USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 784 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 81 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 88 HIS : no HE2:sc= -5.6! X(o=-5.6!,f=-5.6) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 TYR OH : rot 130:sc= -0.243 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.0574 USER MOD Single : A 29 MET CE :methyl 158:sc= -0.641 (180deg=-1.48) USER MOD Single : A 30 SER OG : rot 60:sc= 0.0189 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot -150:sc= -1.74! USER MOD Single : A 66 CYS SG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0112) USER MOD Single : A 69 SER OG : rot 180:sc= -0.609 USER MOD Single : A 70 TYR OH : rot 180:sc= -0.0226 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot -38:sc= 1.26 USER MOD Single : A 82 THR OG1 : rot 180:sc= -0.011 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 SER OG : rot 14:sc= -2.19! USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0336) USER MOD Single : A 106 SER OG : rot -65:sc= 0.34 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 24.792 17.803 -18.109 1.00 0.00 N ATOM 2 CA GLY A 1 23.968 18.941 -17.743 1.00 0.00 C ATOM 3 C GLY A 1 22.534 18.548 -17.451 1.00 0.00 C ATOM 4 O GLY A 1 21.861 17.957 -18.296 1.00 0.00 O ATOM 0 H1 GLY A 1 25.763 18.124 -18.299 1.00 0.00 H new ATOM 0 H2 GLY A 1 24.801 17.116 -17.329 1.00 0.00 H new ATOM 0 H3 GLY A 1 24.403 17.353 -18.962 1.00 0.00 H new ATOM 0 HA2 GLY A 1 24.394 19.427 -16.865 1.00 0.00 H new ATOM 0 HA3 GLY A 1 23.984 19.672 -18.551 1.00 0.00 H new ATOM 8 N SER A 2 22.065 18.875 -16.251 1.00 0.00 N ATOM 9 CA SER A 2 20.702 18.547 -15.848 1.00 0.00 C ATOM 10 C SER A 2 19.888 19.814 -15.604 1.00 0.00 C ATOM 11 O SER A 2 20.441 20.873 -15.309 1.00 0.00 O ATOM 12 CB SER A 2 20.715 17.684 -14.584 1.00 0.00 C ATOM 13 OG SER A 2 19.479 17.014 -14.411 1.00 0.00 O ATOM 0 H SER A 2 22.608 19.366 -15.541 1.00 0.00 H new ATOM 0 HA SER A 2 20.235 17.986 -16.658 1.00 0.00 H new ATOM 0 HB2 SER A 2 21.522 16.954 -14.647 1.00 0.00 H new ATOM 0 HB3 SER A 2 20.918 18.310 -13.715 1.00 0.00 H new ATOM 0 HG SER A 2 19.514 16.468 -13.598 1.00 0.00 H new ATOM 19 N SER A 3 18.570 19.696 -15.730 1.00 0.00 N ATOM 20 CA SER A 3 17.679 20.832 -15.527 1.00 0.00 C ATOM 21 C SER A 3 16.698 20.558 -14.391 1.00 0.00 C ATOM 22 O SER A 3 16.316 19.414 -14.148 1.00 0.00 O ATOM 23 CB SER A 3 16.911 21.141 -16.814 1.00 0.00 C ATOM 24 OG SER A 3 16.044 20.075 -17.159 1.00 0.00 O ATOM 0 H SER A 3 18.096 18.826 -15.972 1.00 0.00 H new ATOM 0 HA SER A 3 18.288 21.695 -15.258 1.00 0.00 H new ATOM 0 HB2 SER A 3 16.334 22.057 -16.686 1.00 0.00 H new ATOM 0 HB3 SER A 3 17.615 21.319 -17.627 1.00 0.00 H new ATOM 0 HG SER A 3 15.564 20.298 -17.984 1.00 0.00 H new ATOM 30 N GLY A 4 16.295 21.618 -13.696 1.00 0.00 N ATOM 31 CA GLY A 4 15.363 21.471 -12.593 1.00 0.00 C ATOM 32 C GLY A 4 15.838 22.173 -11.336 1.00 0.00 C ATOM 33 O GLY A 4 16.865 22.850 -11.346 1.00 0.00 O ATOM 0 H GLY A 4 16.597 22.575 -13.877 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.393 21.872 -12.885 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.219 20.411 -12.382 1.00 0.00 H new ATOM 37 N SER A 5 15.087 22.012 -10.251 1.00 0.00 N ATOM 38 CA SER A 5 15.433 22.640 -8.982 1.00 0.00 C ATOM 39 C SER A 5 16.744 22.080 -8.438 1.00 0.00 C ATOM 40 O SER A 5 17.215 21.032 -8.882 1.00 0.00 O ATOM 41 CB SER A 5 14.313 22.429 -7.962 1.00 0.00 C ATOM 42 OG SER A 5 13.248 23.337 -8.179 1.00 0.00 O ATOM 0 H SER A 5 14.235 21.452 -10.226 1.00 0.00 H new ATOM 0 HA SER A 5 15.559 23.709 -9.156 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.943 21.406 -8.030 1.00 0.00 H new ATOM 0 HB3 SER A 5 14.706 22.559 -6.954 1.00 0.00 H new ATOM 0 HG SER A 5 12.544 23.180 -7.515 1.00 0.00 H new ATOM 48 N SER A 6 17.328 22.785 -7.475 1.00 0.00 N ATOM 49 CA SER A 6 18.587 22.361 -6.873 1.00 0.00 C ATOM 50 C SER A 6 18.345 21.699 -5.520 1.00 0.00 C ATOM 51 O SER A 6 17.587 22.206 -4.694 1.00 0.00 O ATOM 52 CB SER A 6 19.526 23.558 -6.708 1.00 0.00 C ATOM 53 OG SER A 6 19.093 24.405 -5.657 1.00 0.00 O ATOM 0 H SER A 6 16.950 23.653 -7.095 1.00 0.00 H new ATOM 0 HA SER A 6 19.053 21.632 -7.537 1.00 0.00 H new ATOM 0 HB2 SER A 6 20.537 23.206 -6.502 1.00 0.00 H new ATOM 0 HB3 SER A 6 19.568 24.122 -7.640 1.00 0.00 H new ATOM 0 HG SER A 6 19.710 25.161 -5.571 1.00 0.00 H new ATOM 59 N GLY A 7 18.997 20.561 -5.300 1.00 0.00 N ATOM 60 CA GLY A 7 18.841 19.847 -4.046 1.00 0.00 C ATOM 61 C GLY A 7 17.928 18.644 -4.174 1.00 0.00 C ATOM 62 O GLY A 7 18.091 17.827 -5.081 1.00 0.00 O ATOM 0 H GLY A 7 19.630 20.121 -5.968 1.00 0.00 H new ATOM 0 HA2 GLY A 7 19.819 19.521 -3.693 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.440 20.525 -3.293 1.00 0.00 H new ATOM 66 N ILE A 8 16.966 18.534 -3.265 1.00 0.00 N ATOM 67 CA ILE A 8 16.024 17.422 -3.280 1.00 0.00 C ATOM 68 C ILE A 8 14.715 17.820 -3.953 1.00 0.00 C ATOM 69 O ILE A 8 14.569 18.941 -4.439 1.00 0.00 O ATOM 70 CB ILE A 8 15.723 16.919 -1.856 1.00 0.00 C ATOM 71 CG1 ILE A 8 14.996 17.999 -1.053 1.00 0.00 C ATOM 72 CG2 ILE A 8 17.011 16.508 -1.156 1.00 0.00 C ATOM 73 CD1 ILE A 8 14.059 17.444 -0.003 1.00 0.00 C ATOM 0 H ILE A 8 16.818 19.202 -2.508 1.00 0.00 H new ATOM 0 HA ILE A 8 16.493 16.619 -3.848 1.00 0.00 H new ATOM 0 HB ILE A 8 15.075 16.046 -1.925 1.00 0.00 H new ATOM 0 HG12 ILE A 8 15.734 18.638 -0.568 1.00 0.00 H new ATOM 0 HG13 ILE A 8 14.429 18.629 -1.738 1.00 0.00 H new ATOM 0 HG21 ILE A 8 16.782 16.155 -0.151 1.00 0.00 H new ATOM 0 HG22 ILE A 8 17.493 15.709 -1.720 1.00 0.00 H new ATOM 0 HG23 ILE A 8 17.682 17.365 -1.095 1.00 0.00 H new ATOM 0 HD11 ILE A 8 13.578 18.266 0.527 1.00 0.00 H new ATOM 0 HD12 ILE A 8 13.299 16.828 -0.483 1.00 0.00 H new ATOM 0 HD13 ILE A 8 14.624 16.837 0.705 1.00 0.00 H new ATOM 85 N GLY A 9 13.762 16.892 -3.977 1.00 0.00 N ATOM 86 CA GLY A 9 12.476 17.165 -4.591 1.00 0.00 C ATOM 87 C GLY A 9 11.354 17.250 -3.575 1.00 0.00 C ATOM 88 O GLY A 9 11.584 17.584 -2.413 1.00 0.00 O ATOM 0 H GLY A 9 13.858 15.956 -3.582 1.00 0.00 H new ATOM 0 HA2 GLY A 9 12.533 18.103 -5.144 1.00 0.00 H new ATOM 0 HA3 GLY A 9 12.249 16.382 -5.314 1.00 0.00 H new ATOM 92 N ASP A 10 10.137 16.948 -4.014 1.00 0.00 N ATOM 93 CA ASP A 10 8.975 16.992 -3.134 1.00 0.00 C ATOM 94 C ASP A 10 8.040 15.818 -3.409 1.00 0.00 C ATOM 95 O ASP A 10 7.478 15.701 -4.498 1.00 0.00 O ATOM 96 CB ASP A 10 8.222 18.312 -3.314 1.00 0.00 C ATOM 97 CG ASP A 10 9.103 19.520 -3.063 1.00 0.00 C ATOM 98 OD1 ASP A 10 9.505 19.729 -1.899 1.00 0.00 O ATOM 99 OD2 ASP A 10 9.391 20.256 -4.029 1.00 0.00 O ATOM 0 H ASP A 10 9.930 16.670 -4.973 1.00 0.00 H new ATOM 0 HA ASP A 10 9.327 16.920 -2.105 1.00 0.00 H new ATOM 0 HB2 ASP A 10 7.821 18.363 -4.326 1.00 0.00 H new ATOM 0 HB3 ASP A 10 7.372 18.338 -2.632 1.00 0.00 H new ATOM 104 N ALA A 11 7.881 14.951 -2.415 1.00 0.00 N ATOM 105 CA ALA A 11 7.014 13.786 -2.550 1.00 0.00 C ATOM 106 C ALA A 11 5.658 14.175 -3.129 1.00 0.00 C ATOM 107 O ALA A 11 5.099 13.458 -3.959 1.00 0.00 O ATOM 108 CB ALA A 11 6.838 13.101 -1.203 1.00 0.00 C ATOM 0 H ALA A 11 8.340 15.033 -1.508 1.00 0.00 H new ATOM 0 HA ALA A 11 7.488 13.089 -3.241 1.00 0.00 H new ATOM 0 HB1 ALA A 11 6.189 12.233 -1.318 1.00 0.00 H new ATOM 0 HB2 ALA A 11 7.810 12.780 -0.828 1.00 0.00 H new ATOM 0 HB3 ALA A 11 6.389 13.799 -0.496 1.00 0.00 H new ATOM 114 N ARG A 12 5.135 15.313 -2.686 1.00 0.00 N ATOM 115 CA ARG A 12 3.843 15.796 -3.160 1.00 0.00 C ATOM 116 C ARG A 12 3.800 15.826 -4.685 1.00 0.00 C ATOM 117 O ARG A 12 2.754 15.592 -5.291 1.00 0.00 O ATOM 118 CB ARG A 12 3.561 17.192 -2.603 1.00 0.00 C ATOM 119 CG ARG A 12 4.512 18.258 -3.121 1.00 0.00 C ATOM 120 CD ARG A 12 4.622 19.426 -2.153 1.00 0.00 C ATOM 121 NE ARG A 12 5.361 20.547 -2.728 1.00 0.00 N ATOM 122 CZ ARG A 12 4.881 21.326 -3.691 1.00 0.00 C ATOM 123 NH1 ARG A 12 3.670 21.107 -4.184 1.00 0.00 N ATOM 124 NH2 ARG A 12 5.614 22.326 -4.163 1.00 0.00 N ATOM 0 H ARG A 12 5.586 15.918 -2.000 1.00 0.00 H new ATOM 0 HA ARG A 12 3.074 15.109 -2.806 1.00 0.00 H new ATOM 0 HB2 ARG A 12 2.539 17.475 -2.856 1.00 0.00 H new ATOM 0 HB3 ARG A 12 3.623 17.159 -1.515 1.00 0.00 H new ATOM 0 HG2 ARG A 12 5.498 17.821 -3.279 1.00 0.00 H new ATOM 0 HG3 ARG A 12 4.164 18.618 -4.089 1.00 0.00 H new ATOM 0 HD2 ARG A 12 3.623 19.758 -1.870 1.00 0.00 H new ATOM 0 HD3 ARG A 12 5.118 19.095 -1.241 1.00 0.00 H new ATOM 0 HE ARG A 12 6.296 20.742 -2.371 1.00 0.00 H new ATOM 0 HH11 ARG A 12 3.104 20.339 -3.824 1.00 0.00 H new ATOM 0 HH12 ARG A 12 3.304 21.707 -4.923 1.00 0.00 H new ATOM 0 HH21 ARG A 12 6.546 22.497 -3.786 1.00 0.00 H new ATOM 0 HH22 ARG A 12 5.245 22.924 -4.902 1.00 0.00 H new ATOM 138 N ARG A 13 4.943 16.117 -5.298 1.00 0.00 N ATOM 139 CA ARG A 13 5.035 16.180 -6.752 1.00 0.00 C ATOM 140 C ARG A 13 5.144 14.781 -7.351 1.00 0.00 C ATOM 141 O ARG A 13 4.627 14.517 -8.436 1.00 0.00 O ATOM 142 CB ARG A 13 6.241 17.022 -7.171 1.00 0.00 C ATOM 143 CG ARG A 13 6.196 18.450 -6.655 1.00 0.00 C ATOM 144 CD ARG A 13 5.189 19.290 -7.425 1.00 0.00 C ATOM 145 NE ARG A 13 5.482 20.718 -7.332 1.00 0.00 N ATOM 146 CZ ARG A 13 4.940 21.633 -8.128 1.00 0.00 C ATOM 147 NH1 ARG A 13 4.083 21.270 -9.072 1.00 0.00 N ATOM 148 NH2 ARG A 13 5.256 22.913 -7.981 1.00 0.00 N ATOM 0 H ARG A 13 5.818 16.313 -4.811 1.00 0.00 H new ATOM 0 HA ARG A 13 4.125 16.647 -7.129 1.00 0.00 H new ATOM 0 HB2 ARG A 13 7.151 16.543 -6.810 1.00 0.00 H new ATOM 0 HB3 ARG A 13 6.300 17.040 -8.259 1.00 0.00 H new ATOM 0 HG2 ARG A 13 5.935 18.447 -5.597 1.00 0.00 H new ATOM 0 HG3 ARG A 13 7.186 18.899 -6.738 1.00 0.00 H new ATOM 0 HD2 ARG A 13 5.190 18.987 -8.472 1.00 0.00 H new ATOM 0 HD3 ARG A 13 4.188 19.100 -7.039 1.00 0.00 H new ATOM 0 HE ARG A 13 6.139 21.030 -6.617 1.00 0.00 H new ATOM 0 HH11 ARG A 13 3.839 20.287 -9.188 1.00 0.00 H new ATOM 0 HH12 ARG A 13 3.668 21.974 -9.682 1.00 0.00 H new ATOM 0 HH21 ARG A 13 5.916 23.195 -7.256 1.00 0.00 H new ATOM 0 HH22 ARG A 13 4.839 23.615 -8.593 1.00 0.00 H new ATOM 162 N ALA A 14 5.822 13.888 -6.636 1.00 0.00 N ATOM 163 CA ALA A 14 5.998 12.516 -7.096 1.00 0.00 C ATOM 164 C ALA A 14 4.653 11.851 -7.366 1.00 0.00 C ATOM 165 O ALA A 14 3.794 11.783 -6.487 1.00 0.00 O ATOM 166 CB ALA A 14 6.789 11.714 -6.073 1.00 0.00 C ATOM 0 H ALA A 14 6.258 14.091 -5.736 1.00 0.00 H new ATOM 0 HA ALA A 14 6.556 12.541 -8.032 1.00 0.00 H new ATOM 0 HB1 ALA A 14 6.913 10.691 -6.429 1.00 0.00 H new ATOM 0 HB2 ALA A 14 7.769 12.170 -5.932 1.00 0.00 H new ATOM 0 HB3 ALA A 14 6.253 11.705 -5.124 1.00 0.00 H new ATOM 172 N LYS A 15 4.476 11.361 -8.589 1.00 0.00 N ATOM 173 CA LYS A 15 3.235 10.700 -8.976 1.00 0.00 C ATOM 174 C LYS A 15 3.464 9.211 -9.216 1.00 0.00 C ATOM 175 O LYS A 15 4.545 8.798 -9.636 1.00 0.00 O ATOM 176 CB LYS A 15 2.660 11.348 -10.238 1.00 0.00 C ATOM 177 CG LYS A 15 1.812 12.577 -9.959 1.00 0.00 C ATOM 178 CD LYS A 15 0.947 12.941 -11.153 1.00 0.00 C ATOM 179 CE LYS A 15 0.599 14.421 -11.160 1.00 0.00 C ATOM 180 NZ LYS A 15 -0.056 14.832 -12.432 1.00 0.00 N ATOM 0 H LYS A 15 5.176 11.409 -9.329 1.00 0.00 H new ATOM 0 HA LYS A 15 2.522 10.813 -8.159 1.00 0.00 H new ATOM 0 HB2 LYS A 15 3.480 11.626 -10.900 1.00 0.00 H new ATOM 0 HB3 LYS A 15 2.056 10.613 -10.770 1.00 0.00 H new ATOM 0 HG2 LYS A 15 1.178 12.393 -9.092 1.00 0.00 H new ATOM 0 HG3 LYS A 15 2.459 13.417 -9.708 1.00 0.00 H new ATOM 0 HD2 LYS A 15 1.471 12.685 -12.074 1.00 0.00 H new ATOM 0 HD3 LYS A 15 0.031 12.351 -11.133 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -0.063 14.642 -10.323 1.00 0.00 H new ATOM 0 HE3 LYS A 15 1.506 15.008 -11.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -0.277 15.848 -12.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 0.585 14.645 -13.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -0.935 14.291 -12.561 1.00 0.00 H new ATOM 194 N VAL A 16 2.438 8.409 -8.947 1.00 0.00 N ATOM 195 CA VAL A 16 2.527 6.966 -9.136 1.00 0.00 C ATOM 196 C VAL A 16 1.298 6.430 -9.862 1.00 0.00 C ATOM 197 O VAL A 16 0.164 6.689 -9.459 1.00 0.00 O ATOM 198 CB VAL A 16 2.674 6.232 -7.790 1.00 0.00 C ATOM 199 CG1 VAL A 16 3.972 6.631 -7.103 1.00 0.00 C ATOM 200 CG2 VAL A 16 1.478 6.517 -6.894 1.00 0.00 C ATOM 0 H VAL A 16 1.536 8.734 -8.598 1.00 0.00 H new ATOM 0 HA VAL A 16 3.414 6.780 -9.742 1.00 0.00 H new ATOM 0 HB VAL A 16 2.707 5.160 -7.983 1.00 0.00 H new ATOM 0 HG11 VAL A 16 4.059 6.103 -6.154 1.00 0.00 H new ATOM 0 HG12 VAL A 16 4.816 6.371 -7.741 1.00 0.00 H new ATOM 0 HG13 VAL A 16 3.972 7.706 -6.921 1.00 0.00 H new ATOM 0 HG21 VAL A 16 1.599 5.990 -5.947 1.00 0.00 H new ATOM 0 HG22 VAL A 16 1.411 7.589 -6.707 1.00 0.00 H new ATOM 0 HG23 VAL A 16 0.566 6.176 -7.385 1.00 0.00 H new ATOM 210 N TYR A 17 1.531 5.682 -10.935 1.00 0.00 N ATOM 211 CA TYR A 17 0.443 5.111 -11.719 1.00 0.00 C ATOM 212 C TYR A 17 0.826 3.737 -12.262 1.00 0.00 C ATOM 213 O TYR A 17 1.822 3.591 -12.969 1.00 0.00 O ATOM 214 CB TYR A 17 0.076 6.043 -12.875 1.00 0.00 C ATOM 215 CG TYR A 17 1.256 6.798 -13.443 1.00 0.00 C ATOM 216 CD1 TYR A 17 2.057 6.236 -14.428 1.00 0.00 C ATOM 217 CD2 TYR A 17 1.570 8.076 -12.994 1.00 0.00 C ATOM 218 CE1 TYR A 17 3.137 6.922 -14.949 1.00 0.00 C ATOM 219 CE2 TYR A 17 2.647 8.770 -13.510 1.00 0.00 C ATOM 220 CZ TYR A 17 3.428 8.188 -14.487 1.00 0.00 C ATOM 221 OH TYR A 17 4.502 8.876 -15.004 1.00 0.00 O ATOM 0 H TYR A 17 2.464 5.457 -11.281 1.00 0.00 H new ATOM 0 HA TYR A 17 -0.421 4.996 -11.065 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -0.386 5.458 -13.670 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -0.671 6.759 -12.531 1.00 0.00 H new ATOM 0 HD1 TYR A 17 1.832 5.245 -14.793 1.00 0.00 H new ATOM 0 HD2 TYR A 17 0.961 8.534 -12.228 1.00 0.00 H new ATOM 0 HE1 TYR A 17 3.750 6.469 -15.714 1.00 0.00 H new ATOM 0 HE2 TYR A 17 2.876 9.762 -13.151 1.00 0.00 H new ATOM 0 HH TYR A 17 4.217 9.776 -15.269 1.00 0.00 H new ATOM 231 N GLY A 18 0.024 2.731 -11.924 1.00 0.00 N ATOM 232 CA GLY A 18 0.294 1.381 -12.386 1.00 0.00 C ATOM 233 C GLY A 18 -0.788 0.402 -11.976 1.00 0.00 C ATOM 234 O GLY A 18 -1.395 0.545 -10.915 1.00 0.00 O ATOM 0 H GLY A 18 -0.806 2.826 -11.340 1.00 0.00 H new ATOM 0 HA2 GLY A 18 0.385 1.383 -13.472 1.00 0.00 H new ATOM 0 HA3 GLY A 18 1.252 1.048 -11.986 1.00 0.00 H new ATOM 238 N ARG A 19 -1.031 -0.596 -12.820 1.00 0.00 N ATOM 239 CA ARG A 19 -2.049 -1.602 -12.541 1.00 0.00 C ATOM 240 C ARG A 19 -1.740 -2.343 -11.243 1.00 0.00 C ATOM 241 O ARG A 19 -2.640 -2.856 -10.580 1.00 0.00 O ATOM 242 CB ARG A 19 -2.144 -2.596 -13.699 1.00 0.00 C ATOM 243 CG ARG A 19 -3.210 -3.662 -13.500 1.00 0.00 C ATOM 244 CD ARG A 19 -2.921 -4.901 -14.333 1.00 0.00 C ATOM 245 NE ARG A 19 -3.265 -4.707 -15.739 1.00 0.00 N ATOM 246 CZ ARG A 19 -4.503 -4.803 -16.213 1.00 0.00 C ATOM 247 NH1 ARG A 19 -5.508 -5.087 -15.396 1.00 0.00 N ATOM 248 NH2 ARG A 19 -4.737 -4.613 -17.505 1.00 0.00 N ATOM 0 H ARG A 19 -0.537 -0.729 -13.702 1.00 0.00 H new ATOM 0 HA ARG A 19 -3.006 -1.093 -12.429 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -2.355 -2.050 -14.619 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -1.177 -3.081 -13.831 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -3.261 -3.935 -12.446 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -4.185 -3.258 -13.772 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -1.864 -5.155 -14.250 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -3.484 -5.745 -13.935 1.00 0.00 H new ATOM 0 HE ARG A 19 -2.514 -4.486 -16.393 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -5.332 -5.232 -14.402 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -6.457 -5.160 -15.762 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.966 -4.393 -18.136 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -5.688 -4.687 -17.867 1.00 0.00 H new ATOM 262 N GLY A 20 -0.460 -2.395 -10.887 1.00 0.00 N ATOM 263 CA GLY A 20 -0.055 -3.075 -9.672 1.00 0.00 C ATOM 264 C GLY A 20 -0.318 -2.249 -8.429 1.00 0.00 C ATOM 265 O GLY A 20 -0.318 -2.772 -7.314 1.00 0.00 O ATOM 0 H GLY A 20 0.304 -1.978 -11.419 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -0.589 -4.022 -9.594 1.00 0.00 H new ATOM 0 HA3 GLY A 20 1.007 -3.312 -9.729 1.00 0.00 H new ATOM 269 N LEU A 21 -0.543 -0.953 -8.619 1.00 0.00 N ATOM 270 CA LEU A 21 -0.808 -0.051 -7.503 1.00 0.00 C ATOM 271 C LEU A 21 -2.296 -0.017 -7.172 1.00 0.00 C ATOM 272 O LEU A 21 -2.681 0.135 -6.012 1.00 0.00 O ATOM 273 CB LEU A 21 -0.315 1.359 -7.834 1.00 0.00 C ATOM 274 CG LEU A 21 1.181 1.499 -8.115 1.00 0.00 C ATOM 275 CD1 LEU A 21 1.473 2.818 -8.812 1.00 0.00 C ATOM 276 CD2 LEU A 21 1.979 1.388 -6.824 1.00 0.00 C ATOM 0 H LEU A 21 -0.547 -0.504 -9.535 1.00 0.00 H new ATOM 0 HA LEU A 21 -0.269 -0.423 -6.631 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -0.863 1.718 -8.705 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -0.571 2.016 -7.003 1.00 0.00 H new ATOM 0 HG LEU A 21 1.484 0.688 -8.777 1.00 0.00 H new ATOM 0 HD11 LEU A 21 2.543 2.899 -9.004 1.00 0.00 H new ATOM 0 HD12 LEU A 21 0.931 2.858 -9.757 1.00 0.00 H new ATOM 0 HD13 LEU A 21 1.155 3.644 -8.176 1.00 0.00 H new ATOM 0 HD21 LEU A 21 3.042 1.490 -7.043 1.00 0.00 H new ATOM 0 HD22 LEU A 21 1.673 2.178 -6.138 1.00 0.00 H new ATOM 0 HD23 LEU A 21 1.795 0.417 -6.365 1.00 0.00 H new ATOM 288 N SER A 22 -3.129 -0.162 -8.197 1.00 0.00 N ATOM 289 CA SER A 22 -4.576 -0.147 -8.015 1.00 0.00 C ATOM 290 C SER A 22 -5.095 -1.540 -7.674 1.00 0.00 C ATOM 291 O SER A 22 -5.830 -1.719 -6.703 1.00 0.00 O ATOM 292 CB SER A 22 -5.265 0.371 -9.279 1.00 0.00 C ATOM 293 OG SER A 22 -4.716 1.612 -9.687 1.00 0.00 O ATOM 0 H SER A 22 -2.827 -0.291 -9.163 1.00 0.00 H new ATOM 0 HA SER A 22 -4.806 0.521 -7.185 1.00 0.00 H new ATOM 0 HB2 SER A 22 -5.157 -0.359 -10.081 1.00 0.00 H new ATOM 0 HB3 SER A 22 -6.333 0.486 -9.094 1.00 0.00 H new ATOM 0 HG SER A 22 -5.172 1.921 -10.498 1.00 0.00 H new ATOM 299 N GLU A 23 -4.707 -2.523 -8.480 1.00 0.00 N ATOM 300 CA GLU A 23 -5.135 -3.901 -8.264 1.00 0.00 C ATOM 301 C GLU A 23 -3.975 -4.869 -8.475 1.00 0.00 C ATOM 302 O GLU A 23 -2.848 -4.456 -8.748 1.00 0.00 O ATOM 303 CB GLU A 23 -6.287 -4.254 -9.207 1.00 0.00 C ATOM 304 CG GLU A 23 -5.908 -4.205 -10.677 1.00 0.00 C ATOM 305 CD GLU A 23 -6.908 -4.922 -11.562 1.00 0.00 C ATOM 306 OE1 GLU A 23 -6.854 -6.168 -11.628 1.00 0.00 O ATOM 307 OE2 GLU A 23 -7.744 -4.238 -12.189 1.00 0.00 O ATOM 0 H GLU A 23 -4.098 -2.392 -9.288 1.00 0.00 H new ATOM 0 HA GLU A 23 -5.478 -3.991 -7.233 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -6.648 -5.254 -8.967 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -7.114 -3.566 -9.031 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -5.829 -3.165 -10.993 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -4.924 -4.654 -10.810 1.00 0.00 H new ATOM 314 N GLY A 24 -4.259 -6.162 -8.346 1.00 0.00 N ATOM 315 CA GLY A 24 -3.231 -7.170 -8.525 1.00 0.00 C ATOM 316 C GLY A 24 -3.756 -8.577 -8.322 1.00 0.00 C ATOM 317 O GLY A 24 -4.931 -8.769 -8.008 1.00 0.00 O ATOM 0 H GLY A 24 -5.184 -6.529 -8.121 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -2.812 -7.083 -9.528 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -2.418 -6.984 -7.823 1.00 0.00 H new ATOM 321 N ARG A 25 -2.884 -9.564 -8.502 1.00 0.00 N ATOM 322 CA ARG A 25 -3.268 -10.961 -8.338 1.00 0.00 C ATOM 323 C ARG A 25 -2.093 -11.791 -7.828 1.00 0.00 C ATOM 324 O ARG A 25 -0.962 -11.310 -7.760 1.00 0.00 O ATOM 325 CB ARG A 25 -3.772 -11.532 -9.665 1.00 0.00 C ATOM 326 CG ARG A 25 -5.270 -11.370 -9.868 1.00 0.00 C ATOM 327 CD ARG A 25 -5.799 -12.342 -10.911 1.00 0.00 C ATOM 328 NE ARG A 25 -5.245 -12.077 -12.237 1.00 0.00 N ATOM 329 CZ ARG A 25 -5.609 -11.046 -12.992 1.00 0.00 C ATOM 330 NH1 ARG A 25 -6.521 -10.189 -12.556 1.00 0.00 N ATOM 331 NH2 ARG A 25 -5.060 -10.872 -14.188 1.00 0.00 N ATOM 0 H ARG A 25 -1.908 -9.422 -8.761 1.00 0.00 H new ATOM 0 HA ARG A 25 -4.070 -11.008 -7.602 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -3.248 -11.041 -10.485 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -3.520 -12.591 -9.714 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -5.786 -11.533 -8.922 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -5.488 -10.348 -10.178 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -5.555 -13.362 -10.613 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -6.886 -12.274 -10.952 1.00 0.00 H new ATOM 0 HE ARG A 25 -4.541 -12.718 -12.603 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -6.946 -10.320 -11.638 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -6.798 -9.399 -13.138 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -4.358 -11.530 -14.528 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -5.340 -10.080 -14.767 1.00 0.00 H new ATOM 345 N THR A 26 -2.370 -13.041 -7.471 1.00 0.00 N ATOM 346 CA THR A 26 -1.338 -13.938 -6.966 1.00 0.00 C ATOM 347 C THR A 26 -0.505 -14.514 -8.105 1.00 0.00 C ATOM 348 O THR A 26 -1.036 -14.876 -9.155 1.00 0.00 O ATOM 349 CB THR A 26 -1.948 -15.097 -6.155 1.00 0.00 C ATOM 350 OG1 THR A 26 -3.074 -15.643 -6.851 1.00 0.00 O ATOM 351 CG2 THR A 26 -2.381 -14.622 -4.776 1.00 0.00 C ATOM 0 H THR A 26 -3.301 -13.455 -7.522 1.00 0.00 H new ATOM 0 HA THR A 26 -0.697 -13.346 -6.313 1.00 0.00 H new ATOM 0 HB THR A 26 -1.187 -15.868 -6.035 1.00 0.00 H new ATOM 0 HG1 THR A 26 -3.455 -16.380 -6.330 1.00 0.00 H new ATOM 0 HG21 THR A 26 -2.809 -15.457 -4.221 1.00 0.00 H new ATOM 0 HG22 THR A 26 -1.517 -14.233 -4.237 1.00 0.00 H new ATOM 0 HG23 THR A 26 -3.128 -13.835 -4.880 1.00 0.00 H new ATOM 359 N PHE A 27 0.804 -14.597 -7.891 1.00 0.00 N ATOM 360 CA PHE A 27 1.712 -15.130 -8.900 1.00 0.00 C ATOM 361 C PHE A 27 1.622 -14.323 -10.192 1.00 0.00 C ATOM 362 O PHE A 27 1.827 -14.854 -11.283 1.00 0.00 O ATOM 363 CB PHE A 27 1.392 -16.599 -9.180 1.00 0.00 C ATOM 364 CG PHE A 27 1.498 -17.478 -7.967 1.00 0.00 C ATOM 365 CD1 PHE A 27 2.694 -17.588 -7.277 1.00 0.00 C ATOM 366 CD2 PHE A 27 0.401 -18.194 -7.515 1.00 0.00 C ATOM 367 CE1 PHE A 27 2.795 -18.396 -6.161 1.00 0.00 C ATOM 368 CE2 PHE A 27 0.495 -19.003 -6.399 1.00 0.00 C ATOM 369 CZ PHE A 27 1.693 -19.104 -5.720 1.00 0.00 C ATOM 0 H PHE A 27 1.260 -14.302 -7.028 1.00 0.00 H new ATOM 0 HA PHE A 27 2.729 -15.054 -8.514 1.00 0.00 H new ATOM 0 HB2 PHE A 27 0.382 -16.672 -9.584 1.00 0.00 H new ATOM 0 HB3 PHE A 27 2.070 -16.970 -9.948 1.00 0.00 H new ATOM 0 HD1 PHE A 27 3.558 -17.035 -7.616 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -0.539 -18.119 -8.042 1.00 0.00 H new ATOM 0 HE1 PHE A 27 3.734 -18.474 -5.634 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -0.368 -19.556 -6.058 1.00 0.00 H new ATOM 0 HZ PHE A 27 1.769 -19.735 -4.847 1.00 0.00 H new ATOM 379 N GLU A 28 1.314 -13.036 -10.059 1.00 0.00 N ATOM 380 CA GLU A 28 1.195 -12.156 -11.216 1.00 0.00 C ATOM 381 C GLU A 28 2.148 -10.970 -11.097 1.00 0.00 C ATOM 382 O GLU A 28 2.016 -10.143 -10.195 1.00 0.00 O ATOM 383 CB GLU A 28 -0.244 -11.657 -11.359 1.00 0.00 C ATOM 384 CG GLU A 28 -0.409 -10.568 -12.406 1.00 0.00 C ATOM 385 CD GLU A 28 -0.686 -11.126 -13.789 1.00 0.00 C ATOM 386 OE1 GLU A 28 -1.858 -11.450 -14.074 1.00 0.00 O ATOM 387 OE2 GLU A 28 0.269 -11.238 -14.586 1.00 0.00 O ATOM 0 H GLU A 28 1.143 -12.580 -9.163 1.00 0.00 H new ATOM 0 HA GLU A 28 1.463 -12.727 -12.105 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -0.887 -12.498 -11.617 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -0.586 -11.278 -10.396 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -1.226 -9.909 -12.114 1.00 0.00 H new ATOM 0 HG3 GLU A 28 0.495 -9.960 -12.438 1.00 0.00 H new ATOM 394 N MET A 29 3.107 -10.894 -12.013 1.00 0.00 N ATOM 395 CA MET A 29 4.082 -9.809 -12.011 1.00 0.00 C ATOM 396 C MET A 29 3.391 -8.459 -12.172 1.00 0.00 C ATOM 397 O MET A 29 2.935 -8.110 -13.260 1.00 0.00 O ATOM 398 CB MET A 29 5.102 -10.010 -13.133 1.00 0.00 C ATOM 399 CG MET A 29 6.470 -9.423 -12.822 1.00 0.00 C ATOM 400 SD MET A 29 7.560 -10.600 -11.999 1.00 0.00 S ATOM 401 CE MET A 29 8.301 -9.556 -10.747 1.00 0.00 C ATOM 0 H MET A 29 3.230 -11.570 -12.766 1.00 0.00 H new ATOM 0 HA MET A 29 4.601 -9.820 -11.052 1.00 0.00 H new ATOM 0 HB2 MET A 29 5.209 -11.077 -13.329 1.00 0.00 H new ATOM 0 HB3 MET A 29 4.719 -9.555 -14.047 1.00 0.00 H new ATOM 0 HG2 MET A 29 6.937 -9.088 -13.748 1.00 0.00 H new ATOM 0 HG3 MET A 29 6.348 -8.543 -12.190 1.00 0.00 H new ATOM 0 HE1 MET A 29 8.679 -10.176 -9.934 1.00 0.00 H new ATOM 0 HE2 MET A 29 9.123 -8.990 -11.185 1.00 0.00 H new ATOM 0 HE3 MET A 29 7.552 -8.866 -10.359 1.00 0.00 H new ATOM 411 N SER A 30 3.317 -7.703 -11.081 1.00 0.00 N ATOM 412 CA SER A 30 2.679 -6.392 -11.100 1.00 0.00 C ATOM 413 C SER A 30 3.719 -5.280 -11.010 1.00 0.00 C ATOM 414 O SER A 30 4.458 -5.184 -10.029 1.00 0.00 O ATOM 415 CB SER A 30 1.683 -6.270 -9.945 1.00 0.00 C ATOM 416 OG SER A 30 0.598 -7.166 -10.110 1.00 0.00 O ATOM 0 H SER A 30 3.691 -7.976 -10.172 1.00 0.00 H new ATOM 0 HA SER A 30 2.144 -6.289 -12.044 1.00 0.00 H new ATOM 0 HB2 SER A 30 2.189 -6.476 -9.002 1.00 0.00 H new ATOM 0 HB3 SER A 30 1.309 -5.248 -9.890 1.00 0.00 H new ATOM 0 HG SER A 30 0.934 -8.086 -10.131 1.00 0.00 H new ATOM 422 N ASP A 31 3.771 -4.442 -12.039 1.00 0.00 N ATOM 423 CA ASP A 31 4.719 -3.335 -12.077 1.00 0.00 C ATOM 424 C ASP A 31 3.995 -2.005 -12.259 1.00 0.00 C ATOM 425 O ASP A 31 2.897 -1.955 -12.814 1.00 0.00 O ATOM 426 CB ASP A 31 5.728 -3.539 -13.208 1.00 0.00 C ATOM 427 CG ASP A 31 5.139 -4.299 -14.380 1.00 0.00 C ATOM 428 OD1 ASP A 31 3.995 -3.988 -14.774 1.00 0.00 O ATOM 429 OD2 ASP A 31 5.822 -5.203 -14.904 1.00 0.00 O ATOM 0 H ASP A 31 3.167 -4.508 -12.859 1.00 0.00 H new ATOM 0 HA ASP A 31 5.250 -3.311 -11.126 1.00 0.00 H new ATOM 0 HB2 ASP A 31 6.086 -2.568 -13.551 1.00 0.00 H new ATOM 0 HB3 ASP A 31 6.593 -4.081 -12.826 1.00 0.00 H new ATOM 434 N PHE A 32 4.616 -0.929 -11.786 1.00 0.00 N ATOM 435 CA PHE A 32 4.029 0.401 -11.894 1.00 0.00 C ATOM 436 C PHE A 32 5.109 1.455 -12.120 1.00 0.00 C ATOM 437 O PHE A 32 6.262 1.271 -11.727 1.00 0.00 O ATOM 438 CB PHE A 32 3.231 0.734 -10.632 1.00 0.00 C ATOM 439 CG PHE A 32 4.017 0.561 -9.363 1.00 0.00 C ATOM 440 CD1 PHE A 32 4.916 1.531 -8.952 1.00 0.00 C ATOM 441 CD2 PHE A 32 3.855 -0.572 -8.582 1.00 0.00 C ATOM 442 CE1 PHE A 32 5.640 1.374 -7.785 1.00 0.00 C ATOM 443 CE2 PHE A 32 4.576 -0.735 -7.414 1.00 0.00 C ATOM 444 CZ PHE A 32 5.469 0.240 -7.015 1.00 0.00 C ATOM 0 H PHE A 32 5.525 -0.953 -11.324 1.00 0.00 H new ATOM 0 HA PHE A 32 3.356 0.405 -12.752 1.00 0.00 H new ATOM 0 HB2 PHE A 32 2.880 1.764 -10.695 1.00 0.00 H new ATOM 0 HB3 PHE A 32 2.347 0.098 -10.592 1.00 0.00 H new ATOM 0 HD1 PHE A 32 5.053 2.420 -9.550 1.00 0.00 H new ATOM 0 HD2 PHE A 32 3.157 -1.337 -8.889 1.00 0.00 H new ATOM 0 HE1 PHE A 32 6.339 2.137 -7.476 1.00 0.00 H new ATOM 0 HE2 PHE A 32 4.441 -1.623 -6.815 1.00 0.00 H new ATOM 0 HZ PHE A 32 6.033 0.116 -6.102 1.00 0.00 H new ATOM 454 N ILE A 33 4.728 2.558 -12.754 1.00 0.00 N ATOM 455 CA ILE A 33 5.663 3.642 -13.031 1.00 0.00 C ATOM 456 C ILE A 33 5.681 4.657 -11.894 1.00 0.00 C ATOM 457 O ILE A 33 4.696 4.816 -11.174 1.00 0.00 O ATOM 458 CB ILE A 33 5.313 4.365 -14.345 1.00 0.00 C ATOM 459 CG1 ILE A 33 5.857 3.585 -15.544 1.00 0.00 C ATOM 460 CG2 ILE A 33 5.867 5.782 -14.333 1.00 0.00 C ATOM 461 CD1 ILE A 33 7.329 3.258 -15.434 1.00 0.00 C ATOM 0 H ILE A 33 3.778 2.725 -13.086 1.00 0.00 H new ATOM 0 HA ILE A 33 6.650 3.190 -13.126 1.00 0.00 H new ATOM 0 HB ILE A 33 4.228 4.420 -14.434 1.00 0.00 H new ATOM 0 HG12 ILE A 33 5.294 2.658 -15.650 1.00 0.00 H new ATOM 0 HG13 ILE A 33 5.689 4.165 -16.451 1.00 0.00 H new ATOM 0 HG21 ILE A 33 5.612 6.280 -15.268 1.00 0.00 H new ATOM 0 HG22 ILE A 33 5.436 6.334 -13.498 1.00 0.00 H new ATOM 0 HG23 ILE A 33 6.951 5.748 -14.224 1.00 0.00 H new ATOM 0 HD11 ILE A 33 7.646 2.705 -16.318 1.00 0.00 H new ATOM 0 HD12 ILE A 33 7.902 4.182 -15.359 1.00 0.00 H new ATOM 0 HD13 ILE A 33 7.501 2.651 -14.545 1.00 0.00 H new ATOM 473 N VAL A 34 6.809 5.343 -11.738 1.00 0.00 N ATOM 474 CA VAL A 34 6.955 6.346 -10.690 1.00 0.00 C ATOM 475 C VAL A 34 7.484 7.659 -11.256 1.00 0.00 C ATOM 476 O VAL A 34 8.672 7.784 -11.556 1.00 0.00 O ATOM 477 CB VAL A 34 7.903 5.861 -9.577 1.00 0.00 C ATOM 478 CG1 VAL A 34 8.098 6.947 -8.531 1.00 0.00 C ATOM 479 CG2 VAL A 34 7.368 4.586 -8.941 1.00 0.00 C ATOM 0 H VAL A 34 7.635 5.222 -12.324 1.00 0.00 H new ATOM 0 HA VAL A 34 5.964 6.509 -10.267 1.00 0.00 H new ATOM 0 HB VAL A 34 8.874 5.639 -10.021 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.771 6.586 -7.753 1.00 0.00 H new ATOM 0 HG12 VAL A 34 8.528 7.832 -9.001 1.00 0.00 H new ATOM 0 HG13 VAL A 34 7.135 7.203 -8.088 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.050 4.257 -8.157 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.385 4.779 -8.510 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.285 3.808 -9.700 1.00 0.00 H new ATOM 489 N ASP A 35 6.596 8.636 -11.398 1.00 0.00 N ATOM 490 CA ASP A 35 6.973 9.942 -11.927 1.00 0.00 C ATOM 491 C ASP A 35 7.743 10.748 -10.885 1.00 0.00 C ATOM 492 O ASP A 35 7.171 11.222 -9.903 1.00 0.00 O ATOM 493 CB ASP A 35 5.730 10.715 -12.371 1.00 0.00 C ATOM 494 CG ASP A 35 5.962 12.213 -12.409 1.00 0.00 C ATOM 495 OD1 ASP A 35 7.128 12.628 -12.578 1.00 0.00 O ATOM 496 OD2 ASP A 35 4.979 12.969 -12.270 1.00 0.00 O ATOM 0 H ASP A 35 5.609 8.549 -11.154 1.00 0.00 H new ATOM 0 HA ASP A 35 7.620 9.784 -12.790 1.00 0.00 H new ATOM 0 HB2 ASP A 35 5.427 10.372 -13.360 1.00 0.00 H new ATOM 0 HB3 ASP A 35 4.907 10.495 -11.691 1.00 0.00 H new ATOM 501 N THR A 36 9.045 10.899 -11.105 1.00 0.00 N ATOM 502 CA THR A 36 9.895 11.645 -10.185 1.00 0.00 C ATOM 503 C THR A 36 10.758 12.655 -10.931 1.00 0.00 C ATOM 504 O THR A 36 11.884 12.943 -10.525 1.00 0.00 O ATOM 505 CB THR A 36 10.808 10.704 -9.376 1.00 0.00 C ATOM 506 OG1 THR A 36 11.314 9.666 -10.222 1.00 0.00 O ATOM 507 CG2 THR A 36 10.053 10.091 -8.207 1.00 0.00 C ATOM 0 H THR A 36 9.534 10.514 -11.913 1.00 0.00 H new ATOM 0 HA THR A 36 9.232 12.174 -9.500 1.00 0.00 H new ATOM 0 HB THR A 36 11.640 11.289 -8.983 1.00 0.00 H new ATOM 0 HG1 THR A 36 11.895 9.073 -9.701 1.00 0.00 H new ATOM 0 HG21 THR A 36 10.718 9.430 -7.651 1.00 0.00 H new ATOM 0 HG22 THR A 36 9.695 10.883 -7.549 1.00 0.00 H new ATOM 0 HG23 THR A 36 9.204 9.519 -8.582 1.00 0.00 H new ATOM 515 N ARG A 37 10.223 13.192 -12.023 1.00 0.00 N ATOM 516 CA ARG A 37 10.946 14.171 -12.826 1.00 0.00 C ATOM 517 C ARG A 37 10.634 15.591 -12.363 1.00 0.00 C ATOM 518 O ARG A 37 11.538 16.398 -12.147 1.00 0.00 O ATOM 519 CB ARG A 37 10.587 14.015 -14.304 1.00 0.00 C ATOM 520 CG ARG A 37 10.769 12.600 -14.829 1.00 0.00 C ATOM 521 CD ARG A 37 9.500 11.778 -14.668 1.00 0.00 C ATOM 522 NE ARG A 37 8.324 12.482 -15.171 1.00 0.00 N ATOM 523 CZ ARG A 37 8.011 12.564 -16.459 1.00 0.00 C ATOM 524 NH1 ARG A 37 8.784 11.988 -17.370 1.00 0.00 N ATOM 525 NH2 ARG A 37 6.924 13.223 -16.839 1.00 0.00 N ATOM 0 H ARG A 37 9.292 12.966 -12.372 1.00 0.00 H new ATOM 0 HA ARG A 37 12.013 13.992 -12.698 1.00 0.00 H new ATOM 0 HB2 ARG A 37 9.550 14.318 -14.451 1.00 0.00 H new ATOM 0 HB3 ARG A 37 11.204 14.694 -14.893 1.00 0.00 H new ATOM 0 HG2 ARG A 37 11.050 12.635 -15.882 1.00 0.00 H new ATOM 0 HG3 ARG A 37 11.587 12.116 -14.296 1.00 0.00 H new ATOM 0 HD2 ARG A 37 9.611 10.832 -15.199 1.00 0.00 H new ATOM 0 HD3 ARG A 37 9.355 11.537 -13.615 1.00 0.00 H new ATOM 0 HE ARG A 37 7.709 12.936 -14.496 1.00 0.00 H new ATOM 0 HH11 ARG A 37 9.621 11.481 -17.082 1.00 0.00 H new ATOM 0 HH12 ARG A 37 8.542 12.052 -18.359 1.00 0.00 H new ATOM 0 HH21 ARG A 37 6.327 13.668 -16.141 1.00 0.00 H new ATOM 0 HH22 ARG A 37 6.685 13.285 -17.829 1.00 0.00 H new ATOM 539 N ASP A 38 9.348 15.889 -12.213 1.00 0.00 N ATOM 540 CA ASP A 38 8.915 17.211 -11.775 1.00 0.00 C ATOM 541 C ASP A 38 9.031 17.347 -10.260 1.00 0.00 C ATOM 542 O ASP A 38 8.716 18.394 -9.694 1.00 0.00 O ATOM 543 CB ASP A 38 7.474 17.472 -12.214 1.00 0.00 C ATOM 544 CG ASP A 38 7.203 16.989 -13.625 1.00 0.00 C ATOM 545 OD1 ASP A 38 8.175 16.809 -14.388 1.00 0.00 O ATOM 546 OD2 ASP A 38 6.018 16.790 -13.967 1.00 0.00 O ATOM 0 H ASP A 38 8.587 15.233 -12.388 1.00 0.00 H new ATOM 0 HA ASP A 38 9.567 17.951 -12.239 1.00 0.00 H new ATOM 0 HB2 ASP A 38 6.791 16.974 -11.525 1.00 0.00 H new ATOM 0 HB3 ASP A 38 7.266 18.540 -12.152 1.00 0.00 H new ATOM 551 N ALA A 39 9.483 16.280 -9.608 1.00 0.00 N ATOM 552 CA ALA A 39 9.640 16.280 -8.159 1.00 0.00 C ATOM 553 C ALA A 39 11.002 16.835 -7.755 1.00 0.00 C ATOM 554 O ALA A 39 11.101 17.670 -6.857 1.00 0.00 O ATOM 555 CB ALA A 39 9.457 14.874 -7.608 1.00 0.00 C ATOM 0 H ALA A 39 9.747 15.405 -10.061 1.00 0.00 H new ATOM 0 HA ALA A 39 8.872 16.927 -7.735 1.00 0.00 H new ATOM 0 HB1 ALA A 39 9.577 14.889 -6.525 1.00 0.00 H new ATOM 0 HB2 ALA A 39 8.459 14.512 -7.858 1.00 0.00 H new ATOM 0 HB3 ALA A 39 10.203 14.211 -8.046 1.00 0.00 H new ATOM 561 N GLY A 40 12.050 16.365 -8.425 1.00 0.00 N ATOM 562 CA GLY A 40 13.392 16.825 -8.120 1.00 0.00 C ATOM 563 C GLY A 40 14.360 15.681 -7.893 1.00 0.00 C ATOM 564 O GLY A 40 14.625 14.893 -8.802 1.00 0.00 O ATOM 0 H GLY A 40 11.993 15.674 -9.173 1.00 0.00 H new ATOM 0 HA2 GLY A 40 13.755 17.446 -8.939 1.00 0.00 H new ATOM 0 HA3 GLY A 40 13.364 17.455 -7.231 1.00 0.00 H new ATOM 568 N TYR A 41 14.891 15.588 -6.679 1.00 0.00 N ATOM 569 CA TYR A 41 15.838 14.534 -6.337 1.00 0.00 C ATOM 570 C TYR A 41 15.502 13.918 -4.983 1.00 0.00 C ATOM 571 O TYR A 41 14.633 14.408 -4.263 1.00 0.00 O ATOM 572 CB TYR A 41 17.264 15.088 -6.318 1.00 0.00 C ATOM 573 CG TYR A 41 18.330 14.017 -6.372 1.00 0.00 C ATOM 574 CD1 TYR A 41 18.363 13.093 -7.409 1.00 0.00 C ATOM 575 CD2 TYR A 41 19.304 13.928 -5.385 1.00 0.00 C ATOM 576 CE1 TYR A 41 19.334 12.112 -7.462 1.00 0.00 C ATOM 577 CE2 TYR A 41 20.280 12.952 -5.431 1.00 0.00 C ATOM 578 CZ TYR A 41 20.291 12.046 -6.471 1.00 0.00 C ATOM 579 OH TYR A 41 21.261 11.071 -6.520 1.00 0.00 O ATOM 0 H TYR A 41 14.681 16.230 -5.915 1.00 0.00 H new ATOM 0 HA TYR A 41 15.767 13.756 -7.097 1.00 0.00 H new ATOM 0 HB2 TYR A 41 17.394 15.762 -7.165 1.00 0.00 H new ATOM 0 HB3 TYR A 41 17.402 15.681 -5.414 1.00 0.00 H new ATOM 0 HD1 TYR A 41 17.616 13.143 -8.188 1.00 0.00 H new ATOM 0 HD2 TYR A 41 19.298 14.634 -4.568 1.00 0.00 H new ATOM 0 HE1 TYR A 41 19.344 11.401 -8.275 1.00 0.00 H new ATOM 0 HE2 TYR A 41 21.031 12.898 -4.657 1.00 0.00 H new ATOM 0 HH TYR A 41 21.858 11.164 -5.748 1.00 0.00 H new ATOM 589 N GLY A 42 16.198 12.837 -4.642 1.00 0.00 N ATOM 590 CA GLY A 42 15.960 12.170 -3.376 1.00 0.00 C ATOM 591 C GLY A 42 15.911 10.661 -3.515 1.00 0.00 C ATOM 592 O GLY A 42 15.494 10.139 -4.548 1.00 0.00 O ATOM 0 H GLY A 42 16.922 12.412 -5.221 1.00 0.00 H new ATOM 0 HA2 GLY A 42 16.747 12.441 -2.672 1.00 0.00 H new ATOM 0 HA3 GLY A 42 15.019 12.524 -2.954 1.00 0.00 H new ATOM 596 N GLY A 43 16.341 9.958 -2.472 1.00 0.00 N ATOM 597 CA GLY A 43 16.338 8.507 -2.503 1.00 0.00 C ATOM 598 C GLY A 43 14.958 7.925 -2.267 1.00 0.00 C ATOM 599 O GLY A 43 14.316 8.222 -1.260 1.00 0.00 O ATOM 0 H GLY A 43 16.691 10.367 -1.606 1.00 0.00 H new ATOM 0 HA2 GLY A 43 16.712 8.166 -3.468 1.00 0.00 H new ATOM 0 HA3 GLY A 43 17.023 8.129 -1.744 1.00 0.00 H new ATOM 603 N ILE A 44 14.501 7.094 -3.198 1.00 0.00 N ATOM 604 CA ILE A 44 13.189 6.469 -3.086 1.00 0.00 C ATOM 605 C ILE A 44 13.246 5.225 -2.207 1.00 0.00 C ATOM 606 O ILE A 44 14.068 4.335 -2.425 1.00 0.00 O ATOM 607 CB ILE A 44 12.630 6.083 -4.468 1.00 0.00 C ATOM 608 CG1 ILE A 44 12.493 7.325 -5.353 1.00 0.00 C ATOM 609 CG2 ILE A 44 11.288 5.381 -4.320 1.00 0.00 C ATOM 610 CD1 ILE A 44 12.291 7.004 -6.817 1.00 0.00 C ATOM 0 H ILE A 44 15.020 6.838 -4.038 1.00 0.00 H new ATOM 0 HA ILE A 44 12.527 7.204 -2.628 1.00 0.00 H new ATOM 0 HB ILE A 44 13.327 5.395 -4.946 1.00 0.00 H new ATOM 0 HG12 ILE A 44 11.651 7.921 -5.001 1.00 0.00 H new ATOM 0 HG13 ILE A 44 13.387 7.939 -5.244 1.00 0.00 H new ATOM 0 HG21 ILE A 44 10.906 5.115 -5.306 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.414 4.478 -3.723 1.00 0.00 H new ATOM 0 HG23 ILE A 44 10.581 6.047 -3.825 1.00 0.00 H new ATOM 0 HD11 ILE A 44 12.202 7.931 -7.384 1.00 0.00 H new ATOM 0 HD12 ILE A 44 13.144 6.434 -7.186 1.00 0.00 H new ATOM 0 HD13 ILE A 44 11.381 6.416 -6.938 1.00 0.00 H new ATOM 622 N SER A 45 12.365 5.168 -1.214 1.00 0.00 N ATOM 623 CA SER A 45 12.315 4.033 -0.300 1.00 0.00 C ATOM 624 C SER A 45 11.055 3.205 -0.530 1.00 0.00 C ATOM 625 O SER A 45 9.949 3.626 -0.187 1.00 0.00 O ATOM 626 CB SER A 45 12.364 4.516 1.151 1.00 0.00 C ATOM 627 OG SER A 45 13.701 4.658 1.597 1.00 0.00 O ATOM 0 H SER A 45 11.676 5.895 -1.022 1.00 0.00 H new ATOM 0 HA SER A 45 13.183 3.403 -0.495 1.00 0.00 H new ATOM 0 HB2 SER A 45 11.845 5.471 1.237 1.00 0.00 H new ATOM 0 HB3 SER A 45 11.837 3.808 1.791 1.00 0.00 H new ATOM 0 HG SER A 45 13.705 4.969 2.526 1.00 0.00 H new ATOM 633 N LEU A 46 11.228 2.024 -1.113 1.00 0.00 N ATOM 634 CA LEU A 46 10.106 1.134 -1.390 1.00 0.00 C ATOM 635 C LEU A 46 10.147 -0.093 -0.485 1.00 0.00 C ATOM 636 O LEU A 46 11.210 -0.665 -0.247 1.00 0.00 O ATOM 637 CB LEU A 46 10.123 0.701 -2.857 1.00 0.00 C ATOM 638 CG LEU A 46 10.329 1.815 -3.884 1.00 0.00 C ATOM 639 CD1 LEU A 46 11.009 1.273 -5.131 1.00 0.00 C ATOM 640 CD2 LEU A 46 8.999 2.466 -4.239 1.00 0.00 C ATOM 0 H LEU A 46 12.136 1.660 -1.403 1.00 0.00 H new ATOM 0 HA LEU A 46 9.184 1.679 -1.189 1.00 0.00 H new ATOM 0 HB2 LEU A 46 10.914 -0.037 -2.988 1.00 0.00 H new ATOM 0 HB3 LEU A 46 9.180 0.200 -3.078 1.00 0.00 H new ATOM 0 HG LEU A 46 10.976 2.574 -3.444 1.00 0.00 H new ATOM 0 HD11 LEU A 46 11.147 2.080 -5.850 1.00 0.00 H new ATOM 0 HD12 LEU A 46 11.980 0.855 -4.864 1.00 0.00 H new ATOM 0 HD13 LEU A 46 10.389 0.494 -5.574 1.00 0.00 H new ATOM 0 HD21 LEU A 46 9.165 3.256 -4.971 1.00 0.00 H new ATOM 0 HD22 LEU A 46 8.328 1.717 -4.659 1.00 0.00 H new ATOM 0 HD23 LEU A 46 8.551 2.891 -3.341 1.00 0.00 H new ATOM 652 N ALA A 47 8.982 -0.492 0.015 1.00 0.00 N ATOM 653 CA ALA A 47 8.885 -1.653 0.890 1.00 0.00 C ATOM 654 C ALA A 47 7.440 -2.125 1.018 1.00 0.00 C ATOM 655 O ALA A 47 6.618 -1.471 1.659 1.00 0.00 O ATOM 656 CB ALA A 47 9.460 -1.331 2.261 1.00 0.00 C ATOM 0 H ALA A 47 8.093 -0.028 -0.171 1.00 0.00 H new ATOM 0 HA ALA A 47 9.466 -2.461 0.445 1.00 0.00 H new ATOM 0 HB1 ALA A 47 9.381 -2.208 2.904 1.00 0.00 H new ATOM 0 HB2 ALA A 47 10.508 -1.049 2.159 1.00 0.00 H new ATOM 0 HB3 ALA A 47 8.904 -0.505 2.704 1.00 0.00 H new ATOM 662 N VAL A 48 7.138 -3.264 0.403 1.00 0.00 N ATOM 663 CA VAL A 48 5.792 -3.823 0.449 1.00 0.00 C ATOM 664 C VAL A 48 5.630 -4.771 1.632 1.00 0.00 C ATOM 665 O VAL A 48 6.357 -5.757 1.752 1.00 0.00 O ATOM 666 CB VAL A 48 5.454 -4.578 -0.850 1.00 0.00 C ATOM 667 CG1 VAL A 48 4.061 -5.185 -0.768 1.00 0.00 C ATOM 668 CG2 VAL A 48 5.570 -3.651 -2.051 1.00 0.00 C ATOM 0 H VAL A 48 7.807 -3.817 -0.133 1.00 0.00 H new ATOM 0 HA VAL A 48 5.105 -2.985 0.563 1.00 0.00 H new ATOM 0 HB VAL A 48 6.171 -5.389 -0.975 1.00 0.00 H new ATOM 0 HG11 VAL A 48 3.840 -5.714 -1.695 1.00 0.00 H new ATOM 0 HG12 VAL A 48 4.017 -5.883 0.068 1.00 0.00 H new ATOM 0 HG13 VAL A 48 3.327 -4.393 -0.619 1.00 0.00 H new ATOM 0 HG21 VAL A 48 5.328 -4.201 -2.960 1.00 0.00 H new ATOM 0 HG22 VAL A 48 4.877 -2.818 -1.936 1.00 0.00 H new ATOM 0 HG23 VAL A 48 6.589 -3.269 -2.119 1.00 0.00 H new ATOM 678 N GLU A 49 4.673 -4.466 2.502 1.00 0.00 N ATOM 679 CA GLU A 49 4.417 -5.292 3.676 1.00 0.00 C ATOM 680 C GLU A 49 3.065 -5.992 3.564 1.00 0.00 C ATOM 681 O GLU A 49 2.023 -5.401 3.844 1.00 0.00 O ATOM 682 CB GLU A 49 4.459 -4.439 4.946 1.00 0.00 C ATOM 683 CG GLU A 49 5.857 -4.265 5.516 1.00 0.00 C ATOM 684 CD GLU A 49 6.328 -5.483 6.287 1.00 0.00 C ATOM 685 OE1 GLU A 49 5.957 -6.611 5.898 1.00 0.00 O ATOM 686 OE2 GLU A 49 7.067 -5.309 7.278 1.00 0.00 O ATOM 0 H GLU A 49 4.062 -3.653 2.416 1.00 0.00 H new ATOM 0 HA GLU A 49 5.197 -6.052 3.732 1.00 0.00 H new ATOM 0 HB2 GLU A 49 4.040 -3.457 4.728 1.00 0.00 H new ATOM 0 HB3 GLU A 49 3.822 -4.897 5.702 1.00 0.00 H new ATOM 0 HG2 GLU A 49 6.554 -4.062 4.703 1.00 0.00 H new ATOM 0 HG3 GLU A 49 5.872 -3.395 6.173 1.00 0.00 H new ATOM 693 N GLY A 50 3.092 -7.256 3.153 1.00 0.00 N ATOM 694 CA GLY A 50 1.863 -8.015 3.010 1.00 0.00 C ATOM 695 C GLY A 50 1.909 -9.335 3.754 1.00 0.00 C ATOM 696 O GLY A 50 2.744 -9.549 4.633 1.00 0.00 O ATOM 0 H GLY A 50 3.942 -7.768 2.917 1.00 0.00 H new ATOM 0 HA2 GLY A 50 1.027 -7.421 3.380 1.00 0.00 H new ATOM 0 HA3 GLY A 50 1.676 -8.203 1.953 1.00 0.00 H new ATOM 700 N PRO A 51 0.991 -10.249 3.403 1.00 0.00 N ATOM 701 CA PRO A 51 0.909 -11.570 4.032 1.00 0.00 C ATOM 702 C PRO A 51 2.086 -12.465 3.659 1.00 0.00 C ATOM 703 O PRO A 51 2.181 -13.604 4.115 1.00 0.00 O ATOM 704 CB PRO A 51 -0.397 -12.145 3.479 1.00 0.00 C ATOM 705 CG PRO A 51 -0.600 -11.443 2.181 1.00 0.00 C ATOM 706 CD PRO A 51 -0.035 -10.062 2.364 1.00 0.00 C ATOM 0 HA PRO A 51 0.936 -11.506 5.120 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -0.327 -13.224 3.339 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -1.229 -11.966 4.160 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -0.094 -11.967 1.370 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -1.658 -11.401 1.922 1.00 0.00 H new ATOM 0 HD2 PRO A 51 0.395 -9.678 1.439 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -0.801 -9.353 2.678 1.00 0.00 H new ATOM 714 N SER A 52 2.980 -11.942 2.826 1.00 0.00 N ATOM 715 CA SER A 52 4.149 -12.695 2.388 1.00 0.00 C ATOM 716 C SER A 52 5.186 -11.771 1.757 1.00 0.00 C ATOM 717 O SER A 52 4.911 -10.600 1.490 1.00 0.00 O ATOM 718 CB SER A 52 3.740 -13.779 1.389 1.00 0.00 C ATOM 719 OG SER A 52 4.706 -14.814 1.335 1.00 0.00 O ATOM 0 H SER A 52 2.917 -11.000 2.441 1.00 0.00 H new ATOM 0 HA SER A 52 4.594 -13.168 3.264 1.00 0.00 H new ATOM 0 HB2 SER A 52 2.773 -14.194 1.674 1.00 0.00 H new ATOM 0 HB3 SER A 52 3.619 -13.339 0.399 1.00 0.00 H new ATOM 0 HG SER A 52 4.420 -15.495 0.691 1.00 0.00 H new ATOM 725 N LYS A 53 6.379 -12.305 1.521 1.00 0.00 N ATOM 726 CA LYS A 53 7.459 -11.531 0.919 1.00 0.00 C ATOM 727 C LYS A 53 7.277 -11.424 -0.591 1.00 0.00 C ATOM 728 O LYS A 53 6.907 -12.395 -1.252 1.00 0.00 O ATOM 729 CB LYS A 53 8.812 -12.172 1.237 1.00 0.00 C ATOM 730 CG LYS A 53 10.000 -11.323 0.819 1.00 0.00 C ATOM 731 CD LYS A 53 10.382 -10.327 1.901 1.00 0.00 C ATOM 732 CE LYS A 53 11.221 -10.980 2.989 1.00 0.00 C ATOM 733 NZ LYS A 53 11.269 -10.151 4.225 1.00 0.00 N ATOM 0 H LYS A 53 6.623 -13.271 1.737 1.00 0.00 H new ATOM 0 HA LYS A 53 7.431 -10.527 1.342 1.00 0.00 H new ATOM 0 HB2 LYS A 53 8.871 -12.363 2.309 1.00 0.00 H new ATOM 0 HB3 LYS A 53 8.873 -13.139 0.737 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.851 -11.968 0.601 1.00 0.00 H new ATOM 0 HG3 LYS A 53 9.761 -10.789 -0.101 1.00 0.00 H new ATOM 0 HD2 LYS A 53 10.939 -9.502 1.457 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.480 -9.903 2.341 1.00 0.00 H new ATOM 0 HE2 LYS A 53 10.809 -11.961 3.226 1.00 0.00 H new ATOM 0 HE3 LYS A 53 12.234 -11.140 2.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 11.850 -10.630 4.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 11.685 -9.224 4.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 10.305 -10.019 4.592 1.00 0.00 H new ATOM 747 N VAL A 54 7.539 -10.239 -1.133 1.00 0.00 N ATOM 748 CA VAL A 54 7.407 -10.007 -2.566 1.00 0.00 C ATOM 749 C VAL A 54 8.625 -9.277 -3.119 1.00 0.00 C ATOM 750 O VAL A 54 8.871 -8.118 -2.785 1.00 0.00 O ATOM 751 CB VAL A 54 6.141 -9.189 -2.887 1.00 0.00 C ATOM 752 CG1 VAL A 54 4.907 -10.077 -2.843 1.00 0.00 C ATOM 753 CG2 VAL A 54 6.003 -8.021 -1.923 1.00 0.00 C ATOM 0 H VAL A 54 7.844 -9.424 -0.601 1.00 0.00 H new ATOM 0 HA VAL A 54 7.328 -10.985 -3.040 1.00 0.00 H new ATOM 0 HB VAL A 54 6.234 -8.788 -3.896 1.00 0.00 H new ATOM 0 HG11 VAL A 54 4.023 -9.483 -3.072 1.00 0.00 H new ATOM 0 HG12 VAL A 54 5.007 -10.876 -3.578 1.00 0.00 H new ATOM 0 HG13 VAL A 54 4.805 -10.510 -1.848 1.00 0.00 H new ATOM 0 HG21 VAL A 54 5.104 -7.454 -2.164 1.00 0.00 H new ATOM 0 HG22 VAL A 54 5.932 -8.398 -0.903 1.00 0.00 H new ATOM 0 HG23 VAL A 54 6.875 -7.372 -2.010 1.00 0.00 H new ATOM 763 N ASP A 55 9.383 -9.962 -3.968 1.00 0.00 N ATOM 764 CA ASP A 55 10.576 -9.378 -4.570 1.00 0.00 C ATOM 765 C ASP A 55 10.269 -8.007 -5.165 1.00 0.00 C ATOM 766 O ASP A 55 9.137 -7.733 -5.564 1.00 0.00 O ATOM 767 CB ASP A 55 11.133 -10.304 -5.652 1.00 0.00 C ATOM 768 CG ASP A 55 12.636 -10.175 -5.808 1.00 0.00 C ATOM 769 OD1 ASP A 55 13.106 -9.061 -6.123 1.00 0.00 O ATOM 770 OD2 ASP A 55 13.341 -11.186 -5.614 1.00 0.00 O ATOM 0 H ASP A 55 9.193 -10.922 -4.255 1.00 0.00 H new ATOM 0 HA ASP A 55 11.325 -9.255 -3.787 1.00 0.00 H new ATOM 0 HB2 ASP A 55 10.884 -11.336 -5.406 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.651 -10.077 -6.603 1.00 0.00 H new ATOM 775 N ILE A 56 11.284 -7.151 -5.221 1.00 0.00 N ATOM 776 CA ILE A 56 11.122 -5.809 -5.767 1.00 0.00 C ATOM 777 C ILE A 56 12.285 -5.445 -6.684 1.00 0.00 C ATOM 778 O ILE A 56 13.410 -5.247 -6.225 1.00 0.00 O ATOM 779 CB ILE A 56 11.014 -4.756 -4.649 1.00 0.00 C ATOM 780 CG1 ILE A 56 9.856 -5.096 -3.708 1.00 0.00 C ATOM 781 CG2 ILE A 56 10.829 -3.368 -5.245 1.00 0.00 C ATOM 782 CD1 ILE A 56 9.584 -4.025 -2.675 1.00 0.00 C ATOM 0 H ILE A 56 12.227 -7.363 -4.895 1.00 0.00 H new ATOM 0 HA ILE A 56 10.196 -5.811 -6.342 1.00 0.00 H new ATOM 0 HB ILE A 56 11.939 -4.763 -4.073 1.00 0.00 H new ATOM 0 HG12 ILE A 56 8.954 -5.258 -4.298 1.00 0.00 H new ATOM 0 HG13 ILE A 56 10.076 -6.034 -3.198 1.00 0.00 H new ATOM 0 HG21 ILE A 56 10.754 -2.634 -4.442 1.00 0.00 H new ATOM 0 HG22 ILE A 56 11.683 -3.127 -5.878 1.00 0.00 H new ATOM 0 HG23 ILE A 56 9.917 -3.347 -5.842 1.00 0.00 H new ATOM 0 HD11 ILE A 56 8.751 -4.333 -2.043 1.00 0.00 H new ATOM 0 HD12 ILE A 56 10.472 -3.879 -2.060 1.00 0.00 H new ATOM 0 HD13 ILE A 56 9.333 -3.091 -3.177 1.00 0.00 H new ATOM 794 N GLN A 57 12.004 -5.356 -7.980 1.00 0.00 N ATOM 795 CA GLN A 57 13.027 -5.014 -8.961 1.00 0.00 C ATOM 796 C GLN A 57 12.816 -3.602 -9.498 1.00 0.00 C ATOM 797 O GLN A 57 11.743 -3.273 -10.006 1.00 0.00 O ATOM 798 CB GLN A 57 13.015 -6.018 -10.114 1.00 0.00 C ATOM 799 CG GLN A 57 13.859 -7.255 -9.853 1.00 0.00 C ATOM 800 CD GLN A 57 14.351 -7.906 -11.130 1.00 0.00 C ATOM 801 OE1 GLN A 57 15.555 -7.974 -11.382 1.00 0.00 O ATOM 802 NE2 GLN A 57 13.421 -8.390 -11.945 1.00 0.00 N ATOM 0 H GLN A 57 11.077 -5.516 -8.375 1.00 0.00 H new ATOM 0 HA GLN A 57 13.997 -5.053 -8.465 1.00 0.00 H new ATOM 0 HB2 GLN A 57 11.987 -6.324 -10.307 1.00 0.00 H new ATOM 0 HB3 GLN A 57 13.376 -5.526 -11.017 1.00 0.00 H new ATOM 0 HG2 GLN A 57 14.715 -6.982 -9.236 1.00 0.00 H new ATOM 0 HG3 GLN A 57 13.273 -7.977 -9.284 1.00 0.00 H new ATOM 0 HE21 GLN A 57 12.435 -8.312 -11.697 1.00 0.00 H new ATOM 0 HE22 GLN A 57 13.693 -8.840 -12.819 1.00 0.00 H new ATOM 811 N THR A 58 13.846 -2.769 -9.382 1.00 0.00 N ATOM 812 CA THR A 58 13.773 -1.392 -9.854 1.00 0.00 C ATOM 813 C THR A 58 14.790 -1.136 -10.960 1.00 0.00 C ATOM 814 O THR A 58 15.819 -1.806 -11.036 1.00 0.00 O ATOM 815 CB THR A 58 14.013 -0.392 -8.708 1.00 0.00 C ATOM 816 OG1 THR A 58 15.198 -0.749 -7.986 1.00 0.00 O ATOM 817 CG2 THR A 58 12.825 -0.360 -7.758 1.00 0.00 C ATOM 0 H THR A 58 14.741 -3.025 -8.965 1.00 0.00 H new ATOM 0 HA THR A 58 12.767 -1.245 -10.248 1.00 0.00 H new ATOM 0 HB THR A 58 14.137 0.600 -9.142 1.00 0.00 H new ATOM 0 HG1 THR A 58 15.345 -0.107 -7.260 1.00 0.00 H new ATOM 0 HG21 THR A 58 13.019 0.354 -6.957 1.00 0.00 H new ATOM 0 HG22 THR A 58 11.931 -0.059 -8.304 1.00 0.00 H new ATOM 0 HG23 THR A 58 12.673 -1.352 -7.331 1.00 0.00 H new ATOM 825 N GLU A 59 14.495 -0.161 -11.814 1.00 0.00 N ATOM 826 CA GLU A 59 15.386 0.184 -12.916 1.00 0.00 C ATOM 827 C GLU A 59 15.076 1.579 -13.450 1.00 0.00 C ATOM 828 O GLU A 59 13.913 1.948 -13.616 1.00 0.00 O ATOM 829 CB GLU A 59 15.261 -0.845 -14.042 1.00 0.00 C ATOM 830 CG GLU A 59 15.996 -0.449 -15.312 1.00 0.00 C ATOM 831 CD GLU A 59 15.662 -1.351 -16.484 1.00 0.00 C ATOM 832 OE1 GLU A 59 14.502 -1.316 -16.947 1.00 0.00 O ATOM 833 OE2 GLU A 59 16.559 -2.092 -16.938 1.00 0.00 O ATOM 0 H GLU A 59 13.647 0.403 -11.764 1.00 0.00 H new ATOM 0 HA GLU A 59 16.409 0.178 -12.539 1.00 0.00 H new ATOM 0 HB2 GLU A 59 15.647 -1.803 -13.692 1.00 0.00 H new ATOM 0 HB3 GLU A 59 14.206 -0.992 -14.273 1.00 0.00 H new ATOM 0 HG2 GLU A 59 15.744 0.580 -15.567 1.00 0.00 H new ATOM 0 HG3 GLU A 59 17.070 -0.479 -15.130 1.00 0.00 H new ATOM 840 N ASP A 60 16.124 2.350 -13.717 1.00 0.00 N ATOM 841 CA ASP A 60 15.966 3.705 -14.233 1.00 0.00 C ATOM 842 C ASP A 60 15.571 3.682 -15.707 1.00 0.00 C ATOM 843 O ASP A 60 16.280 3.119 -16.542 1.00 0.00 O ATOM 844 CB ASP A 60 17.261 4.497 -14.051 1.00 0.00 C ATOM 845 CG ASP A 60 17.403 5.614 -15.066 1.00 0.00 C ATOM 846 OD1 ASP A 60 17.501 5.309 -16.273 1.00 0.00 O ATOM 847 OD2 ASP A 60 17.418 6.793 -14.654 1.00 0.00 O ATOM 0 H ASP A 60 17.093 2.060 -13.585 1.00 0.00 H new ATOM 0 HA ASP A 60 15.170 4.192 -13.670 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.288 4.918 -13.046 1.00 0.00 H new ATOM 0 HB3 ASP A 60 18.112 3.821 -14.137 1.00 0.00 H new ATOM 852 N LEU A 61 14.436 4.297 -16.019 1.00 0.00 N ATOM 853 CA LEU A 61 13.946 4.347 -17.392 1.00 0.00 C ATOM 854 C LEU A 61 14.476 5.581 -18.115 1.00 0.00 C ATOM 855 O LEU A 61 15.225 6.372 -17.544 1.00 0.00 O ATOM 856 CB LEU A 61 12.416 4.351 -17.409 1.00 0.00 C ATOM 857 CG LEU A 61 11.736 3.055 -16.964 1.00 0.00 C ATOM 858 CD1 LEU A 61 10.232 3.250 -16.860 1.00 0.00 C ATOM 859 CD2 LEU A 61 12.065 1.924 -17.927 1.00 0.00 C ATOM 0 H LEU A 61 13.838 4.768 -15.340 1.00 0.00 H new ATOM 0 HA LEU A 61 14.307 3.460 -17.912 1.00 0.00 H new ATOM 0 HB2 LEU A 61 12.068 5.160 -16.767 1.00 0.00 H new ATOM 0 HB3 LEU A 61 12.084 4.583 -18.421 1.00 0.00 H new ATOM 0 HG LEU A 61 12.115 2.787 -15.978 1.00 0.00 H new ATOM 0 HD11 LEU A 61 9.765 2.318 -16.542 1.00 0.00 H new ATOM 0 HD12 LEU A 61 10.016 4.031 -16.131 1.00 0.00 H new ATOM 0 HD13 LEU A 61 9.835 3.542 -17.832 1.00 0.00 H new ATOM 0 HD21 LEU A 61 11.573 1.009 -17.596 1.00 0.00 H new ATOM 0 HD22 LEU A 61 11.714 2.183 -18.926 1.00 0.00 H new ATOM 0 HD23 LEU A 61 13.144 1.768 -17.950 1.00 0.00 H new ATOM 871 N GLU A 62 14.081 5.738 -19.375 1.00 0.00 N ATOM 872 CA GLU A 62 14.517 6.877 -20.175 1.00 0.00 C ATOM 873 C GLU A 62 13.810 8.155 -19.732 1.00 0.00 C ATOM 874 O GLU A 62 14.419 9.223 -19.669 1.00 0.00 O ATOM 875 CB GLU A 62 14.247 6.619 -21.659 1.00 0.00 C ATOM 876 CG GLU A 62 15.360 5.856 -22.357 1.00 0.00 C ATOM 877 CD GLU A 62 15.198 5.837 -23.864 1.00 0.00 C ATOM 878 OE1 GLU A 62 14.051 5.685 -24.335 1.00 0.00 O ATOM 879 OE2 GLU A 62 16.217 5.974 -24.573 1.00 0.00 O ATOM 0 H GLU A 62 13.461 5.092 -19.863 1.00 0.00 H new ATOM 0 HA GLU A 62 15.589 7.005 -20.025 1.00 0.00 H new ATOM 0 HB2 GLU A 62 13.317 6.060 -21.758 1.00 0.00 H new ATOM 0 HB3 GLU A 62 14.100 7.574 -22.164 1.00 0.00 H new ATOM 0 HG2 GLU A 62 16.319 6.308 -22.104 1.00 0.00 H new ATOM 0 HG3 GLU A 62 15.382 4.832 -21.985 1.00 0.00 H new ATOM 886 N ASP A 63 12.523 8.036 -19.427 1.00 0.00 N ATOM 887 CA ASP A 63 11.732 9.181 -18.990 1.00 0.00 C ATOM 888 C ASP A 63 12.235 9.709 -17.650 1.00 0.00 C ATOM 889 O ASP A 63 12.015 10.870 -17.307 1.00 0.00 O ATOM 890 CB ASP A 63 10.256 8.796 -18.880 1.00 0.00 C ATOM 891 CG ASP A 63 9.752 8.075 -20.114 1.00 0.00 C ATOM 892 OD1 ASP A 63 10.268 6.977 -20.410 1.00 0.00 O ATOM 893 OD2 ASP A 63 8.842 8.608 -20.783 1.00 0.00 O ATOM 0 H ASP A 63 12.005 7.159 -19.474 1.00 0.00 H new ATOM 0 HA ASP A 63 11.838 9.971 -19.734 1.00 0.00 H new ATOM 0 HB2 ASP A 63 10.114 8.159 -18.007 1.00 0.00 H new ATOM 0 HB3 ASP A 63 9.660 9.694 -18.719 1.00 0.00 H new ATOM 898 N GLY A 64 12.911 8.847 -16.896 1.00 0.00 N ATOM 899 CA GLY A 64 13.433 9.244 -15.602 1.00 0.00 C ATOM 900 C GLY A 64 12.564 8.767 -14.455 1.00 0.00 C ATOM 901 O GLY A 64 12.463 9.432 -13.423 1.00 0.00 O ATOM 0 H GLY A 64 13.106 7.881 -17.159 1.00 0.00 H new ATOM 0 HA2 GLY A 64 14.440 8.844 -15.482 1.00 0.00 H new ATOM 0 HA3 GLY A 64 13.515 10.330 -15.564 1.00 0.00 H new ATOM 905 N THR A 65 11.933 7.610 -14.634 1.00 0.00 N ATOM 906 CA THR A 65 11.067 7.045 -13.607 1.00 0.00 C ATOM 907 C THR A 65 11.594 5.700 -13.122 1.00 0.00 C ATOM 908 O THR A 65 12.564 5.170 -13.665 1.00 0.00 O ATOM 909 CB THR A 65 9.627 6.864 -14.125 1.00 0.00 C ATOM 910 OG1 THR A 65 9.608 5.912 -15.194 1.00 0.00 O ATOM 911 CG2 THR A 65 9.055 8.188 -14.606 1.00 0.00 C ATOM 0 H THR A 65 12.006 7.046 -15.481 1.00 0.00 H new ATOM 0 HA THR A 65 11.061 7.750 -12.776 1.00 0.00 H new ATOM 0 HB THR A 65 9.011 6.499 -13.303 1.00 0.00 H new ATOM 0 HG1 THR A 65 8.878 6.128 -15.811 1.00 0.00 H new ATOM 0 HG21 THR A 65 8.038 8.035 -14.967 1.00 0.00 H new ATOM 0 HG22 THR A 65 9.044 8.901 -13.781 1.00 0.00 H new ATOM 0 HG23 THR A 65 9.672 8.579 -15.415 1.00 0.00 H new ATOM 919 N CYS A 66 10.949 5.152 -12.098 1.00 0.00 N ATOM 920 CA CYS A 66 11.354 3.866 -11.539 1.00 0.00 C ATOM 921 C CYS A 66 10.204 2.865 -11.592 1.00 0.00 C ATOM 922 O CYS A 66 9.209 3.007 -10.881 1.00 0.00 O ATOM 923 CB CYS A 66 11.829 4.041 -10.096 1.00 0.00 C ATOM 924 SG CYS A 66 13.597 4.384 -9.938 1.00 0.00 S ATOM 0 H CYS A 66 10.144 5.577 -11.638 1.00 0.00 H new ATOM 0 HA CYS A 66 12.177 3.478 -12.140 1.00 0.00 H new ATOM 0 HB2 CYS A 66 11.269 4.856 -9.637 1.00 0.00 H new ATOM 0 HB3 CYS A 66 11.594 3.137 -9.535 1.00 0.00 H new ATOM 0 HG CYS A 66 13.902 4.518 -8.682 1.00 0.00 H new ATOM 930 N LYS A 67 10.347 1.852 -12.440 1.00 0.00 N ATOM 931 CA LYS A 67 9.322 0.826 -12.586 1.00 0.00 C ATOM 932 C LYS A 67 9.535 -0.303 -11.583 1.00 0.00 C ATOM 933 O LYS A 67 10.325 -1.217 -11.820 1.00 0.00 O ATOM 934 CB LYS A 67 9.332 0.266 -14.011 1.00 0.00 C ATOM 935 CG LYS A 67 8.451 -0.958 -14.189 1.00 0.00 C ATOM 936 CD LYS A 67 8.940 -1.837 -15.328 1.00 0.00 C ATOM 937 CE LYS A 67 8.325 -1.423 -16.656 1.00 0.00 C ATOM 938 NZ LYS A 67 6.917 -1.890 -16.784 1.00 0.00 N ATOM 0 H LYS A 67 11.164 1.720 -13.037 1.00 0.00 H new ATOM 0 HA LYS A 67 8.353 1.285 -12.389 1.00 0.00 H new ATOM 0 HB2 LYS A 67 9.003 1.044 -14.700 1.00 0.00 H new ATOM 0 HB3 LYS A 67 10.355 0.010 -14.285 1.00 0.00 H new ATOM 0 HG2 LYS A 67 8.436 -1.534 -13.264 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.426 -0.644 -14.385 1.00 0.00 H new ATOM 0 HD2 LYS A 67 10.026 -1.777 -15.395 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.690 -2.877 -15.119 1.00 0.00 H new ATOM 0 HE2 LYS A 67 8.358 -0.337 -16.749 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.919 -1.831 -17.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 6.566 -1.678 -17.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 6.875 -2.916 -16.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 6.324 -1.403 -16.082 1.00 0.00 H new ATOM 952 N VAL A 68 8.823 -0.235 -10.462 1.00 0.00 N ATOM 953 CA VAL A 68 8.932 -1.253 -9.424 1.00 0.00 C ATOM 954 C VAL A 68 8.128 -2.496 -9.787 1.00 0.00 C ATOM 955 O VAL A 68 6.924 -2.419 -10.032 1.00 0.00 O ATOM 956 CB VAL A 68 8.448 -0.720 -8.063 1.00 0.00 C ATOM 957 CG1 VAL A 68 8.733 -1.730 -6.962 1.00 0.00 C ATOM 958 CG2 VAL A 68 9.100 0.618 -7.752 1.00 0.00 C ATOM 0 H VAL A 68 8.165 0.515 -10.250 1.00 0.00 H new ATOM 0 HA VAL A 68 9.987 -1.516 -9.348 1.00 0.00 H new ATOM 0 HB VAL A 68 7.370 -0.569 -8.115 1.00 0.00 H new ATOM 0 HG11 VAL A 68 8.384 -1.336 -6.008 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.214 -2.663 -7.181 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.806 -1.916 -6.907 1.00 0.00 H new ATOM 0 HG21 VAL A 68 8.746 0.979 -6.786 1.00 0.00 H new ATOM 0 HG22 VAL A 68 10.183 0.496 -7.719 1.00 0.00 H new ATOM 0 HG23 VAL A 68 8.839 1.339 -8.527 1.00 0.00 H new ATOM 968 N SER A 69 8.801 -3.642 -9.820 1.00 0.00 N ATOM 969 CA SER A 69 8.150 -4.902 -10.156 1.00 0.00 C ATOM 970 C SER A 69 8.220 -5.879 -8.986 1.00 0.00 C ATOM 971 O SER A 69 9.243 -5.980 -8.308 1.00 0.00 O ATOM 972 CB SER A 69 8.802 -5.523 -11.393 1.00 0.00 C ATOM 973 OG SER A 69 8.813 -4.610 -12.476 1.00 0.00 O ATOM 0 H SER A 69 9.797 -3.723 -9.618 1.00 0.00 H new ATOM 0 HA SER A 69 7.102 -4.695 -10.371 1.00 0.00 H new ATOM 0 HB2 SER A 69 9.823 -5.825 -11.157 1.00 0.00 H new ATOM 0 HB3 SER A 69 8.261 -6.425 -11.679 1.00 0.00 H new ATOM 0 HG SER A 69 9.236 -5.030 -13.254 1.00 0.00 H new ATOM 979 N TYR A 70 7.125 -6.595 -8.756 1.00 0.00 N ATOM 980 CA TYR A 70 7.060 -7.562 -7.666 1.00 0.00 C ATOM 981 C TYR A 70 6.184 -8.752 -8.046 1.00 0.00 C ATOM 982 O TYR A 70 5.239 -8.619 -8.824 1.00 0.00 O ATOM 983 CB TYR A 70 6.518 -6.899 -6.399 1.00 0.00 C ATOM 984 CG TYR A 70 5.020 -6.689 -6.420 1.00 0.00 C ATOM 985 CD1 TYR A 70 4.152 -7.692 -6.007 1.00 0.00 C ATOM 986 CD2 TYR A 70 4.474 -5.486 -6.851 1.00 0.00 C ATOM 987 CE1 TYR A 70 2.784 -7.504 -6.025 1.00 0.00 C ATOM 988 CE2 TYR A 70 3.107 -5.289 -6.870 1.00 0.00 C ATOM 989 CZ TYR A 70 2.266 -6.301 -6.457 1.00 0.00 C ATOM 990 OH TYR A 70 0.904 -6.109 -6.475 1.00 0.00 O ATOM 0 H TYR A 70 6.271 -6.524 -9.309 1.00 0.00 H new ATOM 0 HA TYR A 70 8.070 -7.924 -7.474 1.00 0.00 H new ATOM 0 HB2 TYR A 70 6.778 -7.514 -5.537 1.00 0.00 H new ATOM 0 HB3 TYR A 70 7.010 -5.936 -6.264 1.00 0.00 H new ATOM 0 HD1 TYR A 70 4.554 -8.635 -5.666 1.00 0.00 H new ATOM 0 HD2 TYR A 70 5.129 -4.692 -7.177 1.00 0.00 H new ATOM 0 HE1 TYR A 70 2.123 -8.295 -5.702 1.00 0.00 H new ATOM 0 HE2 TYR A 70 2.699 -4.347 -7.207 1.00 0.00 H new ATOM 0 HH TYR A 70 0.705 -5.208 -6.805 1.00 0.00 H new ATOM 1000 N PHE A 71 6.505 -9.916 -7.490 1.00 0.00 N ATOM 1001 CA PHE A 71 5.749 -11.131 -7.770 1.00 0.00 C ATOM 1002 C PHE A 71 5.151 -11.707 -6.489 1.00 0.00 C ATOM 1003 O PHE A 71 5.822 -12.387 -5.712 1.00 0.00 O ATOM 1004 CB PHE A 71 6.646 -12.173 -8.441 1.00 0.00 C ATOM 1005 CG PHE A 71 5.889 -13.176 -9.263 1.00 0.00 C ATOM 1006 CD1 PHE A 71 5.394 -12.837 -10.511 1.00 0.00 C ATOM 1007 CD2 PHE A 71 5.672 -14.460 -8.787 1.00 0.00 C ATOM 1008 CE1 PHE A 71 4.696 -13.758 -11.269 1.00 0.00 C ATOM 1009 CE2 PHE A 71 4.976 -15.385 -9.541 1.00 0.00 C ATOM 1010 CZ PHE A 71 4.488 -15.034 -10.784 1.00 0.00 C ATOM 0 H PHE A 71 7.283 -10.043 -6.843 1.00 0.00 H new ATOM 0 HA PHE A 71 4.934 -10.874 -8.447 1.00 0.00 H new ATOM 0 HB2 PHE A 71 7.367 -11.663 -9.079 1.00 0.00 H new ATOM 0 HB3 PHE A 71 7.215 -12.699 -7.674 1.00 0.00 H new ATOM 0 HD1 PHE A 71 5.555 -11.841 -10.897 1.00 0.00 H new ATOM 0 HD2 PHE A 71 6.051 -14.740 -7.815 1.00 0.00 H new ATOM 0 HE1 PHE A 71 4.314 -13.480 -12.240 1.00 0.00 H new ATOM 0 HE2 PHE A 71 4.814 -16.382 -9.158 1.00 0.00 H new ATOM 0 HZ PHE A 71 3.945 -15.756 -11.376 1.00 0.00 H new ATOM 1020 N PRO A 72 3.859 -11.428 -6.262 1.00 0.00 N ATOM 1021 CA PRO A 72 3.142 -11.907 -5.077 1.00 0.00 C ATOM 1022 C PRO A 72 2.912 -13.414 -5.109 1.00 0.00 C ATOM 1023 O PRO A 72 2.820 -14.017 -6.179 1.00 0.00 O ATOM 1024 CB PRO A 72 1.807 -11.161 -5.144 1.00 0.00 C ATOM 1025 CG PRO A 72 1.620 -10.848 -6.588 1.00 0.00 C ATOM 1026 CD PRO A 72 2.999 -10.623 -7.145 1.00 0.00 C ATOM 0 HA PRO A 72 3.702 -11.724 -4.160 1.00 0.00 H new ATOM 0 HB2 PRO A 72 0.991 -11.775 -4.763 1.00 0.00 H new ATOM 0 HB3 PRO A 72 1.830 -10.253 -4.542 1.00 0.00 H new ATOM 0 HG2 PRO A 72 1.120 -11.668 -7.103 1.00 0.00 H new ATOM 0 HG3 PRO A 72 0.997 -9.963 -6.718 1.00 0.00 H new ATOM 0 HD2 PRO A 72 3.071 -10.949 -8.183 1.00 0.00 H new ATOM 0 HD3 PRO A 72 3.275 -9.569 -7.122 1.00 0.00 H new ATOM 1034 N THR A 73 2.820 -14.020 -3.929 1.00 0.00 N ATOM 1035 CA THR A 73 2.601 -15.456 -3.822 1.00 0.00 C ATOM 1036 C THR A 73 1.376 -15.764 -2.968 1.00 0.00 C ATOM 1037 O THR A 73 0.712 -16.783 -3.162 1.00 0.00 O ATOM 1038 CB THR A 73 3.826 -16.168 -3.217 1.00 0.00 C ATOM 1039 OG1 THR A 73 4.202 -15.536 -1.988 1.00 0.00 O ATOM 1040 CG2 THR A 73 4.999 -16.142 -4.185 1.00 0.00 C ATOM 0 H THR A 73 2.894 -13.537 -3.034 1.00 0.00 H new ATOM 0 HA THR A 73 2.438 -15.826 -4.834 1.00 0.00 H new ATOM 0 HB THR A 73 3.557 -17.206 -3.024 1.00 0.00 H new ATOM 0 HG1 THR A 73 4.980 -15.995 -1.609 1.00 0.00 H new ATOM 0 HG21 THR A 73 5.852 -16.650 -3.736 1.00 0.00 H new ATOM 0 HG22 THR A 73 4.720 -16.648 -5.109 1.00 0.00 H new ATOM 0 HG23 THR A 73 5.267 -15.108 -4.404 1.00 0.00 H new ATOM 1048 N VAL A 74 1.081 -14.877 -2.023 1.00 0.00 N ATOM 1049 CA VAL A 74 -0.066 -15.054 -1.141 1.00 0.00 C ATOM 1050 C VAL A 74 -1.070 -13.919 -1.312 1.00 0.00 C ATOM 1051 O VAL A 74 -0.732 -12.739 -1.223 1.00 0.00 O ATOM 1052 CB VAL A 74 0.367 -15.123 0.336 1.00 0.00 C ATOM 1053 CG1 VAL A 74 -0.839 -14.986 1.253 1.00 0.00 C ATOM 1054 CG2 VAL A 74 1.112 -16.421 0.611 1.00 0.00 C ATOM 0 H VAL A 74 1.620 -14.029 -1.849 1.00 0.00 H new ATOM 0 HA VAL A 74 -0.537 -15.997 -1.418 1.00 0.00 H new ATOM 0 HB VAL A 74 1.043 -14.292 0.539 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.514 -15.037 2.292 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.327 -14.028 1.072 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.542 -15.795 1.053 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.411 -16.454 1.659 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.461 -17.267 0.393 1.00 0.00 H new ATOM 0 HG23 VAL A 74 1.999 -16.473 -0.021 1.00 0.00 H new ATOM 1064 N PRO A 75 -2.337 -14.283 -1.563 1.00 0.00 N ATOM 1065 CA PRO A 75 -3.418 -13.311 -1.750 1.00 0.00 C ATOM 1066 C PRO A 75 -3.778 -12.588 -0.457 1.00 0.00 C ATOM 1067 O PRO A 75 -3.832 -13.196 0.611 1.00 0.00 O ATOM 1068 CB PRO A 75 -4.590 -14.171 -2.227 1.00 0.00 C ATOM 1069 CG PRO A 75 -4.309 -15.530 -1.684 1.00 0.00 C ATOM 1070 CD PRO A 75 -2.812 -15.672 -1.682 1.00 0.00 C ATOM 0 HA PRO A 75 -3.140 -12.521 -2.448 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -5.540 -13.786 -1.857 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -4.654 -14.185 -3.315 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -4.713 -15.640 -0.678 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -4.774 -16.300 -2.300 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -2.468 -16.287 -0.850 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -2.452 -16.143 -2.597 1.00 0.00 H new ATOM 1078 N GLY A 76 -4.024 -11.285 -0.561 1.00 0.00 N ATOM 1079 CA GLY A 76 -4.377 -10.501 0.609 1.00 0.00 C ATOM 1080 C GLY A 76 -4.219 -9.012 0.377 1.00 0.00 C ATOM 1081 O GLY A 76 -4.598 -8.496 -0.675 1.00 0.00 O ATOM 0 H GLY A 76 -3.985 -10.759 -1.434 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.409 -10.715 0.888 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -3.750 -10.804 1.448 1.00 0.00 H new ATOM 1085 N VAL A 77 -3.660 -8.317 1.363 1.00 0.00 N ATOM 1086 CA VAL A 77 -3.454 -6.877 1.262 1.00 0.00 C ATOM 1087 C VAL A 77 -1.979 -6.521 1.415 1.00 0.00 C ATOM 1088 O VAL A 77 -1.385 -6.734 2.472 1.00 0.00 O ATOM 1089 CB VAL A 77 -4.267 -6.118 2.327 1.00 0.00 C ATOM 1090 CG1 VAL A 77 -3.879 -4.647 2.348 1.00 0.00 C ATOM 1091 CG2 VAL A 77 -5.758 -6.280 2.073 1.00 0.00 C ATOM 0 H VAL A 77 -3.342 -8.728 2.241 1.00 0.00 H new ATOM 0 HA VAL A 77 -3.797 -6.577 0.272 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.039 -6.543 3.304 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.464 -4.127 3.107 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -2.818 -4.554 2.581 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -4.076 -4.205 1.372 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -6.318 -5.737 2.835 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.005 -5.882 1.089 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.021 -7.337 2.113 1.00 0.00 H new ATOM 1101 N TYR A 78 -1.395 -5.977 0.353 1.00 0.00 N ATOM 1102 CA TYR A 78 0.012 -5.592 0.369 1.00 0.00 C ATOM 1103 C TYR A 78 0.162 -4.082 0.524 1.00 0.00 C ATOM 1104 O TYR A 78 -0.328 -3.310 -0.301 1.00 0.00 O ATOM 1105 CB TYR A 78 0.702 -6.055 -0.915 1.00 0.00 C ATOM 1106 CG TYR A 78 0.952 -7.546 -0.965 1.00 0.00 C ATOM 1107 CD1 TYR A 78 -0.013 -8.416 -1.456 1.00 0.00 C ATOM 1108 CD2 TYR A 78 2.153 -8.084 -0.520 1.00 0.00 C ATOM 1109 CE1 TYR A 78 0.210 -9.778 -1.503 1.00 0.00 C ATOM 1110 CE2 TYR A 78 2.386 -9.445 -0.564 1.00 0.00 C ATOM 1111 CZ TYR A 78 1.412 -10.288 -1.056 1.00 0.00 C ATOM 1112 OH TYR A 78 1.639 -11.644 -1.101 1.00 0.00 O ATOM 0 H TYR A 78 -1.873 -5.793 -0.529 1.00 0.00 H new ATOM 0 HA TYR A 78 0.486 -6.075 1.224 1.00 0.00 H new ATOM 0 HB2 TYR A 78 0.089 -5.769 -1.770 1.00 0.00 H new ATOM 0 HB3 TYR A 78 1.653 -5.532 -1.015 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -0.954 -8.020 -1.807 1.00 0.00 H new ATOM 0 HD2 TYR A 78 2.918 -7.427 -0.133 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -0.552 -10.440 -1.887 1.00 0.00 H new ATOM 0 HE2 TYR A 78 3.326 -9.847 -0.215 1.00 0.00 H new ATOM 0 HH TYR A 78 0.814 -12.122 -0.873 1.00 0.00 H new ATOM 1122 N ILE A 79 0.843 -3.669 1.587 1.00 0.00 N ATOM 1123 CA ILE A 79 1.060 -2.252 1.851 1.00 0.00 C ATOM 1124 C ILE A 79 2.327 -1.752 1.164 1.00 0.00 C ATOM 1125 O ILE A 79 3.438 -1.994 1.635 1.00 0.00 O ATOM 1126 CB ILE A 79 1.163 -1.970 3.362 1.00 0.00 C ATOM 1127 CG1 ILE A 79 -0.002 -2.624 4.106 1.00 0.00 C ATOM 1128 CG2 ILE A 79 1.190 -0.470 3.620 1.00 0.00 C ATOM 1129 CD1 ILE A 79 -1.356 -2.079 3.706 1.00 0.00 C ATOM 0 H ILE A 79 1.254 -4.295 2.279 1.00 0.00 H new ATOM 0 HA ILE A 79 0.198 -1.721 1.448 1.00 0.00 H new ATOM 0 HB ILE A 79 2.093 -2.400 3.734 1.00 0.00 H new ATOM 0 HG12 ILE A 79 0.017 -3.698 3.922 1.00 0.00 H new ATOM 0 HG13 ILE A 79 0.136 -2.482 5.178 1.00 0.00 H new ATOM 0 HG21 ILE A 79 1.263 -0.286 4.692 1.00 0.00 H new ATOM 0 HG22 ILE A 79 2.051 -0.030 3.117 1.00 0.00 H new ATOM 0 HG23 ILE A 79 0.275 -0.018 3.236 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -2.135 -2.588 4.273 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.394 -1.010 3.916 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -1.515 -2.246 2.641 1.00 0.00 H new ATOM 1141 N VAL A 80 2.151 -1.052 0.048 1.00 0.00 N ATOM 1142 CA VAL A 80 3.280 -0.515 -0.703 1.00 0.00 C ATOM 1143 C VAL A 80 3.704 0.845 -0.160 1.00 0.00 C ATOM 1144 O VAL A 80 3.104 1.869 -0.486 1.00 0.00 O ATOM 1145 CB VAL A 80 2.943 -0.376 -2.199 1.00 0.00 C ATOM 1146 CG1 VAL A 80 4.080 0.310 -2.941 1.00 0.00 C ATOM 1147 CG2 VAL A 80 2.644 -1.739 -2.806 1.00 0.00 C ATOM 0 H VAL A 80 1.238 -0.843 -0.356 1.00 0.00 H new ATOM 0 HA VAL A 80 4.102 -1.221 -0.587 1.00 0.00 H new ATOM 0 HB VAL A 80 2.052 0.244 -2.297 1.00 0.00 H new ATOM 0 HG11 VAL A 80 3.824 0.399 -3.997 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.241 1.303 -2.521 1.00 0.00 H new ATOM 0 HG13 VAL A 80 4.991 -0.280 -2.837 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.408 -1.622 -3.864 1.00 0.00 H new ATOM 0 HG22 VAL A 80 3.516 -2.385 -2.698 1.00 0.00 H new ATOM 0 HG23 VAL A 80 1.794 -2.188 -2.292 1.00 0.00 H new ATOM 1157 N SER A 81 4.742 0.848 0.669 1.00 0.00 N ATOM 1158 CA SER A 81 5.245 2.082 1.260 1.00 0.00 C ATOM 1159 C SER A 81 6.159 2.818 0.285 1.00 0.00 C ATOM 1160 O SER A 81 7.346 2.508 0.172 1.00 0.00 O ATOM 1161 CB SER A 81 6.000 1.781 2.556 1.00 0.00 C ATOM 1162 OG SER A 81 5.127 1.802 3.672 1.00 0.00 O ATOM 0 H SER A 81 5.252 0.009 0.947 1.00 0.00 H new ATOM 0 HA SER A 81 4.392 2.722 1.485 1.00 0.00 H new ATOM 0 HB2 SER A 81 6.479 0.804 2.483 1.00 0.00 H new ATOM 0 HB3 SER A 81 6.793 2.515 2.697 1.00 0.00 H new ATOM 0 HG SER A 81 5.634 1.605 4.487 1.00 0.00 H new ATOM 1168 N THR A 82 5.598 3.797 -0.419 1.00 0.00 N ATOM 1169 CA THR A 82 6.360 4.577 -1.385 1.00 0.00 C ATOM 1170 C THR A 82 6.839 5.890 -0.776 1.00 0.00 C ATOM 1171 O THR A 82 6.038 6.774 -0.472 1.00 0.00 O ATOM 1172 CB THR A 82 5.526 4.882 -2.644 1.00 0.00 C ATOM 1173 OG1 THR A 82 4.727 3.745 -2.989 1.00 0.00 O ATOM 1174 CG2 THR A 82 6.426 5.250 -3.813 1.00 0.00 C ATOM 0 H THR A 82 4.618 4.068 -0.337 1.00 0.00 H new ATOM 0 HA THR A 82 7.223 3.974 -1.667 1.00 0.00 H new ATOM 0 HB THR A 82 4.876 5.730 -2.426 1.00 0.00 H new ATOM 0 HG1 THR A 82 4.199 3.947 -3.789 1.00 0.00 H new ATOM 0 HG21 THR A 82 5.815 5.461 -4.690 1.00 0.00 H new ATOM 0 HG22 THR A 82 7.011 6.133 -3.558 1.00 0.00 H new ATOM 0 HG23 THR A 82 7.098 4.420 -4.030 1.00 0.00 H new ATOM 1182 N LYS A 83 8.150 6.012 -0.602 1.00 0.00 N ATOM 1183 CA LYS A 83 8.737 7.219 -0.031 1.00 0.00 C ATOM 1184 C LYS A 83 9.694 7.879 -1.020 1.00 0.00 C ATOM 1185 O LYS A 83 10.320 7.204 -1.838 1.00 0.00 O ATOM 1186 CB LYS A 83 9.478 6.886 1.266 1.00 0.00 C ATOM 1187 CG LYS A 83 8.593 6.930 2.500 1.00 0.00 C ATOM 1188 CD LYS A 83 9.408 7.146 3.764 1.00 0.00 C ATOM 1189 CE LYS A 83 9.846 5.825 4.377 1.00 0.00 C ATOM 1190 NZ LYS A 83 10.934 6.011 5.377 1.00 0.00 N ATOM 0 H LYS A 83 8.827 5.290 -0.848 1.00 0.00 H new ATOM 0 HA LYS A 83 7.929 7.917 0.188 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.917 5.892 1.179 1.00 0.00 H new ATOM 0 HB3 LYS A 83 10.302 7.588 1.395 1.00 0.00 H new ATOM 0 HG2 LYS A 83 7.862 7.732 2.396 1.00 0.00 H new ATOM 0 HG3 LYS A 83 8.034 5.998 2.581 1.00 0.00 H new ATOM 0 HD2 LYS A 83 10.286 7.750 3.534 1.00 0.00 H new ATOM 0 HD3 LYS A 83 8.817 7.706 4.488 1.00 0.00 H new ATOM 0 HE2 LYS A 83 8.992 5.345 4.855 1.00 0.00 H new ATOM 0 HE3 LYS A 83 10.188 5.155 3.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 11.204 5.088 5.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 11.759 6.445 4.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 10.600 6.630 6.143 1.00 0.00 H new ATOM 1204 N PHE A 84 9.803 9.200 -0.938 1.00 0.00 N ATOM 1205 CA PHE A 84 10.684 9.951 -1.825 1.00 0.00 C ATOM 1206 C PHE A 84 11.274 11.162 -1.108 1.00 0.00 C ATOM 1207 O PHE A 84 10.570 12.127 -0.814 1.00 0.00 O ATOM 1208 CB PHE A 84 9.922 10.404 -3.072 1.00 0.00 C ATOM 1209 CG PHE A 84 10.675 11.400 -3.906 1.00 0.00 C ATOM 1210 CD1 PHE A 84 10.595 12.756 -3.631 1.00 0.00 C ATOM 1211 CD2 PHE A 84 11.463 10.980 -4.966 1.00 0.00 C ATOM 1212 CE1 PHE A 84 11.287 13.674 -4.398 1.00 0.00 C ATOM 1213 CE2 PHE A 84 12.157 11.894 -5.736 1.00 0.00 C ATOM 1214 CZ PHE A 84 12.070 13.243 -5.451 1.00 0.00 C ATOM 0 H PHE A 84 9.292 9.773 -0.266 1.00 0.00 H new ATOM 0 HA PHE A 84 11.501 9.295 -2.125 1.00 0.00 H new ATOM 0 HB2 PHE A 84 9.690 9.532 -3.683 1.00 0.00 H new ATOM 0 HB3 PHE A 84 8.971 10.842 -2.768 1.00 0.00 H new ATOM 0 HD1 PHE A 84 9.985 13.099 -2.808 1.00 0.00 H new ATOM 0 HD2 PHE A 84 11.536 9.927 -5.193 1.00 0.00 H new ATOM 0 HE1 PHE A 84 11.216 14.728 -4.174 1.00 0.00 H new ATOM 0 HE2 PHE A 84 12.767 11.554 -6.560 1.00 0.00 H new ATOM 0 HZ PHE A 84 12.613 13.959 -6.050 1.00 0.00 H new ATOM 1224 N ALA A 85 12.573 11.102 -0.830 1.00 0.00 N ATOM 1225 CA ALA A 85 13.259 12.193 -0.149 1.00 0.00 C ATOM 1226 C ALA A 85 12.787 12.322 1.295 1.00 0.00 C ATOM 1227 O ALA A 85 12.534 13.425 1.780 1.00 0.00 O ATOM 1228 CB ALA A 85 13.041 13.501 -0.896 1.00 0.00 C ATOM 0 H ALA A 85 13.171 10.310 -1.066 1.00 0.00 H new ATOM 0 HA ALA A 85 14.325 11.967 -0.136 1.00 0.00 H new ATOM 0 HB1 ALA A 85 13.559 14.307 -0.377 1.00 0.00 H new ATOM 0 HB2 ALA A 85 13.433 13.411 -1.909 1.00 0.00 H new ATOM 0 HB3 ALA A 85 11.975 13.723 -0.938 1.00 0.00 H new ATOM 1234 N ASP A 86 12.671 11.188 1.978 1.00 0.00 N ATOM 1235 CA ASP A 86 12.230 11.174 3.368 1.00 0.00 C ATOM 1236 C ASP A 86 10.811 11.721 3.493 1.00 0.00 C ATOM 1237 O ASP A 86 10.502 12.460 4.427 1.00 0.00 O ATOM 1238 CB ASP A 86 13.185 11.995 4.236 1.00 0.00 C ATOM 1239 CG ASP A 86 14.598 11.447 4.220 1.00 0.00 C ATOM 1240 OD1 ASP A 86 14.756 10.209 4.279 1.00 0.00 O ATOM 1241 OD2 ASP A 86 15.547 12.255 4.148 1.00 0.00 O ATOM 0 H ASP A 86 12.876 10.267 1.592 1.00 0.00 H new ATOM 0 HA ASP A 86 12.234 10.141 3.715 1.00 0.00 H new ATOM 0 HB2 ASP A 86 13.195 13.027 3.885 1.00 0.00 H new ATOM 0 HB3 ASP A 86 12.816 12.011 5.262 1.00 0.00 H new ATOM 1246 N GLU A 87 9.955 11.353 2.546 1.00 0.00 N ATOM 1247 CA GLU A 87 8.570 11.808 2.550 1.00 0.00 C ATOM 1248 C GLU A 87 7.673 10.831 1.796 1.00 0.00 C ATOM 1249 O GLU A 87 7.951 10.473 0.651 1.00 0.00 O ATOM 1250 CB GLU A 87 8.465 13.201 1.924 1.00 0.00 C ATOM 1251 CG GLU A 87 8.761 14.329 2.898 1.00 0.00 C ATOM 1252 CD GLU A 87 8.576 15.700 2.275 1.00 0.00 C ATOM 1253 OE1 GLU A 87 8.718 15.813 1.040 1.00 0.00 O ATOM 1254 OE2 GLU A 87 8.290 16.658 3.023 1.00 0.00 O ATOM 0 H GLU A 87 10.196 10.741 1.766 1.00 0.00 H new ATOM 0 HA GLU A 87 8.234 11.857 3.586 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.157 13.266 1.084 1.00 0.00 H new ATOM 0 HB3 GLU A 87 7.461 13.334 1.521 1.00 0.00 H new ATOM 0 HG2 GLU A 87 8.107 14.237 3.765 1.00 0.00 H new ATOM 0 HG3 GLU A 87 9.785 14.233 3.259 1.00 0.00 H new ATOM 1261 N HIS A 88 6.596 10.402 2.447 1.00 0.00 N ATOM 1262 CA HIS A 88 5.657 9.466 1.838 1.00 0.00 C ATOM 1263 C HIS A 88 4.772 10.172 0.815 1.00 0.00 C ATOM 1264 O HIS A 88 4.200 11.225 1.096 1.00 0.00 O ATOM 1265 CB HIS A 88 4.791 8.808 2.913 1.00 0.00 C ATOM 1266 CG HIS A 88 5.369 7.537 3.453 1.00 0.00 C ATOM 1267 ND1 HIS A 88 4.952 6.287 3.045 1.00 0.00 N ATOM 1268 CD2 HIS A 88 6.339 7.326 4.373 1.00 0.00 C ATOM 1269 CE1 HIS A 88 5.640 5.363 3.692 1.00 0.00 C ATOM 1270 NE2 HIS A 88 6.488 5.967 4.504 1.00 0.00 N ATOM 0 H HIS A 88 6.352 10.687 3.395 1.00 0.00 H new ATOM 0 HA HIS A 88 6.232 8.696 1.324 1.00 0.00 H new ATOM 0 HB2 HIS A 88 4.650 9.511 3.734 1.00 0.00 H new ATOM 0 HB3 HIS A 88 3.805 8.601 2.497 1.00 0.00 H new ATOM 0 HD1 HIS A 88 4.226 6.105 2.352 1.00 0.00 H new ATOM 0 HD2 HIS A 88 6.893 8.085 4.905 1.00 0.00 H new ATOM 0 HE1 HIS A 88 5.528 4.295 3.576 1.00 0.00 H new ATOM 1279 N VAL A 89 4.663 9.585 -0.372 1.00 0.00 N ATOM 1280 CA VAL A 89 3.847 10.157 -1.436 1.00 0.00 C ATOM 1281 C VAL A 89 2.495 10.618 -0.905 1.00 0.00 C ATOM 1282 O VAL A 89 2.003 10.134 0.115 1.00 0.00 O ATOM 1283 CB VAL A 89 3.621 9.145 -2.576 1.00 0.00 C ATOM 1284 CG1 VAL A 89 4.865 9.031 -3.443 1.00 0.00 C ATOM 1285 CG2 VAL A 89 3.228 7.788 -2.012 1.00 0.00 C ATOM 0 H VAL A 89 5.130 8.713 -0.621 1.00 0.00 H new ATOM 0 HA VAL A 89 4.393 11.016 -1.826 1.00 0.00 H new ATOM 0 HB VAL A 89 2.804 9.504 -3.201 1.00 0.00 H new ATOM 0 HG11 VAL A 89 4.687 8.312 -4.243 1.00 0.00 H new ATOM 0 HG12 VAL A 89 5.098 10.004 -3.875 1.00 0.00 H new ATOM 0 HG13 VAL A 89 5.704 8.695 -2.833 1.00 0.00 H new ATOM 0 HG21 VAL A 89 3.072 7.085 -2.830 1.00 0.00 H new ATOM 0 HG22 VAL A 89 4.023 7.419 -1.364 1.00 0.00 H new ATOM 0 HG23 VAL A 89 2.307 7.886 -1.437 1.00 0.00 H new ATOM 1295 N PRO A 90 1.877 11.576 -1.611 1.00 0.00 N ATOM 1296 CA PRO A 90 0.572 12.124 -1.229 1.00 0.00 C ATOM 1297 C PRO A 90 -0.557 11.117 -1.422 1.00 0.00 C ATOM 1298 O PRO A 90 -1.212 11.096 -2.463 1.00 0.00 O ATOM 1299 CB PRO A 90 0.395 13.313 -2.176 1.00 0.00 C ATOM 1300 CG PRO A 90 1.233 12.980 -3.363 1.00 0.00 C ATOM 1301 CD PRO A 90 2.405 12.199 -2.836 1.00 0.00 C ATOM 0 HA PRO A 90 0.536 12.394 -0.174 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -0.651 13.445 -2.454 1.00 0.00 H new ATOM 0 HB3 PRO A 90 0.721 14.243 -1.709 1.00 0.00 H new ATOM 0 HG2 PRO A 90 0.668 12.394 -4.088 1.00 0.00 H new ATOM 0 HG3 PRO A 90 1.564 13.885 -3.873 1.00 0.00 H new ATOM 0 HD2 PRO A 90 2.745 11.451 -3.553 1.00 0.00 H new ATOM 0 HD3 PRO A 90 3.256 12.846 -2.623 1.00 0.00 H new ATOM 1309 N GLY A 91 -0.781 10.284 -0.410 1.00 0.00 N ATOM 1310 CA GLY A 91 -1.832 9.287 -0.488 1.00 0.00 C ATOM 1311 C GLY A 91 -1.392 7.937 0.043 1.00 0.00 C ATOM 1312 O GLY A 91 -2.156 6.973 0.016 1.00 0.00 O ATOM 0 H GLY A 91 -0.253 10.282 0.463 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -2.698 9.632 0.077 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -2.150 9.180 -1.525 1.00 0.00 H new ATOM 1316 N SER A 92 -0.156 7.868 0.527 1.00 0.00 N ATOM 1317 CA SER A 92 0.388 6.625 1.062 1.00 0.00 C ATOM 1318 C SER A 92 -0.090 6.395 2.492 1.00 0.00 C ATOM 1319 O SER A 92 -0.545 7.311 3.177 1.00 0.00 O ATOM 1320 CB SER A 92 1.917 6.652 1.020 1.00 0.00 C ATOM 1321 OG SER A 92 2.405 6.069 -0.176 1.00 0.00 O ATOM 0 H SER A 92 0.488 8.658 0.560 1.00 0.00 H new ATOM 0 HA SER A 92 0.030 5.803 0.441 1.00 0.00 H new ATOM 0 HB2 SER A 92 2.268 7.681 1.096 1.00 0.00 H new ATOM 0 HB3 SER A 92 2.317 6.115 1.880 1.00 0.00 H new ATOM 0 HG SER A 92 1.671 5.980 -0.820 1.00 0.00 H new ATOM 1327 N PRO A 93 0.017 5.141 2.956 1.00 0.00 N ATOM 1328 CA PRO A 93 0.557 4.042 2.151 1.00 0.00 C ATOM 1329 C PRO A 93 -0.375 3.646 1.011 1.00 0.00 C ATOM 1330 O PRO A 93 -1.466 4.198 0.868 1.00 0.00 O ATOM 1331 CB PRO A 93 0.690 2.896 3.157 1.00 0.00 C ATOM 1332 CG PRO A 93 -0.318 3.200 4.211 1.00 0.00 C ATOM 1333 CD PRO A 93 -0.382 4.699 4.303 1.00 0.00 C ATOM 0 HA PRO A 93 1.496 4.314 1.668 1.00 0.00 H new ATOM 0 HB2 PRO A 93 0.494 1.932 2.688 1.00 0.00 H new ATOM 0 HB3 PRO A 93 1.696 2.849 3.573 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -1.291 2.783 3.952 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -0.028 2.762 5.166 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -1.384 5.043 4.559 1.00 0.00 H new ATOM 0 HD3 PRO A 93 0.292 5.084 5.068 1.00 0.00 H new ATOM 1341 N PHE A 94 0.061 2.685 0.203 1.00 0.00 N ATOM 1342 CA PHE A 94 -0.735 2.215 -0.925 1.00 0.00 C ATOM 1343 C PHE A 94 -1.262 0.806 -0.669 1.00 0.00 C ATOM 1344 O PHE A 94 -0.507 -0.167 -0.698 1.00 0.00 O ATOM 1345 CB PHE A 94 0.097 2.235 -2.208 1.00 0.00 C ATOM 1346 CG PHE A 94 0.069 3.557 -2.920 1.00 0.00 C ATOM 1347 CD1 PHE A 94 0.294 4.737 -2.229 1.00 0.00 C ATOM 1348 CD2 PHE A 94 -0.183 3.621 -4.281 1.00 0.00 C ATOM 1349 CE1 PHE A 94 0.269 5.955 -2.881 1.00 0.00 C ATOM 1350 CE2 PHE A 94 -0.209 4.836 -4.939 1.00 0.00 C ATOM 1351 CZ PHE A 94 0.016 6.004 -4.238 1.00 0.00 C ATOM 0 H PHE A 94 0.961 2.217 0.308 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.585 2.887 -1.042 1.00 0.00 H new ATOM 0 HB2 PHE A 94 1.130 1.984 -1.966 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -0.270 1.461 -2.882 1.00 0.00 H new ATOM 0 HD1 PHE A 94 0.491 4.704 -1.168 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.361 2.711 -4.834 1.00 0.00 H new ATOM 0 HE1 PHE A 94 0.447 6.867 -2.331 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -0.405 4.872 -6.000 1.00 0.00 H new ATOM 0 HZ PHE A 94 -0.006 6.955 -4.750 1.00 0.00 H new ATOM 1361 N THR A 95 -2.563 0.703 -0.417 1.00 0.00 N ATOM 1362 CA THR A 95 -3.192 -0.585 -0.154 1.00 0.00 C ATOM 1363 C THR A 95 -3.616 -1.265 -1.450 1.00 0.00 C ATOM 1364 O THR A 95 -4.595 -0.866 -2.081 1.00 0.00 O ATOM 1365 CB THR A 95 -4.422 -0.434 0.760 1.00 0.00 C ATOM 1366 OG1 THR A 95 -4.060 0.259 1.960 1.00 0.00 O ATOM 1367 CG2 THR A 95 -5.007 -1.794 1.111 1.00 0.00 C ATOM 0 H THR A 95 -3.202 1.497 -0.390 1.00 0.00 H new ATOM 0 HA THR A 95 -2.448 -1.202 0.350 1.00 0.00 H new ATOM 0 HB THR A 95 -5.176 0.141 0.223 1.00 0.00 H new ATOM 0 HG1 THR A 95 -4.848 0.352 2.535 1.00 0.00 H new ATOM 0 HG21 THR A 95 -5.875 -1.661 1.757 1.00 0.00 H new ATOM 0 HG22 THR A 95 -5.310 -2.306 0.198 1.00 0.00 H new ATOM 0 HG23 THR A 95 -4.256 -2.390 1.630 1.00 0.00 H new ATOM 1375 N VAL A 96 -2.873 -2.295 -1.844 1.00 0.00 N ATOM 1376 CA VAL A 96 -3.174 -3.032 -3.065 1.00 0.00 C ATOM 1377 C VAL A 96 -3.872 -4.351 -2.753 1.00 0.00 C ATOM 1378 O VAL A 96 -3.387 -5.149 -1.951 1.00 0.00 O ATOM 1379 CB VAL A 96 -1.897 -3.319 -3.877 1.00 0.00 C ATOM 1380 CG1 VAL A 96 -2.227 -4.115 -5.129 1.00 0.00 C ATOM 1381 CG2 VAL A 96 -1.189 -2.020 -4.232 1.00 0.00 C ATOM 0 H VAL A 96 -2.058 -2.638 -1.335 1.00 0.00 H new ATOM 0 HA VAL A 96 -3.839 -2.404 -3.658 1.00 0.00 H new ATOM 0 HB VAL A 96 -1.224 -3.917 -3.263 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -1.312 -4.308 -5.689 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -2.686 -5.062 -4.847 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -2.919 -3.546 -5.750 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -0.289 -2.241 -4.806 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.854 -1.394 -4.827 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -0.916 -1.493 -3.318 1.00 0.00 H new ATOM 1391 N LYS A 97 -5.015 -4.575 -3.394 1.00 0.00 N ATOM 1392 CA LYS A 97 -5.781 -5.798 -3.187 1.00 0.00 C ATOM 1393 C LYS A 97 -5.376 -6.870 -4.195 1.00 0.00 C ATOM 1394 O LYS A 97 -5.484 -6.669 -5.405 1.00 0.00 O ATOM 1395 CB LYS A 97 -7.279 -5.512 -3.305 1.00 0.00 C ATOM 1396 CG LYS A 97 -7.923 -5.096 -1.994 1.00 0.00 C ATOM 1397 CD LYS A 97 -9.401 -4.789 -2.171 1.00 0.00 C ATOM 1398 CE LYS A 97 -9.904 -3.833 -1.100 1.00 0.00 C ATOM 1399 NZ LYS A 97 -11.045 -3.007 -1.585 1.00 0.00 N ATOM 0 H LYS A 97 -5.431 -3.925 -4.061 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.566 -6.167 -2.184 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.433 -4.724 -4.042 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -7.782 -6.403 -3.681 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -7.801 -5.892 -1.259 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -7.413 -4.217 -1.600 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -9.568 -4.354 -3.156 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -9.974 -5.716 -2.131 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -10.214 -4.401 -0.223 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -9.090 -3.179 -0.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -11.359 -2.369 -0.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -10.743 -2.446 -2.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -11.831 -3.629 -1.861 1.00 0.00 H new ATOM 1413 N ILE A 98 -4.913 -8.008 -3.688 1.00 0.00 N ATOM 1414 CA ILE A 98 -4.496 -9.111 -4.545 1.00 0.00 C ATOM 1415 C ILE A 98 -5.514 -10.246 -4.514 1.00 0.00 C ATOM 1416 O ILE A 98 -5.785 -10.822 -3.461 1.00 0.00 O ATOM 1417 CB ILE A 98 -3.119 -9.659 -4.126 1.00 0.00 C ATOM 1418 CG1 ILE A 98 -2.057 -8.562 -4.224 1.00 0.00 C ATOM 1419 CG2 ILE A 98 -2.739 -10.852 -4.991 1.00 0.00 C ATOM 1420 CD1 ILE A 98 -1.995 -7.902 -5.583 1.00 0.00 C ATOM 0 H ILE A 98 -4.817 -8.190 -2.689 1.00 0.00 H new ATOM 0 HA ILE A 98 -4.427 -8.716 -5.558 1.00 0.00 H new ATOM 0 HB ILE A 98 -3.176 -9.990 -3.089 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -2.260 -7.802 -3.469 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -1.082 -8.990 -3.992 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -1.764 -11.229 -4.683 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -3.485 -11.638 -4.874 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -2.696 -10.545 -6.036 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -1.221 -7.135 -5.580 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -1.762 -8.650 -6.341 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -2.958 -7.444 -5.810 1.00 0.00 H new ATOM 1432 N SER A 99 -6.074 -10.563 -5.677 1.00 0.00 N ATOM 1433 CA SER A 99 -7.063 -11.628 -5.784 1.00 0.00 C ATOM 1434 C SER A 99 -6.393 -12.964 -6.091 1.00 0.00 C ATOM 1435 O SER A 99 -5.403 -13.022 -6.818 1.00 0.00 O ATOM 1436 CB SER A 99 -8.086 -11.296 -6.873 1.00 0.00 C ATOM 1437 OG SER A 99 -8.729 -10.061 -6.609 1.00 0.00 O ATOM 0 H SER A 99 -5.859 -10.097 -6.559 1.00 0.00 H new ATOM 0 HA SER A 99 -7.576 -11.710 -4.826 1.00 0.00 H new ATOM 0 HB2 SER A 99 -7.589 -11.251 -7.842 1.00 0.00 H new ATOM 0 HB3 SER A 99 -8.829 -12.091 -6.933 1.00 0.00 H new ATOM 0 HG SER A 99 -9.376 -9.871 -7.320 1.00 0.00 H new ATOM 1443 N GLY A 100 -6.942 -14.037 -5.529 1.00 0.00 N ATOM 1444 CA GLY A 100 -6.385 -15.358 -5.753 1.00 0.00 C ATOM 1445 C GLY A 100 -7.353 -16.283 -6.463 1.00 0.00 C ATOM 1446 O GLY A 100 -7.669 -17.363 -5.964 1.00 0.00 O ATOM 0 H GLY A 100 -7.762 -14.015 -4.923 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -5.473 -15.269 -6.343 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -6.103 -15.797 -4.796 1.00 0.00 H new ATOM 1450 N GLU A 101 -7.828 -15.859 -7.630 1.00 0.00 N ATOM 1451 CA GLU A 101 -8.769 -16.656 -8.407 1.00 0.00 C ATOM 1452 C GLU A 101 -8.051 -17.409 -9.524 1.00 0.00 C ATOM 1453 O GLU A 101 -6.926 -17.072 -9.892 1.00 0.00 O ATOM 1454 CB GLU A 101 -9.861 -15.764 -8.999 1.00 0.00 C ATOM 1455 CG GLU A 101 -9.341 -14.749 -10.003 1.00 0.00 C ATOM 1456 CD GLU A 101 -10.450 -14.112 -10.817 1.00 0.00 C ATOM 1457 OE1 GLU A 101 -10.901 -14.738 -11.799 1.00 0.00 O ATOM 1458 OE2 GLU A 101 -10.867 -12.986 -10.472 1.00 0.00 O ATOM 0 H GLU A 101 -7.576 -14.968 -8.058 1.00 0.00 H new ATOM 0 HA GLU A 101 -9.228 -17.384 -7.738 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -10.608 -16.392 -9.484 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -10.365 -15.236 -8.190 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -8.790 -13.971 -9.475 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -8.636 -15.238 -10.676 1.00 0.00 H new ATOM 1465 N GLY A 102 -8.711 -18.432 -10.060 1.00 0.00 N ATOM 1466 CA GLY A 102 -8.121 -19.217 -11.128 1.00 0.00 C ATOM 1467 C GLY A 102 -7.450 -18.355 -12.179 1.00 0.00 C ATOM 1468 O GLY A 102 -8.121 -17.665 -12.947 1.00 0.00 O ATOM 0 H GLY A 102 -9.643 -18.730 -9.773 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -7.389 -19.906 -10.706 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -8.895 -19.823 -11.599 1.00 0.00 H new ATOM 1472 N ARG A 103 -6.122 -18.392 -12.213 1.00 0.00 N ATOM 1473 CA ARG A 103 -5.360 -17.605 -13.176 1.00 0.00 C ATOM 1474 C ARG A 103 -5.988 -17.688 -14.564 1.00 0.00 C ATOM 1475 O ARG A 103 -6.865 -18.517 -14.812 1.00 0.00 O ATOM 1476 CB ARG A 103 -3.911 -18.091 -13.230 1.00 0.00 C ATOM 1477 CG ARG A 103 -3.765 -19.517 -13.737 1.00 0.00 C ATOM 1478 CD ARG A 103 -3.704 -19.565 -15.256 1.00 0.00 C ATOM 1479 NE ARG A 103 -3.079 -20.792 -15.740 1.00 0.00 N ATOM 1480 CZ ARG A 103 -2.750 -20.998 -17.011 1.00 0.00 C ATOM 1481 NH1 ARG A 103 -2.986 -20.062 -17.920 1.00 0.00 N ATOM 1482 NH2 ARG A 103 -2.184 -22.141 -17.374 1.00 0.00 N ATOM 0 H ARG A 103 -5.551 -18.958 -11.585 1.00 0.00 H new ATOM 0 HA ARG A 103 -5.375 -16.565 -12.851 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -3.337 -17.425 -13.874 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -3.476 -18.023 -12.233 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -2.861 -19.961 -13.321 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -4.605 -20.117 -13.386 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -4.713 -19.488 -15.662 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -3.145 -18.704 -15.624 1.00 0.00 H new ATOM 0 HE ARG A 103 -2.884 -21.532 -15.066 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -3.421 -19.182 -17.644 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -2.733 -20.222 -18.895 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -2.001 -22.863 -16.677 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -1.932 -22.298 -18.350 1.00 0.00 H new ATOM 1496 N VAL A 104 -5.534 -16.824 -15.466 1.00 0.00 N ATOM 1497 CA VAL A 104 -6.050 -16.800 -16.830 1.00 0.00 C ATOM 1498 C VAL A 104 -6.174 -18.210 -17.395 1.00 0.00 C ATOM 1499 O VAL A 104 -5.185 -18.814 -17.812 1.00 0.00 O ATOM 1500 CB VAL A 104 -5.147 -15.964 -17.757 1.00 0.00 C ATOM 1501 CG1 VAL A 104 -5.676 -15.990 -19.183 1.00 0.00 C ATOM 1502 CG2 VAL A 104 -5.037 -14.536 -17.246 1.00 0.00 C ATOM 0 H VAL A 104 -4.810 -16.131 -15.277 1.00 0.00 H new ATOM 0 HA VAL A 104 -7.038 -16.341 -16.787 1.00 0.00 H new ATOM 0 HB VAL A 104 -4.149 -16.403 -17.757 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -5.026 -15.394 -19.823 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -5.698 -17.018 -19.544 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -6.684 -15.576 -19.205 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -4.396 -13.959 -17.913 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -6.028 -14.083 -17.215 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.608 -14.540 -16.244 1.00 0.00 H new ATOM 1512 N LYS A 105 -7.396 -18.731 -17.408 1.00 0.00 N ATOM 1513 CA LYS A 105 -7.653 -20.070 -17.924 1.00 0.00 C ATOM 1514 C LYS A 105 -7.795 -20.050 -19.442 1.00 0.00 C ATOM 1515 O LYS A 105 -7.171 -20.846 -20.145 1.00 0.00 O ATOM 1516 CB LYS A 105 -8.919 -20.650 -17.290 1.00 0.00 C ATOM 1517 CG LYS A 105 -9.237 -22.063 -17.749 1.00 0.00 C ATOM 1518 CD LYS A 105 -10.408 -22.649 -16.977 1.00 0.00 C ATOM 1519 CE LYS A 105 -9.965 -23.217 -15.638 1.00 0.00 C ATOM 1520 NZ LYS A 105 -9.268 -24.525 -15.793 1.00 0.00 N ATOM 0 H LYS A 105 -8.225 -18.245 -17.066 1.00 0.00 H new ATOM 0 HA LYS A 105 -6.803 -20.701 -17.664 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -8.807 -20.646 -16.206 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -9.763 -20.002 -17.526 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -9.468 -22.057 -18.814 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -8.359 -22.696 -17.617 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -11.161 -21.877 -16.815 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -10.879 -23.434 -17.569 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -9.301 -22.508 -15.145 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -10.834 -23.343 -14.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -9.133 -24.959 -14.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -9.842 -25.156 -16.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -8.342 -24.374 -16.242 1.00 0.00 H new ATOM 1534 N SER A 106 -8.619 -19.135 -19.943 1.00 0.00 N ATOM 1535 CA SER A 106 -8.844 -19.013 -21.379 1.00 0.00 C ATOM 1536 C SER A 106 -7.596 -18.488 -22.082 1.00 0.00 C ATOM 1537 O SER A 106 -7.492 -17.299 -22.380 1.00 0.00 O ATOM 1538 CB SER A 106 -10.027 -18.083 -21.653 1.00 0.00 C ATOM 1539 OG SER A 106 -10.074 -17.706 -23.018 1.00 0.00 O ATOM 0 H SER A 106 -9.142 -18.467 -19.376 1.00 0.00 H new ATOM 0 HA SER A 106 -9.071 -20.004 -21.772 1.00 0.00 H new ATOM 0 HB2 SER A 106 -10.957 -18.581 -21.378 1.00 0.00 H new ATOM 0 HB3 SER A 106 -9.946 -17.193 -21.029 1.00 0.00 H new ATOM 0 HG SER A 106 -9.281 -17.174 -23.238 1.00 0.00 H new ATOM 1545 N GLY A 107 -6.650 -19.385 -22.344 1.00 0.00 N ATOM 1546 CA GLY A 107 -5.422 -18.994 -23.010 1.00 0.00 C ATOM 1547 C GLY A 107 -4.534 -20.180 -23.330 1.00 0.00 C ATOM 1548 O GLY A 107 -3.501 -20.399 -22.697 1.00 0.00 O ATOM 0 H GLY A 107 -6.713 -20.375 -22.107 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -5.665 -18.466 -23.932 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -4.875 -18.295 -22.377 1.00 0.00 H new ATOM 1552 N PRO A 108 -4.937 -20.972 -24.335 1.00 0.00 N ATOM 1553 CA PRO A 108 -4.185 -22.157 -24.760 1.00 0.00 C ATOM 1554 C PRO A 108 -2.870 -21.794 -25.443 1.00 0.00 C ATOM 1555 O PRO A 108 -2.570 -20.618 -25.649 1.00 0.00 O ATOM 1556 CB PRO A 108 -5.131 -22.841 -25.750 1.00 0.00 C ATOM 1557 CG PRO A 108 -5.994 -21.743 -26.270 1.00 0.00 C ATOM 1558 CD PRO A 108 -6.158 -20.772 -25.134 1.00 0.00 C ATOM 0 HA PRO A 108 -3.903 -22.786 -23.916 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -4.579 -23.325 -26.555 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -5.725 -23.613 -25.261 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -5.534 -21.260 -27.132 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -6.960 -22.128 -26.597 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -6.241 -19.746 -25.491 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -7.057 -20.981 -24.554 1.00 0.00 H new ATOM 1566 N SER A 109 -2.090 -22.812 -25.792 1.00 0.00 N ATOM 1567 CA SER A 109 -0.805 -22.600 -26.448 1.00 0.00 C ATOM 1568 C SER A 109 -0.689 -23.460 -27.704 1.00 0.00 C ATOM 1569 O SER A 109 -0.465 -22.948 -28.801 1.00 0.00 O ATOM 1570 CB SER A 109 0.341 -22.922 -25.488 1.00 0.00 C ATOM 1571 OG SER A 109 0.540 -21.869 -24.561 1.00 0.00 O ATOM 0 H SER A 109 -2.325 -23.791 -25.632 1.00 0.00 H new ATOM 0 HA SER A 109 -0.741 -21.551 -26.739 1.00 0.00 H new ATOM 0 HB2 SER A 109 0.122 -23.846 -24.952 1.00 0.00 H new ATOM 0 HB3 SER A 109 1.257 -23.091 -26.054 1.00 0.00 H new ATOM 0 HG SER A 109 1.277 -22.100 -23.957 1.00 0.00 H new ATOM 1577 N SER A 110 -0.842 -24.769 -27.533 1.00 0.00 N ATOM 1578 CA SER A 110 -0.750 -25.701 -28.651 1.00 0.00 C ATOM 1579 C SER A 110 -1.942 -25.544 -29.589 1.00 0.00 C ATOM 1580 O SER A 110 -3.021 -26.078 -29.336 1.00 0.00 O ATOM 1581 CB SER A 110 -0.677 -27.141 -28.137 1.00 0.00 C ATOM 1582 OG SER A 110 -0.894 -28.068 -29.186 1.00 0.00 O ATOM 0 H SER A 110 -1.030 -25.208 -26.632 1.00 0.00 H new ATOM 0 HA SER A 110 0.160 -25.474 -29.207 1.00 0.00 H new ATOM 0 HB2 SER A 110 0.299 -27.320 -27.685 1.00 0.00 H new ATOM 0 HB3 SER A 110 -1.422 -27.290 -27.356 1.00 0.00 H new ATOM 0 HG SER A 110 -0.841 -28.980 -28.832 1.00 0.00 H new ATOM 1588 N GLY A 111 -1.739 -24.804 -30.675 1.00 0.00 N ATOM 1589 CA GLY A 111 -2.805 -24.588 -31.636 1.00 0.00 C ATOM 1590 C GLY A 111 -2.323 -24.691 -33.069 1.00 0.00 C ATOM 1591 O GLY A 111 -2.684 -25.623 -33.787 1.00 0.00 O ATOM 0 H GLY A 111 -0.855 -24.350 -30.906 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -3.595 -25.320 -31.468 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -3.243 -23.603 -31.473 1.00 0.00 H new TER 1595 GLY A 111