USER MOD reduce.3.24.130724 H: found=0, std=0, add=612, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 613 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 102 TYR OH : rot 82:sc= 0.716 USER MOD Set 1.2: A 115 SER OG : rot -55:sc= 0.585 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot -23:sc= 0.586! USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0682) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 HIS : no HD1:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 92:sc= 0.531 USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 72 9.541 -19.886 5.352 1.00 0.00 N ATOM 2 CA ARG A 72 9.303 -21.049 6.199 1.00 0.00 C ATOM 3 C ARG A 72 7.876 -21.044 6.740 1.00 0.00 C ATOM 4 O ARG A 72 7.269 -19.986 6.908 1.00 0.00 O ATOM 5 CB ARG A 72 10.300 -21.074 7.358 1.00 0.00 C ATOM 6 CG ARG A 72 11.752 -21.115 6.912 1.00 0.00 C ATOM 7 CD ARG A 72 12.023 -22.306 6.005 1.00 0.00 C ATOM 8 NE ARG A 72 13.430 -22.696 6.020 1.00 0.00 N ATOM 9 CZ ARG A 72 13.923 -23.698 5.300 1.00 0.00 C ATOM 10 NH1 ARG A 72 13.126 -24.407 4.512 1.00 0.00 N ATOM 11 NH2 ARG A 72 15.215 -23.992 5.367 1.00 0.00 N ATOM 0 HA ARG A 72 9.440 -21.944 5.592 1.00 0.00 H new ATOM 0 HB2 ARG A 72 10.144 -20.192 7.979 1.00 0.00 H new ATOM 0 HB3 ARG A 72 10.096 -21.944 7.983 1.00 0.00 H new ATOM 0 HG2 ARG A 72 11.998 -20.192 6.386 1.00 0.00 H new ATOM 0 HG3 ARG A 72 12.401 -21.167 7.786 1.00 0.00 H new ATOM 0 HD2 ARG A 72 11.410 -23.150 6.321 1.00 0.00 H new ATOM 0 HD3 ARG A 72 11.726 -22.060 4.985 1.00 0.00 H new ATOM 0 HE ARG A 72 14.070 -22.170 6.616 1.00 0.00 H new ATOM 0 HH11 ARG A 72 12.132 -24.184 4.458 1.00 0.00 H new ATOM 0 HH12 ARG A 72 13.507 -25.176 3.960 1.00 0.00 H new ATOM 0 HH21 ARG A 72 15.831 -23.449 5.972 1.00 0.00 H new ATOM 0 HH22 ARG A 72 15.592 -24.761 4.814 1.00 0.00 H new ATOM 25 N ARG A 73 7.348 -22.233 7.012 1.00 0.00 N ATOM 26 CA ARG A 73 5.993 -22.366 7.532 1.00 0.00 C ATOM 27 C ARG A 73 5.741 -21.362 8.654 1.00 0.00 C ATOM 28 O ARG A 73 4.677 -20.748 8.722 1.00 0.00 O ATOM 29 CB ARG A 73 5.757 -23.788 8.043 1.00 0.00 C ATOM 30 CG ARG A 73 4.310 -24.242 7.935 1.00 0.00 C ATOM 31 CD ARG A 73 3.466 -23.690 9.072 1.00 0.00 C ATOM 32 NE ARG A 73 3.552 -24.520 10.271 1.00 0.00 N ATOM 33 CZ ARG A 73 2.946 -25.696 10.394 1.00 0.00 C ATOM 34 NH1 ARG A 73 2.216 -26.178 9.398 1.00 0.00 N ATOM 35 NH2 ARG A 73 3.072 -26.394 11.516 1.00 0.00 N ATOM 0 H ARG A 73 7.838 -23.118 6.881 1.00 0.00 H new ATOM 0 HA ARG A 73 5.297 -22.160 6.719 1.00 0.00 H new ATOM 0 HB2 ARG A 73 6.388 -24.476 7.481 1.00 0.00 H new ATOM 0 HB3 ARG A 73 6.071 -23.847 9.085 1.00 0.00 H new ATOM 0 HG2 ARG A 73 3.895 -23.915 6.981 1.00 0.00 H new ATOM 0 HG3 ARG A 73 4.268 -25.331 7.945 1.00 0.00 H new ATOM 0 HD2 ARG A 73 3.793 -22.677 9.308 1.00 0.00 H new ATOM 0 HD3 ARG A 73 2.426 -23.622 8.752 1.00 0.00 H new ATOM 0 HE ARG A 73 4.107 -24.178 11.056 1.00 0.00 H new ATOM 0 HH11 ARG A 73 2.118 -25.646 8.533 1.00 0.00 H new ATOM 0 HH12 ARG A 73 1.752 -27.081 9.496 1.00 0.00 H new ATOM 0 HH21 ARG A 73 3.634 -26.028 12.284 1.00 0.00 H new ATOM 0 HH22 ARG A 73 2.607 -27.297 11.610 1.00 0.00 H new ATOM 49 N GLU A 74 6.727 -21.204 9.532 1.00 0.00 N ATOM 50 CA GLU A 74 6.610 -20.276 10.651 1.00 0.00 C ATOM 51 C GLU A 74 7.843 -19.382 10.747 1.00 0.00 C ATOM 52 O GLU A 74 8.969 -19.832 10.532 1.00 0.00 O ATOM 53 CB GLU A 74 6.420 -21.044 11.961 1.00 0.00 C ATOM 54 CG GLU A 74 5.208 -21.961 11.959 1.00 0.00 C ATOM 55 CD GLU A 74 3.905 -21.205 12.130 1.00 0.00 C ATOM 56 OE1 GLU A 74 3.529 -20.455 11.205 1.00 0.00 O ATOM 57 OE2 GLU A 74 3.262 -21.363 13.189 1.00 0.00 O ATOM 0 H GLU A 74 7.614 -21.706 9.490 1.00 0.00 H new ATOM 0 HA GLU A 74 5.738 -19.646 10.478 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.313 -21.637 12.158 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.324 -20.331 12.780 1.00 0.00 H new ATOM 0 HG2 GLU A 74 5.180 -22.518 11.023 1.00 0.00 H new ATOM 0 HG3 GLU A 74 5.308 -22.691 12.762 1.00 0.00 H new ATOM 64 N THR A 75 7.622 -18.112 11.073 1.00 0.00 N ATOM 65 CA THR A 75 8.713 -17.154 11.196 1.00 0.00 C ATOM 66 C THR A 75 9.076 -16.919 12.658 1.00 0.00 C ATOM 67 O THR A 75 8.222 -16.569 13.473 1.00 0.00 O ATOM 68 CB THR A 75 8.352 -15.805 10.546 1.00 0.00 C ATOM 69 OG1 THR A 75 9.357 -14.831 10.848 1.00 0.00 O ATOM 70 CG2 THR A 75 6.998 -15.313 11.037 1.00 0.00 C ATOM 0 H THR A 75 6.697 -17.724 11.257 1.00 0.00 H new ATOM 0 HA THR A 75 9.570 -17.582 10.676 1.00 0.00 H new ATOM 0 HB THR A 75 8.299 -15.949 9.467 1.00 0.00 H new ATOM 0 HG1 THR A 75 9.121 -13.977 10.430 1.00 0.00 H new ATOM 0 HG21 THR A 75 6.764 -14.359 10.564 1.00 0.00 H new ATOM 0 HG22 THR A 75 6.230 -16.043 10.780 1.00 0.00 H new ATOM 0 HG23 THR A 75 7.028 -15.184 12.119 1.00 0.00 H new ATOM 78 N THR A 76 10.350 -17.114 12.985 1.00 0.00 N ATOM 79 CA THR A 76 10.826 -16.924 14.349 1.00 0.00 C ATOM 80 C THR A 76 11.277 -15.486 14.579 1.00 0.00 C ATOM 81 O THR A 76 10.945 -14.876 15.595 1.00 0.00 O ATOM 82 CB THR A 76 11.994 -17.875 14.674 1.00 0.00 C ATOM 83 OG1 THR A 76 11.689 -19.198 14.221 1.00 0.00 O ATOM 84 CG2 THR A 76 12.274 -17.897 16.169 1.00 0.00 C ATOM 0 H THR A 76 11.070 -17.403 12.323 1.00 0.00 H new ATOM 0 HA THR A 76 9.989 -17.149 15.010 1.00 0.00 H new ATOM 0 HB THR A 76 12.883 -17.512 14.159 1.00 0.00 H new ATOM 0 HG1 THR A 76 12.437 -19.796 14.430 1.00 0.00 H new ATOM 0 HG21 THR A 76 13.102 -18.575 16.374 1.00 0.00 H new ATOM 0 HG22 THR A 76 12.535 -16.893 16.505 1.00 0.00 H new ATOM 0 HG23 THR A 76 11.386 -18.238 16.701 1.00 0.00 H new ATOM 92 N ASP A 77 12.036 -14.950 13.629 1.00 0.00 N ATOM 93 CA ASP A 77 12.531 -13.582 13.727 1.00 0.00 C ATOM 94 C ASP A 77 11.512 -12.684 14.420 1.00 0.00 C ATOM 95 O ASP A 77 10.324 -12.712 14.097 1.00 0.00 O ATOM 96 CB ASP A 77 12.852 -13.033 12.336 1.00 0.00 C ATOM 97 CG ASP A 77 13.786 -13.937 11.557 1.00 0.00 C ATOM 98 OD1 ASP A 77 14.657 -14.574 12.186 1.00 0.00 O ATOM 99 OD2 ASP A 77 13.646 -14.009 10.319 1.00 0.00 O ATOM 0 H ASP A 77 12.322 -15.442 12.783 1.00 0.00 H new ATOM 0 HA ASP A 77 13.443 -13.593 14.324 1.00 0.00 H new ATOM 0 HB2 ASP A 77 11.925 -12.905 11.777 1.00 0.00 H new ATOM 0 HB3 ASP A 77 13.304 -12.046 12.434 1.00 0.00 H new ATOM 104 N ILE A 78 11.984 -11.889 15.374 1.00 0.00 N ATOM 105 CA ILE A 78 11.113 -10.982 16.113 1.00 0.00 C ATOM 106 C ILE A 78 10.455 -9.971 15.181 1.00 0.00 C ATOM 107 O ILE A 78 9.232 -9.850 15.143 1.00 0.00 O ATOM 108 CB ILE A 78 11.888 -10.226 17.209 1.00 0.00 C ATOM 109 CG1 ILE A 78 12.496 -11.213 18.207 1.00 0.00 C ATOM 110 CG2 ILE A 78 10.972 -9.241 17.920 1.00 0.00 C ATOM 111 CD1 ILE A 78 13.634 -10.630 19.016 1.00 0.00 C ATOM 0 H ILE A 78 12.964 -11.854 15.654 1.00 0.00 H new ATOM 0 HA ILE A 78 10.343 -11.595 16.581 1.00 0.00 H new ATOM 0 HB ILE A 78 12.698 -9.667 16.741 1.00 0.00 H new ATOM 0 HG12 ILE A 78 11.716 -11.557 18.887 1.00 0.00 H new ATOM 0 HG13 ILE A 78 12.856 -12.088 17.667 1.00 0.00 H new ATOM 0 HG21 ILE A 78 11.533 -8.714 18.692 1.00 0.00 H new ATOM 0 HG22 ILE A 78 10.582 -8.522 17.200 1.00 0.00 H new ATOM 0 HG23 ILE A 78 10.143 -9.781 18.379 1.00 0.00 H new ATOM 0 HD11 ILE A 78 14.017 -11.385 19.703 1.00 0.00 H new ATOM 0 HD12 ILE A 78 14.432 -10.312 18.345 1.00 0.00 H new ATOM 0 HD13 ILE A 78 13.274 -9.772 19.584 1.00 0.00 H new ATOM 123 N GLY A 79 11.277 -9.246 14.428 1.00 0.00 N ATOM 124 CA GLY A 79 10.757 -8.255 13.504 1.00 0.00 C ATOM 125 C GLY A 79 11.010 -6.836 13.973 1.00 0.00 C ATOM 126 O GLY A 79 10.255 -6.299 14.783 1.00 0.00 O ATOM 0 H GLY A 79 12.294 -9.327 14.442 1.00 0.00 H new ATOM 0 HA2 GLY A 79 11.216 -8.398 12.526 1.00 0.00 H new ATOM 0 HA3 GLY A 79 9.685 -8.407 13.378 1.00 0.00 H new ATOM 130 N GLY A 80 12.076 -6.227 13.464 1.00 0.00 N ATOM 131 CA GLY A 80 12.408 -4.868 13.849 1.00 0.00 C ATOM 132 C GLY A 80 12.098 -3.863 12.757 1.00 0.00 C ATOM 133 O GLY A 80 12.390 -4.099 11.585 1.00 0.00 O ATOM 0 H GLY A 80 12.716 -6.650 12.792 1.00 0.00 H new ATOM 0 HA2 GLY A 80 11.854 -4.603 14.750 1.00 0.00 H new ATOM 0 HA3 GLY A 80 13.468 -4.813 14.099 1.00 0.00 H new ATOM 137 N GLY A 81 11.501 -2.739 13.141 1.00 0.00 N ATOM 138 CA GLY A 81 11.158 -1.713 12.174 1.00 0.00 C ATOM 139 C GLY A 81 9.935 -2.074 11.354 1.00 0.00 C ATOM 140 O GLY A 81 9.543 -3.239 11.290 1.00 0.00 O ATOM 0 H GLY A 81 11.249 -2.521 14.105 1.00 0.00 H new ATOM 0 HA2 GLY A 81 10.978 -0.773 12.695 1.00 0.00 H new ATOM 0 HA3 GLY A 81 12.004 -1.550 11.506 1.00 0.00 H new ATOM 144 N LYS A 82 9.329 -1.072 10.726 1.00 0.00 N ATOM 145 CA LYS A 82 8.142 -1.289 9.907 1.00 0.00 C ATOM 146 C LYS A 82 8.527 -1.717 8.494 1.00 0.00 C ATOM 147 O LYS A 82 7.806 -1.445 7.534 1.00 0.00 O ATOM 148 CB LYS A 82 7.296 -0.015 9.852 1.00 0.00 C ATOM 149 CG LYS A 82 5.920 -0.224 9.245 1.00 0.00 C ATOM 150 CD LYS A 82 4.909 0.766 9.798 1.00 0.00 C ATOM 151 CE LYS A 82 4.855 2.034 8.960 1.00 0.00 C ATOM 152 NZ LYS A 82 3.857 3.005 9.488 1.00 0.00 N ATOM 0 H LYS A 82 9.640 -0.102 10.768 1.00 0.00 H new ATOM 0 HA LYS A 82 7.557 -2.088 10.363 1.00 0.00 H new ATOM 0 HB2 LYS A 82 7.182 0.379 10.862 1.00 0.00 H new ATOM 0 HB3 LYS A 82 7.828 0.740 9.273 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.979 -0.118 8.162 1.00 0.00 H new ATOM 0 HG3 LYS A 82 5.583 -1.241 9.447 1.00 0.00 H new ATOM 0 HD2 LYS A 82 3.922 0.304 9.824 1.00 0.00 H new ATOM 0 HD3 LYS A 82 5.170 1.019 10.826 1.00 0.00 H new ATOM 0 HE2 LYS A 82 5.840 2.500 8.942 1.00 0.00 H new ATOM 0 HE3 LYS A 82 4.604 1.779 7.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 3.850 3.856 8.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 2.912 2.570 9.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 4.110 3.268 10.462 1.00 0.00 H new ATOM 166 N TYR A 83 9.667 -2.389 8.374 1.00 0.00 N ATOM 167 CA TYR A 83 10.148 -2.854 7.079 1.00 0.00 C ATOM 168 C TYR A 83 10.137 -4.378 7.009 1.00 0.00 C ATOM 169 O TYR A 83 11.063 -5.040 7.481 1.00 0.00 O ATOM 170 CB TYR A 83 11.561 -2.330 6.818 1.00 0.00 C ATOM 171 CG TYR A 83 11.741 -0.871 7.174 1.00 0.00 C ATOM 172 CD1 TYR A 83 10.677 0.019 7.100 1.00 0.00 C ATOM 173 CD2 TYR A 83 12.976 -0.383 7.583 1.00 0.00 C ATOM 174 CE1 TYR A 83 10.837 1.352 7.424 1.00 0.00 C ATOM 175 CE2 TYR A 83 13.145 0.948 7.910 1.00 0.00 C ATOM 176 CZ TYR A 83 12.073 1.812 7.829 1.00 0.00 C ATOM 177 OH TYR A 83 12.238 3.139 8.152 1.00 0.00 O ATOM 0 H TYR A 83 10.275 -2.624 9.159 1.00 0.00 H new ATOM 0 HA TYR A 83 9.477 -2.468 6.311 1.00 0.00 H new ATOM 0 HB2 TYR A 83 12.272 -2.926 7.391 1.00 0.00 H new ATOM 0 HB3 TYR A 83 11.803 -2.471 5.765 1.00 0.00 H new ATOM 0 HD1 TYR A 83 9.708 -0.338 6.784 1.00 0.00 H new ATOM 0 HD2 TYR A 83 13.818 -1.056 7.646 1.00 0.00 H new ATOM 0 HE1 TYR A 83 9.999 2.031 7.361 1.00 0.00 H new ATOM 0 HE2 TYR A 83 14.112 1.310 8.228 1.00 0.00 H new ATOM 0 HH TYR A 83 13.168 3.298 8.418 1.00 0.00 H new ATOM 187 N THR A 84 9.083 -4.929 6.416 1.00 0.00 N ATOM 188 CA THR A 84 8.950 -6.374 6.283 1.00 0.00 C ATOM 189 C THR A 84 9.344 -6.837 4.885 1.00 0.00 C ATOM 190 O THR A 84 9.467 -8.035 4.628 1.00 0.00 O ATOM 191 CB THR A 84 7.510 -6.835 6.577 1.00 0.00 C ATOM 192 OG1 THR A 84 7.378 -8.234 6.303 1.00 0.00 O ATOM 193 CG2 THR A 84 6.510 -6.053 5.739 1.00 0.00 C ATOM 0 H THR A 84 8.309 -4.396 6.020 1.00 0.00 H new ATOM 0 HA THR A 84 9.624 -6.821 7.014 1.00 0.00 H new ATOM 0 HB THR A 84 7.301 -6.650 7.631 1.00 0.00 H new ATOM 0 HG1 THR A 84 8.074 -8.511 5.671 1.00 0.00 H new ATOM 0 HG21 THR A 84 5.500 -6.396 5.964 1.00 0.00 H new ATOM 0 HG22 THR A 84 6.593 -4.991 5.971 1.00 0.00 H new ATOM 0 HG23 THR A 84 6.720 -6.211 4.681 1.00 0.00 H new ATOM 201 N PHE A 85 9.543 -5.880 3.984 1.00 0.00 N ATOM 202 CA PHE A 85 9.923 -6.190 2.611 1.00 0.00 C ATOM 203 C PHE A 85 9.120 -7.372 2.078 1.00 0.00 C ATOM 204 O PHE A 85 9.670 -8.278 1.452 1.00 0.00 O ATOM 205 CB PHE A 85 11.420 -6.499 2.532 1.00 0.00 C ATOM 206 CG PHE A 85 11.921 -6.681 1.128 1.00 0.00 C ATOM 207 CD1 PHE A 85 11.075 -6.494 0.047 1.00 0.00 C ATOM 208 CD2 PHE A 85 13.238 -7.040 0.889 1.00 0.00 C ATOM 209 CE1 PHE A 85 11.532 -6.661 -1.247 1.00 0.00 C ATOM 210 CE2 PHE A 85 13.701 -7.207 -0.402 1.00 0.00 C ATOM 211 CZ PHE A 85 12.847 -7.019 -1.471 1.00 0.00 C ATOM 0 H PHE A 85 9.447 -4.884 4.180 1.00 0.00 H new ATOM 0 HA PHE A 85 9.705 -5.318 1.994 1.00 0.00 H new ATOM 0 HB2 PHE A 85 11.975 -5.689 3.005 1.00 0.00 H new ATOM 0 HB3 PHE A 85 11.627 -7.404 3.103 1.00 0.00 H new ATOM 0 HD1 PHE A 85 10.046 -6.214 0.217 1.00 0.00 H new ATOM 0 HD2 PHE A 85 13.910 -7.191 1.721 1.00 0.00 H new ATOM 0 HE1 PHE A 85 10.862 -6.512 -2.081 1.00 0.00 H new ATOM 0 HE2 PHE A 85 14.730 -7.484 -0.575 1.00 0.00 H new ATOM 0 HZ PHE A 85 13.207 -7.152 -2.481 1.00 0.00 H new ATOM 221 N GLU A 86 7.815 -7.355 2.330 1.00 0.00 N ATOM 222 CA GLU A 86 6.935 -8.426 1.877 1.00 0.00 C ATOM 223 C GLU A 86 5.772 -7.867 1.062 1.00 0.00 C ATOM 224 O GLU A 86 5.049 -8.611 0.398 1.00 0.00 O ATOM 225 CB GLU A 86 6.401 -9.218 3.072 1.00 0.00 C ATOM 226 CG GLU A 86 7.301 -10.367 3.493 1.00 0.00 C ATOM 227 CD GLU A 86 7.617 -11.310 2.348 1.00 0.00 C ATOM 228 OE1 GLU A 86 8.547 -11.010 1.570 1.00 0.00 O ATOM 229 OE2 GLU A 86 6.934 -12.349 2.231 1.00 0.00 O ATOM 0 H GLU A 86 7.344 -6.612 2.845 1.00 0.00 H new ATOM 0 HA GLU A 86 7.515 -9.093 1.239 1.00 0.00 H new ATOM 0 HB2 GLU A 86 6.271 -8.541 3.917 1.00 0.00 H new ATOM 0 HB3 GLU A 86 5.415 -9.612 2.825 1.00 0.00 H new ATOM 0 HG2 GLU A 86 8.231 -9.966 3.896 1.00 0.00 H new ATOM 0 HG3 GLU A 86 6.820 -10.925 4.296 1.00 0.00 H new ATOM 236 N LEU A 87 5.598 -6.551 1.118 1.00 0.00 N ATOM 237 CA LEU A 87 4.523 -5.890 0.386 1.00 0.00 C ATOM 238 C LEU A 87 4.403 -6.449 -1.028 1.00 0.00 C ATOM 239 O LEU A 87 3.301 -6.597 -1.559 1.00 0.00 O ATOM 240 CB LEU A 87 4.769 -4.382 0.331 1.00 0.00 C ATOM 241 CG LEU A 87 5.350 -3.750 1.596 1.00 0.00 C ATOM 242 CD1 LEU A 87 4.807 -4.443 2.836 1.00 0.00 C ATOM 243 CD2 LEU A 87 6.870 -3.809 1.572 1.00 0.00 C ATOM 0 H LEU A 87 6.187 -5.921 1.662 1.00 0.00 H new ATOM 0 HA LEU A 87 3.588 -6.080 0.913 1.00 0.00 H new ATOM 0 HB2 LEU A 87 5.445 -4.174 -0.498 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.824 -3.888 0.103 1.00 0.00 H new ATOM 0 HG LEU A 87 5.048 -2.703 1.628 1.00 0.00 H new ATOM 0 HD11 LEU A 87 5.231 -3.980 3.727 1.00 0.00 H new ATOM 0 HD12 LEU A 87 3.721 -4.348 2.860 1.00 0.00 H new ATOM 0 HD13 LEU A 87 5.078 -5.498 2.811 1.00 0.00 H new ATOM 0 HD21 LEU A 87 7.266 -3.355 2.480 1.00 0.00 H new ATOM 0 HD22 LEU A 87 7.193 -4.849 1.516 1.00 0.00 H new ATOM 0 HD23 LEU A 87 7.242 -3.266 0.703 1.00 0.00 H new ATOM 255 N LYS A 88 5.544 -6.762 -1.634 1.00 0.00 N ATOM 256 CA LYS A 88 5.568 -7.308 -2.986 1.00 0.00 C ATOM 257 C LYS A 88 4.531 -8.415 -3.144 1.00 0.00 C ATOM 258 O LYS A 88 4.641 -9.475 -2.529 1.00 0.00 O ATOM 259 CB LYS A 88 6.961 -7.849 -3.314 1.00 0.00 C ATOM 260 CG LYS A 88 7.313 -7.769 -4.789 1.00 0.00 C ATOM 261 CD LYS A 88 8.442 -8.721 -5.146 1.00 0.00 C ATOM 262 CE LYS A 88 9.273 -8.192 -6.305 1.00 0.00 C ATOM 263 NZ LYS A 88 10.074 -9.268 -6.951 1.00 0.00 N ATOM 0 H LYS A 88 6.464 -6.647 -1.210 1.00 0.00 H new ATOM 0 HA LYS A 88 5.324 -6.504 -3.680 1.00 0.00 H new ATOM 0 HB2 LYS A 88 7.702 -7.291 -2.742 1.00 0.00 H new ATOM 0 HB3 LYS A 88 7.024 -8.888 -2.990 1.00 0.00 H new ATOM 0 HG2 LYS A 88 6.433 -8.006 -5.387 1.00 0.00 H new ATOM 0 HG3 LYS A 88 7.603 -6.749 -5.040 1.00 0.00 H new ATOM 0 HD2 LYS A 88 9.082 -8.870 -4.276 1.00 0.00 H new ATOM 0 HD3 LYS A 88 8.029 -9.695 -5.408 1.00 0.00 H new ATOM 0 HE2 LYS A 88 8.615 -7.735 -7.045 1.00 0.00 H new ATOM 0 HE3 LYS A 88 9.940 -7.409 -5.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 10.626 -8.866 -7.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 10.720 -9.687 -6.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 9.436 -10.003 -7.317 1.00 0.00 H new ATOM 277 N GLY A 89 3.524 -8.162 -3.975 1.00 0.00 N ATOM 278 CA GLY A 89 2.483 -9.148 -4.200 1.00 0.00 C ATOM 279 C GLY A 89 1.207 -8.826 -3.446 1.00 0.00 C ATOM 280 O GLY A 89 0.107 -9.088 -3.932 1.00 0.00 O ATOM 0 H GLY A 89 3.411 -7.292 -4.496 1.00 0.00 H new ATOM 0 HA2 GLY A 89 2.266 -9.206 -5.267 1.00 0.00 H new ATOM 0 HA3 GLY A 89 2.844 -10.130 -3.894 1.00 0.00 H new ATOM 284 N LYS A 90 1.354 -8.258 -2.254 1.00 0.00 N ATOM 285 CA LYS A 90 0.205 -7.900 -1.431 1.00 0.00 C ATOM 286 C LYS A 90 -0.486 -6.653 -1.972 1.00 0.00 C ATOM 287 O LYS A 90 0.131 -5.838 -2.659 1.00 0.00 O ATOM 288 CB LYS A 90 0.643 -7.666 0.017 1.00 0.00 C ATOM 289 CG LYS A 90 1.073 -8.934 0.735 1.00 0.00 C ATOM 290 CD LYS A 90 1.406 -8.663 2.193 1.00 0.00 C ATOM 291 CE LYS A 90 2.019 -9.885 2.860 1.00 0.00 C ATOM 292 NZ LYS A 90 1.911 -9.819 4.344 1.00 0.00 N ATOM 0 H LYS A 90 2.258 -8.036 -1.836 1.00 0.00 H new ATOM 0 HA LYS A 90 -0.504 -8.728 -1.461 1.00 0.00 H new ATOM 0 HB2 LYS A 90 1.469 -6.955 0.027 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -0.179 -7.208 0.567 1.00 0.00 H new ATOM 0 HG2 LYS A 90 0.276 -9.676 0.674 1.00 0.00 H new ATOM 0 HG3 LYS A 90 1.943 -9.359 0.235 1.00 0.00 H new ATOM 0 HD2 LYS A 90 2.099 -7.824 2.259 1.00 0.00 H new ATOM 0 HD3 LYS A 90 0.501 -8.371 2.726 1.00 0.00 H new ATOM 0 HE2 LYS A 90 1.520 -10.784 2.499 1.00 0.00 H new ATOM 0 HE3 LYS A 90 3.068 -9.966 2.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 2.340 -10.669 4.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 2.409 -8.974 4.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 0.909 -9.767 4.617 1.00 0.00 H new ATOM 306 N VAL A 91 -1.769 -6.508 -1.657 1.00 0.00 N ATOM 307 CA VAL A 91 -2.542 -5.358 -2.110 1.00 0.00 C ATOM 308 C VAL A 91 -3.001 -4.506 -0.931 1.00 0.00 C ATOM 309 O VAL A 91 -3.436 -5.028 0.094 1.00 0.00 O ATOM 310 CB VAL A 91 -3.775 -5.796 -2.923 1.00 0.00 C ATOM 311 CG1 VAL A 91 -4.691 -6.668 -2.077 1.00 0.00 C ATOM 312 CG2 VAL A 91 -4.522 -4.581 -3.453 1.00 0.00 C ATOM 0 H VAL A 91 -2.295 -7.173 -1.090 1.00 0.00 H new ATOM 0 HA VAL A 91 -1.886 -4.767 -2.749 1.00 0.00 H new ATOM 0 HB VAL A 91 -3.436 -6.386 -3.774 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -5.556 -6.968 -2.668 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -4.149 -7.556 -1.751 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -5.025 -6.106 -1.205 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.390 -4.909 -4.025 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -4.850 -3.963 -2.617 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -3.862 -4.000 -4.097 1.00 0.00 H new ATOM 322 N GLY A 92 -2.901 -3.189 -1.086 1.00 0.00 N ATOM 323 CA GLY A 92 -3.309 -2.285 -0.027 1.00 0.00 C ATOM 324 C GLY A 92 -4.414 -1.343 -0.463 1.00 0.00 C ATOM 325 O GLY A 92 -5.045 -1.551 -1.500 1.00 0.00 O ATOM 0 H GLY A 92 -2.545 -2.733 -1.926 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -3.648 -2.865 0.831 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -2.448 -1.703 0.302 1.00 0.00 H new ATOM 329 N LYS A 93 -4.651 -0.304 0.330 1.00 0.00 N ATOM 330 CA LYS A 93 -5.688 0.674 0.022 1.00 0.00 C ATOM 331 C LYS A 93 -5.125 2.091 0.049 1.00 0.00 C ATOM 332 O LYS A 93 -4.538 2.518 1.044 1.00 0.00 O ATOM 333 CB LYS A 93 -6.844 0.554 1.018 1.00 0.00 C ATOM 334 CG LYS A 93 -8.153 1.125 0.503 1.00 0.00 C ATOM 335 CD LYS A 93 -9.019 1.646 1.637 1.00 0.00 C ATOM 336 CE LYS A 93 -9.887 0.544 2.226 1.00 0.00 C ATOM 337 NZ LYS A 93 -9.166 -0.229 3.275 1.00 0.00 N ATOM 0 H LYS A 93 -4.138 -0.117 1.192 1.00 0.00 H new ATOM 0 HA LYS A 93 -6.059 0.468 -0.982 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -6.989 -0.497 1.268 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -6.572 1.066 1.941 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -7.947 1.933 -0.199 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -8.696 0.355 -0.046 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -8.385 2.067 2.417 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -9.653 2.454 1.271 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -10.789 0.982 2.653 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -10.205 -0.131 1.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -9.842 -0.828 3.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -8.442 -0.828 2.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -8.710 0.429 3.939 1.00 0.00 H new ATOM 351 N VAL A 94 -5.308 2.817 -1.049 1.00 0.00 N ATOM 352 CA VAL A 94 -4.820 4.187 -1.150 1.00 0.00 C ATOM 353 C VAL A 94 -5.498 5.089 -0.125 1.00 0.00 C ATOM 354 O VAL A 94 -6.631 5.528 -0.322 1.00 0.00 O ATOM 355 CB VAL A 94 -5.053 4.764 -2.559 1.00 0.00 C ATOM 356 CG1 VAL A 94 -4.024 4.219 -3.537 1.00 0.00 C ATOM 357 CG2 VAL A 94 -6.466 4.457 -3.032 1.00 0.00 C ATOM 0 H VAL A 94 -5.791 2.479 -1.881 1.00 0.00 H new ATOM 0 HA VAL A 94 -3.749 4.156 -0.951 1.00 0.00 H new ATOM 0 HB VAL A 94 -4.936 5.847 -2.513 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -4.205 4.638 -4.527 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -3.024 4.495 -3.204 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -4.105 3.133 -3.583 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.614 4.872 -4.029 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -6.613 3.377 -3.062 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -7.185 4.902 -2.344 1.00 0.00 H new ATOM 367 N VAL A 95 -4.797 5.362 0.971 1.00 0.00 N ATOM 368 CA VAL A 95 -5.331 6.213 2.028 1.00 0.00 C ATOM 369 C VAL A 95 -5.207 7.687 1.662 1.00 0.00 C ATOM 370 O VAL A 95 -5.984 8.522 2.125 1.00 0.00 O ATOM 371 CB VAL A 95 -4.609 5.965 3.366 1.00 0.00 C ATOM 372 CG1 VAL A 95 -4.874 4.552 3.862 1.00 0.00 C ATOM 373 CG2 VAL A 95 -3.116 6.216 3.220 1.00 0.00 C ATOM 0 H VAL A 95 -3.858 5.006 1.150 1.00 0.00 H new ATOM 0 HA VAL A 95 -6.385 5.957 2.139 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.001 6.663 4.105 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -4.356 4.395 4.808 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.945 4.412 4.007 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -4.511 3.834 3.126 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.622 6.036 4.175 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.706 5.543 2.467 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -2.949 7.249 2.914 1.00 0.00 H new ATOM 383 N LYS A 96 -4.223 8.002 0.826 1.00 0.00 N ATOM 384 CA LYS A 96 -3.996 9.377 0.394 1.00 0.00 C ATOM 385 C LYS A 96 -3.024 9.424 -0.780 1.00 0.00 C ATOM 386 O LYS A 96 -2.196 8.528 -0.950 1.00 0.00 O ATOM 387 CB LYS A 96 -3.453 10.214 1.554 1.00 0.00 C ATOM 388 CG LYS A 96 -3.698 11.705 1.395 1.00 0.00 C ATOM 389 CD LYS A 96 -3.204 12.483 2.603 1.00 0.00 C ATOM 390 CE LYS A 96 -2.788 13.896 2.224 1.00 0.00 C ATOM 391 NZ LYS A 96 -3.965 14.767 1.954 1.00 0.00 N ATOM 0 H LYS A 96 -3.570 7.324 0.434 1.00 0.00 H new ATOM 0 HA LYS A 96 -4.950 9.793 0.070 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -3.914 9.876 2.482 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -2.381 10.038 1.647 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -3.193 12.064 0.498 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -4.764 11.887 1.255 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -3.990 12.524 3.357 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -2.359 11.962 3.052 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -2.194 14.328 3.029 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -2.151 13.862 1.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -3.639 15.721 1.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -4.519 14.369 1.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -4.560 14.820 2.805 1.00 0.00 H new ATOM 405 N ILE A 97 -3.128 10.475 -1.586 1.00 0.00 N ATOM 406 CA ILE A 97 -2.256 10.640 -2.743 1.00 0.00 C ATOM 407 C ILE A 97 -1.538 11.985 -2.703 1.00 0.00 C ATOM 408 O ILE A 97 -2.137 13.010 -2.379 1.00 0.00 O ATOM 409 CB ILE A 97 -3.044 10.531 -4.062 1.00 0.00 C ATOM 410 CG1 ILE A 97 -3.562 9.104 -4.254 1.00 0.00 C ATOM 411 CG2 ILE A 97 -2.170 10.945 -5.236 1.00 0.00 C ATOM 412 CD1 ILE A 97 -4.933 8.874 -3.657 1.00 0.00 C ATOM 0 H ILE A 97 -3.807 11.225 -1.459 1.00 0.00 H new ATOM 0 HA ILE A 97 -1.521 9.837 -2.701 1.00 0.00 H new ATOM 0 HB ILE A 97 -3.899 11.205 -4.015 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -3.596 8.879 -5.320 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -2.856 8.406 -3.803 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -2.741 10.863 -6.161 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -1.844 11.976 -5.101 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -1.298 10.293 -5.288 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -5.237 7.842 -3.830 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -4.900 9.067 -2.585 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -5.651 9.547 -4.125 1.00 0.00 H new ATOM 424 N ALA A 98 -0.251 11.972 -3.035 1.00 0.00 N ATOM 425 CA ALA A 98 0.548 13.191 -3.041 1.00 0.00 C ATOM 426 C ALA A 98 1.577 13.167 -4.166 1.00 0.00 C ATOM 427 O ALA A 98 2.300 12.187 -4.337 1.00 0.00 O ATOM 428 CB ALA A 98 1.237 13.377 -1.697 1.00 0.00 C ATOM 0 H ALA A 98 0.260 11.131 -3.303 1.00 0.00 H new ATOM 0 HA ALA A 98 -0.121 14.034 -3.214 1.00 0.00 H new ATOM 0 HB1 ALA A 98 1.830 14.291 -1.716 1.00 0.00 H new ATOM 0 HB2 ALA A 98 0.486 13.448 -0.910 1.00 0.00 H new ATOM 0 HB3 ALA A 98 1.889 12.526 -1.501 1.00 0.00 H new ATOM 434 N GLU A 99 1.636 14.253 -4.931 1.00 0.00 N ATOM 435 CA GLU A 99 2.577 14.355 -6.041 1.00 0.00 C ATOM 436 C GLU A 99 3.955 13.840 -5.635 1.00 0.00 C ATOM 437 O GLU A 99 4.534 12.988 -6.308 1.00 0.00 O ATOM 438 CB GLU A 99 2.682 15.805 -6.518 1.00 0.00 C ATOM 439 CG GLU A 99 3.003 15.936 -7.997 1.00 0.00 C ATOM 440 CD GLU A 99 1.834 15.556 -8.884 1.00 0.00 C ATOM 441 OE1 GLU A 99 0.677 15.774 -8.466 1.00 0.00 O ATOM 442 OE2 GLU A 99 2.074 15.041 -9.996 1.00 0.00 O ATOM 0 H GLU A 99 1.044 15.074 -4.803 1.00 0.00 H new ATOM 0 HA GLU A 99 2.204 13.738 -6.858 1.00 0.00 H new ATOM 0 HB2 GLU A 99 1.741 16.316 -6.312 1.00 0.00 H new ATOM 0 HB3 GLU A 99 3.454 16.314 -5.941 1.00 0.00 H new ATOM 0 HG2 GLU A 99 3.298 16.963 -8.211 1.00 0.00 H new ATOM 0 HG3 GLU A 99 3.857 15.303 -8.237 1.00 0.00 H new ATOM 449 N ASP A 100 4.474 14.365 -4.530 1.00 0.00 N ATOM 450 CA ASP A 100 5.783 13.959 -4.033 1.00 0.00 C ATOM 451 C ASP A 100 5.824 12.456 -3.772 1.00 0.00 C ATOM 452 O ASP A 100 6.827 11.795 -4.041 1.00 0.00 O ATOM 453 CB ASP A 100 6.125 14.721 -2.752 1.00 0.00 C ATOM 454 CG ASP A 100 6.177 16.221 -2.967 1.00 0.00 C ATOM 455 OD1 ASP A 100 5.231 16.767 -3.573 1.00 0.00 O ATOM 456 OD2 ASP A 100 7.163 16.849 -2.530 1.00 0.00 O ATOM 0 H ASP A 100 4.008 15.072 -3.962 1.00 0.00 H new ATOM 0 HA ASP A 100 6.523 14.197 -4.797 1.00 0.00 H new ATOM 0 HB2 ASP A 100 5.383 14.492 -1.987 1.00 0.00 H new ATOM 0 HB3 ASP A 100 7.088 14.377 -2.374 1.00 0.00 H new ATOM 461 N HIS A 101 4.726 11.923 -3.244 1.00 0.00 N ATOM 462 CA HIS A 101 4.636 10.498 -2.946 1.00 0.00 C ATOM 463 C HIS A 101 3.203 10.105 -2.598 1.00 0.00 C ATOM 464 O HIS A 101 2.425 10.926 -2.112 1.00 0.00 O ATOM 465 CB HIS A 101 5.571 10.137 -1.792 1.00 0.00 C ATOM 466 CG HIS A 101 5.172 10.748 -0.484 1.00 0.00 C ATOM 467 ND1 HIS A 101 5.332 12.087 -0.199 1.00 0.00 N ATOM 468 CD2 HIS A 101 4.615 10.194 0.619 1.00 0.00 C ATOM 469 CE1 HIS A 101 4.892 12.331 1.022 1.00 0.00 C ATOM 470 NE2 HIS A 101 4.452 11.199 1.540 1.00 0.00 N ATOM 0 H HIS A 101 3.887 12.456 -3.014 1.00 0.00 H new ATOM 0 HA HIS A 101 4.939 9.946 -3.836 1.00 0.00 H new ATOM 0 HB2 HIS A 101 5.599 9.053 -1.684 1.00 0.00 H new ATOM 0 HB3 HIS A 101 6.582 10.459 -2.040 1.00 0.00 H new ATOM 0 HD2 HIS A 101 4.349 9.156 0.750 1.00 0.00 H new ATOM 0 HE1 HIS A 101 4.892 13.293 1.513 1.00 0.00 H new ATOM 0 HE2 HIS A 101 4.055 11.089 2.473 1.00 0.00 H new ATOM 479 N TYR A 102 2.862 8.847 -2.850 1.00 0.00 N ATOM 480 CA TYR A 102 1.522 8.346 -2.566 1.00 0.00 C ATOM 481 C TYR A 102 1.498 7.570 -1.253 1.00 0.00 C ATOM 482 O TYR A 102 2.466 6.897 -0.897 1.00 0.00 O ATOM 483 CB TYR A 102 1.036 7.453 -3.708 1.00 0.00 C ATOM 484 CG TYR A 102 0.972 8.159 -5.044 1.00 0.00 C ATOM 485 CD1 TYR A 102 2.108 8.728 -5.606 1.00 0.00 C ATOM 486 CD2 TYR A 102 -0.224 8.255 -5.744 1.00 0.00 C ATOM 487 CE1 TYR A 102 2.053 9.375 -6.826 1.00 0.00 C ATOM 488 CE2 TYR A 102 -0.288 8.899 -6.965 1.00 0.00 C ATOM 489 CZ TYR A 102 0.853 9.457 -7.501 1.00 0.00 C ATOM 490 OH TYR A 102 0.795 10.099 -8.717 1.00 0.00 O ATOM 0 H TYR A 102 3.495 8.155 -3.251 1.00 0.00 H new ATOM 0 HA TYR A 102 0.854 9.202 -2.474 1.00 0.00 H new ATOM 0 HB2 TYR A 102 1.700 6.592 -3.793 1.00 0.00 H new ATOM 0 HB3 TYR A 102 0.046 7.069 -3.462 1.00 0.00 H new ATOM 0 HD1 TYR A 102 3.050 8.664 -5.081 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -1.119 7.819 -5.327 1.00 0.00 H new ATOM 0 HE1 TYR A 102 2.945 9.814 -7.248 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -1.226 8.965 -7.496 1.00 0.00 H new ATOM 0 HH TYR A 102 1.092 9.488 -9.424 1.00 0.00 H new ATOM 500 N LEU A 103 0.383 7.668 -0.536 1.00 0.00 N ATOM 501 CA LEU A 103 0.230 6.975 0.738 1.00 0.00 C ATOM 502 C LEU A 103 -0.641 5.733 0.581 1.00 0.00 C ATOM 503 O LEU A 103 -1.864 5.827 0.482 1.00 0.00 O ATOM 504 CB LEU A 103 -0.383 7.913 1.780 1.00 0.00 C ATOM 505 CG LEU A 103 0.605 8.730 2.612 1.00 0.00 C ATOM 506 CD1 LEU A 103 1.633 7.819 3.266 1.00 0.00 C ATOM 507 CD2 LEU A 103 1.291 9.778 1.748 1.00 0.00 C ATOM 0 H LEU A 103 -0.428 8.220 -0.816 1.00 0.00 H new ATOM 0 HA LEU A 103 1.218 6.663 1.075 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.054 8.603 1.268 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.995 7.319 2.459 1.00 0.00 H new ATOM 0 HG LEU A 103 0.051 9.243 3.399 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.328 8.418 3.854 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.126 7.107 3.918 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.182 7.278 2.495 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.991 10.350 2.357 1.00 0.00 H new ATOM 0 HD22 LEU A 103 1.832 9.286 0.940 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.543 10.450 1.328 1.00 0.00 H new ATOM 519 N VAL A 104 -0.001 4.567 0.561 1.00 0.00 N ATOM 520 CA VAL A 104 -0.717 3.305 0.419 1.00 0.00 C ATOM 521 C VAL A 104 -0.642 2.484 1.701 1.00 0.00 C ATOM 522 O VAL A 104 0.441 2.240 2.231 1.00 0.00 O ATOM 523 CB VAL A 104 -0.156 2.469 -0.746 1.00 0.00 C ATOM 524 CG1 VAL A 104 -1.242 1.589 -1.345 1.00 0.00 C ATOM 525 CG2 VAL A 104 0.453 3.375 -1.806 1.00 0.00 C ATOM 0 H VAL A 104 1.011 4.471 0.641 1.00 0.00 H new ATOM 0 HA VAL A 104 -1.758 3.553 0.210 1.00 0.00 H new ATOM 0 HB VAL A 104 0.630 1.820 -0.359 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -0.826 1.006 -2.167 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -1.627 0.915 -0.580 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -2.053 2.215 -1.718 1.00 0.00 H new ATOM 0 HG21 VAL A 104 0.845 2.768 -2.622 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -0.312 4.050 -2.191 1.00 0.00 H new ATOM 0 HG23 VAL A 104 1.263 3.957 -1.366 1.00 0.00 H new ATOM 535 N GLU A 105 -1.801 2.059 2.194 1.00 0.00 N ATOM 536 CA GLU A 105 -1.867 1.265 3.416 1.00 0.00 C ATOM 537 C GLU A 105 -1.784 -0.226 3.100 1.00 0.00 C ATOM 538 O GLU A 105 -2.741 -0.821 2.604 1.00 0.00 O ATOM 539 CB GLU A 105 -3.159 1.566 4.178 1.00 0.00 C ATOM 540 CG GLU A 105 -3.307 0.769 5.463 1.00 0.00 C ATOM 541 CD GLU A 105 -4.736 0.739 5.970 1.00 0.00 C ATOM 542 OE1 GLU A 105 -5.657 0.972 5.159 1.00 0.00 O ATOM 543 OE2 GLU A 105 -4.933 0.484 7.176 1.00 0.00 O ATOM 0 H GLU A 105 -2.707 2.251 1.766 1.00 0.00 H new ATOM 0 HA GLU A 105 -1.016 1.535 4.041 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -3.192 2.630 4.414 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -4.010 1.356 3.530 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -2.964 -0.252 5.295 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -2.663 1.200 6.229 1.00 0.00 H new ATOM 550 N VAL A 106 -0.633 -0.823 3.392 1.00 0.00 N ATOM 551 CA VAL A 106 -0.424 -2.244 3.140 1.00 0.00 C ATOM 552 C VAL A 106 -0.409 -3.037 4.443 1.00 0.00 C ATOM 553 O VAL A 106 0.481 -2.864 5.274 1.00 0.00 O ATOM 554 CB VAL A 106 0.895 -2.493 2.385 1.00 0.00 C ATOM 555 CG1 VAL A 106 1.059 -3.972 2.070 1.00 0.00 C ATOM 556 CG2 VAL A 106 0.946 -1.659 1.114 1.00 0.00 C ATOM 0 H VAL A 106 0.169 -0.345 3.803 1.00 0.00 H new ATOM 0 HA VAL A 106 -1.256 -2.581 2.522 1.00 0.00 H new ATOM 0 HB VAL A 106 1.723 -2.189 3.025 1.00 0.00 H new ATOM 0 HG11 VAL A 106 1.997 -4.129 1.536 1.00 0.00 H new ATOM 0 HG12 VAL A 106 1.070 -4.543 2.999 1.00 0.00 H new ATOM 0 HG13 VAL A 106 0.228 -4.306 1.449 1.00 0.00 H new ATOM 0 HG21 VAL A 106 1.885 -1.847 0.593 1.00 0.00 H new ATOM 0 HG22 VAL A 106 0.111 -1.930 0.467 1.00 0.00 H new ATOM 0 HG23 VAL A 106 0.879 -0.602 1.370 1.00 0.00 H new ATOM 566 N GLU A 107 -1.401 -3.906 4.612 1.00 0.00 N ATOM 567 CA GLU A 107 -1.500 -4.725 5.814 1.00 0.00 C ATOM 568 C GLU A 107 -1.672 -3.852 7.054 1.00 0.00 C ATOM 569 O GLU A 107 -1.217 -4.203 8.142 1.00 0.00 O ATOM 570 CB GLU A 107 -0.257 -5.604 5.964 1.00 0.00 C ATOM 571 CG GLU A 107 -0.190 -6.739 4.957 1.00 0.00 C ATOM 572 CD GLU A 107 -1.294 -7.760 5.153 1.00 0.00 C ATOM 573 OE1 GLU A 107 -1.289 -8.447 6.196 1.00 0.00 O ATOM 574 OE2 GLU A 107 -2.163 -7.872 4.263 1.00 0.00 O ATOM 0 H GLU A 107 -2.146 -4.061 3.933 1.00 0.00 H new ATOM 0 HA GLU A 107 -2.377 -5.364 5.716 1.00 0.00 H new ATOM 0 HB2 GLU A 107 0.632 -4.983 5.858 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -0.236 -6.021 6.971 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -0.254 -6.329 3.949 1.00 0.00 H new ATOM 0 HG3 GLU A 107 0.777 -7.235 5.039 1.00 0.00 H new ATOM 581 N GLY A 108 -2.332 -2.711 6.881 1.00 0.00 N ATOM 582 CA GLY A 108 -2.552 -1.805 7.993 1.00 0.00 C ATOM 583 C GLY A 108 -1.312 -1.007 8.345 1.00 0.00 C ATOM 584 O GLY A 108 -1.084 -0.684 9.510 1.00 0.00 O ATOM 0 H GLY A 108 -2.718 -2.398 5.990 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -3.363 -1.120 7.745 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -2.873 -2.376 8.865 1.00 0.00 H new ATOM 588 N ASP A 109 -0.509 -0.689 7.335 1.00 0.00 N ATOM 589 CA ASP A 109 0.714 0.076 7.543 1.00 0.00 C ATOM 590 C ASP A 109 0.990 0.994 6.356 1.00 0.00 C ATOM 591 O ASP A 109 1.220 0.530 5.239 1.00 0.00 O ATOM 592 CB ASP A 109 1.899 -0.866 7.761 1.00 0.00 C ATOM 593 CG ASP A 109 1.999 -1.349 9.195 1.00 0.00 C ATOM 594 OD1 ASP A 109 1.558 -0.612 10.102 1.00 0.00 O ATOM 595 OD2 ASP A 109 2.517 -2.465 9.410 1.00 0.00 O ATOM 0 H ASP A 109 -0.684 -0.949 6.364 1.00 0.00 H new ATOM 0 HA ASP A 109 0.581 0.692 8.432 1.00 0.00 H new ATOM 0 HB2 ASP A 109 1.803 -1.725 7.097 1.00 0.00 H new ATOM 0 HB3 ASP A 109 2.822 -0.354 7.488 1.00 0.00 H new ATOM 600 N LYS A 110 0.965 2.299 6.606 1.00 0.00 N ATOM 601 CA LYS A 110 1.211 3.283 5.559 1.00 0.00 C ATOM 602 C LYS A 110 2.585 3.075 4.929 1.00 0.00 C ATOM 603 O LYS A 110 3.556 2.771 5.622 1.00 0.00 O ATOM 604 CB LYS A 110 1.108 4.700 6.128 1.00 0.00 C ATOM 605 CG LYS A 110 -0.288 5.066 6.599 1.00 0.00 C ATOM 606 CD LYS A 110 -0.530 6.564 6.516 1.00 0.00 C ATOM 607 CE LYS A 110 -2.003 6.902 6.689 1.00 0.00 C ATOM 608 NZ LYS A 110 -2.338 8.233 6.113 1.00 0.00 N ATOM 0 H LYS A 110 0.777 2.699 7.525 1.00 0.00 H new ATOM 0 HA LYS A 110 0.453 3.152 4.787 1.00 0.00 H new ATOM 0 HB2 LYS A 110 1.802 4.798 6.963 1.00 0.00 H new ATOM 0 HB3 LYS A 110 1.424 5.412 5.366 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -1.027 4.543 5.992 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -0.426 4.731 7.627 1.00 0.00 H new ATOM 0 HD2 LYS A 110 0.053 7.071 7.285 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -0.181 6.937 5.553 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -2.610 6.135 6.208 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -2.256 6.891 7.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -3.351 8.426 6.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -1.777 8.968 6.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -2.121 8.236 5.096 1.00 0.00 H new ATOM 622 N TRP A 111 2.660 3.243 3.614 1.00 0.00 N ATOM 623 CA TRP A 111 3.916 3.075 2.892 1.00 0.00 C ATOM 624 C TRP A 111 4.181 4.265 1.976 1.00 0.00 C ATOM 625 O TRP A 111 3.378 5.196 1.905 1.00 0.00 O ATOM 626 CB TRP A 111 3.889 1.783 2.075 1.00 0.00 C ATOM 627 CG TRP A 111 4.023 0.547 2.912 1.00 0.00 C ATOM 628 CD1 TRP A 111 3.010 -0.242 3.378 1.00 0.00 C ATOM 629 CD2 TRP A 111 5.241 -0.040 3.385 1.00 0.00 C ATOM 630 NE1 TRP A 111 3.524 -1.283 4.112 1.00 0.00 N ATOM 631 CE2 TRP A 111 4.890 -1.183 4.130 1.00 0.00 C ATOM 632 CE3 TRP A 111 6.592 0.288 3.249 1.00 0.00 C ATOM 633 CZ2 TRP A 111 5.843 -1.996 4.737 1.00 0.00 C ATOM 634 CZ3 TRP A 111 7.537 -0.520 3.853 1.00 0.00 C ATOM 635 CH2 TRP A 111 7.159 -1.652 4.588 1.00 0.00 C ATOM 0 H TRP A 111 1.866 3.495 3.026 1.00 0.00 H new ATOM 0 HA TRP A 111 4.722 3.017 3.624 1.00 0.00 H new ATOM 0 HB2 TRP A 111 2.955 1.735 1.516 1.00 0.00 H new ATOM 0 HB3 TRP A 111 4.697 1.807 1.344 1.00 0.00 H new ATOM 0 HD1 TRP A 111 1.959 -0.072 3.196 1.00 0.00 H new ATOM 0 HE1 TRP A 111 2.977 -2.012 4.570 1.00 0.00 H new ATOM 0 HE3 TRP A 111 6.893 1.157 2.682 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 5.554 -2.868 5.306 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 8.584 -0.275 3.757 1.00 0.00 H new ATOM 0 HH2 TRP A 111 7.921 -2.265 5.046 1.00 0.00 H new ATOM 646 N ILE A 112 5.310 4.228 1.277 1.00 0.00 N ATOM 647 CA ILE A 112 5.679 5.304 0.365 1.00 0.00 C ATOM 648 C ILE A 112 5.881 4.778 -1.052 1.00 0.00 C ATOM 649 O ILE A 112 6.942 4.250 -1.384 1.00 0.00 O ATOM 650 CB ILE A 112 6.965 6.016 0.825 1.00 0.00 C ATOM 651 CG1 ILE A 112 6.792 6.564 2.243 1.00 0.00 C ATOM 652 CG2 ILE A 112 7.325 7.134 -0.141 1.00 0.00 C ATOM 653 CD1 ILE A 112 6.928 5.510 3.319 1.00 0.00 C ATOM 0 H ILE A 112 5.985 3.465 1.324 1.00 0.00 H new ATOM 0 HA ILE A 112 4.856 6.019 0.371 1.00 0.00 H new ATOM 0 HB ILE A 112 7.780 5.293 0.833 1.00 0.00 H new ATOM 0 HG12 ILE A 112 7.533 7.345 2.415 1.00 0.00 H new ATOM 0 HG13 ILE A 112 5.811 7.032 2.326 1.00 0.00 H new ATOM 0 HG21 ILE A 112 8.236 7.628 0.197 1.00 0.00 H new ATOM 0 HG22 ILE A 112 7.486 6.718 -1.136 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.512 7.859 -0.178 1.00 0.00 H new ATOM 0 HD11 ILE A 112 6.794 5.970 4.298 1.00 0.00 H new ATOM 0 HD12 ILE A 112 6.170 4.741 3.173 1.00 0.00 H new ATOM 0 HD13 ILE A 112 7.919 5.059 3.263 1.00 0.00 H new ATOM 665 N ALA A 113 4.856 4.928 -1.884 1.00 0.00 N ATOM 666 CA ALA A 113 4.922 4.471 -3.267 1.00 0.00 C ATOM 667 C ALA A 113 4.468 5.565 -4.228 1.00 0.00 C ATOM 668 O ALA A 113 3.906 6.578 -3.811 1.00 0.00 O ATOM 669 CB ALA A 113 4.075 3.220 -3.451 1.00 0.00 C ATOM 0 H ALA A 113 3.970 5.362 -1.625 1.00 0.00 H new ATOM 0 HA ALA A 113 5.960 4.230 -3.495 1.00 0.00 H new ATOM 0 HB1 ALA A 113 4.134 2.890 -4.488 1.00 0.00 H new ATOM 0 HB2 ALA A 113 4.446 2.430 -2.798 1.00 0.00 H new ATOM 0 HB3 ALA A 113 3.038 3.442 -3.199 1.00 0.00 H new ATOM 675 N TYR A 114 4.717 5.355 -5.516 1.00 0.00 N ATOM 676 CA TYR A 114 4.338 6.325 -6.536 1.00 0.00 C ATOM 677 C TYR A 114 3.598 5.646 -7.685 1.00 0.00 C ATOM 678 O TYR A 114 3.942 4.535 -8.089 1.00 0.00 O ATOM 679 CB TYR A 114 5.576 7.048 -7.068 1.00 0.00 C ATOM 680 CG TYR A 114 6.752 6.131 -7.319 1.00 0.00 C ATOM 681 CD1 TYR A 114 7.494 5.616 -6.263 1.00 0.00 C ATOM 682 CD2 TYR A 114 7.122 5.780 -8.611 1.00 0.00 C ATOM 683 CE1 TYR A 114 8.569 4.779 -6.487 1.00 0.00 C ATOM 684 CE2 TYR A 114 8.195 4.942 -8.845 1.00 0.00 C ATOM 685 CZ TYR A 114 8.915 4.444 -7.779 1.00 0.00 C ATOM 686 OH TYR A 114 9.986 3.610 -8.008 1.00 0.00 O ATOM 0 H TYR A 114 5.180 4.521 -5.878 1.00 0.00 H new ATOM 0 HA TYR A 114 3.670 7.054 -6.077 1.00 0.00 H new ATOM 0 HB2 TYR A 114 5.318 7.557 -7.997 1.00 0.00 H new ATOM 0 HB3 TYR A 114 5.872 7.817 -6.355 1.00 0.00 H new ATOM 0 HD1 TYR A 114 7.225 5.875 -5.250 1.00 0.00 H new ATOM 0 HD2 TYR A 114 6.561 6.169 -9.448 1.00 0.00 H new ATOM 0 HE1 TYR A 114 9.136 4.389 -5.655 1.00 0.00 H new ATOM 0 HE2 TYR A 114 8.468 4.678 -9.856 1.00 0.00 H new ATOM 0 HH TYR A 114 10.094 3.474 -8.972 1.00 0.00 H new ATOM 696 N SER A 115 2.581 6.323 -8.208 1.00 0.00 N ATOM 697 CA SER A 115 1.790 5.786 -9.309 1.00 0.00 C ATOM 698 C SER A 115 1.837 6.716 -10.517 1.00 0.00 C ATOM 699 O SER A 115 1.733 7.935 -10.379 1.00 0.00 O ATOM 700 CB SER A 115 0.340 5.576 -8.868 1.00 0.00 C ATOM 701 OG SER A 115 -0.380 6.796 -8.887 1.00 0.00 O ATOM 0 H SER A 115 2.285 7.245 -7.887 1.00 0.00 H new ATOM 0 HA SER A 115 2.218 4.825 -9.596 1.00 0.00 H new ATOM 0 HB2 SER A 115 -0.143 4.855 -9.527 1.00 0.00 H new ATOM 0 HB3 SER A 115 0.320 5.154 -7.863 1.00 0.00 H new ATOM 0 HG SER A 115 0.091 7.462 -8.344 1.00 0.00 H new ATOM 707 N ASP A 116 1.995 6.132 -11.699 1.00 0.00 N ATOM 708 CA ASP A 116 2.055 6.908 -12.933 1.00 0.00 C ATOM 709 C ASP A 116 0.676 7.446 -13.304 1.00 0.00 C ATOM 710 O ASP A 116 0.559 8.405 -14.065 1.00 0.00 O ATOM 711 CB ASP A 116 2.605 6.050 -14.073 1.00 0.00 C ATOM 712 CG ASP A 116 4.102 5.832 -13.964 1.00 0.00 C ATOM 713 OD1 ASP A 116 4.812 6.780 -13.569 1.00 0.00 O ATOM 714 OD2 ASP A 116 4.563 4.713 -14.273 1.00 0.00 O ATOM 0 H ASP A 116 2.084 5.124 -11.830 1.00 0.00 H new ATOM 0 HA ASP A 116 2.723 7.754 -12.770 1.00 0.00 H new ATOM 0 HB2 ASP A 116 2.099 5.084 -14.074 1.00 0.00 H new ATOM 0 HB3 ASP A 116 2.379 6.529 -15.026 1.00 0.00 H new ATOM 719 N GLU A 117 -0.363 6.819 -12.762 1.00 0.00 N ATOM 720 CA GLU A 117 -1.734 7.234 -13.039 1.00 0.00 C ATOM 721 C GLU A 117 -2.423 7.717 -11.766 1.00 0.00 C ATOM 722 O GLU A 117 -2.700 6.932 -10.859 1.00 0.00 O ATOM 723 CB GLU A 117 -2.526 6.078 -13.653 1.00 0.00 C ATOM 724 CG GLU A 117 -1.977 5.607 -14.990 1.00 0.00 C ATOM 725 CD GLU A 117 -2.423 4.201 -15.340 1.00 0.00 C ATOM 726 OE1 GLU A 117 -3.463 3.758 -14.810 1.00 0.00 O ATOM 727 OE2 GLU A 117 -1.732 3.543 -16.146 1.00 0.00 O ATOM 0 H GLU A 117 -0.282 6.023 -12.129 1.00 0.00 H new ATOM 0 HA GLU A 117 -1.700 8.060 -13.750 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -2.530 5.240 -12.956 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -3.563 6.388 -13.784 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -2.300 6.292 -15.773 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -0.888 5.643 -14.965 1.00 0.00 H new ATOM 734 N LYS A 118 -2.696 9.016 -11.705 1.00 0.00 N ATOM 735 CA LYS A 118 -3.353 9.607 -10.545 1.00 0.00 C ATOM 736 C LYS A 118 -4.442 8.684 -10.008 1.00 0.00 C ATOM 737 O LYS A 118 -5.542 8.617 -10.560 1.00 0.00 O ATOM 738 CB LYS A 118 -3.956 10.965 -10.911 1.00 0.00 C ATOM 739 CG LYS A 118 -2.916 12.038 -11.186 1.00 0.00 C ATOM 740 CD LYS A 118 -3.462 13.123 -12.098 1.00 0.00 C ATOM 741 CE LYS A 118 -3.363 12.724 -13.562 1.00 0.00 C ATOM 742 NZ LYS A 118 -3.769 13.833 -14.469 1.00 0.00 N ATOM 0 H LYS A 118 -2.472 9.680 -12.446 1.00 0.00 H new ATOM 0 HA LYS A 118 -2.603 9.747 -9.767 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -4.587 10.848 -11.792 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -4.602 11.297 -10.099 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -2.592 12.482 -10.245 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -2.037 11.585 -11.644 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -4.503 13.323 -11.844 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -2.910 14.049 -11.934 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -2.339 12.426 -13.789 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -3.996 11.855 -13.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -3.687 13.521 -15.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -4.754 14.101 -14.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -3.149 14.654 -14.313 1.00 0.00 H new ATOM 756 N LEU A 119 -4.131 7.974 -8.929 1.00 0.00 N ATOM 757 CA LEU A 119 -5.084 7.056 -8.316 1.00 0.00 C ATOM 758 C LEU A 119 -6.238 7.818 -7.672 1.00 0.00 C ATOM 759 O LEU A 119 -6.294 9.046 -7.732 1.00 0.00 O ATOM 760 CB LEU A 119 -4.385 6.187 -7.269 1.00 0.00 C ATOM 761 CG LEU A 119 -3.100 5.493 -7.724 1.00 0.00 C ATOM 762 CD1 LEU A 119 -2.436 4.781 -6.555 1.00 0.00 C ATOM 763 CD2 LEU A 119 -3.393 4.513 -8.850 1.00 0.00 C ATOM 0 H LEU A 119 -3.226 8.017 -8.461 1.00 0.00 H new ATOM 0 HA LEU A 119 -5.488 6.415 -9.100 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -4.152 6.810 -6.405 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -5.087 5.424 -6.932 1.00 0.00 H new ATOM 0 HG LEU A 119 -2.413 6.252 -8.099 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.523 4.293 -6.897 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -2.191 5.506 -5.779 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -3.118 4.033 -6.150 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -2.467 4.029 -9.161 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -4.098 3.758 -8.501 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.824 5.049 -9.696 1.00 0.00 H new ATOM 775 N SER A 120 -7.155 7.081 -7.054 1.00 0.00 N ATOM 776 CA SER A 120 -8.309 7.688 -6.399 1.00 0.00 C ATOM 777 C SER A 120 -8.483 7.139 -4.986 1.00 0.00 C ATOM 778 O SER A 120 -8.391 5.931 -4.762 1.00 0.00 O ATOM 779 CB SER A 120 -9.577 7.435 -7.217 1.00 0.00 C ATOM 780 OG SER A 120 -9.280 7.328 -8.598 1.00 0.00 O ATOM 0 H SER A 120 -7.122 6.063 -6.993 1.00 0.00 H new ATOM 0 HA SER A 120 -8.136 8.762 -6.333 1.00 0.00 H new ATOM 0 HB2 SER A 120 -10.059 6.519 -6.873 1.00 0.00 H new ATOM 0 HB3 SER A 120 -10.286 8.248 -7.056 1.00 0.00 H new ATOM 0 HG SER A 120 -9.128 6.388 -8.828 1.00 0.00 H new ATOM 786 N LEU A 121 -8.734 8.034 -4.038 1.00 0.00 N ATOM 787 CA LEU A 121 -8.922 7.640 -2.645 1.00 0.00 C ATOM 788 C LEU A 121 -9.900 6.476 -2.535 1.00 0.00 C ATOM 789 O LEU A 121 -11.047 6.573 -2.970 1.00 0.00 O ATOM 790 CB LEU A 121 -9.428 8.827 -1.823 1.00 0.00 C ATOM 791 CG LEU A 121 -8.355 9.741 -1.231 1.00 0.00 C ATOM 792 CD1 LEU A 121 -8.994 10.914 -0.505 1.00 0.00 C ATOM 793 CD2 LEU A 121 -7.448 8.959 -0.292 1.00 0.00 C ATOM 0 H LEU A 121 -8.812 9.037 -4.207 1.00 0.00 H new ATOM 0 HA LEU A 121 -7.958 7.318 -2.251 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -10.081 9.429 -2.455 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -10.040 8.443 -1.007 1.00 0.00 H new ATOM 0 HG LEU A 121 -7.748 10.133 -2.047 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -8.215 11.553 -0.090 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -9.600 11.489 -1.205 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -9.626 10.542 0.302 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -6.690 9.625 0.120 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -8.041 8.538 0.520 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -6.962 8.153 -0.843 1.00 0.00 H new ATOM 805 N GLY A 122 -9.440 5.375 -1.949 1.00 0.00 N ATOM 806 CA GLY A 122 -10.288 4.208 -1.791 1.00 0.00 C ATOM 807 C GLY A 122 -10.095 3.196 -2.902 1.00 0.00 C ATOM 808 O GLY A 122 -10.802 2.190 -2.964 1.00 0.00 O ATOM 0 H GLY A 122 -8.495 5.270 -1.581 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -10.075 3.735 -0.832 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -11.332 4.522 -1.767 1.00 0.00 H new ATOM 812 N ASP A 123 -9.136 3.461 -3.782 1.00 0.00 N ATOM 813 CA ASP A 123 -8.852 2.565 -4.897 1.00 0.00 C ATOM 814 C ASP A 123 -7.852 1.488 -4.487 1.00 0.00 C ATOM 815 O ASP A 123 -6.796 1.788 -3.929 1.00 0.00 O ATOM 816 CB ASP A 123 -8.310 3.355 -6.089 1.00 0.00 C ATOM 817 CG ASP A 123 -9.408 4.052 -6.869 1.00 0.00 C ATOM 818 OD1 ASP A 123 -10.561 4.061 -6.390 1.00 0.00 O ATOM 819 OD2 ASP A 123 -9.114 4.587 -7.958 1.00 0.00 O ATOM 0 H ASP A 123 -8.542 4.289 -3.745 1.00 0.00 H new ATOM 0 HA ASP A 123 -9.784 2.079 -5.187 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -7.594 4.096 -5.735 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -7.769 2.680 -6.753 1.00 0.00 H new ATOM 824 N ARG A 124 -8.192 0.235 -4.768 1.00 0.00 N ATOM 825 CA ARG A 124 -7.324 -0.887 -4.427 1.00 0.00 C ATOM 826 C ARG A 124 -6.153 -0.984 -5.400 1.00 0.00 C ATOM 827 O ARG A 124 -6.318 -0.803 -6.607 1.00 0.00 O ATOM 828 CB ARG A 124 -8.118 -2.194 -4.437 1.00 0.00 C ATOM 829 CG ARG A 124 -8.767 -2.522 -3.102 1.00 0.00 C ATOM 830 CD ARG A 124 -9.852 -3.577 -3.254 1.00 0.00 C ATOM 831 NE ARG A 124 -10.632 -3.741 -2.031 1.00 0.00 N ATOM 832 CZ ARG A 124 -11.800 -4.371 -1.983 1.00 0.00 C ATOM 833 NH1 ARG A 124 -12.320 -4.896 -3.084 1.00 0.00 N ATOM 834 NH2 ARG A 124 -12.451 -4.479 -0.831 1.00 0.00 N ATOM 0 H ARG A 124 -9.062 -0.030 -5.231 1.00 0.00 H new ATOM 0 HA ARG A 124 -6.929 -0.717 -3.426 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -8.892 -2.134 -5.202 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -7.454 -3.011 -4.719 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -8.008 -2.877 -2.405 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -9.196 -1.617 -2.673 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -10.516 -3.299 -4.073 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -9.396 -4.530 -3.523 1.00 0.00 H new ATOM 0 HE ARG A 124 -10.259 -3.350 -1.166 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -11.823 -4.817 -3.971 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -13.217 -5.379 -3.044 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -12.054 -4.078 0.019 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -13.348 -4.963 -0.796 1.00 0.00 H new ATOM 848 N VAL A 125 -4.969 -1.269 -4.867 1.00 0.00 N ATOM 849 CA VAL A 125 -3.770 -1.390 -5.687 1.00 0.00 C ATOM 850 C VAL A 125 -2.844 -2.476 -5.150 1.00 0.00 C ATOM 851 O VAL A 125 -2.777 -2.706 -3.943 1.00 0.00 O ATOM 852 CB VAL A 125 -2.998 -0.059 -5.753 1.00 0.00 C ATOM 853 CG1 VAL A 125 -3.864 1.031 -6.367 1.00 0.00 C ATOM 854 CG2 VAL A 125 -2.518 0.347 -4.368 1.00 0.00 C ATOM 0 H VAL A 125 -4.815 -1.420 -3.870 1.00 0.00 H new ATOM 0 HA VAL A 125 -4.099 -1.660 -6.690 1.00 0.00 H new ATOM 0 HB VAL A 125 -2.124 -0.197 -6.390 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -3.302 1.964 -6.405 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -4.154 0.740 -7.377 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -4.758 1.171 -5.759 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -1.974 1.290 -4.433 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -3.376 0.468 -3.707 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -1.859 -0.425 -3.970 1.00 0.00 H new ATOM 864 N MET A 126 -2.132 -3.139 -6.055 1.00 0.00 N ATOM 865 CA MET A 126 -1.207 -4.200 -5.671 1.00 0.00 C ATOM 866 C MET A 126 0.236 -3.785 -5.936 1.00 0.00 C ATOM 867 O MET A 126 0.524 -3.089 -6.910 1.00 0.00 O ATOM 868 CB MET A 126 -1.529 -5.486 -6.434 1.00 0.00 C ATOM 869 CG MET A 126 -0.807 -6.710 -5.893 1.00 0.00 C ATOM 870 SD MET A 126 -1.675 -8.247 -6.262 1.00 0.00 S ATOM 871 CE MET A 126 -1.273 -8.456 -7.995 1.00 0.00 C ATOM 0 H MET A 126 -2.177 -2.961 -7.058 1.00 0.00 H new ATOM 0 HA MET A 126 -1.323 -4.381 -4.602 1.00 0.00 H new ATOM 0 HB2 MET A 126 -2.604 -5.662 -6.396 1.00 0.00 H new ATOM 0 HB3 MET A 126 -1.265 -5.352 -7.483 1.00 0.00 H new ATOM 0 HG2 MET A 126 0.196 -6.753 -6.317 1.00 0.00 H new ATOM 0 HG3 MET A 126 -0.692 -6.612 -4.813 1.00 0.00 H new ATOM 0 HE1 MET A 126 -1.740 -9.367 -8.369 1.00 0.00 H new ATOM 0 HE2 MET A 126 -1.643 -7.600 -8.560 1.00 0.00 H new ATOM 0 HE3 MET A 126 -0.192 -8.528 -8.112 1.00 0.00 H new ATOM 881 N VAL A 127 1.141 -4.216 -5.062 1.00 0.00 N ATOM 882 CA VAL A 127 2.555 -3.890 -5.202 1.00 0.00 C ATOM 883 C VAL A 127 3.152 -4.550 -6.440 1.00 0.00 C ATOM 884 O VAL A 127 3.553 -5.714 -6.404 1.00 0.00 O ATOM 885 CB VAL A 127 3.358 -4.328 -3.963 1.00 0.00 C ATOM 886 CG1 VAL A 127 4.831 -3.991 -4.134 1.00 0.00 C ATOM 887 CG2 VAL A 127 2.796 -3.677 -2.708 1.00 0.00 C ATOM 0 H VAL A 127 0.919 -4.792 -4.250 1.00 0.00 H new ATOM 0 HA VAL A 127 2.621 -2.807 -5.304 1.00 0.00 H new ATOM 0 HB VAL A 127 3.268 -5.409 -3.856 1.00 0.00 H new ATOM 0 HG11 VAL A 127 5.382 -4.308 -3.249 1.00 0.00 H new ATOM 0 HG12 VAL A 127 5.223 -4.508 -5.010 1.00 0.00 H new ATOM 0 HG13 VAL A 127 4.945 -2.915 -4.266 1.00 0.00 H new ATOM 0 HG21 VAL A 127 3.375 -3.997 -1.842 1.00 0.00 H new ATOM 0 HG22 VAL A 127 2.855 -2.593 -2.803 1.00 0.00 H new ATOM 0 HG23 VAL A 127 1.755 -3.974 -2.579 1.00 0.00 H new ATOM 897 N VAL A 128 3.207 -3.800 -7.536 1.00 0.00 N ATOM 898 CA VAL A 128 3.757 -4.312 -8.786 1.00 0.00 C ATOM 899 C VAL A 128 5.206 -4.751 -8.610 1.00 0.00 C ATOM 900 O VAL A 128 5.639 -5.747 -9.191 1.00 0.00 O ATOM 901 CB VAL A 128 3.683 -3.257 -9.905 1.00 0.00 C ATOM 902 CG1 VAL A 128 3.656 -3.927 -11.270 1.00 0.00 C ATOM 903 CG2 VAL A 128 2.466 -2.364 -9.716 1.00 0.00 C ATOM 0 H VAL A 128 2.877 -2.836 -7.584 1.00 0.00 H new ATOM 0 HA VAL A 128 3.152 -5.173 -9.069 1.00 0.00 H new ATOM 0 HB VAL A 128 4.575 -2.633 -9.851 1.00 0.00 H new ATOM 0 HG11 VAL A 128 3.604 -3.165 -12.048 1.00 0.00 H new ATOM 0 HG12 VAL A 128 4.561 -4.519 -11.402 1.00 0.00 H new ATOM 0 HG13 VAL A 128 2.784 -4.577 -11.339 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.430 -1.624 -10.516 1.00 0.00 H new ATOM 0 HG22 VAL A 128 1.561 -2.971 -9.742 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.534 -1.855 -8.754 1.00 0.00 H new ATOM 913 N ASP A 129 5.952 -4.002 -7.806 1.00 0.00 N ATOM 914 CA ASP A 129 7.353 -4.315 -7.551 1.00 0.00 C ATOM 915 C ASP A 129 7.907 -3.449 -6.423 1.00 0.00 C ATOM 916 O ASP A 129 7.270 -2.486 -5.996 1.00 0.00 O ATOM 917 CB ASP A 129 8.182 -4.111 -8.821 1.00 0.00 C ATOM 918 CG ASP A 129 9.546 -4.765 -8.732 1.00 0.00 C ATOM 919 OD1 ASP A 129 10.492 -4.103 -8.257 1.00 0.00 O ATOM 920 OD2 ASP A 129 9.669 -5.940 -9.140 1.00 0.00 O ATOM 0 H ASP A 129 5.610 -3.173 -7.319 1.00 0.00 H new ATOM 0 HA ASP A 129 7.417 -5.360 -7.248 1.00 0.00 H new ATOM 0 HB2 ASP A 129 7.641 -4.520 -9.674 1.00 0.00 H new ATOM 0 HB3 ASP A 129 8.305 -3.043 -9.004 1.00 0.00 H new ATOM 925 N VAL A 130 9.097 -3.800 -5.945 1.00 0.00 N ATOM 926 CA VAL A 130 9.737 -3.055 -4.867 1.00 0.00 C ATOM 927 C VAL A 130 11.200 -3.454 -4.717 1.00 0.00 C ATOM 928 O VAL A 130 11.514 -4.613 -4.446 1.00 0.00 O ATOM 929 CB VAL A 130 9.015 -3.280 -3.525 1.00 0.00 C ATOM 930 CG1 VAL A 130 8.644 -4.745 -3.356 1.00 0.00 C ATOM 931 CG2 VAL A 130 9.882 -2.804 -2.368 1.00 0.00 C ATOM 0 H VAL A 130 9.637 -4.595 -6.287 1.00 0.00 H new ATOM 0 HA VAL A 130 9.677 -1.999 -5.132 1.00 0.00 H new ATOM 0 HB VAL A 130 8.095 -2.696 -3.525 1.00 0.00 H new ATOM 0 HG11 VAL A 130 8.135 -4.884 -2.402 1.00 0.00 H new ATOM 0 HG12 VAL A 130 7.983 -5.049 -4.168 1.00 0.00 H new ATOM 0 HG13 VAL A 130 9.548 -5.354 -3.377 1.00 0.00 H new ATOM 0 HG21 VAL A 130 9.357 -2.970 -1.427 1.00 0.00 H new ATOM 0 HG22 VAL A 130 10.820 -3.360 -2.363 1.00 0.00 H new ATOM 0 HG23 VAL A 130 10.091 -1.741 -2.484 1.00 0.00 H new ATOM 941 N ASP A 131 12.092 -2.486 -4.896 1.00 0.00 N ATOM 942 CA ASP A 131 13.525 -2.734 -4.779 1.00 0.00 C ATOM 943 C ASP A 131 13.994 -2.541 -3.341 1.00 0.00 C ATOM 944 O ASP A 131 15.022 -3.082 -2.935 1.00 0.00 O ATOM 945 CB ASP A 131 14.303 -1.805 -5.712 1.00 0.00 C ATOM 946 CG ASP A 131 15.802 -1.907 -5.512 1.00 0.00 C ATOM 947 OD1 ASP A 131 16.364 -2.991 -5.777 1.00 0.00 O ATOM 948 OD2 ASP A 131 16.414 -0.904 -5.089 1.00 0.00 O ATOM 0 H ASP A 131 11.848 -1.522 -5.123 1.00 0.00 H new ATOM 0 HA ASP A 131 13.715 -3.768 -5.068 1.00 0.00 H new ATOM 0 HB2 ASP A 131 14.060 -2.047 -6.747 1.00 0.00 H new ATOM 0 HB3 ASP A 131 13.986 -0.776 -5.543 1.00 0.00 H new ATOM 953 N GLY A 132 13.234 -1.764 -2.575 1.00 0.00 N ATOM 954 CA GLY A 132 13.589 -1.513 -1.190 1.00 0.00 C ATOM 955 C GLY A 132 12.395 -1.103 -0.351 1.00 0.00 C ATOM 956 O GLY A 132 11.623 -1.951 0.099 1.00 0.00 O ATOM 0 H GLY A 132 12.379 -1.304 -2.889 1.00 0.00 H new ATOM 0 HA2 GLY A 132 14.037 -2.411 -0.764 1.00 0.00 H new ATOM 0 HA3 GLY A 132 14.345 -0.729 -1.148 1.00 0.00 H new ATOM 960 N LEU A 133 12.243 0.199 -0.137 1.00 0.00 N ATOM 961 CA LEU A 133 11.135 0.720 0.656 1.00 0.00 C ATOM 962 C LEU A 133 10.037 1.278 -0.243 1.00 0.00 C ATOM 963 O LEU A 133 9.005 1.747 0.237 1.00 0.00 O ATOM 964 CB LEU A 133 11.632 1.809 1.609 1.00 0.00 C ATOM 965 CG LEU A 133 10.927 1.888 2.964 1.00 0.00 C ATOM 966 CD1 LEU A 133 9.422 1.758 2.791 1.00 0.00 C ATOM 967 CD2 LEU A 133 11.453 0.811 3.902 1.00 0.00 C ATOM 0 H LEU A 133 12.873 0.914 -0.502 1.00 0.00 H new ATOM 0 HA LEU A 133 10.719 -0.102 1.238 1.00 0.00 H new ATOM 0 HB2 LEU A 133 12.696 1.652 1.784 1.00 0.00 H new ATOM 0 HB3 LEU A 133 11.529 2.774 1.112 1.00 0.00 H new ATOM 0 HG LEU A 133 11.138 2.862 3.406 1.00 0.00 H new ATOM 0 HD11 LEU A 133 8.937 1.816 3.766 1.00 0.00 H new ATOM 0 HD12 LEU A 133 9.058 2.565 2.156 1.00 0.00 H new ATOM 0 HD13 LEU A 133 9.191 0.799 2.328 1.00 0.00 H new ATOM 0 HD21 LEU A 133 10.940 0.882 4.861 1.00 0.00 H new ATOM 0 HD22 LEU A 133 11.272 -0.171 3.466 1.00 0.00 H new ATOM 0 HD23 LEU A 133 12.524 0.950 4.052 1.00 0.00 H new ATOM 979 N LYS A 134 10.265 1.221 -1.551 1.00 0.00 N ATOM 980 CA LYS A 134 9.294 1.717 -2.519 1.00 0.00 C ATOM 981 C LYS A 134 8.488 0.570 -3.118 1.00 0.00 C ATOM 982 O LYS A 134 9.043 -0.327 -3.755 1.00 0.00 O ATOM 983 CB LYS A 134 10.003 2.492 -3.632 1.00 0.00 C ATOM 984 CG LYS A 134 10.948 3.565 -3.119 1.00 0.00 C ATOM 985 CD LYS A 134 10.250 4.908 -2.990 1.00 0.00 C ATOM 986 CE LYS A 134 11.243 6.060 -3.043 1.00 0.00 C ATOM 987 NZ LYS A 134 11.724 6.439 -1.686 1.00 0.00 N ATOM 0 H LYS A 134 11.114 0.836 -1.965 1.00 0.00 H new ATOM 0 HA LYS A 134 8.609 2.386 -1.998 1.00 0.00 H new ATOM 0 HB2 LYS A 134 10.564 1.791 -4.251 1.00 0.00 H new ATOM 0 HB3 LYS A 134 9.254 2.956 -4.274 1.00 0.00 H new ATOM 0 HG2 LYS A 134 11.347 3.267 -2.149 1.00 0.00 H new ATOM 0 HG3 LYS A 134 11.796 3.659 -3.797 1.00 0.00 H new ATOM 0 HD2 LYS A 134 9.520 5.018 -3.792 1.00 0.00 H new ATOM 0 HD3 LYS A 134 9.699 4.944 -2.050 1.00 0.00 H new ATOM 0 HE2 LYS A 134 12.093 5.779 -3.664 1.00 0.00 H new ATOM 0 HE3 LYS A 134 10.774 6.923 -3.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 12.398 7.227 -1.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 10.916 6.732 -1.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 12.194 5.623 -1.244 1.00 0.00 H new ATOM 1001 N LEU A 135 7.176 0.603 -2.913 1.00 0.00 N ATOM 1002 CA LEU A 135 6.292 -0.434 -3.434 1.00 0.00 C ATOM 1003 C LEU A 135 5.375 0.126 -4.517 1.00 0.00 C ATOM 1004 O LEU A 135 4.301 0.652 -4.224 1.00 0.00 O ATOM 1005 CB LEU A 135 5.457 -1.036 -2.303 1.00 0.00 C ATOM 1006 CG LEU A 135 6.077 -0.979 -0.907 1.00 0.00 C ATOM 1007 CD1 LEU A 135 7.585 -1.159 -0.985 1.00 0.00 C ATOM 1008 CD2 LEU A 135 5.731 0.336 -0.223 1.00 0.00 C ATOM 0 H LEU A 135 6.700 1.338 -2.389 1.00 0.00 H new ATOM 0 HA LEU A 135 6.910 -1.216 -3.876 1.00 0.00 H new ATOM 0 HB2 LEU A 135 4.497 -0.521 -2.273 1.00 0.00 H new ATOM 0 HB3 LEU A 135 5.252 -2.079 -2.545 1.00 0.00 H new ATOM 0 HG LEU A 135 5.664 -1.795 -0.314 1.00 0.00 H new ATOM 0 HD11 LEU A 135 8.009 -1.116 0.018 1.00 0.00 H new ATOM 0 HD12 LEU A 135 7.813 -2.126 -1.434 1.00 0.00 H new ATOM 0 HD13 LEU A 135 8.015 -0.365 -1.595 1.00 0.00 H new ATOM 0 HD21 LEU A 135 6.181 0.359 0.770 1.00 0.00 H new ATOM 0 HD22 LEU A 135 6.116 1.166 -0.815 1.00 0.00 H new ATOM 0 HD23 LEU A 135 4.648 0.426 -0.133 1.00 0.00 H new ATOM 1020 N LYS A 136 5.805 0.008 -5.768 1.00 0.00 N ATOM 1021 CA LYS A 136 5.022 0.499 -6.896 1.00 0.00 C ATOM 1022 C LYS A 136 3.607 -0.070 -6.865 1.00 0.00 C ATOM 1023 O LYS A 136 3.414 -1.284 -6.928 1.00 0.00 O ATOM 1024 CB LYS A 136 5.702 0.129 -8.216 1.00 0.00 C ATOM 1025 CG LYS A 136 6.743 1.139 -8.667 1.00 0.00 C ATOM 1026 CD LYS A 136 6.955 1.087 -10.171 1.00 0.00 C ATOM 1027 CE LYS A 136 5.998 2.018 -10.901 1.00 0.00 C ATOM 1028 NZ LYS A 136 6.162 1.934 -12.379 1.00 0.00 N ATOM 0 H LYS A 136 6.692 -0.424 -6.027 1.00 0.00 H new ATOM 0 HA LYS A 136 4.961 1.584 -6.818 1.00 0.00 H new ATOM 0 HB2 LYS A 136 6.176 -0.847 -8.110 1.00 0.00 H new ATOM 0 HB3 LYS A 136 4.942 0.031 -8.992 1.00 0.00 H new ATOM 0 HG2 LYS A 136 6.428 2.142 -8.377 1.00 0.00 H new ATOM 0 HG3 LYS A 136 7.687 0.942 -8.158 1.00 0.00 H new ATOM 0 HD2 LYS A 136 7.983 1.364 -10.404 1.00 0.00 H new ATOM 0 HD3 LYS A 136 6.812 0.066 -10.525 1.00 0.00 H new ATOM 0 HE2 LYS A 136 4.972 1.766 -10.635 1.00 0.00 H new ATOM 0 HE3 LYS A 136 6.169 3.044 -10.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 5.493 2.583 -12.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 7.134 2.199 -12.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 5.974 0.961 -12.694 1.00 0.00 H new ATOM 1042 N VAL A 137 2.620 0.815 -6.768 1.00 0.00 N ATOM 1043 CA VAL A 137 1.222 0.401 -6.731 1.00 0.00 C ATOM 1044 C VAL A 137 0.535 0.665 -8.067 1.00 0.00 C ATOM 1045 O VAL A 137 0.701 1.729 -8.664 1.00 0.00 O ATOM 1046 CB VAL A 137 0.450 1.130 -5.616 1.00 0.00 C ATOM 1047 CG1 VAL A 137 0.944 0.689 -4.247 1.00 0.00 C ATOM 1048 CG2 VAL A 137 0.578 2.637 -5.778 1.00 0.00 C ATOM 0 H VAL A 137 2.763 1.824 -6.714 1.00 0.00 H new ATOM 0 HA VAL A 137 1.214 -0.670 -6.527 1.00 0.00 H new ATOM 0 HB VAL A 137 -0.605 0.867 -5.697 1.00 0.00 H new ATOM 0 HG11 VAL A 137 0.386 1.215 -3.472 1.00 0.00 H new ATOM 0 HG12 VAL A 137 0.795 -0.385 -4.135 1.00 0.00 H new ATOM 0 HG13 VAL A 137 2.005 0.920 -4.151 1.00 0.00 H new ATOM 0 HG21 VAL A 137 0.026 3.137 -4.982 1.00 0.00 H new ATOM 0 HG22 VAL A 137 1.629 2.921 -5.725 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.170 2.935 -6.744 1.00 0.00 H new ATOM 1058 N LYS A 138 -0.238 -0.311 -8.531 1.00 0.00 N ATOM 1059 CA LYS A 138 -0.953 -0.185 -9.795 1.00 0.00 C ATOM 1060 C LYS A 138 -2.406 -0.624 -9.645 1.00 0.00 C ATOM 1061 O LYS A 138 -2.697 -1.623 -8.986 1.00 0.00 O ATOM 1062 CB LYS A 138 -0.266 -1.021 -10.878 1.00 0.00 C ATOM 1063 CG LYS A 138 0.788 -0.256 -11.660 1.00 0.00 C ATOM 1064 CD LYS A 138 1.389 -1.107 -12.766 1.00 0.00 C ATOM 1065 CE LYS A 138 0.591 -0.991 -14.055 1.00 0.00 C ATOM 1066 NZ LYS A 138 0.947 -2.062 -15.026 1.00 0.00 N ATOM 0 H LYS A 138 -0.385 -1.198 -8.050 1.00 0.00 H new ATOM 0 HA LYS A 138 -0.938 0.864 -10.089 1.00 0.00 H new ATOM 0 HB2 LYS A 138 0.198 -1.891 -10.414 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -1.021 -1.394 -11.570 1.00 0.00 H new ATOM 0 HG2 LYS A 138 0.343 0.641 -12.091 1.00 0.00 H new ATOM 0 HG3 LYS A 138 1.577 0.073 -10.983 1.00 0.00 H new ATOM 0 HD2 LYS A 138 2.419 -0.798 -12.945 1.00 0.00 H new ATOM 0 HD3 LYS A 138 1.420 -2.149 -12.449 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -0.474 -1.045 -13.829 1.00 0.00 H new ATOM 0 HE3 LYS A 138 0.772 -0.016 -14.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 0.381 -1.948 -15.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 1.958 -1.995 -15.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 0.751 -2.992 -14.604 1.00 0.00 H new ATOM 1080 N ARG A 139 -3.313 0.127 -10.261 1.00 0.00 N ATOM 1081 CA ARG A 139 -4.736 -0.186 -10.195 1.00 0.00 C ATOM 1082 C ARG A 139 -4.989 -1.646 -10.557 1.00 0.00 C ATOM 1083 O ARG A 139 -4.530 -2.127 -11.594 1.00 0.00 O ATOM 1084 CB ARG A 139 -5.524 0.728 -11.136 1.00 0.00 C ATOM 1085 CG ARG A 139 -7.025 0.495 -11.093 1.00 0.00 C ATOM 1086 CD ARG A 139 -7.698 1.385 -10.059 1.00 0.00 C ATOM 1087 NE ARG A 139 -8.106 2.668 -10.623 1.00 0.00 N ATOM 1088 CZ ARG A 139 -9.145 2.817 -11.437 1.00 0.00 C ATOM 1089 NH1 ARG A 139 -9.878 1.767 -11.780 1.00 0.00 N ATOM 1090 NH2 ARG A 139 -9.453 4.018 -11.910 1.00 0.00 N ATOM 0 H ARG A 139 -3.088 0.956 -10.811 1.00 0.00 H new ATOM 0 HA ARG A 139 -5.072 -0.020 -9.171 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -5.318 1.767 -10.877 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -5.170 0.578 -12.156 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -7.453 0.690 -12.076 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -7.225 -0.551 -10.860 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -8.571 0.873 -9.654 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -7.014 1.556 -9.228 1.00 0.00 H new ATOM 0 HE ARG A 139 -7.563 3.496 -10.378 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -9.645 0.842 -11.419 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -10.675 1.884 -12.405 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -8.892 4.828 -11.649 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -10.251 4.131 -12.535 1.00 0.00 H new ATOM 1104 N ILE A 140 -5.720 -2.346 -9.696 1.00 0.00 N ATOM 1105 CA ILE A 140 -6.034 -3.750 -9.925 1.00 0.00 C ATOM 1106 C ILE A 140 -7.535 -4.000 -9.833 1.00 0.00 C ATOM 1107 O ILE A 140 -8.224 -3.481 -8.954 1.00 0.00 O ATOM 1108 CB ILE A 140 -5.311 -4.661 -8.916 1.00 0.00 C ATOM 1109 CG1 ILE A 140 -5.617 -4.216 -7.484 1.00 0.00 C ATOM 1110 CG2 ILE A 140 -3.811 -4.648 -9.171 1.00 0.00 C ATOM 1111 CD1 ILE A 140 -5.603 -5.350 -6.483 1.00 0.00 C ATOM 0 H ILE A 140 -6.106 -1.963 -8.833 1.00 0.00 H new ATOM 0 HA ILE A 140 -5.689 -3.990 -10.931 1.00 0.00 H new ATOM 0 HB ILE A 140 -5.673 -5.681 -9.045 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -4.886 -3.466 -7.181 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -6.595 -3.735 -7.463 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -3.314 -5.297 -8.450 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -3.610 -5.007 -10.180 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -3.433 -3.631 -9.066 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -5.828 -4.961 -5.490 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -6.353 -6.090 -6.761 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -4.618 -5.817 -6.476 1.00 0.00 H new ATOM 1123 N PRO A 141 -8.057 -4.816 -10.761 1.00 0.00 N ATOM 1124 CA PRO A 141 -9.483 -5.156 -10.805 1.00 0.00 C ATOM 1125 C PRO A 141 -9.902 -6.049 -9.642 1.00 0.00 C ATOM 1126 O PRO A 141 -9.134 -6.882 -9.160 1.00 0.00 O ATOM 1127 CB PRO A 141 -9.628 -5.903 -12.133 1.00 0.00 C ATOM 1128 CG PRO A 141 -8.275 -6.463 -12.404 1.00 0.00 C ATOM 1129 CD PRO A 141 -7.296 -5.471 -11.839 1.00 0.00 C ATOM 0 HA PRO A 141 -10.116 -4.272 -10.726 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -10.376 -6.693 -12.063 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -9.946 -5.232 -12.931 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -8.156 -7.440 -11.935 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -8.117 -6.602 -13.474 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -6.401 -5.962 -11.458 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -6.970 -4.755 -12.593 1.00 0.00 H new ATOM 1137 N PRO A 142 -11.149 -5.875 -9.181 1.00 0.00 N ATOM 1138 CA PRO A 142 -11.698 -6.657 -8.070 1.00 0.00 C ATOM 1139 C PRO A 142 -11.938 -8.115 -8.449 1.00 0.00 C ATOM 1140 O PRO A 142 -11.583 -8.545 -9.546 1.00 0.00 O ATOM 1141 CB PRO A 142 -13.026 -5.959 -7.766 1.00 0.00 C ATOM 1142 CG PRO A 142 -13.409 -5.300 -9.047 1.00 0.00 C ATOM 1143 CD PRO A 142 -12.119 -4.901 -9.709 1.00 0.00 C ATOM 0 HA PRO A 142 -11.015 -6.693 -7.221 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -13.785 -6.673 -7.446 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -12.916 -5.230 -6.963 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -13.979 -5.980 -9.680 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -14.040 -4.430 -8.865 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -12.191 -4.955 -10.795 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -11.838 -3.878 -9.458 1.00 0.00 H new ATOM 1151 N GLN A 143 -12.541 -8.868 -7.535 1.00 0.00 N ATOM 1152 CA GLN A 143 -12.827 -10.277 -7.776 1.00 0.00 C ATOM 1153 C GLN A 143 -14.315 -10.567 -7.608 1.00 0.00 C ATOM 1154 O GLN A 143 -14.701 -11.648 -7.161 1.00 0.00 O ATOM 1155 CB GLN A 143 -12.014 -11.155 -6.822 1.00 0.00 C ATOM 1156 CG GLN A 143 -10.515 -11.098 -7.072 1.00 0.00 C ATOM 1157 CD GLN A 143 -9.746 -12.107 -6.242 1.00 0.00 C ATOM 1158 OE1 GLN A 143 -10.106 -12.390 -5.099 1.00 0.00 O ATOM 1159 NE2 GLN A 143 -8.681 -12.655 -6.813 1.00 0.00 N ATOM 0 H GLN A 143 -12.841 -8.526 -6.622 1.00 0.00 H new ATOM 0 HA GLN A 143 -12.544 -10.509 -8.803 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -12.215 -10.846 -5.796 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -12.351 -12.187 -6.915 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -10.320 -11.279 -8.129 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -10.151 -10.095 -6.847 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -8.419 -12.391 -7.763 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -8.124 -13.340 -6.302 1.00 0.00 H new ATOM 1168 N LEU A 144 -15.146 -9.596 -7.970 1.00 0.00 N ATOM 1169 CA LEU A 144 -16.593 -9.747 -7.859 1.00 0.00 C ATOM 1170 C LEU A 144 -17.054 -11.053 -8.497 1.00 0.00 C ATOM 1171 O LEU A 144 -18.076 -11.617 -8.108 1.00 0.00 O ATOM 1172 CB LEU A 144 -17.300 -8.564 -8.523 1.00 0.00 C ATOM 1173 CG LEU A 144 -17.016 -8.361 -10.012 1.00 0.00 C ATOM 1174 CD1 LEU A 144 -17.993 -9.165 -10.856 1.00 0.00 C ATOM 1175 CD2 LEU A 144 -17.086 -6.884 -10.372 1.00 0.00 C ATOM 0 H LEU A 144 -14.843 -8.696 -8.343 1.00 0.00 H new ATOM 0 HA LEU A 144 -16.852 -9.770 -6.800 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -18.375 -8.689 -8.393 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -17.018 -7.654 -7.993 1.00 0.00 H new ATOM 0 HG LEU A 144 -16.008 -8.718 -10.222 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -17.776 -9.008 -11.913 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -17.893 -10.224 -10.618 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -19.011 -8.840 -10.643 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -16.881 -6.759 -11.435 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -18.081 -6.501 -10.146 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -16.345 -6.333 -9.792 1.00 0.00 H new ATOM 1187 N GLU A 145 -16.292 -11.529 -9.477 1.00 0.00 N ATOM 1188 CA GLU A 145 -16.624 -12.770 -10.167 1.00 0.00 C ATOM 1189 C GLU A 145 -16.320 -13.980 -9.287 1.00 0.00 C ATOM 1190 O GLU A 145 -15.172 -14.410 -9.182 1.00 0.00 O ATOM 1191 CB GLU A 145 -15.846 -12.873 -11.480 1.00 0.00 C ATOM 1192 CG GLU A 145 -16.553 -13.696 -12.544 1.00 0.00 C ATOM 1193 CD GLU A 145 -17.764 -12.988 -13.120 1.00 0.00 C ATOM 1194 OE1 GLU A 145 -17.764 -11.739 -13.146 1.00 0.00 O ATOM 1195 OE2 GLU A 145 -18.712 -13.681 -13.544 1.00 0.00 O ATOM 0 H GLU A 145 -15.442 -11.075 -9.810 1.00 0.00 H new ATOM 0 HA GLU A 145 -17.692 -12.760 -10.385 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -15.669 -11.870 -11.867 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -14.870 -13.315 -11.280 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -15.853 -13.922 -13.348 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -16.864 -14.648 -12.114 1.00 0.00 H new TER 1202 GLU A 145