USER MOD reduce.3.24.130724 H: found=0, std=0, add=803, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 804 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 59 GLN : amide:sc= -2.97! C(o=-3!,f=-3.6!) USER MOD Set 1.2: A 63 ASN : amide:sc= -0.0375 X(o=-3,f=-3.1) USER MOD Set 2.1: A 44 ASN : amide:sc= -3.3! C(o=-3.2!,f=-4.2!) USER MOD Set 2.2: A 57 THR OG1 : rot -39:sc= 0.0869 USER MOD Single : A 1 MET CE :methyl -148:sc= -0.0467 (180deg=-0.894) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot -113:sc= 0.163! USER MOD Single : A 8 SER OG : rot -144:sc= -0.715 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 130:sc= -1.94! USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 MET CE :methyl -173:sc= -2.4 (180deg=-2.46) USER MOD Single : A 31 MET CE :methyl -107:sc=-0.00952 (180deg=-2.11!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 149:sc= -0.155 (180deg=-0.883) USER MOD Single : A 35 ASN : amide:sc= -0.297 X(o=-0.3,f=-0.014) USER MOD Single : A 38 SER OG : rot 160:sc= -1.79! USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot -64:sc= 0.074 USER MOD Single : A 73 SER OG : rot 108:sc= 1.21 USER MOD Single : A 77 ASN : amide:sc= -0.413 K(o=-0.41,f=-2.4!) USER MOD Single : A 83 ASN : amide:sc= -1.39 K(o=-1.4,f=-2.8!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 TYR OH : rot 168:sc= -0.969 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot -14:sc= 0.722 USER MOD Single : A 96 SER OG : rot 180:sc= -0.0427 USER MOD Single : A 100 ASN :FLIP amide:sc= 0.00446 F(o=-1.1,f=0.0045) USER MOD Single : A 102 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0134) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc=-0.00452 K(o=-0.0045,f=-1.6) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.691 2.783 -4.169 1.00 0.00 N ATOM 2 CA MET A 1 8.196 1.487 -4.714 1.00 0.00 C ATOM 3 C MET A 1 6.984 1.022 -3.904 1.00 0.00 C ATOM 4 O MET A 1 7.071 0.108 -3.108 1.00 0.00 O ATOM 5 CB MET A 1 9.307 0.438 -4.622 1.00 0.00 C ATOM 6 CG MET A 1 9.018 -0.701 -5.600 1.00 0.00 C ATOM 7 SD MET A 1 9.137 -2.287 -4.733 1.00 0.00 S ATOM 8 CE MET A 1 10.861 -2.128 -4.206 1.00 0.00 C ATOM 0 H1 MET A 1 9.515 3.099 -4.719 1.00 0.00 H new ATOM 0 H2 MET A 1 7.937 3.497 -4.233 1.00 0.00 H new ATOM 0 H3 MET A 1 8.967 2.659 -3.174 1.00 0.00 H new ATOM 0 HA MET A 1 7.906 1.618 -5.757 1.00 0.00 H new ATOM 0 HB2 MET A 1 10.271 0.893 -4.852 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.372 0.050 -3.605 1.00 0.00 H new ATOM 0 HG2 MET A 1 8.023 -0.583 -6.029 1.00 0.00 H new ATOM 0 HG3 MET A 1 9.727 -0.673 -6.427 1.00 0.00 H new ATOM 0 HE1 MET A 1 11.324 -3.114 -4.173 1.00 0.00 H new ATOM 0 HE2 MET A 1 11.401 -1.498 -4.913 1.00 0.00 H new ATOM 0 HE3 MET A 1 10.898 -1.676 -3.215 1.00 0.00 H new ATOM 20 N LYS A 2 5.853 1.644 -4.098 1.00 0.00 N ATOM 21 CA LYS A 2 4.638 1.235 -3.336 1.00 0.00 C ATOM 22 C LYS A 2 3.594 0.666 -4.301 1.00 0.00 C ATOM 23 O LYS A 2 3.676 0.851 -5.499 1.00 0.00 O ATOM 24 CB LYS A 2 4.055 2.452 -2.614 1.00 0.00 C ATOM 25 CG LYS A 2 4.650 2.544 -1.207 1.00 0.00 C ATOM 26 CD LYS A 2 5.826 3.525 -1.210 1.00 0.00 C ATOM 27 CE LYS A 2 5.298 4.957 -1.113 1.00 0.00 C ATOM 28 NZ LYS A 2 6.444 5.909 -1.082 1.00 0.00 N ATOM 0 H LYS A 2 5.717 2.417 -4.750 1.00 0.00 H new ATOM 0 HA LYS A 2 4.909 0.473 -2.605 1.00 0.00 H new ATOM 0 HB2 LYS A 2 4.276 3.361 -3.174 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.970 2.369 -2.557 1.00 0.00 H new ATOM 0 HG2 LYS A 2 3.889 2.875 -0.500 1.00 0.00 H new ATOM 0 HG3 LYS A 2 4.985 1.560 -0.878 1.00 0.00 H new ATOM 0 HD2 LYS A 2 6.491 3.314 -0.373 1.00 0.00 H new ATOM 0 HD3 LYS A 2 6.412 3.403 -2.121 1.00 0.00 H new ATOM 0 HE2 LYS A 2 4.653 5.176 -1.964 1.00 0.00 H new ATOM 0 HE3 LYS A 2 4.692 5.072 -0.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 6.085 6.883 -1.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 7.043 5.704 -0.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 7.005 5.805 -1.951 1.00 0.00 H new ATOM 42 N ILE A 3 2.613 -0.027 -3.787 1.00 0.00 N ATOM 43 CA ILE A 3 1.568 -0.608 -4.675 1.00 0.00 C ATOM 44 C ILE A 3 0.180 -0.281 -4.119 1.00 0.00 C ATOM 45 O ILE A 3 -0.073 -0.401 -2.936 1.00 0.00 O ATOM 46 CB ILE A 3 1.743 -2.127 -4.743 1.00 0.00 C ATOM 47 CG1 ILE A 3 3.141 -2.457 -5.270 1.00 0.00 C ATOM 48 CG2 ILE A 3 0.693 -2.722 -5.684 1.00 0.00 C ATOM 49 CD1 ILE A 3 3.651 -3.732 -4.596 1.00 0.00 C ATOM 0 H ILE A 3 2.491 -0.215 -2.792 1.00 0.00 H new ATOM 0 HA ILE A 3 1.667 -0.184 -5.674 1.00 0.00 H new ATOM 0 HB ILE A 3 1.620 -2.550 -3.746 1.00 0.00 H new ATOM 0 HG12 ILE A 3 3.112 -2.591 -6.351 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.822 -1.630 -5.070 1.00 0.00 H new ATOM 0 HG21 ILE A 3 0.818 -3.804 -5.732 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.304 -2.488 -5.311 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.816 -2.298 -6.681 1.00 0.00 H new ATOM 0 HD11 ILE A 3 4.647 -3.968 -4.971 1.00 0.00 H new ATOM 0 HD12 ILE A 3 3.695 -3.581 -3.517 1.00 0.00 H new ATOM 0 HD13 ILE A 3 2.974 -4.557 -4.819 1.00 0.00 H new ATOM 61 N ALA A 4 -0.722 0.123 -4.969 1.00 0.00 N ATOM 62 CA ALA A 4 -2.097 0.450 -4.502 1.00 0.00 C ATOM 63 C ALA A 4 -3.099 -0.402 -5.283 1.00 0.00 C ATOM 64 O ALA A 4 -3.054 -0.471 -6.494 1.00 0.00 O ATOM 65 CB ALA A 4 -2.382 1.934 -4.745 1.00 0.00 C ATOM 0 H ALA A 4 -0.565 0.241 -5.970 1.00 0.00 H new ATOM 0 HA ALA A 4 -2.186 0.241 -3.436 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -3.389 2.172 -4.403 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -1.660 2.538 -4.196 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -2.300 2.151 -5.810 1.00 0.00 H new ATOM 71 N ILE A 5 -3.996 -1.060 -4.602 1.00 0.00 N ATOM 72 CA ILE A 5 -4.986 -1.914 -5.315 1.00 0.00 C ATOM 73 C ILE A 5 -6.381 -1.298 -5.202 1.00 0.00 C ATOM 74 O ILE A 5 -6.902 -1.106 -4.121 1.00 0.00 O ATOM 75 CB ILE A 5 -4.994 -3.310 -4.689 1.00 0.00 C ATOM 76 CG1 ILE A 5 -3.586 -3.906 -4.764 1.00 0.00 C ATOM 77 CG2 ILE A 5 -5.968 -4.208 -5.453 1.00 0.00 C ATOM 78 CD1 ILE A 5 -3.270 -4.635 -3.456 1.00 0.00 C ATOM 0 H ILE A 5 -4.086 -1.043 -3.586 1.00 0.00 H new ATOM 0 HA ILE A 5 -4.710 -1.984 -6.367 1.00 0.00 H new ATOM 0 HB ILE A 5 -5.307 -3.240 -3.647 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -3.516 -4.597 -5.604 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -2.854 -3.117 -4.939 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -5.973 -5.202 -5.006 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -6.970 -3.783 -5.403 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -5.656 -4.280 -6.495 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -2.267 -5.060 -3.509 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -3.323 -3.931 -2.625 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -3.995 -5.434 -3.301 1.00 0.00 H new ATOM 90 N ALA A 6 -6.993 -0.990 -6.314 1.00 0.00 N ATOM 91 CA ALA A 6 -8.357 -0.389 -6.271 1.00 0.00 C ATOM 92 C ALA A 6 -9.374 -1.466 -5.887 1.00 0.00 C ATOM 93 O ALA A 6 -9.089 -2.646 -5.929 1.00 0.00 O ATOM 94 CB ALA A 6 -8.710 0.176 -7.649 1.00 0.00 C ATOM 0 H ALA A 6 -6.608 -1.128 -7.248 1.00 0.00 H new ATOM 0 HA ALA A 6 -8.378 0.413 -5.533 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -9.707 0.615 -7.618 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -7.985 0.941 -7.925 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -8.690 -0.626 -8.387 1.00 0.00 H new ATOM 100 N SER A 7 -10.561 -1.069 -5.514 1.00 0.00 N ATOM 101 CA SER A 7 -11.595 -2.071 -5.129 1.00 0.00 C ATOM 102 C SER A 7 -11.208 -2.718 -3.796 1.00 0.00 C ATOM 103 O SER A 7 -10.654 -2.076 -2.924 1.00 0.00 O ATOM 104 CB SER A 7 -11.693 -3.144 -6.214 1.00 0.00 C ATOM 105 OG SER A 7 -11.216 -2.614 -7.443 1.00 0.00 O ATOM 0 H SER A 7 -10.859 -0.095 -5.459 1.00 0.00 H new ATOM 0 HA SER A 7 -12.561 -1.577 -5.022 1.00 0.00 H new ATOM 0 HB2 SER A 7 -11.108 -4.019 -5.930 1.00 0.00 H new ATOM 0 HB3 SER A 7 -12.726 -3.474 -6.323 1.00 0.00 H new ATOM 0 HG SER A 7 -11.959 -2.540 -8.078 1.00 0.00 H new ATOM 111 N SER A 8 -11.495 -3.982 -3.626 1.00 0.00 N ATOM 112 CA SER A 8 -11.144 -4.663 -2.349 1.00 0.00 C ATOM 113 C SER A 8 -12.148 -4.265 -1.263 1.00 0.00 C ATOM 114 O SER A 8 -12.027 -4.655 -0.119 1.00 0.00 O ATOM 115 CB SER A 8 -9.736 -4.250 -1.917 1.00 0.00 C ATOM 116 OG SER A 8 -9.031 -5.394 -1.455 1.00 0.00 O ATOM 0 H SER A 8 -11.958 -4.571 -4.318 1.00 0.00 H new ATOM 0 HA SER A 8 -11.176 -5.743 -2.496 1.00 0.00 H new ATOM 0 HB2 SER A 8 -9.205 -3.795 -2.754 1.00 0.00 H new ATOM 0 HB3 SER A 8 -9.791 -3.500 -1.128 1.00 0.00 H new ATOM 0 HG SER A 8 -8.444 -5.139 -0.712 1.00 0.00 H new ATOM 122 N GLY A 9 -13.141 -3.493 -1.613 1.00 0.00 N ATOM 123 CA GLY A 9 -14.151 -3.073 -0.600 1.00 0.00 C ATOM 124 C GLY A 9 -13.441 -2.602 0.670 1.00 0.00 C ATOM 125 O GLY A 9 -12.756 -1.599 0.674 1.00 0.00 O ATOM 0 H GLY A 9 -13.296 -3.135 -2.556 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -14.771 -2.271 -1.001 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -14.817 -3.905 -0.369 1.00 0.00 H new ATOM 129 N THR A 10 -13.599 -3.317 1.749 1.00 0.00 N ATOM 130 CA THR A 10 -12.933 -2.904 3.018 1.00 0.00 C ATOM 131 C THR A 10 -12.082 -4.061 3.548 1.00 0.00 C ATOM 132 O THR A 10 -11.363 -3.920 4.518 1.00 0.00 O ATOM 133 CB THR A 10 -13.998 -2.536 4.054 1.00 0.00 C ATOM 134 OG1 THR A 10 -15.256 -3.050 3.640 1.00 0.00 O ATOM 135 CG2 THR A 10 -14.084 -1.015 4.180 1.00 0.00 C ATOM 0 H THR A 10 -14.159 -4.168 1.808 1.00 0.00 H new ATOM 0 HA THR A 10 -12.294 -2.041 2.830 1.00 0.00 H new ATOM 0 HB THR A 10 -13.730 -2.964 5.020 1.00 0.00 H new ATOM 0 HG1 THR A 10 -15.939 -2.817 4.303 1.00 0.00 H new ATOM 0 HG21 THR A 10 -14.842 -0.753 4.918 1.00 0.00 H new ATOM 0 HG22 THR A 10 -13.118 -0.621 4.497 1.00 0.00 H new ATOM 0 HG23 THR A 10 -14.353 -0.585 3.215 1.00 0.00 H new ATOM 143 N ASP A 11 -12.157 -5.202 2.922 1.00 0.00 N ATOM 144 CA ASP A 11 -11.353 -6.364 3.393 1.00 0.00 C ATOM 145 C ASP A 11 -10.821 -7.142 2.183 1.00 0.00 C ATOM 146 O ASP A 11 -10.446 -6.564 1.183 1.00 0.00 O ATOM 147 CB ASP A 11 -12.236 -7.273 4.251 1.00 0.00 C ATOM 148 CG ASP A 11 -13.026 -6.422 5.248 1.00 0.00 C ATOM 149 OD1 ASP A 11 -12.410 -5.872 6.146 1.00 0.00 O ATOM 150 OD2 ASP A 11 -14.234 -6.336 5.095 1.00 0.00 O ATOM 0 H ASP A 11 -12.740 -5.380 2.104 1.00 0.00 H new ATOM 0 HA ASP A 11 -10.511 -6.013 3.989 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -12.919 -7.838 3.617 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -11.621 -7.999 4.783 1.00 0.00 H new ATOM 155 N LEU A 12 -10.782 -8.446 2.264 1.00 0.00 N ATOM 156 CA LEU A 12 -10.270 -9.245 1.114 1.00 0.00 C ATOM 157 C LEU A 12 -11.439 -9.909 0.385 1.00 0.00 C ATOM 158 O LEU A 12 -11.316 -10.333 -0.748 1.00 0.00 O ATOM 159 CB LEU A 12 -9.314 -10.322 1.630 1.00 0.00 C ATOM 160 CG LEU A 12 -8.093 -9.659 2.271 1.00 0.00 C ATOM 161 CD1 LEU A 12 -7.869 -10.243 3.667 1.00 0.00 C ATOM 162 CD2 LEU A 12 -6.857 -9.922 1.404 1.00 0.00 C ATOM 0 H LEU A 12 -11.081 -8.990 3.073 1.00 0.00 H new ATOM 0 HA LEU A 12 -9.742 -8.587 0.424 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -9.821 -10.954 2.358 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -9.001 -10.968 0.810 1.00 0.00 H new ATOM 0 HG LEU A 12 -8.262 -8.585 2.349 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -6.999 -9.771 4.124 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -8.748 -10.058 4.284 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -7.700 -11.317 3.589 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -5.986 -9.450 1.859 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -6.689 -10.996 1.326 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.016 -9.507 0.409 1.00 0.00 H new ATOM 174 N GLY A 13 -12.572 -10.008 1.023 1.00 0.00 N ATOM 175 CA GLY A 13 -13.746 -10.649 0.362 1.00 0.00 C ATOM 176 C GLY A 13 -13.918 -10.076 -1.047 1.00 0.00 C ATOM 177 O GLY A 13 -14.218 -10.788 -1.984 1.00 0.00 O ATOM 0 H GLY A 13 -12.737 -9.674 1.972 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -13.603 -11.728 0.312 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -14.647 -10.474 0.949 1.00 0.00 H new ATOM 181 N SER A 14 -13.730 -8.794 -1.203 1.00 0.00 N ATOM 182 CA SER A 14 -13.887 -8.176 -2.550 1.00 0.00 C ATOM 183 C SER A 14 -12.672 -8.515 -3.416 1.00 0.00 C ATOM 184 O SER A 14 -11.759 -7.727 -3.558 1.00 0.00 O ATOM 185 CB SER A 14 -14.001 -6.659 -2.402 1.00 0.00 C ATOM 186 OG SER A 14 -15.350 -6.315 -2.116 1.00 0.00 O ATOM 0 H SER A 14 -13.475 -8.148 -0.456 1.00 0.00 H new ATOM 0 HA SER A 14 -14.788 -8.565 -3.025 1.00 0.00 H new ATOM 0 HB2 SER A 14 -13.347 -6.310 -1.603 1.00 0.00 H new ATOM 0 HB3 SER A 14 -13.675 -6.167 -3.318 1.00 0.00 H new ATOM 0 HG SER A 14 -15.426 -5.343 -2.019 1.00 0.00 H new ATOM 192 N GLU A 15 -12.655 -9.684 -3.998 1.00 0.00 N ATOM 193 CA GLU A 15 -11.502 -10.075 -4.857 1.00 0.00 C ATOM 194 C GLU A 15 -11.184 -8.941 -5.835 1.00 0.00 C ATOM 195 O GLU A 15 -10.440 -8.032 -5.524 1.00 0.00 O ATOM 196 CB GLU A 15 -11.851 -11.346 -5.639 1.00 0.00 C ATOM 197 CG GLU A 15 -13.351 -11.367 -5.947 1.00 0.00 C ATOM 198 CD GLU A 15 -13.589 -12.075 -7.282 1.00 0.00 C ATOM 199 OE1 GLU A 15 -13.157 -11.550 -8.295 1.00 0.00 O ATOM 200 OE2 GLU A 15 -14.200 -13.130 -7.270 1.00 0.00 O ATOM 0 H GLU A 15 -13.391 -10.385 -3.915 1.00 0.00 H new ATOM 0 HA GLU A 15 -10.632 -10.266 -4.229 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -11.279 -11.383 -6.566 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -11.576 -12.228 -5.060 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -13.889 -11.880 -5.150 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -13.739 -10.349 -5.989 1.00 0.00 H new ATOM 207 N VAL A 16 -11.738 -8.984 -7.017 1.00 0.00 N ATOM 208 CA VAL A 16 -11.459 -7.904 -8.006 1.00 0.00 C ATOM 209 C VAL A 16 -12.775 -7.395 -8.600 1.00 0.00 C ATOM 210 O VAL A 16 -12.945 -7.339 -9.801 1.00 0.00 O ATOM 211 CB VAL A 16 -10.574 -8.456 -9.127 1.00 0.00 C ATOM 212 CG1 VAL A 16 -9.185 -8.777 -8.570 1.00 0.00 C ATOM 213 CG2 VAL A 16 -11.203 -9.731 -9.692 1.00 0.00 C ATOM 0 H VAL A 16 -12.369 -9.717 -7.339 1.00 0.00 H new ATOM 0 HA VAL A 16 -10.947 -7.082 -7.507 1.00 0.00 H new ATOM 0 HB VAL A 16 -10.485 -7.712 -9.919 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -8.555 -9.170 -9.368 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -8.736 -7.869 -8.167 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -9.274 -9.521 -7.778 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -10.573 -10.124 -10.490 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -11.292 -10.475 -8.900 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -12.192 -9.504 -10.089 1.00 0.00 H new ATOM 223 N SER A 17 -13.707 -7.017 -7.767 1.00 0.00 N ATOM 224 CA SER A 17 -15.007 -6.506 -8.286 1.00 0.00 C ATOM 225 C SER A 17 -14.994 -4.975 -8.261 1.00 0.00 C ATOM 226 O SER A 17 -14.550 -4.366 -7.309 1.00 0.00 O ATOM 227 CB SER A 17 -16.148 -7.021 -7.407 1.00 0.00 C ATOM 228 OG SER A 17 -16.466 -6.041 -6.428 1.00 0.00 O ATOM 0 H SER A 17 -13.624 -7.040 -6.751 1.00 0.00 H new ATOM 0 HA SER A 17 -15.154 -6.855 -9.308 1.00 0.00 H new ATOM 0 HB2 SER A 17 -17.024 -7.238 -8.018 1.00 0.00 H new ATOM 0 HB3 SER A 17 -15.857 -7.954 -6.924 1.00 0.00 H new ATOM 0 HG SER A 17 -17.433 -5.881 -6.428 1.00 0.00 H new ATOM 234 N ARG A 18 -15.470 -4.349 -9.302 1.00 0.00 N ATOM 235 CA ARG A 18 -15.474 -2.860 -9.333 1.00 0.00 C ATOM 236 C ARG A 18 -14.052 -2.366 -9.600 1.00 0.00 C ATOM 237 O ARG A 18 -13.349 -1.947 -8.701 1.00 0.00 O ATOM 238 CB ARG A 18 -15.964 -2.320 -7.987 1.00 0.00 C ATOM 239 CG ARG A 18 -17.092 -3.209 -7.462 1.00 0.00 C ATOM 240 CD ARG A 18 -18.054 -2.369 -6.621 1.00 0.00 C ATOM 241 NE ARG A 18 -19.335 -3.109 -6.445 1.00 0.00 N ATOM 242 CZ ARG A 18 -20.421 -2.681 -7.026 1.00 0.00 C ATOM 243 NH1 ARG A 18 -20.863 -1.478 -6.776 1.00 0.00 N ATOM 244 NH2 ARG A 18 -21.064 -3.453 -7.859 1.00 0.00 N ATOM 0 H ARG A 18 -15.855 -4.803 -10.130 1.00 0.00 H new ATOM 0 HA ARG A 18 -16.140 -2.508 -10.121 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -15.142 -2.296 -7.271 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -16.317 -1.295 -8.101 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -17.625 -3.668 -8.295 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -16.681 -4.020 -6.862 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -17.610 -2.152 -5.649 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -18.239 -1.411 -7.108 1.00 0.00 H new ATOM 0 HE ARG A 18 -19.363 -3.951 -5.870 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -20.359 -0.874 -6.127 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -21.712 -1.142 -7.230 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -20.717 -4.392 -8.056 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -21.913 -3.118 -8.313 1.00 0.00 H new ATOM 258 N PHE A 19 -13.621 -2.419 -10.829 1.00 0.00 N ATOM 259 CA PHE A 19 -12.238 -1.961 -11.155 1.00 0.00 C ATOM 260 C PHE A 19 -12.209 -0.434 -11.246 1.00 0.00 C ATOM 261 O PHE A 19 -13.200 0.230 -11.013 1.00 0.00 O ATOM 262 CB PHE A 19 -11.787 -2.562 -12.492 1.00 0.00 C ATOM 263 CG PHE A 19 -12.951 -2.623 -13.453 1.00 0.00 C ATOM 264 CD1 PHE A 19 -13.615 -1.447 -13.826 1.00 0.00 C ATOM 265 CD2 PHE A 19 -13.368 -3.857 -13.970 1.00 0.00 C ATOM 266 CE1 PHE A 19 -14.695 -1.504 -14.716 1.00 0.00 C ATOM 267 CE2 PHE A 19 -14.449 -3.914 -14.861 1.00 0.00 C ATOM 268 CZ PHE A 19 -15.111 -2.739 -15.234 1.00 0.00 C ATOM 0 H PHE A 19 -14.164 -2.759 -11.622 1.00 0.00 H new ATOM 0 HA PHE A 19 -11.561 -2.292 -10.368 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -10.985 -1.960 -12.918 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -11.384 -3.562 -12.333 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -13.294 -0.496 -13.427 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -12.857 -4.764 -13.682 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -15.207 -0.597 -15.003 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -14.771 -4.865 -15.259 1.00 0.00 H new ATOM 0 HZ PHE A 19 -15.943 -2.783 -15.921 1.00 0.00 H new ATOM 278 N PHE A 20 -11.075 0.125 -11.575 1.00 0.00 N ATOM 279 CA PHE A 20 -10.967 1.609 -11.676 1.00 0.00 C ATOM 280 C PHE A 20 -12.216 2.175 -12.354 1.00 0.00 C ATOM 281 O PHE A 20 -12.710 1.633 -13.322 1.00 0.00 O ATOM 282 CB PHE A 20 -9.731 1.970 -12.503 1.00 0.00 C ATOM 283 CG PHE A 20 -9.270 3.365 -12.151 1.00 0.00 C ATOM 284 CD1 PHE A 20 -9.209 3.771 -10.811 1.00 0.00 C ATOM 285 CD2 PHE A 20 -8.900 4.255 -13.168 1.00 0.00 C ATOM 286 CE1 PHE A 20 -8.779 5.065 -10.489 1.00 0.00 C ATOM 287 CE2 PHE A 20 -8.470 5.549 -12.846 1.00 0.00 C ATOM 288 CZ PHE A 20 -8.410 5.953 -11.507 1.00 0.00 C ATOM 0 H PHE A 20 -10.215 -0.385 -11.779 1.00 0.00 H new ATOM 0 HA PHE A 20 -10.878 2.034 -10.676 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -8.932 1.254 -12.311 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -9.964 1.911 -13.566 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -9.494 3.086 -10.026 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -8.946 3.943 -14.201 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -8.732 5.377 -9.456 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -8.185 6.234 -13.630 1.00 0.00 H new ATOM 0 HZ PHE A 20 -8.079 6.951 -11.259 1.00 0.00 H new ATOM 298 N GLY A 21 -12.731 3.264 -11.850 1.00 0.00 N ATOM 299 CA GLY A 21 -13.948 3.866 -12.464 1.00 0.00 C ATOM 300 C GLY A 21 -14.749 4.611 -11.395 1.00 0.00 C ATOM 301 O GLY A 21 -14.909 5.814 -11.452 1.00 0.00 O ATOM 0 H GLY A 21 -12.361 3.762 -11.040 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -13.663 4.551 -13.263 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -14.562 3.087 -12.916 1.00 0.00 H new ATOM 305 N ARG A 22 -15.257 3.907 -10.418 1.00 0.00 N ATOM 306 CA ARG A 22 -16.049 4.582 -9.351 1.00 0.00 C ATOM 307 C ARG A 22 -16.004 3.750 -8.067 1.00 0.00 C ATOM 308 O ARG A 22 -16.828 3.910 -7.190 1.00 0.00 O ATOM 309 CB ARG A 22 -17.502 4.725 -9.812 1.00 0.00 C ATOM 310 CG ARG A 22 -18.088 6.025 -9.261 1.00 0.00 C ATOM 311 CD ARG A 22 -17.773 7.173 -10.221 1.00 0.00 C ATOM 312 NE ARG A 22 -18.955 7.436 -11.088 1.00 0.00 N ATOM 313 CZ ARG A 22 -18.907 8.377 -11.989 1.00 0.00 C ATOM 314 NH1 ARG A 22 -18.027 8.316 -12.950 1.00 0.00 N ATOM 315 NH2 ARG A 22 -19.740 9.380 -11.931 1.00 0.00 N ATOM 0 H ARG A 22 -15.158 2.897 -10.314 1.00 0.00 H new ATOM 0 HA ARG A 22 -15.625 5.567 -9.157 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -17.551 4.725 -10.901 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -18.089 3.874 -9.467 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -19.166 5.926 -9.136 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -17.671 6.236 -8.276 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -17.515 8.070 -9.659 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -16.908 6.921 -10.834 1.00 0.00 H new ATOM 0 HE ARG A 22 -19.803 6.880 -10.977 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -17.376 7.532 -12.997 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -17.990 9.052 -13.655 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -20.429 9.428 -11.180 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -19.702 10.116 -12.636 1.00 0.00 H new ATOM 329 N ALA A 23 -15.052 2.865 -7.949 1.00 0.00 N ATOM 330 CA ALA A 23 -14.961 2.025 -6.718 1.00 0.00 C ATOM 331 C ALA A 23 -14.512 2.892 -5.533 1.00 0.00 C ATOM 332 O ALA A 23 -13.395 3.373 -5.518 1.00 0.00 O ATOM 333 CB ALA A 23 -13.938 0.910 -6.943 1.00 0.00 C ATOM 0 H ALA A 23 -14.333 2.686 -8.650 1.00 0.00 H new ATOM 0 HA ALA A 23 -15.938 1.593 -6.501 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -13.868 0.294 -6.047 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -14.252 0.292 -7.784 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -12.964 1.348 -7.159 1.00 0.00 H new ATOM 339 N PRO A 24 -15.391 3.069 -4.576 1.00 0.00 N ATOM 340 CA PRO A 24 -15.106 3.875 -3.374 1.00 0.00 C ATOM 341 C PRO A 24 -14.332 3.044 -2.342 1.00 0.00 C ATOM 342 O PRO A 24 -14.733 2.934 -1.200 1.00 0.00 O ATOM 343 CB PRO A 24 -16.497 4.225 -2.842 1.00 0.00 C ATOM 344 CG PRO A 24 -17.463 3.153 -3.404 1.00 0.00 C ATOM 345 CD PRO A 24 -16.752 2.495 -4.600 1.00 0.00 C ATOM 0 HA PRO A 24 -14.495 4.753 -3.584 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -16.507 4.224 -1.752 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -16.796 5.223 -3.163 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -17.703 2.412 -2.642 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -18.404 3.606 -3.716 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -16.728 1.410 -4.501 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -17.261 2.718 -5.538 1.00 0.00 H new ATOM 353 N TYR A 25 -13.231 2.459 -2.731 1.00 0.00 N ATOM 354 CA TYR A 25 -12.444 1.639 -1.767 1.00 0.00 C ATOM 355 C TYR A 25 -11.009 1.491 -2.275 1.00 0.00 C ATOM 356 O TYR A 25 -10.593 0.428 -2.694 1.00 0.00 O ATOM 357 CB TYR A 25 -13.081 0.253 -1.639 1.00 0.00 C ATOM 358 CG TYR A 25 -14.468 0.385 -1.056 1.00 0.00 C ATOM 359 CD1 TYR A 25 -14.643 0.425 0.333 1.00 0.00 C ATOM 360 CD2 TYR A 25 -15.579 0.469 -1.905 1.00 0.00 C ATOM 361 CE1 TYR A 25 -15.930 0.547 0.873 1.00 0.00 C ATOM 362 CE2 TYR A 25 -16.866 0.592 -1.365 1.00 0.00 C ATOM 363 CZ TYR A 25 -17.041 0.631 0.024 1.00 0.00 C ATOM 364 OH TYR A 25 -18.309 0.752 0.556 1.00 0.00 O ATOM 0 H TYR A 25 -12.844 2.514 -3.673 1.00 0.00 H new ATOM 0 HA TYR A 25 -12.438 2.130 -0.794 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -13.130 -0.227 -2.616 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -12.467 -0.383 -1.002 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -13.786 0.362 0.988 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -15.444 0.439 -2.976 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -16.066 0.576 1.944 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -17.723 0.657 -2.020 1.00 0.00 H new ATOM 0 HH TYR A 25 -18.965 0.799 -0.170 1.00 0.00 H new ATOM 374 N PHE A 26 -10.246 2.550 -2.241 1.00 0.00 N ATOM 375 CA PHE A 26 -8.837 2.468 -2.722 1.00 0.00 C ATOM 376 C PHE A 26 -7.944 1.932 -1.601 1.00 0.00 C ATOM 377 O PHE A 26 -7.828 2.527 -0.548 1.00 0.00 O ATOM 378 CB PHE A 26 -8.360 3.861 -3.135 1.00 0.00 C ATOM 379 CG PHE A 26 -9.037 4.261 -4.424 1.00 0.00 C ATOM 380 CD1 PHE A 26 -10.414 4.523 -4.441 1.00 0.00 C ATOM 381 CD2 PHE A 26 -8.289 4.368 -5.603 1.00 0.00 C ATOM 382 CE1 PHE A 26 -11.041 4.890 -5.639 1.00 0.00 C ATOM 383 CE2 PHE A 26 -8.916 4.737 -6.800 1.00 0.00 C ATOM 384 CZ PHE A 26 -10.292 4.998 -6.817 1.00 0.00 C ATOM 0 H PHE A 26 -10.537 3.467 -1.902 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.783 1.796 -3.579 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.589 4.583 -2.351 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -7.278 3.864 -3.264 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -10.991 4.442 -3.532 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -7.228 4.166 -5.589 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -12.102 5.090 -5.654 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -8.339 4.820 -7.709 1.00 0.00 H new ATOM 0 HZ PHE A 26 -10.776 5.283 -7.740 1.00 0.00 H new ATOM 394 N MET A 27 -7.310 0.812 -1.819 1.00 0.00 N ATOM 395 CA MET A 27 -6.425 0.239 -0.766 1.00 0.00 C ATOM 396 C MET A 27 -4.986 0.707 -0.992 1.00 0.00 C ATOM 397 O MET A 27 -4.408 0.485 -2.037 1.00 0.00 O ATOM 398 CB MET A 27 -6.477 -1.290 -0.829 1.00 0.00 C ATOM 399 CG MET A 27 -7.884 -1.770 -0.467 1.00 0.00 C ATOM 400 SD MET A 27 -7.766 -3.195 0.643 1.00 0.00 S ATOM 401 CE MET A 27 -8.519 -2.417 2.092 1.00 0.00 C ATOM 0 H MET A 27 -7.367 0.269 -2.681 1.00 0.00 H new ATOM 0 HA MET A 27 -6.767 0.576 0.213 1.00 0.00 H new ATOM 0 HB2 MET A 27 -6.211 -1.632 -1.829 1.00 0.00 H new ATOM 0 HB3 MET A 27 -5.748 -1.718 -0.141 1.00 0.00 H new ATOM 0 HG2 MET A 27 -8.442 -0.966 0.013 1.00 0.00 H new ATOM 0 HG3 MET A 27 -8.431 -2.043 -1.370 1.00 0.00 H new ATOM 0 HE1 MET A 27 -8.437 -3.086 2.948 1.00 0.00 H new ATOM 0 HE2 MET A 27 -8.004 -1.482 2.312 1.00 0.00 H new ATOM 0 HE3 MET A 27 -9.571 -2.213 1.890 1.00 0.00 H new ATOM 411 N ILE A 28 -4.403 1.350 -0.018 1.00 0.00 N ATOM 412 CA ILE A 28 -3.000 1.829 -0.171 1.00 0.00 C ATOM 413 C ILE A 28 -2.054 0.843 0.519 1.00 0.00 C ATOM 414 O ILE A 28 -2.177 0.574 1.698 1.00 0.00 O ATOM 415 CB ILE A 28 -2.859 3.208 0.477 1.00 0.00 C ATOM 416 CG1 ILE A 28 -3.641 4.237 -0.341 1.00 0.00 C ATOM 417 CG2 ILE A 28 -1.383 3.606 0.518 1.00 0.00 C ATOM 418 CD1 ILE A 28 -3.275 4.098 -1.819 1.00 0.00 C ATOM 0 H ILE A 28 -4.839 1.565 0.879 1.00 0.00 H new ATOM 0 HA ILE A 28 -2.749 1.899 -1.230 1.00 0.00 H new ATOM 0 HB ILE A 28 -3.253 3.173 1.493 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -4.712 4.087 -0.205 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -3.413 5.244 0.008 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -1.284 4.588 0.980 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -0.825 2.873 1.100 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -0.987 3.641 -0.497 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -3.832 4.831 -2.402 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.206 4.269 -1.947 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -3.526 3.095 -2.163 1.00 0.00 H new ATOM 430 N VAL A 29 -1.116 0.293 -0.204 1.00 0.00 N ATOM 431 CA VAL A 29 -0.174 -0.679 0.420 1.00 0.00 C ATOM 432 C VAL A 29 1.268 -0.262 0.122 1.00 0.00 C ATOM 433 O VAL A 29 1.595 0.134 -0.979 1.00 0.00 O ATOM 434 CB VAL A 29 -0.434 -2.074 -0.153 1.00 0.00 C ATOM 435 CG1 VAL A 29 0.689 -3.020 0.274 1.00 0.00 C ATOM 436 CG2 VAL A 29 -1.771 -2.597 0.376 1.00 0.00 C ATOM 0 H VAL A 29 -0.962 0.474 -1.196 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.327 -0.693 1.499 1.00 0.00 H new ATOM 0 HB VAL A 29 -0.467 -2.021 -1.241 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.503 -4.013 -0.134 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.642 -2.646 -0.101 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.724 -3.076 1.362 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.959 -3.591 -0.030 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.736 -2.651 1.464 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.572 -1.923 0.072 1.00 0.00 H new ATOM 446 N GLU A 30 2.132 -0.347 1.096 1.00 0.00 N ATOM 447 CA GLU A 30 3.551 0.043 0.871 1.00 0.00 C ATOM 448 C GLU A 30 4.465 -1.125 1.250 1.00 0.00 C ATOM 449 O GLU A 30 4.259 -1.786 2.249 1.00 0.00 O ATOM 450 CB GLU A 30 3.889 1.257 1.739 1.00 0.00 C ATOM 451 CG GLU A 30 5.368 1.608 1.573 1.00 0.00 C ATOM 452 CD GLU A 30 6.047 1.624 2.944 1.00 0.00 C ATOM 453 OE1 GLU A 30 5.568 2.333 3.812 1.00 0.00 O ATOM 454 OE2 GLU A 30 7.035 0.926 3.101 1.00 0.00 O ATOM 0 H GLU A 30 1.915 -0.670 2.039 1.00 0.00 H new ATOM 0 HA GLU A 30 3.698 0.295 -0.179 1.00 0.00 H new ATOM 0 HB2 GLU A 30 3.269 2.106 1.452 1.00 0.00 H new ATOM 0 HB3 GLU A 30 3.671 1.041 2.785 1.00 0.00 H new ATOM 0 HG2 GLU A 30 5.854 0.880 0.923 1.00 0.00 H new ATOM 0 HG3 GLU A 30 5.470 2.582 1.094 1.00 0.00 H new ATOM 461 N MET A 31 5.471 -1.388 0.461 1.00 0.00 N ATOM 462 CA MET A 31 6.392 -2.515 0.780 1.00 0.00 C ATOM 463 C MET A 31 7.794 -1.971 1.055 1.00 0.00 C ATOM 464 O MET A 31 8.228 -1.009 0.451 1.00 0.00 O ATOM 465 CB MET A 31 6.443 -3.485 -0.403 1.00 0.00 C ATOM 466 CG MET A 31 6.434 -4.923 0.116 1.00 0.00 C ATOM 467 SD MET A 31 6.433 -6.070 -1.285 1.00 0.00 S ATOM 468 CE MET A 31 4.654 -6.028 -1.613 1.00 0.00 C ATOM 0 H MET A 31 5.695 -0.872 -0.390 1.00 0.00 H new ATOM 0 HA MET A 31 6.028 -3.039 1.664 1.00 0.00 H new ATOM 0 HB2 MET A 31 5.589 -3.319 -1.060 1.00 0.00 H new ATOM 0 HB3 MET A 31 7.341 -3.306 -0.995 1.00 0.00 H new ATOM 0 HG2 MET A 31 7.307 -5.100 0.744 1.00 0.00 H new ATOM 0 HG3 MET A 31 5.555 -5.091 0.738 1.00 0.00 H new ATOM 0 HE1 MET A 31 4.202 -6.966 -1.289 1.00 0.00 H new ATOM 0 HE2 MET A 31 4.203 -5.200 -1.066 1.00 0.00 H new ATOM 0 HE3 MET A 31 4.484 -5.893 -2.681 1.00 0.00 H new ATOM 478 N LYS A 32 8.509 -2.582 1.960 1.00 0.00 N ATOM 479 CA LYS A 32 9.885 -2.105 2.275 1.00 0.00 C ATOM 480 C LYS A 32 10.885 -2.793 1.344 1.00 0.00 C ATOM 481 O LYS A 32 11.547 -2.158 0.547 1.00 0.00 O ATOM 482 CB LYS A 32 10.220 -2.446 3.729 1.00 0.00 C ATOM 483 CG LYS A 32 11.080 -1.332 4.332 1.00 0.00 C ATOM 484 CD LYS A 32 10.232 -0.072 4.512 1.00 0.00 C ATOM 485 CE LYS A 32 11.149 1.143 4.660 1.00 0.00 C ATOM 486 NZ LYS A 32 10.943 2.065 3.508 1.00 0.00 N ATOM 0 H LYS A 32 8.199 -3.393 2.496 1.00 0.00 H new ATOM 0 HA LYS A 32 9.940 -1.026 2.134 1.00 0.00 H new ATOM 0 HB2 LYS A 32 9.303 -2.564 4.306 1.00 0.00 H new ATOM 0 HB3 LYS A 32 10.752 -3.396 3.777 1.00 0.00 H new ATOM 0 HG2 LYS A 32 11.485 -1.651 5.292 1.00 0.00 H new ATOM 0 HG3 LYS A 32 11.929 -1.122 3.682 1.00 0.00 H new ATOM 0 HD2 LYS A 32 9.571 0.060 3.655 1.00 0.00 H new ATOM 0 HD3 LYS A 32 9.597 -0.171 5.392 1.00 0.00 H new ATOM 0 HE2 LYS A 32 10.937 1.660 5.596 1.00 0.00 H new ATOM 0 HE3 LYS A 32 12.190 0.823 4.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 11.567 2.891 3.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 11.166 1.569 2.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 9.952 2.380 3.488 1.00 0.00 H new ATOM 500 N LYS A 33 10.999 -4.090 1.439 1.00 0.00 N ATOM 501 CA LYS A 33 11.954 -4.822 0.560 1.00 0.00 C ATOM 502 C LYS A 33 11.444 -6.246 0.331 1.00 0.00 C ATOM 503 O LYS A 33 12.056 -7.209 0.749 1.00 0.00 O ATOM 504 CB LYS A 33 13.328 -4.873 1.231 1.00 0.00 C ATOM 505 CG LYS A 33 14.375 -4.253 0.303 1.00 0.00 C ATOM 506 CD LYS A 33 15.692 -4.083 1.061 1.00 0.00 C ATOM 507 CE LYS A 33 16.120 -2.615 1.016 1.00 0.00 C ATOM 508 NZ LYS A 33 15.056 -1.769 1.628 1.00 0.00 N ATOM 0 H LYS A 33 10.472 -4.674 2.088 1.00 0.00 H new ATOM 0 HA LYS A 33 12.037 -4.307 -0.397 1.00 0.00 H new ATOM 0 HB2 LYS A 33 13.302 -4.334 2.178 1.00 0.00 H new ATOM 0 HB3 LYS A 33 13.595 -5.905 1.459 1.00 0.00 H new ATOM 0 HG2 LYS A 33 14.525 -4.889 -0.570 1.00 0.00 H new ATOM 0 HG3 LYS A 33 14.026 -3.287 -0.062 1.00 0.00 H new ATOM 0 HD2 LYS A 33 15.573 -4.407 2.095 1.00 0.00 H new ATOM 0 HD3 LYS A 33 16.464 -4.712 0.617 1.00 0.00 H new ATOM 0 HE2 LYS A 33 17.059 -2.482 1.553 1.00 0.00 H new ATOM 0 HE3 LYS A 33 16.296 -2.308 -0.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 15.489 -0.935 2.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 14.391 -1.461 0.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 14.545 -2.320 2.347 1.00 0.00 H new ATOM 522 N GLY A 34 10.327 -6.388 -0.330 1.00 0.00 N ATOM 523 CA GLY A 34 9.779 -7.750 -0.585 1.00 0.00 C ATOM 524 C GLY A 34 9.008 -8.232 0.646 1.00 0.00 C ATOM 525 O GLY A 34 8.737 -9.406 0.801 1.00 0.00 O ATOM 0 H GLY A 34 9.771 -5.619 -0.704 1.00 0.00 H new ATOM 0 HA2 GLY A 34 9.121 -7.732 -1.454 1.00 0.00 H new ATOM 0 HA3 GLY A 34 10.589 -8.442 -0.813 1.00 0.00 H new ATOM 529 N ASN A 35 8.654 -7.334 1.525 1.00 0.00 N ATOM 530 CA ASN A 35 7.900 -7.741 2.745 1.00 0.00 C ATOM 531 C ASN A 35 6.893 -6.648 3.110 1.00 0.00 C ATOM 532 O ASN A 35 7.247 -5.623 3.657 1.00 0.00 O ATOM 533 CB ASN A 35 8.879 -7.941 3.905 1.00 0.00 C ATOM 534 CG ASN A 35 8.103 -8.045 5.221 1.00 0.00 C ATOM 535 OD1 ASN A 35 8.503 -7.480 6.220 1.00 0.00 O ATOM 536 ND2 ASN A 35 7.004 -8.746 5.264 1.00 0.00 N ATOM 0 H ASN A 35 8.854 -6.337 1.451 1.00 0.00 H new ATOM 0 HA ASN A 35 7.370 -8.673 2.551 1.00 0.00 H new ATOM 0 HB2 ASN A 35 9.467 -8.845 3.746 1.00 0.00 H new ATOM 0 HB3 ASN A 35 9.580 -7.108 3.950 1.00 0.00 H new ATOM 0 HD21 ASN A 35 6.480 -8.820 6.136 1.00 0.00 H new ATOM 0 HD22 ASN A 35 6.668 -9.220 4.426 1.00 0.00 H new ATOM 543 N ILE A 36 5.640 -6.860 2.814 1.00 0.00 N ATOM 544 CA ILE A 36 4.613 -5.834 3.147 1.00 0.00 C ATOM 545 C ILE A 36 4.850 -5.318 4.567 1.00 0.00 C ATOM 546 O ILE A 36 5.132 -6.076 5.474 1.00 0.00 O ATOM 547 CB ILE A 36 3.219 -6.458 3.055 1.00 0.00 C ATOM 548 CG1 ILE A 36 3.030 -7.082 1.669 1.00 0.00 C ATOM 549 CG2 ILE A 36 2.160 -5.377 3.274 1.00 0.00 C ATOM 550 CD1 ILE A 36 2.926 -8.603 1.802 1.00 0.00 C ATOM 0 H ILE A 36 5.284 -7.699 2.356 1.00 0.00 H new ATOM 0 HA ILE A 36 4.686 -5.005 2.443 1.00 0.00 H new ATOM 0 HB ILE A 36 3.115 -7.228 3.819 1.00 0.00 H new ATOM 0 HG12 ILE A 36 2.130 -6.685 1.200 1.00 0.00 H new ATOM 0 HG13 ILE A 36 3.868 -6.820 1.023 1.00 0.00 H new ATOM 0 HG21 ILE A 36 1.167 -5.822 3.208 1.00 0.00 H new ATOM 0 HG22 ILE A 36 2.294 -4.931 4.260 1.00 0.00 H new ATOM 0 HG23 ILE A 36 2.263 -4.606 2.510 1.00 0.00 H new ATOM 0 HD11 ILE A 36 2.792 -9.046 0.815 1.00 0.00 H new ATOM 0 HD12 ILE A 36 3.839 -8.992 2.253 1.00 0.00 H new ATOM 0 HD13 ILE A 36 2.073 -8.856 2.432 1.00 0.00 H new ATOM 562 N GLU A 37 4.741 -4.033 4.769 1.00 0.00 N ATOM 563 CA GLU A 37 4.963 -3.471 6.131 1.00 0.00 C ATOM 564 C GLU A 37 4.002 -2.303 6.364 1.00 0.00 C ATOM 565 O GLU A 37 4.184 -1.507 7.264 1.00 0.00 O ATOM 566 CB GLU A 37 6.406 -2.975 6.249 1.00 0.00 C ATOM 567 CG GLU A 37 7.152 -3.816 7.287 1.00 0.00 C ATOM 568 CD GLU A 37 8.016 -2.902 8.158 1.00 0.00 C ATOM 569 OE1 GLU A 37 8.476 -1.893 7.651 1.00 0.00 O ATOM 570 OE2 GLU A 37 8.203 -3.227 9.319 1.00 0.00 O ATOM 0 H GLU A 37 4.508 -3.348 4.050 1.00 0.00 H new ATOM 0 HA GLU A 37 4.782 -4.245 6.877 1.00 0.00 H new ATOM 0 HB2 GLU A 37 6.906 -3.044 5.283 1.00 0.00 H new ATOM 0 HB3 GLU A 37 6.418 -1.925 6.540 1.00 0.00 H new ATOM 0 HG2 GLU A 37 6.441 -4.362 7.907 1.00 0.00 H new ATOM 0 HG3 GLU A 37 7.776 -4.558 6.789 1.00 0.00 H new ATOM 577 N SER A 38 2.980 -2.194 5.560 1.00 0.00 N ATOM 578 CA SER A 38 2.008 -1.077 5.737 1.00 0.00 C ATOM 579 C SER A 38 0.754 -1.357 4.907 1.00 0.00 C ATOM 580 O SER A 38 0.819 -1.539 3.708 1.00 0.00 O ATOM 581 CB SER A 38 2.654 0.234 5.279 1.00 0.00 C ATOM 582 OG SER A 38 2.031 0.682 4.081 1.00 0.00 O ATOM 0 H SER A 38 2.776 -2.829 4.789 1.00 0.00 H new ATOM 0 HA SER A 38 1.730 -0.994 6.788 1.00 0.00 H new ATOM 0 HB2 SER A 38 2.555 0.991 6.057 1.00 0.00 H new ATOM 0 HB3 SER A 38 3.721 0.086 5.112 1.00 0.00 H new ATOM 0 HG SER A 38 2.201 1.640 3.962 1.00 0.00 H new ATOM 588 N SER A 39 -0.389 -1.393 5.535 1.00 0.00 N ATOM 589 CA SER A 39 -1.646 -1.660 4.779 1.00 0.00 C ATOM 590 C SER A 39 -2.784 -0.816 5.360 1.00 0.00 C ATOM 591 O SER A 39 -3.250 -1.054 6.456 1.00 0.00 O ATOM 592 CB SER A 39 -2.001 -3.143 4.891 1.00 0.00 C ATOM 593 OG SER A 39 -1.053 -3.910 4.161 1.00 0.00 O ATOM 0 H SER A 39 -0.507 -1.249 6.538 1.00 0.00 H new ATOM 0 HA SER A 39 -1.502 -1.398 3.731 1.00 0.00 H new ATOM 0 HB2 SER A 39 -2.006 -3.449 5.937 1.00 0.00 H new ATOM 0 HB3 SER A 39 -3.004 -3.319 4.503 1.00 0.00 H new ATOM 0 HG SER A 39 -1.277 -4.861 4.232 1.00 0.00 H new ATOM 599 N GLU A 40 -3.238 0.166 4.628 1.00 0.00 N ATOM 600 CA GLU A 40 -4.348 1.023 5.132 1.00 0.00 C ATOM 601 C GLU A 40 -5.445 1.103 4.068 1.00 0.00 C ATOM 602 O GLU A 40 -5.191 0.947 2.891 1.00 0.00 O ATOM 603 CB GLU A 40 -3.818 2.428 5.427 1.00 0.00 C ATOM 604 CG GLU A 40 -4.340 2.895 6.789 1.00 0.00 C ATOM 605 CD GLU A 40 -5.172 4.166 6.609 1.00 0.00 C ATOM 606 OE1 GLU A 40 -5.951 4.213 5.672 1.00 0.00 O ATOM 607 OE2 GLU A 40 -5.016 5.071 7.412 1.00 0.00 O ATOM 0 H GLU A 40 -2.887 0.411 3.702 1.00 0.00 H new ATOM 0 HA GLU A 40 -4.755 0.593 6.047 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -2.728 2.425 5.425 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.136 3.120 4.647 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.946 2.113 7.246 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -3.506 3.086 7.464 1.00 0.00 H new ATOM 614 N VAL A 41 -6.663 1.340 4.471 1.00 0.00 N ATOM 615 CA VAL A 41 -7.771 1.423 3.476 1.00 0.00 C ATOM 616 C VAL A 41 -8.321 2.851 3.435 1.00 0.00 C ATOM 617 O VAL A 41 -8.391 3.531 4.440 1.00 0.00 O ATOM 618 CB VAL A 41 -8.887 0.456 3.877 1.00 0.00 C ATOM 619 CG1 VAL A 41 -9.564 0.959 5.154 1.00 0.00 C ATOM 620 CG2 VAL A 41 -9.921 0.377 2.751 1.00 0.00 C ATOM 0 H VAL A 41 -6.939 1.479 5.443 1.00 0.00 H new ATOM 0 HA VAL A 41 -7.393 1.155 2.489 1.00 0.00 H new ATOM 0 HB VAL A 41 -8.464 -0.533 4.055 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -10.359 0.270 5.440 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -8.829 1.018 5.957 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -9.987 1.948 4.976 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -10.717 -0.312 3.035 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -10.343 1.366 2.575 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -9.440 0.020 1.840 1.00 0.00 H new ATOM 630 N ILE A 42 -8.713 3.309 2.276 1.00 0.00 N ATOM 631 CA ILE A 42 -9.261 4.692 2.166 1.00 0.00 C ATOM 632 C ILE A 42 -10.504 4.676 1.273 1.00 0.00 C ATOM 633 O ILE A 42 -10.506 4.097 0.204 1.00 0.00 O ATOM 634 CB ILE A 42 -8.203 5.612 1.553 1.00 0.00 C ATOM 635 CG1 ILE A 42 -7.005 5.710 2.500 1.00 0.00 C ATOM 636 CG2 ILE A 42 -8.797 7.006 1.339 1.00 0.00 C ATOM 637 CD1 ILE A 42 -5.733 5.974 1.692 1.00 0.00 C ATOM 0 H ILE A 42 -8.677 2.786 1.401 1.00 0.00 H new ATOM 0 HA ILE A 42 -9.530 5.058 3.157 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.880 5.205 0.595 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -7.163 6.512 3.221 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -6.902 4.786 3.069 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -8.042 7.660 0.902 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -9.652 6.938 0.666 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -9.121 7.414 2.296 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -4.881 6.044 2.368 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -5.573 5.157 0.989 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -5.838 6.910 1.143 1.00 0.00 H new ATOM 649 N GLU A 43 -11.563 5.305 1.704 1.00 0.00 N ATOM 650 CA GLU A 43 -12.806 5.323 0.882 1.00 0.00 C ATOM 651 C GLU A 43 -12.993 6.709 0.260 1.00 0.00 C ATOM 652 O GLU A 43 -12.903 7.718 0.930 1.00 0.00 O ATOM 653 CB GLU A 43 -14.009 4.999 1.771 1.00 0.00 C ATOM 654 CG GLU A 43 -14.121 3.484 1.945 1.00 0.00 C ATOM 655 CD GLU A 43 -13.585 3.088 3.322 1.00 0.00 C ATOM 656 OE1 GLU A 43 -14.207 3.456 4.306 1.00 0.00 O ATOM 657 OE2 GLU A 43 -12.562 2.426 3.370 1.00 0.00 O ATOM 0 H GLU A 43 -11.621 5.807 2.590 1.00 0.00 H new ATOM 0 HA GLU A 43 -12.725 4.579 0.090 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -13.897 5.480 2.743 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -14.922 5.393 1.324 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -15.160 3.171 1.844 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -13.557 2.975 1.163 1.00 0.00 H new ATOM 664 N ASN A 44 -13.255 6.765 -1.018 1.00 0.00 N ATOM 665 CA ASN A 44 -13.451 8.084 -1.682 1.00 0.00 C ATOM 666 C ASN A 44 -14.561 8.857 -0.956 1.00 0.00 C ATOM 667 O ASN A 44 -15.716 8.490 -1.037 1.00 0.00 O ATOM 668 CB ASN A 44 -13.856 7.862 -3.139 1.00 0.00 C ATOM 669 CG ASN A 44 -12.608 7.885 -4.025 1.00 0.00 C ATOM 670 OD1 ASN A 44 -11.904 6.901 -4.127 1.00 0.00 O ATOM 671 ND2 ASN A 44 -12.304 8.976 -4.672 1.00 0.00 N ATOM 0 H ASN A 44 -13.342 5.954 -1.630 1.00 0.00 H new ATOM 0 HA ASN A 44 -12.523 8.655 -1.645 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -14.371 6.907 -3.243 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -14.554 8.637 -3.456 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -11.474 9.003 -5.264 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -12.896 9.802 -4.586 1.00 0.00 H new ATOM 769 N GLY A 54 -14.139 10.273 -11.935 1.00 0.00 N ATOM 770 CA GLY A 54 -13.542 9.026 -11.379 1.00 0.00 C ATOM 771 C GLY A 54 -12.059 8.962 -11.748 1.00 0.00 C ATOM 772 O GLY A 54 -11.210 8.742 -10.908 1.00 0.00 O ATOM 0 HA2 GLY A 54 -13.659 9.006 -10.296 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -14.064 8.154 -11.773 1.00 0.00 H new ATOM 776 N ILE A 55 -11.742 9.155 -12.999 1.00 0.00 N ATOM 777 CA ILE A 55 -10.314 9.109 -13.420 1.00 0.00 C ATOM 778 C ILE A 55 -9.579 10.336 -12.874 1.00 0.00 C ATOM 779 O ILE A 55 -8.378 10.461 -13.007 1.00 0.00 O ATOM 780 CB ILE A 55 -10.234 9.106 -14.947 1.00 0.00 C ATOM 781 CG1 ILE A 55 -11.164 8.025 -15.505 1.00 0.00 C ATOM 782 CG2 ILE A 55 -8.796 8.816 -15.384 1.00 0.00 C ATOM 783 CD1 ILE A 55 -10.592 6.643 -15.188 1.00 0.00 C ATOM 0 H ILE A 55 -12.410 9.342 -13.747 1.00 0.00 H new ATOM 0 HA ILE A 55 -9.849 8.204 -13.028 1.00 0.00 H new ATOM 0 HB ILE A 55 -10.539 10.081 -15.327 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -12.158 8.127 -15.070 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -11.273 8.146 -16.583 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -8.740 8.814 -16.473 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -8.133 9.585 -14.988 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -8.489 7.842 -15.003 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -11.255 5.875 -15.586 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -9.607 6.544 -15.644 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -10.506 6.524 -14.108 1.00 0.00 H new ATOM 795 N ARG A 56 -10.290 11.244 -12.260 1.00 0.00 N ATOM 796 CA ARG A 56 -9.629 12.459 -11.708 1.00 0.00 C ATOM 797 C ARG A 56 -8.904 12.102 -10.409 1.00 0.00 C ATOM 798 O ARG A 56 -7.955 12.751 -10.018 1.00 0.00 O ATOM 799 CB ARG A 56 -10.685 13.531 -11.426 1.00 0.00 C ATOM 800 CG ARG A 56 -10.311 14.823 -12.156 1.00 0.00 C ATOM 801 CD ARG A 56 -11.563 15.442 -12.779 1.00 0.00 C ATOM 802 NE ARG A 56 -11.932 14.687 -14.010 1.00 0.00 N ATOM 803 CZ ARG A 56 -12.108 15.321 -15.137 1.00 0.00 C ATOM 804 NH1 ARG A 56 -13.089 16.173 -15.260 1.00 0.00 N ATOM 805 NH2 ARG A 56 -11.302 15.104 -16.140 1.00 0.00 N ATOM 0 H ARG A 56 -11.299 11.196 -12.118 1.00 0.00 H new ATOM 0 HA ARG A 56 -8.909 12.840 -12.432 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -11.665 13.186 -11.755 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -10.755 13.714 -10.354 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -9.853 15.526 -11.460 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -9.573 14.614 -12.930 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -12.386 15.419 -12.065 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -11.381 16.489 -13.023 1.00 0.00 H new ATOM 0 HE ARG A 56 -12.047 13.674 -13.972 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -13.718 16.343 -14.475 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -13.227 16.669 -16.141 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -10.535 14.439 -16.043 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -11.439 15.599 -17.021 1.00 0.00 H new ATOM 819 N THR A 57 -9.344 11.073 -9.735 1.00 0.00 N ATOM 820 CA THR A 57 -8.676 10.678 -8.463 1.00 0.00 C ATOM 821 C THR A 57 -7.277 10.135 -8.766 1.00 0.00 C ATOM 822 O THR A 57 -6.491 9.886 -7.873 1.00 0.00 O ATOM 823 CB THR A 57 -9.503 9.595 -7.765 1.00 0.00 C ATOM 824 OG1 THR A 57 -9.031 9.422 -6.436 1.00 0.00 O ATOM 825 CG2 THR A 57 -9.374 8.277 -8.530 1.00 0.00 C ATOM 0 H THR A 57 -10.135 10.491 -10.010 1.00 0.00 H new ATOM 0 HA THR A 57 -8.594 11.549 -7.812 1.00 0.00 H new ATOM 0 HB THR A 57 -10.550 9.897 -7.742 1.00 0.00 H new ATOM 0 HG1 THR A 57 -8.053 9.491 -6.424 1.00 0.00 H new ATOM 0 HG21 THR A 57 -9.963 7.508 -8.031 1.00 0.00 H new ATOM 0 HG22 THR A 57 -9.739 8.410 -9.549 1.00 0.00 H new ATOM 0 HG23 THR A 57 -8.328 7.972 -8.556 1.00 0.00 H new ATOM 833 N ALA A 58 -6.958 9.952 -10.019 1.00 0.00 N ATOM 834 CA ALA A 58 -5.608 9.428 -10.373 1.00 0.00 C ATOM 835 C ALA A 58 -4.542 10.412 -9.888 1.00 0.00 C ATOM 836 O ALA A 58 -3.652 10.059 -9.139 1.00 0.00 O ATOM 837 CB ALA A 58 -5.502 9.270 -11.890 1.00 0.00 C ATOM 0 H ALA A 58 -7.572 10.142 -10.811 1.00 0.00 H new ATOM 0 HA ALA A 58 -5.457 8.459 -9.897 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -4.515 8.887 -12.148 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -6.264 8.572 -12.237 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.652 10.238 -12.368 1.00 0.00 H new ATOM 843 N GLN A 59 -4.627 11.646 -10.308 1.00 0.00 N ATOM 844 CA GLN A 59 -3.621 12.651 -9.867 1.00 0.00 C ATOM 845 C GLN A 59 -3.377 12.496 -8.366 1.00 0.00 C ATOM 846 O GLN A 59 -2.304 12.775 -7.869 1.00 0.00 O ATOM 847 CB GLN A 59 -4.145 14.059 -10.160 1.00 0.00 C ATOM 848 CG GLN A 59 -3.094 15.092 -9.748 1.00 0.00 C ATOM 849 CD GLN A 59 -3.251 15.418 -8.263 1.00 0.00 C ATOM 850 OE1 GLN A 59 -2.303 15.338 -7.507 1.00 0.00 O ATOM 851 NE2 GLN A 59 -4.418 15.785 -7.807 1.00 0.00 N ATOM 0 H GLN A 59 -5.349 12.000 -10.936 1.00 0.00 H new ATOM 0 HA GLN A 59 -2.686 12.495 -10.405 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -4.373 14.160 -11.221 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -5.074 14.233 -9.617 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -2.094 14.705 -9.942 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -3.207 15.998 -10.344 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -5.215 15.853 -8.440 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -4.533 16.004 -6.817 1.00 0.00 H new ATOM 860 N ILE A 60 -4.364 12.046 -7.640 1.00 0.00 N ATOM 861 CA ILE A 60 -4.190 11.864 -6.172 1.00 0.00 C ATOM 862 C ILE A 60 -3.353 10.610 -5.917 1.00 0.00 C ATOM 863 O ILE A 60 -2.423 10.619 -5.134 1.00 0.00 O ATOM 864 CB ILE A 60 -5.560 11.703 -5.511 1.00 0.00 C ATOM 865 CG1 ILE A 60 -6.429 12.919 -5.838 1.00 0.00 C ATOM 866 CG2 ILE A 60 -5.387 11.593 -3.995 1.00 0.00 C ATOM 867 CD1 ILE A 60 -7.861 12.663 -5.366 1.00 0.00 C ATOM 0 H ILE A 60 -5.285 11.796 -8.001 1.00 0.00 H new ATOM 0 HA ILE A 60 -3.686 12.735 -5.753 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.041 10.800 -5.887 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -6.028 13.808 -5.351 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -6.417 13.110 -6.911 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -6.364 11.478 -3.525 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -4.768 10.727 -3.761 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -4.906 12.495 -3.617 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -8.481 13.529 -5.598 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -8.260 11.784 -5.873 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -7.864 12.493 -4.289 1.00 0.00 H new ATOM 879 N ILE A 61 -3.675 9.531 -6.575 1.00 0.00 N ATOM 880 CA ILE A 61 -2.901 8.275 -6.376 1.00 0.00 C ATOM 881 C ILE A 61 -1.421 8.541 -6.659 1.00 0.00 C ATOM 882 O ILE A 61 -0.550 7.858 -6.157 1.00 0.00 O ATOM 883 CB ILE A 61 -3.416 7.203 -7.338 1.00 0.00 C ATOM 884 CG1 ILE A 61 -4.835 6.796 -6.936 1.00 0.00 C ATOM 885 CG2 ILE A 61 -2.500 5.981 -7.278 1.00 0.00 C ATOM 886 CD1 ILE A 61 -5.310 5.648 -7.828 1.00 0.00 C ATOM 0 H ILE A 61 -4.443 9.465 -7.243 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.021 7.932 -5.349 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.425 7.601 -8.353 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -4.854 6.489 -5.890 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -5.509 7.647 -7.031 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.867 5.217 -7.963 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.489 6.270 -7.564 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -2.490 5.583 -6.263 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -6.321 5.359 -7.541 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -5.307 5.971 -8.869 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.641 4.795 -7.710 1.00 0.00 H new ATOM 898 N ALA A 62 -1.130 9.528 -7.461 1.00 0.00 N ATOM 899 CA ALA A 62 0.293 9.837 -7.780 1.00 0.00 C ATOM 900 C ALA A 62 0.994 10.385 -6.533 1.00 0.00 C ATOM 901 O ALA A 62 2.145 10.093 -6.280 1.00 0.00 O ATOM 902 CB ALA A 62 0.349 10.884 -8.895 1.00 0.00 C ATOM 0 H ALA A 62 -1.817 10.134 -7.910 1.00 0.00 H new ATOM 0 HA ALA A 62 0.795 8.927 -8.107 1.00 0.00 H new ATOM 0 HB1 ALA A 62 1.389 11.111 -9.129 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -0.147 10.495 -9.784 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -0.155 11.793 -8.566 1.00 0.00 H new ATOM 908 N ASN A 63 0.311 11.180 -5.756 1.00 0.00 N ATOM 909 CA ASN A 63 0.944 11.745 -4.531 1.00 0.00 C ATOM 910 C ASN A 63 1.089 10.649 -3.472 1.00 0.00 C ATOM 911 O ASN A 63 1.661 10.862 -2.421 1.00 0.00 O ATOM 912 CB ASN A 63 0.069 12.873 -3.980 1.00 0.00 C ATOM 913 CG ASN A 63 0.439 14.189 -4.666 1.00 0.00 C ATOM 914 OD1 ASN A 63 1.588 14.587 -4.663 1.00 0.00 O ATOM 915 ND2 ASN A 63 -0.490 14.886 -5.260 1.00 0.00 N ATOM 0 H ASN A 63 -0.656 11.462 -5.916 1.00 0.00 H new ATOM 0 HA ASN A 63 1.930 12.136 -4.782 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -0.984 12.646 -4.149 1.00 0.00 H new ATOM 0 HB3 ASN A 63 0.207 12.961 -2.902 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -0.252 15.764 -5.721 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -1.454 14.553 -5.263 1.00 0.00 H new ATOM 922 N ASN A 64 0.576 9.479 -3.737 1.00 0.00 N ATOM 923 CA ASN A 64 0.686 8.374 -2.742 1.00 0.00 C ATOM 924 C ASN A 64 2.041 7.677 -2.897 1.00 0.00 C ATOM 925 O ASN A 64 2.477 6.950 -2.028 1.00 0.00 O ATOM 926 CB ASN A 64 -0.437 7.361 -2.978 1.00 0.00 C ATOM 927 CG ASN A 64 -1.285 7.232 -1.712 1.00 0.00 C ATOM 928 OD1 ASN A 64 -1.042 6.370 -0.890 1.00 0.00 O ATOM 929 ND2 ASN A 64 -2.276 8.057 -1.517 1.00 0.00 N ATOM 0 H ASN A 64 0.086 9.240 -4.599 1.00 0.00 H new ATOM 0 HA ASN A 64 0.602 8.784 -1.736 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -1.059 7.681 -3.814 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -0.016 6.392 -3.246 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -2.847 7.979 -0.675 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -2.480 8.781 -2.206 1.00 0.00 H new ATOM 936 N GLY A 65 2.708 7.894 -3.998 1.00 0.00 N ATOM 937 CA GLY A 65 4.034 7.242 -4.207 1.00 0.00 C ATOM 938 C GLY A 65 3.831 5.849 -4.806 1.00 0.00 C ATOM 939 O GLY A 65 4.761 5.222 -5.273 1.00 0.00 O ATOM 0 H GLY A 65 2.393 8.493 -4.761 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.648 7.849 -4.872 1.00 0.00 H new ATOM 0 HA3 GLY A 65 4.568 7.167 -3.259 1.00 0.00 H new ATOM 943 N VAL A 66 2.622 5.360 -4.796 1.00 0.00 N ATOM 944 CA VAL A 66 2.356 4.007 -5.364 1.00 0.00 C ATOM 945 C VAL A 66 2.786 3.971 -6.827 1.00 0.00 C ATOM 946 O VAL A 66 2.066 4.396 -7.710 1.00 0.00 O ATOM 947 CB VAL A 66 0.862 3.696 -5.263 1.00 0.00 C ATOM 948 CG1 VAL A 66 0.058 4.874 -5.813 1.00 0.00 C ATOM 949 CG2 VAL A 66 0.548 2.438 -6.077 1.00 0.00 C ATOM 0 H VAL A 66 1.805 5.839 -4.418 1.00 0.00 H new ATOM 0 HA VAL A 66 2.921 3.263 -4.803 1.00 0.00 H new ATOM 0 HB VAL A 66 0.594 3.530 -4.220 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.007 4.653 -5.741 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.282 5.770 -5.234 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.324 5.041 -6.857 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.517 2.215 -6.006 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.815 2.604 -7.121 1.00 0.00 H new ATOM 0 HG23 VAL A 66 1.122 1.598 -5.685 1.00 0.00 H new ATOM 959 N LYS A 67 3.949 3.450 -7.093 1.00 0.00 N ATOM 960 CA LYS A 67 4.418 3.370 -8.501 1.00 0.00 C ATOM 961 C LYS A 67 3.738 2.177 -9.171 1.00 0.00 C ATOM 962 O LYS A 67 3.860 1.967 -10.363 1.00 0.00 O ATOM 963 CB LYS A 67 5.936 3.175 -8.525 1.00 0.00 C ATOM 964 CG LYS A 67 6.620 4.425 -7.969 1.00 0.00 C ATOM 965 CD LYS A 67 7.374 5.137 -9.094 1.00 0.00 C ATOM 966 CE LYS A 67 8.879 4.966 -8.888 1.00 0.00 C ATOM 967 NZ LYS A 67 9.562 6.273 -9.104 1.00 0.00 N ATOM 0 H LYS A 67 4.594 3.077 -6.397 1.00 0.00 H new ATOM 0 HA LYS A 67 4.169 4.289 -9.032 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.211 2.303 -7.932 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.273 2.986 -9.544 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.879 5.095 -7.533 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.310 4.151 -7.171 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.080 4.727 -10.060 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.116 6.196 -9.106 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.080 4.601 -7.881 1.00 0.00 H new ATOM 0 HE3 LYS A 67 9.269 4.221 -9.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 10.586 6.157 -8.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.380 6.604 -10.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.197 6.972 -8.426 1.00 0.00 H new ATOM 981 N ALA A 68 3.012 1.396 -8.415 1.00 0.00 N ATOM 982 CA ALA A 68 2.317 0.221 -9.012 1.00 0.00 C ATOM 983 C ALA A 68 0.804 0.441 -8.935 1.00 0.00 C ATOM 984 O ALA A 68 0.246 0.610 -7.870 1.00 0.00 O ATOM 985 CB ALA A 68 2.690 -1.045 -8.239 1.00 0.00 C ATOM 0 H ALA A 68 2.871 1.522 -7.413 1.00 0.00 H new ATOM 0 HA ALA A 68 2.620 0.107 -10.053 1.00 0.00 H new ATOM 0 HB1 ALA A 68 2.180 -1.903 -8.678 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.768 -1.198 -8.290 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.388 -0.937 -7.197 1.00 0.00 H new ATOM 991 N VAL A 69 0.136 0.448 -10.056 1.00 0.00 N ATOM 992 CA VAL A 69 -1.337 0.665 -10.041 1.00 0.00 C ATOM 993 C VAL A 69 -2.058 -0.641 -10.380 1.00 0.00 C ATOM 994 O VAL A 69 -1.994 -1.127 -11.490 1.00 0.00 O ATOM 995 CB VAL A 69 -1.701 1.730 -11.077 1.00 0.00 C ATOM 996 CG1 VAL A 69 -3.223 1.845 -11.179 1.00 0.00 C ATOM 997 CG2 VAL A 69 -1.117 3.078 -10.648 1.00 0.00 C ATOM 0 H VAL A 69 0.546 0.313 -10.980 1.00 0.00 H new ATOM 0 HA VAL A 69 -1.643 0.996 -9.049 1.00 0.00 H new ATOM 0 HB VAL A 69 -1.292 1.447 -12.047 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -3.482 2.604 -11.917 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -3.641 0.885 -11.483 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -3.632 2.128 -10.209 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -1.376 3.838 -11.385 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -1.526 3.360 -9.678 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.032 2.998 -10.575 1.00 0.00 H new ATOM 1007 N ILE A 70 -2.752 -1.210 -9.433 1.00 0.00 N ATOM 1008 CA ILE A 70 -3.481 -2.481 -9.705 1.00 0.00 C ATOM 1009 C ILE A 70 -4.957 -2.168 -9.960 1.00 0.00 C ATOM 1010 O ILE A 70 -5.733 -2.008 -9.039 1.00 0.00 O ATOM 1011 CB ILE A 70 -3.361 -3.411 -8.496 1.00 0.00 C ATOM 1012 CG1 ILE A 70 -2.004 -3.200 -7.820 1.00 0.00 C ATOM 1013 CG2 ILE A 70 -3.478 -4.865 -8.956 1.00 0.00 C ATOM 1014 CD1 ILE A 70 -0.886 -3.411 -8.840 1.00 0.00 C ATOM 0 H ILE A 70 -2.846 -0.850 -8.483 1.00 0.00 H new ATOM 0 HA ILE A 70 -3.050 -2.969 -10.579 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.159 -3.187 -7.788 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -1.946 -2.194 -7.404 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -1.888 -3.896 -6.989 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -3.392 -5.527 -8.094 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -4.444 -5.018 -9.437 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.681 -5.088 -9.665 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.080 -3.260 -8.358 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -0.940 -4.426 -9.235 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -0.999 -2.698 -9.656 1.00 0.00 H new ATOM 1026 N ALA A 71 -5.351 -2.077 -11.200 1.00 0.00 N ATOM 1027 CA ALA A 71 -6.777 -1.771 -11.502 1.00 0.00 C ATOM 1028 C ALA A 71 -7.117 -2.232 -12.919 1.00 0.00 C ATOM 1029 O ALA A 71 -6.253 -2.590 -13.694 1.00 0.00 O ATOM 1030 CB ALA A 71 -7.005 -0.262 -11.391 1.00 0.00 C ATOM 0 H ALA A 71 -4.750 -2.201 -12.014 1.00 0.00 H new ATOM 0 HA ALA A 71 -7.416 -2.294 -10.791 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -8.048 -0.034 -11.611 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -6.767 0.068 -10.380 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -6.362 0.256 -12.103 1.00 0.00 H new ATOM 1036 N SER A 72 -8.376 -2.221 -13.263 1.00 0.00 N ATOM 1037 CA SER A 72 -8.784 -2.652 -14.629 1.00 0.00 C ATOM 1038 C SER A 72 -9.768 -1.630 -15.202 1.00 0.00 C ATOM 1039 O SER A 72 -10.833 -1.975 -15.672 1.00 0.00 O ATOM 1040 CB SER A 72 -9.456 -4.023 -14.553 1.00 0.00 C ATOM 1041 OG SER A 72 -9.569 -4.565 -15.862 1.00 0.00 O ATOM 0 H SER A 72 -9.141 -1.931 -12.654 1.00 0.00 H new ATOM 0 HA SER A 72 -7.906 -2.718 -15.272 1.00 0.00 H new ATOM 0 HB2 SER A 72 -8.873 -4.692 -13.919 1.00 0.00 H new ATOM 0 HB3 SER A 72 -10.442 -3.932 -14.098 1.00 0.00 H new ATOM 0 HG SER A 72 -10.166 -4.003 -16.398 1.00 0.00 H new ATOM 1047 N SER A 73 -9.417 -0.373 -15.157 1.00 0.00 N ATOM 1048 CA SER A 73 -10.324 0.683 -15.690 1.00 0.00 C ATOM 1049 C SER A 73 -10.960 0.212 -17.002 1.00 0.00 C ATOM 1050 O SER A 73 -10.364 -0.546 -17.740 1.00 0.00 O ATOM 1051 CB SER A 73 -9.521 1.958 -15.945 1.00 0.00 C ATOM 1052 OG SER A 73 -8.692 1.768 -17.085 1.00 0.00 O ATOM 0 H SER A 73 -8.537 -0.031 -14.772 1.00 0.00 H new ATOM 0 HA SER A 73 -11.110 0.882 -14.962 1.00 0.00 H new ATOM 0 HB2 SER A 73 -10.194 2.800 -16.106 1.00 0.00 H new ATOM 0 HB3 SER A 73 -8.912 2.199 -15.074 1.00 0.00 H new ATOM 0 HG SER A 73 -9.046 2.287 -17.837 1.00 0.00 H new ATOM 1058 N PRO A 74 -12.157 0.683 -17.249 1.00 0.00 N ATOM 1059 CA PRO A 74 -12.912 0.337 -18.466 1.00 0.00 C ATOM 1060 C PRO A 74 -12.387 1.143 -19.656 1.00 0.00 C ATOM 1061 O PRO A 74 -12.341 0.666 -20.773 1.00 0.00 O ATOM 1062 CB PRO A 74 -14.349 0.740 -18.123 1.00 0.00 C ATOM 1063 CG PRO A 74 -14.248 1.794 -16.994 1.00 0.00 C ATOM 1064 CD PRO A 74 -12.867 1.606 -16.339 1.00 0.00 C ATOM 0 HA PRO A 74 -12.827 -0.713 -18.745 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -14.856 1.152 -18.995 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -14.928 -0.124 -17.797 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -14.353 2.802 -17.395 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -15.045 1.657 -16.263 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -12.339 2.555 -16.243 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -12.955 1.187 -15.336 1.00 0.00 H new ATOM 1072 N GLY A 75 -11.987 2.363 -19.422 1.00 0.00 N ATOM 1073 CA GLY A 75 -11.457 3.202 -20.532 1.00 0.00 C ATOM 1074 C GLY A 75 -9.946 3.370 -20.358 1.00 0.00 C ATOM 1075 O GLY A 75 -9.441 3.301 -19.255 1.00 0.00 O ATOM 0 H GLY A 75 -12.005 2.815 -18.508 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -11.675 2.735 -21.493 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.946 4.176 -20.533 1.00 0.00 H new ATOM 1079 N PRO A 76 -9.270 3.581 -21.454 1.00 0.00 N ATOM 1080 CA PRO A 76 -7.807 3.760 -21.461 1.00 0.00 C ATOM 1081 C PRO A 76 -7.433 5.171 -20.999 1.00 0.00 C ATOM 1082 O PRO A 76 -6.274 5.530 -20.952 1.00 0.00 O ATOM 1083 CB PRO A 76 -7.428 3.547 -22.929 1.00 0.00 C ATOM 1084 CG PRO A 76 -8.707 3.821 -23.755 1.00 0.00 C ATOM 1085 CD PRO A 76 -9.896 3.663 -22.790 1.00 0.00 C ATOM 0 HA PRO A 76 -7.290 3.077 -20.787 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -6.624 4.221 -23.224 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -7.069 2.531 -23.094 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -8.685 4.824 -24.182 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -8.788 3.122 -24.587 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -10.580 4.509 -22.858 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -10.475 2.767 -23.014 1.00 0.00 H new ATOM 1093 N ASN A 77 -8.404 5.973 -20.657 1.00 0.00 N ATOM 1094 CA ASN A 77 -8.097 7.359 -20.202 1.00 0.00 C ATOM 1095 C ASN A 77 -7.205 7.308 -18.959 1.00 0.00 C ATOM 1096 O ASN A 77 -6.265 8.068 -18.828 1.00 0.00 O ATOM 1097 CB ASN A 77 -9.400 8.086 -19.863 1.00 0.00 C ATOM 1098 CG ASN A 77 -9.359 9.502 -20.439 1.00 0.00 C ATOM 1099 OD1 ASN A 77 -8.685 9.753 -21.418 1.00 0.00 O ATOM 1100 ND2 ASN A 77 -10.060 10.445 -19.871 1.00 0.00 N ATOM 0 H ASN A 77 -9.394 5.729 -20.673 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.578 7.892 -20.998 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -10.250 7.540 -20.272 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -9.536 8.125 -18.782 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -10.042 11.392 -20.249 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -10.626 10.235 -19.049 1.00 0.00 H new ATOM 1107 N ALA A 78 -7.493 6.425 -18.044 1.00 0.00 N ATOM 1108 CA ALA A 78 -6.661 6.332 -16.810 1.00 0.00 C ATOM 1109 C ALA A 78 -5.237 5.908 -17.179 1.00 0.00 C ATOM 1110 O ALA A 78 -4.298 6.667 -17.044 1.00 0.00 O ATOM 1111 CB ALA A 78 -7.270 5.300 -15.860 1.00 0.00 C ATOM 0 H ALA A 78 -8.268 5.764 -18.096 1.00 0.00 H new ATOM 0 HA ALA A 78 -6.633 7.305 -16.320 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -6.662 5.232 -14.958 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.282 5.604 -15.593 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -7.301 4.327 -16.351 1.00 0.00 H new ATOM 1117 N PHE A 79 -5.069 4.700 -17.640 1.00 0.00 N ATOM 1118 CA PHE A 79 -3.706 4.225 -18.013 1.00 0.00 C ATOM 1119 C PHE A 79 -3.059 5.213 -18.987 1.00 0.00 C ATOM 1120 O PHE A 79 -1.857 5.228 -19.160 1.00 0.00 O ATOM 1121 CB PHE A 79 -3.810 2.849 -18.673 1.00 0.00 C ATOM 1122 CG PHE A 79 -4.521 1.896 -17.743 1.00 0.00 C ATOM 1123 CD1 PHE A 79 -4.432 2.073 -16.355 1.00 0.00 C ATOM 1124 CD2 PHE A 79 -5.271 0.835 -18.267 1.00 0.00 C ATOM 1125 CE1 PHE A 79 -5.092 1.189 -15.493 1.00 0.00 C ATOM 1126 CE2 PHE A 79 -5.931 -0.050 -17.404 1.00 0.00 C ATOM 1127 CZ PHE A 79 -5.842 0.127 -16.018 1.00 0.00 C ATOM 0 H PHE A 79 -5.817 4.020 -17.775 1.00 0.00 H new ATOM 0 HA PHE A 79 -3.092 4.154 -17.115 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.352 2.926 -19.615 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.815 2.470 -18.908 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -3.854 2.891 -15.951 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.340 0.699 -19.336 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -5.023 1.325 -14.424 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -6.508 -0.869 -17.808 1.00 0.00 H new ATOM 0 HZ PHE A 79 -6.351 -0.555 -15.353 1.00 0.00 H new ATOM 1137 N GLU A 80 -3.843 6.036 -19.628 1.00 0.00 N ATOM 1138 CA GLU A 80 -3.263 7.016 -20.589 1.00 0.00 C ATOM 1139 C GLU A 80 -2.496 8.095 -19.821 1.00 0.00 C ATOM 1140 O GLU A 80 -1.361 8.401 -20.127 1.00 0.00 O ATOM 1141 CB GLU A 80 -4.388 7.667 -21.398 1.00 0.00 C ATOM 1142 CG GLU A 80 -3.790 8.578 -22.471 1.00 0.00 C ATOM 1143 CD GLU A 80 -4.920 9.226 -23.274 1.00 0.00 C ATOM 1144 OE1 GLU A 80 -5.466 8.556 -24.135 1.00 0.00 O ATOM 1145 OE2 GLU A 80 -5.221 10.379 -23.013 1.00 0.00 O ATOM 0 H GLU A 80 -4.857 6.072 -19.528 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.582 6.499 -21.265 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.006 6.899 -21.863 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -5.037 8.243 -20.738 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -3.171 9.346 -22.008 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -3.142 8.003 -23.133 1.00 0.00 H new ATOM 1152 N VAL A 81 -3.106 8.675 -18.823 1.00 0.00 N ATOM 1153 CA VAL A 81 -2.410 9.734 -18.039 1.00 0.00 C ATOM 1154 C VAL A 81 -1.246 9.117 -17.260 1.00 0.00 C ATOM 1155 O VAL A 81 -0.139 9.619 -17.277 1.00 0.00 O ATOM 1156 CB VAL A 81 -3.396 10.374 -17.060 1.00 0.00 C ATOM 1157 CG1 VAL A 81 -2.846 11.721 -16.588 1.00 0.00 C ATOM 1158 CG2 VAL A 81 -4.740 10.590 -17.761 1.00 0.00 C ATOM 0 H VAL A 81 -4.055 8.461 -18.517 1.00 0.00 H new ATOM 0 HA VAL A 81 -2.026 10.494 -18.720 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.534 9.717 -16.201 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -3.549 12.177 -15.891 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.888 11.569 -16.091 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -2.709 12.379 -17.446 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -5.444 11.046 -17.065 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -4.601 11.247 -18.619 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -5.133 9.631 -18.098 1.00 0.00 H new ATOM 1168 N LEU A 82 -1.484 8.031 -16.575 1.00 0.00 N ATOM 1169 CA LEU A 82 -0.391 7.386 -15.796 1.00 0.00 C ATOM 1170 C LEU A 82 0.788 7.083 -16.724 1.00 0.00 C ATOM 1171 O LEU A 82 1.930 7.062 -16.307 1.00 0.00 O ATOM 1172 CB LEU A 82 -0.905 6.083 -15.180 1.00 0.00 C ATOM 1173 CG LEU A 82 -2.130 6.379 -14.313 1.00 0.00 C ATOM 1174 CD1 LEU A 82 -2.844 5.071 -13.972 1.00 0.00 C ATOM 1175 CD2 LEU A 82 -1.683 7.068 -13.022 1.00 0.00 C ATOM 0 H LEU A 82 -2.389 7.563 -16.522 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.064 8.059 -15.003 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.165 5.374 -15.966 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.123 5.619 -14.578 1.00 0.00 H new ATOM 0 HG LEU A 82 -2.812 7.032 -14.858 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -3.717 5.283 -13.354 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -3.161 4.579 -14.892 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -2.164 4.417 -13.427 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -2.554 7.280 -12.402 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.001 6.414 -12.478 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -1.175 8.001 -13.265 1.00 0.00 H new ATOM 1187 N ASN A 83 0.521 6.847 -17.979 1.00 0.00 N ATOM 1188 CA ASN A 83 1.625 6.546 -18.932 1.00 0.00 C ATOM 1189 C ASN A 83 2.482 7.798 -19.128 1.00 0.00 C ATOM 1190 O ASN A 83 3.691 7.726 -19.223 1.00 0.00 O ATOM 1191 CB ASN A 83 1.035 6.114 -20.276 1.00 0.00 C ATOM 1192 CG ASN A 83 2.167 5.757 -21.240 1.00 0.00 C ATOM 1193 OD1 ASN A 83 3.325 5.969 -20.940 1.00 0.00 O ATOM 1194 ND2 ASN A 83 1.880 5.218 -22.394 1.00 0.00 N ATOM 0 H ASN A 83 -0.415 6.850 -18.385 1.00 0.00 H new ATOM 0 HA ASN A 83 2.243 5.742 -18.533 1.00 0.00 H new ATOM 0 HB2 ASN A 83 0.377 5.256 -20.137 1.00 0.00 H new ATOM 0 HB3 ASN A 83 0.428 6.917 -20.693 1.00 0.00 H new ATOM 0 HD21 ASN A 83 2.628 4.975 -23.043 1.00 0.00 H new ATOM 0 HD22 ASN A 83 0.908 5.040 -22.646 1.00 0.00 H new ATOM 1201 N GLU A 84 1.864 8.945 -19.189 1.00 0.00 N ATOM 1202 CA GLU A 84 2.639 10.202 -19.378 1.00 0.00 C ATOM 1203 C GLU A 84 3.375 10.547 -18.082 1.00 0.00 C ATOM 1204 O GLU A 84 4.397 11.206 -18.093 1.00 0.00 O ATOM 1205 CB GLU A 84 1.681 11.341 -19.737 1.00 0.00 C ATOM 1206 CG GLU A 84 2.416 12.381 -20.583 1.00 0.00 C ATOM 1207 CD GLU A 84 2.008 13.785 -20.133 1.00 0.00 C ATOM 1208 OE1 GLU A 84 1.378 13.893 -19.094 1.00 0.00 O ATOM 1209 OE2 GLU A 84 2.332 14.728 -20.836 1.00 0.00 O ATOM 0 H GLU A 84 0.854 9.066 -19.116 1.00 0.00 H new ATOM 0 HA GLU A 84 3.362 10.066 -20.182 1.00 0.00 H new ATOM 0 HB2 GLU A 84 0.825 10.950 -20.286 1.00 0.00 H new ATOM 0 HB3 GLU A 84 1.293 11.804 -18.829 1.00 0.00 H new ATOM 0 HG2 GLU A 84 3.494 12.253 -20.480 1.00 0.00 H new ATOM 0 HG3 GLU A 84 2.178 12.242 -21.638 1.00 0.00 H new ATOM 1216 N LEU A 85 2.865 10.110 -16.963 1.00 0.00 N ATOM 1217 CA LEU A 85 3.536 10.415 -15.668 1.00 0.00 C ATOM 1218 C LEU A 85 4.824 9.598 -15.554 1.00 0.00 C ATOM 1219 O LEU A 85 5.821 10.062 -15.038 1.00 0.00 O ATOM 1220 CB LEU A 85 2.601 10.057 -14.510 1.00 0.00 C ATOM 1221 CG LEU A 85 2.515 11.237 -13.539 1.00 0.00 C ATOM 1222 CD1 LEU A 85 1.170 11.200 -12.810 1.00 0.00 C ATOM 1223 CD2 LEU A 85 3.649 11.138 -12.516 1.00 0.00 C ATOM 0 H LEU A 85 2.012 9.555 -16.890 1.00 0.00 H new ATOM 0 HA LEU A 85 3.775 11.478 -15.626 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.609 9.813 -14.891 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.970 9.172 -13.991 1.00 0.00 H new ATOM 0 HG LEU A 85 2.604 12.171 -14.094 1.00 0.00 H new ATOM 0 HD11 LEU A 85 1.108 12.040 -12.118 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.360 11.268 -13.537 1.00 0.00 H new ATOM 0 HD13 LEU A 85 1.082 10.266 -12.255 1.00 0.00 H new ATOM 0 HD21 LEU A 85 3.589 11.978 -11.824 1.00 0.00 H new ATOM 0 HD22 LEU A 85 3.559 10.204 -11.962 1.00 0.00 H new ATOM 0 HD23 LEU A 85 4.608 11.162 -13.033 1.00 0.00 H new ATOM 1235 N GLY A 86 4.811 8.383 -16.030 1.00 0.00 N ATOM 1236 CA GLY A 86 6.036 7.537 -15.946 1.00 0.00 C ATOM 1237 C GLY A 86 5.851 6.479 -14.856 1.00 0.00 C ATOM 1238 O GLY A 86 6.790 5.830 -14.441 1.00 0.00 O ATOM 0 H GLY A 86 4.006 7.940 -16.473 1.00 0.00 H new ATOM 0 HA2 GLY A 86 6.226 7.056 -16.906 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.904 8.157 -15.723 1.00 0.00 H new ATOM 1242 N ILE A 87 4.645 6.302 -14.388 1.00 0.00 N ATOM 1243 CA ILE A 87 4.399 5.286 -13.325 1.00 0.00 C ATOM 1244 C ILE A 87 4.182 3.914 -13.966 1.00 0.00 C ATOM 1245 O ILE A 87 4.032 3.796 -15.166 1.00 0.00 O ATOM 1246 CB ILE A 87 3.152 5.676 -12.528 1.00 0.00 C ATOM 1247 CG1 ILE A 87 3.230 7.157 -12.148 1.00 0.00 C ATOM 1248 CG2 ILE A 87 3.072 4.829 -11.257 1.00 0.00 C ATOM 1249 CD1 ILE A 87 1.850 7.796 -12.308 1.00 0.00 C ATOM 0 H ILE A 87 3.820 6.817 -14.696 1.00 0.00 H new ATOM 0 HA ILE A 87 5.261 5.243 -12.659 1.00 0.00 H new ATOM 0 HB ILE A 87 2.265 5.503 -13.137 1.00 0.00 H new ATOM 0 HG12 ILE A 87 3.574 7.262 -11.119 1.00 0.00 H new ATOM 0 HG13 ILE A 87 3.955 7.668 -12.781 1.00 0.00 H new ATOM 0 HG21 ILE A 87 2.184 5.107 -10.690 1.00 0.00 H new ATOM 0 HG22 ILE A 87 3.015 3.774 -11.526 1.00 0.00 H new ATOM 0 HG23 ILE A 87 3.960 5.001 -10.648 1.00 0.00 H new ATOM 0 HD11 ILE A 87 1.904 8.851 -12.038 1.00 0.00 H new ATOM 0 HD12 ILE A 87 1.524 7.703 -13.344 1.00 0.00 H new ATOM 0 HD13 ILE A 87 1.137 7.290 -11.656 1.00 0.00 H new ATOM 1261 N LYS A 88 4.161 2.875 -13.175 1.00 0.00 N ATOM 1262 CA LYS A 88 3.950 1.512 -13.739 1.00 0.00 C ATOM 1263 C LYS A 88 2.484 1.112 -13.557 1.00 0.00 C ATOM 1264 O LYS A 88 1.964 1.109 -12.458 1.00 0.00 O ATOM 1265 CB LYS A 88 4.848 0.512 -13.005 1.00 0.00 C ATOM 1266 CG LYS A 88 6.295 0.691 -13.469 1.00 0.00 C ATOM 1267 CD LYS A 88 7.071 1.497 -12.424 1.00 0.00 C ATOM 1268 CE LYS A 88 8.167 0.622 -11.814 1.00 0.00 C ATOM 1269 NZ LYS A 88 9.475 1.331 -11.902 1.00 0.00 N ATOM 0 H LYS A 88 4.281 2.912 -12.163 1.00 0.00 H new ATOM 0 HA LYS A 88 4.200 1.512 -14.800 1.00 0.00 H new ATOM 0 HB2 LYS A 88 4.778 0.666 -11.928 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.514 -0.507 -13.203 1.00 0.00 H new ATOM 0 HG2 LYS A 88 6.764 -0.282 -13.615 1.00 0.00 H new ATOM 0 HG3 LYS A 88 6.319 1.204 -14.430 1.00 0.00 H new ATOM 0 HD2 LYS A 88 7.511 2.381 -12.885 1.00 0.00 H new ATOM 0 HD3 LYS A 88 6.395 1.847 -11.644 1.00 0.00 H new ATOM 0 HE2 LYS A 88 7.932 0.398 -10.773 1.00 0.00 H new ATOM 0 HE3 LYS A 88 8.222 -0.331 -12.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 10.221 0.736 -11.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 9.700 1.523 -12.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 9.419 2.229 -11.381 1.00 0.00 H new ATOM 1283 N ILE A 89 1.811 0.778 -14.624 1.00 0.00 N ATOM 1284 CA ILE A 89 0.379 0.386 -14.504 1.00 0.00 C ATOM 1285 C ILE A 89 0.266 -1.136 -14.408 1.00 0.00 C ATOM 1286 O ILE A 89 1.181 -1.861 -14.748 1.00 0.00 O ATOM 1287 CB ILE A 89 -0.390 0.879 -15.732 1.00 0.00 C ATOM 1288 CG1 ILE A 89 0.209 2.204 -16.211 1.00 0.00 C ATOM 1289 CG2 ILE A 89 -1.858 1.090 -15.363 1.00 0.00 C ATOM 1290 CD1 ILE A 89 -0.711 2.831 -17.260 1.00 0.00 C ATOM 0 H ILE A 89 2.190 0.760 -15.571 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.043 0.835 -13.605 1.00 0.00 H new ATOM 0 HB ILE A 89 -0.317 0.137 -16.528 1.00 0.00 H new ATOM 0 HG12 ILE A 89 0.334 2.884 -15.369 1.00 0.00 H new ATOM 0 HG13 ILE A 89 1.199 2.036 -16.634 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.406 1.441 -16.237 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -2.286 0.148 -15.021 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.930 1.832 -14.568 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -0.284 3.774 -17.601 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -0.813 2.152 -18.107 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -1.692 3.014 -16.821 1.00 0.00 H new ATOM 1302 N TYR A 90 -0.850 -1.628 -13.941 1.00 0.00 N ATOM 1303 CA TYR A 90 -1.028 -3.102 -13.817 1.00 0.00 C ATOM 1304 C TYR A 90 -2.501 -3.457 -14.031 1.00 0.00 C ATOM 1305 O TYR A 90 -3.387 -2.829 -13.484 1.00 0.00 O ATOM 1306 CB TYR A 90 -0.595 -3.550 -12.419 1.00 0.00 C ATOM 1307 CG TYR A 90 0.609 -4.454 -12.528 1.00 0.00 C ATOM 1308 CD1 TYR A 90 0.515 -5.668 -13.223 1.00 0.00 C ATOM 1309 CD2 TYR A 90 1.822 -4.079 -11.936 1.00 0.00 C ATOM 1310 CE1 TYR A 90 1.633 -6.506 -13.324 1.00 0.00 C ATOM 1311 CE2 TYR A 90 2.940 -4.918 -12.035 1.00 0.00 C ATOM 1312 CZ TYR A 90 2.845 -6.131 -12.730 1.00 0.00 C ATOM 1313 OH TYR A 90 3.947 -6.957 -12.828 1.00 0.00 O ATOM 0 H TYR A 90 -1.648 -1.070 -13.639 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.419 -3.607 -14.567 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -0.356 -2.681 -11.805 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.413 -4.074 -11.924 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.420 -5.957 -13.681 1.00 0.00 H new ATOM 0 HD2 TYR A 90 1.896 -3.143 -11.403 1.00 0.00 H new ATOM 0 HE1 TYR A 90 1.561 -7.441 -13.860 1.00 0.00 H new ATOM 0 HE2 TYR A 90 3.874 -4.630 -11.576 1.00 0.00 H new ATOM 0 HH TYR A 90 4.746 -6.472 -12.534 1.00 0.00 H new ATOM 1323 N ARG A 91 -2.773 -4.459 -14.822 1.00 0.00 N ATOM 1324 CA ARG A 91 -4.189 -4.853 -15.069 1.00 0.00 C ATOM 1325 C ARG A 91 -4.623 -5.880 -14.021 1.00 0.00 C ATOM 1326 O ARG A 91 -4.015 -6.921 -13.870 1.00 0.00 O ATOM 1327 CB ARG A 91 -4.310 -5.467 -16.465 1.00 0.00 C ATOM 1328 CG ARG A 91 -4.307 -4.355 -17.516 1.00 0.00 C ATOM 1329 CD ARG A 91 -5.710 -4.209 -18.111 1.00 0.00 C ATOM 1330 NE ARG A 91 -5.642 -4.365 -19.593 1.00 0.00 N ATOM 1331 CZ ARG A 91 -5.063 -3.449 -20.321 1.00 0.00 C ATOM 1332 NH1 ARG A 91 -4.796 -2.278 -19.811 1.00 0.00 N ATOM 1333 NH2 ARG A 91 -4.751 -3.704 -21.563 1.00 0.00 N ATOM 0 H ARG A 91 -2.075 -5.022 -15.308 1.00 0.00 H new ATOM 0 HA ARG A 91 -4.829 -3.973 -15.002 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -3.482 -6.153 -16.645 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -5.229 -6.049 -16.539 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -3.993 -3.414 -17.064 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -3.589 -4.586 -18.303 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -6.376 -4.960 -17.686 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -6.125 -3.234 -17.856 1.00 0.00 H new ATOM 0 HE ARG A 91 -6.048 -5.188 -20.038 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -5.040 -2.076 -18.841 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -4.344 -1.564 -20.382 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -4.960 -4.618 -21.964 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -4.299 -2.989 -22.132 1.00 0.00 H new ATOM 1347 N ALA A 92 -5.669 -5.595 -13.293 1.00 0.00 N ATOM 1348 CA ALA A 92 -6.140 -6.555 -12.254 1.00 0.00 C ATOM 1349 C ALA A 92 -6.958 -7.667 -12.913 1.00 0.00 C ATOM 1350 O ALA A 92 -8.165 -7.583 -13.021 1.00 0.00 O ATOM 1351 CB ALA A 92 -7.012 -5.816 -11.235 1.00 0.00 C ATOM 0 H ALA A 92 -6.218 -4.739 -13.373 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.278 -6.992 -11.749 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.357 -6.517 -10.475 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.429 -5.026 -10.762 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -7.872 -5.378 -11.742 1.00 0.00 H new ATOM 1357 N THR A 93 -6.311 -8.710 -13.353 1.00 0.00 N ATOM 1358 CA THR A 93 -7.052 -9.829 -14.003 1.00 0.00 C ATOM 1359 C THR A 93 -6.468 -11.164 -13.537 1.00 0.00 C ATOM 1360 O THR A 93 -6.628 -12.181 -14.182 1.00 0.00 O ATOM 1361 CB THR A 93 -6.919 -9.715 -15.524 1.00 0.00 C ATOM 1362 OG1 THR A 93 -7.225 -8.387 -15.927 1.00 0.00 O ATOM 1363 CG2 THR A 93 -7.885 -10.691 -16.196 1.00 0.00 C ATOM 0 H THR A 93 -5.301 -8.837 -13.291 1.00 0.00 H new ATOM 0 HA THR A 93 -8.105 -9.777 -13.727 1.00 0.00 H new ATOM 0 HB THR A 93 -5.898 -9.957 -15.819 1.00 0.00 H new ATOM 0 HG1 THR A 93 -7.139 -8.312 -16.900 1.00 0.00 H new ATOM 0 HG21 THR A 93 -7.790 -10.609 -17.279 1.00 0.00 H new ATOM 0 HG22 THR A 93 -7.648 -11.709 -15.887 1.00 0.00 H new ATOM 0 HG23 THR A 93 -8.907 -10.451 -15.902 1.00 0.00 H new ATOM 1371 N GLY A 94 -5.791 -11.171 -12.421 1.00 0.00 N ATOM 1372 CA GLY A 94 -5.197 -12.441 -11.916 1.00 0.00 C ATOM 1373 C GLY A 94 -6.302 -13.331 -11.342 1.00 0.00 C ATOM 1374 O GLY A 94 -6.741 -14.276 -11.969 1.00 0.00 O ATOM 0 H GLY A 94 -5.624 -10.352 -11.837 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -4.681 -12.960 -12.724 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -4.453 -12.227 -11.149 1.00 0.00 H new ATOM 1378 N THR A 95 -6.756 -13.037 -10.154 1.00 0.00 N ATOM 1379 CA THR A 95 -7.831 -13.865 -9.538 1.00 0.00 C ATOM 1380 C THR A 95 -8.520 -13.062 -8.432 1.00 0.00 C ATOM 1381 O THR A 95 -9.653 -12.646 -8.568 1.00 0.00 O ATOM 1382 CB THR A 95 -7.220 -15.136 -8.941 1.00 0.00 C ATOM 1383 OG1 THR A 95 -6.620 -15.901 -9.977 1.00 0.00 O ATOM 1384 CG2 THR A 95 -8.312 -15.962 -8.261 1.00 0.00 C ATOM 0 H THR A 95 -6.428 -12.258 -9.583 1.00 0.00 H new ATOM 0 HA THR A 95 -8.561 -14.138 -10.300 1.00 0.00 H new ATOM 0 HB THR A 95 -6.465 -14.864 -8.204 1.00 0.00 H new ATOM 0 HG1 THR A 95 -6.922 -15.567 -10.847 1.00 0.00 H new ATOM 0 HG21 THR A 95 -7.874 -16.866 -7.837 1.00 0.00 H new ATOM 0 HG22 THR A 95 -8.771 -15.374 -7.466 1.00 0.00 H new ATOM 0 HG23 THR A 95 -9.071 -16.236 -8.994 1.00 0.00 H new ATOM 1392 N SER A 96 -7.843 -12.840 -7.339 1.00 0.00 N ATOM 1393 CA SER A 96 -8.457 -12.063 -6.226 1.00 0.00 C ATOM 1394 C SER A 96 -7.469 -10.997 -5.745 1.00 0.00 C ATOM 1395 O SER A 96 -6.270 -11.184 -5.798 1.00 0.00 O ATOM 1396 CB SER A 96 -8.790 -13.006 -5.069 1.00 0.00 C ATOM 1397 OG SER A 96 -9.641 -14.043 -5.538 1.00 0.00 O ATOM 0 H SER A 96 -6.891 -13.163 -7.169 1.00 0.00 H new ATOM 0 HA SER A 96 -9.370 -11.583 -6.578 1.00 0.00 H new ATOM 0 HB2 SER A 96 -7.875 -13.430 -4.655 1.00 0.00 H new ATOM 0 HB3 SER A 96 -9.278 -12.455 -4.265 1.00 0.00 H new ATOM 0 HG SER A 96 -9.855 -14.650 -4.799 1.00 0.00 H new ATOM 1403 N VAL A 97 -7.962 -9.883 -5.279 1.00 0.00 N ATOM 1404 CA VAL A 97 -7.049 -8.807 -4.797 1.00 0.00 C ATOM 1405 C VAL A 97 -5.941 -9.424 -3.937 1.00 0.00 C ATOM 1406 O VAL A 97 -4.850 -8.898 -3.845 1.00 0.00 O ATOM 1407 CB VAL A 97 -7.843 -7.801 -3.961 1.00 0.00 C ATOM 1408 CG1 VAL A 97 -8.344 -8.474 -2.683 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -6.941 -6.620 -3.594 1.00 0.00 C ATOM 0 H VAL A 97 -8.957 -9.671 -5.211 1.00 0.00 H new ATOM 0 HA VAL A 97 -6.604 -8.298 -5.652 1.00 0.00 H new ATOM 0 HB VAL A 97 -8.696 -7.445 -4.539 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -8.909 -7.754 -2.090 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -8.987 -9.315 -2.943 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -7.494 -8.833 -2.104 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -7.505 -5.902 -2.998 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.088 -6.979 -3.018 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -6.586 -6.137 -4.504 1.00 0.00 H new ATOM 1419 N GLU A 98 -6.216 -10.531 -3.304 1.00 0.00 N ATOM 1420 CA GLU A 98 -5.180 -11.177 -2.447 1.00 0.00 C ATOM 1421 C GLU A 98 -4.029 -11.685 -3.321 1.00 0.00 C ATOM 1422 O GLU A 98 -2.877 -11.380 -3.084 1.00 0.00 O ATOM 1423 CB GLU A 98 -5.804 -12.352 -1.692 1.00 0.00 C ATOM 1424 CG GLU A 98 -4.708 -13.129 -0.959 1.00 0.00 C ATOM 1425 CD GLU A 98 -5.299 -13.795 0.287 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -6.166 -14.639 0.130 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -4.873 -13.449 1.376 1.00 0.00 O ATOM 0 H GLU A 98 -7.112 -11.016 -3.342 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.796 -10.447 -1.734 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -6.545 -11.988 -0.980 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -6.327 -13.009 -2.388 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -4.279 -13.883 -1.619 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -3.898 -12.456 -0.675 1.00 0.00 H new ATOM 1434 N GLU A 99 -4.329 -12.458 -4.330 1.00 0.00 N ATOM 1435 CA GLU A 99 -3.249 -12.985 -5.213 1.00 0.00 C ATOM 1436 C GLU A 99 -2.680 -11.844 -6.061 1.00 0.00 C ATOM 1437 O GLU A 99 -1.613 -11.954 -6.632 1.00 0.00 O ATOM 1438 CB GLU A 99 -3.824 -14.066 -6.131 1.00 0.00 C ATOM 1439 CG GLU A 99 -2.824 -15.217 -6.255 1.00 0.00 C ATOM 1440 CD GLU A 99 -3.254 -16.146 -7.392 1.00 0.00 C ATOM 1441 OE1 GLU A 99 -4.430 -16.463 -7.459 1.00 0.00 O ATOM 1442 OE2 GLU A 99 -2.399 -16.526 -8.176 1.00 0.00 O ATOM 0 H GLU A 99 -5.274 -12.747 -4.581 1.00 0.00 H new ATOM 0 HA GLU A 99 -2.455 -13.413 -4.601 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -4.769 -14.433 -5.730 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -4.036 -13.647 -7.115 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -1.825 -14.826 -6.449 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -2.773 -15.771 -5.318 1.00 0.00 H new ATOM 1449 N ASN A 100 -3.384 -10.747 -6.147 1.00 0.00 N ATOM 1450 CA ASN A 100 -2.884 -9.601 -6.957 1.00 0.00 C ATOM 1451 C ASN A 100 -1.770 -8.884 -6.190 1.00 0.00 C ATOM 1452 O ASN A 100 -0.772 -8.484 -6.757 1.00 0.00 O ATOM 1453 CB ASN A 100 -4.032 -8.623 -7.222 1.00 0.00 C ATOM 1454 CG ASN A 100 -4.665 -8.935 -8.580 1.00 0.00 C ATOM 1455 OD1 ASN A 100 -4.459 -8.127 -9.584 1.00 0.00 O flip ATOM 1456 ND2 ASN A 100 -5.357 -9.923 -8.728 1.00 0.00 N flip ATOM 0 H ASN A 100 -4.284 -10.596 -5.691 1.00 0.00 H new ATOM 0 HA ASN A 100 -2.495 -9.969 -7.906 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -4.780 -8.702 -6.433 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -3.661 -7.598 -7.208 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -5.518 -10.555 -7.944 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -5.776 -10.120 -9.637 1.00 0.00 H new ATOM 1463 N LEU A 101 -1.932 -8.721 -4.907 1.00 0.00 N ATOM 1464 CA LEU A 101 -0.882 -8.032 -4.107 1.00 0.00 C ATOM 1465 C LEU A 101 0.429 -8.813 -4.208 1.00 0.00 C ATOM 1466 O LEU A 101 1.481 -8.252 -4.451 1.00 0.00 O ATOM 1467 CB LEU A 101 -1.323 -7.962 -2.643 1.00 0.00 C ATOM 1468 CG LEU A 101 -0.153 -7.493 -1.778 1.00 0.00 C ATOM 1469 CD1 LEU A 101 0.147 -6.023 -2.077 1.00 0.00 C ATOM 1470 CD2 LEU A 101 -0.522 -7.646 -0.301 1.00 0.00 C ATOM 0 H LEU A 101 -2.746 -9.035 -4.378 1.00 0.00 H new ATOM 0 HA LEU A 101 -0.734 -7.023 -4.491 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -2.164 -7.276 -2.538 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -1.666 -8.941 -2.309 1.00 0.00 H new ATOM 0 HG LEU A 101 0.728 -8.095 -2.000 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.981 -5.689 -1.460 1.00 0.00 H new ATOM 0 HD12 LEU A 101 0.407 -5.911 -3.130 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -0.733 -5.420 -1.855 1.00 0.00 H new ATOM 0 HD21 LEU A 101 0.310 -7.312 0.318 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -1.402 -7.042 -0.082 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -0.737 -8.693 -0.086 1.00 0.00 H new ATOM 1482 N LYS A 102 0.378 -10.104 -4.023 1.00 0.00 N ATOM 1483 CA LYS A 102 1.621 -10.921 -4.110 1.00 0.00 C ATOM 1484 C LYS A 102 1.999 -11.118 -5.580 1.00 0.00 C ATOM 1485 O LYS A 102 3.129 -11.423 -5.905 1.00 0.00 O ATOM 1486 CB LYS A 102 1.381 -12.285 -3.457 1.00 0.00 C ATOM 1487 CG LYS A 102 0.164 -12.953 -4.100 1.00 0.00 C ATOM 1488 CD LYS A 102 0.392 -14.464 -4.178 1.00 0.00 C ATOM 1489 CE LYS A 102 0.102 -15.095 -2.815 1.00 0.00 C ATOM 1490 NZ LYS A 102 1.386 -15.336 -2.097 1.00 0.00 N ATOM 0 H LYS A 102 -0.472 -10.628 -3.815 1.00 0.00 H new ATOM 0 HA LYS A 102 2.431 -10.408 -3.592 1.00 0.00 H new ATOM 0 HB2 LYS A 102 2.261 -12.917 -3.576 1.00 0.00 H new ATOM 0 HB3 LYS A 102 1.219 -12.164 -2.386 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -0.732 -12.739 -3.517 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.001 -12.548 -5.098 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -0.255 -14.901 -4.938 1.00 0.00 H new ATOM 0 HD3 LYS A 102 1.420 -14.673 -4.476 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -0.538 -14.438 -2.227 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -0.437 -16.034 -2.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 1.195 -15.826 -1.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 2.009 -15.924 -2.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 1.851 -14.426 -1.902 1.00 0.00 H new ATOM 1504 N LEU A 103 1.060 -10.951 -6.469 1.00 0.00 N ATOM 1505 CA LEU A 103 1.363 -11.132 -7.918 1.00 0.00 C ATOM 1506 C LEU A 103 2.313 -10.027 -8.388 1.00 0.00 C ATOM 1507 O LEU A 103 3.257 -10.276 -9.110 1.00 0.00 O ATOM 1508 CB LEU A 103 0.064 -11.060 -8.721 1.00 0.00 C ATOM 1509 CG LEU A 103 -0.462 -12.474 -8.967 1.00 0.00 C ATOM 1510 CD1 LEU A 103 -1.918 -12.403 -9.429 1.00 0.00 C ATOM 1511 CD2 LEU A 103 0.384 -13.151 -10.047 1.00 0.00 C ATOM 0 H LEU A 103 0.095 -10.697 -6.256 1.00 0.00 H new ATOM 0 HA LEU A 103 1.835 -12.103 -8.070 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.678 -10.473 -8.180 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.239 -10.555 -9.671 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.402 -13.050 -8.044 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.294 -13.411 -9.605 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -2.521 -11.920 -8.660 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.979 -11.827 -10.352 1.00 0.00 H new ATOM 0 HD21 LEU A 103 0.010 -14.159 -10.223 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.324 -12.575 -10.970 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.422 -13.201 -9.718 1.00 0.00 H new ATOM 1523 N PHE A 104 2.069 -8.810 -7.988 1.00 0.00 N ATOM 1524 CA PHE A 104 2.958 -7.693 -8.415 1.00 0.00 C ATOM 1525 C PHE A 104 4.377 -7.947 -7.903 1.00 0.00 C ATOM 1526 O PHE A 104 5.348 -7.527 -8.502 1.00 0.00 O ATOM 1527 CB PHE A 104 2.434 -6.378 -7.836 1.00 0.00 C ATOM 1528 CG PHE A 104 3.462 -5.289 -8.039 1.00 0.00 C ATOM 1529 CD1 PHE A 104 4.593 -5.232 -7.215 1.00 0.00 C ATOM 1530 CD2 PHE A 104 3.282 -4.336 -9.050 1.00 0.00 C ATOM 1531 CE1 PHE A 104 5.547 -4.223 -7.403 1.00 0.00 C ATOM 1532 CE2 PHE A 104 4.236 -3.326 -9.238 1.00 0.00 C ATOM 1533 CZ PHE A 104 5.368 -3.269 -8.414 1.00 0.00 C ATOM 0 H PHE A 104 1.293 -8.540 -7.384 1.00 0.00 H new ATOM 0 HA PHE A 104 2.971 -7.632 -9.503 1.00 0.00 H new ATOM 0 HB2 PHE A 104 1.498 -6.103 -8.321 1.00 0.00 H new ATOM 0 HB3 PHE A 104 2.220 -6.496 -6.774 1.00 0.00 H new ATOM 0 HD1 PHE A 104 4.730 -5.966 -6.435 1.00 0.00 H new ATOM 0 HD2 PHE A 104 2.409 -4.379 -9.684 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.420 -4.180 -6.769 1.00 0.00 H new ATOM 0 HE2 PHE A 104 4.098 -2.592 -10.018 1.00 0.00 H new ATOM 0 HZ PHE A 104 6.102 -2.490 -8.558 1.00 0.00 H new ATOM 1543 N THR A 105 4.507 -8.631 -6.800 1.00 0.00 N ATOM 1544 CA THR A 105 5.863 -8.909 -6.251 1.00 0.00 C ATOM 1545 C THR A 105 6.657 -9.753 -7.250 1.00 0.00 C ATOM 1546 O THR A 105 7.835 -9.539 -7.460 1.00 0.00 O ATOM 1547 CB THR A 105 5.731 -9.672 -4.932 1.00 0.00 C ATOM 1548 OG1 THR A 105 4.985 -8.892 -4.008 1.00 0.00 O ATOM 1549 CG2 THR A 105 7.121 -9.952 -4.361 1.00 0.00 C ATOM 0 H THR A 105 3.732 -9.009 -6.255 1.00 0.00 H new ATOM 0 HA THR A 105 6.384 -7.967 -6.077 1.00 0.00 H new ATOM 0 HB THR A 105 5.217 -10.617 -5.108 1.00 0.00 H new ATOM 0 HG1 THR A 105 4.898 -9.380 -3.163 1.00 0.00 H new ATOM 0 HG21 THR A 105 7.026 -10.496 -3.421 1.00 0.00 H new ATOM 0 HG22 THR A 105 7.692 -10.551 -5.070 1.00 0.00 H new ATOM 0 HG23 THR A 105 7.638 -9.009 -4.184 1.00 0.00 H new ATOM 1557 N GLU A 106 6.024 -10.712 -7.868 1.00 0.00 N ATOM 1558 CA GLU A 106 6.743 -11.570 -8.852 1.00 0.00 C ATOM 1559 C GLU A 106 6.682 -10.927 -10.240 1.00 0.00 C ATOM 1560 O GLU A 106 7.154 -11.483 -11.212 1.00 0.00 O ATOM 1561 CB GLU A 106 6.084 -12.948 -8.901 1.00 0.00 C ATOM 1562 CG GLU A 106 5.844 -13.452 -7.476 1.00 0.00 C ATOM 1563 CD GLU A 106 7.183 -13.830 -6.838 1.00 0.00 C ATOM 1564 OE1 GLU A 106 7.636 -14.937 -7.069 1.00 0.00 O ATOM 1565 OE2 GLU A 106 7.731 -13.002 -6.128 1.00 0.00 O ATOM 0 H GLU A 106 5.039 -10.939 -7.734 1.00 0.00 H new ATOM 0 HA GLU A 106 7.785 -11.673 -8.548 1.00 0.00 H new ATOM 0 HB2 GLU A 106 5.139 -12.892 -9.442 1.00 0.00 H new ATOM 0 HB3 GLU A 106 6.720 -13.648 -9.443 1.00 0.00 H new ATOM 0 HG2 GLU A 106 5.351 -12.681 -6.884 1.00 0.00 H new ATOM 0 HG3 GLU A 106 5.179 -14.316 -7.491 1.00 0.00 H new ATOM 1572 N GLY A 107 6.105 -9.761 -10.343 1.00 0.00 N ATOM 1573 CA GLY A 107 6.017 -9.089 -11.670 1.00 0.00 C ATOM 1574 C GLY A 107 5.596 -10.107 -12.732 1.00 0.00 C ATOM 1575 O GLY A 107 6.081 -10.094 -13.846 1.00 0.00 O ATOM 0 H GLY A 107 5.691 -9.245 -9.566 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.297 -8.272 -11.629 1.00 0.00 H new ATOM 0 HA3 GLY A 107 6.980 -8.651 -11.932 1.00 0.00 H new ATOM 1579 N ASN A 108 4.698 -10.993 -12.395 1.00 0.00 N ATOM 1580 CA ASN A 108 4.248 -12.012 -13.384 1.00 0.00 C ATOM 1581 C ASN A 108 2.873 -11.625 -13.930 1.00 0.00 C ATOM 1582 O ASN A 108 2.391 -12.197 -14.888 1.00 0.00 O ATOM 1583 CB ASN A 108 4.158 -13.379 -12.703 1.00 0.00 C ATOM 1584 CG ASN A 108 5.486 -14.121 -12.866 1.00 0.00 C ATOM 1585 OD1 ASN A 108 6.359 -14.019 -12.027 1.00 0.00 O ATOM 1586 ND2 ASN A 108 5.677 -14.867 -13.920 1.00 0.00 N ATOM 0 H ASN A 108 4.257 -11.055 -11.477 1.00 0.00 H new ATOM 0 HA ASN A 108 4.964 -12.060 -14.205 1.00 0.00 H new ATOM 0 HB2 ASN A 108 3.926 -13.255 -11.645 1.00 0.00 H new ATOM 0 HB3 ASN A 108 3.348 -13.962 -13.141 1.00 0.00 H new ATOM 0 HD21 ASN A 108 6.559 -15.365 -14.040 1.00 0.00 H new ATOM 0 HD22 ASN A 108 4.944 -14.952 -14.624 1.00 0.00 H new ATOM 1593 N LEU A 109 2.235 -10.659 -13.328 1.00 0.00 N ATOM 1594 CA LEU A 109 0.891 -10.240 -13.817 1.00 0.00 C ATOM 1595 C LEU A 109 1.045 -9.449 -15.118 1.00 0.00 C ATOM 1596 O LEU A 109 2.059 -9.521 -15.783 1.00 0.00 O ATOM 1597 CB LEU A 109 0.217 -9.361 -12.763 1.00 0.00 C ATOM 1598 CG LEU A 109 -1.124 -9.978 -12.364 1.00 0.00 C ATOM 1599 CD1 LEU A 109 -1.820 -9.071 -11.348 1.00 0.00 C ATOM 1600 CD2 LEU A 109 -2.008 -10.123 -13.605 1.00 0.00 C ATOM 0 H LEU A 109 2.585 -10.143 -12.521 1.00 0.00 H new ATOM 0 HA LEU A 109 0.279 -11.123 -13.999 1.00 0.00 H new ATOM 0 HB2 LEU A 109 0.860 -9.266 -11.888 1.00 0.00 H new ATOM 0 HB3 LEU A 109 0.064 -8.356 -13.156 1.00 0.00 H new ATOM 0 HG LEU A 109 -0.955 -10.959 -11.921 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -2.776 -9.510 -11.063 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -1.191 -8.965 -10.464 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -1.989 -8.090 -11.792 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -2.964 -10.563 -13.321 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -2.177 -9.142 -14.048 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -1.513 -10.768 -14.331 1.00 0.00 H new ATOM 1612 N GLU A 110 0.046 -8.695 -15.485 1.00 0.00 N ATOM 1613 CA GLU A 110 0.135 -7.900 -16.743 1.00 0.00 C ATOM 1614 C GLU A 110 0.608 -6.485 -16.417 1.00 0.00 C ATOM 1615 O GLU A 110 -0.079 -5.725 -15.762 1.00 0.00 O ATOM 1616 CB GLU A 110 -1.240 -7.836 -17.412 1.00 0.00 C ATOM 1617 CG GLU A 110 -2.008 -9.124 -17.118 1.00 0.00 C ATOM 1618 CD GLU A 110 -3.293 -9.154 -17.945 1.00 0.00 C ATOM 1619 OE1 GLU A 110 -3.571 -8.167 -18.608 1.00 0.00 O ATOM 1620 OE2 GLU A 110 -3.978 -10.163 -17.906 1.00 0.00 O ATOM 0 H GLU A 110 -0.828 -8.595 -14.969 1.00 0.00 H new ATOM 0 HA GLU A 110 0.844 -8.376 -17.421 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -1.797 -6.975 -17.042 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -1.127 -7.704 -18.488 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -1.390 -9.990 -17.356 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -2.246 -9.184 -16.056 1.00 0.00 H new ATOM 1627 N GLU A 111 1.775 -6.126 -16.866 1.00 0.00 N ATOM 1628 CA GLU A 111 2.296 -4.760 -16.582 1.00 0.00 C ATOM 1629 C GLU A 111 2.151 -3.886 -17.829 1.00 0.00 C ATOM 1630 O GLU A 111 2.326 -4.340 -18.942 1.00 0.00 O ATOM 1631 CB GLU A 111 3.772 -4.845 -16.189 1.00 0.00 C ATOM 1632 CG GLU A 111 4.287 -3.451 -15.826 1.00 0.00 C ATOM 1633 CD GLU A 111 5.096 -2.885 -16.995 1.00 0.00 C ATOM 1634 OE1 GLU A 111 4.874 -3.323 -18.111 1.00 0.00 O ATOM 1635 OE2 GLU A 111 5.925 -2.023 -16.754 1.00 0.00 O ATOM 0 H GLU A 111 2.393 -6.720 -17.419 1.00 0.00 H new ATOM 0 HA GLU A 111 1.727 -4.321 -15.763 1.00 0.00 H new ATOM 0 HB2 GLU A 111 3.895 -5.521 -15.343 1.00 0.00 H new ATOM 0 HB3 GLU A 111 4.355 -5.256 -17.013 1.00 0.00 H new ATOM 0 HG2 GLU A 111 3.450 -2.791 -15.596 1.00 0.00 H new ATOM 0 HG3 GLU A 111 4.908 -3.503 -14.932 1.00 0.00 H new ATOM 1642 N ILE A 112 1.831 -2.634 -17.651 1.00 0.00 N ATOM 1643 CA ILE A 112 1.676 -1.729 -18.825 1.00 0.00 C ATOM 1644 C ILE A 112 2.491 -0.456 -18.593 1.00 0.00 C ATOM 1645 O ILE A 112 2.240 0.293 -17.667 1.00 0.00 O ATOM 1646 CB ILE A 112 0.198 -1.370 -18.999 1.00 0.00 C ATOM 1647 CG1 ILE A 112 -0.642 -2.650 -18.985 1.00 0.00 C ATOM 1648 CG2 ILE A 112 -0.001 -0.646 -20.332 1.00 0.00 C ATOM 1649 CD1 ILE A 112 -0.422 -3.423 -20.287 1.00 0.00 C ATOM 0 H ILE A 112 1.670 -2.198 -16.743 1.00 0.00 H new ATOM 0 HA ILE A 112 2.034 -2.230 -19.725 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.115 -0.719 -18.183 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -0.365 -3.269 -18.132 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -1.697 -2.403 -18.871 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -1.054 -0.391 -20.454 1.00 0.00 H new ATOM 0 HG22 ILE A 112 0.597 0.265 -20.344 1.00 0.00 H new ATOM 0 HG23 ILE A 112 0.312 -1.296 -21.149 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -1.021 -4.334 -20.275 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -0.720 -2.804 -21.133 1.00 0.00 H new ATOM 0 HD13 ILE A 112 0.632 -3.683 -20.382 1.00 0.00 H new ATOM 1661 N ARG A 113 3.468 -0.203 -19.422 1.00 0.00 N ATOM 1662 CA ARG A 113 4.300 1.019 -19.245 1.00 0.00 C ATOM 1663 C ARG A 113 5.392 1.057 -20.317 1.00 0.00 C ATOM 1664 O ARG A 113 6.557 0.852 -20.035 1.00 0.00 O ATOM 1665 CB ARG A 113 4.949 0.994 -17.859 1.00 0.00 C ATOM 1666 CG ARG A 113 5.657 2.323 -17.600 1.00 0.00 C ATOM 1667 CD ARG A 113 7.094 2.057 -17.147 1.00 0.00 C ATOM 1668 NE ARG A 113 7.668 3.298 -16.558 1.00 0.00 N ATOM 1669 CZ ARG A 113 8.379 4.103 -17.300 1.00 0.00 C ATOM 1670 NH1 ARG A 113 8.028 4.331 -18.536 1.00 0.00 N ATOM 1671 NH2 ARG A 113 9.439 4.680 -16.805 1.00 0.00 N ATOM 0 H ARG A 113 3.725 -0.791 -20.215 1.00 0.00 H new ATOM 0 HA ARG A 113 3.670 1.903 -19.339 1.00 0.00 H new ATOM 0 HB2 ARG A 113 4.192 0.819 -17.095 1.00 0.00 H new ATOM 0 HB3 ARG A 113 5.662 0.172 -17.795 1.00 0.00 H new ATOM 0 HG2 ARG A 113 5.656 2.930 -18.505 1.00 0.00 H new ATOM 0 HG3 ARG A 113 5.123 2.889 -16.837 1.00 0.00 H new ATOM 0 HD2 ARG A 113 7.112 1.252 -16.413 1.00 0.00 H new ATOM 0 HD3 ARG A 113 7.699 1.730 -17.993 1.00 0.00 H new ATOM 0 HE ARG A 113 7.506 3.519 -15.576 1.00 0.00 H new ATOM 0 HH11 ARG A 113 7.198 3.880 -18.922 1.00 0.00 H new ATOM 0 HH12 ARG A 113 8.583 4.960 -19.116 1.00 0.00 H new ATOM 0 HH21 ARG A 113 9.712 4.502 -15.838 1.00 0.00 H new ATOM 0 HH22 ARG A 113 9.995 5.309 -17.384 1.00 0.00 H new