USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 753 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 1 MET CE :methyl -125:sc= 0 (180deg=-0.0536) USER MOD Single : A 3 THR OG1 : rot -31:sc= 0.068 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 157:sc= 0.00646 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -4 SER OG : rot 9:sc= 1.19 USER MOD Single : A -5 SER OG : rot 180:sc= 0 USER MOD Single : A -6 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 HIS : no HD1:sc= -3.14! C(o=-3.1!,f=-5.7!) USER MOD Single : A 33 THR OG1 : rot 141:sc= -0.0373 USER MOD Single : A 36 GLN :FLIP amide:sc= -3.35! C(o=-4.1!,f=-3.3!) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot -150:sc= -0.0399 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 HIS : no HD1:sc= -4.37! C(o=-4.4!,f=-10!) USER MOD Single : A 66 ASN :FLIP amide:sc= -0.409 F(o=-1.2,f=-0.41) USER MOD Single : A 67 MET CE :methyl 176:sc= -3.29! (180deg=-3.69!) USER MOD Single : A 68 ASN :FLIP amide:sc= -0.247 F(o=-2.2,f=-0.25) USER MOD Single : A 70 SER OG : rot -150:sc= -0.0286 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.215 K(o=-0.22,f=-0.73) USER MOD Single : A 83 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0165) USER MOD Single : A 85 MET CE :methyl 144:sc= -1.22 (180deg=-2.61!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= -0.172 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -6 -11.377 -16.456 28.326 1.00 0.00 N ATOM 2 CA GLY A -6 -10.751 -15.404 27.546 1.00 0.00 C ATOM 3 C GLY A -6 -11.202 -15.408 26.099 1.00 0.00 C ATOM 4 O GLY A -6 -10.496 -15.908 25.223 1.00 0.00 O ATOM 0 H1 GLY A -6 -11.036 -16.410 29.307 1.00 0.00 H new ATOM 0 H2 GLY A -6 -12.409 -16.331 28.312 1.00 0.00 H new ATOM 0 H3 GLY A -6 -11.135 -17.382 27.918 1.00 0.00 H new ATOM 0 HA2 GLY A -6 -10.983 -14.437 27.993 1.00 0.00 H new ATOM 0 HA3 GLY A -6 -9.668 -15.522 27.586 1.00 0.00 H new ATOM 8 N SER A -5 -12.381 -14.850 25.847 1.00 0.00 N ATOM 9 CA SER A -5 -12.928 -14.796 24.496 1.00 0.00 C ATOM 10 C SER A -5 -13.525 -13.423 24.206 1.00 0.00 C ATOM 11 O SER A -5 -14.021 -12.746 25.106 1.00 0.00 O ATOM 12 CB SER A -5 -13.995 -15.877 24.311 1.00 0.00 C ATOM 13 OG SER A -5 -13.477 -17.162 24.612 1.00 0.00 O ATOM 0 H SER A -5 -12.976 -14.429 26.560 1.00 0.00 H new ATOM 0 HA SER A -5 -12.114 -14.975 23.794 1.00 0.00 H new ATOM 0 HB2 SER A -5 -14.848 -15.665 24.956 1.00 0.00 H new ATOM 0 HB3 SER A -5 -14.360 -15.860 23.284 1.00 0.00 H new ATOM 0 HG SER A -5 -14.179 -17.835 24.488 1.00 0.00 H new ATOM 19 N SER A -4 -13.472 -13.017 22.941 1.00 0.00 N ATOM 20 CA SER A -4 -14.003 -11.722 22.531 1.00 0.00 C ATOM 21 C SER A -4 -14.180 -11.662 21.017 1.00 0.00 C ATOM 22 O SER A -4 -13.517 -12.384 20.274 1.00 0.00 O ATOM 23 CB SER A -4 -13.074 -10.597 22.991 1.00 0.00 C ATOM 24 OG SER A -4 -13.255 -10.317 24.368 1.00 0.00 O ATOM 0 H SER A -4 -13.067 -13.566 22.183 1.00 0.00 H new ATOM 0 HA SER A -4 -14.979 -11.593 22.999 1.00 0.00 H new ATOM 0 HB2 SER A -4 -12.037 -10.879 22.807 1.00 0.00 H new ATOM 0 HB3 SER A -4 -13.268 -9.698 22.405 1.00 0.00 H new ATOM 0 HG SER A -4 -13.838 -10.997 24.766 1.00 0.00 H new ATOM 30 N GLY A -3 -15.083 -10.796 20.567 1.00 0.00 N ATOM 31 CA GLY A -3 -15.333 -10.657 19.144 1.00 0.00 C ATOM 32 C GLY A -3 -16.536 -9.784 18.849 1.00 0.00 C ATOM 33 O GLY A -3 -17.510 -10.239 18.250 1.00 0.00 O ATOM 0 H GLY A -3 -15.646 -10.188 21.162 1.00 0.00 H new ATOM 0 HA2 GLY A -3 -14.452 -10.231 18.664 1.00 0.00 H new ATOM 0 HA3 GLY A -3 -15.488 -11.644 18.708 1.00 0.00 H new ATOM 37 N SER A -2 -16.470 -8.525 19.272 1.00 0.00 N ATOM 38 CA SER A -2 -17.565 -7.587 19.055 1.00 0.00 C ATOM 39 C SER A -2 -17.142 -6.468 18.109 1.00 0.00 C ATOM 40 O SER A -2 -16.744 -5.388 18.546 1.00 0.00 O ATOM 41 CB SER A -2 -18.030 -6.996 20.387 1.00 0.00 C ATOM 42 OG SER A -2 -18.906 -7.883 21.060 1.00 0.00 O ATOM 0 H SER A -2 -15.670 -8.132 19.767 1.00 0.00 H new ATOM 0 HA SER A -2 -18.392 -8.131 18.599 1.00 0.00 H new ATOM 0 HB2 SER A -2 -17.166 -6.786 21.017 1.00 0.00 H new ATOM 0 HB3 SER A -2 -18.534 -6.046 20.211 1.00 0.00 H new ATOM 0 HG SER A -2 -19.188 -7.483 21.909 1.00 0.00 H new ATOM 48 N SER A -1 -17.230 -6.735 16.810 1.00 0.00 N ATOM 49 CA SER A -1 -16.853 -5.752 15.800 1.00 0.00 C ATOM 50 C SER A -1 -18.032 -5.432 14.886 1.00 0.00 C ATOM 51 O SER A -1 -18.778 -6.323 14.482 1.00 0.00 O ATOM 52 CB SER A -1 -15.675 -6.268 14.971 1.00 0.00 C ATOM 53 OG SER A -1 -16.110 -7.188 13.985 1.00 0.00 O ATOM 0 H SER A -1 -17.559 -7.623 16.432 1.00 0.00 H new ATOM 0 HA SER A -1 -16.555 -4.837 16.312 1.00 0.00 H new ATOM 0 HB2 SER A -1 -15.168 -5.430 14.493 1.00 0.00 H new ATOM 0 HB3 SER A -1 -14.948 -6.748 15.626 1.00 0.00 H new ATOM 0 HG SER A -1 -15.339 -7.502 13.468 1.00 0.00 H new ATOM 59 N GLY A 0 -18.193 -4.152 14.564 1.00 0.00 N ATOM 60 CA GLY A 0 -19.282 -3.736 13.701 1.00 0.00 C ATOM 61 C GLY A 0 -20.178 -2.703 14.355 1.00 0.00 C ATOM 62 O GLY A 0 -21.249 -3.033 14.862 1.00 0.00 O ATOM 0 H GLY A 0 -17.588 -3.396 14.886 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -18.873 -3.325 12.778 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -19.877 -4.607 13.427 1.00 0.00 H new ATOM 66 N MET A 1 -19.738 -1.449 14.344 1.00 0.00 N ATOM 67 CA MET A 1 -20.508 -0.364 14.942 1.00 0.00 C ATOM 68 C MET A 1 -20.914 0.660 13.887 1.00 0.00 C ATOM 69 O MET A 1 -22.098 0.844 13.610 1.00 0.00 O ATOM 70 CB MET A 1 -19.698 0.317 16.046 1.00 0.00 C ATOM 71 CG MET A 1 -20.493 1.340 16.841 1.00 0.00 C ATOM 72 SD MET A 1 -19.450 2.619 17.568 1.00 0.00 S ATOM 73 CE MET A 1 -19.123 3.644 16.136 1.00 0.00 C ATOM 0 H MET A 1 -18.853 -1.159 13.928 1.00 0.00 H new ATOM 0 HA MET A 1 -21.413 -0.790 15.376 1.00 0.00 H new ATOM 0 HB2 MET A 1 -19.317 -0.444 16.727 1.00 0.00 H new ATOM 0 HB3 MET A 1 -18.833 0.808 15.600 1.00 0.00 H new ATOM 0 HG2 MET A 1 -21.232 1.806 16.189 1.00 0.00 H new ATOM 0 HG3 MET A 1 -21.043 0.831 17.633 1.00 0.00 H new ATOM 0 HE1 MET A 1 -18.046 3.753 16.005 1.00 0.00 H new ATOM 0 HE2 MET A 1 -19.551 3.177 15.249 1.00 0.00 H new ATOM 0 HE3 MET A 1 -19.572 4.626 16.281 1.00 0.00 H new ATOM 83 N ALA A 2 -19.922 1.325 13.302 1.00 0.00 N ATOM 84 CA ALA A 2 -20.176 2.330 12.277 1.00 0.00 C ATOM 85 C ALA A 2 -21.252 1.860 11.303 1.00 0.00 C ATOM 86 O ALA A 2 -21.250 0.708 10.868 1.00 0.00 O ATOM 87 CB ALA A 2 -18.892 2.658 11.530 1.00 0.00 C ATOM 0 H ALA A 2 -18.936 1.186 13.521 1.00 0.00 H new ATOM 0 HA ALA A 2 -20.537 3.233 12.769 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -19.096 3.410 10.768 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -18.152 3.044 12.231 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -18.506 1.756 11.055 1.00 0.00 H new ATOM 93 N THR A 3 -22.170 2.759 10.964 1.00 0.00 N ATOM 94 CA THR A 3 -23.253 2.436 10.043 1.00 0.00 C ATOM 95 C THR A 3 -22.747 2.353 8.607 1.00 0.00 C ATOM 96 O THR A 3 -23.413 1.796 7.734 1.00 0.00 O ATOM 97 CB THR A 3 -24.384 3.479 10.117 1.00 0.00 C ATOM 98 OG1 THR A 3 -25.421 3.145 9.188 1.00 0.00 O ATOM 99 CG2 THR A 3 -23.855 4.873 9.814 1.00 0.00 C ATOM 0 H THR A 3 -22.185 3.717 11.313 1.00 0.00 H new ATOM 0 HA THR A 3 -23.645 1.465 10.344 1.00 0.00 H new ATOM 0 HB THR A 3 -24.788 3.472 11.129 1.00 0.00 H new ATOM 0 HG1 THR A 3 -25.031 2.696 8.410 1.00 0.00 H new ATOM 0 HG21 THR A 3 -24.672 5.593 9.872 1.00 0.00 H new ATOM 0 HG22 THR A 3 -23.087 5.137 10.541 1.00 0.00 H new ATOM 0 HG23 THR A 3 -23.427 4.890 8.812 1.00 0.00 H new ATOM 107 N THR A 4 -21.563 2.910 8.369 1.00 0.00 N ATOM 108 CA THR A 4 -20.968 2.900 7.039 1.00 0.00 C ATOM 109 C THR A 4 -19.924 1.796 6.912 1.00 0.00 C ATOM 110 O THR A 4 -18.769 1.971 7.301 1.00 0.00 O ATOM 111 CB THR A 4 -20.311 4.252 6.706 1.00 0.00 C ATOM 112 OG1 THR A 4 -21.286 5.299 6.765 1.00 0.00 O ATOM 113 CG2 THR A 4 -19.676 4.221 5.324 1.00 0.00 C ATOM 0 H THR A 4 -20.998 3.373 9.080 1.00 0.00 H new ATOM 0 HA THR A 4 -21.777 2.715 6.333 1.00 0.00 H new ATOM 0 HB THR A 4 -19.530 4.441 7.443 1.00 0.00 H new ATOM 0 HG1 THR A 4 -20.859 6.156 6.554 1.00 0.00 H new ATOM 0 HG21 THR A 4 -19.219 5.187 5.112 1.00 0.00 H new ATOM 0 HG22 THR A 4 -18.913 3.443 5.292 1.00 0.00 H new ATOM 0 HG23 THR A 4 -20.441 4.010 4.577 1.00 0.00 H new ATOM 121 N LYS A 5 -20.337 0.657 6.365 1.00 0.00 N ATOM 122 CA LYS A 5 -19.438 -0.476 6.185 1.00 0.00 C ATOM 123 C LYS A 5 -18.909 -0.529 4.755 1.00 0.00 C ATOM 124 O LYS A 5 -18.734 -1.607 4.188 1.00 0.00 O ATOM 125 CB LYS A 5 -20.158 -1.784 6.522 1.00 0.00 C ATOM 126 CG LYS A 5 -20.283 -2.042 8.013 1.00 0.00 C ATOM 127 CD LYS A 5 -21.537 -1.405 8.587 1.00 0.00 C ATOM 128 CE LYS A 5 -22.780 -2.209 8.240 1.00 0.00 C ATOM 129 NZ LYS A 5 -24.029 -1.448 8.519 1.00 0.00 N ATOM 0 H LYS A 5 -21.290 0.495 6.039 1.00 0.00 H new ATOM 0 HA LYS A 5 -18.593 -0.348 6.862 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -21.154 -1.765 6.080 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -19.621 -2.614 6.062 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -20.303 -3.116 8.197 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -19.406 -1.647 8.526 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -21.444 -1.327 9.670 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -21.640 -0.390 8.202 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -22.751 -2.485 7.186 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -22.784 -3.136 8.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -24.804 -1.828 7.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -24.274 -1.539 9.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -23.883 -0.445 8.288 1.00 0.00 H new ATOM 143 N ARG A 6 -18.655 0.642 4.180 1.00 0.00 N ATOM 144 CA ARG A 6 -18.145 0.728 2.816 1.00 0.00 C ATOM 145 C ARG A 6 -16.625 0.861 2.811 1.00 0.00 C ATOM 146 O ARG A 6 -15.941 0.256 1.986 1.00 0.00 O ATOM 147 CB ARG A 6 -18.774 1.918 2.089 1.00 0.00 C ATOM 148 CG ARG A 6 -20.194 1.659 1.611 1.00 0.00 C ATOM 149 CD ARG A 6 -20.990 2.950 1.503 1.00 0.00 C ATOM 150 NE ARG A 6 -22.140 2.811 0.615 1.00 0.00 N ATOM 151 CZ ARG A 6 -22.053 2.833 -0.711 1.00 0.00 C ATOM 152 NH1 ARG A 6 -20.874 2.988 -1.298 1.00 0.00 N ATOM 153 NH2 ARG A 6 -23.146 2.700 -1.451 1.00 0.00 N ATOM 0 H ARG A 6 -18.794 1.544 4.637 1.00 0.00 H new ATOM 0 HA ARG A 6 -18.413 -0.191 2.295 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -18.776 2.780 2.756 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -18.153 2.179 1.232 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -20.168 1.164 0.640 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -20.693 0.979 2.302 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -21.331 3.249 2.494 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -20.342 3.746 1.135 1.00 0.00 H new ATOM 0 HE ARG A 6 -23.061 2.690 1.035 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -20.032 3.091 -0.732 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -20.809 3.005 -2.316 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -24.054 2.581 -1.002 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -23.078 2.717 -2.469 1.00 0.00 H new ATOM 167 N VAL A 7 -16.103 1.658 3.739 1.00 0.00 N ATOM 168 CA VAL A 7 -14.664 1.870 3.842 1.00 0.00 C ATOM 169 C VAL A 7 -14.010 0.791 4.697 1.00 0.00 C ATOM 170 O VAL A 7 -14.237 0.717 5.906 1.00 0.00 O ATOM 171 CB VAL A 7 -14.342 3.251 4.442 1.00 0.00 C ATOM 172 CG1 VAL A 7 -12.838 3.437 4.577 1.00 0.00 C ATOM 173 CG2 VAL A 7 -14.951 4.356 3.593 1.00 0.00 C ATOM 0 H VAL A 7 -16.655 2.167 4.429 1.00 0.00 H new ATOM 0 HA VAL A 7 -14.263 1.820 2.830 1.00 0.00 H new ATOM 0 HB VAL A 7 -14.781 3.307 5.438 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -12.630 4.419 5.003 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -12.433 2.665 5.231 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -12.372 3.361 3.594 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -14.713 5.325 4.032 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -14.544 4.305 2.583 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -16.033 4.231 3.554 1.00 0.00 H new ATOM 183 N LEU A 8 -13.195 -0.046 4.063 1.00 0.00 N ATOM 184 CA LEU A 8 -12.506 -1.122 4.766 1.00 0.00 C ATOM 185 C LEU A 8 -11.060 -0.739 5.065 1.00 0.00 C ATOM 186 O LEU A 8 -10.433 0.000 4.305 1.00 0.00 O ATOM 187 CB LEU A 8 -12.544 -2.407 3.936 1.00 0.00 C ATOM 188 CG LEU A 8 -13.887 -2.749 3.290 1.00 0.00 C ATOM 189 CD1 LEU A 8 -13.759 -3.986 2.416 1.00 0.00 C ATOM 190 CD2 LEU A 8 -14.954 -2.955 4.356 1.00 0.00 C ATOM 0 H LEU A 8 -12.996 0.000 3.064 1.00 0.00 H new ATOM 0 HA LEU A 8 -13.020 -1.292 5.712 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -11.794 -2.330 3.149 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.249 -3.238 4.576 1.00 0.00 H new ATOM 0 HG LEU A 8 -14.188 -1.913 2.659 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -14.725 -4.214 1.965 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -13.026 -3.802 1.631 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -13.435 -4.830 3.025 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -15.903 -3.198 3.878 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -14.659 -3.773 5.013 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -15.065 -2.042 4.941 1.00 0.00 H new ATOM 202 N TYR A 9 -10.536 -1.248 6.174 1.00 0.00 N ATOM 203 CA TYR A 9 -9.163 -0.960 6.573 1.00 0.00 C ATOM 204 C TYR A 9 -8.272 -2.183 6.384 1.00 0.00 C ATOM 205 O TYR A 9 -8.562 -3.263 6.899 1.00 0.00 O ATOM 206 CB TYR A 9 -9.120 -0.504 8.033 1.00 0.00 C ATOM 207 CG TYR A 9 -7.784 -0.740 8.701 1.00 0.00 C ATOM 208 CD1 TYR A 9 -7.422 -2.006 9.146 1.00 0.00 C ATOM 209 CD2 TYR A 9 -6.885 0.302 8.888 1.00 0.00 C ATOM 210 CE1 TYR A 9 -6.203 -2.226 9.758 1.00 0.00 C ATOM 211 CE2 TYR A 9 -5.663 0.091 9.497 1.00 0.00 C ATOM 212 CZ TYR A 9 -5.327 -1.175 9.931 1.00 0.00 C ATOM 213 OH TYR A 9 -4.112 -1.390 10.539 1.00 0.00 O ATOM 0 H TYR A 9 -11.041 -1.862 6.813 1.00 0.00 H new ATOM 0 HA TYR A 9 -8.787 -0.159 5.937 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -9.358 0.559 8.080 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -9.894 -1.029 8.592 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -8.105 -2.832 9.011 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -7.146 1.295 8.551 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -5.938 -3.216 10.099 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -4.975 0.912 9.633 1.00 0.00 H new ATOM 0 HH TYR A 9 -3.614 -0.547 10.582 1.00 0.00 H new ATOM 223 N VAL A 10 -7.184 -2.005 5.641 1.00 0.00 N ATOM 224 CA VAL A 10 -6.247 -3.093 5.384 1.00 0.00 C ATOM 225 C VAL A 10 -4.900 -2.826 6.046 1.00 0.00 C ATOM 226 O VAL A 10 -4.355 -1.728 5.948 1.00 0.00 O ATOM 227 CB VAL A 10 -6.032 -3.303 3.874 1.00 0.00 C ATOM 228 CG1 VAL A 10 -5.075 -4.459 3.626 1.00 0.00 C ATOM 229 CG2 VAL A 10 -7.362 -3.542 3.174 1.00 0.00 C ATOM 0 H VAL A 10 -6.930 -1.118 5.207 1.00 0.00 H new ATOM 0 HA VAL A 10 -6.685 -3.996 5.810 1.00 0.00 H new ATOM 0 HB VAL A 10 -5.587 -2.399 3.460 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -4.936 -4.592 2.553 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -4.114 -4.242 4.093 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -5.489 -5.372 4.054 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -7.191 -3.688 2.108 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -7.838 -4.430 3.590 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -8.011 -2.679 3.322 1.00 0.00 H new ATOM 239 N GLY A 11 -4.368 -3.841 6.722 1.00 0.00 N ATOM 240 CA GLY A 11 -3.088 -3.696 7.390 1.00 0.00 C ATOM 241 C GLY A 11 -2.146 -4.845 7.093 1.00 0.00 C ATOM 242 O GLY A 11 -2.534 -5.830 6.466 1.00 0.00 O ATOM 0 H GLY A 11 -4.801 -4.760 6.818 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -2.624 -2.760 7.080 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -3.249 -3.631 8.466 1.00 0.00 H new ATOM 246 N GLY A 12 -0.901 -4.720 7.544 1.00 0.00 N ATOM 247 CA GLY A 12 0.081 -5.763 7.312 1.00 0.00 C ATOM 248 C GLY A 12 0.403 -5.939 5.841 1.00 0.00 C ATOM 249 O GLY A 12 0.672 -7.051 5.385 1.00 0.00 O ATOM 0 H GLY A 12 -0.555 -3.915 8.066 1.00 0.00 H new ATOM 0 HA2 GLY A 12 0.995 -5.524 7.855 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -0.292 -6.705 7.714 1.00 0.00 H new ATOM 253 N LEU A 13 0.374 -4.840 5.095 1.00 0.00 N ATOM 254 CA LEU A 13 0.663 -4.878 3.666 1.00 0.00 C ATOM 255 C LEU A 13 2.164 -4.988 3.417 1.00 0.00 C ATOM 256 O LEU A 13 2.954 -5.075 4.356 1.00 0.00 O ATOM 257 CB LEU A 13 0.111 -3.627 2.980 1.00 0.00 C ATOM 258 CG LEU A 13 -1.413 -3.511 2.919 1.00 0.00 C ATOM 259 CD1 LEU A 13 -1.824 -2.131 2.432 1.00 0.00 C ATOM 260 CD2 LEU A 13 -1.994 -4.592 2.019 1.00 0.00 C ATOM 0 H LEU A 13 0.153 -3.912 5.456 1.00 0.00 H new ATOM 0 HA LEU A 13 0.178 -5.759 3.246 1.00 0.00 H new ATOM 0 HB2 LEU A 13 0.501 -2.751 3.498 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.499 -3.594 1.962 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.810 -3.651 3.924 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.912 -2.067 2.395 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.439 -1.374 3.116 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.417 -1.961 1.436 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -3.079 -4.495 1.987 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -1.590 -4.483 1.012 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -1.729 -5.574 2.412 1.00 0.00 H new ATOM 272 N ALA A 14 2.549 -4.981 2.145 1.00 0.00 N ATOM 273 CA ALA A 14 3.956 -5.075 1.772 1.00 0.00 C ATOM 274 C ALA A 14 4.541 -3.697 1.486 1.00 0.00 C ATOM 275 O ALA A 14 3.859 -2.682 1.624 1.00 0.00 O ATOM 276 CB ALA A 14 4.121 -5.983 0.563 1.00 0.00 C ATOM 0 H ALA A 14 1.907 -4.911 1.356 1.00 0.00 H new ATOM 0 HA ALA A 14 4.502 -5.504 2.612 1.00 0.00 H new ATOM 0 HB1 ALA A 14 5.176 -6.044 0.295 1.00 0.00 H new ATOM 0 HB2 ALA A 14 3.749 -6.979 0.803 1.00 0.00 H new ATOM 0 HB3 ALA A 14 3.557 -5.577 -0.277 1.00 0.00 H new ATOM 282 N GLU A 15 5.809 -3.669 1.087 1.00 0.00 N ATOM 283 CA GLU A 15 6.486 -2.414 0.782 1.00 0.00 C ATOM 284 C GLU A 15 6.188 -1.967 -0.646 1.00 0.00 C ATOM 285 O GLU A 15 6.291 -0.785 -0.971 1.00 0.00 O ATOM 286 CB GLU A 15 7.996 -2.563 0.977 1.00 0.00 C ATOM 287 CG GLU A 15 8.673 -3.377 -0.112 1.00 0.00 C ATOM 288 CD GLU A 15 9.142 -2.522 -1.273 1.00 0.00 C ATOM 289 OE1 GLU A 15 8.653 -1.381 -1.406 1.00 0.00 O ATOM 290 OE2 GLU A 15 9.999 -2.995 -2.049 1.00 0.00 O ATOM 0 H GLU A 15 6.388 -4.500 0.968 1.00 0.00 H new ATOM 0 HA GLU A 15 6.112 -1.654 1.467 1.00 0.00 H new ATOM 0 HB2 GLU A 15 8.449 -1.572 1.013 1.00 0.00 H new ATOM 0 HB3 GLU A 15 8.184 -3.034 1.942 1.00 0.00 H new ATOM 0 HG2 GLU A 15 9.526 -3.906 0.312 1.00 0.00 H new ATOM 0 HG3 GLU A 15 7.979 -4.133 -0.479 1.00 0.00 H new ATOM 297 N GLU A 16 5.820 -2.923 -1.494 1.00 0.00 N ATOM 298 CA GLU A 16 5.508 -2.628 -2.888 1.00 0.00 C ATOM 299 C GLU A 16 4.002 -2.502 -3.094 1.00 0.00 C ATOM 300 O GLU A 16 3.542 -2.071 -4.152 1.00 0.00 O ATOM 301 CB GLU A 16 6.070 -3.720 -3.801 1.00 0.00 C ATOM 302 CG GLU A 16 7.585 -3.828 -3.759 1.00 0.00 C ATOM 303 CD GLU A 16 8.168 -4.357 -5.055 1.00 0.00 C ATOM 304 OE1 GLU A 16 8.091 -3.641 -6.075 1.00 0.00 O ATOM 305 OE2 GLU A 16 8.701 -5.486 -5.050 1.00 0.00 O ATOM 0 H GLU A 16 5.731 -3.907 -1.240 1.00 0.00 H new ATOM 0 HA GLU A 16 5.972 -1.676 -3.144 1.00 0.00 H new ATOM 0 HB2 GLU A 16 5.638 -4.679 -3.515 1.00 0.00 H new ATOM 0 HB3 GLU A 16 5.757 -3.522 -4.826 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.010 -2.847 -3.548 1.00 0.00 H new ATOM 0 HG3 GLU A 16 7.876 -4.485 -2.939 1.00 0.00 H new ATOM 312 N VAL A 17 3.237 -2.882 -2.075 1.00 0.00 N ATOM 313 CA VAL A 17 1.782 -2.812 -2.143 1.00 0.00 C ATOM 314 C VAL A 17 1.292 -1.381 -1.958 1.00 0.00 C ATOM 315 O VAL A 17 1.763 -0.661 -1.077 1.00 0.00 O ATOM 316 CB VAL A 17 1.127 -3.710 -1.077 1.00 0.00 C ATOM 317 CG1 VAL A 17 -0.388 -3.577 -1.125 1.00 0.00 C ATOM 318 CG2 VAL A 17 1.549 -5.159 -1.268 1.00 0.00 C ATOM 0 H VAL A 17 3.601 -3.242 -1.193 1.00 0.00 H new ATOM 0 HA VAL A 17 1.493 -3.166 -3.133 1.00 0.00 H new ATOM 0 HB VAL A 17 1.466 -3.384 -0.094 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -0.834 -4.219 -0.365 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -0.668 -2.541 -0.935 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -0.748 -3.876 -2.109 1.00 0.00 H new ATOM 0 HG21 VAL A 17 1.077 -5.779 -0.506 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.241 -5.501 -2.256 1.00 0.00 H new ATOM 0 HG23 VAL A 17 2.633 -5.237 -1.179 1.00 0.00 H new ATOM 328 N ASP A 18 0.343 -0.974 -2.793 1.00 0.00 N ATOM 329 CA ASP A 18 -0.214 0.372 -2.721 1.00 0.00 C ATOM 330 C ASP A 18 -1.622 0.410 -3.305 1.00 0.00 C ATOM 331 O ASP A 18 -2.148 -0.610 -3.751 1.00 0.00 O ATOM 332 CB ASP A 18 0.687 1.360 -3.465 1.00 0.00 C ATOM 333 CG ASP A 18 2.126 1.300 -2.993 1.00 0.00 C ATOM 334 OD1 ASP A 18 2.390 1.702 -1.840 1.00 0.00 O ATOM 335 OD2 ASP A 18 2.989 0.850 -3.776 1.00 0.00 O ATOM 0 H ASP A 18 -0.057 -1.557 -3.528 1.00 0.00 H new ATOM 0 HA ASP A 18 -0.268 0.660 -1.671 1.00 0.00 H new ATOM 0 HB2 ASP A 18 0.649 1.148 -4.534 1.00 0.00 H new ATOM 0 HB3 ASP A 18 0.304 2.371 -3.327 1.00 0.00 H new ATOM 340 N ASP A 19 -2.229 1.592 -3.299 1.00 0.00 N ATOM 341 CA ASP A 19 -3.577 1.763 -3.828 1.00 0.00 C ATOM 342 C ASP A 19 -3.741 1.016 -5.148 1.00 0.00 C ATOM 343 O ASP A 19 -4.803 0.461 -5.432 1.00 0.00 O ATOM 344 CB ASP A 19 -3.885 3.248 -4.027 1.00 0.00 C ATOM 345 CG ASP A 19 -2.925 3.914 -4.992 1.00 0.00 C ATOM 346 OD1 ASP A 19 -1.792 4.234 -4.577 1.00 0.00 O ATOM 347 OD2 ASP A 19 -3.307 4.115 -6.164 1.00 0.00 O ATOM 0 H ASP A 19 -1.808 2.446 -2.933 1.00 0.00 H new ATOM 0 HA ASP A 19 -4.280 1.348 -3.106 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -4.904 3.358 -4.399 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -3.840 3.758 -3.064 1.00 0.00 H new ATOM 352 N LYS A 20 -2.683 1.005 -5.952 1.00 0.00 N ATOM 353 CA LYS A 20 -2.709 0.326 -7.242 1.00 0.00 C ATOM 354 C LYS A 20 -2.846 -1.182 -7.060 1.00 0.00 C ATOM 355 O LYS A 20 -3.797 -1.792 -7.548 1.00 0.00 O ATOM 356 CB LYS A 20 -1.437 0.642 -8.033 1.00 0.00 C ATOM 357 CG LYS A 20 -1.296 2.110 -8.396 1.00 0.00 C ATOM 358 CD LYS A 20 -0.546 2.881 -7.323 1.00 0.00 C ATOM 359 CE LYS A 20 0.111 4.130 -7.890 1.00 0.00 C ATOM 360 NZ LYS A 20 0.972 4.809 -6.883 1.00 0.00 N ATOM 0 H LYS A 20 -1.796 1.459 -5.733 1.00 0.00 H new ATOM 0 HA LYS A 20 -3.574 0.687 -7.798 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -0.570 0.336 -7.448 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -1.430 0.048 -8.947 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -0.770 2.202 -9.346 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -2.284 2.548 -8.536 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -1.235 3.161 -6.526 1.00 0.00 H new ATOM 0 HD3 LYS A 20 0.214 2.240 -6.877 1.00 0.00 H new ATOM 0 HE2 LYS A 20 0.711 3.862 -8.759 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -0.659 4.821 -8.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 1.402 5.655 -7.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 0.395 5.088 -6.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 1.722 4.159 -6.573 1.00 0.00 H new ATOM 374 N VAL A 21 -1.890 -1.778 -6.354 1.00 0.00 N ATOM 375 CA VAL A 21 -1.906 -3.215 -6.105 1.00 0.00 C ATOM 376 C VAL A 21 -3.198 -3.639 -5.415 1.00 0.00 C ATOM 377 O VAL A 21 -3.862 -4.584 -5.842 1.00 0.00 O ATOM 378 CB VAL A 21 -0.708 -3.648 -5.240 1.00 0.00 C ATOM 379 CG1 VAL A 21 -0.705 -5.157 -5.049 1.00 0.00 C ATOM 380 CG2 VAL A 21 0.597 -3.178 -5.864 1.00 0.00 C ATOM 0 H VAL A 21 -1.095 -1.288 -5.944 1.00 0.00 H new ATOM 0 HA VAL A 21 -1.839 -3.705 -7.076 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.803 -3.182 -4.259 1.00 0.00 H new ATOM 0 HG11 VAL A 21 0.149 -5.444 -4.435 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -1.627 -5.463 -4.554 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -0.635 -5.647 -6.020 1.00 0.00 H new ATOM 0 HG21 VAL A 21 1.433 -3.493 -5.239 1.00 0.00 H new ATOM 0 HG22 VAL A 21 0.703 -3.613 -6.858 1.00 0.00 H new ATOM 0 HG23 VAL A 21 0.592 -2.091 -5.943 1.00 0.00 H new ATOM 390 N LEU A 22 -3.549 -2.934 -4.345 1.00 0.00 N ATOM 391 CA LEU A 22 -4.763 -3.237 -3.594 1.00 0.00 C ATOM 392 C LEU A 22 -6.002 -3.051 -4.465 1.00 0.00 C ATOM 393 O LEU A 22 -6.980 -3.788 -4.335 1.00 0.00 O ATOM 394 CB LEU A 22 -4.856 -2.343 -2.357 1.00 0.00 C ATOM 395 CG LEU A 22 -3.997 -2.758 -1.162 1.00 0.00 C ATOM 396 CD1 LEU A 22 -3.952 -1.647 -0.125 1.00 0.00 C ATOM 397 CD2 LEU A 22 -4.527 -4.045 -0.546 1.00 0.00 C ATOM 0 H LEU A 22 -3.011 -2.149 -3.978 1.00 0.00 H new ATOM 0 HA LEU A 22 -4.716 -4.279 -3.279 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.577 -1.329 -2.644 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -5.897 -2.308 -2.036 1.00 0.00 H new ATOM 0 HG LEU A 22 -2.981 -2.939 -1.514 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -3.336 -1.961 0.718 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.525 -0.749 -0.572 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -4.962 -1.434 0.224 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -3.904 -4.326 0.303 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -5.552 -3.892 -0.209 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -4.505 -4.841 -1.291 1.00 0.00 H new ATOM 409 N HIS A 23 -5.952 -2.064 -5.353 1.00 0.00 N ATOM 410 CA HIS A 23 -7.070 -1.784 -6.247 1.00 0.00 C ATOM 411 C HIS A 23 -7.347 -2.974 -7.161 1.00 0.00 C ATOM 412 O HIS A 23 -8.494 -3.388 -7.327 1.00 0.00 O ATOM 413 CB HIS A 23 -6.780 -0.539 -7.086 1.00 0.00 C ATOM 414 CG HIS A 23 -7.697 -0.380 -8.260 1.00 0.00 C ATOM 415 ND1 HIS A 23 -7.897 -1.371 -9.198 1.00 0.00 N ATOM 416 CD2 HIS A 23 -8.471 0.661 -8.644 1.00 0.00 C ATOM 417 CE1 HIS A 23 -8.753 -0.945 -10.109 1.00 0.00 C ATOM 418 NE2 HIS A 23 -9.117 0.285 -9.796 1.00 0.00 N ATOM 0 H HIS A 23 -5.150 -1.445 -5.473 1.00 0.00 H new ATOM 0 HA HIS A 23 -7.955 -1.604 -5.636 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -6.860 0.343 -6.451 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -5.751 -0.583 -7.443 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -8.564 1.611 -8.139 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -9.097 -1.507 -10.965 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -9.772 0.862 -10.324 1.00 0.00 H new ATOM 426 N ALA A 24 -6.288 -3.520 -7.751 1.00 0.00 N ATOM 427 CA ALA A 24 -6.417 -4.663 -8.646 1.00 0.00 C ATOM 428 C ALA A 24 -6.530 -5.965 -7.861 1.00 0.00 C ATOM 429 O ALA A 24 -6.801 -7.022 -8.430 1.00 0.00 O ATOM 430 CB ALA A 24 -5.234 -4.721 -9.601 1.00 0.00 C ATOM 0 H ALA A 24 -5.332 -3.189 -7.625 1.00 0.00 H new ATOM 0 HA ALA A 24 -7.332 -4.538 -9.225 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -5.343 -5.579 -10.264 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -5.200 -3.807 -10.194 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.310 -4.818 -9.031 1.00 0.00 H new ATOM 436 N ALA A 25 -6.321 -5.881 -6.551 1.00 0.00 N ATOM 437 CA ALA A 25 -6.401 -7.053 -5.688 1.00 0.00 C ATOM 438 C ALA A 25 -7.787 -7.183 -5.066 1.00 0.00 C ATOM 439 O ALA A 25 -8.135 -8.227 -4.513 1.00 0.00 O ATOM 440 CB ALA A 25 -5.337 -6.982 -4.602 1.00 0.00 C ATOM 0 H ALA A 25 -6.095 -5.013 -6.064 1.00 0.00 H new ATOM 0 HA ALA A 25 -6.222 -7.937 -6.300 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -5.408 -7.863 -3.965 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -4.349 -6.946 -5.062 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -5.490 -6.086 -4.000 1.00 0.00 H new ATOM 446 N PHE A 26 -8.574 -6.116 -5.159 1.00 0.00 N ATOM 447 CA PHE A 26 -9.923 -6.111 -4.603 1.00 0.00 C ATOM 448 C PHE A 26 -10.962 -5.906 -5.701 1.00 0.00 C ATOM 449 O PHE A 26 -12.163 -5.859 -5.432 1.00 0.00 O ATOM 450 CB PHE A 26 -10.057 -5.013 -3.546 1.00 0.00 C ATOM 451 CG PHE A 26 -9.374 -5.342 -2.250 1.00 0.00 C ATOM 452 CD1 PHE A 26 -8.050 -5.751 -2.233 1.00 0.00 C ATOM 453 CD2 PHE A 26 -10.055 -5.242 -1.047 1.00 0.00 C ATOM 454 CE1 PHE A 26 -7.418 -6.054 -1.042 1.00 0.00 C ATOM 455 CE2 PHE A 26 -9.428 -5.543 0.147 1.00 0.00 C ATOM 456 CZ PHE A 26 -8.108 -5.951 0.150 1.00 0.00 C ATOM 0 H PHE A 26 -8.302 -5.244 -5.614 1.00 0.00 H new ATOM 0 HA PHE A 26 -10.101 -7.079 -4.135 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -9.641 -4.086 -3.942 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -11.115 -4.831 -3.354 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.505 -5.834 -3.162 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -11.087 -4.925 -1.043 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -6.386 -6.371 -1.043 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -9.970 -5.459 1.078 1.00 0.00 H new ATOM 0 HZ PHE A 26 -7.617 -6.189 1.082 1.00 0.00 H new ATOM 466 N ILE A 27 -10.492 -5.783 -6.937 1.00 0.00 N ATOM 467 CA ILE A 27 -11.380 -5.584 -8.076 1.00 0.00 C ATOM 468 C ILE A 27 -12.361 -6.743 -8.218 1.00 0.00 C ATOM 469 O ILE A 27 -13.496 -6.577 -8.664 1.00 0.00 O ATOM 470 CB ILE A 27 -10.588 -5.432 -9.388 1.00 0.00 C ATOM 471 CG1 ILE A 27 -11.447 -4.742 -10.450 1.00 0.00 C ATOM 472 CG2 ILE A 27 -10.116 -6.791 -9.881 1.00 0.00 C ATOM 473 CD1 ILE A 27 -11.849 -3.332 -10.079 1.00 0.00 C ATOM 0 H ILE A 27 -9.501 -5.818 -7.176 1.00 0.00 H new ATOM 0 HA ILE A 27 -11.934 -4.664 -7.887 1.00 0.00 H new ATOM 0 HB ILE A 27 -9.712 -4.812 -9.198 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -10.898 -4.719 -11.391 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -12.346 -5.335 -10.620 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -9.558 -6.668 -10.809 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -9.473 -7.248 -9.129 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -10.979 -7.433 -10.059 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -12.456 -2.905 -10.877 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -12.426 -3.350 -9.154 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.955 -2.724 -9.938 1.00 0.00 H new ATOM 485 N PRO A 28 -11.915 -7.946 -7.827 1.00 0.00 N ATOM 486 CA PRO A 28 -12.738 -9.157 -7.899 1.00 0.00 C ATOM 487 C PRO A 28 -13.998 -9.053 -7.046 1.00 0.00 C ATOM 488 O PRO A 28 -15.102 -9.331 -7.515 1.00 0.00 O ATOM 489 CB PRO A 28 -11.813 -10.248 -7.356 1.00 0.00 C ATOM 490 CG PRO A 28 -10.439 -9.695 -7.517 1.00 0.00 C ATOM 491 CD PRO A 28 -10.573 -8.217 -7.285 1.00 0.00 C ATOM 0 HA PRO A 28 -13.095 -9.347 -8.911 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -12.031 -10.468 -6.311 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -11.932 -11.180 -7.909 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -9.749 -10.144 -6.802 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -10.046 -9.902 -8.513 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -10.500 -7.961 -6.228 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -9.800 -7.650 -7.804 1.00 0.00 H new ATOM 499 N PHE A 29 -13.826 -8.650 -5.792 1.00 0.00 N ATOM 500 CA PHE A 29 -14.949 -8.509 -4.873 1.00 0.00 C ATOM 501 C PHE A 29 -16.041 -7.633 -5.479 1.00 0.00 C ATOM 502 O PHE A 29 -17.106 -8.121 -5.856 1.00 0.00 O ATOM 503 CB PHE A 29 -14.478 -7.912 -3.545 1.00 0.00 C ATOM 504 CG PHE A 29 -13.509 -8.787 -2.804 1.00 0.00 C ATOM 505 CD1 PHE A 29 -12.166 -8.800 -3.146 1.00 0.00 C ATOM 506 CD2 PHE A 29 -13.940 -9.597 -1.766 1.00 0.00 C ATOM 507 CE1 PHE A 29 -11.272 -9.605 -2.466 1.00 0.00 C ATOM 508 CE2 PHE A 29 -13.050 -10.404 -1.082 1.00 0.00 C ATOM 509 CZ PHE A 29 -11.714 -10.407 -1.432 1.00 0.00 C ATOM 0 H PHE A 29 -12.919 -8.415 -5.389 1.00 0.00 H new ATOM 0 HA PHE A 29 -15.363 -9.501 -4.690 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -14.010 -6.946 -3.736 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -15.345 -7.727 -2.911 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -11.814 -8.174 -3.953 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -14.984 -9.598 -1.488 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -10.228 -9.607 -2.743 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -13.399 -11.031 -0.275 1.00 0.00 H new ATOM 0 HZ PHE A 29 -11.016 -11.035 -0.898 1.00 0.00 H new ATOM 519 N GLY A 30 -15.769 -6.334 -5.568 1.00 0.00 N ATOM 520 CA GLY A 30 -16.737 -5.410 -6.128 1.00 0.00 C ATOM 521 C GLY A 30 -16.110 -4.432 -7.101 1.00 0.00 C ATOM 522 O GLY A 30 -15.139 -4.761 -7.783 1.00 0.00 O ATOM 0 H GLY A 30 -14.895 -5.906 -5.262 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -17.519 -5.973 -6.637 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -17.216 -4.857 -5.320 1.00 0.00 H new ATOM 526 N ASP A 31 -16.665 -3.227 -7.168 1.00 0.00 N ATOM 527 CA ASP A 31 -16.154 -2.198 -8.065 1.00 0.00 C ATOM 528 C ASP A 31 -15.596 -1.017 -7.277 1.00 0.00 C ATOM 529 O ASP A 31 -16.251 0.017 -7.142 1.00 0.00 O ATOM 530 CB ASP A 31 -17.258 -1.720 -9.009 1.00 0.00 C ATOM 531 CG ASP A 31 -17.983 -2.869 -9.682 1.00 0.00 C ATOM 532 OD1 ASP A 31 -18.917 -3.423 -9.066 1.00 0.00 O ATOM 533 OD2 ASP A 31 -17.615 -3.216 -10.824 1.00 0.00 O ATOM 0 H ASP A 31 -17.470 -2.939 -6.611 1.00 0.00 H new ATOM 0 HA ASP A 31 -15.346 -2.633 -8.653 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -17.975 -1.120 -8.450 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -16.825 -1.072 -9.771 1.00 0.00 H new ATOM 538 N ILE A 32 -14.384 -1.180 -6.757 1.00 0.00 N ATOM 539 CA ILE A 32 -13.738 -0.127 -5.982 1.00 0.00 C ATOM 540 C ILE A 32 -14.074 1.251 -6.540 1.00 0.00 C ATOM 541 O ILE A 32 -13.814 1.542 -7.708 1.00 0.00 O ATOM 542 CB ILE A 32 -12.208 -0.301 -5.962 1.00 0.00 C ATOM 543 CG1 ILE A 32 -11.834 -1.644 -5.330 1.00 0.00 C ATOM 544 CG2 ILE A 32 -11.555 0.846 -5.206 1.00 0.00 C ATOM 545 CD1 ILE A 32 -10.370 -1.995 -5.479 1.00 0.00 C ATOM 0 H ILE A 32 -13.830 -2.030 -6.858 1.00 0.00 H new ATOM 0 HA ILE A 32 -14.118 -0.207 -4.964 1.00 0.00 H new ATOM 0 HB ILE A 32 -11.842 -0.289 -6.989 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -12.088 -1.621 -4.270 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -12.436 -2.431 -5.785 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -10.474 0.709 -5.200 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -11.799 1.789 -5.695 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -11.924 0.863 -4.180 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -10.177 -2.959 -5.008 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -10.115 -2.051 -6.537 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -9.761 -1.229 -4.999 1.00 0.00 H new ATOM 557 N THR A 33 -14.654 2.100 -5.697 1.00 0.00 N ATOM 558 CA THR A 33 -15.025 3.449 -6.104 1.00 0.00 C ATOM 559 C THR A 33 -13.872 4.424 -5.894 1.00 0.00 C ATOM 560 O THR A 33 -13.536 5.204 -6.784 1.00 0.00 O ATOM 561 CB THR A 33 -16.256 3.952 -5.327 1.00 0.00 C ATOM 562 OG1 THR A 33 -15.966 3.997 -3.926 1.00 0.00 O ATOM 563 CG2 THR A 33 -17.457 3.050 -5.574 1.00 0.00 C ATOM 0 H THR A 33 -14.877 1.876 -4.727 1.00 0.00 H new ATOM 0 HA THR A 33 -15.269 3.403 -7.165 1.00 0.00 H new ATOM 0 HB THR A 33 -16.497 4.955 -5.680 1.00 0.00 H new ATOM 0 HG1 THR A 33 -16.371 4.799 -3.534 1.00 0.00 H new ATOM 0 HG21 THR A 33 -18.315 3.425 -5.015 1.00 0.00 H new ATOM 0 HG22 THR A 33 -17.693 3.042 -6.638 1.00 0.00 H new ATOM 0 HG23 THR A 33 -17.225 2.037 -5.246 1.00 0.00 H new ATOM 571 N ASP A 34 -13.270 4.374 -4.710 1.00 0.00 N ATOM 572 CA ASP A 34 -12.153 5.253 -4.383 1.00 0.00 C ATOM 573 C ASP A 34 -11.304 4.658 -3.264 1.00 0.00 C ATOM 574 O ASP A 34 -11.811 3.942 -2.400 1.00 0.00 O ATOM 575 CB ASP A 34 -12.666 6.634 -3.972 1.00 0.00 C ATOM 576 CG ASP A 34 -13.540 7.267 -5.037 1.00 0.00 C ATOM 577 OD1 ASP A 34 -13.025 7.547 -6.139 1.00 0.00 O ATOM 578 OD2 ASP A 34 -14.741 7.484 -4.767 1.00 0.00 O ATOM 0 H ASP A 34 -13.537 3.734 -3.961 1.00 0.00 H new ATOM 0 HA ASP A 34 -11.531 5.356 -5.272 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -13.233 6.547 -3.045 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -11.818 7.287 -3.767 1.00 0.00 H new ATOM 583 N ILE A 35 -10.010 4.958 -3.287 1.00 0.00 N ATOM 584 CA ILE A 35 -9.091 4.453 -2.275 1.00 0.00 C ATOM 585 C ILE A 35 -8.329 5.593 -1.607 1.00 0.00 C ATOM 586 O ILE A 35 -8.027 6.604 -2.239 1.00 0.00 O ATOM 587 CB ILE A 35 -8.081 3.459 -2.877 1.00 0.00 C ATOM 588 CG1 ILE A 35 -8.800 2.448 -3.774 1.00 0.00 C ATOM 589 CG2 ILE A 35 -7.317 2.745 -1.772 1.00 0.00 C ATOM 590 CD1 ILE A 35 -7.859 1.573 -4.573 1.00 0.00 C ATOM 0 H ILE A 35 -9.574 5.548 -3.996 1.00 0.00 H new ATOM 0 HA ILE A 35 -9.696 3.937 -1.529 1.00 0.00 H new ATOM 0 HB ILE A 35 -7.367 4.014 -3.486 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -9.436 1.814 -3.156 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -9.455 2.985 -4.460 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -6.607 2.046 -2.214 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -6.779 3.477 -1.170 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -8.017 2.200 -1.139 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -8.437 0.881 -5.185 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -7.240 2.198 -5.217 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -7.221 1.009 -3.893 1.00 0.00 H new ATOM 602 N GLN A 36 -8.020 5.420 -0.326 1.00 0.00 N ATOM 603 CA GLN A 36 -7.291 6.434 0.428 1.00 0.00 C ATOM 604 C GLN A 36 -6.053 5.836 1.087 1.00 0.00 C ATOM 605 O GLN A 36 -6.136 4.825 1.786 1.00 0.00 O ATOM 606 CB GLN A 36 -8.197 7.060 1.489 1.00 0.00 C ATOM 607 CG GLN A 36 -9.157 8.100 0.933 1.00 0.00 C ATOM 608 CD GLN A 36 -10.001 7.565 -0.207 1.00 0.00 C ATOM 609 OE1 GLN A 36 -9.882 8.186 -1.374 1.00 0.00 O flip ATOM 610 NE2 GLN A 36 -10.753 6.604 -0.040 1.00 0.00 N flip ATOM 0 H GLN A 36 -8.263 4.588 0.212 1.00 0.00 H new ATOM 0 HA GLN A 36 -6.971 7.209 -0.268 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -8.771 6.271 1.976 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -7.577 7.523 2.257 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -9.811 8.449 1.732 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -8.590 8.964 0.586 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -10.813 6.156 0.875 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -11.316 6.256 -0.816 1.00 0.00 H new ATOM 619 N ILE A 37 -4.906 6.468 0.862 1.00 0.00 N ATOM 620 CA ILE A 37 -3.650 5.998 1.435 1.00 0.00 C ATOM 621 C ILE A 37 -3.055 7.037 2.380 1.00 0.00 C ATOM 622 O ILE A 37 -2.776 8.173 1.997 1.00 0.00 O ATOM 623 CB ILE A 37 -2.620 5.667 0.340 1.00 0.00 C ATOM 624 CG1 ILE A 37 -3.250 4.774 -0.730 1.00 0.00 C ATOM 625 CG2 ILE A 37 -1.398 4.994 0.948 1.00 0.00 C ATOM 626 CD1 ILE A 37 -3.384 3.327 -0.308 1.00 0.00 C ATOM 0 H ILE A 37 -4.820 7.306 0.287 1.00 0.00 H new ATOM 0 HA ILE A 37 -3.878 5.090 1.993 1.00 0.00 H new ATOM 0 HB ILE A 37 -2.301 6.597 -0.131 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -4.236 5.163 -0.982 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -2.646 4.825 -1.636 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -0.679 4.766 0.161 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -0.939 5.663 1.676 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.699 4.071 1.442 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.838 2.753 -1.116 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.398 2.920 -0.084 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -4.013 3.264 0.580 1.00 0.00 H new ATOM 638 N PRO A 38 -2.855 6.640 3.645 1.00 0.00 N ATOM 639 CA PRO A 38 -2.288 7.521 4.671 1.00 0.00 C ATOM 640 C PRO A 38 -0.813 7.821 4.428 1.00 0.00 C ATOM 641 O PRO A 38 0.044 6.953 4.599 1.00 0.00 O ATOM 642 CB PRO A 38 -2.465 6.720 5.963 1.00 0.00 C ATOM 643 CG PRO A 38 -2.507 5.297 5.524 1.00 0.00 C ATOM 644 CD PRO A 38 -3.165 5.300 4.172 1.00 0.00 C ATOM 0 HA PRO A 38 -2.777 8.495 4.687 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -1.641 6.897 6.654 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -3.382 7.002 6.481 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -1.503 4.876 5.468 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -3.070 4.687 6.231 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -2.768 4.514 3.530 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -4.240 5.137 4.248 1.00 0.00 H new ATOM 652 N LEU A 39 -0.523 9.054 4.028 1.00 0.00 N ATOM 653 CA LEU A 39 0.850 9.469 3.761 1.00 0.00 C ATOM 654 C LEU A 39 1.215 10.703 4.580 1.00 0.00 C ATOM 655 O LEU A 39 0.356 11.526 4.896 1.00 0.00 O ATOM 656 CB LEU A 39 1.036 9.758 2.271 1.00 0.00 C ATOM 657 CG LEU A 39 0.872 8.564 1.329 1.00 0.00 C ATOM 658 CD1 LEU A 39 1.180 8.969 -0.104 1.00 0.00 C ATOM 659 CD2 LEU A 39 1.769 7.415 1.765 1.00 0.00 C ATOM 0 H LEU A 39 -1.220 9.784 3.881 1.00 0.00 H new ATOM 0 HA LEU A 39 1.513 8.654 4.052 1.00 0.00 H new ATOM 0 HB2 LEU A 39 0.321 10.527 1.979 1.00 0.00 H new ATOM 0 HB3 LEU A 39 2.032 10.177 2.124 1.00 0.00 H new ATOM 0 HG LEU A 39 -0.164 8.228 1.375 1.00 0.00 H new ATOM 0 HD11 LEU A 39 1.058 8.107 -0.760 1.00 0.00 H new ATOM 0 HD12 LEU A 39 0.497 9.760 -0.413 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.206 9.331 -0.167 1.00 0.00 H new ATOM 0 HD21 LEU A 39 1.640 6.574 1.084 1.00 0.00 H new ATOM 0 HD22 LEU A 39 2.810 7.739 1.748 1.00 0.00 H new ATOM 0 HD23 LEU A 39 1.501 7.108 2.776 1.00 0.00 H new ATOM 671 N ASP A 40 2.494 10.825 4.918 1.00 0.00 N ATOM 672 CA ASP A 40 2.973 11.961 5.697 1.00 0.00 C ATOM 673 C ASP A 40 3.120 13.199 4.819 1.00 0.00 C ATOM 674 O ASP A 40 2.877 13.150 3.613 1.00 0.00 O ATOM 675 CB ASP A 40 4.312 11.625 6.356 1.00 0.00 C ATOM 676 CG ASP A 40 4.564 12.446 7.606 1.00 0.00 C ATOM 677 OD1 ASP A 40 3.648 13.183 8.026 1.00 0.00 O ATOM 678 OD2 ASP A 40 5.678 12.352 8.163 1.00 0.00 O ATOM 0 H ASP A 40 3.217 10.152 4.665 1.00 0.00 H new ATOM 0 HA ASP A 40 2.238 12.174 6.473 1.00 0.00 H new ATOM 0 HB2 ASP A 40 4.333 10.565 6.610 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.118 11.797 5.643 1.00 0.00 H new ATOM 683 N TYR A 41 3.518 14.309 5.432 1.00 0.00 N ATOM 684 CA TYR A 41 3.694 15.561 4.706 1.00 0.00 C ATOM 685 C TYR A 41 5.168 15.812 4.402 1.00 0.00 C ATOM 686 O TYR A 41 5.505 16.628 3.544 1.00 0.00 O ATOM 687 CB TYR A 41 3.123 16.727 5.514 1.00 0.00 C ATOM 688 CG TYR A 41 4.124 17.359 6.456 1.00 0.00 C ATOM 689 CD1 TYR A 41 5.001 18.341 6.013 1.00 0.00 C ATOM 690 CD2 TYR A 41 4.191 16.974 7.789 1.00 0.00 C ATOM 691 CE1 TYR A 41 5.917 18.920 6.869 1.00 0.00 C ATOM 692 CE2 TYR A 41 5.103 17.548 8.654 1.00 0.00 C ATOM 693 CZ TYR A 41 5.964 18.520 8.189 1.00 0.00 C ATOM 694 OH TYR A 41 6.875 19.095 9.046 1.00 0.00 O ATOM 0 H TYR A 41 3.725 14.367 6.429 1.00 0.00 H new ATOM 0 HA TYR A 41 3.155 15.483 3.762 1.00 0.00 H new ATOM 0 HB2 TYR A 41 2.753 17.488 4.827 1.00 0.00 H new ATOM 0 HB3 TYR A 41 2.267 16.374 6.090 1.00 0.00 H new ATOM 0 HD1 TYR A 41 4.966 18.657 4.981 1.00 0.00 H new ATOM 0 HD2 TYR A 41 3.518 16.213 8.156 1.00 0.00 H new ATOM 0 HE1 TYR A 41 6.593 19.681 6.508 1.00 0.00 H new ATOM 0 HE2 TYR A 41 5.141 17.237 9.688 1.00 0.00 H new ATOM 0 HH TYR A 41 6.777 18.703 9.939 1.00 0.00 H new ATOM 704 N GLU A 42 6.041 15.103 5.111 1.00 0.00 N ATOM 705 CA GLU A 42 7.479 15.248 4.917 1.00 0.00 C ATOM 706 C GLU A 42 8.047 14.061 4.145 1.00 0.00 C ATOM 707 O GLU A 42 8.912 14.221 3.283 1.00 0.00 O ATOM 708 CB GLU A 42 8.187 15.380 6.267 1.00 0.00 C ATOM 709 CG GLU A 42 7.527 14.585 7.381 1.00 0.00 C ATOM 710 CD GLU A 42 8.322 14.617 8.671 1.00 0.00 C ATOM 711 OE1 GLU A 42 9.421 15.211 8.675 1.00 0.00 O ATOM 712 OE2 GLU A 42 7.848 14.047 9.675 1.00 0.00 O ATOM 0 H GLU A 42 5.778 14.423 5.824 1.00 0.00 H new ATOM 0 HA GLU A 42 7.652 16.153 4.334 1.00 0.00 H new ATOM 0 HB2 GLU A 42 9.220 15.050 6.160 1.00 0.00 H new ATOM 0 HB3 GLU A 42 8.216 16.432 6.551 1.00 0.00 H new ATOM 0 HG2 GLU A 42 6.529 14.983 7.564 1.00 0.00 H new ATOM 0 HG3 GLU A 42 7.404 13.551 7.060 1.00 0.00 H new ATOM 719 N THR A 43 7.554 12.867 4.462 1.00 0.00 N ATOM 720 CA THR A 43 8.013 11.651 3.801 1.00 0.00 C ATOM 721 C THR A 43 6.959 11.120 2.836 1.00 0.00 C ATOM 722 O THR A 43 7.275 10.375 1.908 1.00 0.00 O ATOM 723 CB THR A 43 8.358 10.552 4.823 1.00 0.00 C ATOM 724 OG1 THR A 43 7.201 10.227 5.602 1.00 0.00 O ATOM 725 CG2 THR A 43 9.484 11.001 5.742 1.00 0.00 C ATOM 0 H THR A 43 6.837 12.716 5.172 1.00 0.00 H new ATOM 0 HA THR A 43 8.913 11.913 3.244 1.00 0.00 H new ATOM 0 HB THR A 43 8.688 9.669 4.276 1.00 0.00 H new ATOM 0 HG1 THR A 43 7.480 9.933 6.494 1.00 0.00 H new ATOM 0 HG21 THR A 43 9.710 10.208 6.455 1.00 0.00 H new ATOM 0 HG22 THR A 43 10.372 11.220 5.149 1.00 0.00 H new ATOM 0 HG23 THR A 43 9.178 11.897 6.281 1.00 0.00 H new ATOM 733 N GLU A 44 5.708 11.508 3.060 1.00 0.00 N ATOM 734 CA GLU A 44 4.609 11.069 2.209 1.00 0.00 C ATOM 735 C GLU A 44 4.725 9.580 1.894 1.00 0.00 C ATOM 736 O GLU A 44 4.329 9.128 0.819 1.00 0.00 O ATOM 737 CB GLU A 44 4.587 11.876 0.909 1.00 0.00 C ATOM 738 CG GLU A 44 5.919 11.890 0.178 1.00 0.00 C ATOM 739 CD GLU A 44 5.876 12.708 -1.098 1.00 0.00 C ATOM 740 OE1 GLU A 44 6.066 13.939 -1.019 1.00 0.00 O ATOM 741 OE2 GLU A 44 5.653 12.117 -2.175 1.00 0.00 O ATOM 0 H GLU A 44 5.430 12.125 3.823 1.00 0.00 H new ATOM 0 HA GLU A 44 3.677 11.237 2.749 1.00 0.00 H new ATOM 0 HB2 GLU A 44 3.824 11.464 0.248 1.00 0.00 H new ATOM 0 HB3 GLU A 44 4.294 12.902 1.133 1.00 0.00 H new ATOM 0 HG2 GLU A 44 6.687 12.293 0.838 1.00 0.00 H new ATOM 0 HG3 GLU A 44 6.209 10.867 -0.061 1.00 0.00 H new ATOM 748 N LYS A 45 5.273 8.823 2.838 1.00 0.00 N ATOM 749 CA LYS A 45 5.442 7.385 2.664 1.00 0.00 C ATOM 750 C LYS A 45 4.533 6.611 3.613 1.00 0.00 C ATOM 751 O LYS A 45 4.371 6.984 4.776 1.00 0.00 O ATOM 752 CB LYS A 45 6.901 6.990 2.903 1.00 0.00 C ATOM 753 CG LYS A 45 7.285 6.942 4.372 1.00 0.00 C ATOM 754 CD LYS A 45 8.787 6.798 4.551 1.00 0.00 C ATOM 755 CE LYS A 45 9.218 7.165 5.963 1.00 0.00 C ATOM 756 NZ LYS A 45 8.724 6.182 6.967 1.00 0.00 N ATOM 0 H LYS A 45 5.608 9.181 3.732 1.00 0.00 H new ATOM 0 HA LYS A 45 5.166 7.134 1.640 1.00 0.00 H new ATOM 0 HB2 LYS A 45 7.082 6.012 2.457 1.00 0.00 H new ATOM 0 HB3 LYS A 45 7.550 7.700 2.389 1.00 0.00 H new ATOM 0 HG2 LYS A 45 6.944 7.851 4.868 1.00 0.00 H new ATOM 0 HG3 LYS A 45 6.778 6.106 4.854 1.00 0.00 H new ATOM 0 HD2 LYS A 45 9.084 5.772 4.334 1.00 0.00 H new ATOM 0 HD3 LYS A 45 9.303 7.437 3.834 1.00 0.00 H new ATOM 0 HE2 LYS A 45 10.306 7.216 6.009 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.842 8.158 6.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.039 6.467 7.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 7.685 6.152 6.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 9.103 5.239 6.746 1.00 0.00 H new ATOM 770 N HIS A 46 3.942 5.532 3.111 1.00 0.00 N ATOM 771 CA HIS A 46 3.050 4.704 3.916 1.00 0.00 C ATOM 772 C HIS A 46 3.831 3.616 4.647 1.00 0.00 C ATOM 773 O HIS A 46 4.848 3.129 4.152 1.00 0.00 O ATOM 774 CB HIS A 46 1.974 4.070 3.034 1.00 0.00 C ATOM 775 CG HIS A 46 2.372 2.744 2.463 1.00 0.00 C ATOM 776 ND1 HIS A 46 2.640 1.639 3.243 1.00 0.00 N ATOM 777 CD2 HIS A 46 2.546 2.348 1.180 1.00 0.00 C ATOM 778 CE1 HIS A 46 2.963 0.621 2.464 1.00 0.00 C ATOM 779 NE2 HIS A 46 2.913 1.025 1.208 1.00 0.00 N ATOM 0 H HIS A 46 4.064 5.210 2.151 1.00 0.00 H new ATOM 0 HA HIS A 46 2.571 5.344 4.657 1.00 0.00 H new ATOM 0 HB2 HIS A 46 1.063 3.945 3.619 1.00 0.00 H new ATOM 0 HB3 HIS A 46 1.737 4.752 2.217 1.00 0.00 H new ATOM 0 HD2 HIS A 46 2.420 2.959 0.298 1.00 0.00 H new ATOM 0 HE1 HIS A 46 3.224 -0.372 2.798 1.00 0.00 H new ATOM 0 HE2 HIS A 46 3.114 0.448 0.391 1.00 0.00 H new ATOM 787 N ARG A 47 3.350 3.241 5.827 1.00 0.00 N ATOM 788 CA ARG A 47 4.004 2.213 6.627 1.00 0.00 C ATOM 789 C ARG A 47 3.595 0.819 6.161 1.00 0.00 C ATOM 790 O ARG A 47 4.428 -0.081 6.054 1.00 0.00 O ATOM 791 CB ARG A 47 3.657 2.389 8.107 1.00 0.00 C ATOM 792 CG ARG A 47 4.479 1.509 9.035 1.00 0.00 C ATOM 793 CD ARG A 47 5.781 2.185 9.435 1.00 0.00 C ATOM 794 NE ARG A 47 6.831 1.982 8.441 1.00 0.00 N ATOM 795 CZ ARG A 47 8.083 2.396 8.600 1.00 0.00 C ATOM 796 NH1 ARG A 47 8.439 3.031 9.708 1.00 0.00 N ATOM 797 NH2 ARG A 47 8.983 2.173 7.650 1.00 0.00 N ATOM 0 H ARG A 47 2.509 3.634 6.251 1.00 0.00 H new ATOM 0 HA ARG A 47 5.081 2.320 6.498 1.00 0.00 H new ATOM 0 HB2 ARG A 47 3.805 3.433 8.384 1.00 0.00 H new ATOM 0 HB3 ARG A 47 2.600 2.167 8.252 1.00 0.00 H new ATOM 0 HG2 ARG A 47 3.898 1.278 9.928 1.00 0.00 H new ATOM 0 HG3 ARG A 47 4.696 0.561 8.542 1.00 0.00 H new ATOM 0 HD2 ARG A 47 5.609 3.253 9.568 1.00 0.00 H new ATOM 0 HD3 ARG A 47 6.112 1.794 10.397 1.00 0.00 H new ATOM 0 HE ARG A 47 6.590 1.496 7.577 1.00 0.00 H new ATOM 0 HH11 ARG A 47 7.751 3.203 10.441 1.00 0.00 H new ATOM 0 HH12 ARG A 47 9.401 3.348 9.828 1.00 0.00 H new ATOM 0 HH21 ARG A 47 8.713 1.683 6.797 1.00 0.00 H new ATOM 0 HH22 ARG A 47 9.944 2.491 7.773 1.00 0.00 H new ATOM 811 N GLY A 48 2.306 0.647 5.885 1.00 0.00 N ATOM 812 CA GLY A 48 1.808 -0.639 5.434 1.00 0.00 C ATOM 813 C GLY A 48 0.331 -0.823 5.720 1.00 0.00 C ATOM 814 O GLY A 48 -0.061 -1.750 6.430 1.00 0.00 O ATOM 0 H GLY A 48 1.597 1.376 5.966 1.00 0.00 H new ATOM 0 HA2 GLY A 48 1.982 -0.737 4.362 1.00 0.00 H new ATOM 0 HA3 GLY A 48 2.371 -1.434 5.922 1.00 0.00 H new ATOM 818 N PHE A 49 -0.492 0.063 5.169 1.00 0.00 N ATOM 819 CA PHE A 49 -1.934 -0.004 5.371 1.00 0.00 C ATOM 820 C PHE A 49 -2.651 1.049 4.531 1.00 0.00 C ATOM 821 O PHE A 49 -2.034 2.001 4.051 1.00 0.00 O ATOM 822 CB PHE A 49 -2.272 0.192 6.851 1.00 0.00 C ATOM 823 CG PHE A 49 -1.447 1.253 7.519 1.00 0.00 C ATOM 824 CD1 PHE A 49 -1.625 2.590 7.203 1.00 0.00 C ATOM 825 CD2 PHE A 49 -0.492 0.914 8.464 1.00 0.00 C ATOM 826 CE1 PHE A 49 -0.868 3.570 7.816 1.00 0.00 C ATOM 827 CE2 PHE A 49 0.268 1.890 9.082 1.00 0.00 C ATOM 828 CZ PHE A 49 0.081 3.219 8.756 1.00 0.00 C ATOM 0 H PHE A 49 -0.184 0.836 4.579 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.275 -0.990 5.054 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -3.327 0.451 6.943 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -2.129 -0.752 7.376 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -2.365 2.870 6.468 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -0.340 -0.124 8.721 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -1.018 4.609 7.561 1.00 0.00 H new ATOM 0 HE2 PHE A 49 1.007 1.613 9.819 1.00 0.00 H new ATOM 0 HZ PHE A 49 0.676 3.982 9.235 1.00 0.00 H new ATOM 838 N ALA A 50 -3.956 0.871 4.357 1.00 0.00 N ATOM 839 CA ALA A 50 -4.757 1.805 3.576 1.00 0.00 C ATOM 840 C ALA A 50 -6.247 1.555 3.780 1.00 0.00 C ATOM 841 O ALA A 50 -6.640 0.671 4.543 1.00 0.00 O ATOM 842 CB ALA A 50 -4.400 1.702 2.101 1.00 0.00 C ATOM 0 H ALA A 50 -4.481 0.088 4.747 1.00 0.00 H new ATOM 0 HA ALA A 50 -4.534 2.814 3.923 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -5.006 2.405 1.530 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -3.345 1.938 1.965 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.593 0.688 1.750 1.00 0.00 H new ATOM 848 N PHE A 51 -7.074 2.338 3.096 1.00 0.00 N ATOM 849 CA PHE A 51 -8.522 2.202 3.203 1.00 0.00 C ATOM 850 C PHE A 51 -9.163 2.105 1.822 1.00 0.00 C ATOM 851 O PHE A 51 -8.938 2.954 0.960 1.00 0.00 O ATOM 852 CB PHE A 51 -9.111 3.388 3.970 1.00 0.00 C ATOM 853 CG PHE A 51 -8.559 3.537 5.359 1.00 0.00 C ATOM 854 CD1 PHE A 51 -7.263 3.986 5.559 1.00 0.00 C ATOM 855 CD2 PHE A 51 -9.336 3.230 6.464 1.00 0.00 C ATOM 856 CE1 PHE A 51 -6.753 4.125 6.836 1.00 0.00 C ATOM 857 CE2 PHE A 51 -8.831 3.368 7.743 1.00 0.00 C ATOM 858 CZ PHE A 51 -7.537 3.814 7.929 1.00 0.00 C ATOM 0 H PHE A 51 -6.766 3.074 2.461 1.00 0.00 H new ATOM 0 HA PHE A 51 -8.737 1.283 3.748 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -8.919 4.304 3.411 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -10.193 3.272 4.028 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -6.645 4.230 4.708 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -10.348 2.879 6.324 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -5.742 4.477 6.979 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -9.448 3.127 8.596 1.00 0.00 H new ATOM 0 HZ PHE A 51 -7.139 3.919 8.928 1.00 0.00 H new ATOM 868 N VAL A 52 -9.965 1.064 1.620 1.00 0.00 N ATOM 869 CA VAL A 52 -10.640 0.855 0.345 1.00 0.00 C ATOM 870 C VAL A 52 -12.148 1.024 0.488 1.00 0.00 C ATOM 871 O VAL A 52 -12.777 0.382 1.329 1.00 0.00 O ATOM 872 CB VAL A 52 -10.343 -0.545 -0.225 1.00 0.00 C ATOM 873 CG1 VAL A 52 -10.903 -0.678 -1.633 1.00 0.00 C ATOM 874 CG2 VAL A 52 -8.847 -0.819 -0.209 1.00 0.00 C ATOM 0 H VAL A 52 -10.163 0.352 2.323 1.00 0.00 H new ATOM 0 HA VAL A 52 -10.256 1.608 -0.343 1.00 0.00 H new ATOM 0 HB VAL A 52 -10.832 -1.287 0.406 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -10.684 -1.673 -2.019 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -11.982 -0.527 -1.611 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -10.445 0.071 -2.279 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -8.655 -1.812 -0.615 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -8.334 -0.073 -0.816 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -8.479 -0.768 0.816 1.00 0.00 H new ATOM 884 N GLU A 53 -12.722 1.892 -0.340 1.00 0.00 N ATOM 885 CA GLU A 53 -14.158 2.145 -0.305 1.00 0.00 C ATOM 886 C GLU A 53 -14.883 1.313 -1.359 1.00 0.00 C ATOM 887 O GLU A 53 -14.506 1.312 -2.531 1.00 0.00 O ATOM 888 CB GLU A 53 -14.442 3.632 -0.528 1.00 0.00 C ATOM 889 CG GLU A 53 -15.839 4.055 -0.106 1.00 0.00 C ATOM 890 CD GLU A 53 -16.120 5.515 -0.401 1.00 0.00 C ATOM 891 OE1 GLU A 53 -16.550 5.821 -1.532 1.00 0.00 O ATOM 892 OE2 GLU A 53 -15.909 6.353 0.502 1.00 0.00 O ATOM 0 H GLU A 53 -12.215 2.431 -1.042 1.00 0.00 H new ATOM 0 HA GLU A 53 -14.528 1.856 0.679 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -13.711 4.220 0.026 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -14.304 3.865 -1.584 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -16.573 3.436 -0.622 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -15.963 3.874 0.962 1.00 0.00 H new ATOM 899 N PHE A 54 -15.925 0.607 -0.934 1.00 0.00 N ATOM 900 CA PHE A 54 -16.703 -0.230 -1.840 1.00 0.00 C ATOM 901 C PHE A 54 -17.963 0.496 -2.304 1.00 0.00 C ATOM 902 O PHE A 54 -18.538 1.295 -1.566 1.00 0.00 O ATOM 903 CB PHE A 54 -17.081 -1.545 -1.156 1.00 0.00 C ATOM 904 CG PHE A 54 -15.964 -2.549 -1.130 1.00 0.00 C ATOM 905 CD1 PHE A 54 -14.682 -2.171 -0.766 1.00 0.00 C ATOM 906 CD2 PHE A 54 -16.197 -3.872 -1.470 1.00 0.00 C ATOM 907 CE1 PHE A 54 -13.652 -3.093 -0.740 1.00 0.00 C ATOM 908 CE2 PHE A 54 -15.171 -4.799 -1.446 1.00 0.00 C ATOM 909 CZ PHE A 54 -13.897 -4.408 -1.082 1.00 0.00 C ATOM 0 H PHE A 54 -16.251 0.598 0.033 1.00 0.00 H new ATOM 0 HA PHE A 54 -16.087 -0.447 -2.713 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -17.395 -1.336 -0.133 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -17.938 -1.980 -1.670 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -14.485 -1.143 -0.499 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -17.191 -4.183 -1.757 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -12.658 -2.785 -0.453 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -15.366 -5.828 -1.712 1.00 0.00 H new ATOM 0 HZ PHE A 54 -13.094 -5.130 -1.065 1.00 0.00 H new ATOM 919 N GLU A 55 -18.384 0.210 -3.532 1.00 0.00 N ATOM 920 CA GLU A 55 -19.575 0.836 -4.095 1.00 0.00 C ATOM 921 C GLU A 55 -20.824 0.421 -3.323 1.00 0.00 C ATOM 922 O GLU A 55 -21.746 1.217 -3.138 1.00 0.00 O ATOM 923 CB GLU A 55 -19.726 0.462 -5.571 1.00 0.00 C ATOM 924 CG GLU A 55 -19.695 -1.036 -5.825 1.00 0.00 C ATOM 925 CD GLU A 55 -20.512 -1.439 -7.037 1.00 0.00 C ATOM 926 OE1 GLU A 55 -20.845 -0.552 -7.851 1.00 0.00 O ATOM 927 OE2 GLU A 55 -20.819 -2.642 -7.172 1.00 0.00 O ATOM 0 H GLU A 55 -17.919 -0.450 -4.155 1.00 0.00 H new ATOM 0 HA GLU A 55 -19.460 1.917 -4.012 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -20.667 0.866 -5.945 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -18.926 0.935 -6.141 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -18.662 -1.356 -5.965 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -20.074 -1.558 -4.946 1.00 0.00 H new ATOM 934 N LEU A 56 -20.848 -0.829 -2.876 1.00 0.00 N ATOM 935 CA LEU A 56 -21.984 -1.352 -2.125 1.00 0.00 C ATOM 936 C LEU A 56 -21.545 -1.849 -0.751 1.00 0.00 C ATOM 937 O LEU A 56 -20.405 -2.275 -0.569 1.00 0.00 O ATOM 938 CB LEU A 56 -22.654 -2.487 -2.901 1.00 0.00 C ATOM 939 CG LEU A 56 -22.960 -2.206 -4.372 1.00 0.00 C ATOM 940 CD1 LEU A 56 -23.572 -3.430 -5.034 1.00 0.00 C ATOM 941 CD2 LEU A 56 -23.887 -1.006 -4.505 1.00 0.00 C ATOM 0 H LEU A 56 -20.093 -1.500 -3.020 1.00 0.00 H new ATOM 0 HA LEU A 56 -22.701 -0.543 -1.986 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -22.012 -3.366 -2.846 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -23.587 -2.742 -2.399 1.00 0.00 H new ATOM 0 HG LEU A 56 -22.023 -1.974 -4.879 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -23.783 -3.210 -6.081 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -22.874 -4.265 -4.972 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -24.499 -3.694 -4.525 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -24.094 -0.821 -5.559 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -24.822 -1.209 -3.982 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -23.410 -0.128 -4.069 1.00 0.00 H new ATOM 953 N ALA A 57 -22.460 -1.794 0.212 1.00 0.00 N ATOM 954 CA ALA A 57 -22.169 -2.243 1.568 1.00 0.00 C ATOM 955 C ALA A 57 -22.050 -3.762 1.630 1.00 0.00 C ATOM 956 O ALA A 57 -21.251 -4.300 2.395 1.00 0.00 O ATOM 957 CB ALA A 57 -23.245 -1.756 2.527 1.00 0.00 C ATOM 0 H ALA A 57 -23.408 -1.443 0.078 1.00 0.00 H new ATOM 0 HA ALA A 57 -21.211 -1.818 1.868 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -23.015 -2.098 3.536 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -23.279 -0.667 2.513 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -24.213 -2.154 2.221 1.00 0.00 H new ATOM 963 N GLU A 58 -22.852 -4.447 0.820 1.00 0.00 N ATOM 964 CA GLU A 58 -22.836 -5.905 0.786 1.00 0.00 C ATOM 965 C GLU A 58 -21.457 -6.425 0.389 1.00 0.00 C ATOM 966 O GLU A 58 -20.872 -7.254 1.086 1.00 0.00 O ATOM 967 CB GLU A 58 -23.890 -6.425 -0.194 1.00 0.00 C ATOM 968 CG GLU A 58 -23.664 -5.975 -1.627 1.00 0.00 C ATOM 969 CD GLU A 58 -24.870 -6.221 -2.513 1.00 0.00 C ATOM 970 OE1 GLU A 58 -25.777 -5.363 -2.531 1.00 0.00 O ATOM 971 OE2 GLU A 58 -24.907 -7.270 -3.189 1.00 0.00 O ATOM 0 H GLU A 58 -23.519 -4.017 0.180 1.00 0.00 H new ATOM 0 HA GLU A 58 -23.068 -6.269 1.787 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -23.898 -7.514 -0.161 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -24.874 -6.089 0.132 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -23.422 -4.912 -1.636 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -22.803 -6.502 -2.038 1.00 0.00 H new ATOM 978 N ASP A 59 -20.946 -5.932 -0.733 1.00 0.00 N ATOM 979 CA ASP A 59 -19.636 -6.346 -1.223 1.00 0.00 C ATOM 980 C ASP A 59 -18.557 -6.085 -0.176 1.00 0.00 C ATOM 981 O ASP A 59 -17.656 -6.900 0.017 1.00 0.00 O ATOM 982 CB ASP A 59 -19.296 -5.608 -2.519 1.00 0.00 C ATOM 983 CG ASP A 59 -20.249 -5.951 -3.647 1.00 0.00 C ATOM 984 OD1 ASP A 59 -20.906 -7.010 -3.568 1.00 0.00 O ATOM 985 OD2 ASP A 59 -20.337 -5.160 -4.609 1.00 0.00 O ATOM 0 H ASP A 59 -21.418 -5.245 -1.321 1.00 0.00 H new ATOM 0 HA ASP A 59 -19.672 -7.417 -1.423 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -19.322 -4.533 -2.339 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -18.278 -5.856 -2.819 1.00 0.00 H new ATOM 990 N ALA A 60 -18.656 -4.942 0.495 1.00 0.00 N ATOM 991 CA ALA A 60 -17.689 -4.574 1.523 1.00 0.00 C ATOM 992 C ALA A 60 -17.609 -5.641 2.609 1.00 0.00 C ATOM 993 O ALA A 60 -16.533 -6.161 2.904 1.00 0.00 O ATOM 994 CB ALA A 60 -18.052 -3.227 2.130 1.00 0.00 C ATOM 0 H ALA A 60 -19.395 -4.255 0.346 1.00 0.00 H new ATOM 0 HA ALA A 60 -16.708 -4.497 1.054 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -17.322 -2.964 2.896 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -18.051 -2.465 1.351 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -19.044 -3.286 2.579 1.00 0.00 H new ATOM 1000 N ALA A 61 -18.755 -5.964 3.201 1.00 0.00 N ATOM 1001 CA ALA A 61 -18.814 -6.970 4.254 1.00 0.00 C ATOM 1002 C ALA A 61 -18.197 -8.286 3.790 1.00 0.00 C ATOM 1003 O ALA A 61 -17.459 -8.932 4.534 1.00 0.00 O ATOM 1004 CB ALA A 61 -20.253 -7.187 4.697 1.00 0.00 C ATOM 0 H ALA A 61 -19.655 -5.543 2.969 1.00 0.00 H new ATOM 0 HA ALA A 61 -18.235 -6.606 5.103 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -20.282 -7.941 5.484 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -20.662 -6.251 5.077 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -20.848 -7.525 3.849 1.00 0.00 H new ATOM 1010 N ALA A 62 -18.505 -8.677 2.558 1.00 0.00 N ATOM 1011 CA ALA A 62 -17.980 -9.915 1.996 1.00 0.00 C ATOM 1012 C ALA A 62 -16.464 -9.851 1.848 1.00 0.00 C ATOM 1013 O ALA A 62 -15.771 -10.853 2.024 1.00 0.00 O ATOM 1014 CB ALA A 62 -18.632 -10.203 0.652 1.00 0.00 C ATOM 0 H ALA A 62 -19.116 -8.154 1.930 1.00 0.00 H new ATOM 0 HA ALA A 62 -18.218 -10.727 2.684 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -18.230 -11.131 0.244 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -19.710 -10.301 0.784 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -18.424 -9.384 -0.036 1.00 0.00 H new ATOM 1020 N ALA A 63 -15.955 -8.667 1.523 1.00 0.00 N ATOM 1021 CA ALA A 63 -14.521 -8.473 1.352 1.00 0.00 C ATOM 1022 C ALA A 63 -13.776 -8.699 2.664 1.00 0.00 C ATOM 1023 O ALA A 63 -12.705 -9.306 2.683 1.00 0.00 O ATOM 1024 CB ALA A 63 -14.237 -7.077 0.816 1.00 0.00 C ATOM 0 H ALA A 63 -16.515 -7.828 1.373 1.00 0.00 H new ATOM 0 HA ALA A 63 -14.164 -9.207 0.630 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -13.162 -6.946 0.693 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -14.730 -6.950 -0.148 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -14.615 -6.334 1.518 1.00 0.00 H new ATOM 1030 N ILE A 64 -14.350 -8.207 3.757 1.00 0.00 N ATOM 1031 CA ILE A 64 -13.740 -8.357 5.072 1.00 0.00 C ATOM 1032 C ILE A 64 -13.727 -9.818 5.509 1.00 0.00 C ATOM 1033 O ILE A 64 -12.668 -10.391 5.764 1.00 0.00 O ATOM 1034 CB ILE A 64 -14.480 -7.521 6.134 1.00 0.00 C ATOM 1035 CG1 ILE A 64 -14.602 -6.067 5.676 1.00 0.00 C ATOM 1036 CG2 ILE A 64 -13.757 -7.603 7.470 1.00 0.00 C ATOM 1037 CD1 ILE A 64 -15.356 -5.188 6.649 1.00 0.00 C ATOM 0 H ILE A 64 -15.236 -7.702 3.758 1.00 0.00 H new ATOM 0 HA ILE A 64 -12.715 -7.997 4.987 1.00 0.00 H new ATOM 0 HB ILE A 64 -15.484 -7.927 6.261 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -13.603 -5.657 5.527 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -15.105 -6.040 4.709 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -14.291 -7.007 8.210 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -13.718 -8.641 7.799 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -12.743 -7.219 7.359 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -15.403 -4.171 6.259 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -16.367 -5.574 6.780 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -14.842 -5.185 7.610 1.00 0.00 H new ATOM 1049 N ASP A 65 -14.911 -10.415 5.592 1.00 0.00 N ATOM 1050 CA ASP A 65 -15.036 -11.811 5.995 1.00 0.00 C ATOM 1051 C ASP A 65 -14.011 -12.679 5.273 1.00 0.00 C ATOM 1052 O ASP A 65 -13.670 -13.768 5.735 1.00 0.00 O ATOM 1053 CB ASP A 65 -16.449 -12.322 5.708 1.00 0.00 C ATOM 1054 CG ASP A 65 -17.437 -11.931 6.789 1.00 0.00 C ATOM 1055 OD1 ASP A 65 -17.211 -12.301 7.960 1.00 0.00 O ATOM 1056 OD2 ASP A 65 -18.437 -11.257 6.464 1.00 0.00 O ATOM 0 H ASP A 65 -15.797 -9.954 5.386 1.00 0.00 H new ATOM 0 HA ASP A 65 -14.846 -11.873 7.067 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -16.788 -11.927 4.750 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -16.428 -13.408 5.615 1.00 0.00 H new ATOM 1061 N ASN A 66 -13.524 -12.191 4.137 1.00 0.00 N ATOM 1062 CA ASN A 66 -12.539 -12.923 3.350 1.00 0.00 C ATOM 1063 C ASN A 66 -11.173 -12.246 3.422 1.00 0.00 C ATOM 1064 O ASN A 66 -10.263 -12.731 4.094 1.00 0.00 O ATOM 1065 CB ASN A 66 -12.993 -13.026 1.893 1.00 0.00 C ATOM 1066 CG ASN A 66 -14.241 -13.873 1.735 1.00 0.00 C ATOM 1067 OD1 ASN A 66 -15.338 -13.429 2.339 1.00 0.00 O flip ATOM 1068 ND2 ASN A 66 -14.219 -14.915 1.079 1.00 0.00 N flip ATOM 0 H ASN A 66 -13.796 -11.291 3.741 1.00 0.00 H new ATOM 0 HA ASN A 66 -12.451 -13.926 3.767 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -13.184 -12.026 1.503 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -12.189 -13.453 1.294 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -13.354 -15.218 0.632 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -15.066 -15.475 0.983 1.00 0.00 H new ATOM 1075 N MET A 67 -11.039 -11.123 2.725 1.00 0.00 N ATOM 1076 CA MET A 67 -9.785 -10.378 2.711 1.00 0.00 C ATOM 1077 C MET A 67 -9.086 -10.465 4.064 1.00 0.00 C ATOM 1078 O MET A 67 -7.858 -10.464 4.140 1.00 0.00 O ATOM 1079 CB MET A 67 -10.040 -8.914 2.349 1.00 0.00 C ATOM 1080 CG MET A 67 -10.732 -8.731 1.008 1.00 0.00 C ATOM 1081 SD MET A 67 -9.569 -8.466 -0.343 1.00 0.00 S ATOM 1082 CE MET A 67 -8.290 -9.648 0.075 1.00 0.00 C ATOM 0 H MET A 67 -11.782 -10.709 2.163 1.00 0.00 H new ATOM 0 HA MET A 67 -9.136 -10.823 1.957 1.00 0.00 H new ATOM 0 HB2 MET A 67 -10.649 -8.456 3.128 1.00 0.00 H new ATOM 0 HB3 MET A 67 -9.089 -8.381 2.334 1.00 0.00 H new ATOM 0 HG2 MET A 67 -11.338 -9.611 0.793 1.00 0.00 H new ATOM 0 HG3 MET A 67 -11.413 -7.882 1.068 1.00 0.00 H new ATOM 0 HE1 MET A 67 -7.531 -9.655 -0.707 1.00 0.00 H new ATOM 0 HE2 MET A 67 -7.831 -9.368 1.023 1.00 0.00 H new ATOM 0 HE3 MET A 67 -8.728 -10.642 0.164 1.00 0.00 H new ATOM 1092 N ASN A 68 -9.876 -10.540 5.130 1.00 0.00 N ATOM 1093 CA ASN A 68 -9.332 -10.626 6.480 1.00 0.00 C ATOM 1094 C ASN A 68 -8.433 -11.850 6.627 1.00 0.00 C ATOM 1095 O ASN A 68 -8.813 -12.960 6.255 1.00 0.00 O ATOM 1096 CB ASN A 68 -10.466 -10.687 7.506 1.00 0.00 C ATOM 1097 CG ASN A 68 -9.974 -11.067 8.889 1.00 0.00 C ATOM 1098 OD1 ASN A 68 -9.876 -12.366 9.147 1.00 0.00 O flip ATOM 1099 ND2 ASN A 68 -9.685 -10.202 9.717 1.00 0.00 N flip ATOM 0 H ASN A 68 -10.895 -10.543 5.085 1.00 0.00 H new ATOM 0 HA ASN A 68 -8.734 -9.733 6.661 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -10.962 -9.718 7.553 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -11.212 -11.411 7.177 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -9.775 -9.215 9.476 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -9.355 -10.473 10.643 1.00 0.00 H new ATOM 1106 N GLU A 69 -7.239 -11.638 7.171 1.00 0.00 N ATOM 1107 CA GLU A 69 -6.285 -12.724 7.367 1.00 0.00 C ATOM 1108 C GLU A 69 -6.070 -13.499 6.070 1.00 0.00 C ATOM 1109 O GLU A 69 -5.988 -14.727 6.074 1.00 0.00 O ATOM 1110 CB GLU A 69 -6.775 -13.671 8.464 1.00 0.00 C ATOM 1111 CG GLU A 69 -6.937 -13.001 9.818 1.00 0.00 C ATOM 1112 CD GLU A 69 -7.563 -13.918 10.852 1.00 0.00 C ATOM 1113 OE1 GLU A 69 -8.341 -14.812 10.458 1.00 0.00 O ATOM 1114 OE2 GLU A 69 -7.274 -13.741 12.054 1.00 0.00 O ATOM 0 H GLU A 69 -6.909 -10.725 7.484 1.00 0.00 H new ATOM 0 HA GLU A 69 -5.334 -12.288 7.672 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -7.731 -14.099 8.163 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -6.072 -14.498 8.559 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.962 -12.670 10.174 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.555 -12.110 9.707 1.00 0.00 H new ATOM 1121 N SER A 70 -5.980 -12.771 4.961 1.00 0.00 N ATOM 1122 CA SER A 70 -5.778 -13.390 3.656 1.00 0.00 C ATOM 1123 C SER A 70 -4.301 -13.390 3.277 1.00 0.00 C ATOM 1124 O SER A 70 -3.489 -12.707 3.901 1.00 0.00 O ATOM 1125 CB SER A 70 -6.590 -12.653 2.588 1.00 0.00 C ATOM 1126 OG SER A 70 -7.954 -13.034 2.632 1.00 0.00 O ATOM 0 H SER A 70 -6.044 -11.753 4.940 1.00 0.00 H new ATOM 0 HA SER A 70 -6.120 -14.423 3.715 1.00 0.00 H new ATOM 0 HB2 SER A 70 -6.505 -11.577 2.740 1.00 0.00 H new ATOM 0 HB3 SER A 70 -6.180 -12.869 1.601 1.00 0.00 H new ATOM 0 HG SER A 70 -8.342 -12.965 1.735 1.00 0.00 H new ATOM 1132 N GLU A 71 -3.960 -14.161 2.249 1.00 0.00 N ATOM 1133 CA GLU A 71 -2.580 -14.251 1.787 1.00 0.00 C ATOM 1134 C GLU A 71 -2.346 -13.334 0.590 1.00 0.00 C ATOM 1135 O GLU A 71 -2.971 -13.493 -0.460 1.00 0.00 O ATOM 1136 CB GLU A 71 -2.237 -15.695 1.413 1.00 0.00 C ATOM 1137 CG GLU A 71 -0.750 -15.934 1.209 1.00 0.00 C ATOM 1138 CD GLU A 71 -0.373 -17.398 1.327 1.00 0.00 C ATOM 1139 OE1 GLU A 71 -0.978 -18.226 0.616 1.00 0.00 O ATOM 1140 OE2 GLU A 71 0.528 -17.714 2.132 1.00 0.00 O ATOM 0 H GLU A 71 -4.620 -14.732 1.721 1.00 0.00 H new ATOM 0 HA GLU A 71 -1.930 -13.930 2.601 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -2.599 -16.360 2.197 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -2.768 -15.961 0.499 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -0.458 -15.566 0.226 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -0.189 -15.358 1.945 1.00 0.00 H new ATOM 1147 N LEU A 72 -1.442 -12.374 0.755 1.00 0.00 N ATOM 1148 CA LEU A 72 -1.125 -11.431 -0.311 1.00 0.00 C ATOM 1149 C LEU A 72 0.371 -11.134 -0.349 1.00 0.00 C ATOM 1150 O LEU A 72 1.015 -11.006 0.693 1.00 0.00 O ATOM 1151 CB LEU A 72 -1.910 -10.132 -0.120 1.00 0.00 C ATOM 1152 CG LEU A 72 -1.735 -9.075 -1.211 1.00 0.00 C ATOM 1153 CD1 LEU A 72 -2.531 -9.452 -2.451 1.00 0.00 C ATOM 1154 CD2 LEU A 72 -2.158 -7.706 -0.699 1.00 0.00 C ATOM 0 H LEU A 72 -0.916 -12.229 1.617 1.00 0.00 H new ATOM 0 HA LEU A 72 -1.411 -11.885 -1.260 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.969 -10.379 -0.048 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -1.619 -9.692 0.834 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.680 -9.030 -1.481 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.395 -8.689 -3.217 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -2.181 -10.412 -2.830 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -3.588 -9.526 -2.196 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.027 -6.966 -1.488 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -3.206 -7.737 -0.401 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.545 -7.433 0.160 1.00 0.00 H new ATOM 1166 N PHE A 73 0.917 -11.022 -1.555 1.00 0.00 N ATOM 1167 CA PHE A 73 2.336 -10.739 -1.728 1.00 0.00 C ATOM 1168 C PHE A 73 3.185 -11.657 -0.853 1.00 0.00 C ATOM 1169 O PHE A 73 4.270 -11.282 -0.411 1.00 0.00 O ATOM 1170 CB PHE A 73 2.631 -9.276 -1.389 1.00 0.00 C ATOM 1171 CG PHE A 73 2.498 -8.350 -2.564 1.00 0.00 C ATOM 1172 CD1 PHE A 73 1.351 -8.356 -3.341 1.00 0.00 C ATOM 1173 CD2 PHE A 73 3.520 -7.473 -2.890 1.00 0.00 C ATOM 1174 CE1 PHE A 73 1.226 -7.504 -4.423 1.00 0.00 C ATOM 1175 CE2 PHE A 73 3.399 -6.619 -3.970 1.00 0.00 C ATOM 1176 CZ PHE A 73 2.251 -6.635 -4.738 1.00 0.00 C ATOM 0 H PHE A 73 0.398 -11.123 -2.427 1.00 0.00 H new ATOM 0 HA PHE A 73 2.593 -10.922 -2.771 1.00 0.00 H new ATOM 0 HB2 PHE A 73 1.952 -8.950 -0.601 1.00 0.00 H new ATOM 0 HB3 PHE A 73 3.642 -9.201 -0.990 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.546 -9.034 -3.099 1.00 0.00 H new ATOM 0 HD2 PHE A 73 4.421 -7.457 -2.294 1.00 0.00 H new ATOM 0 HE1 PHE A 73 0.327 -7.519 -5.021 1.00 0.00 H new ATOM 0 HE2 PHE A 73 4.202 -5.939 -4.213 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.156 -5.969 -5.583 1.00 0.00 H new ATOM 1186 N GLY A 74 2.681 -12.862 -0.608 1.00 0.00 N ATOM 1187 CA GLY A 74 3.405 -13.815 0.214 1.00 0.00 C ATOM 1188 C GLY A 74 3.432 -13.417 1.676 1.00 0.00 C ATOM 1189 O GLY A 74 4.432 -13.625 2.364 1.00 0.00 O ATOM 0 H GLY A 74 1.785 -13.196 -0.963 1.00 0.00 H new ATOM 0 HA2 GLY A 74 2.944 -14.798 0.117 1.00 0.00 H new ATOM 0 HA3 GLY A 74 4.427 -13.905 -0.154 1.00 0.00 H new ATOM 1193 N ARG A 75 2.332 -12.843 2.152 1.00 0.00 N ATOM 1194 CA ARG A 75 2.235 -12.412 3.541 1.00 0.00 C ATOM 1195 C ARG A 75 0.785 -12.425 4.014 1.00 0.00 C ATOM 1196 O ARG A 75 -0.139 -12.587 3.216 1.00 0.00 O ATOM 1197 CB ARG A 75 2.824 -11.009 3.705 1.00 0.00 C ATOM 1198 CG ARG A 75 1.808 -9.896 3.506 1.00 0.00 C ATOM 1199 CD ARG A 75 2.473 -8.613 3.030 1.00 0.00 C ATOM 1200 NE ARG A 75 2.855 -7.749 4.144 1.00 0.00 N ATOM 1201 CZ ARG A 75 3.989 -7.883 4.823 1.00 0.00 C ATOM 1202 NH1 ARG A 75 4.848 -8.840 4.502 1.00 0.00 N ATOM 1203 NH2 ARG A 75 4.265 -7.057 5.824 1.00 0.00 N ATOM 0 H ARG A 75 1.495 -12.666 1.596 1.00 0.00 H new ATOM 0 HA ARG A 75 2.805 -13.111 4.153 1.00 0.00 H new ATOM 0 HB2 ARG A 75 3.258 -10.920 4.701 1.00 0.00 H new ATOM 0 HB3 ARG A 75 3.637 -10.879 2.991 1.00 0.00 H new ATOM 0 HG2 ARG A 75 1.060 -10.211 2.779 1.00 0.00 H new ATOM 0 HG3 ARG A 75 1.283 -9.709 4.443 1.00 0.00 H new ATOM 0 HD2 ARG A 75 3.357 -8.859 2.442 1.00 0.00 H new ATOM 0 HD3 ARG A 75 1.792 -8.075 2.371 1.00 0.00 H new ATOM 0 HE ARG A 75 2.216 -7.002 4.416 1.00 0.00 H new ATOM 0 HH11 ARG A 75 4.639 -9.476 3.732 1.00 0.00 H new ATOM 0 HH12 ARG A 75 5.718 -8.941 5.025 1.00 0.00 H new ATOM 0 HH21 ARG A 75 3.606 -6.319 6.072 1.00 0.00 H new ATOM 0 HH22 ARG A 75 5.136 -7.160 6.345 1.00 0.00 H new ATOM 1217 N THR A 76 0.591 -12.254 5.319 1.00 0.00 N ATOM 1218 CA THR A 76 -0.745 -12.247 5.899 1.00 0.00 C ATOM 1219 C THR A 76 -1.181 -10.832 6.261 1.00 0.00 C ATOM 1220 O THR A 76 -0.547 -10.169 7.082 1.00 0.00 O ATOM 1221 CB THR A 76 -0.816 -13.132 7.158 1.00 0.00 C ATOM 1222 OG1 THR A 76 -0.289 -14.433 6.872 1.00 0.00 O ATOM 1223 CG2 THR A 76 -2.249 -13.257 7.653 1.00 0.00 C ATOM 0 H THR A 76 1.344 -12.118 5.994 1.00 0.00 H new ATOM 0 HA THR A 76 -1.419 -12.649 5.143 1.00 0.00 H new ATOM 0 HB THR A 76 -0.219 -12.662 7.940 1.00 0.00 H new ATOM 0 HG1 THR A 76 -0.336 -14.989 7.677 1.00 0.00 H new ATOM 0 HG21 THR A 76 -2.273 -13.886 8.543 1.00 0.00 H new ATOM 0 HG22 THR A 76 -2.637 -12.268 7.898 1.00 0.00 H new ATOM 0 HG23 THR A 76 -2.865 -13.706 6.874 1.00 0.00 H new ATOM 1231 N ILE A 77 -2.267 -10.377 5.645 1.00 0.00 N ATOM 1232 CA ILE A 77 -2.788 -9.040 5.905 1.00 0.00 C ATOM 1233 C ILE A 77 -4.031 -9.097 6.786 1.00 0.00 C ATOM 1234 O ILE A 77 -4.691 -10.131 6.880 1.00 0.00 O ATOM 1235 CB ILE A 77 -3.133 -8.306 4.596 1.00 0.00 C ATOM 1236 CG1 ILE A 77 -4.170 -9.100 3.799 1.00 0.00 C ATOM 1237 CG2 ILE A 77 -1.877 -8.083 3.766 1.00 0.00 C ATOM 1238 CD1 ILE A 77 -4.799 -8.312 2.671 1.00 0.00 C ATOM 0 H ILE A 77 -2.803 -10.914 4.963 1.00 0.00 H new ATOM 0 HA ILE A 77 -2.003 -8.490 6.424 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.559 -7.334 4.844 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.696 -9.991 3.388 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.954 -9.439 4.476 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -2.138 -7.563 2.844 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.168 -7.481 4.334 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -1.425 -9.045 3.525 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.524 -8.938 2.150 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -5.303 -7.435 3.077 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -4.025 -7.995 1.972 1.00 0.00 H new ATOM 1250 N ARG A 78 -4.345 -7.976 7.429 1.00 0.00 N ATOM 1251 CA ARG A 78 -5.509 -7.898 8.303 1.00 0.00 C ATOM 1252 C ARG A 78 -6.520 -6.885 7.772 1.00 0.00 C ATOM 1253 O ARG A 78 -6.162 -5.761 7.420 1.00 0.00 O ATOM 1254 CB ARG A 78 -5.084 -7.514 9.721 1.00 0.00 C ATOM 1255 CG ARG A 78 -5.999 -8.067 10.802 1.00 0.00 C ATOM 1256 CD ARG A 78 -5.290 -8.146 12.145 1.00 0.00 C ATOM 1257 NE ARG A 78 -6.223 -8.386 13.243 1.00 0.00 N ATOM 1258 CZ ARG A 78 -7.039 -7.458 13.731 1.00 0.00 C ATOM 1259 NH1 ARG A 78 -7.037 -6.234 13.221 1.00 0.00 N ATOM 1260 NH2 ARG A 78 -7.859 -7.754 14.731 1.00 0.00 N ATOM 0 H ARG A 78 -3.810 -7.110 7.361 1.00 0.00 H new ATOM 0 HA ARG A 78 -5.981 -8.880 8.326 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -4.070 -7.873 9.897 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -5.056 -6.427 9.801 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -6.882 -7.434 10.892 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -6.346 -9.059 10.514 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -4.549 -8.945 12.117 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -4.750 -7.217 12.325 1.00 0.00 H new ATOM 0 HE ARG A 78 -6.250 -9.317 13.658 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -6.408 -6.003 12.452 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -7.665 -5.524 13.598 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -7.863 -8.695 15.126 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -8.485 -7.041 15.105 1.00 0.00 H new ATOM 1274 N VAL A 79 -7.784 -7.292 7.716 1.00 0.00 N ATOM 1275 CA VAL A 79 -8.847 -6.421 7.229 1.00 0.00 C ATOM 1276 C VAL A 79 -9.936 -6.242 8.280 1.00 0.00 C ATOM 1277 O VAL A 79 -10.288 -7.184 8.990 1.00 0.00 O ATOM 1278 CB VAL A 79 -9.479 -6.975 5.938 1.00 0.00 C ATOM 1279 CG1 VAL A 79 -10.480 -5.983 5.366 1.00 0.00 C ATOM 1280 CG2 VAL A 79 -8.402 -7.307 4.917 1.00 0.00 C ATOM 0 H VAL A 79 -8.097 -8.220 8.002 1.00 0.00 H new ATOM 0 HA VAL A 79 -8.391 -5.454 7.015 1.00 0.00 H new ATOM 0 HB VAL A 79 -10.012 -7.894 6.181 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -10.916 -6.391 4.454 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.269 -5.800 6.096 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -9.973 -5.045 5.137 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -8.867 -7.697 4.012 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -7.839 -6.405 4.676 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -7.727 -8.057 5.330 1.00 0.00 H new ATOM 1290 N ASN A 80 -10.467 -5.027 8.374 1.00 0.00 N ATOM 1291 CA ASN A 80 -11.518 -4.725 9.339 1.00 0.00 C ATOM 1292 C ASN A 80 -12.138 -3.360 9.057 1.00 0.00 C ATOM 1293 O ASN A 80 -11.573 -2.548 8.323 1.00 0.00 O ATOM 1294 CB ASN A 80 -10.957 -4.759 10.762 1.00 0.00 C ATOM 1295 CG ASN A 80 -12.037 -4.973 11.804 1.00 0.00 C ATOM 1296 OD1 ASN A 80 -12.932 -5.800 11.627 1.00 0.00 O ATOM 1297 ND2 ASN A 80 -11.959 -4.225 12.899 1.00 0.00 N ATOM 0 H ASN A 80 -10.187 -4.236 7.794 1.00 0.00 H new ATOM 0 HA ASN A 80 -12.295 -5.484 9.244 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -10.218 -5.557 10.839 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -10.438 -3.823 10.968 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -12.658 -4.324 13.635 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -11.200 -3.552 13.004 1.00 0.00 H new ATOM 1304 N LEU A 81 -13.303 -3.113 9.646 1.00 0.00 N ATOM 1305 CA LEU A 81 -14.001 -1.846 9.459 1.00 0.00 C ATOM 1306 C LEU A 81 -13.135 -0.675 9.912 1.00 0.00 C ATOM 1307 O LEU A 81 -12.488 -0.737 10.957 1.00 0.00 O ATOM 1308 CB LEU A 81 -15.320 -1.849 10.235 1.00 0.00 C ATOM 1309 CG LEU A 81 -16.481 -2.599 9.581 1.00 0.00 C ATOM 1310 CD1 LEU A 81 -17.622 -2.783 10.569 1.00 0.00 C ATOM 1311 CD2 LEU A 81 -16.962 -1.861 8.340 1.00 0.00 C ATOM 0 H LEU A 81 -13.784 -3.773 10.257 1.00 0.00 H new ATOM 0 HA LEU A 81 -14.211 -1.729 8.396 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -15.139 -2.285 11.218 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -15.626 -0.815 10.396 1.00 0.00 H new ATOM 0 HG LEU A 81 -16.127 -3.584 9.279 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -18.439 -3.319 10.086 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -17.271 -3.355 11.428 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -17.975 -1.807 10.903 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -17.788 -2.409 7.888 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -17.298 -0.862 8.618 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -16.144 -1.782 7.624 1.00 0.00 H new ATOM 1323 N ALA A 82 -13.129 0.392 9.120 1.00 0.00 N ATOM 1324 CA ALA A 82 -12.346 1.578 9.441 1.00 0.00 C ATOM 1325 C ALA A 82 -12.628 2.054 10.862 1.00 0.00 C ATOM 1326 O ALA A 82 -13.779 2.094 11.298 1.00 0.00 O ATOM 1327 CB ALA A 82 -12.637 2.689 8.443 1.00 0.00 C ATOM 0 H ALA A 82 -13.658 0.459 8.251 1.00 0.00 H new ATOM 0 HA ALA A 82 -11.290 1.314 9.377 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -12.045 3.569 8.695 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -12.378 2.353 7.439 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -13.697 2.942 8.479 1.00 0.00 H new ATOM 1333 N LYS A 83 -11.571 2.413 11.582 1.00 0.00 N ATOM 1334 CA LYS A 83 -11.704 2.887 12.954 1.00 0.00 C ATOM 1335 C LYS A 83 -12.356 4.266 12.993 1.00 0.00 C ATOM 1336 O LYS A 83 -12.272 5.046 12.044 1.00 0.00 O ATOM 1337 CB LYS A 83 -10.333 2.940 13.633 1.00 0.00 C ATOM 1338 CG LYS A 83 -9.743 1.570 13.920 1.00 0.00 C ATOM 1339 CD LYS A 83 -8.452 1.674 14.714 1.00 0.00 C ATOM 1340 CE LYS A 83 -7.511 0.521 14.402 1.00 0.00 C ATOM 1341 NZ LYS A 83 -8.096 -0.793 14.789 1.00 0.00 N ATOM 0 H LYS A 83 -10.611 2.385 11.237 1.00 0.00 H new ATOM 0 HA LYS A 83 -12.343 2.187 13.493 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -9.644 3.497 12.998 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -10.421 3.492 14.569 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -10.465 0.971 14.475 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -9.553 1.051 12.981 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -7.959 2.619 14.486 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -8.679 1.681 15.780 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -7.282 0.517 13.336 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -6.569 0.668 14.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -7.392 -1.544 14.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -8.369 -0.769 15.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -8.936 -0.984 14.206 1.00 0.00 H new ATOM 1355 N PRO A 84 -13.020 4.576 14.117 1.00 0.00 N ATOM 1356 CA PRO A 84 -13.697 5.862 14.307 1.00 0.00 C ATOM 1357 C PRO A 84 -12.714 7.019 14.452 1.00 0.00 C ATOM 1358 O PRO A 84 -13.116 8.175 14.575 1.00 0.00 O ATOM 1359 CB PRO A 84 -14.482 5.661 15.605 1.00 0.00 C ATOM 1360 CG PRO A 84 -13.734 4.603 16.340 1.00 0.00 C ATOM 1361 CD PRO A 84 -13.161 3.695 15.288 1.00 0.00 C ATOM 0 HA PRO A 84 -14.320 6.125 13.452 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -14.534 6.584 16.183 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -15.508 5.353 15.404 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -12.944 5.038 16.953 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -14.394 4.054 17.012 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -12.202 3.279 15.596 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -13.822 2.853 15.080 1.00 0.00 H new ATOM 1369 N MET A 85 -11.424 6.698 14.438 1.00 0.00 N ATOM 1370 CA MET A 85 -10.384 7.712 14.566 1.00 0.00 C ATOM 1371 C MET A 85 -10.708 8.683 15.697 1.00 0.00 C ATOM 1372 O MET A 85 -10.604 9.899 15.532 1.00 0.00 O ATOM 1373 CB MET A 85 -10.222 8.477 13.252 1.00 0.00 C ATOM 1374 CG MET A 85 -8.874 9.167 13.112 1.00 0.00 C ATOM 1375 SD MET A 85 -7.491 8.016 13.214 1.00 0.00 S ATOM 1376 CE MET A 85 -7.072 8.142 14.951 1.00 0.00 C ATOM 0 H MET A 85 -11.075 5.745 14.339 1.00 0.00 H new ATOM 0 HA MET A 85 -9.447 7.207 14.801 1.00 0.00 H new ATOM 0 HB2 MET A 85 -10.355 7.786 12.420 1.00 0.00 H new ATOM 0 HB3 MET A 85 -11.013 9.223 13.176 1.00 0.00 H new ATOM 0 HG2 MET A 85 -8.836 9.691 12.157 1.00 0.00 H new ATOM 0 HG3 MET A 85 -8.773 9.920 13.893 1.00 0.00 H new ATOM 0 HE1 MET A 85 -6.758 7.166 15.321 1.00 0.00 H new ATOM 0 HE2 MET A 85 -6.259 8.857 15.078 1.00 0.00 H new ATOM 0 HE3 MET A 85 -7.943 8.480 15.512 1.00 0.00 H new ATOM 1386 N ARG A 86 -11.101 8.139 16.844 1.00 0.00 N ATOM 1387 CA ARG A 86 -11.442 8.959 18.001 1.00 0.00 C ATOM 1388 C ARG A 86 -10.236 9.134 18.918 1.00 0.00 C ATOM 1389 O ARG A 86 -9.913 8.249 19.711 1.00 0.00 O ATOM 1390 CB ARG A 86 -12.599 8.326 18.777 1.00 0.00 C ATOM 1391 CG ARG A 86 -13.332 9.303 19.682 1.00 0.00 C ATOM 1392 CD ARG A 86 -14.264 10.205 18.888 1.00 0.00 C ATOM 1393 NE ARG A 86 -15.440 9.487 18.404 1.00 0.00 N ATOM 1394 CZ ARG A 86 -16.404 10.053 17.687 1.00 0.00 C ATOM 1395 NH1 ARG A 86 -16.331 11.339 17.371 1.00 0.00 N ATOM 1396 NH2 ARG A 86 -17.443 9.333 17.283 1.00 0.00 N ATOM 0 H ARG A 86 -11.191 7.135 16.997 1.00 0.00 H new ATOM 0 HA ARG A 86 -11.748 9.941 17.641 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -13.308 7.897 18.069 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -12.214 7.504 19.380 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -13.905 8.751 20.427 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -12.608 9.912 20.224 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -14.581 11.039 19.514 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -13.724 10.629 18.041 1.00 0.00 H new ATOM 0 HE ARG A 86 -15.526 8.496 18.629 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -15.533 11.895 17.679 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -17.072 11.772 16.820 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -17.502 8.343 17.523 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -18.183 9.769 16.732 1.00 0.00 H new ATOM 1410 N ILE A 87 -9.573 10.280 18.803 1.00 0.00 N ATOM 1411 CA ILE A 87 -8.403 10.571 19.621 1.00 0.00 C ATOM 1412 C ILE A 87 -8.758 11.498 20.778 1.00 0.00 C ATOM 1413 O ILE A 87 -7.959 12.346 21.177 1.00 0.00 O ATOM 1414 CB ILE A 87 -7.279 11.214 18.788 1.00 0.00 C ATOM 1415 CG1 ILE A 87 -7.695 12.612 18.324 1.00 0.00 C ATOM 1416 CG2 ILE A 87 -6.933 10.335 17.596 1.00 0.00 C ATOM 1417 CD1 ILE A 87 -6.530 13.482 17.907 1.00 0.00 C ATOM 0 H ILE A 87 -9.827 11.022 18.151 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.050 9.619 20.017 1.00 0.00 H new ATOM 0 HB ILE A 87 -6.391 11.308 19.414 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.385 12.517 17.486 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -8.237 13.107 19.130 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -6.137 10.804 17.017 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -6.599 9.359 17.948 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -7.814 10.212 16.967 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.899 14.457 17.590 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.850 13.608 18.749 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -6.000 13.009 17.080 1.00 0.00 H new ATOM 1429 N LYS A 88 -9.962 11.331 21.316 1.00 0.00 N ATOM 1430 CA LYS A 88 -10.423 12.150 22.430 1.00 0.00 C ATOM 1431 C LYS A 88 -11.053 11.286 23.517 1.00 0.00 C ATOM 1432 O LYS A 88 -11.590 10.214 23.236 1.00 0.00 O ATOM 1433 CB LYS A 88 -11.434 13.190 21.940 1.00 0.00 C ATOM 1434 CG LYS A 88 -11.671 14.320 22.927 1.00 0.00 C ATOM 1435 CD LYS A 88 -13.033 14.963 22.723 1.00 0.00 C ATOM 1436 CE LYS A 88 -13.310 16.027 23.774 1.00 0.00 C ATOM 1437 NZ LYS A 88 -12.590 17.297 23.481 1.00 0.00 N ATOM 0 H LYS A 88 -10.636 10.635 20.998 1.00 0.00 H new ATOM 0 HA LYS A 88 -9.559 12.662 22.854 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -11.083 13.610 20.997 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -12.382 12.694 21.734 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -11.598 13.937 23.945 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -10.891 15.073 22.813 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -13.080 15.410 21.730 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -13.808 14.198 22.765 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -14.382 16.220 23.822 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -13.009 15.657 24.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -12.805 17.996 24.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -11.566 17.119 23.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -12.896 17.664 22.557 1.00 0.00 H new ATOM 1451 N GLU A 89 -10.985 11.759 24.757 1.00 0.00 N ATOM 1452 CA GLU A 89 -11.550 11.028 25.885 1.00 0.00 C ATOM 1453 C GLU A 89 -13.036 11.336 26.044 1.00 0.00 C ATOM 1454 O GLU A 89 -13.413 12.430 26.462 1.00 0.00 O ATOM 1455 CB GLU A 89 -10.805 11.379 27.174 1.00 0.00 C ATOM 1456 CG GLU A 89 -9.558 10.542 27.404 1.00 0.00 C ATOM 1457 CD GLU A 89 -8.760 11.002 28.609 1.00 0.00 C ATOM 1458 OE1 GLU A 89 -9.288 10.918 29.738 1.00 0.00 O ATOM 1459 OE2 GLU A 89 -7.608 11.446 28.423 1.00 0.00 O ATOM 0 H GLU A 89 -10.545 12.645 25.006 1.00 0.00 H new ATOM 0 HA GLU A 89 -11.437 9.962 25.687 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -10.525 12.432 27.147 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -11.480 11.250 28.020 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -9.845 9.499 27.540 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -8.927 10.586 26.517 1.00 0.00 H new ATOM 1466 N SER A 90 -13.876 10.362 25.706 1.00 0.00 N ATOM 1467 CA SER A 90 -15.321 10.530 25.807 1.00 0.00 C ATOM 1468 C SER A 90 -15.755 10.636 27.265 1.00 0.00 C ATOM 1469 O SER A 90 -14.955 10.439 28.179 1.00 0.00 O ATOM 1470 CB SER A 90 -16.039 9.359 25.133 1.00 0.00 C ATOM 1471 OG SER A 90 -15.645 9.231 23.778 1.00 0.00 O ATOM 0 H SER A 90 -13.581 9.449 25.360 1.00 0.00 H new ATOM 0 HA SER A 90 -15.591 11.455 25.298 1.00 0.00 H new ATOM 0 HB2 SER A 90 -15.817 8.436 25.668 1.00 0.00 H new ATOM 0 HB3 SER A 90 -17.117 9.509 25.189 1.00 0.00 H new ATOM 0 HG SER A 90 -16.116 8.475 23.370 1.00 0.00 H new ATOM 1477 N GLY A 91 -17.030 10.950 27.475 1.00 0.00 N ATOM 1478 CA GLY A 91 -17.550 11.077 28.824 1.00 0.00 C ATOM 1479 C GLY A 91 -19.066 11.076 28.864 1.00 0.00 C ATOM 1480 O GLY A 91 -19.733 11.534 27.936 1.00 0.00 O ATOM 0 H GLY A 91 -17.712 11.119 26.735 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -17.173 10.256 29.434 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -17.179 12.001 29.268 1.00 0.00 H new ATOM 1484 N PRO A 92 -19.632 10.548 29.959 1.00 0.00 N ATOM 1485 CA PRO A 92 -21.085 10.475 30.142 1.00 0.00 C ATOM 1486 C PRO A 92 -21.712 11.848 30.359 1.00 0.00 C ATOM 1487 O PRO A 92 -21.038 12.872 30.251 1.00 0.00 O ATOM 1488 CB PRO A 92 -21.241 9.611 31.396 1.00 0.00 C ATOM 1489 CG PRO A 92 -19.967 9.797 32.145 1.00 0.00 C ATOM 1490 CD PRO A 92 -18.898 9.984 31.104 1.00 0.00 C ATOM 0 HA PRO A 92 -21.587 10.070 29.263 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -22.099 9.926 31.990 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -21.399 8.564 31.138 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -20.025 10.663 32.805 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -19.753 8.932 32.773 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -18.114 10.657 31.450 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -18.417 9.040 30.848 1.00 0.00 H new ATOM 1498 N SER A 93 -23.005 11.861 30.665 1.00 0.00 N ATOM 1499 CA SER A 93 -23.724 13.108 30.894 1.00 0.00 C ATOM 1500 C SER A 93 -25.008 12.859 31.679 1.00 0.00 C ATOM 1501 O SER A 93 -25.803 11.986 31.331 1.00 0.00 O ATOM 1502 CB SER A 93 -24.051 13.785 29.562 1.00 0.00 C ATOM 1503 OG SER A 93 -24.219 15.183 29.727 1.00 0.00 O ATOM 0 H SER A 93 -23.576 11.021 30.760 1.00 0.00 H new ATOM 0 HA SER A 93 -23.082 13.766 31.480 1.00 0.00 H new ATOM 0 HB2 SER A 93 -23.251 13.594 28.847 1.00 0.00 H new ATOM 0 HB3 SER A 93 -24.961 13.353 29.145 1.00 0.00 H new ATOM 0 HG SER A 93 -24.425 15.592 28.861 1.00 0.00 H new ATOM 1509 N SER A 94 -25.204 13.634 32.742 1.00 0.00 N ATOM 1510 CA SER A 94 -26.390 13.496 33.580 1.00 0.00 C ATOM 1511 C SER A 94 -27.662 13.640 32.750 1.00 0.00 C ATOM 1512 O SER A 94 -28.596 12.850 32.884 1.00 0.00 O ATOM 1513 CB SER A 94 -26.375 14.542 34.697 1.00 0.00 C ATOM 1514 OG SER A 94 -26.620 15.840 34.183 1.00 0.00 O ATOM 0 H SER A 94 -24.557 14.363 33.043 1.00 0.00 H new ATOM 0 HA SER A 94 -26.378 12.500 34.023 1.00 0.00 H new ATOM 0 HB2 SER A 94 -27.131 14.294 35.442 1.00 0.00 H new ATOM 0 HB3 SER A 94 -25.410 14.524 35.203 1.00 0.00 H new ATOM 0 HG SER A 94 -26.607 16.490 34.916 1.00 0.00 H new ATOM 1520 N GLY A 95 -27.690 14.654 31.891 1.00 0.00 N ATOM 1521 CA GLY A 95 -28.851 14.884 31.052 1.00 0.00 C ATOM 1522 C GLY A 95 -29.535 16.201 31.357 1.00 0.00 C ATOM 1523 O GLY A 95 -28.887 17.166 31.763 1.00 0.00 O ATOM 0 H GLY A 95 -26.929 15.321 31.761 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -28.547 14.870 30.005 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -29.562 14.069 31.189 1.00 0.00 H new TER 1527 GLY A 95