8.511 3.182 1.00 10.00 H new ATOM 0 HA ASP A 878 5.470 -9.676 1.332 1.00 10.00 H new ATOM 0 HB2 ASP A 878 5.838 -10.376 3.697 1.00 10.00 H new ATOM 0 HB3 ASP A 878 5.126 -8.875 4.254 1.00 10.00 H new ATOM 857 N TYR A 879 3.850 -7.994 0.607 1.00 10.00 N ATOM 858 CA TYR A 879 2.876 -7.018 0.134 1.00 10.00 C ATOM 859 C TYR A 879 1.469 -7.311 0.678 1.00 10.00 C ATOM 860 O TYR A 879 0.649 -6.402 0.833 1.00 10.00 O ATOM 861 CB TYR A 879 2.864 -6.981 -1.405 1.00 10.00 C ATOM 862 CG TYR A 879 1.792 -7.830 -2.060 1.00 10.00 C ATOM 863 CD1 TYR A 879 0.623 -7.250 -2.542 1.00 10.00 C ATOM 864 CD2 TYR A 879 1.953 -9.201 -2.213 1.00 10.00 C ATOM 865 CE1 TYR A 879 -0.358 -8.019 -3.143 1.00 10.00 C ATOM 866 CE2 TYR A 879 0.981 -9.971 -2.810 1.00 10.00 C ATOM 867 CZ TYR A 879 -0.171 -9.379 -3.278 1.00 10.00 C ATOM 868 OH TYR A 879 -1.144 -10.152 -3.874 1.00 10.00 O ATOM 0 H TYR A 879 3.995 -8.784 -0.022 1.00 10.00 H new ATOM 0 HA TYR A 879 3.175 -6.039 0.510 1.00 10.00 H new ATOM 0 HB2 TYR A 879 2.735 -5.948 -1.727 1.00 10.00 H new ATOM 0 HB3 TYR A 879 3.838 -7.309 -1.769 1.00 10.00 H new ATOM 0 HD1 TYR A 879 0.479 -6.184 -2.446 1.00 10.00 H new ATOM 0 HD2 TYR A 879 2.858 -9.671 -1.857 1.00 10.00 H new ATOM 0 HE1 TYR A 879 -1.265 -7.557 -3.504 1.00 10.00 H new ATOM 0 HE2 TYR A 879 1.121 -11.037 -2.911 1.00 10.00 H new ATOM 0 HH TYR A 879 -1.544 -9.657 -4.619 1.00 10.00 H new ATOM 878 N MET A 880 1.198 -8.580 0.971 1.00 10.00 N ATOM 879 CA MET A 880 -0.103 -9.009 1.487 1.00 10.00 C ATOM 880 C MET A 880 -0.436 -8.304 2.794 1.00 10.00 C ATOM 881 O MET A 880 -1.593 -7.959 3.057 1.00 10.00 O ATOM 882 CB MET A 880 -0.111 -10.528 1.702 1.00 10.00 C ATOM 883 CG MET A 880 -1.345 -11.040 2.417 1.00 10.00 C ATOM 884 SD MET A 880 -1.275 -12.817 2.743 1.00 10.00 S ATOM 885 CE MET A 880 0.256 -12.940 3.671 1.00 10.00 C ATOM 0 H MET A 880 1.870 -9.339 0.859 1.00 10.00 H new ATOM 0 HA MET A 880 -0.861 -8.742 0.750 1.00 10.00 H new ATOM 0 HB2 MET A 880 -0.033 -11.023 0.734 1.00 10.00 H new ATOM 0 HB3 MET A 880 0.772 -10.809 2.276 1.00 10.00 H new ATOM 0 HG2 MET A 880 -1.461 -10.506 3.360 1.00 10.00 H new ATOM 0 HG3 MET A 880 -2.227 -10.820 1.815 1.00 10.00 H new ATOM 0 HE1 MET A 880 0.131 -13.653 4.486 1.00 10.00 H new ATOM 0 HE2 MET A 880 1.055 -13.279 3.012 1.00 10.00 H new ATOM 0 HE3 MET A 880 0.513 -11.963 4.080 1.00 10.00 H new ATOM 895 N SER A 881 0.595 -8.070 3.602 1.00 10.00 N ATOM 896 CA SER A 881 0.447 -7.421 4.888 1.00 10.00 C ATOM 897 C SER A 881 -0.047 -5.997 4.709 1.00 10.00 C ATOM 898 O SER A 881 -0.856 -5.509 5.493 1.00 10.00 O ATOM 899 CB SER A 881 1.782 -7.426 5.627 1.00 10.00 C ATOM 900 OG SER A 881 2.322 -8.732 5.664 1.00 10.00 O ATOM 0 H SER A 881 1.556 -8.328 3.377 1.00 10.00 H new ATOM 0 HA SER A 881 -0.288 -7.970 5.477 1.00 10.00 H new ATOM 0 HB2 SER A 881 2.481 -6.751 5.133 1.00 10.00 H new ATOM 0 HB3 SER A 881 1.644 -7.054 6.642 1.00 10.00 H new ATOM 0 HG SER A 881 2.432 -9.014 6.596 1.00 10.00 H new ATOM 906 N PHE A 882 0.428 -5.336 3.656 1.00 10.00 N ATOM 907 CA PHE A 882 0.004 -3.976 3.368 1.00 10.00 C ATOM 908 C PHE A 882 -1.492 -3.955 3.072 1.00 10.00 C ATOM 909 O PHE A 882 -2.224 -3.104 3.575 1.00 10.00 O ATOM 910 CB PHE A 882 0.792 -3.413 2.186 1.00 10.00 C ATOM 911 CG PHE A 882 0.346 -2.039 1.760 1.00 10.00 C ATOM 912 CD1 PHE A 882 0.542 -0.942 2.590 1.00 10.00 C ATOM 913 CD2 PHE A 882 -0.278 -1.845 0.536 1.00 10.00 C ATOM 914 CE1 PHE A 882 0.128 0.316 2.208 1.00 10.00 C ATOM 915 CE2 PHE A 882 -0.692 -0.581 0.152 1.00 10.00 C ATOM 916 CZ PHE A 882 -0.489 0.496 0.991 1.00 10.00 C ATOM 0 H PHE A 882 1.102 -5.720 2.994 1.00 10.00 H new ATOM 0 HA PHE A 882 0.200 -3.350 4.238 1.00 10.00 H new ATOM 0 HB2 PHE A 882 1.849 -3.377 2.450 1.00 10.00 H new ATOM 0 HB3 PHE A 882 0.698 -4.094 1.340 1.00 10.00 H new ATOM 0 HD1 PHE A 882 1.025 -1.077 3.547 1.00 10.00 H new ATOM 0 HD2 PHE A 882 -0.442 -2.686 -0.122 1.00 10.00 H new ATOM 0 HE1 PHE A 882 0.288 1.160 2.863 1.00 10.00 H new ATOM 0 HE2 PHE A 882 -1.174 -0.438 -0.804 1.00 10.00 H new ATOM 0 HZ PHE A 882 -0.815 1.481 0.692 1.00 10.00 H new ATOM 926 N SER A 883 -1.935 -4.911 2.262 1.00 10.00 N ATOM 927 CA SER A 883 -3.341 -5.025 1.908 1.00 10.00 C ATOM 928 C SER A 883 -4.174 -5.333 3.153 1.00 10.00 C ATOM 929 O SER A 883 -5.318 -4.891 3.278 1.00 10.00 O ATOM 930 CB SER A 883 -3.515 -6.138 0.876 1.00 10.00 C ATOM 931 OG SER A 883 -2.589 -6.014 -0.197 1.00 10.00 O ATOM 0 H SER A 883 -1.336 -5.620 1.838 1.00 10.00 H new ATOM 0 HA SER A 883 -3.683 -4.081 1.484 1.00 10.00 H new ATOM 0 HB2 SER A 883 -3.383 -7.106 1.360 1.00 10.00 H new ATOM 0 HB3 SER A 883 -4.532 -6.114 0.483 1.00 10.00 H new ATOM 0 HG SER A 883 -2.861 -6.601 -0.933 1.00 10.00 H new ATOM 937 N THR A 884 -3.580 -6.079 4.076 1.00 10.00 N ATOM 938 CA THR A 884 -4.240 -6.447 5.318 1.00 10.00 C ATOM 939 C THR A 884 -4.401 -5.229 6.228 1.00 10.00 C ATOM 940 O THR A 884 -5.502 -4.938 6.705 1.00 10.00 O ATOM 941 CB THR A 884 -3.438 -7.549 6.048 1.00 10.00 C ATOM 942 OG1 THR A 884 -3.180 -8.650 5.155 1.00 10.00 O ATOM 943 CG2 THR A 884 -4.190 -8.046 7.275 1.00 10.00 C ATOM 0 H THR A 884 -2.632 -6.443 3.984 1.00 10.00 H new ATOM 0 HA THR A 884 -5.230 -6.832 5.075 1.00 10.00 H new ATOM 0 HB THR A 884 -2.490 -7.120 6.373 1.00 10.00 H new ATOM 0 HG1 THR A 884 -2.497 -8.389 4.503 1.00 10.00 H new ATOM 0 HG21 THR A 884 -3.605 -8.821 7.771 1.00 10.00 H new ATOM 0 HG22 THR A 884 -4.352 -7.216 7.963 1.00 10.00 H new ATOM 0 HG23 THR A 884 -5.152 -8.457 6.970 1.00 10.00 H new ATOM 951 N ALA A 885 -3.309 -4.503 6.437 1.00 10.00 N ATOM 952 CA ALA A 885 -3.335 -3.321 7.282 1.00 10.00 C ATOM 953 C ALA A 885 -4.259 -2.262 6.691 1.00 10.00 C ATOM 954 O ALA A 885 -4.897 -1.494 7.415 1.00 10.00 O ATOM 955 CB ALA A 885 -1.930 -2.759 7.446 1.00 10.00 C ATOM 0 H ALA A 885 -2.397 -4.714 6.032 1.00 10.00 H new ATOM 0 HA ALA A 885 -3.716 -3.606 8.263 1.00 10.00 H new ATOM 0 HB1 ALA A 885 -1.964 -1.874 8.081 1.00 10.00 H new ATOM 0 HB2 ALA A 885 -1.289 -3.511 7.906 1.00 10.00 H new ATOM 0 HB3 ALA A 885 -1.530 -2.489 6.469 1.00 10.00 H new ATOM 961 N LEU A 886 -4.321 -2.237 5.369 1.00 10.00 N ATOM 962 CA LEU A 886 -5.163 -1.289 4.657 1.00 10.00 C ATOM 963 C LEU A 886 -6.630 -1.692 4.737 1.00 10.00 C ATOM 964 O LEU A 886 -7.515 -0.841 4.650 1.00 10.00 O ATOM 965 CB LEU A 886 -4.719 -1.173 3.195 1.00 10.00 C ATOM 966 CG LEU A 886 -5.431 -0.089 2.383 1.00 10.00 C ATOM 967 CD1 LEU A 886 -4.986 1.294 2.831 1.00 10.00 C ATOM 968 CD2 LEU A 886 -5.172 -0.288 0.895 1.00 10.00 C ATOM 0 H LEU A 886 -3.794 -2.867 4.764 1.00 10.00 H new ATOM 0 HA LEU A 886 -5.054 -0.315 5.134 1.00 10.00 H new ATOM 0 HB2 LEU A 886 -3.647 -0.977 3.172 1.00 10.00 H new ATOM 0 HB3 LEU A 886 -4.878 -2.134 2.706 1.00 10.00 H new ATOM 0 HG LEU A 886 -6.504 -0.171 2.558 1.00 10.00 H new ATOM 0 HD11 LEU A 886 -5.503 2.051 2.242 1.00 10.00 H new ATOM 0 HD12 LEU A 886 -5.225 1.429 3.886 1.00 10.00 H new ATOM 0 HD13 LEU A 886 -3.910 1.395 2.687 1.00 10.00 H new ATOM 0 HD21 LEU A 886 -5.684 0.490 0.329 1.00 10.00 H new ATOM 0 HD22 LEU A 886 -4.101 -0.232 0.701 1.00 10.00 H new ATOM 0 HD23 LEU A 886 -5.545 -1.265 0.588 1.00 10.00 H new ATOM 980 N TYR A 887 -6.876 -2.987 4.923 1.00 10.00 N ATOM 981 CA TYR A 887 -8.235 -3.510 5.015 1.00 10.00 C ATOM 982 C TYR A 887 -8.850 -3.171 6.377 1.00 10.00 C ATOM 983 O TYR A 887 -10.042 -2.868 6.468 1.00 10.00 O ATOM 984 CB TYR A 887 -8.261 -5.030 4.768 1.00 10.00 C ATOM 985 CG TYR A 887 -9.621 -5.663 4.991 1.00 10.00 C ATOM 986 CD1 TYR A 887 -9.784 -6.700 5.898 1.00 10.00 C ATOM 987 CD2 TYR A 887 -10.741 -5.221 4.293 1.00 10.00 C ATOM 988 CE1 TYR A 887 -11.020 -7.279 6.106 1.00 10.00 C ATOM 989 CE2 TYR A 887 -11.986 -5.797 4.497 1.00 10.00 C ATOM 990 CZ TYR A 887 -12.119 -6.831 5.405 1.00 10.00 C ATOM 991 OH TYR A 887 -13.351 -7.414 5.624 1.00 10.00 O ATOM 0 H TYR A 887 -6.148 -3.695 5.013 1.00 10.00 H new ATOM 0 HA TYR A 887 -8.834 -3.035 4.238 1.00 10.00 H new ATOM 0 HB2 TYR A 887 -7.942 -5.228 3.745 1.00 10.00 H new ATOM 0 HB3 TYR A 887 -7.536 -5.508 5.426 1.00 10.00 H new ATOM 0 HD1 TYR A 887 -8.929 -7.061 6.451 1.00 10.00 H new ATOM 0 HD2 TYR A 887 -10.639 -4.416 3.580 1.00 10.00 H new ATOM 0 HE1 TYR A 887 -11.126 -8.084 6.819 1.00 10.00 H new ATOM 0 HE2 TYR A 887 -12.846 -5.440 3.950 1.00 10.00 H new ATOM 0 HH TYR A 887 -14.022 -6.985 5.053 1.00 10.00 H new ATOM 1001 N GLY A 888 -8.036 -3.222 7.421 1.00 10.00 N ATOM 1002 CA GLY A 888 -8.527 -2.913 8.746 1.00 10.00 C ATOM 1003 C GLY A 888 -8.806 -1.434 8.914 1.00 10.00 C ATOM 1004 O GLY A 888 -7.902 -0.600 8.795 1.00 10.00 O ATOM 0 H GLY A 888 -7.048 -3.471 7.374 1.00 10.00 H new ATOM 0 HA2 GLY A 888 -9.439 -3.478 8.936 1.00 10.00 H new ATOM 0 HA3 GLY A 888 -7.794 -3.231 9.488 1.00 10.00 H new ATOM 1008 N GLU A 889 -10.055 -1.111 9.179 1.00 10.00 N ATOM 1009 CA GLU A 889 -10.465 0.266 9.366 1.00 10.00 C ATOM 1010 C GLU A 889 -10.644 0.549 10.850 1.00 10.00 C ATOM 1011 O GLU A 889 -10.946 -0.356 11.629 1.00 10.00 O ATOM 1012 CB GLU A 889 -11.768 0.531 8.607 1.00 10.00 C ATOM 1013 CG GLU A 889 -11.684 1.673 7.609 1.00 10.00 C ATOM 1014 CD GLU A 889 -12.159 2.988 8.183 1.00 10.00 C ATOM 1015 OE1 GLU A 889 -13.076 3.608 7.593 1.00 10.00 O ATOM 1016 OE2 GLU A 889 -11.617 3.414 9.228 1.00 10.00 O ATOM 0 H GLU A 889 -10.810 -1.790 9.270 1.00 10.00 H new ATOM 0 HA GLU A 889 -9.695 0.930 8.972 1.00 10.00 H new ATOM 0 HB2 GLU A 889 -12.060 -0.377 8.080 1.00 10.00 H new ATOM 0 HB3 GLU A 889 -12.557 0.749 9.327 1.00 10.00 H new ATOM 0 HG2 GLU A 889 -10.653 1.780 7.272 1.00 10.00 H new ATOM 0 HG3 GLU A 889 -12.282 1.427 6.732 1.00 10.00 H new ATOM 1023 N SER A 890 -10.450 1.797 11.233 1.00 10.00 N ATOM 1024 CA SER A 890 -10.595 2.202 12.627 1.00 10.00 C ATOM 1025 C SER A 890 -12.058 2.486 12.936 1.00 10.00 C ATOM 1026 O SER A 890 -12.511 2.347 14.072 1.00 10.00 O ATOM 1027 CB SER A 890 -9.725 3.430 12.909 1.00 10.00 C ATOM 1028 OG SER A 890 -8.414 3.241 12.401 1.00 10.00 O ATOM 0 H SER A 890 -10.191 2.553 10.599 1.00 10.00 H new ATOM 0 HA SER A 890 -10.260 1.392 13.275 1.00 10.00 H new ATOM 0 HB2 SER A 890 -10.174 4.313 12.453 1.00 10.00 H new ATOM 0 HB3 SER A 890 -9.682 3.613 13.983 1.00 10.00 H new ATOM 0 HG SER A 890 -7.873 4.036 12.589 1.00 10.00 H new ATOM 1034 N ASP A 891 -12.792 2.866 11.900 1.00 10.00 N ATOM 1035 CA ASP A 891 -14.206 3.169 12.024 1.00 10.00 C ATOM 1036 C ASP A 891 -14.953 2.616 10.810 1.00 10.00 C ATOM 1037 O ASP A 891 -15.103 3.290 9.788 1.00 10.00 O ATOM 1038 CB ASP A 891 -14.407 4.683 12.174 1.00 10.00 C ATOM 1039 CG ASP A 891 -15.828 5.123 11.876 1.00 10.00 C ATOM 1040 OD1 ASP A 891 -16.025 5.868 10.886 1.00 10.00 O ATOM 1041 OD2 ASP A 891 -16.753 4.717 12.616 1.00 10.00 O ATOM 0 H ASP A 891 -12.424 2.972 10.955 1.00 10.00 H new ATOM 0 HA ASP A 891 -14.611 2.694 12.917 1.00 10.00 H new ATOM 0 HB2 ASP A 891 -14.146 4.980 13.190 1.00 10.00 H new ATOM 0 HB3 ASP A 891 -13.723 5.203 11.504 1.00 10.00 H new ATOM 1046 N LEU A 892 -15.366 1.362 10.911 1.00 10.00 N ATOM 1047 CA LEU A 892 -16.081 0.705 9.833 1.00 10.00 C ATOM 1048 C LEU A 892 -16.983 -0.366 10.406 1.00 10.00 C ATOM 1049 O LEU A 892 -18.192 -0.113 10.548 1.00 10.00 O ATOM 1050 CB LEU A 892 -15.094 0.080 8.845 1.00 10.00 C ATOM 1051 CG LEU A 892 -15.721 -0.655 7.661 1.00 10.00 C ATOM 1052 CD1 LEU A 892 -16.540 0.301 6.816 1.00 10.00 C ATOM 1053 CD2 LEU A 892 -14.645 -1.329 6.820 1.00 10.00 C ATOM 1054 OXT LEU A 892 -16.470 -1.453 10.743 1.00 10.00 O ATOM 0 H LEU A 892 -15.216 0.778 11.734 1.00 10.00 H new ATOM 0 HA LEU A 892 -16.684 1.443 9.304 1.00 10.00 H new ATOM 0 HB2 LEU A 892 -14.446 0.867 8.459 1.00 10.00 H new ATOM 0 HB3 LEU A 892 -14.458 -0.619 9.388 1.00 10.00 H new ATOM 0 HG LEU A 892 -16.386 -1.427 8.047 1.00 10.00 H new ATOM 0 HD11 LEU A 892 -16.979 -0.239 5.977 1.00 10.00 H new ATOM 0 HD12 LEU A 892 -17.334 0.735 7.424 1.00 10.00 H new ATOM 0 HD13 LEU A 892 -15.896 1.096 6.439 1.00 10.00 H new ATOM 0 HD21 LEU A 892 -15.110 -1.847 5.982 1.00 10.00 H new ATOM 0 HD22 LEU A 892 -13.953 -0.576 6.442 1.00 10.00 H new ATOM 0 HD23 LEU A 892 -14.100 -2.047 7.433 1.00 10.00 H new TER 1066 LEU A 892 ATOM 1067 N GLY B1646 -0.863 -5.912 -16.669 1.00 10.00 N ATOM 1068 CA GLY B1646 -0.305 -4.563 -16.945 1.00 10.00 C ATOM 1069 C GLY B1646 0.246 -3.907 -15.699 1.00 10.00 C ATOM 1070 O GLY B1646 -0.298 -4.078 -14.610 1.00 10.00 O ATOM 0 HA2 GLY B1646 0.486 -4.644 -17.691 1.00 10.00 H new ATOM 0 HA3 GLY B1646 -1.083 -3.931 -17.373 1.00 10.00 H new ATOM 1076 N LYS B1647 1.318 -3.146 -15.860 1.00 10.00 N ATOM 1077 CA LYS B1647 1.945 -2.476 -14.740 1.00 10.00 C ATOM 1078 C LYS B1647 1.220 -1.180 -14.415 1.00 10.00 C ATOM 1079 O LYS B1647 0.749 -1.003 -13.294 1.00 10.00 O ATOM 1080 CB LYS B1647 3.418 -2.200 -15.035 1.00 10.00 C ATOM 1081 CG LYS B1647 4.274 -3.457 -15.078 1.00 10.00 C ATOM 1082 CD LYS B1647 5.743 -3.140 -14.872 1.00 10.00 C ATOM 1083 CE LYS B1647 6.148 -3.316 -13.421 1.00 10.00 C ATOM 1084 NZ LYS B1647 7.451 -2.658 -13.117 1.00 10.00 N ATOM 0 H LYS B1647 1.770 -2.979 -16.759 1.00 10.00 H new ATOM 0 HA LYS B1647 1.882 -3.133 -13.873 1.00 10.00 H new ATOM 0 HB2 LYS B1647 3.498 -1.682 -15.991 1.00 10.00 H new ATOM 0 HB3 LYS B1647 3.813 -1.527 -14.274 1.00 10.00 H new ATOM 0 HG2 LYS B1647 3.940 -4.152 -14.308 1.00 10.00 H new ATOM 0 HG3 LYS B1647 4.140 -3.956 -16.038 1.00 10.00 H new ATOM 0 HD2 LYS B1647 6.349 -3.791 -15.502 1.00 10.00 H new ATOM 0 HD3 LYS B1647 5.943 -2.116 -15.186 1.00 10.00 H new ATOM 0 HE2 LYS B1647 5.374 -2.900 -12.776 1.00 10.00 H new ATOM 0 HE3 LYS B1647 6.217 -4.379 -13.191 1.00 10.00 H new ATOM 0 HZ1 LYS B1647 8.028 -3.288 -12.523 1.00 10.00 H new ATOM 0 HZ2 LYS B1647 7.956 -2.461 -14.005 1.00 10.00 H new ATOM 0 HZ3 LYS B1647 7.280 -1.766 -12.610 1.00 10.00 H new ATOM 1098 N PHE B1648 1.095 -0.301 -15.411 1.00 10.00 N ATOM 1099 CA PHE B1648 0.431 0.983 -15.225 1.00 10.00 C ATOM 1100 C PHE B1648 -1.034 0.771 -14.880 1.00 10.00 C ATOM 1101 O PHE B1648 -1.618 1.534 -14.112 1.00 10.00 O ATOM 1102 CB PHE B1648 0.556 1.838 -16.492 1.00 10.00 C ATOM 1103 CG PHE B1648 1.977 2.141 -16.868 1.00 10.00 C ATOM 1104 CD1 PHE B1648 2.694 3.114 -16.186 1.00 10.00 C ATOM 1105 CD2 PHE B1648 2.600 1.449 -17.899 1.00 10.00 C ATOM 1106 CE1 PHE B1648 4.003 3.396 -16.533 1.00 10.00 C ATOM 1107 CE2 PHE B1648 3.905 1.729 -18.246 1.00 10.00 C ATOM 1108 CZ PHE B1648 4.607 2.699 -17.561 1.00 10.00 C ATOM 0 H PHE B1648 1.447 -0.459 -16.355 1.00 10.00 H new ATOM 0 HA PHE B1648 0.915 1.508 -14.401 1.00 10.00 H new ATOM 0 HB2 PHE B1648 0.071 1.321 -17.320 1.00 10.00 H new ATOM 0 HB3 PHE B1648 0.019 2.775 -16.344 1.00 10.00 H new ATOM 0 HD1 PHE B1648 2.226 3.656 -15.377 1.00 10.00 H new ATOM 0 HD2 PHE B1648 2.057 0.684 -18.434 1.00 10.00 H new ATOM 0 HE1 PHE B1648 4.551 4.159 -16.001 1.00 10.00 H new ATOM 0 HE2 PHE B1648 4.377 1.189 -19.054 1.00 10.00 H new ATOM 0 HZ PHE B1648 5.631 2.914 -17.829 1.00 10.00 H new ATOM 1118 N TYR B1649 -1.622 -0.278 -15.451 1.00 10.00 N ATOM 1119 CA TYR B1649 -3.015 -0.611 -15.197 1.00 10.00 C ATOM 1120 C TYR B1649 -3.216 -0.878 -13.711 1.00 10.00 C ATOM 1121 O TYR B1649 -4.180 -0.419 -13.105 1.00 10.00 O ATOM 1122 CB TYR B1649 -3.419 -1.839 -16.012 1.00 10.00 C ATOM 1123 CG TYR B1649 -4.906 -1.959 -16.247 1.00 10.00 C ATOM 1124 CD1 TYR B1649 -5.646 -2.960 -15.637 1.00 10.00 C ATOM 1125 CD2 TYR B1649 -5.569 -1.069 -17.081 1.00 10.00 C ATOM 1126 CE1 TYR B1649 -7.008 -3.073 -15.854 1.00 10.00 C ATOM 1127 CE2 TYR B1649 -6.925 -1.175 -17.306 1.00 10.00 C ATOM 1128 CZ TYR B1649 -7.642 -2.177 -16.688 1.00 10.00 C ATOM 1129 OH TYR B1649 -8.999 -2.273 -16.903 1.00 10.00 O ATOM 0 H TYR B1649 -1.150 -0.912 -16.095 1.00 10.00 H new ATOM 0 HA TYR B1649 -3.643 0.228 -15.497 1.00 10.00 H new ATOM 0 HB2 TYR B1649 -2.911 -1.806 -16.976 1.00 10.00 H new ATOM 0 HB3 TYR B1649 -3.069 -2.734 -15.498 1.00 10.00 H new ATOM 0 HD1 TYR B1649 -5.152 -3.663 -14.982 1.00 10.00 H new ATOM 0 HD2 TYR B1649 -5.012 -0.279 -17.563 1.00 10.00 H new ATOM 0 HE1 TYR B1649 -7.571 -3.859 -15.373 1.00 10.00 H new ATOM 0 HE2 TYR B1649 -7.423 -0.477 -17.963 1.00 10.00 H new ATOM 0 HH TYR B1649 -9.284 -1.563 -17.516 1.00 10.00 H new ATOM 1139 N ALA B1650 -2.273 -1.601 -13.133 1.00 10.00 N ATOM 1140 CA ALA B1650 -2.321 -1.936 -11.720 1.00 10.00 C ATOM 1141 C ALA B1650 -2.202 -0.687 -10.855 1.00 10.00 C ATOM 1142 O ALA B1650 -2.948 -0.514 -9.888 1.00 10.00 O ATOM 1143 CB ALA B1650 -1.221 -2.920 -11.389 1.00 10.00 C ATOM 0 H ALA B1650 -1.459 -1.970 -13.624 1.00 10.00 H new ATOM 0 HA ALA B1650 -3.286 -2.396 -11.506 1.00 10.00 H new ATOM 0 HB1 ALA B1650 -1.262 -3.168 -10.328 1.00 10.00 H new ATOM 0 HB2 ALA B1650 -1.354 -3.827 -11.979 1.00 10.00 H new ATOM 0 HB3 ALA B1650 -0.253 -2.475 -11.621 1.00 10.00 H new ATOM 1149 N THR B1651 -1.270 0.186 -11.220 1.00 10.00 N ATOM 1150 CA THR B1651 -1.049 1.429 -10.493 1.00 10.00 C ATOM 1151 C THR B1651 -2.316 2.280 -10.476 1.00 10.00 C ATOM 1152 O THR B1651 -2.691 2.836 -9.443 1.00 10.00 O ATOM 1153 CB THR B1651 0.098 2.242 -11.121 1.00 10.00 C ATOM 1154 OG1 THR B1651 0.893 1.392 -11.950 1.00 10.00 O ATOM 1155 CG2 THR B1651 0.984 2.853 -10.046 1.00 10.00 C ATOM 0 H THR B1651 -0.652 0.054 -12.021 1.00 10.00 H new ATOM 0 HA THR B1651 -0.779 1.164 -9.471 1.00 10.00 H new ATOM 0 HB THR B1651 -0.340 3.044 -11.715 1.00 10.00 H new ATOM 0 HG1 THR B1651 1.621 1.913 -12.350 1.00 10.00 H new ATOM 0 HG21 THR B1651 1.786 3.422 -10.516 1.00 10.00 H new ATOM 0 HG22 THR B1651 0.389 3.516 -9.417 1.00 10.00 H new ATOM 0 HG23 THR B1651 1.412 2.060 -9.433 1.00 10.00 H new ATOM 1163 N PHE B1652 -2.985 2.348 -11.624 1.00 10.00 N ATOM 1164 CA PHE B1652 -4.216 3.123 -11.754 1.00 10.00 C ATOM 1165 C PHE B1652 -5.327 2.560 -10.873 1.00 10.00 C ATOM 1166 O PHE B1652 -6.140 3.317 -10.338 1.00 10.00 O ATOM 1167 CB PHE B1652 -4.669 3.157 -13.206 1.00 10.00 C ATOM 1168 CG PHE B1652 -4.056 4.284 -13.989 1.00 10.00 C ATOM 1169 CD1 PHE B1652 -3.082 4.041 -14.942 1.00 10.00 C ATOM 1170 CD2 PHE B1652 -4.448 5.590 -13.759 1.00 10.00 C ATOM 1171 CE1 PHE B1652 -2.506 5.076 -15.647 1.00 10.00 C ATOM 1172 CE2 PHE B1652 -3.875 6.634 -14.464 1.00 10.00 C ATOM 1173 CZ PHE B1652 -2.902 6.375 -15.411 1.00 10.00 C ATOM 0 H PHE B1652 -2.695 1.875 -12.480 1.00 10.00 H new ATOM 0 HA PHE B1652 -4.004 4.139 -11.421 1.00 10.00 H new ATOM 0 HB2 PHE B1652 -4.413 2.211 -13.682 1.00 10.00 H new ATOM 0 HB3 PHE B1652 -5.755 3.248 -13.240 1.00 10.00 H new ATOM 0 HD1 PHE B1652 -2.769 3.026 -15.136 1.00 10.00 H new ATOM 0 HD2 PHE B1652 -5.209 5.797 -13.022 1.00 10.00 H new ATOM 0 HE1 PHE B1652 -1.744 4.869 -16.384 1.00 10.00 H new ATOM 0 HE2 PHE B1652 -4.188 7.650 -14.274 1.00 10.00 H new ATOM 0 HZ PHE B1652 -2.454 7.187 -15.964 1.00 10.00 H new ATOM 1183 N LEU B1653 -5.356 1.234 -10.725 1.00 10.00 N ATOM 1184 CA LEU B1653 -6.357 0.572 -9.895 1.00 10.00 C ATOM 1185 C LEU B1653 -6.168 0.966 -8.440 1.00 10.00 C ATOM 1186 O LEU B1653 -7.136 1.237 -7.732 1.00 10.00 O ATOM 1187 CB LEU B1653 -6.257 -0.948 -10.032 1.00 10.00 C ATOM 1188 CG LEU B1653 -6.629 -1.505 -11.399 1.00 10.00 C ATOM 1189 CD1 LEU B1653 -6.371 -2.998 -11.437 1.00 10.00 C ATOM 1190 CD2 LEU B1653 -8.085 -1.214 -11.713 1.00 10.00 C ATOM 0 H LEU B1653 -4.695 0.599 -11.172 1.00 10.00 H new ATOM 0 HA LEU B1653 -7.344 0.888 -10.232 1.00 10.00 H new ATOM 0 HB2 LEU B1653 -5.236 -1.250 -9.801 1.00 10.00 H new ATOM 0 HB3 LEU B1653 -6.903 -1.407 -9.283 1.00 10.00 H new ATOM 0 HG LEU B1653 -6.011 -1.020 -12.155 1.00 10.00 H new ATOM 0 HD11 LEU B1653 -6.640 -3.389 -12.418 1.00 10.00 H new ATOM 0 HD12 LEU B1653 -5.315 -3.190 -11.247 1.00 10.00 H new ATOM 0 HD13 LEU B1653 -6.973 -3.491 -10.673 1.00 10.00 H new ATOM 0 HD21 LEU B1653 -8.334 -1.619 -12.694 1.00 10.00 H new ATOM 0 HD22 LEU B1653 -8.720 -1.677 -10.957 1.00 10.00 H new ATOM 0 HD23 LEU B1653 -8.249 -0.136 -11.713 1.00 10.00 H new ATOM 1202 N ILE B1654 -4.910 1.011 -8.003 1.00 10.00 N ATOM 1203 CA ILE B1654 -4.585 1.381 -6.630 1.00 10.00 C ATOM 1204 C ILE B1654 -4.978 2.829 -6.366 1.00 10.00 C ATOM 1205 O ILE B1654 -5.571 3.147 -5.332 1.00 10.00 O ATOM 1206 CB ILE B1654 -3.078 1.189 -6.330 1.00 10.00 C ATOM 1207 CG1 ILE B1654 -2.608 -0.199 -6.779 1.00 10.00 C ATOM 1208 CG2 ILE B1654 -2.811 1.379 -4.847 1.00 10.00 C ATOM 1209 CD1 ILE B1654 -1.127 -0.441 -6.573 1.00 10.00 C ATOM 0 H ILE B1654 -4.099 0.795 -8.583 1.00 10.00 H new ATOM 0 HA ILE B1654 -5.151 0.723 -5.970 1.00 10.00 H new ATOM 0 HB ILE B1654 -2.518 1.938 -6.889 1.00 10.00 H new ATOM 0 HG12 ILE B1654 -3.170 -0.957 -6.232 1.00 10.00 H new ATOM 0 HG13 ILE B1654 -2.844 -0.328 -7.835 1.00 10.00 H new ATOM 0 HG21 ILE B1654 -1.748 1.242 -4.648 1.00 10.00 H new ATOM 0 HG22 ILE B1654 -3.109 2.384 -4.550 1.00 10.00 H new ATOM 0 HG23 ILE B1654 -3.384 0.647 -4.277 1.00 10.00 H new ATOM 0 HD11 ILE B1654 -0.871 -1.444 -6.914 1.00 10.00 H new ATOM 0 HD12 ILE B1654 -0.556 0.293 -7.142 1.00 10.00 H new ATOM 0 HD13 ILE B1654 -0.887 -0.346 -5.514 1.00 10.00 H new ATOM 1221 N GLN B1655 -4.669 3.688 -7.325 1.00 10.00 N ATOM 1222 CA GLN B1655 -4.977 5.108 -7.222 1.00 10.00 C ATOM 1223 C GLN B1655 -6.476 5.350 -7.040 1.00 10.00 C ATOM 1224 O GLN B1655 -6.890 6.105 -6.154 1.00 10.00 O ATOM 1225 CB GLN B1655 -4.482 5.849 -8.468 1.00 10.00 C ATOM 1226 CG GLN B1655 -2.980 6.067 -8.496 1.00 10.00 C ATOM 1227 CD GLN B1655 -2.514 6.711 -9.788 1.00 10.00 C ATOM 1228 OE1 GLN B1655 -2.124 6.027 -10.739 1.00 10.00 O ATOM 1229 NE2 GLN B1655 -2.540 8.037 -9.831 1.00 10.00 N ATOM 0 H GLN B1655 -4.201 3.424 -8.192 1.00 10.00 H new ATOM 0 HA GLN B1655 -4.463 5.492 -6.340 1.00 10.00 H new ATOM 0 HB2 GLN B1655 -4.774 5.286 -9.354 1.00 10.00 H new ATOM 0 HB3 GLN B1655 -4.981 6.816 -8.526 1.00 10.00 H new ATOM 0 HG2 GLN B1655 -2.691 6.697 -7.654 1.00 10.00 H new ATOM 0 HG3 GLN B1655 -2.474 5.110 -8.367 1.00 10.00 H new ATOM 0 HE21 GLN B1655 -2.869 8.567 -9.024 1.00 10.00 H new ATOM 0 HE22 GLN B1655 -2.231 8.526 -10.671 1.00 10.00 H new ATOM 1238 N GLU B1656 -7.282 4.697 -7.879 1.00 10.00 N ATOM 1239 CA GLU B1656 -8.732 4.852 -7.828 1.00 10.00 C ATOM 1240 C GLU B1656 -9.302 4.279 -6.538 1.00 10.00 C ATOM 1241 O GLU B1656 -10.256 4.826 -5.987 1.00 10.00 O ATOM 1242 CB GLU B1656 -9.398 4.181 -9.034 1.00 10.00 C ATOM 1243 CG GLU B1656 -10.544 4.989 -9.618 1.00 10.00 C ATOM 1244 CD GLU B1656 -10.137 6.413 -9.976 1.00 10.00 C ATOM 1245 OE1 GLU B1656 -9.239 6.582 -10.826 1.00 10.00 O ATOM 1246 OE2 GLU B1656 -10.715 7.373 -9.417 1.00 10.00 O ATOM 0 H GLU B1656 -6.953 4.056 -8.601 1.00 10.00 H new ATOM 0 HA GLU B1656 -8.946 5.920 -7.858 1.00 10.00 H new ATOM 0 HB2 GLU B1656 -8.649 4.016 -9.808 1.00 10.00 H new ATOM 0 HB3 GLU B1656 -9.770 3.201 -8.736 1.00 10.00 H new ATOM 0 HG2 GLU B1656 -10.919 4.488 -10.510 1.00 10.00 H new ATOM 0 HG3 GLU B1656 -11.364 5.019 -8.901 1.00 10.00 H new ATOM 1253 N TYR B1657 -8.715 3.184 -6.046 1.00 10.00 N ATOM 1254 CA TYR B1657 -9.189 2.566 -4.812 1.00 10.00 C ATOM 1255 C TYR B1657 -8.998 3.517 -3.637 1.00 10.00 C ATOM 1256 O TYR B1657 -9.898 3.698 -2.822 1.00 10.00 O ATOM 1257 CB TYR B1657 -8.471 1.244 -4.539 1.00 10.00 C ATOM 1258 CG TYR B1657 -9.068 0.488 -3.371 1.00 10.00 C ATOM 1259 CD1 TYR B1657 -8.391 0.384 -2.162 1.00 10.00 C ATOM 1260 CD2 TYR B1657 -10.313 -0.114 -3.482 1.00 10.00 C ATOM 1261 CE1 TYR B1657 -8.942 -0.298 -1.092 1.00 10.00 C ATOM 1262 CE2 TYR B1657 -10.873 -0.798 -2.417 1.00 10.00 C ATOM 1263 CZ TYR B1657 -10.181 -0.887 -1.223 1.00 10.00 C ATOM 1264 OH TYR B1657 -10.731 -1.556 -0.152 1.00 10.00 O ATOM 0 H TYR B1657 -7.920 2.714 -6.480 1.00 10.00 H new ATOM 0 HA TYR B1657 -10.252 2.355 -4.932 1.00 10.00 H new ATOM 0 HB2 TYR B1657 -8.515 0.620 -5.432 1.00 10.00 H new ATOM 0 HB3 TYR B1657 -7.418 1.441 -4.339 1.00 10.00 H new ATOM 0 HD1 TYR B1657 -7.419 0.843 -2.056 1.00 10.00 H new ATOM 0 HD2 TYR B1657 -10.854 -0.048 -4.414 1.00 10.00 H new ATOM 0 HE1 TYR B1657 -8.404 -0.369 -0.158 1.00 10.00 H new ATOM 0 HE2 TYR B1657 -11.844 -1.259 -2.518 1.00 10.00 H new ATOM 0 HH TYR B1657 -11.608 -1.914 -0.405 1.00 10.00 H new ATOM 1274 N PHE B1658 -7.812 4.111 -3.549 1.00 10.00 N ATOM 1275 CA PHE B1658 -7.512 5.062 -2.484 1.00 10.00 C ATOM 1276 C PHE B1658 -8.429 6.264 -2.600 1.00 10.00 C ATOM 1277 O PHE B1658 -8.926 6.778 -1.599 1.00 10.00 O ATOM 1278 CB PHE B1658 -6.048 5.506 -2.549 1.00 10.00 C ATOM 1279 CG PHE B1658 -5.120 4.599 -1.798 1.00 10.00 C ATOM 1280 CD1 PHE B1658 -4.468 5.046 -0.662 1.00 10.00 C ATOM 1281 CD2 PHE B1658 -4.898 3.299 -2.225 1.00 10.00 C ATOM 1282 CE1 PHE B1658 -3.622 4.211 0.040 1.00 10.00 C ATOM 1283 CE2 PHE B1658 -4.051 2.463 -1.529 1.00 10.00 C ATOM 1284 CZ PHE B1658 -3.409 2.921 -0.397 1.00 10.00 C ATOM 0 H PHE B1658 -7.044 3.951 -4.201 1.00 10.00 H new ATOM 0 HA PHE B1658 -7.677 4.574 -1.523 1.00 10.00 H new ATOM 0 HB2 PHE B1658 -5.735 5.552 -3.592 1.00 10.00 H new ATOM 0 HB3 PHE B1658 -5.963 6.515 -2.146 1.00 10.00 H new ATOM 0 HD1 PHE B1658 -4.623 6.059 -0.321 1.00 10.00 H new ATOM 0 HD2 PHE B1658 -5.394 2.937 -3.113 1.00 10.00 H new ATOM 0 HE1 PHE B1658 -3.127 4.568 0.931 1.00 10.00 H new ATOM 0 HE2 PHE B1658 -3.890 1.451 -1.870 1.00 10.00 H new ATOM 0 HZ PHE B1658 -2.740 2.270 0.146 1.00 10.00 H new ATOM 1294 N ARG B1659 -8.662 6.691 -3.833 1.00 10.00 N ATOM 1295 CA ARG B1659 -9.523 7.828 -4.103 1.00 10.00 C ATOM 1296 C ARG B1659 -10.967 7.553 -3.670 1.00 10.00 C ATOM 1297 O ARG B1659 -11.537 8.312 -2.882 1.00 10.00 O ATOM 1298 CB ARG B1659 -9.473 8.181 -5.592 1.00 10.00 C ATOM 1299 CG ARG B1659 -10.241 9.440 -5.954 1.00 10.00 C ATOM 1300 CD ARG B1659 -9.528 10.218 -7.045 1.00 10.00 C ATOM 1301 NE ARG B1659 -9.177 9.377 -8.194 1.00 10.00 N ATOM 1302 CZ ARG B1659 -8.067 9.530 -8.917 1.00 10.00 C ATOM 1303 NH1 ARG B1659 -7.198 10.483 -8.612 1.00 10.00 N ATOM 1304 NH2 ARG B1659 -7.819 8.733 -9.948 1.00 10.00 N ATOM 0 H ARG B1659 -8.262 6.261 -4.667 1.00 10.00 H new ATOM 0 HA ARG B1659 -9.157 8.674 -3.521 1.00 10.00 H new ATOM 0 HB2 ARG B1659 -8.432 8.304 -5.891 1.00 10.00 H new ATOM 0 HB3 ARG B1659 -9.873 7.346 -6.167 1.00 10.00 H new ATOM 0 HG2 ARG B1659 -11.244 9.175 -6.288 1.00 10.00 H new ATOM 0 HG3 ARG B1659 -10.355 10.068 -5.070 1.00 10.00 H new ATOM 0 HD2 ARG B1659 -10.165 11.037 -7.379 1.00 10.00 H new ATOM 0 HD3 ARG B1659 -8.622 10.665 -6.636 1.00 10.00 H new ATOM 0 HE ARG B1659 -9.821 8.630 -8.456 1.00 10.00 H new ATOM 0 HH11 ARG B1659 -7.377 11.103 -7.822 1.00 10.00 H new ATOM 0 HH12 ARG B1659 -6.350 10.597 -9.167 1.00 10.00 H new ATOM 0 HH21 ARG B1659 -8.480 7.996 -10.193 1.00 10.00 H new ATOM 0 HH22 ARG B1659 -6.967 8.857 -10.495 1.00 10.00 H new ATOM 1318 N LYS B1660 -11.552 6.463 -4.172 1.00 10.00 N ATOM 1319 CA LYS B1660 -12.937 6.116 -3.835 1.00 10.00 C ATOM 1320 C LYS B1660 -13.078 5.798 -2.344 1.00 10.00 C ATOM 1321 O LYS B1660 -14.151 5.975 -1.765 1.00 10.00 O ATOM 1322 CB LYS B1660 -13.458 4.940 -4.693 1.00 10.00 C ATOM 1323 CG LYS B1660 -13.046 3.560 -4.204 1.00 10.00 C ATOM 1324 CD LYS B1660 -14.229 2.780 -3.647 1.00 10.00 C ATOM 1325 CE LYS B1660 -15.197 2.356 -4.748 1.00 10.00 C ATOM 1326 NZ LYS B1660 -16.577 2.184 -4.238 1.00 10.00 N ATOM 0 H LYS B1660 -11.094 5.810 -4.808 1.00 10.00 H new ATOM 0 HA LYS B1660 -13.551 6.988 -4.060 1.00 10.00 H new ATOM 0 HB2 LYS B1660 -14.546 4.988 -4.727 1.00 10.00 H new ATOM 0 HB3 LYS B1660 -13.102 5.069 -5.715 1.00 10.00 H new ATOM 0 HG2 LYS B1660 -12.598 3.002 -5.026 1.00 10.00 H new ATOM 0 HG3 LYS B1660 -12.282 3.661 -3.433 1.00 10.00 H new ATOM 0 HD2 LYS B1660 -13.867 1.896 -3.121 1.00 10.00 H new ATOM 0 HD3 LYS B1660 -14.756 3.392 -2.915 1.00 10.00 H new ATOM 0 HE2 LYS B1660 -15.194 3.104 -5.541 1.00 10.00 H new ATOM 0 HE3 LYS B1660 -14.855 1.421 -5.191 1.00 10.00 H new ATOM 0 HZ1 LYS B1660 -17.202 1.896 -5.018 1.00 10.00 H new ATOM 0 HZ2 LYS B1660 -16.585 1.452 -3.499 1.00 10.00 H new ATOM 0 HZ3 LYS B1660 -16.914 3.083 -3.838 1.00 10.00 H new ATOM 1340 N PHE B1661 -11.997 5.324 -1.727 1.00 10.00 N ATOM 1341 CA PHE B1661 -12.022 4.999 -0.304 1.00 10.00 C ATOM 1342 C PHE B1661 -12.262 6.262 0.517 1.00 10.00 C ATOM 1343 O PHE B1661 -13.035 6.263 1.479 1.00 10.00 O ATOM 1344 CB PHE B1661 -10.715 4.324 0.136 1.00 10.00 C ATOM 1345 CG PHE B1661 -10.850 3.597 1.441 1.00 10.00 C ATOM 1346 CD1 PHE B1661 -11.393 2.322 1.482 1.00 10.00 C ATOM 1347 CD2 PHE B1661 -10.433 4.183 2.625 1.00 10.00 C ATOM 1348 CE1 PHE B1661 -11.531 1.648 2.684 1.00 10.00 C ATOM 1349 CE2 PHE B1661 -10.569 3.519 3.828 1.00 10.00 C ATOM 1350 CZ PHE B1661 -11.113 2.248 3.860 1.00 10.00 C ATOM 0 H PHE B1661 -11.101 5.158 -2.186 1.00 10.00 H new ATOM 0 HA PHE B1661 -12.838 4.298 -0.132 1.00 10.00 H new ATOM 0 HB2 PHE B1661 -10.396 3.622 -0.635 1.00 10.00 H new ATOM 0 HB3 PHE B1661 -9.933 5.078 0.224 1.00 10.00 H new ATOM 0 HD1 PHE B1661 -11.712 1.849 0.565 1.00 10.00 H new ATOM 0 HD2 PHE B1661 -9.996 5.171 2.607 1.00 10.00 H new ATOM 0 HE1 PHE B1661 -11.963 0.658 2.704 1.00 10.00 H new ATOM 0 HE2 PHE B1661 -10.250 3.993 4.745 1.00 10.00 H new ATOM 0 HZ PHE B1661 -11.212 1.725 4.800 1.00 10.00 H new ATOM 1360 N LYS B1662 -11.601 7.338 0.120 1.00 10.00 N ATOM 1361 CA LYS B1662 -11.750 8.619 0.796 1.00 10.00 C ATOM 1362 C LYS B1662 -13.190 9.098 0.672 1.00 10.00 C ATOM 1363 O LYS B1662 -13.784 9.573 1.638 1.00 10.00 O ATOM 1364 CB LYS B1662 -10.765 9.642 0.207 1.00 10.00 C ATOM 1365 CG LYS B1662 -9.313 9.251 0.431 1.00 10.00 C ATOM 1366 CD LYS B1662 -8.387 9.945 -0.545 1.00 10.00 C ATOM 1367 CE LYS B1662 -7.002 9.313 -0.551 1.00 10.00 C ATOM 1368 NZ LYS B1662 -6.407 9.253 0.816 1.00 10.00 N ATOM 0 H LYS B1662 -10.954 7.350 -0.669 1.00 10.00 H new ATOM 0 HA LYS B1662 -11.519 8.505 1.855 1.00 10.00 H new ATOM 0 HB2 LYS B1662 -10.949 9.744 -0.862 1.00 10.00 H new ATOM 0 HB3 LYS B1662 -10.948 10.618 0.657 1.00 10.00 H new ATOM 0 HG2 LYS B1662 -9.022 9.503 1.451 1.00 10.00 H new ATOM 0 HG3 LYS B1662 -9.207 8.171 0.327 1.00 10.00 H new ATOM 0 HD2 LYS B1662 -8.813 9.898 -1.547 1.00 10.00 H new ATOM 0 HD3 LYS B1662 -8.305 11.000 -0.282 1.00 10.00 H new ATOM 0 HE2 LYS B1662 -7.065 8.306 -0.963 1.00 10.00 H new ATOM 0 HE3 LYS B1662 -6.346 9.885 -1.207 1.00 10.00 H new ATOM 0 HZ1 LYS B1662 -5.407 8.976 0.747 1.00 10.00 H new ATOM 0 HZ2 LYS B1662 -6.477 10.188 1.266 1.00 10.00 H new ATOM 0 HZ3 LYS B1662 -6.922 8.554 1.388 1.00 10.00 H new ATOM 1382 N LYS B1663 -13.749 8.925 -0.520 1.00 10.00 N ATOM 1383 CA LYS B1663 -15.123 9.322 -0.797 1.00 10.00 C ATOM 1384 C LYS B1663 -16.094 8.487 0.026 1.00 10.00 C ATOM 1385 O LYS B1663 -17.101 8.994 0.520 1.00 10.00 O ATOM 1386 CB LYS B1663 -15.442 9.148 -2.285 1.00 10.00 C ATOM 1387 CG LYS B1663 -14.341 9.635 -3.209 1.00 10.00 C ATOM 1388 CD LYS B1663 -14.736 9.490 -4.679 1.00 10.00 C ATOM 1389 CE LYS B1663 -15.790 10.512 -5.071 1.00 10.00 C ATOM 1390 NZ LYS B1663 -15.329 11.899 -4.835 1.00 10.00 N ATOM 0 H LYS B1663 -13.266 8.509 -1.316 1.00 10.00 H new ATOM 0 HA LYS B1663 -15.232 10.372 -0.527 1.00 10.00 H new ATOM 0 HB2 LYS B1663 -15.632 8.093 -2.485 1.00 10.00 H new ATOM 0 HB3 LYS B1663 -16.361 9.686 -2.515 1.00 10.00 H new ATOM 0 HG2 LYS B1663 -14.119 10.680 -2.993 1.00 10.00 H new ATOM 0 HG3 LYS B1663 -13.429 9.069 -3.019 1.00 10.00 H new ATOM 0 HD2 LYS B1663 -13.855 9.614 -5.308 1.00 10.00 H new ATOM 0 HD3 LYS B1663 -15.117 8.485 -4.858 1.00 10.00 H new ATOM 0 HE2 LYS B1663 -16.042 10.388 -6.124 1.00 10.00 H new ATOM 0 HE3 LYS B1663 -16.701 10.330 -4.501 1.00 10.00 H new ATOM 0 HZ1 LYS B1663 -15.876 12.553 -5.431 1.00 10.00 H new ATOM 0 HZ2 LYS B1663 -15.467 12.145 -3.834 1.00 10.00 H new ATOM 0 HZ3 LYS B1663 -14.320 11.975 -5.074 1.00 10.00 H new ATOM 1404 N ARG B1664 -15.778 7.202 0.162 1.00 10.00 N ATOM 1405 CA ARG B1664 -16.597 6.277 0.932 1.00 10.00 C ATOM 1406 C ARG B1664 -16.707 6.766 2.367 1.00 10.00 C ATOM 1407 O ARG B1664 -17.784 6.746 2.958 1.00 10.00 O ATOM 1408 CB ARG B1664 -15.990 4.868 0.910 1.00 10.00 C ATOM 1409 CG ARG B1664 -16.956 3.754 1.310 1.00 10.00 C ATOM 1410 CD ARG B1664 -17.118 3.627 2.824 1.00 10.00 C ATOM 1411 NE ARG B1664 -15.860 3.285 3.490 1.00 10.00 N ATOM 1412 CZ ARG B1664 -15.622 3.503 4.787 1.00 10.00 C ATOM 1413 NH1 ARG B1664 -16.557 4.054 5.548 1.00 10.00 N ATOM 1414 NH2 ARG B1664 -14.448 3.173 5.321 1.00 10.00 N ATOM 0 H ARG B1664 -14.951 6.777 -0.257 1.00 10.00 H new ATOM 0 HA ARG B1664 -17.589 6.234 0.483 1.00 10.00 H new ATOM 0 HB2 ARG B1664 -15.615 4.664 -0.093 1.00 10.00 H new ATOM 0 HB3 ARG B1664 -15.132 4.846 1.582 1.00 10.00 H new ATOM 0 HG2 ARG B1664 -17.930 3.945 0.860 1.00 10.00 H new ATOM 0 HG3 ARG B1664 -16.598 2.807 0.907 1.00 10.00 H new ATOM 0 HD2 ARG B1664 -17.496 4.567 3.227 1.00 10.00 H new ATOM 0 HD3 ARG B1664 -17.863 2.863 3.045 1.00 10.00 H new ATOM 0 HE ARG B1664 -15.122 2.855 2.932 1.00 10.00 H new ATOM 0 HH11 ARG B1664 -17.457 4.311 5.144 1.00 10.00 H new ATOM 0 HH12 ARG B1664 -16.376 4.221 6.538 1.00 10.00 H new ATOM 0 HH21 ARG B1664 -13.724 2.751 4.740 1.00 10.00 H new ATOM 0 HH22 ARG B1664 -14.273 3.342 6.312 1.00 10.00 H new ATOM 1428 N LYS B1665 -15.577 7.211 2.914 1.00 10.00 N ATOM 1429 CA LYS B1665 -15.522 7.714 4.286 1.00 10.00 C ATOM 1430 C LYS B1665 -16.364 8.984 4.420 1.00 10.00 C ATOM 1431 O LYS B1665 -16.899 9.280 5.485 1.00 10.00 O ATOM 1432 CB LYS B1665 -14.070 7.991 4.686 1.00 10.00 C ATOM 1433 CG LYS B1665 -13.872 8.213 6.178 1.00 10.00 C ATOM 1434 CD LYS B1665 -14.099 6.929 6.974 1.00 10.00 C ATOM 1435 CE LYS B1665 -13.519 7.041 8.369 1.00 10.00 C ATOM 1436 NZ LYS B1665 -13.656 5.778 9.141 1.00 10.00 N ATOM 0 H LYS B1665 -14.682 7.233 2.425 1.00 10.00 H new ATOM 0 HA LYS B1665 -15.931 6.957 4.955 1.00 10.00 H new ATOM 0 HB2 LYS B1665 -13.450 7.153 4.368 1.00 10.00 H new ATOM 0 HB3 LYS B1665 -13.717 8.871 4.148 1.00 10.00 H new ATOM 0 HG2 LYS B1665 -12.862 8.581 6.361 1.00 10.00 H new ATOM 0 HG3 LYS B1665 -14.560 8.984 6.526 1.00 10.00 H new ATOM 0 HD2 LYS B1665 -15.167 6.721 7.037 1.00 10.00 H new ATOM 0 HD3 LYS B1665 -13.640 6.089 6.453 1.00 10.00 H new ATOM 0 HE2 LYS B1665 -12.465 7.310 8.301 1.00 10.00 H new ATOM 0 HE3 LYS B1665 -14.020 7.847 8.904 1.00 10.00 H new ATOM 0 HZ1 LYS B1665 -12.843 5.672 9.781 1.00 10.00 H new ATOM 0 HZ2 LYS B1665 -14.534 5.805 9.698 1.00 10.00 H new ATOM 0 HZ3 LYS B1665 -13.688 4.972 8.485 1.00 10.00 H new ATOM 1450 N GLU B1666 -16.484 9.725 3.324 1.00 10.00 N ATOM 1451 CA GLU B1666 -17.275 10.951 3.304 1.00 10.00 C ATOM 1452 C GLU B1666 -18.763 10.612 3.367 1.00 10.00 C ATOM 1453 O GLU B1666 -19.584 11.403 3.832 1.00 10.00 O ATOM 1454 CB GLU B1666 -16.969 11.767 2.042 1.00 10.00 C ATOM 1455 CG GLU B1666 -15.521 12.209 1.944 1.00 10.00 C ATOM 1456 CD GLU B1666 -15.271 13.134 0.778 1.00 10.00 C ATOM 1457 OE1 GLU B1666 -15.504 14.355 0.923 1.00 10.00 O ATOM 1458 OE2 GLU B1666 -14.843 12.654 -0.291 1.00 10.00 O ATOM 0 H GLU B1666 -16.042 9.497 2.434 1.00 10.00 H new ATOM 0 HA GLU B1666 -17.011 11.552 4.174 1.00 10.00 H new ATOM 0 HB2 GLU B1666 -17.219 11.171 1.164 1.00 10.00 H new ATOM 0 HB3 GLU B1666 -17.611 12.647 2.023 1.00 10.00 H new ATOM 0 HG2 GLU B1666 -15.236 12.711 2.868 1.00 10.00 H new ATOM 0 HG3 GLU B1666 -14.883 11.330 1.849 1.00 10.00 H new ATOM 1465 N GLN B1667 -19.097 9.422 2.896 1.00 10.00 N ATOM 1466 CA GLN B1667 -20.473 8.958 2.905 1.00 10.00 C ATOM 1467 C GLN B1667 -20.791 8.285 4.236 1.00 10.00 C ATOM 1468 O GLN B1667 -21.678 8.725 4.968 1.00 10.00 O ATOM 1469 CB GLN B1667 -20.717 7.981 1.754 1.00 10.00 C ATOM 1470 CG GLN B1667 -20.438 8.572 0.386 1.00 10.00 C ATOM 1471 CD GLN B1667 -21.290 9.797 0.094 1.00 10.00 C ATOM 1472 OE1 GLN B1667 -20.907 10.926 0.405 1.00 10.00 O ATOM 1473 NE2 GLN B1667 -22.455 9.589 -0.504 1.00 10.00 N ATOM 0 H GLN B1667 -18.431 8.758 2.501 1.00 10.00 H new ATOM 0 HA GLN B1667 -21.129 9.819 2.776 1.00 10.00 H new ATOM 0 HB2 GLN B1667 -20.089 7.102 1.896 1.00 10.00 H new ATOM 0 HB3 GLN B1667 -21.752 7.642 1.790 1.00 10.00 H new ATOM 0 HG2 GLN B1667 -19.384 8.842 0.319 1.00 10.00 H new ATOM 0 HG3 GLN B1667 -20.622 7.816 -0.377 1.00 10.00 H new ATOM 0 HE21 GLN B1667 -22.741 8.641 -0.748 1.00 10.00 H new ATOM 0 HE22 GLN B1667 -23.065 10.377 -0.720 1.00 10.00 H new ATOM 1482 N GLY B1668 -20.056 7.224 4.549 1.00 10.00 N ATOM 1483 CA GLY B1668 -20.267 6.511 5.787 1.00 10.00 C ATOM 1484 C GLY B1668 -20.011 5.035 5.622 1.00 10.00 C ATOM 1485 O GLY B1668 -20.655 4.230 6.323 1.00 10.00 O ATOM 1486 OXT GLY B1668 -19.172 4.672 4.770 1.00 10.00 O ATOM 0 H GLY B1668 -19.314 6.846 3.960 1.00 10.00 H new ATOM 0 HA2 GLY B1668 -19.608 6.912 6.557 1.00 10.00 H new ATOM 0 HA3 GLY B1668 -21.290 6.668 6.130 1.00 10.00 H new TER 1490 GLY B1668