USER MOD reduce.3.24.130724 H: found=0, std=0, add=706, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 703 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 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 171:sc= 1.05 (180deg=0.928) USER MOD Single : A 2 SER OG : rot -78:sc= 1.28 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.288 USER MOD Single : A 15 SER OG : rot -69:sc= 1.24 USER MOD Single : A 16 SER OG : rot -156:sc= 0.835 USER MOD Single : A 19 HIS : no HD1:sc= -0.0316 X(o=-0.032,f=0) USER MOD Single : A 20 ASN : amide:sc= 0.448 K(o=0.45,f=-0.13) USER MOD Single : A 21 THR OG1 : rot 58:sc= 1.2 USER MOD Single : A 23 SER OG : rot 101:sc= 1.13 USER MOD Single : A 28 LYS NZ :NH3+ 137:sc= 0.452 (180deg=-0.0615) USER MOD Single : A 31 SER OG : rot 180:sc= 0.327 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 102:sc= 0.946 USER MOD Single : A 51 LYS NZ :NH3+ 178:sc= 1.25 (180deg=1.23) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -0:sc= 0.871 USER MOD Single : A 64 SER OG : rot -131:sc= 0.914 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 102:sc= 1.26 USER MOD Single : A 84 SER OG : rot -61:sc= 1.01 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.596 5.945 -12.750 1.00 10.00 N ATOM 2 CA MET A 1 -16.364 6.333 -12.026 1.00 10.00 C ATOM 3 C MET A 1 -15.257 6.600 -13.039 1.00 10.00 C ATOM 4 O MET A 1 -15.319 6.043 -14.127 1.00 10.00 O ATOM 5 CB MET A 1 -15.938 5.233 -11.034 1.00 10.00 C ATOM 6 CG MET A 1 -16.729 5.286 -9.722 1.00 10.00 C ATOM 7 SD MET A 1 -18.532 5.157 -9.872 1.00 10.00 S ATOM 8 CE MET A 1 -18.980 5.252 -8.117 1.00 10.00 C ATOM 0 H1 MET A 1 -18.309 5.615 -12.069 1.00 10.00 H new ATOM 0 H2 MET A 1 -17.967 6.766 -13.269 1.00 10.00 H new ATOM 0 H3 MET A 1 -17.378 5.181 -13.421 1.00 10.00 H new ATOM 0 HA MET A 1 -16.557 7.238 -11.450 1.00 10.00 H new ATOM 0 HB2 MET A 1 -16.076 4.257 -11.498 1.00 10.00 H new ATOM 0 HB3 MET A 1 -14.875 5.336 -10.818 1.00 10.00 H new ATOM 0 HG2 MET A 1 -16.380 4.479 -9.078 1.00 10.00 H new ATOM 0 HG3 MET A 1 -16.493 6.222 -9.216 1.00 10.00 H new ATOM 0 HE1 MET A 1 -20.063 5.188 -8.014 1.00 10.00 H new ATOM 0 HE2 MET A 1 -18.515 4.427 -7.578 1.00 10.00 H new ATOM 0 HE3 MET A 1 -18.631 6.198 -7.703 1.00 10.00 H new ATOM 18 N SER A 2 -14.288 7.459 -12.701 1.00 10.00 N ATOM 19 CA SER A 2 -13.045 7.662 -13.438 1.00 10.00 C ATOM 20 C SER A 2 -12.085 8.459 -12.563 1.00 10.00 C ATOM 21 O SER A 2 -12.486 9.415 -11.899 1.00 10.00 O ATOM 22 CB SER A 2 -13.260 8.481 -14.720 1.00 10.00 C ATOM 23 OG SER A 2 -12.034 8.657 -15.419 1.00 10.00 O ATOM 0 H SER A 2 -14.355 8.052 -11.874 1.00 10.00 H new ATOM 0 HA SER A 2 -12.657 6.678 -13.701 1.00 10.00 H new ATOM 0 HB2 SER A 2 -13.981 7.976 -15.363 1.00 10.00 H new ATOM 0 HB3 SER A 2 -13.683 9.454 -14.469 1.00 10.00 H new ATOM 0 HG SER A 2 -11.506 9.358 -14.982 1.00 10.00 H new ATOM 29 N LEU A 3 -10.820 8.055 -12.595 1.00 10.00 N ATOM 30 CA LEU A 3 -9.686 8.858 -12.149 1.00 10.00 C ATOM 31 C LEU A 3 -9.443 9.967 -13.204 1.00 10.00 C ATOM 32 O LEU A 3 -10.200 10.077 -14.182 1.00 10.00 O ATOM 33 CB LEU A 3 -8.462 7.937 -11.929 1.00 10.00 C ATOM 34 CG LEU A 3 -8.269 6.780 -12.934 1.00 10.00 C ATOM 35 CD1 LEU A 3 -8.346 7.195 -14.407 1.00 10.00 C ATOM 36 CD2 LEU A 3 -6.937 6.081 -12.681 1.00 10.00 C ATOM 0 H LEU A 3 -10.547 7.135 -12.941 1.00 10.00 H new ATOM 0 HA LEU A 3 -9.879 9.345 -11.193 1.00 10.00 H new ATOM 0 HB2 LEU A 3 -7.565 8.555 -11.947 1.00 10.00 H new ATOM 0 HB3 LEU A 3 -8.534 7.509 -10.929 1.00 10.00 H new ATOM 0 HG LEU A 3 -9.107 6.105 -12.760 1.00 10.00 H new ATOM 0 HD11 LEU A 3 -8.199 6.320 -15.040 1.00 10.00 H new ATOM 0 HD12 LEU A 3 -9.324 7.631 -14.612 1.00 10.00 H new ATOM 0 HD13 LEU A 3 -7.570 7.930 -14.619 1.00 10.00 H new ATOM 0 HD21 LEU A 3 -6.812 5.267 -13.395 1.00 10.00 H new ATOM 0 HD22 LEU A 3 -6.123 6.796 -12.799 1.00 10.00 H new ATOM 0 HD23 LEU A 3 -6.923 5.680 -11.668 1.00 10.00 H new ATOM 48 N ARG A 4 -8.388 10.774 -13.039 1.00 10.00 N ATOM 49 CA ARG A 4 -8.000 11.837 -13.978 1.00 10.00 C ATOM 50 C ARG A 4 -6.576 11.591 -14.502 1.00 10.00 C ATOM 51 O ARG A 4 -6.026 10.497 -14.369 1.00 10.00 O ATOM 52 CB ARG A 4 -8.175 13.202 -13.279 1.00 10.00 C ATOM 53 CG ARG A 4 -9.634 13.465 -12.872 1.00 10.00 C ATOM 54 CD ARG A 4 -9.763 14.807 -12.147 1.00 10.00 C ATOM 55 NE ARG A 4 -11.176 15.116 -11.863 1.00 10.00 N ATOM 56 CZ ARG A 4 -11.632 16.164 -11.188 1.00 10.00 C ATOM 57 NH1 ARG A 4 -10.823 17.047 -10.650 1.00 10.00 N ATOM 58 NH2 ARG A 4 -12.925 16.343 -11.045 1.00 10.00 N ATOM 0 H ARG A 4 -7.767 10.706 -12.233 1.00 10.00 H new ATOM 0 HA ARG A 4 -8.644 11.835 -14.858 1.00 10.00 H new ATOM 0 HB2 ARG A 4 -7.541 13.238 -12.393 1.00 10.00 H new ATOM 0 HB3 ARG A 4 -7.837 13.995 -13.946 1.00 10.00 H new ATOM 0 HG2 ARG A 4 -10.269 13.463 -13.758 1.00 10.00 H new ATOM 0 HG3 ARG A 4 -9.986 12.662 -12.225 1.00 10.00 H new ATOM 0 HD2 ARG A 4 -9.198 14.778 -11.215 1.00 10.00 H new ATOM 0 HD3 ARG A 4 -9.329 15.598 -12.758 1.00 10.00 H new ATOM 0 HE ARG A 4 -11.871 14.461 -12.220 1.00 10.00 H new ATOM 0 HH11 ARG A 4 -9.813 16.938 -10.745 1.00 10.00 H new ATOM 0 HH12 ARG A 4 -11.204 17.842 -10.137 1.00 10.00 H new ATOM 0 HH21 ARG A 4 -13.580 15.676 -11.453 1.00 10.00 H new ATOM 0 HH22 ARG A 4 -13.274 17.149 -10.526 1.00 10.00 H new ATOM 72 N LYS A 5 -5.988 12.596 -15.164 1.00 10.00 N ATOM 73 CA LYS A 5 -4.579 12.587 -15.578 1.00 10.00 C ATOM 74 C LYS A 5 -3.699 12.369 -14.346 1.00 10.00 C ATOM 75 O LYS A 5 -3.808 13.108 -13.371 1.00 10.00 O ATOM 76 CB LYS A 5 -4.214 13.913 -16.270 1.00 10.00 C ATOM 77 CG LYS A 5 -4.784 14.066 -17.690 1.00 10.00 C ATOM 78 CD LYS A 5 -4.104 13.128 -18.700 1.00 10.00 C ATOM 79 CE LYS A 5 -4.599 13.428 -20.118 1.00 10.00 C ATOM 80 NZ LYS A 5 -3.914 12.578 -21.122 1.00 10.00 N ATOM 0 H LYS A 5 -6.483 13.447 -15.430 1.00 10.00 H new ATOM 0 HA LYS A 5 -4.415 11.778 -16.290 1.00 10.00 H new ATOM 0 HB2 LYS A 5 -4.573 14.740 -15.657 1.00 10.00 H new ATOM 0 HB3 LYS A 5 -3.128 13.998 -16.316 1.00 10.00 H new ATOM 0 HG2 LYS A 5 -5.855 13.862 -17.673 1.00 10.00 H new ATOM 0 HG3 LYS A 5 -4.662 15.098 -18.018 1.00 10.00 H new ATOM 0 HD2 LYS A 5 -3.022 13.252 -18.651 1.00 10.00 H new ATOM 0 HD3 LYS A 5 -4.318 12.090 -18.444 1.00 10.00 H new ATOM 0 HE2 LYS A 5 -5.675 13.262 -20.172 1.00 10.00 H new ATOM 0 HE3 LYS A 5 -4.427 14.479 -20.350 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 -4.272 12.806 -22.072 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 -2.890 12.755 -21.086 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 -4.100 11.576 -20.913 1.00 10.00 H new ATOM 94 N LEU A 6 -2.820 11.368 -14.404 1.00 10.00 N ATOM 95 CA LEU A 6 -2.039 10.951 -13.247 1.00 10.00 C ATOM 96 C LEU A 6 -0.925 11.967 -12.972 1.00 10.00 C ATOM 97 O LEU A 6 0.058 12.059 -13.703 1.00 10.00 O ATOM 98 CB LEU A 6 -1.499 9.528 -13.464 1.00 10.00 C ATOM 99 CG LEU A 6 -2.581 8.428 -13.523 1.00 10.00 C ATOM 100 CD1 LEU A 6 -1.905 7.055 -13.557 1.00 10.00 C ATOM 101 CD2 LEU A 6 -3.543 8.472 -12.330 1.00 10.00 C ATOM 0 H LEU A 6 -2.633 10.829 -15.249 1.00 10.00 H new ATOM 0 HA LEU A 6 -2.674 10.923 -12.361 1.00 10.00 H new ATOM 0 HB2 LEU A 6 -0.929 9.508 -14.393 1.00 10.00 H new ATOM 0 HB3 LEU A 6 -0.804 9.291 -12.659 1.00 10.00 H new ATOM 0 HG LEU A 6 -3.166 8.605 -14.425 1.00 10.00 H new ATOM 0 HD11 LEU A 6 -2.666 6.276 -13.599 1.00 10.00 H new ATOM 0 HD12 LEU A 6 -1.266 6.986 -14.437 1.00 10.00 H new ATOM 0 HD13 LEU A 6 -1.301 6.925 -12.659 1.00 10.00 H new ATOM 0 HD21 LEU A 6 -4.280 7.675 -12.428 1.00 10.00 H new ATOM 0 HD22 LEU A 6 -2.982 8.336 -11.405 1.00 10.00 H new ATOM 0 HD23 LEU A 6 -4.051 9.436 -12.308 1.00 10.00 H new ATOM 113 N THR A 7 -1.132 12.753 -11.913 1.00 10.00 N ATOM 114 CA THR A 7 -0.281 13.864 -11.483 1.00 10.00 C ATOM 115 C THR A 7 -0.274 13.952 -9.952 1.00 10.00 C ATOM 116 O THR A 7 -0.810 13.070 -9.282 1.00 10.00 O ATOM 117 CB THR A 7 -0.765 15.167 -12.150 1.00 10.00 C ATOM 118 OG1 THR A 7 0.199 16.180 -11.971 1.00 10.00 O ATOM 119 CG2 THR A 7 -2.106 15.696 -11.630 1.00 10.00 C ATOM 0 H THR A 7 -1.938 12.625 -11.302 1.00 10.00 H new ATOM 0 HA THR A 7 0.749 13.698 -11.798 1.00 10.00 H new ATOM 0 HB THR A 7 -0.908 14.912 -13.200 1.00 10.00 H new ATOM 0 HG1 THR A 7 -0.111 17.006 -12.398 1.00 10.00 H new ATOM 0 HG21 THR A 7 -2.364 16.614 -12.157 1.00 10.00 H new ATOM 0 HG22 THR A 7 -2.882 14.950 -11.800 1.00 10.00 H new ATOM 0 HG23 THR A 7 -2.027 15.901 -10.562 1.00 10.00 H new ATOM 127 N GLU A 8 0.298 15.028 -9.406 1.00 10.00 N ATOM 128 CA GLU A 8 0.493 15.378 -7.985 1.00 10.00 C ATOM 129 C GLU A 8 -0.820 15.592 -7.183 1.00 10.00 C ATOM 130 O GLU A 8 -0.894 16.411 -6.273 1.00 10.00 O ATOM 131 CB GLU A 8 1.441 16.595 -7.944 1.00 10.00 C ATOM 132 CG GLU A 8 2.268 16.698 -6.654 1.00 10.00 C ATOM 133 CD GLU A 8 3.330 17.796 -6.786 1.00 10.00 C ATOM 134 OE1 GLU A 8 4.440 17.465 -7.262 1.00 10.00 O ATOM 135 OE2 GLU A 8 3.016 18.956 -6.438 1.00 10.00 O ATOM 0 H GLU A 8 0.679 15.758 -10.008 1.00 10.00 H new ATOM 0 HA GLU A 8 0.940 14.529 -7.468 1.00 10.00 H new ATOM 0 HB2 GLU A 8 2.120 16.543 -8.795 1.00 10.00 H new ATOM 0 HB3 GLU A 8 0.853 17.505 -8.060 1.00 10.00 H new ATOM 0 HG2 GLU A 8 1.613 16.917 -5.811 1.00 10.00 H new ATOM 0 HG3 GLU A 8 2.748 15.742 -6.445 1.00 10.00 H new ATOM 142 N GLY A 9 -1.871 14.845 -7.534 1.00 10.00 N ATOM 143 CA GLY A 9 -3.131 14.719 -6.810 1.00 10.00 C ATOM 144 C GLY A 9 -3.681 13.298 -6.943 1.00 10.00 C ATOM 145 O GLY A 9 -3.841 12.606 -5.941 1.00 10.00 O ATOM 0 H GLY A 9 -1.860 14.280 -8.383 1.00 10.00 H new ATOM 0 HA2 GLY A 9 -2.979 14.960 -5.758 1.00 10.00 H new ATOM 0 HA3 GLY A 9 -3.855 15.434 -7.200 1.00 10.00 H new ATOM 149 N ASP A 10 -3.870 12.812 -8.177 1.00 10.00 N ATOM 150 CA ASP A 10 -4.274 11.422 -8.430 1.00 10.00 C ATOM 151 C ASP A 10 -3.213 10.422 -7.939 1.00 10.00 C ATOM 152 O ASP A 10 -3.551 9.430 -7.295 1.00 10.00 O ATOM 153 CB ASP A 10 -4.537 11.212 -9.931 1.00 10.00 C ATOM 154 CG ASP A 10 -5.824 11.881 -10.428 1.00 10.00 C ATOM 155 OD1 ASP A 10 -5.868 13.131 -10.399 1.00 10.00 O ATOM 156 OD2 ASP A 10 -6.740 11.137 -10.854 1.00 10.00 O ATOM 0 H ASP A 10 -3.748 13.367 -9.024 1.00 10.00 H new ATOM 0 HA ASP A 10 -5.191 11.238 -7.870 1.00 10.00 H new ATOM 0 HB2 ASP A 10 -3.692 11.603 -10.498 1.00 10.00 H new ATOM 0 HB3 ASP A 10 -4.591 10.143 -10.136 1.00 10.00 H new ATOM 161 N LEU A 11 -1.926 10.693 -8.196 1.00 10.00 N ATOM 162 CA LEU A 11 -0.818 9.859 -7.723 1.00 10.00 C ATOM 163 C LEU A 11 -0.644 9.947 -6.202 1.00 10.00 C ATOM 164 O LEU A 11 -0.330 8.941 -5.566 1.00 10.00 O ATOM 165 CB LEU A 11 0.483 10.277 -8.430 1.00 10.00 C ATOM 166 CG LEU A 11 0.498 10.017 -9.949 1.00 10.00 C ATOM 167 CD1 LEU A 11 1.814 10.519 -10.550 1.00 10.00 C ATOM 168 CD2 LEU A 11 0.345 8.526 -10.270 1.00 10.00 C ATOM 0 H LEU A 11 -1.625 11.501 -8.741 1.00 10.00 H new ATOM 0 HA LEU A 11 -1.052 8.822 -7.965 1.00 10.00 H new ATOM 0 HB2 LEU A 11 0.652 11.340 -8.255 1.00 10.00 H new ATOM 0 HB3 LEU A 11 1.317 9.743 -7.975 1.00 10.00 H new ATOM 0 HG LEU A 11 -0.347 10.553 -10.381 1.00 10.00 H new ATOM 0 HD11 LEU A 11 1.818 10.332 -11.624 1.00 10.00 H new ATOM 0 HD12 LEU A 11 1.913 11.589 -10.367 1.00 10.00 H new ATOM 0 HD13 LEU A 11 2.649 9.994 -10.087 1.00 10.00 H new ATOM 0 HD21 LEU A 11 0.360 8.383 -11.350 1.00 10.00 H new ATOM 0 HD22 LEU A 11 1.167 7.970 -9.819 1.00 10.00 H new ATOM 0 HD23 LEU A 11 -0.601 8.163 -9.869 1.00 10.00 H new ATOM 180 N ASP A 12 -0.886 11.128 -5.619 1.00 10.00 N ATOM 181 CA ASP A 12 -0.862 11.319 -4.170 1.00 10.00 C ATOM 182 C ASP A 12 -1.982 10.507 -3.501 1.00 10.00 C ATOM 183 O ASP A 12 -1.698 9.734 -2.583 1.00 10.00 O ATOM 184 CB ASP A 12 -0.975 12.818 -3.857 1.00 10.00 C ATOM 185 CG ASP A 12 -0.835 13.088 -2.358 1.00 10.00 C ATOM 186 OD1 ASP A 12 0.312 12.994 -1.870 1.00 10.00 O ATOM 187 OD2 ASP A 12 -1.875 13.375 -1.726 1.00 10.00 O ATOM 0 H ASP A 12 -1.104 11.976 -6.142 1.00 10.00 H new ATOM 0 HA ASP A 12 0.081 10.954 -3.764 1.00 10.00 H new ATOM 0 HB2 ASP A 12 -0.203 13.364 -4.400 1.00 10.00 H new ATOM 0 HB3 ASP A 12 -1.937 13.193 -4.207 1.00 10.00 H new ATOM 192 N GLU A 13 -3.209 10.562 -4.039 1.00 10.00 N ATOM 193 CA GLU A 13 -4.332 9.745 -3.575 1.00 10.00 C ATOM 194 C GLU A 13 -4.081 8.242 -3.773 1.00 10.00 C ATOM 195 O GLU A 13 -4.412 7.449 -2.897 1.00 10.00 O ATOM 196 CB GLU A 13 -5.655 10.202 -4.207 1.00 10.00 C ATOM 197 CG GLU A 13 -6.890 9.550 -3.556 1.00 10.00 C ATOM 198 CD GLU A 13 -7.077 9.944 -2.079 1.00 10.00 C ATOM 199 OE1 GLU A 13 -6.377 9.357 -1.216 1.00 10.00 O ATOM 200 OE2 GLU A 13 -7.922 10.830 -1.824 1.00 10.00 O ATOM 0 H GLU A 13 -3.448 11.180 -4.814 1.00 10.00 H new ATOM 0 HA GLU A 13 -4.418 9.899 -2.499 1.00 10.00 H new ATOM 0 HB2 GLU A 13 -5.736 11.286 -4.123 1.00 10.00 H new ATOM 0 HB3 GLU A 13 -5.644 9.965 -5.271 1.00 10.00 H new ATOM 0 HG2 GLU A 13 -7.781 9.834 -4.117 1.00 10.00 H new ATOM 0 HG3 GLU A 13 -6.801 8.466 -3.628 1.00 10.00 H new ATOM 207 N ILE A 14 -3.445 7.824 -4.876 1.00 10.00 N ATOM 208 CA ILE A 14 -3.057 6.416 -5.065 1.00 10.00 C ATOM 209 C ILE A 14 -2.019 6.007 -4.008 1.00 10.00 C ATOM 210 O ILE A 14 -2.157 4.938 -3.413 1.00 10.00 O ATOM 211 CB ILE A 14 -2.541 6.201 -6.506 1.00 10.00 C ATOM 212 CG1 ILE A 14 -3.744 6.172 -7.476 1.00 10.00 C ATOM 213 CG2 ILE A 14 -1.718 4.905 -6.653 1.00 10.00 C ATOM 214 CD1 ILE A 14 -3.387 6.353 -8.957 1.00 10.00 C ATOM 0 H ILE A 14 -3.188 8.437 -5.650 1.00 10.00 H new ATOM 0 HA ILE A 14 -3.927 5.773 -4.929 1.00 10.00 H new ATOM 0 HB ILE A 14 -1.875 7.030 -6.747 1.00 10.00 H new ATOM 0 HG12 ILE A 14 -4.265 5.222 -7.357 1.00 10.00 H new ATOM 0 HG13 ILE A 14 -4.443 6.957 -7.188 1.00 10.00 H new ATOM 0 HG21 ILE A 14 -1.380 4.803 -7.684 1.00 10.00 H new ATOM 0 HG22 ILE A 14 -0.853 4.946 -5.990 1.00 10.00 H new ATOM 0 HG23 ILE A 14 -2.338 4.048 -6.388 1.00 10.00 H new ATOM 0 HD11 ILE A 14 -4.296 6.318 -9.557 1.00 10.00 H new ATOM 0 HD12 ILE A 14 -2.896 7.316 -9.098 1.00 10.00 H new ATOM 0 HD13 ILE A 14 -2.715 5.554 -9.270 1.00 10.00 H new ATOM 226 N SER A 15 -1.038 6.866 -3.698 1.00 10.00 N ATOM 227 CA SER A 15 -0.127 6.635 -2.573 1.00 10.00 C ATOM 228 C SER A 15 -0.880 6.517 -1.235 1.00 10.00 C ATOM 229 O SER A 15 -0.609 5.598 -0.461 1.00 10.00 O ATOM 230 CB SER A 15 0.961 7.721 -2.538 1.00 10.00 C ATOM 231 OG SER A 15 0.577 8.886 -1.834 1.00 10.00 O ATOM 0 H SER A 15 -0.857 7.728 -4.213 1.00 10.00 H new ATOM 0 HA SER A 15 0.365 5.674 -2.725 1.00 10.00 H new ATOM 0 HB2 SER A 15 1.859 7.309 -2.078 1.00 10.00 H new ATOM 0 HB3 SER A 15 1.223 7.994 -3.560 1.00 10.00 H new ATOM 0 HG SER A 15 -0.115 9.361 -2.340 1.00 10.00 H new ATOM 237 N SER A 16 -1.887 7.372 -1.002 1.00 10.00 N ATOM 238 CA SER A 16 -2.759 7.339 0.180 1.00 10.00 C ATOM 239 C SER A 16 -3.550 6.028 0.255 1.00 10.00 C ATOM 240 O SER A 16 -3.559 5.381 1.303 1.00 10.00 O ATOM 241 CB SER A 16 -3.677 8.579 0.164 1.00 10.00 C ATOM 242 OG SER A 16 -5.037 8.301 0.438 1.00 10.00 O ATOM 0 H SER A 16 -2.123 8.125 -1.648 1.00 10.00 H new ATOM 0 HA SER A 16 -2.149 7.373 1.083 1.00 10.00 H new ATOM 0 HB2 SER A 16 -3.310 9.297 0.897 1.00 10.00 H new ATOM 0 HB3 SER A 16 -3.606 9.057 -0.813 1.00 10.00 H new ATOM 0 HG SER A 16 -5.599 9.006 0.054 1.00 10.00 H new ATOM 248 N PHE A 17 -4.109 5.570 -0.873 1.00 10.00 N ATOM 249 CA PHE A 17 -4.854 4.318 -0.967 1.00 10.00 C ATOM 250 C PHE A 17 -3.965 3.098 -0.693 1.00 10.00 C ATOM 251 O PHE A 17 -4.370 2.194 0.045 1.00 10.00 O ATOM 252 CB PHE A 17 -5.493 4.239 -2.360 1.00 10.00 C ATOM 253 CG PHE A 17 -6.048 2.874 -2.713 1.00 10.00 C ATOM 254 CD1 PHE A 17 -7.229 2.413 -2.102 1.00 10.00 C ATOM 255 CD2 PHE A 17 -5.362 2.051 -3.628 1.00 10.00 C ATOM 256 CE1 PHE A 17 -7.735 1.141 -2.421 1.00 10.00 C ATOM 257 CE2 PHE A 17 -5.868 0.778 -3.944 1.00 10.00 C ATOM 258 CZ PHE A 17 -7.060 0.329 -3.348 1.00 10.00 C ATOM 0 H PHE A 17 -4.052 6.072 -1.759 1.00 10.00 H new ATOM 0 HA PHE A 17 -5.630 4.305 -0.201 1.00 10.00 H new ATOM 0 HB2 PHE A 17 -6.297 4.972 -2.421 1.00 10.00 H new ATOM 0 HB3 PHE A 17 -4.749 4.520 -3.105 1.00 10.00 H new ATOM 0 HD1 PHE A 17 -7.747 3.037 -1.388 1.00 10.00 H new ATOM 0 HD2 PHE A 17 -4.448 2.398 -4.086 1.00 10.00 H new ATOM 0 HE1 PHE A 17 -8.642 0.788 -1.954 1.00 10.00 H new ATOM 0 HE2 PHE A 17 -5.342 0.146 -4.644 1.00 10.00 H new ATOM 0 HZ PHE A 17 -7.458 -0.642 -3.603 1.00 10.00 H new ATOM 268 N LEU A 18 -2.742 3.075 -1.234 1.00 10.00 N ATOM 269 CA LEU A 18 -1.783 1.997 -0.986 1.00 10.00 C ATOM 270 C LEU A 18 -1.316 1.999 0.477 1.00 10.00 C ATOM 271 O LEU A 18 -1.366 0.958 1.137 1.00 10.00 O ATOM 272 CB LEU A 18 -0.597 2.142 -1.953 1.00 10.00 C ATOM 273 CG LEU A 18 -0.954 1.870 -3.426 1.00 10.00 C ATOM 274 CD1 LEU A 18 0.222 2.265 -4.323 1.00 10.00 C ATOM 275 CD2 LEU A 18 -1.286 0.399 -3.675 1.00 10.00 C ATOM 0 H LEU A 18 -2.391 3.804 -1.856 1.00 10.00 H new ATOM 0 HA LEU A 18 -2.268 1.037 -1.164 1.00 10.00 H new ATOM 0 HB2 LEU A 18 -0.193 3.151 -1.868 1.00 10.00 H new ATOM 0 HB3 LEU A 18 0.193 1.456 -1.648 1.00 10.00 H new ATOM 0 HG LEU A 18 -1.837 2.465 -3.660 1.00 10.00 H new ATOM 0 HD11 LEU A 18 -0.034 2.071 -5.365 1.00 10.00 H new ATOM 0 HD12 LEU A 18 0.438 3.325 -4.194 1.00 10.00 H new ATOM 0 HD13 LEU A 18 1.100 1.680 -4.050 1.00 10.00 H new ATOM 0 HD21 LEU A 18 -1.532 0.254 -4.727 1.00 10.00 H new ATOM 0 HD22 LEU A 18 -0.425 -0.217 -3.415 1.00 10.00 H new ATOM 0 HD23 LEU A 18 -2.138 0.109 -3.060 1.00 10.00 H new ATOM 287 N HIS A 19 -0.928 3.165 1.012 1.00 10.00 N ATOM 288 CA HIS A 19 -0.513 3.315 2.408 1.00 10.00 C ATOM 289 C HIS A 19 -1.636 2.916 3.379 1.00 10.00 C ATOM 290 O HIS A 19 -1.384 2.168 4.330 1.00 10.00 O ATOM 291 CB HIS A 19 -0.033 4.761 2.621 1.00 10.00 C ATOM 292 CG HIS A 19 0.609 5.072 3.953 1.00 10.00 C ATOM 293 ND1 HIS A 19 0.965 6.334 4.374 1.00 10.00 N ATOM 294 CD2 HIS A 19 1.008 4.201 4.933 1.00 10.00 C ATOM 295 CE1 HIS A 19 1.559 6.221 5.575 1.00 10.00 C ATOM 296 NE2 HIS A 19 1.602 4.938 5.958 1.00 10.00 N ATOM 0 H HIS A 19 -0.894 4.036 0.481 1.00 10.00 H new ATOM 0 HA HIS A 19 0.312 2.636 2.624 1.00 10.00 H new ATOM 0 HB2 HIS A 19 0.682 5.002 1.834 1.00 10.00 H new ATOM 0 HB3 HIS A 19 -0.887 5.426 2.491 1.00 10.00 H new ATOM 0 HD2 HIS A 19 0.884 3.128 4.915 1.00 10.00 H new ATOM 0 HE1 HIS A 19 1.947 7.049 6.150 1.00 10.00 H new ATOM 0 HE2 HIS A 19 1.992 4.572 6.827 1.00 10.00 H new ATOM 304 N ASN A 20 -2.882 3.340 3.115 1.00 10.00 N ATOM 305 CA ASN A 20 -4.054 2.884 3.856 1.00 10.00 C ATOM 306 C ASN A 20 -4.255 1.367 3.734 1.00 10.00 C ATOM 307 O ASN A 20 -4.463 0.715 4.754 1.00 10.00 O ATOM 308 CB ASN A 20 -5.305 3.648 3.379 1.00 10.00 C ATOM 309 CG ASN A 20 -6.580 3.012 3.922 1.00 10.00 C ATOM 310 OD1 ASN A 20 -7.364 2.441 3.180 1.00 10.00 O ATOM 311 ND2 ASN A 20 -6.746 3.018 5.230 1.00 10.00 N ATOM 0 H ASN A 20 -3.099 4.011 2.378 1.00 10.00 H new ATOM 0 HA ASN A 20 -3.890 3.096 4.912 1.00 10.00 H new ATOM 0 HB2 ASN A 20 -5.246 4.687 3.705 1.00 10.00 H new ATOM 0 HB3 ASN A 20 -5.335 3.657 2.289 1.00 10.00 H new ATOM 0 HD21 ASN A 20 -7.545 2.538 5.645 1.00 10.00 H new ATOM 0 HD22 ASN A 20 -6.076 3.503 5.827 1.00 10.00 H new ATOM 318 N THR A 21 -4.147 0.799 2.528 1.00 10.00 N ATOM 319 CA THR A 21 -4.423 -0.626 2.284 1.00 10.00 C ATOM 320 C THR A 21 -3.481 -1.520 3.095 1.00 10.00 C ATOM 321 O THR A 21 -3.943 -2.439 3.772 1.00 10.00 O ATOM 322 CB THR A 21 -4.320 -0.962 0.785 1.00 10.00 C ATOM 323 OG1 THR A 21 -5.259 -0.210 0.051 1.00 10.00 O ATOM 324 CG2 THR A 21 -4.619 -2.433 0.492 1.00 10.00 C ATOM 0 H THR A 21 -3.866 1.312 1.692 1.00 10.00 H new ATOM 0 HA THR A 21 -5.444 -0.821 2.611 1.00 10.00 H new ATOM 0 HB THR A 21 -3.295 -0.730 0.497 1.00 10.00 H new ATOM 0 HG1 THR A 21 -5.100 0.746 0.199 1.00 10.00 H new ATOM 0 HG21 THR A 21 -4.532 -2.616 -0.579 1.00 10.00 H new ATOM 0 HG22 THR A 21 -3.907 -3.062 1.026 1.00 10.00 H new ATOM 0 HG23 THR A 21 -5.631 -2.671 0.820 1.00 10.00 H new ATOM 332 N ILE A 22 -2.172 -1.224 3.085 1.00 10.00 N ATOM 333 CA ILE A 22 -1.194 -1.955 3.905 1.00 10.00 C ATOM 334 C ILE A 22 -1.468 -1.724 5.398 1.00 10.00 C ATOM 335 O ILE A 22 -1.461 -2.679 6.173 1.00 10.00 O ATOM 336 CB ILE A 22 0.246 -1.535 3.538 1.00 10.00 C ATOM 337 CG1 ILE A 22 0.523 -1.774 2.045 1.00 10.00 C ATOM 338 CG2 ILE A 22 1.313 -2.278 4.365 1.00 10.00 C ATOM 339 CD1 ILE A 22 1.949 -1.425 1.635 1.00 10.00 C ATOM 0 H ILE A 22 -1.766 -0.481 2.516 1.00 10.00 H new ATOM 0 HA ILE A 22 -1.297 -3.020 3.700 1.00 10.00 H new ATOM 0 HB ILE A 22 0.316 -0.472 3.768 1.00 10.00 H new ATOM 0 HG12 ILE A 22 0.330 -2.821 1.809 1.00 10.00 H new ATOM 0 HG13 ILE A 22 -0.174 -1.180 1.453 1.00 10.00 H new ATOM 0 HG21 ILE A 22 2.305 -1.942 4.064 1.00 10.00 H new ATOM 0 HG22 ILE A 22 1.164 -2.067 5.424 1.00 10.00 H new ATOM 0 HG23 ILE A 22 1.225 -3.351 4.193 1.00 10.00 H new ATOM 0 HD11 ILE A 22 2.079 -1.616 0.570 1.00 10.00 H new ATOM 0 HD12 ILE A 22 2.139 -0.371 1.840 1.00 10.00 H new ATOM 0 HD13 ILE A 22 2.651 -2.037 2.202 1.00 10.00 H new ATOM 351 N SER A 23 -1.739 -0.474 5.796 1.00 10.00 N ATOM 352 CA SER A 23 -1.997 -0.109 7.194 1.00 10.00 C ATOM 353 C SER A 23 -3.219 -0.835 7.770 1.00 10.00 C ATOM 354 O SER A 23 -3.094 -1.467 8.817 1.00 10.00 O ATOM 355 CB SER A 23 -2.160 1.406 7.357 1.00 10.00 C ATOM 356 OG SER A 23 -1.038 2.090 6.839 1.00 10.00 O ATOM 0 H SER A 23 -1.786 0.316 5.153 1.00 10.00 H new ATOM 0 HA SER A 23 -1.122 -0.430 7.760 1.00 10.00 H new ATOM 0 HB2 SER A 23 -3.062 1.737 6.843 1.00 10.00 H new ATOM 0 HB3 SER A 23 -2.286 1.651 8.412 1.00 10.00 H new ATOM 0 HG SER A 23 -1.253 2.445 5.951 1.00 10.00 H new ATOM 362 N ASP A 24 -4.376 -0.811 7.086 1.00 10.00 N ATOM 363 CA ASP A 24 -5.502 -1.677 7.445 1.00 10.00 C ATOM 364 C ASP A 24 -5.202 -3.168 7.358 1.00 10.00 C ATOM 365 O ASP A 24 -5.622 -3.876 8.268 1.00 10.00 O ATOM 366 CB ASP A 24 -6.800 -1.374 6.667 1.00 10.00 C ATOM 367 CG ASP A 24 -7.604 -0.205 7.231 1.00 10.00 C ATOM 368 OD1 ASP A 24 -8.290 -0.502 8.245 1.00 10.00 O ATOM 369 OD2 ASP A 24 -7.608 0.898 6.636 1.00 10.00 O ATOM 0 H ASP A 24 -4.551 -0.203 6.286 1.00 10.00 H new ATOM 0 HA ASP A 24 -5.664 -1.428 8.494 1.00 10.00 H new ATOM 0 HB2 ASP A 24 -6.547 -1.160 5.628 1.00 10.00 H new ATOM 0 HB3 ASP A 24 -7.427 -2.266 6.666 1.00 10.00 H new ATOM 374 N PHE A 25 -4.445 -3.676 6.377 1.00 10.00 N ATOM 375 CA PHE A 25 -4.127 -5.108 6.378 1.00 10.00 C ATOM 376 C PHE A 25 -3.344 -5.484 7.647 1.00 10.00 C ATOM 377 O PHE A 25 -3.720 -6.425 8.351 1.00 10.00 O ATOM 378 CB PHE A 25 -3.369 -5.488 5.099 1.00 10.00 C ATOM 379 CG PHE A 25 -3.152 -6.984 4.932 1.00 10.00 C ATOM 380 CD1 PHE A 25 -2.153 -7.649 5.672 1.00 10.00 C ATOM 381 CD2 PHE A 25 -3.954 -7.718 4.036 1.00 10.00 C ATOM 382 CE1 PHE A 25 -1.977 -9.037 5.539 1.00 10.00 C ATOM 383 CE2 PHE A 25 -3.790 -9.110 3.917 1.00 10.00 C ATOM 384 CZ PHE A 25 -2.813 -9.770 4.681 1.00 10.00 C ATOM 0 H PHE A 25 -4.055 -3.141 5.601 1.00 10.00 H new ATOM 0 HA PHE A 25 -5.055 -5.679 6.389 1.00 10.00 H new ATOM 0 HB2 PHE A 25 -3.920 -5.112 4.237 1.00 10.00 H new ATOM 0 HB3 PHE A 25 -2.400 -4.988 5.101 1.00 10.00 H new ATOM 0 HD1 PHE A 25 -1.520 -7.089 6.344 1.00 10.00 H new ATOM 0 HD2 PHE A 25 -4.697 -7.210 3.439 1.00 10.00 H new ATOM 0 HE1 PHE A 25 -1.200 -9.539 6.096 1.00 10.00 H new ATOM 0 HE2 PHE A 25 -4.415 -9.671 3.238 1.00 10.00 H new ATOM 0 HZ PHE A 25 -2.705 -10.842 4.608 1.00 10.00 H new ATOM 394 N ILE A 26 -2.330 -4.685 8.009 1.00 10.00 N ATOM 395 CA ILE A 26 -1.553 -4.872 9.221 1.00 10.00 C ATOM 396 C ILE A 26 -2.461 -4.744 10.450 1.00 10.00 C ATOM 397 O ILE A 26 -2.500 -5.684 11.233 1.00 10.00 O ATOM 398 CB ILE A 26 -0.345 -3.911 9.202 1.00 10.00 C ATOM 399 CG1 ILE A 26 0.679 -4.397 8.147 1.00 10.00 C ATOM 400 CG2 ILE A 26 0.294 -3.838 10.590 1.00 10.00 C ATOM 401 CD1 ILE A 26 1.883 -3.468 7.947 1.00 10.00 C ATOM 0 H ILE A 26 -2.031 -3.883 7.454 1.00 10.00 H new ATOM 0 HA ILE A 26 -1.137 -5.878 9.276 1.00 10.00 H new ATOM 0 HB ILE A 26 -0.679 -2.909 8.933 1.00 10.00 H new ATOM 0 HG12 ILE A 26 1.042 -5.382 8.440 1.00 10.00 H new ATOM 0 HG13 ILE A 26 0.167 -4.517 7.192 1.00 10.00 H new ATOM 0 HG21 ILE A 26 1.145 -3.157 10.564 1.00 10.00 H new ATOM 0 HG22 ILE A 26 -0.440 -3.474 11.310 1.00 10.00 H new ATOM 0 HG23 ILE A 26 0.633 -4.830 10.887 1.00 10.00 H new ATOM 0 HD11 ILE A 26 2.546 -3.889 7.191 1.00 10.00 H new ATOM 0 HD12 ILE A 26 1.536 -2.488 7.620 1.00 10.00 H new ATOM 0 HD13 ILE A 26 2.424 -3.366 8.888 1.00 10.00 H new ATOM 413 N LEU A 27 -3.260 -3.678 10.599 1.00 10.00 N ATOM 414 CA LEU A 27 -4.176 -3.518 11.743 1.00 10.00 C ATOM 415 C LEU A 27 -5.289 -4.586 11.813 1.00 10.00 C ATOM 416 O LEU A 27 -5.866 -4.788 12.881 1.00 10.00 O ATOM 417 CB LEU A 27 -4.757 -2.089 11.761 1.00 10.00 C ATOM 418 CG LEU A 27 -3.957 -1.103 12.637 1.00 10.00 C ATOM 419 CD1 LEU A 27 -2.478 -0.969 12.258 1.00 10.00 C ATOM 420 CD2 LEU A 27 -4.604 0.283 12.566 1.00 10.00 C ATOM 0 H LEU A 27 -3.292 -2.905 9.935 1.00 10.00 H new ATOM 0 HA LEU A 27 -3.581 -3.676 12.642 1.00 10.00 H new ATOM 0 HB2 LEU A 27 -4.792 -1.708 10.740 1.00 10.00 H new ATOM 0 HB3 LEU A 27 -5.785 -2.129 12.121 1.00 10.00 H new ATOM 0 HG LEU A 27 -3.985 -1.517 13.645 1.00 10.00 H new ATOM 0 HD11 LEU A 27 -1.994 -0.256 12.926 1.00 10.00 H new ATOM 0 HD12 LEU A 27 -1.990 -1.939 12.348 1.00 10.00 H new ATOM 0 HD13 LEU A 27 -2.396 -0.616 11.230 1.00 10.00 H new ATOM 0 HD21 LEU A 27 -4.039 0.980 13.185 1.00 10.00 H new ATOM 0 HD22 LEU A 27 -4.604 0.632 11.533 1.00 10.00 H new ATOM 0 HD23 LEU A 27 -5.630 0.225 12.929 1.00 10.00 H new ATOM 432 N LYS A 28 -5.576 -5.293 10.710 1.00 10.00 N ATOM 433 CA LYS A 28 -6.496 -6.443 10.650 1.00 10.00 C ATOM 434 C LYS A 28 -5.753 -7.788 10.773 1.00 10.00 C ATOM 435 O LYS A 28 -6.380 -8.844 10.639 1.00 10.00 O ATOM 436 CB LYS A 28 -7.338 -6.366 9.359 1.00 10.00 C ATOM 437 CG LYS A 28 -8.180 -5.078 9.232 1.00 10.00 C ATOM 438 CD LYS A 28 -9.509 -5.067 9.994 1.00 10.00 C ATOM 439 CE LYS A 28 -10.035 -3.627 10.169 1.00 10.00 C ATOM 440 NZ LYS A 28 -10.013 -2.816 8.918 1.00 10.00 N ATOM 0 H LYS A 28 -5.161 -5.074 9.804 1.00 10.00 H new ATOM 0 HA LYS A 28 -7.167 -6.392 11.507 1.00 10.00 H new ATOM 0 HB2 LYS A 28 -6.672 -6.439 8.499 1.00 10.00 H new ATOM 0 HB3 LYS A 28 -8.004 -7.228 9.320 1.00 10.00 H new ATOM 0 HG2 LYS A 28 -7.578 -4.238 9.579 1.00 10.00 H new ATOM 0 HG3 LYS A 28 -8.388 -4.906 8.176 1.00 10.00 H new ATOM 0 HD2 LYS A 28 -10.245 -5.664 9.456 1.00 10.00 H new ATOM 0 HD3 LYS A 28 -9.376 -5.530 10.972 1.00 10.00 H new ATOM 0 HE2 LYS A 28 -11.057 -3.668 10.545 1.00 10.00 H new ATOM 0 HE3 LYS A 28 -9.436 -3.122 10.927 1.00 10.00 H new ATOM 0 HZ1 LYS A 28 -10.899 -2.277 8.838 1.00 10.00 H new ATOM 0 HZ2 LYS A 28 -9.208 -2.158 8.945 1.00 10.00 H new ATOM 0 HZ3 LYS A 28 -9.917 -3.447 8.097 1.00 10.00 H new ATOM 454 N ARG A 29 -4.431 -7.772 11.008 1.00 10.00 N ATOM 455 CA ARG A 29 -3.591 -8.958 11.270 1.00 10.00 C ATOM 456 C ARG A 29 -2.798 -8.900 12.588 1.00 10.00 C ATOM 457 O ARG A 29 -2.555 -9.948 13.174 1.00 10.00 O ATOM 458 CB ARG A 29 -2.613 -9.162 10.095 1.00 10.00 C ATOM 459 CG ARG A 29 -3.138 -10.103 9.005 1.00 10.00 C ATOM 460 CD ARG A 29 -4.209 -9.486 8.100 1.00 10.00 C ATOM 461 NE ARG A 29 -4.891 -10.531 7.329 1.00 10.00 N ATOM 462 CZ ARG A 29 -5.942 -11.235 7.729 1.00 10.00 C ATOM 463 NH1 ARG A 29 -6.609 -10.970 8.834 1.00 10.00 N ATOM 464 NH2 ARG A 29 -6.342 -12.255 7.006 1.00 10.00 N ATOM 0 H ARG A 29 -3.896 -6.904 11.022 1.00 10.00 H new ATOM 0 HA ARG A 29 -4.279 -9.798 11.368 1.00 10.00 H new ATOM 0 HB2 ARG A 29 -2.390 -8.193 9.648 1.00 10.00 H new ATOM 0 HB3 ARG A 29 -1.674 -9.558 10.482 1.00 10.00 H new ATOM 0 HG2 ARG A 29 -2.300 -10.427 8.387 1.00 10.00 H new ATOM 0 HG3 ARG A 29 -3.549 -10.995 9.479 1.00 10.00 H new ATOM 0 HD2 ARG A 29 -4.933 -8.939 8.704 1.00 10.00 H new ATOM 0 HD3 ARG A 29 -3.751 -8.766 7.422 1.00 10.00 H new ATOM 0 HE ARG A 29 -4.523 -10.735 6.400 1.00 10.00 H new ATOM 0 HH11 ARG A 29 -6.323 -10.191 9.428 1.00 10.00 H new ATOM 0 HH12 ARG A 29 -7.411 -11.544 9.096 1.00 10.00 H new ATOM 0 HH21 ARG A 29 -5.846 -12.498 6.148 1.00 10.00 H new ATOM 0 HH22 ARG A 29 -7.149 -12.805 7.302 1.00 10.00 H new ATOM 478 N VAL A 30 -2.402 -7.710 13.045 1.00 10.00 N ATOM 479 CA VAL A 30 -1.491 -7.454 14.171 1.00 10.00 C ATOM 480 C VAL A 30 -1.947 -6.169 14.878 1.00 10.00 C ATOM 481 O VAL A 30 -2.322 -5.198 14.222 1.00 10.00 O ATOM 482 CB VAL A 30 -0.048 -7.278 13.646 1.00 10.00 C ATOM 483 CG1 VAL A 30 0.941 -7.095 14.798 1.00 10.00 C ATOM 484 CG2 VAL A 30 0.454 -8.469 12.815 1.00 10.00 C ATOM 0 H VAL A 30 -2.727 -6.844 12.615 1.00 10.00 H new ATOM 0 HA VAL A 30 -1.510 -8.292 14.867 1.00 10.00 H new ATOM 0 HB VAL A 30 -0.094 -6.393 13.011 1.00 10.00 H new ATOM 0 HG11 VAL A 30 1.948 -6.974 14.398 1.00 10.00 H new ATOM 0 HG12 VAL A 30 0.670 -6.210 15.373 1.00 10.00 H new ATOM 0 HG13 VAL A 30 0.911 -7.971 15.446 1.00 10.00 H new ATOM 0 HG21 VAL A 30 1.473 -8.275 12.480 1.00 10.00 H new ATOM 0 HG22 VAL A 30 0.438 -9.371 13.426 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -0.193 -8.606 11.948 1.00 10.00 H new ATOM 494 N SER A 31 -1.946 -6.144 16.215 1.00 10.00 N ATOM 495 CA SER A 31 -2.534 -5.023 16.961 1.00 10.00 C ATOM 496 C SER A 31 -1.627 -3.785 17.036 1.00 10.00 C ATOM 497 O SER A 31 -0.448 -3.852 17.379 1.00 10.00 O ATOM 498 CB SER A 31 -2.932 -5.479 18.368 1.00 10.00 C ATOM 499 OG SER A 31 -3.436 -4.392 19.128 1.00 10.00 O ATOM 0 H SER A 31 -1.549 -6.879 16.800 1.00 10.00 H new ATOM 0 HA SER A 31 -3.419 -4.714 16.404 1.00 10.00 H new ATOM 0 HB2 SER A 31 -3.687 -6.262 18.301 1.00 10.00 H new ATOM 0 HB3 SER A 31 -2.068 -5.911 18.873 1.00 10.00 H new ATOM 0 HG SER A 31 -3.686 -4.706 20.022 1.00 10.00 H new ATOM 505 N ALA A 32 -2.220 -2.607 16.831 1.00 10.00 N ATOM 506 CA ALA A 32 -1.599 -1.312 17.116 1.00 10.00 C ATOM 507 C ALA A 32 -1.013 -1.225 18.545 1.00 10.00 C ATOM 508 O ALA A 32 -0.119 -0.421 18.781 1.00 10.00 O ATOM 509 CB ALA A 32 -2.623 -0.203 16.854 1.00 10.00 C ATOM 0 H ALA A 32 -3.164 -2.525 16.455 1.00 10.00 H new ATOM 0 HA ALA A 32 -0.746 -1.187 16.449 1.00 10.00 H new ATOM 0 HB1 ALA A 32 -2.171 0.767 17.063 1.00 10.00 H new ATOM 0 HB2 ALA A 32 -2.939 -0.239 15.811 1.00 10.00 H new ATOM 0 HB3 ALA A 32 -3.489 -0.347 17.501 1.00 10.00 H new ATOM 515 N LYS A 33 -1.525 -2.026 19.499 1.00 10.00 N ATOM 516 CA LYS A 33 -1.053 -2.084 20.896 1.00 10.00 C ATOM 517 C LYS A 33 0.107 -3.066 21.161 1.00 10.00 C ATOM 518 O LYS A 33 0.612 -3.095 22.280 1.00 10.00 O ATOM 519 CB LYS A 33 -2.239 -2.383 21.828 1.00 10.00 C ATOM 520 CG LYS A 33 -3.361 -1.346 21.668 1.00 10.00 C ATOM 521 CD LYS A 33 -4.455 -1.535 22.723 1.00 10.00 C ATOM 522 CE LYS A 33 -5.529 -0.458 22.539 1.00 10.00 C ATOM 523 NZ LYS A 33 -6.604 -0.584 23.551 1.00 10.00 N ATOM 0 H LYS A 33 -2.297 -2.666 19.315 1.00 10.00 H new ATOM 0 HA LYS A 33 -0.632 -1.101 21.106 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -2.629 -3.378 21.613 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -1.896 -2.392 22.863 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -2.944 -0.342 21.750 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -3.796 -1.430 20.672 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -4.898 -2.526 22.630 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -4.027 -1.470 23.723 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -5.072 0.529 22.613 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -5.957 -0.537 21.540 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -7.314 0.160 23.398 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -7.055 -1.517 23.464 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -6.198 -0.484 24.503 1.00 10.00 H new ATOM 537 N GLU A 34 0.546 -3.838 20.161 1.00 10.00 N ATOM 538 CA GLU A 34 1.776 -4.661 20.208 1.00 10.00 C ATOM 539 C GLU A 34 2.810 -4.218 19.156 1.00 10.00 C ATOM 540 O GLU A 34 3.970 -4.621 19.204 1.00 10.00 O ATOM 541 CB GLU A 34 1.441 -6.156 20.054 1.00 10.00 C ATOM 542 CG GLU A 34 0.839 -6.462 18.673 1.00 10.00 C ATOM 543 CD GLU A 34 0.384 -7.905 18.473 1.00 10.00 C ATOM 544 OE1 GLU A 34 1.077 -8.815 18.987 1.00 10.00 O ATOM 545 OE2 GLU A 34 -0.657 -8.064 17.788 1.00 10.00 O ATOM 0 H GLU A 34 0.050 -3.915 19.273 1.00 10.00 H new ATOM 0 HA GLU A 34 2.229 -4.508 21.187 1.00 10.00 H new ATOM 0 HB2 GLU A 34 2.345 -6.748 20.197 1.00 10.00 H new ATOM 0 HB3 GLU A 34 0.738 -6.454 20.832 1.00 10.00 H new ATOM 0 HG2 GLU A 34 -0.013 -5.802 18.511 1.00 10.00 H new ATOM 0 HG3 GLU A 34 1.579 -6.221 17.909 1.00 10.00 H new ATOM 552 N ILE A 35 2.391 -3.370 18.214 1.00 10.00 N ATOM 553 CA ILE A 35 3.241 -2.666 17.263 1.00 10.00 C ATOM 554 C ILE A 35 3.905 -1.469 17.956 1.00 10.00 C ATOM 555 O ILE A 35 3.239 -0.632 18.561 1.00 10.00 O ATOM 556 CB ILE A 35 2.367 -2.247 16.058 1.00 10.00 C ATOM 557 CG1 ILE A 35 2.056 -3.519 15.241 1.00 10.00 C ATOM 558 CG2 ILE A 35 3.020 -1.181 15.167 1.00 10.00 C ATOM 559 CD1 ILE A 35 1.059 -3.316 14.096 1.00 10.00 C ATOM 0 H ILE A 35 1.403 -3.148 18.091 1.00 10.00 H new ATOM 0 HA ILE A 35 4.045 -3.304 16.897 1.00 10.00 H new ATOM 0 HB ILE A 35 1.457 -1.785 16.439 1.00 10.00 H new ATOM 0 HG12 ILE A 35 2.988 -3.907 14.829 1.00 10.00 H new ATOM 0 HG13 ILE A 35 1.664 -4.281 15.915 1.00 10.00 H new ATOM 0 HG21 ILE A 35 2.350 -0.936 14.343 1.00 10.00 H new ATOM 0 HG22 ILE A 35 3.214 -0.284 15.755 1.00 10.00 H new ATOM 0 HG23 ILE A 35 3.960 -1.565 14.770 1.00 10.00 H new ATOM 0 HD11 ILE A 35 0.902 -4.262 13.578 1.00 10.00 H new ATOM 0 HD12 ILE A 35 0.110 -2.960 14.498 1.00 10.00 H new ATOM 0 HD13 ILE A 35 1.454 -2.581 13.395 1.00 10.00 H new ATOM 571 N VAL A 36 5.231 -1.389 17.834 1.00 10.00 N ATOM 572 CA VAL A 36 6.035 -0.218 18.186 1.00 10.00 C ATOM 573 C VAL A 36 5.839 0.847 17.105 1.00 10.00 C ATOM 574 O VAL A 36 5.492 1.978 17.436 1.00 10.00 O ATOM 575 CB VAL A 36 7.521 -0.619 18.322 1.00 10.00 C ATOM 576 CG1 VAL A 36 8.467 0.588 18.348 1.00 10.00 C ATOM 577 CG2 VAL A 36 7.732 -1.435 19.603 1.00 10.00 C ATOM 0 H VAL A 36 5.792 -2.162 17.476 1.00 10.00 H new ATOM 0 HA VAL A 36 5.717 0.189 19.146 1.00 10.00 H new ATOM 0 HB VAL A 36 7.760 -1.213 17.440 1.00 10.00 H new ATOM 0 HG11 VAL A 36 9.496 0.242 18.445 1.00 10.00 H new ATOM 0 HG12 VAL A 36 8.360 1.154 17.423 1.00 10.00 H new ATOM 0 HG13 VAL A 36 8.218 1.227 19.195 1.00 10.00 H new ATOM 0 HG21 VAL A 36 8.783 -1.712 19.689 1.00 10.00 H new ATOM 0 HG22 VAL A 36 7.443 -0.837 20.467 1.00 10.00 H new ATOM 0 HG23 VAL A 36 7.121 -2.337 19.565 1.00 10.00 H new ATOM 587 N ASP A 37 6.008 0.477 15.826 1.00 10.00 N ATOM 588 CA ASP A 37 5.653 1.325 14.679 1.00 10.00 C ATOM 589 C ASP A 37 5.557 0.538 13.350 1.00 10.00 C ATOM 590 O ASP A 37 5.864 -0.657 13.281 1.00 10.00 O ATOM 591 CB ASP A 37 6.655 2.499 14.544 1.00 10.00 C ATOM 592 CG ASP A 37 5.961 3.809 14.139 1.00 10.00 C ATOM 593 OD1 ASP A 37 4.929 3.719 13.433 1.00 10.00 O ATOM 594 OD2 ASP A 37 6.455 4.880 14.556 1.00 10.00 O ATOM 0 H ASP A 37 6.398 -0.426 15.557 1.00 10.00 H new ATOM 0 HA ASP A 37 4.657 1.720 14.879 1.00 10.00 H new ATOM 0 HB2 ASP A 37 7.174 2.642 15.492 1.00 10.00 H new ATOM 0 HB3 ASP A 37 7.411 2.246 13.801 1.00 10.00 H new ATOM 599 N ILE A 38 5.167 1.237 12.279 1.00 10.00 N ATOM 600 CA ILE A 38 5.205 0.765 10.890 1.00 10.00 C ATOM 601 C ILE A 38 5.851 1.824 9.995 1.00 10.00 C ATOM 602 O ILE A 38 5.594 3.018 10.131 1.00 10.00 O ATOM 603 CB ILE A 38 3.805 0.386 10.342 1.00 10.00 C ATOM 604 CG1 ILE A 38 2.718 1.458 10.599 1.00 10.00 C ATOM 605 CG2 ILE A 38 3.392 -0.989 10.879 1.00 10.00 C ATOM 606 CD1 ILE A 38 1.358 1.143 9.960 1.00 10.00 C ATOM 0 H ILE A 38 4.801 2.186 12.359 1.00 10.00 H new ATOM 0 HA ILE A 38 5.804 -0.145 10.881 1.00 10.00 H new ATOM 0 HB ILE A 38 3.891 0.336 9.257 1.00 10.00 H new ATOM 0 HG12 ILE A 38 2.583 1.572 11.675 1.00 10.00 H new ATOM 0 HG13 ILE A 38 3.072 2.416 10.219 1.00 10.00 H new ATOM 0 HG21 ILE A 38 2.408 -1.250 10.491 1.00 10.00 H new ATOM 0 HG22 ILE A 38 4.118 -1.737 10.561 1.00 10.00 H new ATOM 0 HG23 ILE A 38 3.356 -0.959 11.968 1.00 10.00 H new ATOM 0 HD11 ILE A 38 0.655 1.944 10.188 1.00 10.00 H new ATOM 0 HD12 ILE A 38 1.474 1.059 8.879 1.00 10.00 H new ATOM 0 HD13 ILE A 38 0.978 0.202 10.358 1.00 10.00 H new ATOM 618 N ASP A 39 6.635 1.363 9.021 1.00 10.00 N ATOM 619 CA ASP A 39 7.336 2.213 8.063 1.00 10.00 C ATOM 620 C ASP A 39 6.900 1.800 6.660 1.00 10.00 C ATOM 621 O ASP A 39 7.185 0.688 6.218 1.00 10.00 O ATOM 622 CB ASP A 39 8.855 2.092 8.249 1.00 10.00 C ATOM 623 CG ASP A 39 9.342 2.859 9.478 1.00 10.00 C ATOM 624 OD1 ASP A 39 9.565 4.081 9.323 1.00 10.00 O ATOM 625 OD2 ASP A 39 9.498 2.215 10.539 1.00 10.00 O ATOM 0 H ASP A 39 6.803 0.368 8.874 1.00 10.00 H new ATOM 0 HA ASP A 39 7.084 3.261 8.223 1.00 10.00 H new ATOM 0 HB2 ASP A 39 9.126 1.041 8.346 1.00 10.00 H new ATOM 0 HB3 ASP A 39 9.361 2.471 7.361 1.00 10.00 H new ATOM 630 N ILE A 40 6.168 2.682 5.971 1.00 10.00 N ATOM 631 CA ILE A 40 5.595 2.413 4.650 1.00 10.00 C ATOM 632 C ILE A 40 5.968 3.557 3.711 1.00 10.00 C ATOM 633 O ILE A 40 5.585 4.707 3.919 1.00 10.00 O ATOM 634 CB ILE A 40 4.069 2.173 4.732 1.00 10.00 C ATOM 635 CG1 ILE A 40 3.790 0.825 5.434 1.00 10.00 C ATOM 636 CG2 ILE A 40 3.444 2.142 3.320 1.00 10.00 C ATOM 637 CD1 ILE A 40 2.353 0.639 5.917 1.00 10.00 C ATOM 0 H ILE A 40 5.955 3.616 6.321 1.00 10.00 H new ATOM 0 HA ILE A 40 6.011 1.490 4.247 1.00 10.00 H new ATOM 0 HB ILE A 40 3.624 2.990 5.300 1.00 10.00 H new ATOM 0 HG12 ILE A 40 4.035 0.016 4.746 1.00 10.00 H new ATOM 0 HG13 ILE A 40 4.460 0.731 6.288 1.00 10.00 H new ATOM 0 HG21 ILE A 40 2.370 1.972 3.401 1.00 10.00 H new ATOM 0 HG22 ILE A 40 3.624 3.094 2.821 1.00 10.00 H new ATOM 0 HG23 ILE A 40 3.896 1.338 2.740 1.00 10.00 H new ATOM 0 HD11 ILE A 40 2.253 -0.335 6.396 1.00 10.00 H new ATOM 0 HD12 ILE A 40 2.106 1.423 6.633 1.00 10.00 H new ATOM 0 HD13 ILE A 40 1.673 0.696 5.067 1.00 10.00 H new ATOM 649 N THR A 41 6.693 3.199 2.652 1.00 10.00 N ATOM 650 CA THR A 41 7.129 4.096 1.588 1.00 10.00 C ATOM 651 C THR A 41 6.537 3.588 0.278 1.00 10.00 C ATOM 652 O THR A 41 6.827 2.478 -0.172 1.00 10.00 O ATOM 653 CB THR A 41 8.665 4.143 1.549 1.00 10.00 C ATOM 654 OG1 THR A 41 9.139 4.772 2.717 1.00 10.00 O ATOM 655 CG2 THR A 41 9.213 4.939 0.366 1.00 10.00 C ATOM 0 H THR A 41 7.004 2.238 2.508 1.00 10.00 H new ATOM 0 HA THR A 41 6.783 5.115 1.760 1.00 10.00 H new ATOM 0 HB THR A 41 9.000 3.110 1.461 1.00 10.00 H new ATOM 0 HG1 THR A 41 10.118 4.803 2.698 1.00 10.00 H new ATOM 0 HG21 THR A 41 10.303 4.933 0.397 1.00 10.00 H new ATOM 0 HG22 THR A 41 8.874 4.486 -0.566 1.00 10.00 H new ATOM 0 HG23 THR A 41 8.854 5.967 0.421 1.00 10.00 H new ATOM 663 N VAL A 42 5.696 4.424 -0.328 1.00 10.00 N ATOM 664 CA VAL A 42 5.017 4.196 -1.599 1.00 10.00 C ATOM 665 C VAL A 42 5.507 5.229 -2.613 1.00 10.00 C ATOM 666 O VAL A 42 5.339 6.428 -2.401 1.00 10.00 O ATOM 667 CB VAL A 42 3.488 4.241 -1.401 1.00 10.00 C ATOM 668 CG1 VAL A 42 2.987 2.877 -0.912 1.00 10.00 C ATOM 669 CG2 VAL A 42 3.000 5.311 -0.408 1.00 10.00 C ATOM 0 H VAL A 42 5.458 5.329 0.079 1.00 10.00 H new ATOM 0 HA VAL A 42 5.253 3.205 -1.986 1.00 10.00 H new ATOM 0 HB VAL A 42 3.082 4.502 -2.378 1.00 10.00 H new ATOM 0 HG11 VAL A 42 1.906 2.914 -0.774 1.00 10.00 H new ATOM 0 HG12 VAL A 42 3.232 2.113 -1.650 1.00 10.00 H new ATOM 0 HG13 VAL A 42 3.466 2.632 0.036 1.00 10.00 H new ATOM 0 HG21 VAL A 42 1.913 5.269 -0.333 1.00 10.00 H new ATOM 0 HG22 VAL A 42 3.439 5.125 0.572 1.00 10.00 H new ATOM 0 HG23 VAL A 42 3.301 6.298 -0.759 1.00 10.00 H new ATOM 679 N LEU A 43 6.119 4.766 -3.705 1.00 10.00 N ATOM 680 CA LEU A 43 6.653 5.608 -4.778 1.00 10.00 C ATOM 681 C LEU A 43 5.921 5.292 -6.081 1.00 10.00 C ATOM 682 O LEU A 43 5.652 4.134 -6.387 1.00 10.00 O ATOM 683 CB LEU A 43 8.177 5.392 -4.920 1.00 10.00 C ATOM 684 CG LEU A 43 9.028 6.558 -4.381 1.00 10.00 C ATOM 685 CD1 LEU A 43 8.863 6.772 -2.875 1.00 10.00 C ATOM 686 CD2 LEU A 43 10.509 6.292 -4.666 1.00 10.00 C ATOM 0 H LEU A 43 6.261 3.770 -3.872 1.00 10.00 H new ATOM 0 HA LEU A 43 6.491 6.658 -4.536 1.00 10.00 H new ATOM 0 HB2 LEU A 43 8.455 4.479 -4.393 1.00 10.00 H new ATOM 0 HB3 LEU A 43 8.415 5.238 -5.972 1.00 10.00 H new ATOM 0 HG LEU A 43 8.679 7.456 -4.890 1.00 10.00 H new ATOM 0 HD11 LEU A 43 9.487 7.606 -2.556 1.00 10.00 H new ATOM 0 HD12 LEU A 43 7.819 6.993 -2.651 1.00 10.00 H new ATOM 0 HD13 LEU A 43 9.165 5.869 -2.344 1.00 10.00 H new ATOM 0 HD21 LEU A 43 11.107 7.119 -4.283 1.00 10.00 H new ATOM 0 HD22 LEU A 43 10.813 5.367 -4.176 1.00 10.00 H new ATOM 0 HD23 LEU A 43 10.662 6.201 -5.741 1.00 10.00 H new ATOM 698 N VAL A 44 5.598 6.323 -6.860 1.00 10.00 N ATOM 699 CA VAL A 44 5.005 6.169 -8.190 1.00 10.00 C ATOM 700 C VAL A 44 5.622 7.190 -9.147 1.00 10.00 C ATOM 701 O VAL A 44 5.853 8.338 -8.770 1.00 10.00 O ATOM 702 CB VAL A 44 3.464 6.225 -8.094 1.00 10.00 C ATOM 703 CG1 VAL A 44 2.935 7.562 -7.566 1.00 10.00 C ATOM 704 CG2 VAL A 44 2.807 5.891 -9.438 1.00 10.00 C ATOM 0 H VAL A 44 5.741 7.295 -6.586 1.00 10.00 H new ATOM 0 HA VAL A 44 5.234 5.189 -8.608 1.00 10.00 H new ATOM 0 HB VAL A 44 3.189 5.464 -7.363 1.00 10.00 H new ATOM 0 HG11 VAL A 44 1.846 7.532 -7.524 1.00 10.00 H new ATOM 0 HG12 VAL A 44 3.331 7.741 -6.567 1.00 10.00 H new ATOM 0 HG13 VAL A 44 3.250 8.366 -8.231 1.00 10.00 H new ATOM 0 HG21 VAL A 44 1.723 5.940 -9.335 1.00 10.00 H new ATOM 0 HG22 VAL A 44 3.133 6.609 -10.191 1.00 10.00 H new ATOM 0 HG23 VAL A 44 3.098 4.886 -9.745 1.00 10.00 H new ATOM 714 N GLU A 45 5.897 6.769 -10.381 1.00 10.00 N ATOM 715 CA GLU A 45 6.485 7.599 -11.431 1.00 10.00 C ATOM 716 C GLU A 45 5.935 7.217 -12.808 1.00 10.00 C ATOM 717 O GLU A 45 5.449 6.103 -13.018 1.00 10.00 O ATOM 718 CB GLU A 45 8.025 7.516 -11.428 1.00 10.00 C ATOM 719 CG GLU A 45 8.601 6.155 -11.866 1.00 10.00 C ATOM 720 CD GLU A 45 10.077 6.262 -12.264 1.00 10.00 C ATOM 721 OE1 GLU A 45 10.350 6.991 -13.252 1.00 10.00 O ATOM 722 OE2 GLU A 45 10.907 5.604 -11.598 1.00 10.00 O ATOM 0 H GLU A 45 5.711 5.814 -10.686 1.00 10.00 H new ATOM 0 HA GLU A 45 6.204 8.631 -11.219 1.00 10.00 H new ATOM 0 HB2 GLU A 45 8.418 8.290 -12.088 1.00 10.00 H new ATOM 0 HB3 GLU A 45 8.385 7.740 -10.424 1.00 10.00 H new ATOM 0 HG2 GLU A 45 8.495 5.437 -11.053 1.00 10.00 H new ATOM 0 HG3 GLU A 45 8.025 5.771 -12.708 1.00 10.00 H new ATOM 729 N TYR A 46 6.060 8.133 -13.769 1.00 10.00 N ATOM 730 CA TYR A 46 5.771 7.833 -15.163 1.00 10.00 C ATOM 731 C TYR A 46 6.828 8.550 -16.006 1.00 10.00 C ATOM 732 O TYR A 46 6.743 9.754 -16.245 1.00 10.00 O ATOM 733 CB TYR A 46 4.317 8.226 -15.475 1.00 10.00 C ATOM 734 CG TYR A 46 3.667 7.584 -16.693 1.00 10.00 C ATOM 735 CD1 TYR A 46 4.410 7.136 -17.807 1.00 10.00 C ATOM 736 CD2 TYR A 46 2.270 7.397 -16.671 1.00 10.00 C ATOM 737 CE1 TYR A 46 3.761 6.503 -18.884 1.00 10.00 C ATOM 738 CE2 TYR A 46 1.616 6.766 -17.745 1.00 10.00 C ATOM 739 CZ TYR A 46 2.362 6.315 -18.854 1.00 10.00 C ATOM 740 OH TYR A 46 1.734 5.696 -19.889 1.00 10.00 O ATOM 0 H TYR A 46 6.362 9.093 -13.601 1.00 10.00 H new ATOM 0 HA TYR A 46 5.835 6.770 -15.397 1.00 10.00 H new ATOM 0 HB2 TYR A 46 3.708 7.988 -14.603 1.00 10.00 H new ATOM 0 HB3 TYR A 46 4.280 9.308 -15.604 1.00 10.00 H new ATOM 0 HD1 TYR A 46 5.480 7.279 -17.833 1.00 10.00 H new ATOM 0 HD2 TYR A 46 1.697 7.741 -15.823 1.00 10.00 H new ATOM 0 HE1 TYR A 46 4.333 6.161 -19.734 1.00 10.00 H new ATOM 0 HE2 TYR A 46 0.545 6.627 -17.720 1.00 10.00 H new ATOM 0 HH TYR A 46 0.772 5.648 -19.707 1.00 10.00 H new ATOM 750 N THR A 47 7.839 7.791 -16.433 1.00 10.00 N ATOM 751 CA THR A 47 9.043 8.298 -17.104 1.00 10.00 C ATOM 752 C THR A 47 9.160 7.504 -18.401 1.00 10.00 C ATOM 753 O THR A 47 9.886 6.516 -18.475 1.00 10.00 O ATOM 754 CB THR A 47 10.278 8.129 -16.190 1.00 10.00 C ATOM 755 OG1 THR A 47 10.044 8.696 -14.918 1.00 10.00 O ATOM 756 CG2 THR A 47 11.509 8.828 -16.769 1.00 10.00 C ATOM 0 H THR A 47 7.845 6.777 -16.319 1.00 10.00 H new ATOM 0 HA THR A 47 8.982 9.365 -17.320 1.00 10.00 H new ATOM 0 HB THR A 47 10.455 7.056 -16.113 1.00 10.00 H new ATOM 0 HG1 THR A 47 9.847 7.984 -14.274 1.00 10.00 H new ATOM 0 HG21 THR A 47 12.357 8.687 -16.098 1.00 10.00 H new ATOM 0 HG22 THR A 47 11.744 8.403 -17.745 1.00 10.00 H new ATOM 0 HG23 THR A 47 11.305 9.893 -16.877 1.00 10.00 H new ATOM 764 N ASP A 48 8.378 7.925 -19.406 1.00 10.00 N ATOM 765 CA ASP A 48 8.057 7.206 -20.657 1.00 10.00 C ATOM 766 C ASP A 48 7.317 5.863 -20.426 1.00 10.00 C ATOM 767 O ASP A 48 6.354 5.552 -21.125 1.00 10.00 O ATOM 768 CB ASP A 48 9.302 7.072 -21.552 1.00 10.00 C ATOM 769 CG ASP A 48 8.928 6.804 -23.012 1.00 10.00 C ATOM 770 OD1 ASP A 48 8.250 7.683 -23.592 1.00 10.00 O ATOM 771 OD2 ASP A 48 9.346 5.748 -23.537 1.00 10.00 O ATOM 0 H ASP A 48 7.921 8.836 -19.368 1.00 10.00 H new ATOM 0 HA ASP A 48 7.337 7.818 -21.200 1.00 10.00 H new ATOM 0 HB2 ASP A 48 9.894 7.985 -21.490 1.00 10.00 H new ATOM 0 HB3 ASP A 48 9.929 6.260 -21.183 1.00 10.00 H new ATOM 776 N GLU A 49 7.670 5.140 -19.360 1.00 10.00 N ATOM 777 CA GLU A 49 6.996 3.966 -18.809 1.00 10.00 C ATOM 778 C GLU A 49 6.452 4.294 -17.402 1.00 10.00 C ATOM 779 O GLU A 49 7.039 5.089 -16.663 1.00 10.00 O ATOM 780 CB GLU A 49 8.007 2.804 -18.783 1.00 10.00 C ATOM 781 CG GLU A 49 7.419 1.492 -18.249 1.00 10.00 C ATOM 782 CD GLU A 49 8.404 0.330 -18.427 1.00 10.00 C ATOM 783 OE1 GLU A 49 9.329 0.220 -17.590 1.00 10.00 O ATOM 784 OE2 GLU A 49 8.221 -0.435 -19.401 1.00 10.00 O ATOM 0 H GLU A 49 8.500 5.381 -18.819 1.00 10.00 H new ATOM 0 HA GLU A 49 6.144 3.675 -19.423 1.00 10.00 H new ATOM 0 HB2 GLU A 49 8.385 2.639 -19.792 1.00 10.00 H new ATOM 0 HB3 GLU A 49 8.859 3.088 -18.166 1.00 10.00 H new ATOM 0 HG2 GLU A 49 7.172 1.604 -17.193 1.00 10.00 H new ATOM 0 HG3 GLU A 49 6.489 1.268 -18.772 1.00 10.00 H new ATOM 791 N LEU A 50 5.315 3.688 -17.042 1.00 10.00 N ATOM 792 CA LEU A 50 4.665 3.817 -15.736 1.00 10.00 C ATOM 793 C LEU A 50 5.275 2.810 -14.751 1.00 10.00 C ATOM 794 O LEU A 50 5.299 1.614 -15.040 1.00 10.00 O ATOM 795 CB LEU A 50 3.154 3.558 -15.919 1.00 10.00 C ATOM 796 CG LEU A 50 2.329 3.387 -14.623 1.00 10.00 C ATOM 797 CD1 LEU A 50 2.345 4.620 -13.716 1.00 10.00 C ATOM 798 CD2 LEU A 50 0.872 3.079 -14.977 1.00 10.00 C ATOM 0 H LEU A 50 4.805 3.073 -17.676 1.00 10.00 H new ATOM 0 HA LEU A 50 4.816 4.818 -15.331 1.00 10.00 H new ATOM 0 HB2 LEU A 50 2.731 4.386 -16.488 1.00 10.00 H new ATOM 0 HB3 LEU A 50 3.031 2.660 -16.524 1.00 10.00 H new ATOM 0 HG LEU A 50 2.796 2.568 -14.076 1.00 10.00 H new ATOM 0 HD11 LEU A 50 1.745 4.425 -12.827 1.00 10.00 H new ATOM 0 HD12 LEU A 50 3.371 4.841 -13.421 1.00 10.00 H new ATOM 0 HD13 LEU A 50 1.931 5.473 -14.254 1.00 10.00 H new ATOM 0 HD21 LEU A 50 0.293 2.959 -14.062 1.00 10.00 H new ATOM 0 HD22 LEU A 50 0.459 3.900 -15.563 1.00 10.00 H new ATOM 0 HD23 LEU A 50 0.826 2.159 -15.559 1.00 10.00 H new ATOM 810 N LYS A 51 5.687 3.281 -13.568 1.00 10.00 N ATOM 811 CA LYS A 51 6.117 2.417 -12.463 1.00 10.00 C ATOM 812 C LYS A 51 5.485 2.862 -11.140 1.00 10.00 C ATOM 813 O LYS A 51 5.364 4.049 -10.852 1.00 10.00 O ATOM 814 CB LYS A 51 7.662 2.374 -12.402 1.00 10.00 C ATOM 815 CG LYS A 51 8.147 1.640 -11.143 1.00 10.00 C ATOM 816 CD LYS A 51 9.659 1.427 -11.018 1.00 10.00 C ATOM 817 CE LYS A 51 9.827 0.891 -9.593 1.00 10.00 C ATOM 818 NZ LYS A 51 11.214 0.584 -9.194 1.00 10.00 N ATOM 0 H LYS A 51 5.732 4.276 -13.350 1.00 10.00 H new ATOM 0 HA LYS A 51 5.767 1.400 -12.642 1.00 10.00 H new ATOM 0 HB2 LYS A 51 8.050 1.875 -13.290 1.00 10.00 H new ATOM 0 HB3 LYS A 51 8.057 3.390 -12.409 1.00 10.00 H new ATOM 0 HG2 LYS A 51 7.807 2.198 -10.270 1.00 10.00 H new ATOM 0 HG3 LYS A 51 7.661 0.665 -11.107 1.00 10.00 H new ATOM 0 HD2 LYS A 51 10.027 0.718 -11.760 1.00 10.00 H new ATOM 0 HD3 LYS A 51 10.209 2.357 -11.165 1.00 10.00 H new ATOM 0 HE2 LYS A 51 9.420 1.624 -8.896 1.00 10.00 H new ATOM 0 HE3 LYS A 51 9.228 -0.014 -9.490 1.00 10.00 H new ATOM 0 HZ1 LYS A 51 11.227 0.261 -8.206 1.00 10.00 H new ATOM 0 HZ2 LYS A 51 11.594 -0.164 -9.808 1.00 10.00 H new ATOM 0 HZ3 LYS A 51 11.799 1.439 -9.287 1.00 10.00 H new ATOM 832 N VAL A 52 5.160 1.875 -10.303 1.00 10.00 N ATOM 833 CA VAL A 52 4.770 2.028 -8.900 1.00 10.00 C ATOM 834 C VAL A 52 5.602 1.033 -8.087 1.00 10.00 C ATOM 835 O VAL A 52 5.868 -0.079 -8.545 1.00 10.00 O ATOM 836 CB VAL A 52 3.243 1.869 -8.709 1.00 10.00 C ATOM 837 CG1 VAL A 52 2.668 0.578 -9.308 1.00 10.00 C ATOM 838 CG2 VAL A 52 2.829 1.963 -7.233 1.00 10.00 C ATOM 0 H VAL A 52 5.162 0.899 -10.600 1.00 10.00 H new ATOM 0 HA VAL A 52 4.978 3.037 -8.543 1.00 10.00 H new ATOM 0 HB VAL A 52 2.819 2.707 -9.262 1.00 10.00 H new ATOM 0 HG11 VAL A 52 1.593 0.542 -9.132 1.00 10.00 H new ATOM 0 HG12 VAL A 52 2.861 0.557 -10.381 1.00 10.00 H new ATOM 0 HG13 VAL A 52 3.141 -0.284 -8.837 1.00 10.00 H new ATOM 0 HG21 VAL A 52 1.749 1.846 -7.150 1.00 10.00 H new ATOM 0 HG22 VAL A 52 3.324 1.175 -6.665 1.00 10.00 H new ATOM 0 HG23 VAL A 52 3.120 2.935 -6.835 1.00 10.00 H new ATOM 848 N ASP A 53 6.050 1.454 -6.906 1.00 10.00 N ATOM 849 CA ASP A 53 6.938 0.700 -6.031 1.00 10.00 C ATOM 850 C ASP A 53 6.513 0.877 -4.574 1.00 10.00 C ATOM 851 O ASP A 53 6.075 1.954 -4.157 1.00 10.00 O ATOM 852 CB ASP A 53 8.395 1.148 -6.232 1.00 10.00 C ATOM 853 CG ASP A 53 9.384 -0.006 -6.037 1.00 10.00 C ATOM 854 OD1 ASP A 53 9.047 -0.929 -5.263 1.00 10.00 O ATOM 855 OD2 ASP A 53 10.444 0.036 -6.710 1.00 10.00 O ATOM 0 H ASP A 53 5.794 2.363 -6.520 1.00 10.00 H new ATOM 0 HA ASP A 53 6.869 -0.358 -6.285 1.00 10.00 H new ATOM 0 HB2 ASP A 53 8.512 1.560 -7.234 1.00 10.00 H new ATOM 0 HB3 ASP A 53 8.628 1.948 -5.529 1.00 10.00 H new ATOM 860 N ILE A 54 6.590 -0.219 -3.822 1.00 10.00 N ATOM 861 CA ILE A 54 6.041 -0.320 -2.474 1.00 10.00 C ATOM 862 C ILE A 54 7.099 -0.935 -1.559 1.00 10.00 C ATOM 863 O ILE A 54 7.656 -1.989 -1.857 1.00 10.00 O ATOM 864 CB ILE A 54 4.715 -1.118 -2.481 1.00 10.00 C ATOM 865 CG1 ILE A 54 3.717 -0.584 -3.540 1.00 10.00 C ATOM 866 CG2 ILE A 54 4.075 -1.059 -1.086 1.00 10.00 C ATOM 867 CD1 ILE A 54 2.321 -1.220 -3.505 1.00 10.00 C ATOM 0 H ILE A 54 7.044 -1.076 -4.139 1.00 10.00 H new ATOM 0 HA ILE A 54 5.794 0.670 -2.090 1.00 10.00 H new ATOM 0 HB ILE A 54 4.949 -2.149 -2.745 1.00 10.00 H new ATOM 0 HG12 ILE A 54 3.611 0.492 -3.405 1.00 10.00 H new ATOM 0 HG13 ILE A 54 4.145 -0.741 -4.530 1.00 10.00 H new ATOM 0 HG21 ILE A 54 3.141 -1.621 -1.090 1.00 10.00 H new ATOM 0 HG22 ILE A 54 4.756 -1.493 -0.354 1.00 10.00 H new ATOM 0 HG23 ILE A 54 3.873 -0.021 -0.822 1.00 10.00 H new ATOM 0 HD11 ILE A 54 1.700 -0.778 -4.284 1.00 10.00 H new ATOM 0 HD12 ILE A 54 2.406 -2.293 -3.674 1.00 10.00 H new ATOM 0 HD13 ILE A 54 1.864 -1.041 -2.532 1.00 10.00 H new ATOM 879 N SER A 55 7.367 -0.294 -0.424 1.00 10.00 N ATOM 880 CA SER A 55 8.188 -0.848 0.652 1.00 10.00 C ATOM 881 C SER A 55 7.453 -0.664 1.973 1.00 10.00 C ATOM 882 O SER A 55 7.110 0.462 2.326 1.00 10.00 O ATOM 883 CB SER A 55 9.550 -0.152 0.665 1.00 10.00 C ATOM 884 OG SER A 55 10.263 -0.522 -0.496 1.00 10.00 O ATOM 0 H SER A 55 7.014 0.641 -0.222 1.00 10.00 H new ATOM 0 HA SER A 55 8.359 -1.913 0.496 1.00 10.00 H new ATOM 0 HB2 SER A 55 9.420 0.930 0.699 1.00 10.00 H new ATOM 0 HB3 SER A 55 10.109 -0.434 1.557 1.00 10.00 H new ATOM 0 HG SER A 55 11.137 -0.079 -0.498 1.00 10.00 H new ATOM 890 N ALA A 56 7.203 -1.760 2.692 1.00 10.00 N ATOM 891 CA ALA A 56 6.551 -1.743 3.997 1.00 10.00 C ATOM 892 C ALA A 56 7.349 -2.582 4.996 1.00 10.00 C ATOM 893 O ALA A 56 7.804 -3.679 4.673 1.00 10.00 O ATOM 894 CB ALA A 56 5.116 -2.258 3.861 1.00 10.00 C ATOM 0 H ALA A 56 7.453 -2.697 2.377 1.00 10.00 H new ATOM 0 HA ALA A 56 6.515 -0.721 4.373 1.00 10.00 H new ATOM 0 HB1 ALA A 56 4.631 -2.245 4.837 1.00 10.00 H new ATOM 0 HB2 ALA A 56 4.564 -1.619 3.172 1.00 10.00 H new ATOM 0 HB3 ALA A 56 5.130 -3.278 3.477 1.00 10.00 H new ATOM 900 N GLU A 57 7.479 -2.068 6.217 1.00 10.00 N ATOM 901 CA GLU A 57 8.244 -2.670 7.301 1.00 10.00 C ATOM 902 C GLU A 57 7.477 -2.497 8.621 1.00 10.00 C ATOM 903 O GLU A 57 6.769 -1.507 8.825 1.00 10.00 O ATOM 904 CB GLU A 57 9.640 -2.027 7.308 1.00 10.00 C ATOM 905 CG GLU A 57 10.646 -2.757 8.200 1.00 10.00 C ATOM 906 CD GLU A 57 12.057 -2.201 7.972 1.00 10.00 C ATOM 907 OE1 GLU A 57 12.401 -1.192 8.636 1.00 10.00 O ATOM 908 OE2 GLU A 57 12.786 -2.790 7.144 1.00 10.00 O ATOM 0 H GLU A 57 7.038 -1.189 6.486 1.00 10.00 H new ATOM 0 HA GLU A 57 8.376 -3.743 7.165 1.00 10.00 H new ATOM 0 HB2 GLU A 57 10.024 -2.000 6.288 1.00 10.00 H new ATOM 0 HB3 GLU A 57 9.553 -0.993 7.643 1.00 10.00 H new ATOM 0 HG2 GLU A 57 10.366 -2.641 9.247 1.00 10.00 H new ATOM 0 HG3 GLU A 57 10.628 -3.825 7.982 1.00 10.00 H new ATOM 915 N LEU A 58 7.600 -3.493 9.502 1.00 10.00 N ATOM 916 CA LEU A 58 6.783 -3.658 10.701 1.00 10.00 C ATOM 917 C LEU A 58 7.682 -3.834 11.926 1.00 10.00 C ATOM 918 O LEU A 58 8.507 -4.748 11.955 1.00 10.00 O ATOM 919 CB LEU A 58 5.882 -4.890 10.465 1.00 10.00 C ATOM 920 CG LEU A 58 5.011 -5.334 11.657 1.00 10.00 C ATOM 921 CD1 LEU A 58 3.972 -4.280 12.032 1.00 10.00 C ATOM 922 CD2 LEU A 58 4.269 -6.628 11.309 1.00 10.00 C ATOM 0 H LEU A 58 8.296 -4.231 9.394 1.00 10.00 H new ATOM 0 HA LEU A 58 6.165 -2.781 10.891 1.00 10.00 H new ATOM 0 HB2 LEU A 58 5.226 -4.678 9.621 1.00 10.00 H new ATOM 0 HB3 LEU A 58 6.516 -5.727 10.173 1.00 10.00 H new ATOM 0 HG LEU A 58 5.683 -5.484 12.502 1.00 10.00 H new ATOM 0 HD11 LEU A 58 3.381 -4.636 12.876 1.00 10.00 H new ATOM 0 HD12 LEU A 58 4.476 -3.353 12.307 1.00 10.00 H new ATOM 0 HD13 LEU A 58 3.316 -4.097 11.181 1.00 10.00 H new ATOM 0 HD21 LEU A 58 3.656 -6.935 12.156 1.00 10.00 H new ATOM 0 HD22 LEU A 58 3.631 -6.459 10.442 1.00 10.00 H new ATOM 0 HD23 LEU A 58 4.991 -7.412 11.081 1.00 10.00 H new ATOM 934 N TYR A 59 7.470 -3.010 12.957 1.00 10.00 N ATOM 935 CA TYR A 59 8.196 -3.094 14.220 1.00 10.00 C ATOM 936 C TYR A 59 7.228 -3.511 15.323 1.00 10.00 C ATOM 937 O TYR A 59 6.423 -2.710 15.792 1.00 10.00 O ATOM 938 CB TYR A 59 8.902 -1.761 14.515 1.00 10.00 C ATOM 939 CG TYR A 59 10.063 -1.494 13.578 1.00 10.00 C ATOM 940 CD1 TYR A 59 9.847 -0.865 12.335 1.00 10.00 C ATOM 941 CD2 TYR A 59 11.356 -1.930 13.930 1.00 10.00 C ATOM 942 CE1 TYR A 59 10.909 -0.718 11.424 1.00 10.00 C ATOM 943 CE2 TYR A 59 12.426 -1.762 13.032 1.00 10.00 C ATOM 944 CZ TYR A 59 12.201 -1.180 11.766 1.00 10.00 C ATOM 945 OH TYR A 59 13.229 -1.114 10.879 1.00 10.00 O ATOM 0 H TYR A 59 6.781 -2.259 12.934 1.00 10.00 H new ATOM 0 HA TYR A 59 8.978 -3.851 14.163 1.00 10.00 H new ATOM 0 HB2 TYR A 59 8.181 -0.947 14.435 1.00 10.00 H new ATOM 0 HB3 TYR A 59 9.264 -1.766 15.543 1.00 10.00 H new ATOM 0 HD1 TYR A 59 8.864 -0.495 12.082 1.00 10.00 H new ATOM 0 HD2 TYR A 59 11.526 -2.394 14.890 1.00 10.00 H new ATOM 0 HE1 TYR A 59 10.738 -0.253 10.465 1.00 10.00 H new ATOM 0 HE2 TYR A 59 13.420 -2.079 13.312 1.00 10.00 H new ATOM 0 HH TYR A 59 12.911 -0.724 10.038 1.00 10.00 H new ATOM 955 N LEU A 60 7.298 -4.786 15.711 1.00 10.00 N ATOM 956 CA LEU A 60 6.636 -5.344 16.889 1.00 10.00 C ATOM 957 C LEU A 60 7.446 -5.103 18.168 1.00 10.00 C ATOM 958 O LEU A 60 8.673 -5.023 18.130 1.00 10.00 O ATOM 959 CB LEU A 60 6.489 -6.871 16.723 1.00 10.00 C ATOM 960 CG LEU A 60 5.311 -7.310 15.843 1.00 10.00 C ATOM 961 CD1 LEU A 60 5.391 -8.818 15.583 1.00 10.00 C ATOM 962 CD2 LEU A 60 3.993 -7.005 16.561 1.00 10.00 C ATOM 0 H LEU A 60 7.836 -5.482 15.195 1.00 10.00 H new ATOM 0 HA LEU A 60 5.668 -4.851 16.975 1.00 10.00 H new ATOM 0 HB2 LEU A 60 7.411 -7.267 16.296 1.00 10.00 H new ATOM 0 HB3 LEU A 60 6.375 -7.321 17.709 1.00 10.00 H new ATOM 0 HG LEU A 60 5.355 -6.769 14.898 1.00 10.00 H new ATOM 0 HD11 LEU A 60 4.552 -9.124 14.958 1.00 10.00 H new ATOM 0 HD12 LEU A 60 6.327 -9.050 15.074 1.00 10.00 H new ATOM 0 HD13 LEU A 60 5.351 -9.353 16.532 1.00 10.00 H new ATOM 0 HD21 LEU A 60 3.157 -7.317 15.935 1.00 10.00 H new ATOM 0 HD22 LEU A 60 3.960 -7.546 17.507 1.00 10.00 H new ATOM 0 HD23 LEU A 60 3.923 -5.934 16.753 1.00 10.00 H new ATOM 974 N ASP A 61 6.740 -5.024 19.298 1.00 10.00 N ATOM 975 CA ASP A 61 7.340 -5.118 20.627 1.00 10.00 C ATOM 976 C ASP A 61 7.966 -6.518 20.775 1.00 10.00 C ATOM 977 O ASP A 61 7.396 -7.512 20.314 1.00 10.00 O ATOM 978 CB ASP A 61 6.229 -4.880 21.667 1.00 10.00 C ATOM 979 CG ASP A 61 6.709 -5.008 23.116 1.00 10.00 C ATOM 980 OD1 ASP A 61 6.965 -6.161 23.532 1.00 10.00 O ATOM 981 OD2 ASP A 61 6.786 -3.964 23.800 1.00 10.00 O ATOM 0 H ASP A 61 5.729 -4.892 19.315 1.00 10.00 H new ATOM 0 HA ASP A 61 8.123 -4.374 20.776 1.00 10.00 H new ATOM 0 HB2 ASP A 61 5.810 -3.885 21.518 1.00 10.00 H new ATOM 0 HB3 ASP A 61 5.423 -5.594 21.495 1.00 10.00 H new ATOM 986 N GLU A 62 9.116 -6.619 21.448 1.00 10.00 N ATOM 987 CA GLU A 62 9.884 -7.864 21.562 1.00 10.00 C ATOM 988 C GLU A 62 9.157 -8.987 22.337 1.00 10.00 C ATOM 989 O GLU A 62 9.646 -10.117 22.361 1.00 10.00 O ATOM 990 CB GLU A 62 11.256 -7.584 22.209 1.00 10.00 C ATOM 991 CG GLU A 62 12.131 -6.567 21.452 1.00 10.00 C ATOM 992 CD GLU A 62 11.995 -5.137 21.997 1.00 10.00 C ATOM 993 OE1 GLU A 62 10.865 -4.599 21.948 1.00 10.00 O ATOM 994 OE2 GLU A 62 13.026 -4.601 22.462 1.00 10.00 O ATOM 0 H GLU A 62 9.545 -5.831 21.934 1.00 10.00 H new ATOM 0 HA GLU A 62 10.010 -8.231 20.543 1.00 10.00 H new ATOM 0 HB2 GLU A 62 11.096 -7.220 23.224 1.00 10.00 H new ATOM 0 HB3 GLU A 62 11.803 -8.524 22.290 1.00 10.00 H new ATOM 0 HG2 GLU A 62 13.174 -6.876 21.514 1.00 10.00 H new ATOM 0 HG3 GLU A 62 11.858 -6.575 20.397 1.00 10.00 H new ATOM 1001 N LEU A 63 7.987 -8.714 22.933 1.00 10.00 N ATOM 1002 CA LEU A 63 7.109 -9.708 23.553 1.00 10.00 C ATOM 1003 C LEU A 63 6.010 -10.256 22.611 1.00 10.00 C ATOM 1004 O LEU A 63 5.213 -11.079 23.062 1.00 10.00 O ATOM 1005 CB LEU A 63 6.495 -9.095 24.827 1.00 10.00 C ATOM 1006 CG LEU A 63 7.525 -8.602 25.866 1.00 10.00 C ATOM 1007 CD1 LEU A 63 6.800 -7.918 27.027 1.00 10.00 C ATOM 1008 CD2 LEU A 63 8.374 -9.748 26.430 1.00 10.00 C ATOM 0 H LEU A 63 7.618 -7.765 22.997 1.00 10.00 H new ATOM 0 HA LEU A 63 7.720 -10.576 23.800 1.00 10.00 H new ATOM 0 HB2 LEU A 63 5.859 -8.258 24.541 1.00 10.00 H new ATOM 0 HB3 LEU A 63 5.851 -9.838 25.298 1.00 10.00 H new ATOM 0 HG LEU A 63 8.187 -7.903 25.355 1.00 10.00 H new ATOM 0 HD11 LEU A 63 7.530 -7.571 27.758 1.00 10.00 H new ATOM 0 HD12 LEU A 63 6.232 -7.068 26.651 1.00 10.00 H new ATOM 0 HD13 LEU A 63 6.121 -8.627 27.500 1.00 10.00 H new ATOM 0 HD21 LEU A 63 9.084 -9.352 27.156 1.00 10.00 H new ATOM 0 HD22 LEU A 63 7.725 -10.476 26.917 1.00 10.00 H new ATOM 0 HD23 LEU A 63 8.918 -10.232 25.618 1.00 10.00 H new ATOM 1020 N SER A 64 5.973 -9.860 21.327 1.00 10.00 N ATOM 1021 CA SER A 64 5.031 -10.388 20.320 1.00 10.00 C ATOM 1022 C SER A 64 5.743 -10.941 19.078 1.00 10.00 C ATOM 1023 O SER A 64 6.770 -10.423 18.642 1.00 10.00 O ATOM 1024 CB SER A 64 4.028 -9.307 19.884 1.00 10.00 C ATOM 1025 OG SER A 64 2.770 -9.527 20.492 1.00 10.00 O ATOM 0 H SER A 64 6.606 -9.153 20.952 1.00 10.00 H new ATOM 0 HA SER A 64 4.503 -11.210 20.802 1.00 10.00 H new ATOM 0 HB2 SER A 64 4.404 -8.321 20.158 1.00 10.00 H new ATOM 0 HB3 SER A 64 3.921 -9.317 18.799 1.00 10.00 H new ATOM 0 HG SER A 64 2.066 -9.484 19.812 1.00 10.00 H new ATOM 1031 N ASP A 65 5.152 -11.974 18.466 1.00 10.00 N ATOM 1032 CA ASP A 65 5.711 -12.738 17.357 1.00 10.00 C ATOM 1033 C ASP A 65 4.593 -13.171 16.392 1.00 10.00 C ATOM 1034 O ASP A 65 3.947 -14.205 16.539 1.00 10.00 O ATOM 1035 CB ASP A 65 6.527 -13.931 17.905 1.00 10.00 C ATOM 1036 CG ASP A 65 5.766 -14.944 18.786 1.00 10.00 C ATOM 1037 OD1 ASP A 65 4.929 -14.518 19.617 1.00 10.00 O ATOM 1038 OD2 ASP A 65 6.091 -16.148 18.665 1.00 10.00 O ATOM 0 H ASP A 65 4.231 -12.311 18.747 1.00 10.00 H new ATOM 0 HA ASP A 65 6.396 -12.115 16.782 1.00 10.00 H new ATOM 0 HB2 ASP A 65 6.954 -14.469 17.058 1.00 10.00 H new ATOM 0 HB3 ASP A 65 7.361 -13.535 18.484 1.00 10.00 H new ATOM 1043 N ALA A 66 4.398 -12.351 15.361 1.00 10.00 N ATOM 1044 CA ALA A 66 3.523 -12.632 14.221 1.00 10.00 C ATOM 1045 C ALA A 66 4.189 -13.552 13.168 1.00 10.00 C ATOM 1046 O ALA A 66 5.347 -13.951 13.304 1.00 10.00 O ATOM 1047 CB ALA A 66 3.075 -11.293 13.621 1.00 10.00 C ATOM 0 H ALA A 66 4.859 -11.444 15.292 1.00 10.00 H new ATOM 0 HA ALA A 66 2.652 -13.189 14.567 1.00 10.00 H new ATOM 0 HB1 ALA A 66 2.421 -11.477 12.769 1.00 10.00 H new ATOM 0 HB2 ALA A 66 2.536 -10.719 14.375 1.00 10.00 H new ATOM 0 HB3 ALA A 66 3.949 -10.731 13.293 1.00 10.00 H new ATOM 1053 N ASP A 67 3.480 -13.842 12.070 1.00 10.00 N ATOM 1054 CA ASP A 67 3.875 -14.884 11.118 1.00 10.00 C ATOM 1055 C ASP A 67 4.878 -14.383 10.052 1.00 10.00 C ATOM 1056 O ASP A 67 4.785 -13.230 9.610 1.00 10.00 O ATOM 1057 CB ASP A 67 2.612 -15.385 10.396 1.00 10.00 C ATOM 1058 CG ASP A 67 1.539 -15.874 11.370 1.00 10.00 C ATOM 1059 OD1 ASP A 67 0.870 -14.992 11.956 1.00 10.00 O ATOM 1060 OD2 ASP A 67 1.417 -17.110 11.519 1.00 10.00 O ATOM 0 H ASP A 67 2.617 -13.360 11.818 1.00 10.00 H new ATOM 0 HA ASP A 67 4.367 -15.674 11.685 1.00 10.00 H new ATOM 0 HB2 ASP A 67 2.204 -14.581 9.784 1.00 10.00 H new ATOM 0 HB3 ASP A 67 2.881 -16.196 9.719 1.00 10.00 H new ATOM 1065 N PRO A 68 5.819 -15.248 9.597 1.00 10.00 N ATOM 1066 CA PRO A 68 6.932 -14.924 8.688 1.00 10.00 C ATOM 1067 C PRO A 68 6.486 -14.701 7.226 1.00 10.00 C ATOM 1068 O PRO A 68 6.941 -15.362 6.294 1.00 10.00 O ATOM 1069 CB PRO A 68 7.935 -16.074 8.862 1.00 10.00 C ATOM 1070 CG PRO A 68 7.028 -17.266 9.141 1.00 10.00 C ATOM 1071 CD PRO A 68 5.938 -16.644 10.012 1.00 10.00 C ATOM 0 HA PRO A 68 7.387 -13.966 8.939 1.00 10.00 H new ATOM 0 HB2 PRO A 68 8.539 -16.225 7.967 1.00 10.00 H new ATOM 0 HB3 PRO A 68 8.626 -15.889 9.685 1.00 10.00 H new ATOM 0 HG2 PRO A 68 6.622 -17.693 8.224 1.00 10.00 H new ATOM 0 HG3 PRO A 68 7.556 -18.067 9.659 1.00 10.00 H new ATOM 0 HD2 PRO A 68 4.992 -17.169 9.882 1.00 10.00 H new ATOM 0 HD3 PRO A 68 6.199 -16.714 11.068 1.00 10.00 H new ATOM 1079 N GLY A 69 5.554 -13.767 7.058 1.00 10.00 N ATOM 1080 CA GLY A 69 4.975 -13.321 5.789 1.00 10.00 C ATOM 1081 C GLY A 69 3.854 -12.277 5.934 1.00 10.00 C ATOM 1082 O GLY A 69 3.331 -11.804 4.928 1.00 10.00 O ATOM 0 H GLY A 69 5.156 -13.268 7.854 1.00 10.00 H new ATOM 0 HA2 GLY A 69 5.768 -12.901 5.169 1.00 10.00 H new ATOM 0 HA3 GLY A 69 4.581 -14.188 5.259 1.00 10.00 H new ATOM 1086 N ILE A 70 3.447 -11.918 7.162 1.00 10.00 N ATOM 1087 CA ILE A 70 2.257 -11.102 7.423 1.00 10.00 C ATOM 1088 C ILE A 70 2.364 -9.652 6.914 1.00 10.00 C ATOM 1089 O ILE A 70 1.344 -9.014 6.656 1.00 10.00 O ATOM 1090 CB ILE A 70 1.950 -11.200 8.934 1.00 10.00 C ATOM 1091 CG1 ILE A 70 0.437 -11.138 9.194 1.00 10.00 C ATOM 1092 CG2 ILE A 70 2.733 -10.173 9.776 1.00 10.00 C ATOM 1093 CD1 ILE A 70 0.085 -11.704 10.575 1.00 10.00 C ATOM 0 H ILE A 70 3.943 -12.191 8.010 1.00 10.00 H new ATOM 0 HA ILE A 70 1.420 -11.496 6.847 1.00 10.00 H new ATOM 0 HB ILE A 70 2.303 -12.176 9.267 1.00 10.00 H new ATOM 0 HG12 ILE A 70 0.096 -10.105 9.124 1.00 10.00 H new ATOM 0 HG13 ILE A 70 -0.090 -11.700 8.423 1.00 10.00 H new ATOM 0 HG21 ILE A 70 2.474 -10.292 10.828 1.00 10.00 H new ATOM 0 HG22 ILE A 70 3.803 -10.335 9.645 1.00 10.00 H new ATOM 0 HG23 ILE A 70 2.476 -9.165 9.451 1.00 10.00 H new ATOM 0 HD11 ILE A 70 -0.993 -11.646 10.728 1.00 10.00 H new ATOM 0 HD12 ILE A 70 0.404 -12.745 10.634 1.00 10.00 H new ATOM 0 HD13 ILE A 70 0.593 -11.125 11.346 1.00 10.00 H new ATOM 1105 N VAL A 71 3.592 -9.143 6.745 1.00 10.00 N ATOM 1106 CA VAL A 71 3.871 -7.852 6.101 1.00 10.00 C ATOM 1107 C VAL A 71 3.803 -8.016 4.587 1.00 10.00 C ATOM 1108 O VAL A 71 3.128 -7.255 3.907 1.00 10.00 O ATOM 1109 CB VAL A 71 5.273 -7.297 6.445 1.00 10.00 C ATOM 1110 CG1 VAL A 71 5.265 -5.768 6.346 1.00 10.00 C ATOM 1111 CG2 VAL A 71 5.788 -7.725 7.822 1.00 10.00 C ATOM 0 H VAL A 71 4.434 -9.626 7.058 1.00 10.00 H new ATOM 0 HA VAL A 71 3.122 -7.153 6.472 1.00 10.00 H new ATOM 0 HB VAL A 71 5.959 -7.726 5.715 1.00 10.00 H new ATOM 0 HG11 VAL A 71 6.255 -5.382 6.589 1.00 10.00 H new ATOM 0 HG12 VAL A 71 4.999 -5.470 5.332 1.00 10.00 H new ATOM 0 HG13 VAL A 71 4.535 -5.362 7.046 1.00 10.00 H new ATOM 0 HG21 VAL A 71 6.776 -7.296 7.990 1.00 10.00 H new ATOM 0 HG22 VAL A 71 5.103 -7.371 8.593 1.00 10.00 H new ATOM 0 HG23 VAL A 71 5.852 -8.812 7.865 1.00 10.00 H new ATOM 1121 N ASP A 72 4.480 -9.041 4.071 1.00 10.00 N ATOM 1122 CA ASP A 72 4.557 -9.406 2.657 1.00 10.00 C ATOM 1123 C ASP A 72 3.162 -9.598 2.041 1.00 10.00 C ATOM 1124 O ASP A 72 2.895 -9.089 0.951 1.00 10.00 O ATOM 1125 CB ASP A 72 5.414 -10.679 2.511 1.00 10.00 C ATOM 1126 CG ASP A 72 6.710 -10.633 3.336 1.00 10.00 C ATOM 1127 OD1 ASP A 72 6.595 -10.642 4.587 1.00 10.00 O ATOM 1128 OD2 ASP A 72 7.789 -10.576 2.709 1.00 10.00 O ATOM 0 H ASP A 72 5.019 -9.674 4.661 1.00 10.00 H new ATOM 0 HA ASP A 72 5.028 -8.590 2.108 1.00 10.00 H new ATOM 0 HB2 ASP A 72 4.825 -11.543 2.819 1.00 10.00 H new ATOM 0 HB3 ASP A 72 5.665 -10.822 1.460 1.00 10.00 H new ATOM 1133 N GLU A 73 2.241 -10.230 2.785 1.00 10.00 N ATOM 1134 CA GLU A 73 0.832 -10.324 2.398 1.00 10.00 C ATOM 1135 C GLU A 73 0.146 -8.952 2.347 1.00 10.00 C ATOM 1136 O GLU A 73 -0.713 -8.756 1.492 1.00 10.00 O ATOM 1137 CB GLU A 73 0.031 -11.192 3.379 1.00 10.00 C ATOM 1138 CG GLU A 73 0.314 -12.698 3.354 1.00 10.00 C ATOM 1139 CD GLU A 73 -0.734 -13.480 4.168 1.00 10.00 C ATOM 1140 OE1 GLU A 73 -1.274 -12.917 5.151 1.00 10.00 O ATOM 1141 OE2 GLU A 73 -1.010 -14.638 3.782 1.00 10.00 O ATOM 0 H GLU A 73 2.456 -10.689 3.670 1.00 10.00 H new ATOM 0 HA GLU A 73 0.839 -10.773 1.405 1.00 10.00 H new ATOM 0 HB2 GLU A 73 0.220 -10.827 4.389 1.00 10.00 H new ATOM 0 HB3 GLU A 73 -1.030 -11.042 3.179 1.00 10.00 H new ATOM 0 HG2 GLU A 73 0.315 -13.053 2.323 1.00 10.00 H new ATOM 0 HG3 GLU A 73 1.308 -12.890 3.758 1.00 10.00 H new ATOM 1148 N ALA A 74 0.519 -7.988 3.203 1.00 10.00 N ATOM 1149 CA ALA A 74 -0.022 -6.629 3.135 1.00 10.00 C ATOM 1150 C ALA A 74 0.427 -5.928 1.850 1.00 10.00 C ATOM 1151 O ALA A 74 -0.377 -5.273 1.183 1.00 10.00 O ATOM 1152 CB ALA A 74 0.426 -5.815 4.358 1.00 10.00 C ATOM 0 H ALA A 74 1.196 -8.129 3.952 1.00 10.00 H new ATOM 0 HA ALA A 74 -1.110 -6.697 3.131 1.00 10.00 H new ATOM 0 HB1 ALA A 74 0.016 -4.807 4.294 1.00 10.00 H new ATOM 0 HB2 ALA A 74 0.065 -6.296 5.267 1.00 10.00 H new ATOM 0 HB3 ALA A 74 1.515 -5.764 4.382 1.00 10.00 H new ATOM 1158 N VAL A 75 1.708 -6.090 1.490 1.00 10.00 N ATOM 1159 CA VAL A 75 2.273 -5.509 0.269 1.00 10.00 C ATOM 1160 C VAL A 75 1.638 -6.150 -0.970 1.00 10.00 C ATOM 1161 O VAL A 75 1.149 -5.431 -1.837 1.00 10.00 O ATOM 1162 CB VAL A 75 3.812 -5.612 0.229 1.00 10.00 C ATOM 1163 CG1 VAL A 75 4.369 -4.575 -0.747 1.00 10.00 C ATOM 1164 CG2 VAL A 75 4.467 -5.317 1.586 1.00 10.00 C ATOM 0 H VAL A 75 2.379 -6.628 2.038 1.00 10.00 H new ATOM 0 HA VAL A 75 2.035 -4.445 0.270 1.00 10.00 H new ATOM 0 HB VAL A 75 4.038 -6.636 -0.068 1.00 10.00 H new ATOM 0 HG11 VAL A 75 5.456 -4.648 -0.775 1.00 10.00 H new ATOM 0 HG12 VAL A 75 3.967 -4.760 -1.743 1.00 10.00 H new ATOM 0 HG13 VAL A 75 4.081 -3.576 -0.420 1.00 10.00 H new ATOM 0 HG21 VAL A 75 5.550 -5.405 1.494 1.00 10.00 H new ATOM 0 HG22 VAL A 75 4.211 -4.306 1.902 1.00 10.00 H new ATOM 0 HG23 VAL A 75 4.106 -6.031 2.327 1.00 10.00 H new ATOM 1174 N ASP A 76 1.547 -7.486 -1.026 1.00 10.00 N ATOM 1175 CA ASP A 76 0.826 -8.208 -2.079 1.00 10.00 C ATOM 1176 C ASP A 76 -0.657 -7.810 -2.138 1.00 10.00 C ATOM 1177 O ASP A 76 -1.171 -7.545 -3.223 1.00 10.00 O ATOM 1178 CB ASP A 76 1.002 -9.724 -1.891 1.00 10.00 C ATOM 1179 CG ASP A 76 0.496 -10.525 -3.096 1.00 10.00 C ATOM 1180 OD1 ASP A 76 0.541 -10.013 -4.235 1.00 10.00 O ATOM 1181 OD2 ASP A 76 0.041 -11.676 -2.922 1.00 10.00 O ATOM 0 H ASP A 76 1.977 -8.100 -0.334 1.00 10.00 H new ATOM 0 HA ASP A 76 1.256 -7.927 -3.040 1.00 10.00 H new ATOM 0 HB2 ASP A 76 2.056 -9.947 -1.727 1.00 10.00 H new ATOM 0 HB3 ASP A 76 0.466 -10.041 -0.996 1.00 10.00 H new ATOM 1186 N ALA A 77 -1.332 -7.648 -0.994 1.00 10.00 N ATOM 1187 CA ALA A 77 -2.716 -7.179 -0.961 1.00 10.00 C ATOM 1188 C ALA A 77 -2.839 -5.759 -1.529 1.00 10.00 C ATOM 1189 O ALA A 77 -3.777 -5.500 -2.286 1.00 10.00 O ATOM 1190 CB ALA A 77 -3.267 -7.258 0.467 1.00 10.00 C ATOM 0 H ALA A 77 -0.935 -7.837 -0.074 1.00 10.00 H new ATOM 0 HA ALA A 77 -3.314 -7.832 -1.597 1.00 10.00 H new ATOM 0 HB1 ALA A 77 -4.299 -6.906 0.479 1.00 10.00 H new ATOM 0 HB2 ALA A 77 -3.232 -8.291 0.814 1.00 10.00 H new ATOM 0 HB3 ALA A 77 -2.663 -6.633 1.125 1.00 10.00 H new ATOM 1196 N ALA A 78 -1.885 -4.861 -1.242 1.00 10.00 N ATOM 1197 CA ALA A 78 -1.796 -3.555 -1.893 1.00 10.00 C ATOM 1198 C ALA A 78 -1.539 -3.672 -3.406 1.00 10.00 C ATOM 1199 O ALA A 78 -2.204 -2.981 -4.176 1.00 10.00 O ATOM 1200 CB ALA A 78 -0.742 -2.698 -1.183 1.00 10.00 C ATOM 0 H ALA A 78 -1.154 -5.025 -0.550 1.00 10.00 H new ATOM 0 HA ALA A 78 -2.761 -3.056 -1.802 1.00 10.00 H new ATOM 0 HB1 ALA A 78 -0.677 -1.725 -1.669 1.00 10.00 H new ATOM 0 HB2 ALA A 78 -1.025 -2.564 -0.139 1.00 10.00 H new ATOM 0 HB3 ALA A 78 0.227 -3.195 -1.235 1.00 10.00 H new ATOM 1206 N TYR A 79 -0.657 -4.579 -3.852 1.00 10.00 N ATOM 1207 CA TYR A 79 -0.421 -4.818 -5.280 1.00 10.00 C ATOM 1208 C TYR A 79 -1.664 -5.361 -6.007 1.00 10.00 C ATOM 1209 O TYR A 79 -2.004 -4.838 -7.067 1.00 10.00 O ATOM 1210 CB TYR A 79 0.762 -5.783 -5.478 1.00 10.00 C ATOM 1211 CG TYR A 79 2.148 -5.202 -5.243 1.00 10.00 C ATOM 1212 CD1 TYR A 79 2.617 -4.175 -6.090 1.00 10.00 C ATOM 1213 CD2 TYR A 79 3.000 -5.739 -4.254 1.00 10.00 C ATOM 1214 CE1 TYR A 79 3.929 -3.680 -5.955 1.00 10.00 C ATOM 1215 CE2 TYR A 79 4.322 -5.267 -4.139 1.00 10.00 C ATOM 1216 CZ TYR A 79 4.787 -4.234 -4.980 1.00 10.00 C ATOM 1217 OH TYR A 79 6.065 -3.787 -4.848 1.00 10.00 O ATOM 0 H TYR A 79 -0.092 -5.163 -3.236 1.00 10.00 H new ATOM 0 HA TYR A 79 -0.184 -3.850 -5.721 1.00 10.00 H new ATOM 0 HB2 TYR A 79 0.628 -6.632 -4.807 1.00 10.00 H new ATOM 0 HB3 TYR A 79 0.721 -6.171 -6.496 1.00 10.00 H new ATOM 0 HD1 TYR A 79 1.965 -3.765 -6.847 1.00 10.00 H new ATOM 0 HD2 TYR A 79 2.640 -6.509 -3.588 1.00 10.00 H new ATOM 0 HE1 TYR A 79 4.277 -2.881 -6.594 1.00 10.00 H new ATOM 0 HE2 TYR A 79 4.984 -5.698 -3.403 1.00 10.00 H new ATOM 0 HH TYR A 79 6.511 -4.279 -4.127 1.00 10.00 H new ATOM 1227 N ARG A 80 -2.410 -6.321 -5.428 1.00 10.00 N ATOM 1228 CA ARG A 80 -3.684 -6.778 -6.026 1.00 10.00 C ATOM 1229 C ARG A 80 -4.716 -5.645 -6.031 1.00 10.00 C ATOM 1230 O ARG A 80 -5.425 -5.443 -7.018 1.00 10.00 O ATOM 1231 CB ARG A 80 -4.289 -8.001 -5.304 1.00 10.00 C ATOM 1232 CG ARG A 80 -3.389 -9.225 -5.071 1.00 10.00 C ATOM 1233 CD ARG A 80 -2.504 -9.656 -6.246 1.00 10.00 C ATOM 1234 NE ARG A 80 -1.560 -10.688 -5.785 1.00 10.00 N ATOM 1235 CZ ARG A 80 -1.622 -12.002 -5.927 1.00 10.00 C ATOM 1236 NH1 ARG A 80 -2.431 -12.579 -6.786 1.00 10.00 N ATOM 1237 NH2 ARG A 80 -0.867 -12.767 -5.180 1.00 10.00 N ATOM 0 H ARG A 80 -2.159 -6.791 -4.558 1.00 10.00 H new ATOM 0 HA ARG A 80 -3.444 -7.078 -7.046 1.00 10.00 H new ATOM 0 HB2 ARG A 80 -4.655 -7.667 -4.333 1.00 10.00 H new ATOM 0 HB3 ARG A 80 -5.157 -8.330 -5.876 1.00 10.00 H new ATOM 0 HG2 ARG A 80 -2.745 -9.017 -4.217 1.00 10.00 H new ATOM 0 HG3 ARG A 80 -4.023 -10.067 -4.794 1.00 10.00 H new ATOM 0 HD2 ARG A 80 -3.119 -10.045 -7.057 1.00 10.00 H new ATOM 0 HD3 ARG A 80 -1.960 -8.798 -6.641 1.00 10.00 H new ATOM 0 HE ARG A 80 -0.742 -10.340 -5.285 1.00 10.00 H new ATOM 0 HH11 ARG A 80 -3.041 -12.010 -7.373 1.00 10.00 H new ATOM 0 HH12 ARG A 80 -2.449 -13.596 -6.866 1.00 10.00 H new ATOM 0 HH21 ARG A 80 -0.237 -12.349 -4.495 1.00 10.00 H new ATOM 0 HH22 ARG A 80 -0.908 -13.781 -5.283 1.00 10.00 H new ATOM 1251 N SER A 81 -4.771 -4.894 -4.927 1.00 10.00 N ATOM 1252 CA SER A 81 -5.696 -3.776 -4.755 1.00 10.00 C ATOM 1253 C SER A 81 -5.418 -2.635 -5.731 1.00 10.00 C ATOM 1254 O SER A 81 -6.371 -1.982 -6.137 1.00 10.00 O ATOM 1255 CB SER A 81 -5.668 -3.241 -3.321 1.00 10.00 C ATOM 1256 OG SER A 81 -5.963 -4.270 -2.403 1.00 10.00 O ATOM 0 H SER A 81 -4.167 -5.049 -4.120 1.00 10.00 H new ATOM 0 HA SER A 81 -6.689 -4.171 -4.969 1.00 10.00 H new ATOM 0 HB2 SER A 81 -4.686 -2.821 -3.102 1.00 10.00 H new ATOM 0 HB3 SER A 81 -6.391 -2.432 -3.214 1.00 10.00 H new ATOM 0 HG SER A 81 -5.134 -4.582 -1.983 1.00 10.00 H new ATOM 1262 N LEU A 82 -4.164 -2.399 -6.143 1.00 10.00 N ATOM 1263 CA LEU A 82 -3.830 -1.373 -7.137 1.00 10.00 C ATOM 1264 C LEU A 82 -4.470 -1.679 -8.496 1.00 10.00 C ATOM 1265 O LEU A 82 -5.134 -0.815 -9.069 1.00 10.00 O ATOM 1266 CB LEU A 82 -2.294 -1.271 -7.242 1.00 10.00 C ATOM 1267 CG LEU A 82 -1.710 -0.053 -7.994 1.00 10.00 C ATOM 1268 CD1 LEU A 82 -1.706 -0.219 -9.515 1.00 10.00 C ATOM 1269 CD2 LEU A 82 -2.395 1.273 -7.647 1.00 10.00 C ATOM 0 H LEU A 82 -3.355 -2.914 -5.796 1.00 10.00 H new ATOM 0 HA LEU A 82 -4.234 -0.412 -6.818 1.00 10.00 H new ATOM 0 HB2 LEU A 82 -1.887 -1.269 -6.231 1.00 10.00 H new ATOM 0 HB3 LEU A 82 -1.929 -2.175 -7.731 1.00 10.00 H new ATOM 0 HG LEU A 82 -0.679 -0.014 -7.641 1.00 10.00 H new ATOM 0 HD11 LEU A 82 -1.283 0.673 -9.977 1.00 10.00 H new ATOM 0 HD12 LEU A 82 -1.105 -1.087 -9.785 1.00 10.00 H new ATOM 0 HD13 LEU A 82 -2.727 -0.361 -9.868 1.00 10.00 H new ATOM 0 HD21 LEU A 82 -1.931 2.081 -8.213 1.00 10.00 H new ATOM 0 HD22 LEU A 82 -3.453 1.213 -7.901 1.00 10.00 H new ATOM 0 HD23 LEU A 82 -2.288 1.470 -6.580 1.00 10.00 H new ATOM 1281 N GLU A 83 -4.355 -2.922 -8.974 1.00 10.00 N ATOM 1282 CA GLU A 83 -4.968 -3.317 -10.242 1.00 10.00 C ATOM 1283 C GLU A 83 -6.497 -3.299 -10.157 1.00 10.00 C ATOM 1284 O GLU A 83 -7.134 -2.741 -11.051 1.00 10.00 O ATOM 1285 CB GLU A 83 -4.428 -4.692 -10.680 1.00 10.00 C ATOM 1286 CG GLU A 83 -3.367 -4.579 -11.787 1.00 10.00 C ATOM 1287 CD GLU A 83 -2.255 -3.575 -11.456 1.00 10.00 C ATOM 1288 OE1 GLU A 83 -1.356 -3.938 -10.666 1.00 10.00 O ATOM 1289 OE2 GLU A 83 -2.328 -2.446 -11.994 1.00 10.00 O ATOM 0 H GLU A 83 -3.844 -3.668 -8.502 1.00 10.00 H new ATOM 0 HA GLU A 83 -4.695 -2.588 -11.004 1.00 10.00 H new ATOM 0 HB2 GLU A 83 -3.997 -5.202 -9.818 1.00 10.00 H new ATOM 0 HB3 GLU A 83 -5.255 -5.308 -11.034 1.00 10.00 H new ATOM 0 HG2 GLU A 83 -2.923 -5.560 -11.958 1.00 10.00 H new ATOM 0 HG3 GLU A 83 -3.851 -4.282 -12.717 1.00 10.00 H new ATOM 1296 N SER A 84 -7.101 -3.768 -9.055 1.00 10.00 N ATOM 1297 CA SER A 84 -8.563 -3.694 -8.919 1.00 10.00 C ATOM 1298 C SER A 84 -9.111 -2.316 -8.545 1.00 10.00 C ATOM 1299 O SER A 84 -10.284 -2.041 -8.785 1.00 10.00 O ATOM 1300 CB SER A 84 -9.164 -4.880 -8.172 1.00 10.00 C ATOM 1301 OG SER A 84 -9.044 -6.035 -8.990 1.00 10.00 O ATOM 0 H SER A 84 -6.615 -4.192 -8.264 1.00 10.00 H new ATOM 0 HA SER A 84 -8.945 -3.809 -9.933 1.00 10.00 H new ATOM 0 HB2 SER A 84 -8.648 -5.032 -7.224 1.00 10.00 H new ATOM 0 HB3 SER A 84 -10.211 -4.689 -7.938 1.00 10.00 H new ATOM 0 HG SER A 84 -9.536 -5.896 -9.826 1.00 10.00 H new ATOM 1307 N PHE A 85 -8.284 -1.408 -8.029 1.00 10.00 N ATOM 1308 CA PHE A 85 -8.623 0.011 -7.939 1.00 10.00 C ATOM 1309 C PHE A 85 -8.744 0.595 -9.359 1.00 10.00 C ATOM 1310 O PHE A 85 -9.641 1.398 -9.608 1.00 10.00 O ATOM 1311 CB PHE A 85 -7.551 0.699 -7.084 1.00 10.00 C ATOM 1312 CG PHE A 85 -7.495 2.212 -7.068 1.00 10.00 C ATOM 1313 CD1 PHE A 85 -6.971 2.902 -8.175 1.00 10.00 C ATOM 1314 CD2 PHE A 85 -7.819 2.918 -5.895 1.00 10.00 C ATOM 1315 CE1 PHE A 85 -6.734 4.286 -8.097 1.00 10.00 C ATOM 1316 CE2 PHE A 85 -7.571 4.300 -5.810 1.00 10.00 C ATOM 1317 CZ PHE A 85 -7.010 4.981 -6.904 1.00 10.00 C ATOM 0 H PHE A 85 -7.360 -1.636 -7.662 1.00 10.00 H new ATOM 0 HA PHE A 85 -9.587 0.173 -7.457 1.00 10.00 H new ATOM 0 HB2 PHE A 85 -7.682 0.362 -6.056 1.00 10.00 H new ATOM 0 HB3 PHE A 85 -6.579 0.336 -7.417 1.00 10.00 H new ATOM 0 HD1 PHE A 85 -6.750 2.368 -9.087 1.00 10.00 H new ATOM 0 HD2 PHE A 85 -8.259 2.397 -5.057 1.00 10.00 H new ATOM 0 HE1 PHE A 85 -6.340 4.816 -8.952 1.00 10.00 H new ATOM 0 HE2 PHE A 85 -7.812 4.837 -4.905 1.00 10.00 H new ATOM 0 HZ PHE A 85 -6.791 6.036 -6.830 1.00 10.00 H new ATOM 1327 N LEU A 86 -7.906 0.152 -10.314 1.00 10.00 N ATOM 1328 CA LEU A 86 -8.056 0.519 -11.728 1.00 10.00 C ATOM 1329 C LEU A 86 -9.225 -0.218 -12.398 1.00 10.00 C ATOM 1330 O LEU A 86 -9.944 0.419 -13.176 1.00 10.00 O ATOM 1331 CB LEU A 86 -6.737 0.293 -12.485 1.00 10.00 C ATOM 1332 CG LEU A 86 -5.559 1.136 -11.957 1.00 10.00 C ATOM 1333 CD1 LEU A 86 -4.280 0.768 -12.710 1.00 10.00 C ATOM 1334 CD2 LEU A 86 -5.819 2.637 -12.123 1.00 10.00 C ATOM 0 H LEU A 86 -7.115 -0.464 -10.127 1.00 10.00 H new ATOM 0 HA LEU A 86 -8.297 1.581 -11.769 1.00 10.00 H new ATOM 0 HB2 LEU A 86 -6.471 -0.762 -12.424 1.00 10.00 H new ATOM 0 HB3 LEU A 86 -6.891 0.523 -13.539 1.00 10.00 H new ATOM 0 HG LEU A 86 -5.449 0.920 -10.894 1.00 10.00 H new ATOM 0 HD11 LEU A 86 -3.451 1.367 -12.333 1.00 10.00 H new ATOM 0 HD12 LEU A 86 -4.061 -0.289 -12.561 1.00 10.00 H new ATOM 0 HD13 LEU A 86 -4.415 0.964 -13.774 1.00 10.00 H new ATOM 0 HD21 LEU A 86 -4.967 3.198 -11.740 1.00 10.00 H new ATOM 0 HD22 LEU A 86 -5.960 2.867 -13.179 1.00 10.00 H new ATOM 0 HD23 LEU A 86 -6.715 2.914 -11.568 1.00 10.00 H new ATOM 1346 N ASP A 87 -9.510 -1.476 -12.018 1.00 10.00 N ATOM 1347 CA ASP A 87 -10.771 -2.134 -12.404 1.00 10.00 C ATOM 1348 C ASP A 87 -11.948 -1.268 -11.917 1.00 10.00 C ATOM 1349 O ASP A 87 -12.924 -1.081 -12.640 1.00 10.00 O ATOM 1350 CB ASP A 87 -10.950 -3.554 -11.818 1.00 10.00 C ATOM 1351 CG ASP A 87 -9.884 -4.602 -12.160 1.00 10.00 C ATOM 1352 OD1 ASP A 87 -9.333 -4.541 -13.279 1.00 10.00 O ATOM 1353 OD2 ASP A 87 -9.655 -5.474 -11.279 1.00 10.00 O ATOM 0 H ASP A 87 -8.891 -2.053 -11.449 1.00 10.00 H new ATOM 0 HA ASP A 87 -10.743 -2.237 -13.489 1.00 10.00 H new ATOM 0 HB2 ASP A 87 -10.999 -3.466 -10.733 1.00 10.00 H new ATOM 0 HB3 ASP A 87 -11.915 -3.936 -12.151 1.00 10.00 H new ATOM 1358 N GLY A 88 -11.805 -0.648 -10.732 1.00 10.00 N ATOM 1359 CA GLY A 88 -12.829 0.174 -10.085 1.00 10.00 C ATOM 1360 C GLY A 88 -13.001 1.563 -10.705 1.00 10.00 C ATOM 1361 O GLY A 88 -13.908 2.299 -10.312 1.00 10.00 O ATOM 0 H GLY A 88 -10.946 -0.711 -10.186 1.00 10.00 H new ATOM 0 HA2 GLY A 88 -13.783 -0.352 -10.129 1.00 10.00 H new ATOM 0 HA3 GLY A 88 -12.576 0.287 -9.031 1.00 10.00 H new ATOM 1365 N PHE A 89 -12.166 1.913 -11.690 1.00 10.00 N ATOM 1366 CA PHE A 89 -12.212 3.193 -12.390 1.00 10.00 C ATOM 1367 C PHE A 89 -12.407 3.074 -13.904 1.00 10.00 C ATOM 1368 O PHE A 89 -12.754 4.084 -14.516 1.00 10.00 O ATOM 1369 CB PHE A 89 -10.939 3.998 -12.073 1.00 10.00 C ATOM 1370 CG PHE A 89 -10.988 4.805 -10.787 1.00 10.00 C ATOM 1371 CD1 PHE A 89 -12.026 5.734 -10.599 1.00 10.00 C ATOM 1372 CD2 PHE A 89 -9.986 4.684 -9.807 1.00 10.00 C ATOM 1373 CE1 PHE A 89 -12.082 6.534 -9.446 1.00 10.00 C ATOM 1374 CE2 PHE A 89 -10.056 5.466 -8.640 1.00 10.00 C ATOM 1375 CZ PHE A 89 -11.095 6.394 -8.460 1.00 10.00 C ATOM 0 H PHE A 89 -11.425 1.298 -12.027 1.00 10.00 H new ATOM 0 HA PHE A 89 -13.096 3.715 -12.023 1.00 10.00 H new ATOM 0 HB2 PHE A 89 -10.096 3.309 -12.019 1.00 10.00 H new ATOM 0 HB3 PHE A 89 -10.742 4.677 -12.902 1.00 10.00 H new ATOM 0 HD1 PHE A 89 -12.793 5.834 -11.353 1.00 10.00 H new ATOM 0 HD2 PHE A 89 -9.167 3.994 -9.950 1.00 10.00 H new ATOM 0 HE1 PHE A 89 -12.879 7.252 -9.320 1.00 10.00 H new ATOM 0 HE2 PHE A 89 -9.303 5.352 -7.874 1.00 10.00 H new ATOM 0 HZ PHE A 89 -11.133 6.998 -7.565 1.00 10.00 H new ATOM 1385 N ARG A 90 -12.187 1.898 -14.515 1.00 10.00 N ATOM 1386 CA ARG A 90 -12.247 1.740 -15.981 1.00 10.00 C ATOM 1387 C ARG A 90 -12.724 0.378 -16.494 1.00 10.00 C ATOM 1388 O ARG A 90 -13.351 0.365 -17.551 1.00 10.00 O ATOM 1389 CB ARG A 90 -10.851 1.967 -16.587 1.00 10.00 C ATOM 1390 CG ARG A 90 -10.252 3.361 -16.333 1.00 10.00 C ATOM 1391 CD ARG A 90 -8.897 3.521 -17.028 1.00 10.00 C ATOM 1392 NE ARG A 90 -7.919 2.536 -16.528 1.00 10.00 N ATOM 1393 CZ ARG A 90 -6.642 2.441 -16.867 1.00 10.00 C ATOM 1394 NH1 ARG A 90 -6.079 3.304 -17.681 1.00 10.00 N ATOM 1395 NH2 ARG A 90 -5.907 1.464 -16.392 1.00 10.00 N ATOM 0 H ARG A 90 -11.965 1.037 -14.015 1.00 10.00 H new ATOM 0 HA ARG A 90 -12.987 2.478 -16.289 1.00 10.00 H new ATOM 0 HB2 ARG A 90 -10.170 1.217 -16.185 1.00 10.00 H new ATOM 0 HB3 ARG A 90 -10.907 1.803 -17.663 1.00 10.00 H new ATOM 0 HG2 ARG A 90 -10.940 4.126 -16.693 1.00 10.00 H new ATOM 0 HG3 ARG A 90 -10.134 3.518 -15.261 1.00 10.00 H new ATOM 0 HD2 ARG A 90 -9.021 3.400 -18.104 1.00 10.00 H new ATOM 0 HD3 ARG A 90 -8.518 4.529 -16.863 1.00 10.00 H new ATOM 0 HE ARG A 90 -8.263 1.856 -15.850 1.00 10.00 H new ATOM 0 HH11 ARG A 90 -6.627 4.072 -18.069 1.00 10.00 H new ATOM 0 HH12 ARG A 90 -5.093 3.207 -17.925 1.00 10.00 H new ATOM 0 HH21 ARG A 90 -6.319 0.776 -15.761 1.00 10.00 H new ATOM 0 HH22 ARG A 90 -4.924 1.392 -16.654 1.00 10.00 H new ATOM 1409 N GLU A 91 -12.453 -0.711 -15.762 1.00 10.00 N ATOM 1410 CA GLU A 91 -12.588 -2.100 -16.250 1.00 10.00 C ATOM 1411 C GLU A 91 -11.869 -2.294 -17.610 1.00 10.00 C ATOM 1412 O GLU A 91 -10.711 -1.816 -17.693 1.00 10.00 O ATOM 1413 CB GLU A 91 -14.072 -2.536 -16.195 1.00 10.00 C ATOM 1414 CG GLU A 91 -14.263 -4.062 -16.130 1.00 10.00 C ATOM 1415 CD GLU A 91 -15.744 -4.445 -15.960 1.00 10.00 C ATOM 1416 OE1 GLU A 91 -16.236 -4.376 -14.809 1.00 10.00 O ATOM 1417 OE2 GLU A 91 -16.376 -4.823 -16.974 1.00 10.00 O ATOM 1418 OXT GLU A 91 -12.440 -2.918 -18.531 1.00 10.00 O ATOM 0 H GLU A 91 -12.128 -0.656 -14.797 1.00 10.00 H new ATOM 0 HA GLU A 91 -12.065 -2.790 -15.588 1.00 10.00 H new ATOM 0 HB2 GLU A 91 -14.544 -2.082 -15.324 1.00 10.00 H new ATOM 0 HB3 GLU A 91 -14.588 -2.151 -17.074 1.00 10.00 H new ATOM 0 HG2 GLU A 91 -13.872 -4.517 -17.040 1.00 10.00 H new ATOM 0 HG3 GLU A 91 -13.685 -4.466 -15.299 1.00 10.00 H new TER 1425 GLU A 91