USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 547 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 Single : A 741 SER OG : rot 180:sc= 0 USER MOD Single : A 744 SER OG : rot 180:sc= -0.937 USER MOD Single : A 750 TYR OH : rot 165:sc= -0.256 USER MOD Single : A 758 THR OG1 : rot -88:sc= -0.369 USER MOD Single : A 760 SER OG : rot -10:sc= -3.06! USER MOD Single : A 764 SER OG : rot 180:sc= -0.116 USER MOD Single : A 766 SER OG : rot 180:sc= 0 USER MOD Single : A 769 GLN : amide:sc= -1.23 K(o=-1.2,f=-0.015) USER MOD Single : A 771 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 773 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 776 TYR OH : rot 180:sc= 0 USER MOD Single : A 777 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 782 MET CE :methyl 134:sc= -5.38! (180deg=-9.37!) USER MOD Single : A 786 MET CE :methyl 170:sc= -4.99! (180deg=-5.11!) USER MOD Single : A 788 MET CE :methyl -166:sc=-0.00682 (180deg=-0.274) USER MOD Single : A 793 THR OG1 : rot 140:sc= -0.799 USER MOD Single : A 795 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 796 ASN : amide:sc= -0.735 K(o=-0.73,f=-1.7!) USER MOD Single : A 797 THR OG1 : rot 180:sc= 0 USER MOD Single : A 798 ASN : amide:sc= -0.192 K(o=-0.19,f=-1.9!) USER MOD Single : A 800 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 740 14.630 -1.959 14.288 1.00 0.00 N ATOM 2 CA GLY A 740 13.982 -1.515 13.023 1.00 0.00 C ATOM 3 C GLY A 740 12.532 -1.950 12.932 1.00 0.00 C ATOM 4 O GLY A 740 11.960 -2.437 13.907 1.00 0.00 O ATOM 0 HA2 GLY A 740 14.038 -0.429 12.951 1.00 0.00 H new ATOM 0 HA3 GLY A 740 14.534 -1.919 12.174 1.00 0.00 H new ATOM 10 N SER A 741 11.937 -1.773 11.756 1.00 0.00 N ATOM 11 CA SER A 741 10.545 -2.150 11.540 1.00 0.00 C ATOM 12 C SER A 741 10.284 -2.443 10.065 1.00 0.00 C ATOM 13 O SER A 741 9.688 -3.463 9.721 1.00 0.00 O ATOM 14 CB SER A 741 9.613 -1.038 12.027 1.00 0.00 C ATOM 15 OG SER A 741 8.790 -1.491 13.088 1.00 0.00 O ATOM 0 H SER A 741 12.397 -1.371 10.939 1.00 0.00 H new ATOM 0 HA SER A 741 10.345 -3.056 12.112 1.00 0.00 H new ATOM 0 HB2 SER A 741 10.203 -0.184 12.359 1.00 0.00 H new ATOM 0 HB3 SER A 741 8.990 -0.693 11.201 1.00 0.00 H new ATOM 0 HG SER A 741 8.205 -0.762 13.383 1.00 0.00 H new ATOM 21 N GLU A 742 10.739 -1.543 9.199 1.00 0.00 N ATOM 22 CA GLU A 742 10.558 -1.703 7.761 1.00 0.00 C ATOM 23 C GLU A 742 9.079 -1.695 7.390 1.00 0.00 C ATOM 24 O GLU A 742 8.439 -2.744 7.327 1.00 0.00 O ATOM 25 CB GLU A 742 11.205 -3.006 7.285 1.00 0.00 C ATOM 26 CG GLU A 742 11.752 -2.934 5.870 1.00 0.00 C ATOM 27 CD GLU A 742 12.427 -4.220 5.439 1.00 0.00 C ATOM 28 OE1 GLU A 742 11.860 -5.304 5.697 1.00 0.00 O ATOM 29 OE2 GLU A 742 13.522 -4.146 4.842 1.00 0.00 O ATOM 0 H GLU A 742 11.236 -0.694 9.469 1.00 0.00 H new ATOM 0 HA GLU A 742 11.042 -0.861 7.267 1.00 0.00 H new ATOM 0 HB2 GLU A 742 12.015 -3.269 7.965 1.00 0.00 H new ATOM 0 HB3 GLU A 742 10.469 -3.808 7.340 1.00 0.00 H new ATOM 0 HG2 GLU A 742 10.938 -2.707 5.181 1.00 0.00 H new ATOM 0 HG3 GLU A 742 12.466 -2.113 5.802 1.00 0.00 H new ATOM 36 N GLY A 743 8.543 -0.505 7.139 1.00 0.00 N ATOM 37 CA GLY A 743 7.144 -0.385 6.772 1.00 0.00 C ATOM 38 C GLY A 743 6.272 0.075 7.926 1.00 0.00 C ATOM 39 O GLY A 743 5.344 -0.626 8.327 1.00 0.00 O ATOM 0 H GLY A 743 9.052 0.378 7.183 1.00 0.00 H new ATOM 0 HA2 GLY A 743 7.049 0.320 5.947 1.00 0.00 H new ATOM 0 HA3 GLY A 743 6.783 -1.348 6.411 1.00 0.00 H new ATOM 43 N SER A 744 6.566 1.259 8.453 1.00 0.00 N ATOM 44 CA SER A 744 5.796 1.816 9.562 1.00 0.00 C ATOM 45 C SER A 744 5.122 3.113 9.137 1.00 0.00 C ATOM 46 O SER A 744 3.914 3.285 9.298 1.00 0.00 O ATOM 47 CB SER A 744 6.703 2.065 10.769 1.00 0.00 C ATOM 48 OG SER A 744 7.787 1.154 10.791 1.00 0.00 O ATOM 0 H SER A 744 7.331 1.852 8.131 1.00 0.00 H new ATOM 0 HA SER A 744 5.027 1.097 9.845 1.00 0.00 H new ATOM 0 HB2 SER A 744 7.083 3.086 10.737 1.00 0.00 H new ATOM 0 HB3 SER A 744 6.125 1.969 11.688 1.00 0.00 H new ATOM 0 HG SER A 744 8.352 1.336 11.571 1.00 0.00 H new ATOM 54 N GLU A 745 5.918 4.014 8.582 1.00 0.00 N ATOM 55 CA GLU A 745 5.422 5.297 8.107 1.00 0.00 C ATOM 56 C GLU A 745 6.362 5.861 7.055 1.00 0.00 C ATOM 57 O GLU A 745 5.935 6.259 5.971 1.00 0.00 O ATOM 58 CB GLU A 745 5.275 6.285 9.264 1.00 0.00 C ATOM 59 CG GLU A 745 4.306 7.415 8.962 1.00 0.00 C ATOM 60 CD GLU A 745 4.811 8.762 9.442 1.00 0.00 C ATOM 61 OE1 GLU A 745 5.270 8.846 10.600 1.00 0.00 O ATOM 62 OE2 GLU A 745 4.747 9.733 8.659 1.00 0.00 O ATOM 0 H GLU A 745 6.920 3.878 8.449 1.00 0.00 H new ATOM 0 HA GLU A 745 4.439 5.142 7.662 1.00 0.00 H new ATOM 0 HB2 GLU A 745 4.935 5.750 10.150 1.00 0.00 H new ATOM 0 HB3 GLU A 745 6.252 6.706 9.501 1.00 0.00 H new ATOM 0 HG2 GLU A 745 4.130 7.460 7.887 1.00 0.00 H new ATOM 0 HG3 GLU A 745 3.347 7.202 9.434 1.00 0.00 H new ATOM 69 N ASP A 746 7.649 5.870 7.373 1.00 0.00 N ATOM 70 CA ASP A 746 8.659 6.360 6.447 1.00 0.00 C ATOM 71 C ASP A 746 9.725 5.296 6.219 1.00 0.00 C ATOM 72 O ASP A 746 10.683 5.178 6.983 1.00 0.00 O ATOM 73 CB ASP A 746 9.302 7.639 6.986 1.00 0.00 C ATOM 74 CG ASP A 746 8.572 8.889 6.534 1.00 0.00 C ATOM 75 OD1 ASP A 746 8.130 8.929 5.367 1.00 0.00 O ATOM 76 OD2 ASP A 746 8.440 9.826 7.349 1.00 0.00 O ATOM 0 H ASP A 746 8.018 5.543 8.266 1.00 0.00 H new ATOM 0 HA ASP A 746 8.176 6.586 5.496 1.00 0.00 H new ATOM 0 HB2 ASP A 746 9.316 7.604 8.075 1.00 0.00 H new ATOM 0 HB3 ASP A 746 10.339 7.688 6.655 1.00 0.00 H new ATOM 81 N ASP A 747 9.547 4.528 5.152 1.00 0.00 N ATOM 82 CA ASP A 747 10.482 3.471 4.792 1.00 0.00 C ATOM 83 C ASP A 747 11.017 3.694 3.380 1.00 0.00 C ATOM 84 O ASP A 747 10.282 4.145 2.500 1.00 0.00 O ATOM 85 CB ASP A 747 9.793 2.106 4.884 1.00 0.00 C ATOM 86 CG ASP A 747 10.714 0.957 4.524 1.00 0.00 C ATOM 87 OD1 ASP A 747 10.830 0.645 3.320 1.00 0.00 O ATOM 88 OD2 ASP A 747 11.320 0.371 5.445 1.00 0.00 O ATOM 0 H ASP A 747 8.755 4.619 4.515 1.00 0.00 H new ATOM 0 HA ASP A 747 11.319 3.493 5.490 1.00 0.00 H new ATOM 0 HB2 ASP A 747 9.418 1.961 5.897 1.00 0.00 H new ATOM 0 HB3 ASP A 747 8.929 2.095 4.220 1.00 0.00 H new ATOM 93 N PRO A 748 12.304 3.379 3.142 1.00 0.00 N ATOM 94 CA PRO A 748 12.936 3.542 1.831 1.00 0.00 C ATOM 95 C PRO A 748 12.007 3.241 0.658 1.00 0.00 C ATOM 96 O PRO A 748 12.174 3.797 -0.428 1.00 0.00 O ATOM 97 CB PRO A 748 14.068 2.522 1.891 1.00 0.00 C ATOM 98 CG PRO A 748 14.491 2.524 3.320 1.00 0.00 C ATOM 99 CD PRO A 748 13.255 2.833 4.133 1.00 0.00 C ATOM 0 HA PRO A 748 13.250 4.571 1.656 1.00 0.00 H new ATOM 0 HB2 PRO A 748 13.730 1.534 1.578 1.00 0.00 H new ATOM 0 HB3 PRO A 748 14.890 2.801 1.232 1.00 0.00 H new ATOM 0 HG2 PRO A 748 14.909 1.558 3.602 1.00 0.00 H new ATOM 0 HG3 PRO A 748 15.266 3.270 3.494 1.00 0.00 H new ATOM 0 HD2 PRO A 748 12.860 1.939 4.615 1.00 0.00 H new ATOM 0 HD3 PRO A 748 13.466 3.554 4.923 1.00 0.00 H new ATOM 107 N LEU A 749 11.040 2.350 0.865 1.00 0.00 N ATOM 108 CA LEU A 749 10.118 1.987 -0.203 1.00 0.00 C ATOM 109 C LEU A 749 8.657 2.291 0.144 1.00 0.00 C ATOM 110 O LEU A 749 7.811 2.349 -0.750 1.00 0.00 O ATOM 111 CB LEU A 749 10.281 0.502 -0.527 1.00 0.00 C ATOM 112 CG LEU A 749 11.661 0.109 -1.059 1.00 0.00 C ATOM 113 CD1 LEU A 749 11.910 -1.380 -0.870 1.00 0.00 C ATOM 114 CD2 LEU A 749 11.794 0.495 -2.523 1.00 0.00 C ATOM 0 H LEU A 749 10.877 1.872 1.751 1.00 0.00 H new ATOM 0 HA LEU A 749 10.367 2.596 -1.072 1.00 0.00 H new ATOM 0 HB2 LEU A 749 10.076 -0.077 0.374 1.00 0.00 H new ATOM 0 HB3 LEU A 749 9.529 0.221 -1.264 1.00 0.00 H new ATOM 0 HG LEU A 749 12.415 0.652 -0.489 1.00 0.00 H new ATOM 0 HD11 LEU A 749 12.897 -1.636 -1.256 1.00 0.00 H new ATOM 0 HD12 LEU A 749 11.860 -1.625 0.191 1.00 0.00 H new ATOM 0 HD13 LEU A 749 11.152 -1.947 -1.410 1.00 0.00 H new ATOM 0 HD21 LEU A 749 12.781 0.209 -2.887 1.00 0.00 H new ATOM 0 HD22 LEU A 749 11.030 -0.019 -3.106 1.00 0.00 H new ATOM 0 HD23 LEU A 749 11.667 1.572 -2.628 1.00 0.00 H new ATOM 126 N TYR A 750 8.350 2.494 1.427 1.00 0.00 N ATOM 127 CA TYR A 750 6.972 2.785 1.825 1.00 0.00 C ATOM 128 C TYR A 750 6.415 3.956 1.036 1.00 0.00 C ATOM 129 O TYR A 750 5.319 3.878 0.499 1.00 0.00 O ATOM 130 CB TYR A 750 6.863 3.078 3.320 1.00 0.00 C ATOM 131 CG TYR A 750 5.462 3.444 3.773 1.00 0.00 C ATOM 132 CD1 TYR A 750 4.562 2.462 4.168 1.00 0.00 C ATOM 133 CD2 TYR A 750 5.042 4.771 3.816 1.00 0.00 C ATOM 134 CE1 TYR A 750 3.290 2.786 4.599 1.00 0.00 C ATOM 135 CE2 TYR A 750 3.771 5.103 4.243 1.00 0.00 C ATOM 136 CZ TYR A 750 2.900 4.108 4.636 1.00 0.00 C ATOM 137 OH TYR A 750 1.635 4.435 5.065 1.00 0.00 O ATOM 0 H TYR A 750 9.022 2.463 2.194 1.00 0.00 H new ATOM 0 HA TYR A 750 6.385 1.893 1.607 1.00 0.00 H new ATOM 0 HB2 TYR A 750 7.198 2.203 3.877 1.00 0.00 H new ATOM 0 HB3 TYR A 750 7.540 3.894 3.571 1.00 0.00 H new ATOM 0 HD1 TYR A 750 4.863 1.425 4.138 1.00 0.00 H new ATOM 0 HD2 TYR A 750 5.721 5.553 3.511 1.00 0.00 H new ATOM 0 HE1 TYR A 750 2.605 2.009 4.905 1.00 0.00 H new ATOM 0 HE2 TYR A 750 3.460 6.137 4.269 1.00 0.00 H new ATOM 0 HH TYR A 750 1.593 5.395 5.259 1.00 0.00 H new ATOM 147 N ASP A 751 7.175 5.040 0.959 1.00 0.00 N ATOM 148 CA ASP A 751 6.731 6.211 0.215 1.00 0.00 C ATOM 149 C ASP A 751 6.341 5.804 -1.202 1.00 0.00 C ATOM 150 O ASP A 751 5.368 6.313 -1.761 1.00 0.00 O ATOM 151 CB ASP A 751 7.833 7.271 0.176 1.00 0.00 C ATOM 152 CG ASP A 751 9.125 6.744 -0.420 1.00 0.00 C ATOM 153 OD1 ASP A 751 9.896 6.095 0.316 1.00 0.00 O ATOM 154 OD2 ASP A 751 9.363 6.981 -1.623 1.00 0.00 O ATOM 0 H ASP A 751 8.091 5.133 1.397 1.00 0.00 H new ATOM 0 HA ASP A 751 5.862 6.638 0.716 1.00 0.00 H new ATOM 0 HB2 ASP A 751 7.490 8.126 -0.407 1.00 0.00 H new ATOM 0 HB3 ASP A 751 8.023 7.630 1.187 1.00 0.00 H new ATOM 159 N GLU A 752 7.092 4.862 -1.767 1.00 0.00 N ATOM 160 CA GLU A 752 6.807 4.366 -3.104 1.00 0.00 C ATOM 161 C GLU A 752 5.538 3.524 -3.090 1.00 0.00 C ATOM 162 O GLU A 752 4.698 3.632 -3.981 1.00 0.00 O ATOM 163 CB GLU A 752 7.982 3.547 -3.633 1.00 0.00 C ATOM 164 CG GLU A 752 8.217 3.713 -5.125 1.00 0.00 C ATOM 165 CD GLU A 752 9.672 3.976 -5.461 1.00 0.00 C ATOM 166 OE1 GLU A 752 10.549 3.327 -4.852 1.00 0.00 O ATOM 167 OE2 GLU A 752 9.936 4.832 -6.332 1.00 0.00 O ATOM 0 H GLU A 752 7.900 4.430 -1.318 1.00 0.00 H new ATOM 0 HA GLU A 752 6.656 5.218 -3.767 1.00 0.00 H new ATOM 0 HB2 GLU A 752 8.886 3.836 -3.097 1.00 0.00 H new ATOM 0 HB3 GLU A 752 7.806 2.493 -3.416 1.00 0.00 H new ATOM 0 HG2 GLU A 752 7.885 2.813 -5.643 1.00 0.00 H new ATOM 0 HG3 GLU A 752 7.608 4.537 -5.495 1.00 0.00 H new ATOM 174 N ALA A 753 5.408 2.690 -2.061 1.00 0.00 N ATOM 175 CA ALA A 753 4.238 1.833 -1.909 1.00 0.00 C ATOM 176 C ALA A 753 2.981 2.678 -1.786 1.00 0.00 C ATOM 177 O ALA A 753 2.023 2.504 -2.535 1.00 0.00 O ATOM 178 CB ALA A 753 4.392 0.935 -0.692 1.00 0.00 C ATOM 0 H ALA A 753 6.101 2.590 -1.319 1.00 0.00 H new ATOM 0 HA ALA A 753 4.151 1.203 -2.794 1.00 0.00 H new ATOM 0 HB1 ALA A 753 3.510 0.302 -0.593 1.00 0.00 H new ATOM 0 HB2 ALA A 753 5.276 0.309 -0.811 1.00 0.00 H new ATOM 0 HB3 ALA A 753 4.500 1.549 0.202 1.00 0.00 H new ATOM 184 N VAL A 754 3.006 3.607 -0.839 1.00 0.00 N ATOM 185 CA VAL A 754 1.888 4.506 -0.608 1.00 0.00 C ATOM 186 C VAL A 754 1.548 5.258 -1.890 1.00 0.00 C ATOM 187 O VAL A 754 0.378 5.444 -2.223 1.00 0.00 O ATOM 188 CB VAL A 754 2.228 5.493 0.530 1.00 0.00 C ATOM 189 CG1 VAL A 754 1.351 6.731 0.493 1.00 0.00 C ATOM 190 CG2 VAL A 754 2.103 4.792 1.867 1.00 0.00 C ATOM 0 H VAL A 754 3.798 3.756 -0.214 1.00 0.00 H new ATOM 0 HA VAL A 754 1.017 3.922 -0.309 1.00 0.00 H new ATOM 0 HB VAL A 754 3.256 5.827 0.388 1.00 0.00 H new ATOM 0 HG11 VAL A 754 1.626 7.396 1.312 1.00 0.00 H new ATOM 0 HG12 VAL A 754 1.490 7.247 -0.457 1.00 0.00 H new ATOM 0 HG13 VAL A 754 0.306 6.440 0.598 1.00 0.00 H new ATOM 0 HG21 VAL A 754 2.344 5.491 2.668 1.00 0.00 H new ATOM 0 HG22 VAL A 754 1.082 4.431 1.995 1.00 0.00 H new ATOM 0 HG23 VAL A 754 2.793 3.949 1.902 1.00 0.00 H new ATOM 200 N ARG A 755 2.583 5.664 -2.617 1.00 0.00 N ATOM 201 CA ARG A 755 2.399 6.367 -3.878 1.00 0.00 C ATOM 202 C ARG A 755 1.793 5.424 -4.910 1.00 0.00 C ATOM 203 O ARG A 755 0.961 5.818 -5.729 1.00 0.00 O ATOM 204 CB ARG A 755 3.744 6.890 -4.388 1.00 0.00 C ATOM 205 CG ARG A 755 4.120 8.255 -3.837 1.00 0.00 C ATOM 206 CD ARG A 755 5.045 9.002 -4.784 1.00 0.00 C ATOM 207 NE ARG A 755 5.392 10.329 -4.281 1.00 0.00 N ATOM 208 CZ ARG A 755 6.329 11.106 -4.821 1.00 0.00 C ATOM 209 NH1 ARG A 755 7.014 10.692 -5.880 1.00 0.00 N ATOM 210 NH2 ARG A 755 6.580 12.300 -4.302 1.00 0.00 N ATOM 0 H ARG A 755 3.557 5.518 -2.353 1.00 0.00 H new ATOM 0 HA ARG A 755 1.726 7.209 -3.718 1.00 0.00 H new ATOM 0 HB2 ARG A 755 4.524 6.175 -4.126 1.00 0.00 H new ATOM 0 HB3 ARG A 755 3.713 6.944 -5.476 1.00 0.00 H new ATOM 0 HG2 ARG A 755 3.217 8.842 -3.670 1.00 0.00 H new ATOM 0 HG3 ARG A 755 4.607 8.136 -2.869 1.00 0.00 H new ATOM 0 HD2 ARG A 755 5.956 8.422 -4.933 1.00 0.00 H new ATOM 0 HD3 ARG A 755 4.565 9.098 -5.758 1.00 0.00 H new ATOM 0 HE ARG A 755 4.887 10.681 -3.468 1.00 0.00 H new ATOM 0 HH11 ARG A 755 6.824 9.775 -6.284 1.00 0.00 H new ATOM 0 HH12 ARG A 755 7.731 11.291 -6.290 1.00 0.00 H new ATOM 0 HH21 ARG A 755 6.055 12.623 -3.489 1.00 0.00 H new ATOM 0 HH22 ARG A 755 7.298 12.895 -4.716 1.00 0.00 H new ATOM 224 N PHE A 756 2.231 4.172 -4.853 1.00 0.00 N ATOM 225 CA PHE A 756 1.764 3.140 -5.767 1.00 0.00 C ATOM 226 C PHE A 756 0.291 2.805 -5.521 1.00 0.00 C ATOM 227 O PHE A 756 -0.495 2.706 -6.463 1.00 0.00 O ATOM 228 CB PHE A 756 2.633 1.887 -5.602 1.00 0.00 C ATOM 229 CG PHE A 756 1.946 0.613 -5.994 1.00 0.00 C ATOM 230 CD1 PHE A 756 1.935 0.191 -7.310 1.00 0.00 C ATOM 231 CD2 PHE A 756 1.308 -0.157 -5.039 1.00 0.00 C ATOM 232 CE1 PHE A 756 1.299 -0.980 -7.670 1.00 0.00 C ATOM 233 CE2 PHE A 756 0.670 -1.327 -5.391 1.00 0.00 C ATOM 234 CZ PHE A 756 0.665 -1.740 -6.708 1.00 0.00 C ATOM 0 H PHE A 756 2.918 3.845 -4.173 1.00 0.00 H new ATOM 0 HA PHE A 756 1.849 3.512 -6.788 1.00 0.00 H new ATOM 0 HB2 PHE A 756 3.535 2.001 -6.203 1.00 0.00 H new ATOM 0 HB3 PHE A 756 2.950 1.812 -4.562 1.00 0.00 H new ATOM 0 HD1 PHE A 756 2.430 0.784 -8.065 1.00 0.00 H new ATOM 0 HD2 PHE A 756 1.310 0.161 -4.007 1.00 0.00 H new ATOM 0 HE1 PHE A 756 1.297 -1.301 -8.701 1.00 0.00 H new ATOM 0 HE2 PHE A 756 0.174 -1.920 -4.637 1.00 0.00 H new ATOM 0 HZ PHE A 756 0.166 -2.657 -6.985 1.00 0.00 H new ATOM 244 N VAL A 757 -0.074 2.630 -4.256 1.00 0.00 N ATOM 245 CA VAL A 757 -1.446 2.305 -3.901 1.00 0.00 C ATOM 246 C VAL A 757 -2.361 3.494 -4.155 1.00 0.00 C ATOM 247 O VAL A 757 -3.452 3.347 -4.704 1.00 0.00 O ATOM 248 CB VAL A 757 -1.550 1.879 -2.424 1.00 0.00 C ATOM 249 CG1 VAL A 757 -2.978 1.491 -2.073 1.00 0.00 C ATOM 250 CG2 VAL A 757 -0.593 0.730 -2.138 1.00 0.00 C ATOM 0 H VAL A 757 0.561 2.708 -3.462 1.00 0.00 H new ATOM 0 HA VAL A 757 -1.761 1.471 -4.528 1.00 0.00 H new ATOM 0 HB VAL A 757 -1.269 2.727 -1.800 1.00 0.00 H new ATOM 0 HG11 VAL A 757 -3.027 1.194 -1.025 1.00 0.00 H new ATOM 0 HG12 VAL A 757 -3.638 2.342 -2.240 1.00 0.00 H new ATOM 0 HG13 VAL A 757 -3.294 0.658 -2.702 1.00 0.00 H new ATOM 0 HG21 VAL A 757 -0.677 0.439 -1.091 1.00 0.00 H new ATOM 0 HG22 VAL A 757 -0.845 -0.120 -2.772 1.00 0.00 H new ATOM 0 HG23 VAL A 757 0.429 1.047 -2.346 1.00 0.00 H new ATOM 260 N THR A 758 -1.901 4.675 -3.758 1.00 0.00 N ATOM 261 CA THR A 758 -2.669 5.898 -3.945 1.00 0.00 C ATOM 262 C THR A 758 -3.021 6.105 -5.416 1.00 0.00 C ATOM 263 O THR A 758 -4.159 6.438 -5.751 1.00 0.00 O ATOM 264 CB THR A 758 -1.875 7.098 -3.427 1.00 0.00 C ATOM 265 OG1 THR A 758 -0.531 7.036 -3.867 1.00 0.00 O ATOM 266 CG2 THR A 758 -1.862 7.201 -1.918 1.00 0.00 C ATOM 0 H THR A 758 -0.998 4.810 -3.304 1.00 0.00 H new ATOM 0 HA THR A 758 -3.597 5.807 -3.380 1.00 0.00 H new ATOM 0 HB THR A 758 -2.382 7.976 -3.829 1.00 0.00 H new ATOM 0 HG1 THR A 758 -0.002 6.513 -3.229 1.00 0.00 H new ATOM 0 HG21 THR A 758 -1.282 8.074 -1.618 1.00 0.00 H new ATOM 0 HG22 THR A 758 -2.884 7.301 -1.551 1.00 0.00 H new ATOM 0 HG23 THR A 758 -1.411 6.303 -1.496 1.00 0.00 H new ATOM 274 N GLU A 759 -2.038 5.915 -6.291 1.00 0.00 N ATOM 275 CA GLU A 759 -2.243 6.090 -7.726 1.00 0.00 C ATOM 276 C GLU A 759 -2.945 4.883 -8.346 1.00 0.00 C ATOM 277 O GLU A 759 -3.730 5.026 -9.283 1.00 0.00 O ATOM 278 CB GLU A 759 -0.904 6.326 -8.426 1.00 0.00 C ATOM 279 CG GLU A 759 -0.976 7.348 -9.548 1.00 0.00 C ATOM 280 CD GLU A 759 0.359 7.551 -10.238 1.00 0.00 C ATOM 281 OE1 GLU A 759 1.396 7.527 -9.542 1.00 0.00 O ATOM 282 OE2 GLU A 759 0.368 7.733 -11.474 1.00 0.00 O ATOM 0 H GLU A 759 -1.091 5.640 -6.032 1.00 0.00 H new ATOM 0 HA GLU A 759 -2.884 6.961 -7.863 1.00 0.00 H new ATOM 0 HB2 GLU A 759 -0.172 6.658 -7.690 1.00 0.00 H new ATOM 0 HB3 GLU A 759 -0.543 5.380 -8.830 1.00 0.00 H new ATOM 0 HG2 GLU A 759 -1.715 7.025 -10.282 1.00 0.00 H new ATOM 0 HG3 GLU A 759 -1.321 8.300 -9.146 1.00 0.00 H new ATOM 289 N SER A 760 -2.652 3.694 -7.827 1.00 0.00 N ATOM 290 CA SER A 760 -3.252 2.468 -8.344 1.00 0.00 C ATOM 291 C SER A 760 -4.706 2.323 -7.896 1.00 0.00 C ATOM 292 O SER A 760 -5.467 1.550 -8.479 1.00 0.00 O ATOM 293 CB SER A 760 -2.442 1.252 -7.894 1.00 0.00 C ATOM 294 OG SER A 760 -2.531 1.068 -6.493 1.00 0.00 O ATOM 0 H SER A 760 -2.005 3.554 -7.051 1.00 0.00 H new ATOM 0 HA SER A 760 -3.240 2.526 -9.432 1.00 0.00 H new ATOM 0 HB2 SER A 760 -2.806 0.360 -8.404 1.00 0.00 H new ATOM 0 HB3 SER A 760 -1.398 1.380 -8.181 1.00 0.00 H new ATOM 0 HG SER A 760 -2.960 1.850 -6.087 1.00 0.00 H new ATOM 300 N ARG A 761 -5.086 3.069 -6.863 1.00 0.00 N ATOM 301 CA ARG A 761 -6.450 3.024 -6.343 1.00 0.00 C ATOM 302 C ARG A 761 -6.786 1.645 -5.784 1.00 0.00 C ATOM 303 O ARG A 761 -7.930 1.196 -5.861 1.00 0.00 O ATOM 304 CB ARG A 761 -7.451 3.406 -7.437 1.00 0.00 C ATOM 305 CG ARG A 761 -7.377 4.869 -7.844 1.00 0.00 C ATOM 306 CD ARG A 761 -7.973 5.774 -6.777 1.00 0.00 C ATOM 307 NE ARG A 761 -9.338 6.183 -7.104 1.00 0.00 N ATOM 308 CZ ARG A 761 -9.680 7.411 -7.494 1.00 0.00 C ATOM 309 NH1 ARG A 761 -8.761 8.363 -7.624 1.00 0.00 N ATOM 310 NH2 ARG A 761 -10.949 7.689 -7.759 1.00 0.00 N ATOM 0 H ARG A 761 -4.468 3.713 -6.369 1.00 0.00 H new ATOM 0 HA ARG A 761 -6.519 3.745 -5.529 1.00 0.00 H new ATOM 0 HB2 ARG A 761 -7.273 2.784 -8.314 1.00 0.00 H new ATOM 0 HB3 ARG A 761 -8.460 3.185 -7.088 1.00 0.00 H new ATOM 0 HG2 ARG A 761 -6.338 5.147 -8.020 1.00 0.00 H new ATOM 0 HG3 ARG A 761 -7.909 5.014 -8.784 1.00 0.00 H new ATOM 0 HD2 ARG A 761 -7.970 5.255 -5.819 1.00 0.00 H new ATOM 0 HD3 ARG A 761 -7.347 6.659 -6.662 1.00 0.00 H new ATOM 0 HE ARG A 761 -10.076 5.483 -7.029 1.00 0.00 H new ATOM 0 HH11 ARG A 761 -7.782 8.157 -7.425 1.00 0.00 H new ATOM 0 HH12 ARG A 761 -9.035 9.299 -7.923 1.00 0.00 H new ATOM 0 HH21 ARG A 761 -11.660 6.964 -7.664 1.00 0.00 H new ATOM 0 HH22 ARG A 761 -11.214 8.628 -8.058 1.00 0.00 H new ATOM 324 N ARG A 762 -5.786 0.982 -5.214 1.00 0.00 N ATOM 325 CA ARG A 762 -5.976 -0.343 -4.631 1.00 0.00 C ATOM 326 C ARG A 762 -4.733 -0.764 -3.849 1.00 0.00 C ATOM 327 O ARG A 762 -3.607 -0.563 -4.301 1.00 0.00 O ATOM 328 CB ARG A 762 -6.319 -1.369 -5.726 1.00 0.00 C ATOM 329 CG ARG A 762 -5.135 -2.188 -6.224 1.00 0.00 C ATOM 330 CD ARG A 762 -4.080 -1.312 -6.878 1.00 0.00 C ATOM 331 NE ARG A 762 -4.076 -1.446 -8.334 1.00 0.00 N ATOM 332 CZ ARG A 762 -3.849 -2.589 -8.977 1.00 0.00 C ATOM 333 NH1 ARG A 762 -3.593 -3.703 -8.302 1.00 0.00 N ATOM 334 NH2 ARG A 762 -3.869 -2.616 -10.302 1.00 0.00 N ATOM 0 H ARG A 762 -4.834 1.340 -5.143 1.00 0.00 H new ATOM 0 HA ARG A 762 -6.814 -0.303 -3.935 1.00 0.00 H new ATOM 0 HB2 ARG A 762 -7.078 -2.050 -5.342 1.00 0.00 H new ATOM 0 HB3 ARG A 762 -6.761 -0.843 -6.572 1.00 0.00 H new ATOM 0 HG2 ARG A 762 -4.691 -2.730 -5.389 1.00 0.00 H new ATOM 0 HG3 ARG A 762 -5.483 -2.933 -6.939 1.00 0.00 H new ATOM 0 HD2 ARG A 762 -4.259 -0.270 -6.611 1.00 0.00 H new ATOM 0 HD3 ARG A 762 -3.097 -1.577 -6.488 1.00 0.00 H new ATOM 0 HE ARG A 762 -4.259 -0.612 -8.892 1.00 0.00 H new ATOM 0 HH11 ARG A 762 -3.569 -3.687 -7.282 1.00 0.00 H new ATOM 0 HH12 ARG A 762 -3.420 -4.575 -8.803 1.00 0.00 H new ATOM 0 HH21 ARG A 762 -4.058 -1.762 -10.827 1.00 0.00 H new ATOM 0 HH22 ARG A 762 -3.695 -3.491 -10.797 1.00 0.00 H new ATOM 348 N ALA A 763 -4.943 -1.335 -2.667 1.00 0.00 N ATOM 349 CA ALA A 763 -3.838 -1.765 -1.825 1.00 0.00 C ATOM 350 C ALA A 763 -3.660 -3.279 -1.853 1.00 0.00 C ATOM 351 O ALA A 763 -4.228 -3.997 -1.031 1.00 0.00 O ATOM 352 CB ALA A 763 -4.050 -1.284 -0.398 1.00 0.00 C ATOM 0 H ALA A 763 -5.868 -1.509 -2.273 1.00 0.00 H new ATOM 0 HA ALA A 763 -2.926 -1.321 -2.223 1.00 0.00 H new ATOM 0 HB1 ALA A 763 -3.217 -1.611 0.224 1.00 0.00 H new ATOM 0 HB2 ALA A 763 -4.106 -0.196 -0.386 1.00 0.00 H new ATOM 0 HB3 ALA A 763 -4.979 -1.700 -0.008 1.00 0.00 H new ATOM 358 N SER A 764 -2.850 -3.753 -2.792 1.00 0.00 N ATOM 359 CA SER A 764 -2.570 -5.177 -2.915 1.00 0.00 C ATOM 360 C SER A 764 -1.078 -5.415 -2.780 1.00 0.00 C ATOM 361 O SER A 764 -0.285 -4.913 -3.573 1.00 0.00 O ATOM 362 CB SER A 764 -3.069 -5.709 -4.260 1.00 0.00 C ATOM 363 OG SER A 764 -4.248 -5.037 -4.670 1.00 0.00 O ATOM 0 H SER A 764 -2.375 -3.170 -3.481 1.00 0.00 H new ATOM 0 HA SER A 764 -3.094 -5.709 -2.121 1.00 0.00 H new ATOM 0 HB2 SER A 764 -2.293 -5.582 -5.015 1.00 0.00 H new ATOM 0 HB3 SER A 764 -3.265 -6.778 -4.181 1.00 0.00 H new ATOM 0 HG SER A 764 -4.545 -5.394 -5.533 1.00 0.00 H new ATOM 369 N ILE A 765 -0.699 -6.175 -1.764 1.00 0.00 N ATOM 370 CA ILE A 765 0.705 -6.464 -1.513 1.00 0.00 C ATOM 371 C ILE A 765 1.391 -7.029 -2.749 1.00 0.00 C ATOM 372 O ILE A 765 2.447 -6.551 -3.155 1.00 0.00 O ATOM 373 CB ILE A 765 0.886 -7.446 -0.348 1.00 0.00 C ATOM 374 CG1 ILE A 765 -0.014 -7.067 0.834 1.00 0.00 C ATOM 375 CG2 ILE A 765 2.342 -7.471 0.075 1.00 0.00 C ATOM 376 CD1 ILE A 765 -0.944 -8.180 1.260 1.00 0.00 C ATOM 0 H ILE A 765 -1.344 -6.603 -1.100 1.00 0.00 H new ATOM 0 HA ILE A 765 1.169 -5.513 -1.250 1.00 0.00 H new ATOM 0 HB ILE A 765 0.594 -8.442 -0.680 1.00 0.00 H new ATOM 0 HG12 ILE A 765 0.611 -6.782 1.680 1.00 0.00 H new ATOM 0 HG13 ILE A 765 -0.606 -6.192 0.565 1.00 0.00 H new ATOM 0 HG21 ILE A 765 2.469 -8.169 0.903 1.00 0.00 H new ATOM 0 HG22 ILE A 765 2.960 -7.788 -0.765 1.00 0.00 H new ATOM 0 HG23 ILE A 765 2.646 -6.473 0.392 1.00 0.00 H new ATOM 0 HD11 ILE A 765 -1.552 -7.845 2.100 1.00 0.00 H new ATOM 0 HD12 ILE A 765 -1.593 -8.450 0.427 1.00 0.00 H new ATOM 0 HD13 ILE A 765 -0.358 -9.049 1.560 1.00 0.00 H new ATOM 388 N SER A 766 0.784 -8.048 -3.347 1.00 0.00 N ATOM 389 CA SER A 766 1.342 -8.670 -4.541 1.00 0.00 C ATOM 390 C SER A 766 1.572 -7.627 -5.628 1.00 0.00 C ATOM 391 O SER A 766 2.576 -7.660 -6.341 1.00 0.00 O ATOM 392 CB SER A 766 0.409 -9.768 -5.047 1.00 0.00 C ATOM 393 OG SER A 766 0.793 -10.211 -6.337 1.00 0.00 O ATOM 0 H SER A 766 -0.092 -8.460 -3.025 1.00 0.00 H new ATOM 0 HA SER A 766 2.302 -9.117 -4.284 1.00 0.00 H new ATOM 0 HB2 SER A 766 0.421 -10.608 -4.352 1.00 0.00 H new ATOM 0 HB3 SER A 766 -0.614 -9.394 -5.077 1.00 0.00 H new ATOM 0 HG SER A 766 0.181 -10.915 -6.637 1.00 0.00 H new ATOM 399 N ALA A 767 0.639 -6.691 -5.740 1.00 0.00 N ATOM 400 CA ALA A 767 0.742 -5.628 -6.728 1.00 0.00 C ATOM 401 C ALA A 767 1.831 -4.638 -6.335 1.00 0.00 C ATOM 402 O ALA A 767 2.562 -4.135 -7.189 1.00 0.00 O ATOM 403 CB ALA A 767 -0.597 -4.925 -6.886 1.00 0.00 C ATOM 0 H ALA A 767 -0.198 -6.647 -5.158 1.00 0.00 H new ATOM 0 HA ALA A 767 1.014 -6.067 -7.688 1.00 0.00 H new ATOM 0 HB1 ALA A 767 -0.506 -4.132 -7.628 1.00 0.00 H new ATOM 0 HB2 ALA A 767 -1.349 -5.643 -7.213 1.00 0.00 H new ATOM 0 HB3 ALA A 767 -0.897 -4.495 -5.930 1.00 0.00 H new ATOM 409 N VAL A 768 1.946 -4.371 -5.036 1.00 0.00 N ATOM 410 CA VAL A 768 2.965 -3.453 -4.542 1.00 0.00 C ATOM 411 C VAL A 768 4.349 -4.025 -4.785 1.00 0.00 C ATOM 412 O VAL A 768 5.233 -3.337 -5.282 1.00 0.00 O ATOM 413 CB VAL A 768 2.817 -3.161 -3.034 1.00 0.00 C ATOM 414 CG1 VAL A 768 3.840 -2.130 -2.589 1.00 0.00 C ATOM 415 CG2 VAL A 768 1.421 -2.678 -2.707 1.00 0.00 C ATOM 0 H VAL A 768 1.350 -4.774 -4.313 1.00 0.00 H new ATOM 0 HA VAL A 768 2.831 -2.519 -5.088 1.00 0.00 H new ATOM 0 HB VAL A 768 2.994 -4.092 -2.495 1.00 0.00 H new ATOM 0 HG11 VAL A 768 3.721 -1.936 -1.523 1.00 0.00 H new ATOM 0 HG12 VAL A 768 4.844 -2.508 -2.779 1.00 0.00 H new ATOM 0 HG13 VAL A 768 3.690 -1.205 -3.145 1.00 0.00 H new ATOM 0 HG21 VAL A 768 1.346 -2.480 -1.638 1.00 0.00 H new ATOM 0 HG22 VAL A 768 1.214 -1.762 -3.261 1.00 0.00 H new ATOM 0 HG23 VAL A 768 0.697 -3.443 -2.986 1.00 0.00 H new ATOM 425 N GLN A 769 4.536 -5.291 -4.427 1.00 0.00 N ATOM 426 CA GLN A 769 5.822 -5.939 -4.611 1.00 0.00 C ATOM 427 C GLN A 769 6.154 -6.052 -6.091 1.00 0.00 C ATOM 428 O GLN A 769 7.319 -5.971 -6.483 1.00 0.00 O ATOM 429 CB GLN A 769 5.839 -7.319 -3.948 1.00 0.00 C ATOM 430 CG GLN A 769 4.878 -8.315 -4.574 1.00 0.00 C ATOM 431 CD GLN A 769 5.532 -9.650 -4.874 1.00 0.00 C ATOM 432 OE1 GLN A 769 5.660 -10.046 -6.033 1.00 0.00 O ATOM 433 NE2 GLN A 769 5.948 -10.352 -3.827 1.00 0.00 N ATOM 0 H GLN A 769 3.817 -5.882 -4.011 1.00 0.00 H new ATOM 0 HA GLN A 769 6.584 -5.325 -4.131 1.00 0.00 H new ATOM 0 HB2 GLN A 769 6.850 -7.723 -3.999 1.00 0.00 H new ATOM 0 HB3 GLN A 769 5.594 -7.207 -2.892 1.00 0.00 H new ATOM 0 HG2 GLN A 769 4.034 -8.471 -3.902 1.00 0.00 H new ATOM 0 HG3 GLN A 769 4.477 -7.896 -5.497 1.00 0.00 H new ATOM 0 HE21 GLN A 769 5.821 -9.985 -2.884 1.00 0.00 H new ATOM 0 HE22 GLN A 769 6.394 -11.259 -3.966 1.00 0.00 H new ATOM 442 N ARG A 770 5.119 -6.233 -6.903 1.00 0.00 N ATOM 443 CA ARG A 770 5.284 -6.355 -8.341 1.00 0.00 C ATOM 444 C ARG A 770 5.675 -5.016 -8.966 1.00 0.00 C ATOM 445 O ARG A 770 6.536 -4.957 -9.844 1.00 0.00 O ATOM 446 CB ARG A 770 3.983 -6.868 -8.964 1.00 0.00 C ATOM 447 CG ARG A 770 4.016 -8.347 -9.307 1.00 0.00 C ATOM 448 CD ARG A 770 3.193 -8.650 -10.548 1.00 0.00 C ATOM 449 NE ARG A 770 3.496 -9.971 -11.096 1.00 0.00 N ATOM 450 CZ ARG A 770 3.548 -10.246 -12.399 1.00 0.00 C ATOM 451 NH1 ARG A 770 3.313 -9.300 -13.300 1.00 0.00 N ATOM 452 NH2 ARG A 770 3.836 -11.476 -12.802 1.00 0.00 N ATOM 0 H ARG A 770 4.152 -6.298 -6.585 1.00 0.00 H new ATOM 0 HA ARG A 770 6.087 -7.065 -8.539 1.00 0.00 H new ATOM 0 HB2 ARG A 770 3.161 -6.682 -8.273 1.00 0.00 H new ATOM 0 HB3 ARG A 770 3.774 -6.298 -9.869 1.00 0.00 H new ATOM 0 HG2 ARG A 770 5.047 -8.661 -9.468 1.00 0.00 H new ATOM 0 HG3 ARG A 770 3.634 -8.925 -8.466 1.00 0.00 H new ATOM 0 HD2 ARG A 770 2.132 -8.594 -10.303 1.00 0.00 H new ATOM 0 HD3 ARG A 770 3.386 -7.890 -11.305 1.00 0.00 H new ATOM 0 HE ARG A 770 3.679 -10.730 -10.440 1.00 0.00 H new ATOM 0 HH11 ARG A 770 3.090 -8.352 -12.998 1.00 0.00 H new ATOM 0 HH12 ARG A 770 3.355 -9.521 -14.295 1.00 0.00 H new ATOM 0 HH21 ARG A 770 4.017 -12.208 -12.115 1.00 0.00 H new ATOM 0 HH22 ARG A 770 3.877 -11.690 -13.799 1.00 0.00 H new ATOM 466 N LYS A 771 5.026 -3.946 -8.516 1.00 0.00 N ATOM 467 CA LYS A 771 5.294 -2.608 -9.037 1.00 0.00 C ATOM 468 C LYS A 771 6.569 -2.005 -8.445 1.00 0.00 C ATOM 469 O LYS A 771 7.307 -1.300 -9.132 1.00 0.00 O ATOM 470 CB LYS A 771 4.102 -1.690 -8.762 1.00 0.00 C ATOM 471 CG LYS A 771 3.722 -0.821 -9.950 1.00 0.00 C ATOM 472 CD LYS A 771 4.194 0.609 -9.765 1.00 0.00 C ATOM 473 CE LYS A 771 3.202 1.602 -10.349 1.00 0.00 C ATOM 474 NZ LYS A 771 3.516 3.001 -9.949 1.00 0.00 N ATOM 0 H LYS A 771 4.310 -3.979 -7.791 1.00 0.00 H new ATOM 0 HA LYS A 771 5.445 -2.699 -10.113 1.00 0.00 H new ATOM 0 HB2 LYS A 771 3.243 -2.298 -8.476 1.00 0.00 H new ATOM 0 HB3 LYS A 771 4.335 -1.049 -7.912 1.00 0.00 H new ATOM 0 HG2 LYS A 771 4.158 -1.235 -10.859 1.00 0.00 H new ATOM 0 HG3 LYS A 771 2.640 -0.834 -10.081 1.00 0.00 H new ATOM 0 HD2 LYS A 771 4.333 0.813 -8.703 1.00 0.00 H new ATOM 0 HD3 LYS A 771 5.165 0.738 -10.244 1.00 0.00 H new ATOM 0 HE2 LYS A 771 3.209 1.525 -11.436 1.00 0.00 H new ATOM 0 HE3 LYS A 771 2.195 1.347 -10.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 771 2.817 3.647 -10.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 771 3.485 3.081 -8.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 771 4.466 3.254 -10.287 1.00 0.00 H new ATOM 488 N LEU A 772 6.820 -2.283 -7.171 1.00 0.00 N ATOM 489 CA LEU A 772 8.006 -1.763 -6.492 1.00 0.00 C ATOM 490 C LEU A 772 9.185 -2.725 -6.588 1.00 0.00 C ATOM 491 O LEU A 772 10.303 -2.381 -6.204 1.00 0.00 O ATOM 492 CB LEU A 772 7.703 -1.477 -5.016 1.00 0.00 C ATOM 493 CG LEU A 772 7.567 0.005 -4.654 1.00 0.00 C ATOM 494 CD1 LEU A 772 6.108 0.431 -4.606 1.00 0.00 C ATOM 495 CD2 LEU A 772 8.243 0.282 -3.318 1.00 0.00 C ATOM 0 H LEU A 772 6.220 -2.865 -6.586 1.00 0.00 H new ATOM 0 HA LEU A 772 8.279 -0.836 -6.996 1.00 0.00 H new ATOM 0 HB2 LEU A 772 6.778 -1.987 -4.746 1.00 0.00 H new ATOM 0 HB3 LEU A 772 8.496 -1.912 -4.408 1.00 0.00 H new ATOM 0 HG LEU A 772 8.060 0.589 -5.431 1.00 0.00 H new ATOM 0 HD11 LEU A 772 6.046 1.488 -4.346 1.00 0.00 H new ATOM 0 HD12 LEU A 772 5.649 0.269 -5.582 1.00 0.00 H new ATOM 0 HD13 LEU A 772 5.581 -0.158 -3.855 1.00 0.00 H new ATOM 0 HD21 LEU A 772 8.140 1.339 -3.070 1.00 0.00 H new ATOM 0 HD22 LEU A 772 7.773 -0.320 -2.541 1.00 0.00 H new ATOM 0 HD23 LEU A 772 9.300 0.026 -3.385 1.00 0.00 H new ATOM 507 N LYS A 773 8.937 -3.934 -7.077 1.00 0.00 N ATOM 508 CA LYS A 773 9.993 -4.929 -7.188 1.00 0.00 C ATOM 509 C LYS A 773 10.560 -5.237 -5.807 1.00 0.00 C ATOM 510 O LYS A 773 11.769 -5.387 -5.636 1.00 0.00 O ATOM 511 CB LYS A 773 11.105 -4.432 -8.116 1.00 0.00 C ATOM 512 CG LYS A 773 10.676 -4.302 -9.568 1.00 0.00 C ATOM 513 CD LYS A 773 11.566 -3.332 -10.328 1.00 0.00 C ATOM 514 CE LYS A 773 12.883 -3.980 -10.725 1.00 0.00 C ATOM 515 NZ LYS A 773 13.374 -3.480 -12.040 1.00 0.00 N ATOM 0 H LYS A 773 8.021 -4.246 -7.400 1.00 0.00 H new ATOM 0 HA LYS A 773 9.572 -5.840 -7.613 1.00 0.00 H new ATOM 0 HB2 LYS A 773 11.456 -3.463 -7.762 1.00 0.00 H new ATOM 0 HB3 LYS A 773 11.950 -5.118 -8.056 1.00 0.00 H new ATOM 0 HG2 LYS A 773 10.710 -5.280 -10.047 1.00 0.00 H new ATOM 0 HG3 LYS A 773 9.642 -3.960 -9.614 1.00 0.00 H new ATOM 0 HD2 LYS A 773 11.047 -2.983 -11.221 1.00 0.00 H new ATOM 0 HD3 LYS A 773 11.762 -2.456 -9.710 1.00 0.00 H new ATOM 0 HE2 LYS A 773 13.632 -3.780 -9.958 1.00 0.00 H new ATOM 0 HE3 LYS A 773 12.756 -5.062 -10.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 773 14.274 -3.946 -12.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 773 12.671 -3.693 -12.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 773 13.520 -2.452 -11.988 1.00 0.00 H new ATOM 529 N ILE A 774 9.667 -5.334 -4.825 1.00 0.00 N ATOM 530 CA ILE A 774 10.067 -5.628 -3.453 1.00 0.00 C ATOM 531 C ILE A 774 9.578 -7.013 -3.045 1.00 0.00 C ATOM 532 O ILE A 774 9.041 -7.754 -3.868 1.00 0.00 O ATOM 533 CB ILE A 774 9.522 -4.581 -2.450 1.00 0.00 C ATOM 534 CG1 ILE A 774 8.009 -4.424 -2.603 1.00 0.00 C ATOM 535 CG2 ILE A 774 10.216 -3.244 -2.645 1.00 0.00 C ATOM 536 CD1 ILE A 774 7.389 -3.421 -1.649 1.00 0.00 C ATOM 0 H ILE A 774 8.662 -5.213 -4.955 1.00 0.00 H new ATOM 0 HA ILE A 774 11.156 -5.592 -3.424 1.00 0.00 H new ATOM 0 HB ILE A 774 9.731 -4.935 -1.440 1.00 0.00 H new ATOM 0 HG12 ILE A 774 7.788 -4.120 -3.626 1.00 0.00 H new ATOM 0 HG13 ILE A 774 7.537 -5.394 -2.450 1.00 0.00 H new ATOM 0 HG21 ILE A 774 9.820 -2.521 -1.932 1.00 0.00 H new ATOM 0 HG22 ILE A 774 11.287 -3.363 -2.484 1.00 0.00 H new ATOM 0 HG23 ILE A 774 10.039 -2.887 -3.660 1.00 0.00 H new ATOM 0 HD11 ILE A 774 6.314 -3.370 -1.823 1.00 0.00 H new ATOM 0 HD12 ILE A 774 7.576 -3.733 -0.621 1.00 0.00 H new ATOM 0 HD13 ILE A 774 7.831 -2.439 -1.816 1.00 0.00 H new ATOM 548 N GLY A 775 9.764 -7.361 -1.779 1.00 0.00 N ATOM 549 CA GLY A 775 9.330 -8.660 -1.300 1.00 0.00 C ATOM 550 C GLY A 775 7.900 -8.636 -0.804 1.00 0.00 C ATOM 551 O GLY A 775 7.420 -7.607 -0.333 1.00 0.00 O ATOM 0 H GLY A 775 10.207 -6.769 -1.076 1.00 0.00 H new ATOM 0 HA2 GLY A 775 9.422 -9.391 -2.103 1.00 0.00 H new ATOM 0 HA3 GLY A 775 9.987 -8.987 -0.494 1.00 0.00 H new ATOM 555 N TYR A 776 7.213 -9.771 -0.906 1.00 0.00 N ATOM 556 CA TYR A 776 5.828 -9.859 -0.458 1.00 0.00 C ATOM 557 C TYR A 776 5.709 -9.436 1.002 1.00 0.00 C ATOM 558 O TYR A 776 4.816 -8.671 1.367 1.00 0.00 O ATOM 559 CB TYR A 776 5.295 -11.283 -0.633 1.00 0.00 C ATOM 560 CG TYR A 776 3.875 -11.463 -0.143 1.00 0.00 C ATOM 561 CD1 TYR A 776 3.603 -11.627 1.209 1.00 0.00 C ATOM 562 CD2 TYR A 776 2.808 -11.466 -1.033 1.00 0.00 C ATOM 563 CE1 TYR A 776 2.308 -11.790 1.661 1.00 0.00 C ATOM 564 CE2 TYR A 776 1.509 -11.628 -0.588 1.00 0.00 C ATOM 565 CZ TYR A 776 1.265 -11.791 0.760 1.00 0.00 C ATOM 566 OH TYR A 776 -0.026 -11.954 1.206 1.00 0.00 O ATOM 0 H TYR A 776 7.590 -10.636 -1.292 1.00 0.00 H new ATOM 0 HA TYR A 776 5.231 -9.183 -1.070 1.00 0.00 H new ATOM 0 HB2 TYR A 776 5.343 -11.553 -1.688 1.00 0.00 H new ATOM 0 HB3 TYR A 776 5.946 -11.974 -0.097 1.00 0.00 H new ATOM 0 HD1 TYR A 776 4.417 -11.627 1.918 1.00 0.00 H new ATOM 0 HD2 TYR A 776 2.996 -11.340 -2.089 1.00 0.00 H new ATOM 0 HE1 TYR A 776 2.114 -11.916 2.716 1.00 0.00 H new ATOM 0 HE2 TYR A 776 0.690 -11.627 -1.292 1.00 0.00 H new ATOM 0 HH TYR A 776 -0.641 -11.929 0.443 1.00 0.00 H new ATOM 576 N ASN A 777 6.618 -9.935 1.831 1.00 0.00 N ATOM 577 CA ASN A 777 6.618 -9.606 3.250 1.00 0.00 C ATOM 578 C ASN A 777 6.873 -8.117 3.460 1.00 0.00 C ATOM 579 O ASN A 777 6.159 -7.459 4.215 1.00 0.00 O ATOM 580 CB ASN A 777 7.679 -10.427 3.985 1.00 0.00 C ATOM 581 CG ASN A 777 7.257 -11.871 4.183 1.00 0.00 C ATOM 582 OD1 ASN A 777 6.735 -12.238 5.236 1.00 0.00 O ATOM 583 ND2 ASN A 777 7.484 -12.698 3.169 1.00 0.00 N ATOM 0 H ASN A 777 7.364 -10.569 1.545 1.00 0.00 H new ATOM 0 HA ASN A 777 5.636 -9.850 3.656 1.00 0.00 H new ATOM 0 HB2 ASN A 777 8.612 -10.398 3.422 1.00 0.00 H new ATOM 0 HB3 ASN A 777 7.878 -9.973 4.956 1.00 0.00 H new ATOM 0 HD21 ASN A 777 7.223 -13.681 3.245 1.00 0.00 H new ATOM 0 HD22 ASN A 777 7.919 -12.350 2.315 1.00 0.00 H new ATOM 590 N ARG A 778 7.893 -7.591 2.787 1.00 0.00 N ATOM 591 CA ARG A 778 8.235 -6.180 2.902 1.00 0.00 C ATOM 592 C ARG A 778 7.064 -5.303 2.474 1.00 0.00 C ATOM 593 O ARG A 778 6.666 -4.385 3.192 1.00 0.00 O ATOM 594 CB ARG A 778 9.476 -5.877 2.058 1.00 0.00 C ATOM 595 CG ARG A 778 9.744 -4.396 1.862 1.00 0.00 C ATOM 596 CD ARG A 778 10.924 -4.167 0.934 1.00 0.00 C ATOM 597 NE ARG A 778 11.856 -3.174 1.468 1.00 0.00 N ATOM 598 CZ ARG A 778 13.055 -3.467 1.973 1.00 0.00 C ATOM 599 NH1 ARG A 778 13.479 -4.724 2.024 1.00 0.00 N ATOM 600 NH2 ARG A 778 13.832 -2.495 2.430 1.00 0.00 N ATOM 0 H ARG A 778 8.495 -8.122 2.158 1.00 0.00 H new ATOM 0 HA ARG A 778 8.456 -5.956 3.946 1.00 0.00 H new ATOM 0 HB2 ARG A 778 10.345 -6.333 2.532 1.00 0.00 H new ATOM 0 HB3 ARG A 778 9.362 -6.347 1.081 1.00 0.00 H new ATOM 0 HG2 ARG A 778 8.857 -3.915 1.451 1.00 0.00 H new ATOM 0 HG3 ARG A 778 9.941 -3.929 2.827 1.00 0.00 H new ATOM 0 HD2 ARG A 778 11.449 -5.109 0.776 1.00 0.00 H new ATOM 0 HD3 ARG A 778 10.561 -3.837 -0.039 1.00 0.00 H new ATOM 0 HE ARG A 778 11.571 -2.195 1.453 1.00 0.00 H new ATOM 0 HH11 ARG A 778 12.886 -5.477 1.675 1.00 0.00 H new ATOM 0 HH12 ARG A 778 14.398 -4.937 2.412 1.00 0.00 H new ATOM 0 HH21 ARG A 778 13.512 -1.527 2.395 1.00 0.00 H new ATOM 0 HH22 ARG A 778 14.750 -2.715 2.817 1.00 0.00 H new ATOM 614 N ALA A 779 6.511 -5.597 1.304 1.00 0.00 N ATOM 615 CA ALA A 779 5.380 -4.843 0.785 1.00 0.00 C ATOM 616 C ALA A 779 4.220 -4.875 1.773 1.00 0.00 C ATOM 617 O ALA A 779 3.668 -3.835 2.128 1.00 0.00 O ATOM 618 CB ALA A 779 4.951 -5.395 -0.566 1.00 0.00 C ATOM 0 H ALA A 779 6.828 -6.353 0.697 1.00 0.00 H new ATOM 0 HA ALA A 779 5.686 -3.805 0.651 1.00 0.00 H new ATOM 0 HB1 ALA A 779 4.104 -4.821 -0.941 1.00 0.00 H new ATOM 0 HB2 ALA A 779 5.780 -5.320 -1.269 1.00 0.00 H new ATOM 0 HB3 ALA A 779 4.661 -6.440 -0.457 1.00 0.00 H new ATOM 624 N ALA A 780 3.862 -6.076 2.221 1.00 0.00 N ATOM 625 CA ALA A 780 2.776 -6.245 3.180 1.00 0.00 C ATOM 626 C ALA A 780 3.028 -5.423 4.439 1.00 0.00 C ATOM 627 O ALA A 780 2.109 -4.807 4.980 1.00 0.00 O ATOM 628 CB ALA A 780 2.599 -7.715 3.527 1.00 0.00 C ATOM 0 H ALA A 780 4.309 -6.947 1.934 1.00 0.00 H new ATOM 0 HA ALA A 780 1.856 -5.884 2.720 1.00 0.00 H new ATOM 0 HB1 ALA A 780 1.785 -7.824 4.244 1.00 0.00 H new ATOM 0 HB2 ALA A 780 2.364 -8.277 2.623 1.00 0.00 H new ATOM 0 HB3 ALA A 780 3.521 -8.099 3.964 1.00 0.00 H new ATOM 634 N ARG A 781 4.278 -5.404 4.900 1.00 0.00 N ATOM 635 CA ARG A 781 4.633 -4.639 6.089 1.00 0.00 C ATOM 636 C ARG A 781 4.297 -3.168 5.871 1.00 0.00 C ATOM 637 O ARG A 781 3.678 -2.524 6.720 1.00 0.00 O ATOM 638 CB ARG A 781 6.118 -4.806 6.416 1.00 0.00 C ATOM 639 CG ARG A 781 6.457 -6.159 7.024 1.00 0.00 C ATOM 640 CD ARG A 781 7.650 -6.069 7.963 1.00 0.00 C ATOM 641 NE ARG A 781 8.496 -7.259 7.883 1.00 0.00 N ATOM 642 CZ ARG A 781 9.309 -7.662 8.857 1.00 0.00 C ATOM 643 NH1 ARG A 781 9.399 -6.969 9.986 1.00 0.00 N ATOM 644 NH2 ARG A 781 10.038 -8.759 8.703 1.00 0.00 N ATOM 0 H ARG A 781 5.055 -5.906 4.470 1.00 0.00 H new ATOM 0 HA ARG A 781 4.057 -5.015 6.935 1.00 0.00 H new ATOM 0 HB2 ARG A 781 6.700 -4.670 5.505 1.00 0.00 H new ATOM 0 HB3 ARG A 781 6.420 -4.020 7.108 1.00 0.00 H new ATOM 0 HG2 ARG A 781 5.593 -6.540 7.568 1.00 0.00 H new ATOM 0 HG3 ARG A 781 6.673 -6.872 6.228 1.00 0.00 H new ATOM 0 HD2 ARG A 781 8.240 -5.186 7.717 1.00 0.00 H new ATOM 0 HD3 ARG A 781 7.298 -5.942 8.987 1.00 0.00 H new ATOM 0 HE ARG A 781 8.461 -7.814 7.028 1.00 0.00 H new ATOM 0 HH11 ARG A 781 8.843 -6.123 10.111 1.00 0.00 H new ATOM 0 HH12 ARG A 781 10.024 -7.283 10.729 1.00 0.00 H new ATOM 0 HH21 ARG A 781 9.976 -9.295 7.837 1.00 0.00 H new ATOM 0 HH22 ARG A 781 10.661 -9.067 9.450 1.00 0.00 H new ATOM 658 N MET A 782 4.683 -2.652 4.709 1.00 0.00 N ATOM 659 CA MET A 782 4.396 -1.269 4.358 1.00 0.00 C ATOM 660 C MET A 782 2.892 -1.088 4.239 1.00 0.00 C ATOM 661 O MET A 782 2.327 -0.108 4.723 1.00 0.00 O ATOM 662 CB MET A 782 5.075 -0.898 3.040 1.00 0.00 C ATOM 663 CG MET A 782 6.592 -0.909 3.117 1.00 0.00 C ATOM 664 SD MET A 782 7.349 -1.868 1.792 1.00 0.00 S ATOM 665 CE MET A 782 7.160 -0.747 0.409 1.00 0.00 C ATOM 0 H MET A 782 5.195 -3.171 3.996 1.00 0.00 H new ATOM 0 HA MET A 782 4.784 -0.613 5.137 1.00 0.00 H new ATOM 0 HB2 MET A 782 4.753 -1.594 2.266 1.00 0.00 H new ATOM 0 HB3 MET A 782 4.742 0.094 2.735 1.00 0.00 H new ATOM 0 HG2 MET A 782 6.961 0.116 3.075 1.00 0.00 H new ATOM 0 HG3 MET A 782 6.900 -1.320 4.079 1.00 0.00 H new ATOM 0 HE1 MET A 782 8.098 -0.690 -0.144 1.00 0.00 H new ATOM 0 HE2 MET A 782 6.372 -1.112 -0.250 1.00 0.00 H new ATOM 0 HE3 MET A 782 6.895 0.244 0.778 1.00 0.00 H new ATOM 675 N ILE A 783 2.247 -2.063 3.608 1.00 0.00 N ATOM 676 CA ILE A 783 0.803 -2.045 3.439 1.00 0.00 C ATOM 677 C ILE A 783 0.136 -1.951 4.809 1.00 0.00 C ATOM 678 O ILE A 783 -0.877 -1.270 4.981 1.00 0.00 O ATOM 679 CB ILE A 783 0.329 -3.309 2.678 1.00 0.00 C ATOM 680 CG1 ILE A 783 0.712 -3.211 1.196 1.00 0.00 C ATOM 681 CG2 ILE A 783 -1.170 -3.526 2.828 1.00 0.00 C ATOM 682 CD1 ILE A 783 -0.165 -2.269 0.391 1.00 0.00 C ATOM 0 H ILE A 783 2.707 -2.879 3.204 1.00 0.00 H new ATOM 0 HA ILE A 783 0.519 -1.176 2.846 1.00 0.00 H new ATOM 0 HB ILE A 783 0.831 -4.171 3.118 1.00 0.00 H new ATOM 0 HG12 ILE A 783 1.748 -2.880 1.120 1.00 0.00 H new ATOM 0 HG13 ILE A 783 0.662 -4.205 0.752 1.00 0.00 H new ATOM 0 HG21 ILE A 783 -1.465 -4.421 2.281 1.00 0.00 H new ATOM 0 HG22 ILE A 783 -1.416 -3.648 3.883 1.00 0.00 H new ATOM 0 HG23 ILE A 783 -1.704 -2.664 2.428 1.00 0.00 H new ATOM 0 HD11 ILE A 783 0.171 -2.256 -0.646 1.00 0.00 H new ATOM 0 HD12 ILE A 783 -1.199 -2.610 0.433 1.00 0.00 H new ATOM 0 HD13 ILE A 783 -0.097 -1.264 0.807 1.00 0.00 H new ATOM 694 N GLU A 784 0.746 -2.604 5.794 1.00 0.00 N ATOM 695 CA GLU A 784 0.245 -2.555 7.158 1.00 0.00 C ATOM 696 C GLU A 784 0.347 -1.123 7.656 1.00 0.00 C ATOM 697 O GLU A 784 -0.598 -0.569 8.225 1.00 0.00 O ATOM 698 CB GLU A 784 1.052 -3.489 8.061 1.00 0.00 C ATOM 699 CG GLU A 784 0.296 -3.950 9.294 1.00 0.00 C ATOM 700 CD GLU A 784 0.843 -3.348 10.574 1.00 0.00 C ATOM 701 OE1 GLU A 784 2.067 -3.108 10.643 1.00 0.00 O ATOM 702 OE2 GLU A 784 0.046 -3.116 11.508 1.00 0.00 O ATOM 0 H GLU A 784 1.585 -3.171 5.671 1.00 0.00 H new ATOM 0 HA GLU A 784 -0.794 -2.885 7.180 1.00 0.00 H new ATOM 0 HB2 GLU A 784 1.357 -4.363 7.485 1.00 0.00 H new ATOM 0 HB3 GLU A 784 1.963 -2.979 8.374 1.00 0.00 H new ATOM 0 HG2 GLU A 784 -0.756 -3.682 9.192 1.00 0.00 H new ATOM 0 HG3 GLU A 784 0.343 -5.037 9.359 1.00 0.00 H new ATOM 709 N ALA A 785 1.502 -0.521 7.391 1.00 0.00 N ATOM 710 CA ALA A 785 1.748 0.864 7.761 1.00 0.00 C ATOM 711 C ALA A 785 0.705 1.759 7.110 1.00 0.00 C ATOM 712 O ALA A 785 0.291 2.766 7.680 1.00 0.00 O ATOM 713 CB ALA A 785 3.146 1.291 7.341 1.00 0.00 C ATOM 0 H ALA A 785 2.284 -0.975 6.919 1.00 0.00 H new ATOM 0 HA ALA A 785 1.675 0.958 8.845 1.00 0.00 H new ATOM 0 HB1 ALA A 785 3.310 2.330 7.627 1.00 0.00 H new ATOM 0 HB2 ALA A 785 3.883 0.658 7.835 1.00 0.00 H new ATOM 0 HB3 ALA A 785 3.248 1.191 6.260 1.00 0.00 H new ATOM 719 N MET A 786 0.280 1.370 5.912 1.00 0.00 N ATOM 720 CA MET A 786 -0.726 2.121 5.179 1.00 0.00 C ATOM 721 C MET A 786 -2.065 2.042 5.899 1.00 0.00 C ATOM 722 O MET A 786 -2.813 3.014 5.957 1.00 0.00 O ATOM 723 CB MET A 786 -0.866 1.584 3.753 1.00 0.00 C ATOM 724 CG MET A 786 0.168 2.142 2.798 1.00 0.00 C ATOM 725 SD MET A 786 -0.049 1.560 1.106 1.00 0.00 S ATOM 726 CE MET A 786 1.450 0.608 0.878 1.00 0.00 C ATOM 0 H MET A 786 0.619 0.537 5.430 1.00 0.00 H new ATOM 0 HA MET A 786 -0.410 3.163 5.128 1.00 0.00 H new ATOM 0 HB2 MET A 786 -0.784 0.497 3.772 1.00 0.00 H new ATOM 0 HB3 MET A 786 -1.862 1.822 3.379 1.00 0.00 H new ATOM 0 HG2 MET A 786 0.117 3.231 2.811 1.00 0.00 H new ATOM 0 HG3 MET A 786 1.163 1.866 3.147 1.00 0.00 H new ATOM 0 HE1 MET A 786 1.383 0.040 -0.050 1.00 0.00 H new ATOM 0 HE2 MET A 786 2.305 1.282 0.830 1.00 0.00 H new ATOM 0 HE3 MET A 786 1.576 -0.079 1.715 1.00 0.00 H new ATOM 736 N GLU A 787 -2.358 0.872 6.454 1.00 0.00 N ATOM 737 CA GLU A 787 -3.606 0.669 7.178 1.00 0.00 C ATOM 738 C GLU A 787 -3.678 1.589 8.389 1.00 0.00 C ATOM 739 O GLU A 787 -4.685 2.256 8.620 1.00 0.00 O ATOM 740 CB GLU A 787 -3.731 -0.787 7.625 1.00 0.00 C ATOM 741 CG GLU A 787 -4.436 -1.667 6.610 1.00 0.00 C ATOM 742 CD GLU A 787 -5.085 -2.883 7.242 1.00 0.00 C ATOM 743 OE1 GLU A 787 -4.418 -3.557 8.055 1.00 0.00 O ATOM 744 OE2 GLU A 787 -6.261 -3.158 6.926 1.00 0.00 O ATOM 0 H GLU A 787 -1.751 0.053 6.417 1.00 0.00 H new ATOM 0 HA GLU A 787 -4.432 0.906 6.507 1.00 0.00 H new ATOM 0 HB2 GLU A 787 -2.736 -1.188 7.815 1.00 0.00 H new ATOM 0 HB3 GLU A 787 -4.275 -0.825 8.569 1.00 0.00 H new ATOM 0 HG2 GLU A 787 -5.196 -1.081 6.093 1.00 0.00 H new ATOM 0 HG3 GLU A 787 -3.718 -1.993 5.857 1.00 0.00 H new ATOM 751 N MET A 788 -2.598 1.615 9.157 1.00 0.00 N ATOM 752 CA MET A 788 -2.524 2.450 10.349 1.00 0.00 C ATOM 753 C MET A 788 -2.362 3.923 9.984 1.00 0.00 C ATOM 754 O MET A 788 -2.920 4.803 10.641 1.00 0.00 O ATOM 755 CB MET A 788 -1.355 2.001 11.227 1.00 0.00 C ATOM 756 CG MET A 788 -1.654 0.757 12.045 1.00 0.00 C ATOM 757 SD MET A 788 -0.553 0.575 13.461 1.00 0.00 S ATOM 758 CE MET A 788 1.047 0.680 12.661 1.00 0.00 C ATOM 0 H MET A 788 -1.758 1.066 8.976 1.00 0.00 H new ATOM 0 HA MET A 788 -3.458 2.338 10.899 1.00 0.00 H new ATOM 0 HB2 MET A 788 -0.488 1.810 10.594 1.00 0.00 H new ATOM 0 HB3 MET A 788 -1.085 2.813 11.902 1.00 0.00 H new ATOM 0 HG2 MET A 788 -2.686 0.796 12.395 1.00 0.00 H new ATOM 0 HG3 MET A 788 -1.567 -0.122 11.407 1.00 0.00 H new ATOM 0 HE1 MET A 788 1.821 0.341 13.350 1.00 0.00 H new ATOM 0 HE2 MET A 788 1.051 0.050 11.772 1.00 0.00 H new ATOM 0 HE3 MET A 788 1.243 1.713 12.375 1.00 0.00 H new ATOM 768 N ALA A 789 -1.591 4.179 8.937 1.00 0.00 N ATOM 769 CA ALA A 789 -1.338 5.541 8.475 1.00 0.00 C ATOM 770 C ALA A 789 -2.580 6.159 7.843 1.00 0.00 C ATOM 771 O ALA A 789 -2.691 7.381 7.740 1.00 0.00 O ATOM 772 CB ALA A 789 -0.192 5.548 7.473 1.00 0.00 C ATOM 0 H ALA A 789 -1.126 3.457 8.386 1.00 0.00 H new ATOM 0 HA ALA A 789 -1.068 6.141 9.344 1.00 0.00 H new ATOM 0 HB1 ALA A 789 -0.011 6.568 7.134 1.00 0.00 H new ATOM 0 HB2 ALA A 789 0.709 5.158 7.947 1.00 0.00 H new ATOM 0 HB3 ALA A 789 -0.452 4.923 6.619 1.00 0.00 H new ATOM 778 N GLY A 790 -3.501 5.312 7.403 1.00 0.00 N ATOM 779 CA GLY A 790 -4.711 5.800 6.767 1.00 0.00 C ATOM 780 C GLY A 790 -4.558 5.893 5.260 1.00 0.00 C ATOM 781 O GLY A 790 -5.354 6.544 4.584 1.00 0.00 O ATOM 0 H GLY A 790 -3.433 4.297 7.475 1.00 0.00 H new ATOM 0 HA2 GLY A 790 -5.541 5.136 7.008 1.00 0.00 H new ATOM 0 HA3 GLY A 790 -4.962 6.782 7.168 1.00 0.00 H new ATOM 785 N VAL A 791 -3.524 5.239 4.742 1.00 0.00 N ATOM 786 CA VAL A 791 -3.244 5.235 3.315 1.00 0.00 C ATOM 787 C VAL A 791 -4.063 4.171 2.599 1.00 0.00 C ATOM 788 O VAL A 791 -4.408 4.325 1.428 1.00 0.00 O ATOM 789 CB VAL A 791 -1.747 4.996 3.056 1.00 0.00 C ATOM 790 CG1 VAL A 791 -1.442 5.015 1.568 1.00 0.00 C ATOM 791 CG2 VAL A 791 -0.917 6.036 3.792 1.00 0.00 C ATOM 0 H VAL A 791 -2.861 4.700 5.298 1.00 0.00 H new ATOM 0 HA VAL A 791 -3.522 6.213 2.922 1.00 0.00 H new ATOM 0 HB VAL A 791 -1.484 4.008 3.435 1.00 0.00 H new ATOM 0 HG11 VAL A 791 -0.377 4.844 1.413 1.00 0.00 H new ATOM 0 HG12 VAL A 791 -2.012 4.231 1.070 1.00 0.00 H new ATOM 0 HG13 VAL A 791 -1.718 5.984 1.152 1.00 0.00 H new ATOM 0 HG21 VAL A 791 0.141 5.858 3.602 1.00 0.00 H new ATOM 0 HG22 VAL A 791 -1.186 7.032 3.440 1.00 0.00 H new ATOM 0 HG23 VAL A 791 -1.110 5.965 4.862 1.00 0.00 H new ATOM 801 N VAL A 792 -4.386 3.097 3.310 1.00 0.00 N ATOM 802 CA VAL A 792 -5.181 2.022 2.733 1.00 0.00 C ATOM 803 C VAL A 792 -6.208 1.494 3.729 1.00 0.00 C ATOM 804 O VAL A 792 -5.896 1.261 4.896 1.00 0.00 O ATOM 805 CB VAL A 792 -4.300 0.855 2.249 1.00 0.00 C ATOM 806 CG1 VAL A 792 -3.254 1.343 1.263 1.00 0.00 C ATOM 807 CG2 VAL A 792 -3.642 0.150 3.421 1.00 0.00 C ATOM 0 H VAL A 792 -4.111 2.949 4.281 1.00 0.00 H new ATOM 0 HA VAL A 792 -5.700 2.449 1.875 1.00 0.00 H new ATOM 0 HB VAL A 792 -4.943 0.137 1.739 1.00 0.00 H new ATOM 0 HG11 VAL A 792 -2.643 0.502 0.935 1.00 0.00 H new ATOM 0 HG12 VAL A 792 -3.748 1.791 0.401 1.00 0.00 H new ATOM 0 HG13 VAL A 792 -2.619 2.086 1.745 1.00 0.00 H new ATOM 0 HG21 VAL A 792 -3.025 -0.670 3.053 1.00 0.00 H new ATOM 0 HG22 VAL A 792 -3.017 0.857 3.967 1.00 0.00 H new ATOM 0 HG23 VAL A 792 -4.410 -0.244 4.086 1.00 0.00 H new ATOM 817 N THR A 793 -7.430 1.295 3.253 1.00 0.00 N ATOM 818 CA THR A 793 -8.509 0.780 4.087 1.00 0.00 C ATOM 819 C THR A 793 -8.384 -0.740 4.207 1.00 0.00 C ATOM 820 O THR A 793 -7.611 -1.355 3.473 1.00 0.00 O ATOM 821 CB THR A 793 -9.876 1.144 3.490 1.00 0.00 C ATOM 822 OG1 THR A 793 -10.224 0.246 2.454 1.00 0.00 O ATOM 823 CG2 THR A 793 -9.944 2.546 2.918 1.00 0.00 C ATOM 0 H THR A 793 -7.700 1.484 2.288 1.00 0.00 H new ATOM 0 HA THR A 793 -8.432 1.232 5.076 1.00 0.00 H new ATOM 0 HB THR A 793 -10.572 1.082 4.327 1.00 0.00 H new ATOM 0 HG1 THR A 793 -11.179 0.033 2.513 1.00 0.00 H new ATOM 0 HG21 THR A 793 -10.941 2.727 2.516 1.00 0.00 H new ATOM 0 HG22 THR A 793 -9.733 3.271 3.705 1.00 0.00 H new ATOM 0 HG23 THR A 793 -9.207 2.650 2.122 1.00 0.00 H new ATOM 831 N PRO A 794 -9.137 -1.376 5.122 1.00 0.00 N ATOM 832 CA PRO A 794 -9.081 -2.832 5.295 1.00 0.00 C ATOM 833 C PRO A 794 -9.596 -3.573 4.065 1.00 0.00 C ATOM 834 O PRO A 794 -10.264 -2.991 3.211 1.00 0.00 O ATOM 835 CB PRO A 794 -9.990 -3.089 6.500 1.00 0.00 C ATOM 836 CG PRO A 794 -10.906 -1.918 6.536 1.00 0.00 C ATOM 837 CD PRO A 794 -10.096 -0.749 6.049 1.00 0.00 C ATOM 0 HA PRO A 794 -8.061 -3.188 5.439 1.00 0.00 H new ATOM 0 HB2 PRO A 794 -10.543 -4.021 6.387 1.00 0.00 H new ATOM 0 HB3 PRO A 794 -9.413 -3.170 7.421 1.00 0.00 H new ATOM 0 HG2 PRO A 794 -11.776 -2.083 5.901 1.00 0.00 H new ATOM 0 HG3 PRO A 794 -11.277 -1.743 7.546 1.00 0.00 H new ATOM 0 HD2 PRO A 794 -10.718 -0.008 5.547 1.00 0.00 H new ATOM 0 HD3 PRO A 794 -9.591 -0.238 6.869 1.00 0.00 H new ATOM 845 N MET A 795 -9.276 -4.858 3.980 1.00 0.00 N ATOM 846 CA MET A 795 -9.696 -5.683 2.856 1.00 0.00 C ATOM 847 C MET A 795 -11.216 -5.752 2.752 1.00 0.00 C ATOM 848 O MET A 795 -11.930 -5.444 3.707 1.00 0.00 O ATOM 849 CB MET A 795 -9.120 -7.091 3.000 1.00 0.00 C ATOM 850 CG MET A 795 -7.626 -7.113 3.285 1.00 0.00 C ATOM 851 SD MET A 795 -7.174 -8.326 4.541 1.00 0.00 S ATOM 852 CE MET A 795 -5.500 -8.722 4.042 1.00 0.00 C ATOM 0 H MET A 795 -8.724 -5.353 4.680 1.00 0.00 H new ATOM 0 HA MET A 795 -9.317 -5.225 1.943 1.00 0.00 H new ATOM 0 HB2 MET A 795 -9.642 -7.607 3.805 1.00 0.00 H new ATOM 0 HB3 MET A 795 -9.315 -7.649 2.084 1.00 0.00 H new ATOM 0 HG2 MET A 795 -7.088 -7.333 2.363 1.00 0.00 H new ATOM 0 HG3 MET A 795 -7.308 -6.123 3.611 1.00 0.00 H new ATOM 0 HE1 MET A 795 -5.082 -9.462 4.724 1.00 0.00 H new ATOM 0 HE2 MET A 795 -5.508 -9.125 3.029 1.00 0.00 H new ATOM 0 HE3 MET A 795 -4.889 -7.819 4.068 1.00 0.00 H new ATOM 862 N ASN A 796 -11.703 -6.158 1.583 1.00 0.00 N ATOM 863 CA ASN A 796 -13.137 -6.270 1.346 1.00 0.00 C ATOM 864 C ASN A 796 -13.575 -7.731 1.341 1.00 0.00 C ATOM 865 O ASN A 796 -12.750 -8.637 1.458 1.00 0.00 O ATOM 866 CB ASN A 796 -13.510 -5.610 0.016 1.00 0.00 C ATOM 867 CG ASN A 796 -13.470 -4.103 0.085 1.00 0.00 C ATOM 868 OD1 ASN A 796 -13.660 -3.509 1.147 1.00 0.00 O ATOM 869 ND2 ASN A 796 -13.219 -3.475 -1.054 1.00 0.00 N ATOM 0 H ASN A 796 -11.123 -6.415 0.784 1.00 0.00 H new ATOM 0 HA ASN A 796 -13.654 -5.756 2.156 1.00 0.00 H new ATOM 0 HB2 ASN A 796 -12.826 -5.953 -0.760 1.00 0.00 H new ATOM 0 HB3 ASN A 796 -14.510 -5.930 -0.277 1.00 0.00 H new ATOM 0 HD21 ASN A 796 -13.177 -2.456 -1.076 1.00 0.00 H new ATOM 0 HD22 ASN A 796 -13.068 -4.010 -1.909 1.00 0.00 H new ATOM 876 N THR A 797 -14.879 -7.953 1.205 1.00 0.00 N ATOM 877 CA THR A 797 -15.426 -9.305 1.185 1.00 0.00 C ATOM 878 C THR A 797 -14.852 -10.111 0.022 1.00 0.00 C ATOM 879 O THR A 797 -14.712 -11.331 0.110 1.00 0.00 O ATOM 880 CB THR A 797 -16.952 -9.260 1.083 1.00 0.00 C ATOM 881 OG1 THR A 797 -17.355 -8.701 -0.154 1.00 0.00 O ATOM 882 CG2 THR A 797 -17.601 -8.451 2.187 1.00 0.00 C ATOM 0 H THR A 797 -15.576 -7.215 1.107 1.00 0.00 H new ATOM 0 HA THR A 797 -15.144 -9.795 2.117 1.00 0.00 H new ATOM 0 HB THR A 797 -17.279 -10.296 1.173 1.00 0.00 H new ATOM 0 HG1 THR A 797 -18.334 -8.682 -0.201 1.00 0.00 H new ATOM 0 HG21 THR A 797 -18.683 -8.459 2.056 1.00 0.00 H new ATOM 0 HG22 THR A 797 -17.349 -8.887 3.154 1.00 0.00 H new ATOM 0 HG23 THR A 797 -17.239 -7.424 2.147 1.00 0.00 H new ATOM 890 N ASN A 798 -14.521 -9.421 -1.065 1.00 0.00 N ATOM 891 CA ASN A 798 -13.962 -10.075 -2.243 1.00 0.00 C ATOM 892 C ASN A 798 -12.453 -10.273 -2.103 1.00 0.00 C ATOM 893 O ASN A 798 -11.856 -11.075 -2.820 1.00 0.00 O ATOM 894 CB ASN A 798 -14.266 -9.255 -3.499 1.00 0.00 C ATOM 895 CG ASN A 798 -14.808 -10.102 -4.626 1.00 0.00 C ATOM 896 OD1 ASN A 798 -15.396 -11.160 -4.401 1.00 0.00 O ATOM 897 ND2 ASN A 798 -14.610 -9.637 -5.850 1.00 0.00 N ATOM 0 H ASN A 798 -14.630 -8.411 -1.155 1.00 0.00 H new ATOM 0 HA ASN A 798 -14.428 -11.056 -2.333 1.00 0.00 H new ATOM 0 HB2 ASN A 798 -14.988 -8.476 -3.254 1.00 0.00 H new ATOM 0 HB3 ASN A 798 -13.357 -8.754 -3.831 1.00 0.00 H new ATOM 0 HD21 ASN A 798 -14.951 -10.161 -6.656 1.00 0.00 H new ATOM 0 HD22 ASN A 798 -14.117 -8.755 -5.987 1.00 0.00 H new ATOM 904 N GLY A 799 -11.842 -9.540 -1.175 1.00 0.00 N ATOM 905 CA GLY A 799 -10.412 -9.657 -0.965 1.00 0.00 C ATOM 906 C GLY A 799 -9.636 -8.522 -1.606 1.00 0.00 C ATOM 907 O GLY A 799 -8.465 -8.681 -1.953 1.00 0.00 O ATOM 0 H GLY A 799 -12.312 -8.869 -0.567 1.00 0.00 H new ATOM 0 HA2 GLY A 799 -10.205 -9.675 0.105 1.00 0.00 H new ATOM 0 HA3 GLY A 799 -10.065 -10.606 -1.373 1.00 0.00 H new ATOM 911 N SER A 800 -10.288 -7.375 -1.763 1.00 0.00 N ATOM 912 CA SER A 800 -9.649 -6.210 -2.366 1.00 0.00 C ATOM 913 C SER A 800 -9.705 -5.013 -1.424 1.00 0.00 C ATOM 914 O SER A 800 -10.761 -4.680 -0.887 1.00 0.00 O ATOM 915 CB SER A 800 -10.324 -5.860 -3.692 1.00 0.00 C ATOM 916 OG SER A 800 -10.241 -6.939 -4.607 1.00 0.00 O ATOM 0 H SER A 800 -11.257 -7.227 -1.482 1.00 0.00 H new ATOM 0 HA SER A 800 -8.604 -6.456 -2.553 1.00 0.00 H new ATOM 0 HB2 SER A 800 -11.370 -5.608 -3.516 1.00 0.00 H new ATOM 0 HB3 SER A 800 -9.851 -4.977 -4.122 1.00 0.00 H new ATOM 0 HG SER A 800 -10.681 -6.691 -5.446 1.00 0.00 H new ATOM 922 N ARG A 801 -8.558 -4.373 -1.225 1.00 0.00 N ATOM 923 CA ARG A 801 -8.472 -3.217 -0.344 1.00 0.00 C ATOM 924 C ARG A 801 -8.877 -1.937 -1.063 1.00 0.00 C ATOM 925 O ARG A 801 -9.049 -1.917 -2.282 1.00 0.00 O ATOM 926 CB ARG A 801 -7.053 -3.070 0.203 1.00 0.00 C ATOM 927 CG ARG A 801 -6.827 -3.823 1.497 1.00 0.00 C ATOM 928 CD ARG A 801 -5.408 -4.361 1.586 1.00 0.00 C ATOM 929 NE ARG A 801 -5.041 -4.726 2.951 1.00 0.00 N ATOM 930 CZ ARG A 801 -4.282 -3.974 3.747 1.00 0.00 C ATOM 931 NH1 ARG A 801 -3.834 -2.790 3.338 1.00 0.00 N ATOM 932 NH2 ARG A 801 -3.975 -4.405 4.963 1.00 0.00 N ATOM 0 H ARG A 801 -7.675 -4.636 -1.663 1.00 0.00 H new ATOM 0 HA ARG A 801 -9.165 -3.381 0.481 1.00 0.00 H new ATOM 0 HB2 ARG A 801 -6.344 -3.426 -0.545 1.00 0.00 H new ATOM 0 HB3 ARG A 801 -6.841 -2.013 0.364 1.00 0.00 H new ATOM 0 HG2 ARG A 801 -7.021 -3.163 2.342 1.00 0.00 H new ATOM 0 HG3 ARG A 801 -7.536 -4.648 1.568 1.00 0.00 H new ATOM 0 HD2 ARG A 801 -5.311 -5.233 0.940 1.00 0.00 H new ATOM 0 HD3 ARG A 801 -4.712 -3.609 1.213 1.00 0.00 H new ATOM 0 HE ARG A 801 -5.387 -5.612 3.318 1.00 0.00 H new ATOM 0 HH11 ARG A 801 -4.071 -2.449 2.406 1.00 0.00 H new ATOM 0 HH12 ARG A 801 -3.254 -2.223 3.956 1.00 0.00 H new ATOM 0 HH21 ARG A 801 -4.320 -5.309 5.286 1.00 0.00 H new ATOM 0 HH22 ARG A 801 -3.394 -3.832 5.576 1.00 0.00 H new ATOM 946 N GLU A 802 -9.016 -0.869 -0.289 1.00 0.00 N ATOM 947 CA GLU A 802 -9.389 0.434 -0.824 1.00 0.00 C ATOM 948 C GLU A 802 -8.460 1.508 -0.271 1.00 0.00 C ATOM 949 O GLU A 802 -8.175 1.529 0.920 1.00 0.00 O ATOM 950 CB GLU A 802 -10.840 0.761 -0.468 1.00 0.00 C ATOM 951 CG GLU A 802 -11.814 0.538 -1.612 1.00 0.00 C ATOM 952 CD GLU A 802 -13.153 1.209 -1.379 1.00 0.00 C ATOM 953 OE1 GLU A 802 -13.162 2.404 -1.014 1.00 0.00 O ATOM 954 OE2 GLU A 802 -14.192 0.541 -1.560 1.00 0.00 O ATOM 0 H GLU A 802 -8.874 -0.880 0.721 1.00 0.00 H new ATOM 0 HA GLU A 802 -9.295 0.407 -1.910 1.00 0.00 H new ATOM 0 HB2 GLU A 802 -11.144 0.148 0.381 1.00 0.00 H new ATOM 0 HB3 GLU A 802 -10.901 1.801 -0.148 1.00 0.00 H new ATOM 0 HG2 GLU A 802 -11.377 0.919 -2.535 1.00 0.00 H new ATOM 0 HG3 GLU A 802 -11.968 -0.532 -1.750 1.00 0.00 H new ATOM 961 N VAL A 803 -7.980 2.390 -1.137 1.00 0.00 N ATOM 962 CA VAL A 803 -7.071 3.449 -0.711 1.00 0.00 C ATOM 963 C VAL A 803 -7.807 4.578 0.000 1.00 0.00 C ATOM 964 O VAL A 803 -8.865 5.023 -0.444 1.00 0.00 O ATOM 965 CB VAL A 803 -6.299 4.042 -1.904 1.00 0.00 C ATOM 966 CG1 VAL A 803 -5.204 4.978 -1.415 1.00 0.00 C ATOM 967 CG2 VAL A 803 -5.722 2.935 -2.772 1.00 0.00 C ATOM 0 H VAL A 803 -8.202 2.395 -2.133 1.00 0.00 H new ATOM 0 HA VAL A 803 -6.371 2.985 -0.016 1.00 0.00 H new ATOM 0 HB VAL A 803 -6.993 4.620 -2.514 1.00 0.00 H new ATOM 0 HG11 VAL A 803 -4.668 5.389 -2.270 1.00 0.00 H new ATOM 0 HG12 VAL A 803 -5.649 5.791 -0.842 1.00 0.00 H new ATOM 0 HG13 VAL A 803 -4.509 4.426 -0.782 1.00 0.00 H new ATOM 0 HG21 VAL A 803 -5.180 3.374 -3.610 1.00 0.00 H new ATOM 0 HG22 VAL A 803 -5.040 2.325 -2.179 1.00 0.00 H new ATOM 0 HG23 VAL A 803 -6.531 2.311 -3.151 1.00 0.00 H new ATOM 977 N ILE A 804 -7.225 5.053 1.100 1.00 0.00 N ATOM 978 CA ILE A 804 -7.813 6.151 1.862 1.00 0.00 C ATOM 979 C ILE A 804 -7.014 7.432 1.656 1.00 0.00 C ATOM 980 O ILE A 804 -7.560 8.533 1.722 1.00 0.00 O ATOM 981 CB ILE A 804 -7.896 5.858 3.382 1.00 0.00 C ATOM 982 CG1 ILE A 804 -7.125 4.589 3.759 1.00 0.00 C ATOM 983 CG2 ILE A 804 -9.347 5.750 3.815 1.00 0.00 C ATOM 984 CD1 ILE A 804 -7.170 4.272 5.238 1.00 0.00 C ATOM 0 H ILE A 804 -6.349 4.695 1.482 1.00 0.00 H new ATOM 0 HA ILE A 804 -8.829 6.268 1.486 1.00 0.00 H new ATOM 0 HB ILE A 804 -7.429 6.690 3.908 1.00 0.00 H new ATOM 0 HG12 ILE A 804 -7.534 3.746 3.202 1.00 0.00 H new ATOM 0 HG13 ILE A 804 -6.085 4.700 3.451 1.00 0.00 H new ATOM 0 HG21 ILE A 804 -9.393 5.544 4.884 1.00 0.00 H new ATOM 0 HG22 ILE A 804 -9.861 6.688 3.604 1.00 0.00 H new ATOM 0 HG23 ILE A 804 -9.831 4.940 3.268 1.00 0.00 H new ATOM 0 HD11 ILE A 804 -6.604 3.361 5.432 1.00 0.00 H new ATOM 0 HD12 ILE A 804 -6.734 5.098 5.800 1.00 0.00 H new ATOM 0 HD13 ILE A 804 -8.205 4.129 5.548 1.00 0.00 H new ATOM 996 N ALA A 805 -5.716 7.282 1.411 1.00 0.00 N ATOM 997 CA ALA A 805 -4.845 8.430 1.203 1.00 0.00 C ATOM 998 C ALA A 805 -5.062 9.043 -0.181 1.00 0.00 C ATOM 999 O ALA A 805 -4.879 8.375 -1.198 1.00 0.00 O ATOM 1000 CB ALA A 805 -3.386 8.029 1.375 1.00 0.00 C ATOM 0 H ALA A 805 -5.246 6.378 1.352 1.00 0.00 H new ATOM 0 HA ALA A 805 -5.096 9.181 1.952 1.00 0.00 H new ATOM 0 HB1 ALA A 805 -2.748 8.899 1.216 1.00 0.00 H new ATOM 0 HB2 ALA A 805 -3.231 7.645 2.383 1.00 0.00 H new ATOM 0 HB3 ALA A 805 -3.133 7.256 0.649 1.00 0.00 H new ATOM 1006 N PRO A 806 -5.459 10.327 -0.240 1.00 0.00 N ATOM 1007 CA PRO A 806 -5.700 11.024 -1.508 1.00 0.00 C ATOM 1008 C PRO A 806 -4.550 10.879 -2.491 1.00 0.00 C ATOM 1009 O PRO A 806 -3.439 10.496 -2.122 1.00 0.00 O ATOM 1010 CB PRO A 806 -5.853 12.482 -1.086 1.00 0.00 C ATOM 1011 CG PRO A 806 -6.383 12.401 0.296 1.00 0.00 C ATOM 1012 CD PRO A 806 -5.709 11.208 0.917 1.00 0.00 C ATOM 0 HA PRO A 806 -6.566 10.617 -2.030 1.00 0.00 H new ATOM 0 HB2 PRO A 806 -4.899 13.009 -1.118 1.00 0.00 H new ATOM 0 HB3 PRO A 806 -6.536 13.019 -1.745 1.00 0.00 H new ATOM 0 HG2 PRO A 806 -6.163 13.311 0.854 1.00 0.00 H new ATOM 0 HG3 PRO A 806 -7.467 12.283 0.294 1.00 0.00 H new ATOM 0 HD2 PRO A 806 -4.783 11.485 1.421 1.00 0.00 H new ATOM 0 HD3 PRO A 806 -6.345 10.727 1.660 1.00 0.00 H new ATOM 1020 N ALA A 807 -4.833 11.190 -3.746 1.00 0.00 N ATOM 1021 CA ALA A 807 -3.834 11.102 -4.805 1.00 0.00 C ATOM 1022 C ALA A 807 -3.166 12.454 -5.046 1.00 0.00 C ATOM 1023 O ALA A 807 -3.801 13.501 -4.915 1.00 0.00 O ATOM 1024 CB ALA A 807 -4.469 10.586 -6.087 1.00 0.00 C ATOM 0 H ALA A 807 -5.750 11.507 -4.059 1.00 0.00 H new ATOM 0 HA ALA A 807 -3.064 10.400 -4.487 1.00 0.00 H new ATOM 0 HB1 ALA A 807 -3.712 10.525 -6.869 1.00 0.00 H new ATOM 0 HB2 ALA A 807 -4.890 9.596 -5.912 1.00 0.00 H new ATOM 0 HB3 ALA A 807 -5.261 11.266 -6.400 1.00 0.00 H new ATOM 1030 N PRO A 808 -1.869 12.451 -5.403 1.00 0.00 N ATOM 1031 CA PRO A 808 -1.118 13.686 -5.662 1.00 0.00 C ATOM 1032 C PRO A 808 -1.805 14.577 -6.692 1.00 0.00 C ATOM 1033 O PRO A 808 -1.877 14.237 -7.872 1.00 0.00 O ATOM 1034 CB PRO A 808 0.223 13.184 -6.203 1.00 0.00 C ATOM 1035 CG PRO A 808 0.360 11.804 -5.658 1.00 0.00 C ATOM 1036 CD PRO A 808 -1.033 11.250 -5.582 1.00 0.00 C ATOM 0 HA PRO A 808 -1.028 14.301 -4.766 1.00 0.00 H new ATOM 0 HB2 PRO A 808 0.234 13.182 -7.293 1.00 0.00 H new ATOM 0 HB3 PRO A 808 1.045 13.822 -5.877 1.00 0.00 H new ATOM 0 HG2 PRO A 808 0.989 11.190 -6.303 1.00 0.00 H new ATOM 0 HG3 PRO A 808 0.829 11.818 -4.674 1.00 0.00 H new ATOM 0 HD2 PRO A 808 -1.299 10.707 -6.489 1.00 0.00 H new ATOM 0 HD3 PRO A 808 -1.144 10.555 -4.750 1.00 0.00 H new ATOM 1044 N VAL A 809 -2.304 15.722 -6.236 1.00 0.00 N ATOM 1045 CA VAL A 809 -2.983 16.669 -7.113 1.00 0.00 C ATOM 1046 C VAL A 809 -4.302 16.102 -7.624 1.00 0.00 C ATOM 1047 O VAL A 809 -5.379 16.560 -7.240 1.00 0.00 O ATOM 1048 CB VAL A 809 -2.101 17.062 -8.313 1.00 0.00 C ATOM 1049 CG1 VAL A 809 -2.725 18.221 -9.072 1.00 0.00 C ATOM 1050 CG2 VAL A 809 -0.695 17.412 -7.851 1.00 0.00 C ATOM 0 H VAL A 809 -2.250 16.017 -5.261 1.00 0.00 H new ATOM 0 HA VAL A 809 -3.184 17.559 -6.517 1.00 0.00 H new ATOM 0 HB VAL A 809 -2.033 16.209 -8.988 1.00 0.00 H new ATOM 0 HG11 VAL A 809 -2.090 18.487 -9.917 1.00 0.00 H new ATOM 0 HG12 VAL A 809 -3.710 17.929 -9.436 1.00 0.00 H new ATOM 0 HG13 VAL A 809 -2.824 19.080 -8.408 1.00 0.00 H new ATOM 0 HG21 VAL A 809 -0.087 17.687 -8.713 1.00 0.00 H new ATOM 0 HG22 VAL A 809 -0.739 18.250 -7.155 1.00 0.00 H new ATOM 0 HG23 VAL A 809 -0.250 16.550 -7.353 1.00 0.00 H new ATOM 1060 N ARG A 810 -4.209 15.103 -8.491 1.00 0.00 N ATOM 1061 CA ARG A 810 -5.393 14.468 -9.059 1.00 0.00 C ATOM 1062 C ARG A 810 -5.180 12.968 -9.224 1.00 0.00 C ATOM 1063 O ARG A 810 -6.040 12.164 -8.866 1.00 0.00 O ATOM 1064 CB ARG A 810 -5.739 15.099 -10.409 1.00 0.00 C ATOM 1065 CG ARG A 810 -7.188 14.896 -10.820 1.00 0.00 C ATOM 1066 CD ARG A 810 -7.443 15.396 -12.232 1.00 0.00 C ATOM 1067 NE ARG A 810 -8.757 14.984 -12.727 1.00 0.00 N ATOM 1068 CZ ARG A 810 -9.644 15.812 -13.278 1.00 0.00 C ATOM 1069 NH1 ARG A 810 -9.369 17.103 -13.424 1.00 0.00 N ATOM 1070 NH2 ARG A 810 -10.814 15.344 -13.691 1.00 0.00 N ATOM 0 H ARG A 810 -3.325 14.713 -8.818 1.00 0.00 H new ATOM 0 HA ARG A 810 -6.223 14.624 -8.370 1.00 0.00 H new ATOM 0 HB2 ARG A 810 -5.528 16.168 -10.366 1.00 0.00 H new ATOM 0 HB3 ARG A 810 -5.090 14.676 -11.176 1.00 0.00 H new ATOM 0 HG2 ARG A 810 -7.440 13.837 -10.757 1.00 0.00 H new ATOM 0 HG3 ARG A 810 -7.842 15.421 -10.124 1.00 0.00 H new ATOM 0 HD2 ARG A 810 -7.373 16.484 -12.250 1.00 0.00 H new ATOM 0 HD3 ARG A 810 -6.668 15.015 -12.898 1.00 0.00 H new ATOM 0 HE ARG A 810 -9.010 13.999 -12.645 1.00 0.00 H new ATOM 0 HH11 ARG A 810 -8.470 17.471 -13.113 1.00 0.00 H new ATOM 0 HH12 ARG A 810 -10.057 17.726 -13.847 1.00 0.00 H new ATOM 0 HH21 ARG A 810 -11.033 14.353 -13.586 1.00 0.00 H new ATOM 0 HH22 ARG A 810 -11.495 15.975 -14.113 1.00 0.00 H new ATOM 1084 N ASP A 811 -4.029 12.601 -9.771 1.00 0.00 N ATOM 1085 CA ASP A 811 -3.696 11.198 -9.987 1.00 0.00 C ATOM 1086 C ASP A 811 -2.451 10.806 -9.197 1.00 0.00 C ATOM 1087 O ASP A 811 -1.371 11.369 -9.479 1.00 0.00 O ATOM 1088 CB ASP A 811 -3.478 10.928 -11.479 1.00 0.00 C ATOM 1089 CG ASP A 811 -4.461 9.915 -12.033 1.00 0.00 C ATOM 1090 OD1 ASP A 811 -5.677 10.082 -11.804 1.00 0.00 O ATOM 1091 OD2 ASP A 811 -4.014 8.955 -12.695 1.00 0.00 O ATOM 1092 OXT ASP A 811 -2.566 9.943 -8.302 1.00 0.00 O ATOM 0 H ASP A 811 -3.308 13.256 -10.074 1.00 0.00 H new ATOM 0 HA ASP A 811 -4.531 10.593 -9.635 1.00 0.00 H new ATOM 0 HB2 ASP A 811 -3.573 11.862 -12.032 1.00 0.00 H new ATOM 0 HB3 ASP A 811 -2.462 10.567 -11.635 1.00 0.00 H new TER 1097 ASP A 811