USER MOD reduce.3.24.130724 H: found=0, std=0, add=612, rem=0, adj=14 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 Single : A 75 THR OG1 : rot 180:sc= 0.0012 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= -0.282 USER MOD Single : A 84 THR OG1 : rot -26:sc= 0.135 USER MOD Single : A 88 LYS NZ :NH3+ -131:sc= -0.52 (180deg=-1.56) USER MOD Single : A 90 LYS NZ :NH3+ 150:sc= -0.285 (180deg=-1.71) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 HIS : no HE2:sc= -2.02! X(o=-2!,f=-1.7) USER MOD Single : A 102 TYR OH : rot 106:sc= 1.06 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 115 SER OG : rot -113:sc= -0.682 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 126 MET CE :methyl 149:sc= 0 (180deg=-0.619) USER MOD Single : A 134 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0135) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 143:sc= -0.103 (180deg=-0.707) USER MOD Single : A 143 GLN : amide:sc= -0.0119 K(o=-0.012,f=-0.69) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 72 5.260 -16.797 17.541 1.00 0.00 N ATOM 2 CA ARG A 72 6.486 -17.228 18.201 1.00 0.00 C ATOM 3 C ARG A 72 7.346 -18.066 17.258 1.00 0.00 C ATOM 4 O ARG A 72 8.455 -17.671 16.897 1.00 0.00 O ATOM 5 CB ARG A 72 6.158 -18.034 19.459 1.00 0.00 C ATOM 6 CG ARG A 72 5.763 -17.172 20.648 1.00 0.00 C ATOM 7 CD ARG A 72 4.366 -16.595 20.477 1.00 0.00 C ATOM 8 NE ARG A 72 4.388 -15.301 19.801 1.00 0.00 N ATOM 9 CZ ARG A 72 3.301 -14.701 19.328 1.00 0.00 C ATOM 10 NH1 ARG A 72 2.113 -15.275 19.457 1.00 0.00 N ATOM 11 NH2 ARG A 72 3.401 -13.523 18.725 1.00 0.00 N ATOM 0 HA ARG A 72 7.048 -16.338 18.484 1.00 0.00 H new ATOM 0 HB2 ARG A 72 5.345 -18.725 19.236 1.00 0.00 H new ATOM 0 HB3 ARG A 72 7.024 -18.637 19.730 1.00 0.00 H new ATOM 0 HG2 ARG A 72 5.803 -17.768 21.560 1.00 0.00 H new ATOM 0 HG3 ARG A 72 6.481 -16.361 20.765 1.00 0.00 H new ATOM 0 HD2 ARG A 72 3.753 -17.292 19.906 1.00 0.00 H new ATOM 0 HD3 ARG A 72 3.897 -16.485 21.455 1.00 0.00 H new ATOM 0 HE ARG A 72 5.287 -14.832 19.686 1.00 0.00 H new ATOM 0 HH11 ARG A 72 2.031 -16.180 19.921 1.00 0.00 H new ATOM 0 HH12 ARG A 72 1.280 -14.812 19.093 1.00 0.00 H new ATOM 0 HH21 ARG A 72 4.313 -13.077 18.624 1.00 0.00 H new ATOM 0 HH22 ARG A 72 2.566 -13.063 18.362 1.00 0.00 H new ATOM 25 N ARG A 73 6.826 -19.223 16.863 1.00 0.00 N ATOM 26 CA ARG A 73 7.545 -20.117 15.964 1.00 0.00 C ATOM 27 C ARG A 73 7.210 -19.809 14.507 1.00 0.00 C ATOM 28 O ARG A 73 8.086 -19.821 13.643 1.00 0.00 O ATOM 29 CB ARG A 73 7.205 -21.575 16.279 1.00 0.00 C ATOM 30 CG ARG A 73 8.015 -22.155 17.427 1.00 0.00 C ATOM 31 CD ARG A 73 7.290 -23.316 18.089 1.00 0.00 C ATOM 32 NE ARG A 73 8.075 -23.906 19.171 1.00 0.00 N ATOM 33 CZ ARG A 73 7.818 -25.097 19.700 1.00 0.00 C ATOM 34 NH1 ARG A 73 6.804 -25.822 19.248 1.00 0.00 N ATOM 35 NH2 ARG A 73 8.577 -25.565 20.682 1.00 0.00 N ATOM 0 H ARG A 73 5.909 -19.563 17.152 1.00 0.00 H new ATOM 0 HA ARG A 73 8.613 -19.960 16.115 1.00 0.00 H new ATOM 0 HB2 ARG A 73 6.145 -21.648 16.520 1.00 0.00 H new ATOM 0 HB3 ARG A 73 7.371 -22.179 15.387 1.00 0.00 H new ATOM 0 HG2 ARG A 73 8.983 -22.493 17.057 1.00 0.00 H new ATOM 0 HG3 ARG A 73 8.210 -21.377 18.166 1.00 0.00 H new ATOM 0 HD2 ARG A 73 6.334 -22.970 18.482 1.00 0.00 H new ATOM 0 HD3 ARG A 73 7.070 -24.079 17.343 1.00 0.00 H new ATOM 0 HE ARG A 73 8.863 -23.374 19.540 1.00 0.00 H new ATOM 0 HH11 ARG A 73 6.219 -25.465 18.492 1.00 0.00 H new ATOM 0 HH12 ARG A 73 6.609 -26.736 19.656 1.00 0.00 H new ATOM 0 HH21 ARG A 73 9.358 -25.010 21.031 1.00 0.00 H new ATOM 0 HH22 ARG A 73 8.379 -26.480 21.088 1.00 0.00 H new ATOM 49 N GLU A 74 5.936 -19.534 14.244 1.00 0.00 N ATOM 50 CA GLU A 74 5.486 -19.224 12.892 1.00 0.00 C ATOM 51 C GLU A 74 5.923 -17.821 12.481 1.00 0.00 C ATOM 52 O GLU A 74 6.503 -17.081 13.276 1.00 0.00 O ATOM 53 CB GLU A 74 3.964 -19.344 12.798 1.00 0.00 C ATOM 54 CG GLU A 74 3.442 -20.736 13.111 1.00 0.00 C ATOM 55 CD GLU A 74 2.103 -21.018 12.458 1.00 0.00 C ATOM 56 OE1 GLU A 74 1.180 -20.191 12.613 1.00 0.00 O ATOM 57 OE2 GLU A 74 1.979 -22.066 11.790 1.00 0.00 O ATOM 0 H GLU A 74 5.198 -19.520 14.948 1.00 0.00 H new ATOM 0 HA GLU A 74 5.943 -19.942 12.211 1.00 0.00 H new ATOM 0 HB2 GLU A 74 3.509 -18.631 13.486 1.00 0.00 H new ATOM 0 HB3 GLU A 74 3.647 -19.064 11.793 1.00 0.00 H new ATOM 0 HG2 GLU A 74 4.168 -21.476 12.776 1.00 0.00 H new ATOM 0 HG3 GLU A 74 3.346 -20.850 14.191 1.00 0.00 H new ATOM 64 N THR A 75 5.641 -17.461 11.233 1.00 0.00 N ATOM 65 CA THR A 75 6.006 -16.149 10.714 1.00 0.00 C ATOM 66 C THR A 75 4.974 -15.097 11.105 1.00 0.00 C ATOM 67 O THR A 75 4.529 -14.308 10.270 1.00 0.00 O ATOM 68 CB THR A 75 6.146 -16.170 9.181 1.00 0.00 C ATOM 69 OG1 THR A 75 4.968 -16.727 8.588 1.00 0.00 O ATOM 70 CG2 THR A 75 7.363 -16.980 8.760 1.00 0.00 C ATOM 0 H THR A 75 5.160 -18.061 10.562 1.00 0.00 H new ATOM 0 HA THR A 75 6.969 -15.891 11.155 1.00 0.00 H new ATOM 0 HB THR A 75 6.275 -15.144 8.836 1.00 0.00 H new ATOM 0 HG1 THR A 75 5.065 -16.735 7.613 1.00 0.00 H new ATOM 0 HG21 THR A 75 7.441 -16.981 7.673 1.00 0.00 H new ATOM 0 HG22 THR A 75 8.262 -16.536 9.188 1.00 0.00 H new ATOM 0 HG23 THR A 75 7.259 -18.005 9.117 1.00 0.00 H new ATOM 78 N THR A 76 4.595 -15.091 12.379 1.00 0.00 N ATOM 79 CA THR A 76 3.615 -14.136 12.880 1.00 0.00 C ATOM 80 C THR A 76 4.287 -12.849 13.345 1.00 0.00 C ATOM 81 O THR A 76 3.912 -11.755 12.925 1.00 0.00 O ATOM 82 CB THR A 76 2.801 -14.726 14.047 1.00 0.00 C ATOM 83 OG1 THR A 76 2.215 -15.972 13.654 1.00 0.00 O ATOM 84 CG2 THR A 76 1.709 -13.763 14.487 1.00 0.00 C ATOM 0 H THR A 76 4.952 -15.737 13.083 1.00 0.00 H new ATOM 0 HA THR A 76 2.942 -13.912 12.052 1.00 0.00 H new ATOM 0 HB THR A 76 3.477 -14.891 14.886 1.00 0.00 H new ATOM 0 HG1 THR A 76 1.701 -16.342 14.402 1.00 0.00 H new ATOM 0 HG21 THR A 76 1.148 -14.202 15.312 1.00 0.00 H new ATOM 0 HG22 THR A 76 2.160 -12.826 14.813 1.00 0.00 H new ATOM 0 HG23 THR A 76 1.035 -13.571 13.652 1.00 0.00 H new ATOM 92 N ASP A 77 5.284 -12.988 14.212 1.00 0.00 N ATOM 93 CA ASP A 77 6.011 -11.836 14.733 1.00 0.00 C ATOM 94 C ASP A 77 6.966 -11.277 13.683 1.00 0.00 C ATOM 95 O ASP A 77 7.951 -11.921 13.321 1.00 0.00 O ATOM 96 CB ASP A 77 6.787 -12.223 15.992 1.00 0.00 C ATOM 97 CG ASP A 77 7.745 -11.135 16.439 1.00 0.00 C ATOM 98 OD1 ASP A 77 8.559 -10.682 15.607 1.00 0.00 O ATOM 99 OD2 ASP A 77 7.679 -10.737 17.621 1.00 0.00 O ATOM 0 H ASP A 77 5.607 -13.887 14.569 1.00 0.00 H new ATOM 0 HA ASP A 77 5.285 -11.063 14.987 1.00 0.00 H new ATOM 0 HB2 ASP A 77 6.084 -12.437 16.797 1.00 0.00 H new ATOM 0 HB3 ASP A 77 7.345 -13.140 15.804 1.00 0.00 H new ATOM 104 N ILE A 78 6.667 -10.077 13.198 1.00 0.00 N ATOM 105 CA ILE A 78 7.499 -9.432 12.190 1.00 0.00 C ATOM 106 C ILE A 78 8.919 -9.218 12.703 1.00 0.00 C ATOM 107 O ILE A 78 9.891 -9.481 11.998 1.00 0.00 O ATOM 108 CB ILE A 78 6.911 -8.075 11.759 1.00 0.00 C ATOM 109 CG1 ILE A 78 5.526 -8.269 11.139 1.00 0.00 C ATOM 110 CG2 ILE A 78 7.844 -7.381 10.778 1.00 0.00 C ATOM 111 CD1 ILE A 78 4.399 -8.204 12.146 1.00 0.00 C ATOM 0 H ILE A 78 5.855 -9.532 13.487 1.00 0.00 H new ATOM 0 HA ILE A 78 7.524 -10.099 11.328 1.00 0.00 H new ATOM 0 HB ILE A 78 6.808 -7.443 12.641 1.00 0.00 H new ATOM 0 HG12 ILE A 78 5.367 -7.505 10.378 1.00 0.00 H new ATOM 0 HG13 ILE A 78 5.495 -9.234 10.633 1.00 0.00 H new ATOM 0 HG21 ILE A 78 7.415 -6.424 10.483 1.00 0.00 H new ATOM 0 HG22 ILE A 78 8.811 -7.214 11.252 1.00 0.00 H new ATOM 0 HG23 ILE A 78 7.975 -8.007 9.896 1.00 0.00 H new ATOM 0 HD11 ILE A 78 3.447 -8.350 11.636 1.00 0.00 H new ATOM 0 HD12 ILE A 78 4.534 -8.986 12.894 1.00 0.00 H new ATOM 0 HD13 ILE A 78 4.404 -7.230 12.635 1.00 0.00 H new ATOM 123 N GLY A 79 9.029 -8.740 13.939 1.00 0.00 N ATOM 124 CA GLY A 79 10.334 -8.501 14.528 1.00 0.00 C ATOM 125 C GLY A 79 11.168 -7.531 13.714 1.00 0.00 C ATOM 126 O GLY A 79 12.332 -7.799 13.419 1.00 0.00 O ATOM 0 H GLY A 79 8.238 -8.514 14.543 1.00 0.00 H new ATOM 0 HA2 GLY A 79 10.208 -8.109 15.537 1.00 0.00 H new ATOM 0 HA3 GLY A 79 10.867 -9.447 14.618 1.00 0.00 H new ATOM 130 N GLY A 80 10.571 -6.401 13.349 1.00 0.00 N ATOM 131 CA GLY A 80 11.280 -5.406 12.566 1.00 0.00 C ATOM 132 C GLY A 80 10.386 -4.260 12.137 1.00 0.00 C ATOM 133 O GLY A 80 10.314 -3.929 10.954 1.00 0.00 O ATOM 0 H GLY A 80 9.608 -6.157 13.582 1.00 0.00 H new ATOM 0 HA2 GLY A 80 12.112 -5.014 13.150 1.00 0.00 H new ATOM 0 HA3 GLY A 80 11.707 -5.880 11.682 1.00 0.00 H new ATOM 137 N GLY A 81 9.700 -3.653 13.101 1.00 0.00 N ATOM 138 CA GLY A 81 8.814 -2.545 12.796 1.00 0.00 C ATOM 139 C GLY A 81 7.762 -2.910 11.766 1.00 0.00 C ATOM 140 O GLY A 81 7.013 -3.871 11.946 1.00 0.00 O ATOM 0 H GLY A 81 9.742 -3.909 14.087 1.00 0.00 H new ATOM 0 HA2 GLY A 81 8.323 -2.214 13.711 1.00 0.00 H new ATOM 0 HA3 GLY A 81 9.402 -1.704 12.428 1.00 0.00 H new ATOM 144 N LYS A 82 7.704 -2.141 10.684 1.00 0.00 N ATOM 145 CA LYS A 82 6.737 -2.387 9.621 1.00 0.00 C ATOM 146 C LYS A 82 7.422 -2.957 8.383 1.00 0.00 C ATOM 147 O LYS A 82 6.780 -3.193 7.360 1.00 0.00 O ATOM 148 CB LYS A 82 6.004 -1.093 9.261 1.00 0.00 C ATOM 149 CG LYS A 82 5.805 -0.158 10.441 1.00 0.00 C ATOM 150 CD LYS A 82 4.737 0.884 10.154 1.00 0.00 C ATOM 151 CE LYS A 82 5.329 2.123 9.500 1.00 0.00 C ATOM 152 NZ LYS A 82 4.313 3.197 9.325 1.00 0.00 N ATOM 0 H LYS A 82 8.316 -1.342 10.520 1.00 0.00 H new ATOM 0 HA LYS A 82 6.014 -3.118 9.984 1.00 0.00 H new ATOM 0 HB2 LYS A 82 6.565 -0.571 8.486 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.031 -1.342 8.838 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.523 -0.736 11.321 1.00 0.00 H new ATOM 0 HG3 LYS A 82 6.746 0.339 10.675 1.00 0.00 H new ATOM 0 HD2 LYS A 82 3.975 0.456 9.502 1.00 0.00 H new ATOM 0 HD3 LYS A 82 4.241 1.164 11.083 1.00 0.00 H new ATOM 0 HE2 LYS A 82 6.152 2.497 10.109 1.00 0.00 H new ATOM 0 HE3 LYS A 82 5.747 1.857 8.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 4.756 4.024 8.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 3.540 2.849 8.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 3.932 3.469 10.254 1.00 0.00 H new ATOM 166 N TYR A 83 8.728 -3.178 8.484 1.00 0.00 N ATOM 167 CA TYR A 83 9.500 -3.720 7.372 1.00 0.00 C ATOM 168 C TYR A 83 9.316 -5.231 7.267 1.00 0.00 C ATOM 169 O TYR A 83 9.795 -5.988 8.112 1.00 0.00 O ATOM 170 CB TYR A 83 10.983 -3.386 7.543 1.00 0.00 C ATOM 171 CG TYR A 83 11.275 -1.903 7.522 1.00 0.00 C ATOM 172 CD1 TYR A 83 10.249 -0.974 7.396 1.00 0.00 C ATOM 173 CD2 TYR A 83 12.578 -1.430 7.628 1.00 0.00 C ATOM 174 CE1 TYR A 83 10.512 0.382 7.376 1.00 0.00 C ATOM 175 CE2 TYR A 83 12.849 -0.076 7.610 1.00 0.00 C ATOM 176 CZ TYR A 83 11.813 0.826 7.484 1.00 0.00 C ATOM 177 OH TYR A 83 12.080 2.176 7.465 1.00 0.00 O ATOM 0 H TYR A 83 9.274 -2.990 9.325 1.00 0.00 H new ATOM 0 HA TYR A 83 9.135 -3.263 6.452 1.00 0.00 H new ATOM 0 HB2 TYR A 83 11.335 -3.804 8.486 1.00 0.00 H new ATOM 0 HB3 TYR A 83 11.550 -3.871 6.748 1.00 0.00 H new ATOM 0 HD1 TYR A 83 9.229 -1.318 7.312 1.00 0.00 H new ATOM 0 HD2 TYR A 83 13.392 -2.133 7.726 1.00 0.00 H new ATOM 0 HE1 TYR A 83 9.703 1.091 7.276 1.00 0.00 H new ATOM 0 HE2 TYR A 83 13.867 0.275 7.694 1.00 0.00 H new ATOM 0 HH TYR A 83 13.045 2.320 7.552 1.00 0.00 H new ATOM 187 N THR A 84 8.618 -5.664 6.221 1.00 0.00 N ATOM 188 CA THR A 84 8.370 -7.083 6.003 1.00 0.00 C ATOM 189 C THR A 84 8.845 -7.519 4.622 1.00 0.00 C ATOM 190 O THR A 84 9.029 -8.709 4.364 1.00 0.00 O ATOM 191 CB THR A 84 6.874 -7.421 6.149 1.00 0.00 C ATOM 192 OG1 THR A 84 6.669 -8.826 5.967 1.00 0.00 O ATOM 193 CG2 THR A 84 6.043 -6.646 5.137 1.00 0.00 C ATOM 0 H THR A 84 8.215 -5.052 5.512 1.00 0.00 H new ATOM 0 HA THR A 84 8.933 -7.622 6.765 1.00 0.00 H new ATOM 0 HB THR A 84 6.556 -7.135 7.152 1.00 0.00 H new ATOM 0 HG1 THR A 84 7.383 -9.191 5.404 1.00 0.00 H new ATOM 0 HG21 THR A 84 4.990 -6.901 5.259 1.00 0.00 H new ATOM 0 HG22 THR A 84 6.178 -5.576 5.298 1.00 0.00 H new ATOM 0 HG23 THR A 84 6.364 -6.905 4.128 1.00 0.00 H new ATOM 201 N PHE A 85 9.043 -6.548 3.736 1.00 0.00 N ATOM 202 CA PHE A 85 9.497 -6.832 2.379 1.00 0.00 C ATOM 203 C PHE A 85 8.618 -7.891 1.722 1.00 0.00 C ATOM 204 O PHE A 85 9.109 -8.762 1.005 1.00 0.00 O ATOM 205 CB PHE A 85 10.954 -7.299 2.394 1.00 0.00 C ATOM 206 CG PHE A 85 11.477 -7.672 1.036 1.00 0.00 C ATOM 207 CD1 PHE A 85 10.892 -7.161 -0.111 1.00 0.00 C ATOM 208 CD2 PHE A 85 12.554 -8.535 0.908 1.00 0.00 C ATOM 209 CE1 PHE A 85 11.371 -7.502 -1.362 1.00 0.00 C ATOM 210 CE2 PHE A 85 13.038 -8.879 -0.340 1.00 0.00 C ATOM 211 CZ PHE A 85 12.445 -8.363 -1.476 1.00 0.00 C ATOM 0 H PHE A 85 8.896 -5.558 3.933 1.00 0.00 H new ATOM 0 HA PHE A 85 9.423 -5.913 1.798 1.00 0.00 H new ATOM 0 HB2 PHE A 85 11.577 -6.507 2.810 1.00 0.00 H new ATOM 0 HB3 PHE A 85 11.045 -8.158 3.058 1.00 0.00 H new ATOM 0 HD1 PHE A 85 10.052 -6.488 -0.027 1.00 0.00 H new ATOM 0 HD2 PHE A 85 13.020 -8.943 1.793 1.00 0.00 H new ATOM 0 HE1 PHE A 85 10.906 -7.096 -2.248 1.00 0.00 H new ATOM 0 HE2 PHE A 85 13.879 -9.551 -0.427 1.00 0.00 H new ATOM 0 HZ PHE A 85 12.821 -8.632 -2.452 1.00 0.00 H new ATOM 221 N GLU A 86 7.315 -7.810 1.973 1.00 0.00 N ATOM 222 CA GLU A 86 6.367 -8.762 1.407 1.00 0.00 C ATOM 223 C GLU A 86 5.281 -8.042 0.612 1.00 0.00 C ATOM 224 O GLU A 86 4.615 -8.640 -0.234 1.00 0.00 O ATOM 225 CB GLU A 86 5.731 -9.603 2.515 1.00 0.00 C ATOM 226 CG GLU A 86 6.647 -10.685 3.061 1.00 0.00 C ATOM 227 CD GLU A 86 6.064 -11.387 4.272 1.00 0.00 C ATOM 228 OE1 GLU A 86 4.910 -11.856 4.189 1.00 0.00 O ATOM 229 OE2 GLU A 86 6.764 -11.468 5.303 1.00 0.00 O ATOM 0 H GLU A 86 6.892 -7.095 2.565 1.00 0.00 H new ATOM 0 HA GLU A 86 6.913 -9.419 0.730 1.00 0.00 H new ATOM 0 HB2 GLU A 86 5.432 -8.946 3.332 1.00 0.00 H new ATOM 0 HB3 GLU A 86 4.823 -10.068 2.131 1.00 0.00 H new ATOM 0 HG2 GLU A 86 6.842 -11.419 2.279 1.00 0.00 H new ATOM 0 HG3 GLU A 86 7.606 -10.242 3.329 1.00 0.00 H new ATOM 236 N LEU A 87 5.108 -6.755 0.891 1.00 0.00 N ATOM 237 CA LEU A 87 4.103 -5.952 0.203 1.00 0.00 C ATOM 238 C LEU A 87 3.942 -6.404 -1.245 1.00 0.00 C ATOM 239 O LEU A 87 2.831 -6.447 -1.774 1.00 0.00 O ATOM 240 CB LEU A 87 4.486 -4.472 0.248 1.00 0.00 C ATOM 241 CG LEU A 87 5.165 -3.993 1.532 1.00 0.00 C ATOM 242 CD1 LEU A 87 4.550 -4.671 2.746 1.00 0.00 C ATOM 243 CD2 LEU A 87 6.663 -4.257 1.473 1.00 0.00 C ATOM 0 H LEU A 87 5.650 -6.245 1.588 1.00 0.00 H new ATOM 0 HA LEU A 87 3.151 -6.090 0.715 1.00 0.00 H new ATOM 0 HB2 LEU A 87 5.151 -4.264 -0.590 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.584 -3.879 0.095 1.00 0.00 H new ATOM 0 HG LEU A 87 5.009 -2.918 1.624 1.00 0.00 H new ATOM 0 HD11 LEU A 87 5.046 -4.318 3.650 1.00 0.00 H new ATOM 0 HD12 LEU A 87 3.488 -4.431 2.797 1.00 0.00 H new ATOM 0 HD13 LEU A 87 4.675 -5.751 2.662 1.00 0.00 H new ATOM 0 HD21 LEU A 87 7.130 -3.910 2.395 1.00 0.00 H new ATOM 0 HD22 LEU A 87 6.840 -5.326 1.357 1.00 0.00 H new ATOM 0 HD23 LEU A 87 7.093 -3.724 0.625 1.00 0.00 H new ATOM 255 N LYS A 88 5.059 -6.742 -1.881 1.00 0.00 N ATOM 256 CA LYS A 88 5.043 -7.194 -3.267 1.00 0.00 C ATOM 257 C LYS A 88 3.978 -8.265 -3.478 1.00 0.00 C ATOM 258 O LYS A 88 3.864 -9.204 -2.692 1.00 0.00 O ATOM 259 CB LYS A 88 6.417 -7.740 -3.662 1.00 0.00 C ATOM 260 CG LYS A 88 6.419 -8.481 -4.988 1.00 0.00 C ATOM 261 CD LYS A 88 7.833 -8.784 -5.456 1.00 0.00 C ATOM 262 CE LYS A 88 8.607 -9.574 -4.412 1.00 0.00 C ATOM 263 NZ LYS A 88 9.333 -8.682 -3.467 1.00 0.00 N ATOM 0 H LYS A 88 5.987 -6.711 -1.458 1.00 0.00 H new ATOM 0 HA LYS A 88 4.803 -6.339 -3.899 1.00 0.00 H new ATOM 0 HB2 LYS A 88 7.125 -6.913 -3.716 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.770 -8.412 -2.880 1.00 0.00 H new ATOM 0 HG2 LYS A 88 5.861 -9.412 -4.886 1.00 0.00 H new ATOM 0 HG3 LYS A 88 5.906 -7.883 -5.741 1.00 0.00 H new ATOM 0 HD2 LYS A 88 7.796 -9.348 -6.388 1.00 0.00 H new ATOM 0 HD3 LYS A 88 8.355 -7.851 -5.669 1.00 0.00 H new ATOM 0 HE2 LYS A 88 7.919 -10.210 -3.855 1.00 0.00 H new ATOM 0 HE3 LYS A 88 9.319 -10.233 -4.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 10.320 -8.998 -3.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 9.312 -7.706 -3.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 8.875 -8.718 -2.534 1.00 0.00 H new ATOM 277 N GLY A 89 3.201 -8.118 -4.547 1.00 0.00 N ATOM 278 CA GLY A 89 2.157 -9.081 -4.843 1.00 0.00 C ATOM 279 C GLY A 89 0.889 -8.822 -4.054 1.00 0.00 C ATOM 280 O GLY A 89 -0.213 -9.110 -4.522 1.00 0.00 O ATOM 0 H GLY A 89 3.276 -7.349 -5.213 1.00 0.00 H new ATOM 0 HA2 GLY A 89 1.931 -9.051 -5.909 1.00 0.00 H new ATOM 0 HA3 GLY A 89 2.520 -10.085 -4.623 1.00 0.00 H new ATOM 284 N LYS A 90 1.043 -8.278 -2.852 1.00 0.00 N ATOM 285 CA LYS A 90 -0.098 -7.980 -1.994 1.00 0.00 C ATOM 286 C LYS A 90 -0.835 -6.737 -2.481 1.00 0.00 C ATOM 287 O LYS A 90 -0.272 -5.910 -3.198 1.00 0.00 O ATOM 288 CB LYS A 90 0.363 -7.779 -0.549 1.00 0.00 C ATOM 289 CG LYS A 90 0.966 -9.025 0.076 1.00 0.00 C ATOM 290 CD LYS A 90 1.966 -8.674 1.166 1.00 0.00 C ATOM 291 CE LYS A 90 1.300 -7.933 2.315 1.00 0.00 C ATOM 292 NZ LYS A 90 2.098 -8.023 3.569 1.00 0.00 N ATOM 0 H LYS A 90 1.948 -8.034 -2.449 1.00 0.00 H new ATOM 0 HA LYS A 90 -0.783 -8.827 -2.036 1.00 0.00 H new ATOM 0 HB2 LYS A 90 1.099 -6.976 -0.520 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -0.486 -7.455 0.053 1.00 0.00 H new ATOM 0 HG2 LYS A 90 0.172 -9.644 0.495 1.00 0.00 H new ATOM 0 HG3 LYS A 90 1.459 -9.617 -0.695 1.00 0.00 H new ATOM 0 HD2 LYS A 90 2.432 -9.585 1.541 1.00 0.00 H new ATOM 0 HD3 LYS A 90 2.762 -8.058 0.747 1.00 0.00 H new ATOM 0 HE2 LYS A 90 1.167 -6.886 2.043 1.00 0.00 H new ATOM 0 HE3 LYS A 90 0.306 -8.346 2.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 1.942 -7.169 4.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 1.802 -8.861 4.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.108 -8.102 3.333 1.00 0.00 H new ATOM 306 N VAL A 91 -2.098 -6.610 -2.086 1.00 0.00 N ATOM 307 CA VAL A 91 -2.911 -5.466 -2.480 1.00 0.00 C ATOM 308 C VAL A 91 -3.211 -4.567 -1.286 1.00 0.00 C ATOM 309 O VAL A 91 -3.531 -5.047 -0.200 1.00 0.00 O ATOM 310 CB VAL A 91 -4.240 -5.915 -3.117 1.00 0.00 C ATOM 311 CG1 VAL A 91 -5.012 -6.815 -2.164 1.00 0.00 C ATOM 312 CG2 VAL A 91 -5.074 -4.707 -3.516 1.00 0.00 C ATOM 0 H VAL A 91 -2.580 -7.286 -1.493 1.00 0.00 H new ATOM 0 HA VAL A 91 -2.334 -4.906 -3.216 1.00 0.00 H new ATOM 0 HB VAL A 91 -4.016 -6.487 -4.018 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -5.948 -7.122 -2.631 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -4.415 -7.697 -1.933 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -5.227 -6.271 -1.244 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -6.009 -5.043 -3.964 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -5.290 -4.106 -2.633 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -4.521 -4.105 -4.237 1.00 0.00 H new ATOM 322 N GLY A 92 -3.105 -3.258 -1.496 1.00 0.00 N ATOM 323 CA GLY A 92 -3.368 -2.312 -0.428 1.00 0.00 C ATOM 324 C GLY A 92 -4.430 -1.297 -0.802 1.00 0.00 C ATOM 325 O GLY A 92 -4.992 -1.348 -1.896 1.00 0.00 O ATOM 0 H GLY A 92 -2.842 -2.836 -2.387 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -3.685 -2.854 0.463 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -2.445 -1.791 -0.173 1.00 0.00 H new ATOM 329 N LYS A 93 -4.708 -0.371 0.110 1.00 0.00 N ATOM 330 CA LYS A 93 -5.711 0.660 -0.127 1.00 0.00 C ATOM 331 C LYS A 93 -5.104 2.052 0.020 1.00 0.00 C ATOM 332 O LYS A 93 -4.664 2.437 1.103 1.00 0.00 O ATOM 333 CB LYS A 93 -6.881 0.497 0.845 1.00 0.00 C ATOM 334 CG LYS A 93 -8.132 1.248 0.423 1.00 0.00 C ATOM 335 CD LYS A 93 -8.980 1.637 1.622 1.00 0.00 C ATOM 336 CE LYS A 93 -9.726 0.440 2.190 1.00 0.00 C ATOM 337 NZ LYS A 93 -10.631 0.828 3.307 1.00 0.00 N ATOM 0 H LYS A 93 -4.252 -0.314 1.021 1.00 0.00 H new ATOM 0 HA LYS A 93 -6.077 0.548 -1.147 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -7.118 -0.563 0.940 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -6.574 0.845 1.831 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -7.850 2.144 -0.131 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -8.720 0.627 -0.253 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -8.344 2.070 2.394 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -9.694 2.407 1.329 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -10.308 -0.034 1.399 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -9.008 -0.300 2.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -11.121 -0.016 3.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -10.073 1.257 4.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -11.332 1.515 2.963 1.00 0.00 H new ATOM 351 N VAL A 94 -5.085 2.804 -1.077 1.00 0.00 N ATOM 352 CA VAL A 94 -4.535 4.154 -1.069 1.00 0.00 C ATOM 353 C VAL A 94 -5.242 5.029 -0.041 1.00 0.00 C ATOM 354 O VAL A 94 -6.432 5.318 -0.168 1.00 0.00 O ATOM 355 CB VAL A 94 -4.651 4.815 -2.456 1.00 0.00 C ATOM 356 CG1 VAL A 94 -3.688 4.166 -3.438 1.00 0.00 C ATOM 357 CG2 VAL A 94 -6.081 4.734 -2.966 1.00 0.00 C ATOM 0 H VAL A 94 -5.444 2.500 -1.982 1.00 0.00 H new ATOM 0 HA VAL A 94 -3.482 4.065 -0.803 1.00 0.00 H new ATOM 0 HB VAL A 94 -4.382 5.867 -2.362 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -3.784 4.645 -4.412 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -2.666 4.281 -3.076 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -3.923 3.106 -3.531 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.145 5.206 -3.947 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -6.380 3.689 -3.046 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -6.745 5.249 -2.272 1.00 0.00 H new ATOM 367 N VAL A 95 -4.502 5.450 0.980 1.00 0.00 N ATOM 368 CA VAL A 95 -5.057 6.295 2.031 1.00 0.00 C ATOM 369 C VAL A 95 -4.955 7.770 1.661 1.00 0.00 C ATOM 370 O VAL A 95 -5.784 8.583 2.070 1.00 0.00 O ATOM 371 CB VAL A 95 -4.341 6.062 3.374 1.00 0.00 C ATOM 372 CG1 VAL A 95 -4.540 4.630 3.845 1.00 0.00 C ATOM 373 CG2 VAL A 95 -2.860 6.391 3.252 1.00 0.00 C ATOM 0 H VAL A 95 -3.516 5.219 1.102 1.00 0.00 H new ATOM 0 HA VAL A 95 -6.107 6.022 2.136 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.778 6.727 4.119 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -4.027 4.485 4.796 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.604 4.434 3.974 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -4.132 3.943 3.104 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.369 6.221 4.210 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.407 5.753 2.494 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -2.742 7.436 2.964 1.00 0.00 H new ATOM 383 N LYS A 96 -3.932 8.110 0.884 1.00 0.00 N ATOM 384 CA LYS A 96 -3.721 9.488 0.456 1.00 0.00 C ATOM 385 C LYS A 96 -2.768 9.548 -0.734 1.00 0.00 C ATOM 386 O LYS A 96 -1.953 8.647 -0.935 1.00 0.00 O ATOM 387 CB LYS A 96 -3.163 10.322 1.612 1.00 0.00 C ATOM 388 CG LYS A 96 -3.567 11.785 1.556 1.00 0.00 C ATOM 389 CD LYS A 96 -3.150 12.528 2.814 1.00 0.00 C ATOM 390 CE LYS A 96 -2.916 14.005 2.539 1.00 0.00 C ATOM 391 NZ LYS A 96 -2.126 14.653 3.622 1.00 0.00 N ATOM 0 H LYS A 96 -3.236 7.450 0.538 1.00 0.00 H new ATOM 0 HA LYS A 96 -4.683 9.899 0.150 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -3.505 9.895 2.555 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -2.075 10.254 1.607 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -3.110 12.256 0.686 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -4.647 11.860 1.429 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -3.922 12.417 3.576 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -2.239 12.083 3.215 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -2.392 14.119 1.590 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -3.876 14.512 2.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -1.988 15.659 3.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -2.637 14.567 4.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -1.200 14.186 3.703 1.00 0.00 H new ATOM 405 N ILE A 97 -2.876 10.615 -1.518 1.00 0.00 N ATOM 406 CA ILE A 97 -2.022 10.793 -2.686 1.00 0.00 C ATOM 407 C ILE A 97 -1.294 12.133 -2.637 1.00 0.00 C ATOM 408 O ILE A 97 -1.846 13.133 -2.180 1.00 0.00 O ATOM 409 CB ILE A 97 -2.832 10.710 -3.993 1.00 0.00 C ATOM 410 CG1 ILE A 97 -3.472 9.327 -4.135 1.00 0.00 C ATOM 411 CG2 ILE A 97 -1.941 11.013 -5.189 1.00 0.00 C ATOM 412 CD1 ILE A 97 -4.808 9.205 -3.438 1.00 0.00 C ATOM 0 H ILE A 97 -3.546 11.369 -1.366 1.00 0.00 H new ATOM 0 HA ILE A 97 -1.291 9.984 -2.668 1.00 0.00 H new ATOM 0 HB ILE A 97 -3.626 11.456 -3.959 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -3.602 9.103 -5.194 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -2.791 8.577 -3.732 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -2.528 10.950 -6.105 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -1.529 12.017 -5.090 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -1.127 10.289 -5.229 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -5.202 8.199 -3.581 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -4.681 9.397 -2.373 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -5.505 9.931 -3.857 1.00 0.00 H new ATOM 424 N ALA A 98 -0.053 12.143 -3.112 1.00 0.00 N ATOM 425 CA ALA A 98 0.749 13.360 -3.125 1.00 0.00 C ATOM 426 C ALA A 98 1.593 13.447 -4.392 1.00 0.00 C ATOM 427 O ALA A 98 1.947 12.428 -4.984 1.00 0.00 O ATOM 428 CB ALA A 98 1.637 13.421 -1.891 1.00 0.00 C ATOM 0 H ALA A 98 0.419 11.323 -3.493 1.00 0.00 H new ATOM 0 HA ALA A 98 0.071 14.213 -3.112 1.00 0.00 H new ATOM 0 HB1 ALA A 98 2.230 14.335 -1.914 1.00 0.00 H new ATOM 0 HB2 ALA A 98 1.016 13.414 -0.995 1.00 0.00 H new ATOM 0 HB3 ALA A 98 2.302 12.557 -1.878 1.00 0.00 H new ATOM 434 N GLU A 99 1.913 14.671 -4.802 1.00 0.00 N ATOM 435 CA GLU A 99 2.715 14.889 -6.000 1.00 0.00 C ATOM 436 C GLU A 99 4.115 14.308 -5.831 1.00 0.00 C ATOM 437 O GLU A 99 4.657 13.687 -6.746 1.00 0.00 O ATOM 438 CB GLU A 99 2.805 16.383 -6.315 1.00 0.00 C ATOM 439 CG GLU A 99 2.968 16.685 -7.795 1.00 0.00 C ATOM 440 CD GLU A 99 2.646 18.127 -8.136 1.00 0.00 C ATOM 441 OE1 GLU A 99 3.053 19.023 -7.367 1.00 0.00 O ATOM 442 OE2 GLU A 99 1.987 18.360 -9.171 1.00 0.00 O ATOM 0 H GLU A 99 1.629 15.525 -4.323 1.00 0.00 H new ATOM 0 HA GLU A 99 2.227 14.379 -6.831 1.00 0.00 H new ATOM 0 HB2 GLU A 99 1.905 16.878 -5.949 1.00 0.00 H new ATOM 0 HB3 GLU A 99 3.647 16.810 -5.771 1.00 0.00 H new ATOM 0 HG2 GLU A 99 3.992 16.465 -8.096 1.00 0.00 H new ATOM 0 HG3 GLU A 99 2.318 16.026 -8.370 1.00 0.00 H new ATOM 449 N ASP A 100 4.696 14.514 -4.654 1.00 0.00 N ATOM 450 CA ASP A 100 6.033 14.010 -4.363 1.00 0.00 C ATOM 451 C ASP A 100 6.018 12.495 -4.192 1.00 0.00 C ATOM 452 O ASP A 100 6.994 11.814 -4.509 1.00 0.00 O ATOM 453 CB ASP A 100 6.587 14.673 -3.100 1.00 0.00 C ATOM 454 CG ASP A 100 6.944 16.130 -3.320 1.00 0.00 C ATOM 455 OD1 ASP A 100 7.319 16.483 -4.457 1.00 0.00 O ATOM 456 OD2 ASP A 100 6.851 16.916 -2.354 1.00 0.00 O ATOM 0 H ASP A 100 4.262 15.026 -3.886 1.00 0.00 H new ATOM 0 HA ASP A 100 6.678 14.255 -5.206 1.00 0.00 H new ATOM 0 HB2 ASP A 100 5.849 14.599 -2.301 1.00 0.00 H new ATOM 0 HB3 ASP A 100 7.472 14.131 -2.767 1.00 0.00 H new ATOM 461 N HIS A 101 4.905 11.972 -3.687 1.00 0.00 N ATOM 462 CA HIS A 101 4.763 10.536 -3.474 1.00 0.00 C ATOM 463 C HIS A 101 3.312 10.173 -3.171 1.00 0.00 C ATOM 464 O HIS A 101 2.450 11.047 -3.078 1.00 0.00 O ATOM 465 CB HIS A 101 5.665 10.078 -2.327 1.00 0.00 C ATOM 466 CG HIS A 101 5.324 10.703 -1.010 1.00 0.00 C ATOM 467 ND1 HIS A 101 5.653 12.003 -0.686 1.00 0.00 N ATOM 468 CD2 HIS A 101 4.677 10.201 0.068 1.00 0.00 C ATOM 469 CE1 HIS A 101 5.225 12.272 0.535 1.00 0.00 C ATOM 470 NE2 HIS A 101 4.629 11.195 1.014 1.00 0.00 N ATOM 0 H HIS A 101 4.089 12.521 -3.418 1.00 0.00 H new ATOM 0 HA HIS A 101 5.064 10.026 -4.389 1.00 0.00 H new ATOM 0 HB2 HIS A 101 5.598 8.994 -2.234 1.00 0.00 H new ATOM 0 HB3 HIS A 101 6.700 10.313 -2.574 1.00 0.00 H new ATOM 0 HD1 HIS A 101 6.149 12.655 -1.294 1.00 0.00 H new ATOM 0 HD2 HIS A 101 4.274 9.204 0.166 1.00 0.00 H new ATOM 0 HE1 HIS A 101 5.343 13.212 1.053 1.00 0.00 H new ATOM 479 N TYR A 102 3.050 8.880 -3.021 1.00 0.00 N ATOM 480 CA TYR A 102 1.704 8.401 -2.733 1.00 0.00 C ATOM 481 C TYR A 102 1.666 7.644 -1.409 1.00 0.00 C ATOM 482 O TYR A 102 2.608 6.932 -1.059 1.00 0.00 O ATOM 483 CB TYR A 102 1.208 7.497 -3.863 1.00 0.00 C ATOM 484 CG TYR A 102 1.090 8.203 -5.195 1.00 0.00 C ATOM 485 CD1 TYR A 102 2.189 8.825 -5.774 1.00 0.00 C ATOM 486 CD2 TYR A 102 -0.121 8.246 -5.876 1.00 0.00 C ATOM 487 CE1 TYR A 102 2.085 9.472 -6.990 1.00 0.00 C ATOM 488 CE2 TYR A 102 -0.234 8.889 -7.093 1.00 0.00 C ATOM 489 CZ TYR A 102 0.872 9.501 -7.646 1.00 0.00 C ATOM 490 OH TYR A 102 0.764 10.143 -8.858 1.00 0.00 O ATOM 0 H TYR A 102 3.753 8.144 -3.094 1.00 0.00 H new ATOM 0 HA TYR A 102 1.048 9.268 -2.655 1.00 0.00 H new ATOM 0 HB2 TYR A 102 1.890 6.653 -3.968 1.00 0.00 H new ATOM 0 HB3 TYR A 102 0.235 7.089 -3.590 1.00 0.00 H new ATOM 0 HD1 TYR A 102 3.141 8.802 -5.265 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -0.989 7.768 -5.446 1.00 0.00 H new ATOM 0 HE1 TYR A 102 2.949 9.953 -7.425 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -1.183 8.913 -7.609 1.00 0.00 H new ATOM 0 HH TYR A 102 0.706 9.479 -9.576 1.00 0.00 H new ATOM 500 N LEU A 103 0.570 7.804 -0.675 1.00 0.00 N ATOM 501 CA LEU A 103 0.407 7.136 0.612 1.00 0.00 C ATOM 502 C LEU A 103 -0.493 5.911 0.479 1.00 0.00 C ATOM 503 O LEU A 103 -1.708 6.035 0.322 1.00 0.00 O ATOM 504 CB LEU A 103 -0.179 8.105 1.640 1.00 0.00 C ATOM 505 CG LEU A 103 0.833 8.918 2.449 1.00 0.00 C ATOM 506 CD1 LEU A 103 1.790 7.996 3.187 1.00 0.00 C ATOM 507 CD2 LEU A 103 1.599 9.869 1.541 1.00 0.00 C ATOM 0 H LEU A 103 -0.219 8.390 -0.949 1.00 0.00 H new ATOM 0 HA LEU A 103 1.389 6.807 0.951 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.840 8.799 1.120 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.797 7.536 2.335 1.00 0.00 H new ATOM 0 HG LEU A 103 0.290 9.509 3.186 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.503 8.592 3.757 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.227 7.356 3.866 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.327 7.378 2.468 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.315 10.440 2.133 1.00 0.00 H new ATOM 0 HD22 LEU A 103 2.131 9.297 0.781 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.901 10.553 1.058 1.00 0.00 H new ATOM 519 N VAL A 104 0.111 4.729 0.546 1.00 0.00 N ATOM 520 CA VAL A 104 -0.636 3.482 0.437 1.00 0.00 C ATOM 521 C VAL A 104 -0.612 2.711 1.752 1.00 0.00 C ATOM 522 O VAL A 104 0.315 2.851 2.548 1.00 0.00 O ATOM 523 CB VAL A 104 -0.071 2.585 -0.681 1.00 0.00 C ATOM 524 CG1 VAL A 104 -1.152 1.663 -1.224 1.00 0.00 C ATOM 525 CG2 VAL A 104 0.525 3.434 -1.794 1.00 0.00 C ATOM 0 H VAL A 104 1.116 4.609 0.675 1.00 0.00 H new ATOM 0 HA VAL A 104 -1.664 3.749 0.194 1.00 0.00 H new ATOM 0 HB VAL A 104 0.723 1.967 -0.261 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -0.734 1.037 -2.013 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -1.528 1.031 -0.420 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -1.969 2.260 -1.629 1.00 0.00 H new ATOM 0 HG21 VAL A 104 0.920 2.785 -2.575 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -0.248 4.078 -2.213 1.00 0.00 H new ATOM 0 HG23 VAL A 104 1.331 4.048 -1.392 1.00 0.00 H new ATOM 535 N GLU A 105 -1.639 1.895 1.972 1.00 0.00 N ATOM 536 CA GLU A 105 -1.736 1.102 3.191 1.00 0.00 C ATOM 537 C GLU A 105 -1.732 -0.390 2.871 1.00 0.00 C ATOM 538 O GLU A 105 -2.652 -0.902 2.235 1.00 0.00 O ATOM 539 CB GLU A 105 -3.005 1.466 3.964 1.00 0.00 C ATOM 540 CG GLU A 105 -3.210 0.639 5.222 1.00 0.00 C ATOM 541 CD GLU A 105 -4.663 0.583 5.654 1.00 0.00 C ATOM 542 OE1 GLU A 105 -5.448 -0.134 4.999 1.00 0.00 O ATOM 543 OE2 GLU A 105 -5.014 1.257 6.645 1.00 0.00 O ATOM 0 H GLU A 105 -2.414 1.766 1.322 1.00 0.00 H new ATOM 0 HA GLU A 105 -0.867 1.326 3.809 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -2.965 2.521 4.235 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -3.868 1.338 3.310 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -2.847 -0.374 5.049 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -2.611 1.059 6.030 1.00 0.00 H new ATOM 550 N VAL A 106 -0.688 -1.082 3.318 1.00 0.00 N ATOM 551 CA VAL A 106 -0.563 -2.515 3.080 1.00 0.00 C ATOM 552 C VAL A 106 -0.495 -3.286 4.393 1.00 0.00 C ATOM 553 O VAL A 106 0.370 -3.030 5.230 1.00 0.00 O ATOM 554 CB VAL A 106 0.688 -2.838 2.242 1.00 0.00 C ATOM 555 CG1 VAL A 106 0.801 -4.337 2.006 1.00 0.00 C ATOM 556 CG2 VAL A 106 0.655 -2.083 0.922 1.00 0.00 C ATOM 0 H VAL A 106 0.083 -0.673 3.847 1.00 0.00 H new ATOM 0 HA VAL A 106 -1.451 -2.823 2.527 1.00 0.00 H new ATOM 0 HB VAL A 106 1.569 -2.515 2.797 1.00 0.00 H new ATOM 0 HG11 VAL A 106 1.691 -4.546 1.412 1.00 0.00 H new ATOM 0 HG12 VAL A 106 0.875 -4.852 2.964 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -0.082 -4.689 1.472 1.00 0.00 H new ATOM 0 HG21 VAL A 106 1.547 -2.323 0.343 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -0.232 -2.373 0.359 1.00 0.00 H new ATOM 0 HG23 VAL A 106 0.627 -1.011 1.117 1.00 0.00 H new ATOM 566 N GLU A 107 -1.413 -4.232 4.566 1.00 0.00 N ATOM 567 CA GLU A 107 -1.456 -5.041 5.779 1.00 0.00 C ATOM 568 C GLU A 107 -1.380 -4.160 7.023 1.00 0.00 C ATOM 569 O GLU A 107 -0.759 -4.527 8.020 1.00 0.00 O ATOM 570 CB GLU A 107 -0.308 -6.052 5.786 1.00 0.00 C ATOM 571 CG GLU A 107 -0.603 -7.312 4.989 1.00 0.00 C ATOM 572 CD GLU A 107 -2.004 -7.841 5.230 1.00 0.00 C ATOM 573 OE1 GLU A 107 -2.435 -7.869 6.401 1.00 0.00 O ATOM 574 OE2 GLU A 107 -2.669 -8.226 4.245 1.00 0.00 O ATOM 0 H GLU A 107 -2.136 -4.457 3.883 1.00 0.00 H new ATOM 0 HA GLU A 107 -2.404 -5.579 5.793 1.00 0.00 H new ATOM 0 HB2 GLU A 107 0.586 -5.577 5.382 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -0.084 -6.328 6.816 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -0.475 -7.104 3.927 1.00 0.00 H new ATOM 0 HG3 GLU A 107 0.122 -8.082 5.252 1.00 0.00 H new ATOM 581 N GLY A 108 -2.017 -2.995 6.956 1.00 0.00 N ATOM 582 CA GLY A 108 -2.009 -2.079 8.082 1.00 0.00 C ATOM 583 C GLY A 108 -0.664 -1.405 8.272 1.00 0.00 C ATOM 584 O GLY A 108 -0.221 -1.195 9.401 1.00 0.00 O ATOM 0 H GLY A 108 -2.538 -2.669 6.142 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -2.775 -1.318 7.933 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -2.271 -2.622 8.990 1.00 0.00 H new ATOM 588 N ASP A 109 -0.012 -1.067 7.165 1.00 0.00 N ATOM 589 CA ASP A 109 1.290 -0.413 7.214 1.00 0.00 C ATOM 590 C ASP A 109 1.446 0.575 6.063 1.00 0.00 C ATOM 591 O ASP A 109 1.422 0.192 4.893 1.00 0.00 O ATOM 592 CB ASP A 109 2.410 -1.454 7.163 1.00 0.00 C ATOM 593 CG ASP A 109 2.624 -2.139 8.498 1.00 0.00 C ATOM 594 OD1 ASP A 109 2.770 -1.427 9.514 1.00 0.00 O ATOM 595 OD2 ASP A 109 2.645 -3.387 8.528 1.00 0.00 O ATOM 0 H ASP A 109 -0.364 -1.235 6.223 1.00 0.00 H new ATOM 0 HA ASP A 109 1.357 0.137 8.153 1.00 0.00 H new ATOM 0 HB2 ASP A 109 2.172 -2.203 6.408 1.00 0.00 H new ATOM 0 HB3 ASP A 109 3.337 -0.972 6.853 1.00 0.00 H new ATOM 600 N LYS A 110 1.604 1.850 6.402 1.00 0.00 N ATOM 601 CA LYS A 110 1.764 2.896 5.398 1.00 0.00 C ATOM 602 C LYS A 110 3.041 2.684 4.590 1.00 0.00 C ATOM 603 O LYS A 110 4.096 2.383 5.148 1.00 0.00 O ATOM 604 CB LYS A 110 1.791 4.272 6.065 1.00 0.00 C ATOM 605 CG LYS A 110 0.507 4.620 6.797 1.00 0.00 C ATOM 606 CD LYS A 110 0.277 6.121 6.839 1.00 0.00 C ATOM 607 CE LYS A 110 -0.981 6.471 7.618 1.00 0.00 C ATOM 608 NZ LYS A 110 -1.048 7.923 7.941 1.00 0.00 N ATOM 0 H LYS A 110 1.625 2.184 7.365 1.00 0.00 H new ATOM 0 HA LYS A 110 0.913 2.846 4.718 1.00 0.00 H new ATOM 0 HB2 LYS A 110 2.622 4.308 6.770 1.00 0.00 H new ATOM 0 HB3 LYS A 110 1.983 5.030 5.306 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -0.336 4.136 6.304 1.00 0.00 H new ATOM 0 HG3 LYS A 110 0.550 4.229 7.814 1.00 0.00 H new ATOM 0 HD2 LYS A 110 1.137 6.609 7.297 1.00 0.00 H new ATOM 0 HD3 LYS A 110 0.196 6.506 5.823 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -1.859 6.187 7.037 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -1.009 5.892 8.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -1.920 8.121 8.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -0.224 8.189 8.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -1.047 8.475 7.060 1.00 0.00 H new ATOM 622 N TRP A 111 2.937 2.846 3.276 1.00 0.00 N ATOM 623 CA TRP A 111 4.085 2.674 2.393 1.00 0.00 C ATOM 624 C TRP A 111 4.215 3.853 1.434 1.00 0.00 C ATOM 625 O TRP A 111 3.215 4.433 1.011 1.00 0.00 O ATOM 626 CB TRP A 111 3.957 1.371 1.604 1.00 0.00 C ATOM 627 CG TRP A 111 4.081 0.145 2.457 1.00 0.00 C ATOM 628 CD1 TRP A 111 3.062 -0.642 2.915 1.00 0.00 C ATOM 629 CD2 TRP A 111 5.292 -0.433 2.957 1.00 0.00 C ATOM 630 NE1 TRP A 111 3.568 -1.673 3.669 1.00 0.00 N ATOM 631 CE2 TRP A 111 4.933 -1.568 3.709 1.00 0.00 C ATOM 632 CE3 TRP A 111 6.645 -0.103 2.840 1.00 0.00 C ATOM 633 CZ2 TRP A 111 5.878 -2.372 4.341 1.00 0.00 C ATOM 634 CZ3 TRP A 111 7.582 -0.901 3.468 1.00 0.00 C ATOM 635 CH2 TRP A 111 7.195 -2.025 4.210 1.00 0.00 C ATOM 0 H TRP A 111 2.071 3.096 2.799 1.00 0.00 H new ATOM 0 HA TRP A 111 4.983 2.630 3.009 1.00 0.00 H new ATOM 0 HB2 TRP A 111 2.993 1.355 1.096 1.00 0.00 H new ATOM 0 HB3 TRP A 111 4.725 1.346 0.831 1.00 0.00 H new ATOM 0 HD1 TRP A 111 2.014 -0.478 2.714 1.00 0.00 H new ATOM 0 HE1 TRP A 111 3.016 -2.399 4.125 1.00 0.00 H new ATOM 0 HE3 TRP A 111 6.953 0.760 2.269 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 5.582 -3.238 4.914 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 8.630 -0.654 3.386 1.00 0.00 H new ATOM 0 HH2 TRP A 111 7.952 -2.630 4.688 1.00 0.00 H new ATOM 646 N ILE A 112 5.452 4.201 1.096 1.00 0.00 N ATOM 647 CA ILE A 112 5.711 5.309 0.185 1.00 0.00 C ATOM 648 C ILE A 112 5.838 4.821 -1.254 1.00 0.00 C ATOM 649 O ILE A 112 6.925 4.458 -1.703 1.00 0.00 O ATOM 650 CB ILE A 112 6.994 6.068 0.573 1.00 0.00 C ATOM 651 CG1 ILE A 112 6.834 6.714 1.951 1.00 0.00 C ATOM 652 CG2 ILE A 112 7.325 7.120 -0.475 1.00 0.00 C ATOM 653 CD1 ILE A 112 5.666 7.671 2.038 1.00 0.00 C ATOM 0 H ILE A 112 6.290 3.732 1.439 1.00 0.00 H new ATOM 0 HA ILE A 112 4.860 5.986 0.262 1.00 0.00 H new ATOM 0 HB ILE A 112 7.819 5.357 0.619 1.00 0.00 H new ATOM 0 HG12 ILE A 112 6.708 5.930 2.698 1.00 0.00 H new ATOM 0 HG13 ILE A 112 7.750 7.248 2.201 1.00 0.00 H new ATOM 0 HG21 ILE A 112 8.234 7.648 -0.186 1.00 0.00 H new ATOM 0 HG22 ILE A 112 7.477 6.637 -1.440 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.502 7.830 -0.550 1.00 0.00 H new ATOM 0 HD11 ILE A 112 5.614 8.091 3.043 1.00 0.00 H new ATOM 0 HD12 ILE A 112 5.800 8.475 1.315 1.00 0.00 H new ATOM 0 HD13 ILE A 112 4.741 7.137 1.819 1.00 0.00 H new ATOM 665 N ALA A 113 4.720 4.817 -1.972 1.00 0.00 N ATOM 666 CA ALA A 113 4.707 4.377 -3.362 1.00 0.00 C ATOM 667 C ALA A 113 4.486 5.553 -4.307 1.00 0.00 C ATOM 668 O ALA A 113 4.090 6.639 -3.882 1.00 0.00 O ATOM 669 CB ALA A 113 3.632 3.321 -3.571 1.00 0.00 C ATOM 0 H ALA A 113 3.812 5.113 -1.615 1.00 0.00 H new ATOM 0 HA ALA A 113 5.679 3.940 -3.588 1.00 0.00 H new ATOM 0 HB1 ALA A 113 3.634 3.002 -4.613 1.00 0.00 H new ATOM 0 HB2 ALA A 113 3.834 2.464 -2.928 1.00 0.00 H new ATOM 0 HB3 ALA A 113 2.657 3.740 -3.321 1.00 0.00 H new ATOM 675 N TYR A 114 4.745 5.330 -5.591 1.00 0.00 N ATOM 676 CA TYR A 114 4.578 6.373 -6.597 1.00 0.00 C ATOM 677 C TYR A 114 4.046 5.790 -7.902 1.00 0.00 C ATOM 678 O TYR A 114 4.663 4.907 -8.498 1.00 0.00 O ATOM 679 CB TYR A 114 5.908 7.086 -6.848 1.00 0.00 C ATOM 680 CG TYR A 114 7.052 6.145 -7.150 1.00 0.00 C ATOM 681 CD1 TYR A 114 7.540 5.279 -6.180 1.00 0.00 C ATOM 682 CD2 TYR A 114 7.645 6.123 -8.406 1.00 0.00 C ATOM 683 CE1 TYR A 114 8.586 4.418 -6.451 1.00 0.00 C ATOM 684 CE2 TYR A 114 8.691 5.264 -8.687 1.00 0.00 C ATOM 685 CZ TYR A 114 9.157 4.414 -7.706 1.00 0.00 C ATOM 686 OH TYR A 114 10.199 3.558 -7.982 1.00 0.00 O ATOM 0 H TYR A 114 5.071 4.437 -5.960 1.00 0.00 H new ATOM 0 HA TYR A 114 3.853 7.094 -6.220 1.00 0.00 H new ATOM 0 HB2 TYR A 114 5.788 7.778 -7.682 1.00 0.00 H new ATOM 0 HB3 TYR A 114 6.161 7.683 -5.972 1.00 0.00 H new ATOM 0 HD1 TYR A 114 7.094 5.279 -5.196 1.00 0.00 H new ATOM 0 HD2 TYR A 114 7.283 6.788 -9.176 1.00 0.00 H new ATOM 0 HE1 TYR A 114 8.954 3.752 -5.684 1.00 0.00 H new ATOM 0 HE2 TYR A 114 9.141 5.259 -9.669 1.00 0.00 H new ATOM 0 HH TYR A 114 10.486 3.680 -8.911 1.00 0.00 H new ATOM 696 N SER A 115 2.896 6.292 -8.341 1.00 0.00 N ATOM 697 CA SER A 115 2.277 5.820 -9.575 1.00 0.00 C ATOM 698 C SER A 115 1.807 6.992 -10.430 1.00 0.00 C ATOM 699 O SER A 115 1.360 8.014 -9.910 1.00 0.00 O ATOM 700 CB SER A 115 1.097 4.899 -9.258 1.00 0.00 C ATOM 701 OG SER A 115 1.536 3.701 -8.642 1.00 0.00 O ATOM 0 H SER A 115 2.374 7.025 -7.861 1.00 0.00 H new ATOM 0 HA SER A 115 3.025 5.261 -10.137 1.00 0.00 H new ATOM 0 HB2 SER A 115 0.396 5.414 -8.601 1.00 0.00 H new ATOM 0 HB3 SER A 115 0.559 4.663 -10.176 1.00 0.00 H new ATOM 0 HG SER A 115 1.371 2.945 -9.243 1.00 0.00 H new ATOM 707 N ASP A 116 1.913 6.837 -11.745 1.00 0.00 N ATOM 708 CA ASP A 116 1.497 7.881 -12.674 1.00 0.00 C ATOM 709 C ASP A 116 0.003 7.787 -12.965 1.00 0.00 C ATOM 710 O ASP A 116 -0.606 8.741 -13.448 1.00 0.00 O ATOM 711 CB ASP A 116 2.291 7.778 -13.978 1.00 0.00 C ATOM 712 CG ASP A 116 3.649 8.444 -13.883 1.00 0.00 C ATOM 713 OD1 ASP A 116 3.701 9.637 -13.520 1.00 0.00 O ATOM 714 OD2 ASP A 116 4.661 7.772 -14.173 1.00 0.00 O ATOM 0 H ASP A 116 2.284 5.998 -12.192 1.00 0.00 H new ATOM 0 HA ASP A 116 1.698 8.847 -12.210 1.00 0.00 H new ATOM 0 HB2 ASP A 116 2.422 6.728 -14.238 1.00 0.00 H new ATOM 0 HB3 ASP A 116 1.720 8.237 -14.785 1.00 0.00 H new ATOM 719 N GLU A 117 -0.581 6.631 -12.668 1.00 0.00 N ATOM 720 CA GLU A 117 -2.004 6.413 -12.899 1.00 0.00 C ATOM 721 C GLU A 117 -2.844 7.155 -11.863 1.00 0.00 C ATOM 722 O GLU A 117 -2.742 6.896 -10.664 1.00 0.00 O ATOM 723 CB GLU A 117 -2.327 4.918 -12.858 1.00 0.00 C ATOM 724 CG GLU A 117 -2.080 4.205 -14.176 1.00 0.00 C ATOM 725 CD GLU A 117 -0.689 3.607 -14.265 1.00 0.00 C ATOM 726 OE1 GLU A 117 -0.440 2.581 -13.597 1.00 0.00 O ATOM 727 OE2 GLU A 117 0.150 4.165 -15.002 1.00 0.00 O ATOM 0 H GLU A 117 -0.091 5.831 -12.267 1.00 0.00 H new ATOM 0 HA GLU A 117 -2.249 6.803 -13.887 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -1.725 4.446 -12.081 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -3.372 4.788 -12.575 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -2.820 3.414 -14.301 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -2.222 4.908 -14.997 1.00 0.00 H new ATOM 734 N LYS A 118 -3.674 8.079 -12.335 1.00 0.00 N ATOM 735 CA LYS A 118 -4.533 8.859 -11.452 1.00 0.00 C ATOM 736 C LYS A 118 -5.282 7.953 -10.481 1.00 0.00 C ATOM 737 O LYS A 118 -6.318 7.381 -10.822 1.00 0.00 O ATOM 738 CB LYS A 118 -5.530 9.681 -12.272 1.00 0.00 C ATOM 739 CG LYS A 118 -4.925 10.926 -12.897 1.00 0.00 C ATOM 740 CD LYS A 118 -4.867 12.076 -11.905 1.00 0.00 C ATOM 741 CE LYS A 118 -3.999 13.213 -12.420 1.00 0.00 C ATOM 742 NZ LYS A 118 -4.758 14.127 -13.319 1.00 0.00 N ATOM 0 H LYS A 118 -3.770 8.306 -13.325 1.00 0.00 H new ATOM 0 HA LYS A 118 -3.901 9.535 -10.876 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -5.943 9.053 -13.061 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -6.361 9.974 -11.630 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -3.920 10.703 -13.256 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -5.515 11.222 -13.765 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -5.875 12.444 -11.714 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -4.473 11.718 -10.954 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -3.604 13.779 -11.576 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -3.144 12.803 -12.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -4.131 14.889 -13.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -5.114 13.593 -14.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -5.559 14.539 -12.799 1.00 0.00 H new ATOM 756 N LEU A 119 -4.753 7.826 -9.269 1.00 0.00 N ATOM 757 CA LEU A 119 -5.372 6.990 -8.247 1.00 0.00 C ATOM 758 C LEU A 119 -6.500 7.737 -7.543 1.00 0.00 C ATOM 759 O LEU A 119 -6.701 8.931 -7.764 1.00 0.00 O ATOM 760 CB LEU A 119 -4.327 6.540 -7.225 1.00 0.00 C ATOM 761 CG LEU A 119 -3.102 5.821 -7.790 1.00 0.00 C ATOM 762 CD1 LEU A 119 -2.117 5.490 -6.679 1.00 0.00 C ATOM 763 CD2 LEU A 119 -3.519 4.557 -8.528 1.00 0.00 C ATOM 0 H LEU A 119 -3.896 8.292 -8.970 1.00 0.00 H new ATOM 0 HA LEU A 119 -5.792 6.112 -8.737 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.987 7.416 -6.673 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -4.812 5.879 -6.506 1.00 0.00 H new ATOM 0 HG LEU A 119 -2.609 6.487 -8.499 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.252 4.979 -7.100 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -1.793 6.411 -6.193 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.599 4.843 -5.946 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -2.634 4.058 -8.924 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -4.036 3.888 -7.840 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -4.186 4.819 -9.350 1.00 0.00 H new ATOM 775 N SER A 120 -7.233 7.026 -6.692 1.00 0.00 N ATOM 776 CA SER A 120 -8.343 7.622 -5.955 1.00 0.00 C ATOM 777 C SER A 120 -8.341 7.158 -4.502 1.00 0.00 C ATOM 778 O SER A 120 -8.175 5.971 -4.217 1.00 0.00 O ATOM 779 CB SER A 120 -9.674 7.260 -6.617 1.00 0.00 C ATOM 780 OG SER A 120 -9.520 7.095 -8.016 1.00 0.00 O ATOM 0 H SER A 120 -7.079 6.037 -6.495 1.00 0.00 H new ATOM 0 HA SER A 120 -8.220 8.705 -5.972 1.00 0.00 H new ATOM 0 HB2 SER A 120 -10.063 6.340 -6.180 1.00 0.00 H new ATOM 0 HB3 SER A 120 -10.407 8.042 -6.418 1.00 0.00 H new ATOM 0 HG SER A 120 -10.384 6.863 -8.415 1.00 0.00 H new ATOM 786 N LEU A 121 -8.527 8.102 -3.586 1.00 0.00 N ATOM 787 CA LEU A 121 -8.548 7.792 -2.161 1.00 0.00 C ATOM 788 C LEU A 121 -9.460 6.604 -1.875 1.00 0.00 C ATOM 789 O LEU A 121 -10.661 6.652 -2.139 1.00 0.00 O ATOM 790 CB LEU A 121 -9.012 9.011 -1.361 1.00 0.00 C ATOM 791 CG LEU A 121 -8.183 10.283 -1.534 1.00 0.00 C ATOM 792 CD1 LEU A 121 -8.961 11.497 -1.050 1.00 0.00 C ATOM 793 CD2 LEU A 121 -6.861 10.164 -0.790 1.00 0.00 C ATOM 0 H LEU A 121 -8.665 9.089 -3.805 1.00 0.00 H new ATOM 0 HA LEU A 121 -7.535 7.529 -1.856 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -10.042 9.232 -1.639 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -9.017 8.746 -0.304 1.00 0.00 H new ATOM 0 HG LEU A 121 -7.969 10.413 -2.595 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -8.355 12.393 -1.181 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -9.881 11.593 -1.627 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -9.206 11.375 0.005 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -6.284 11.079 -0.925 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -7.054 10.009 0.272 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -6.297 9.318 -1.183 1.00 0.00 H new ATOM 805 N GLY A 122 -8.882 5.537 -1.332 1.00 0.00 N ATOM 806 CA GLY A 122 -9.658 4.352 -1.017 1.00 0.00 C ATOM 807 C GLY A 122 -9.719 3.375 -2.174 1.00 0.00 C ATOM 808 O GLY A 122 -10.508 2.430 -2.156 1.00 0.00 O ATOM 0 H GLY A 122 -7.890 5.472 -1.105 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -9.223 3.856 -0.149 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -10.670 4.647 -0.741 1.00 0.00 H new ATOM 812 N ASP A 123 -8.885 3.602 -3.182 1.00 0.00 N ATOM 813 CA ASP A 123 -8.847 2.734 -4.354 1.00 0.00 C ATOM 814 C ASP A 123 -7.987 1.502 -4.090 1.00 0.00 C ATOM 815 O ASP A 123 -7.031 1.555 -3.316 1.00 0.00 O ATOM 816 CB ASP A 123 -8.308 3.498 -5.564 1.00 0.00 C ATOM 817 CG ASP A 123 -8.137 2.609 -6.780 1.00 0.00 C ATOM 818 OD1 ASP A 123 -9.056 1.814 -7.068 1.00 0.00 O ATOM 819 OD2 ASP A 123 -7.084 2.708 -7.445 1.00 0.00 O ATOM 0 H ASP A 123 -8.226 4.380 -3.212 1.00 0.00 H new ATOM 0 HA ASP A 123 -9.865 2.406 -4.566 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -8.988 4.314 -5.807 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -7.349 3.948 -5.308 1.00 0.00 H new ATOM 824 N ARG A 124 -8.334 0.395 -4.737 1.00 0.00 N ATOM 825 CA ARG A 124 -7.595 -0.851 -4.571 1.00 0.00 C ATOM 826 C ARG A 124 -6.435 -0.932 -5.560 1.00 0.00 C ATOM 827 O ARG A 124 -6.612 -0.716 -6.758 1.00 0.00 O ATOM 828 CB ARG A 124 -8.525 -2.050 -4.760 1.00 0.00 C ATOM 829 CG ARG A 124 -9.290 -2.433 -3.504 1.00 0.00 C ATOM 830 CD ARG A 124 -10.456 -3.356 -3.820 1.00 0.00 C ATOM 831 NE ARG A 124 -11.242 -3.672 -2.631 1.00 0.00 N ATOM 832 CZ ARG A 124 -10.876 -4.571 -1.725 1.00 0.00 C ATOM 833 NH1 ARG A 124 -9.740 -5.239 -1.871 1.00 0.00 N ATOM 834 NH2 ARG A 124 -11.645 -4.803 -0.669 1.00 0.00 N ATOM 0 H ARG A 124 -9.122 0.335 -5.381 1.00 0.00 H new ATOM 0 HA ARG A 124 -7.189 -0.871 -3.560 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -9.237 -1.825 -5.554 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -7.937 -2.906 -5.092 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -8.616 -2.924 -2.802 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -9.660 -1.533 -3.014 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -11.098 -2.886 -4.565 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -10.079 -4.279 -4.261 1.00 0.00 H new ATOM 0 HE ARG A 124 -12.121 -3.175 -2.488 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -9.145 -5.063 -2.681 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -9.461 -5.929 -1.174 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -12.519 -4.290 -0.552 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -11.362 -5.494 0.026 1.00 0.00 H new ATOM 848 N VAL A 125 -5.249 -1.244 -5.048 1.00 0.00 N ATOM 849 CA VAL A 125 -4.060 -1.354 -5.886 1.00 0.00 C ATOM 850 C VAL A 125 -3.185 -2.522 -5.447 1.00 0.00 C ATOM 851 O VAL A 125 -3.127 -2.858 -4.264 1.00 0.00 O ATOM 852 CB VAL A 125 -3.226 -0.060 -5.849 1.00 0.00 C ATOM 853 CG1 VAL A 125 -4.049 1.121 -6.343 1.00 0.00 C ATOM 854 CG2 VAL A 125 -2.702 0.196 -4.444 1.00 0.00 C ATOM 0 H VAL A 125 -5.085 -1.425 -4.058 1.00 0.00 H new ATOM 0 HA VAL A 125 -4.406 -1.526 -6.905 1.00 0.00 H new ATOM 0 HB VAL A 125 -2.371 -0.180 -6.515 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -3.443 2.026 -6.310 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -4.370 0.937 -7.368 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -4.924 1.247 -5.706 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -2.115 1.114 -4.436 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -3.541 0.296 -3.755 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -2.074 -0.639 -4.132 1.00 0.00 H new ATOM 864 N MET A 126 -2.505 -3.138 -6.408 1.00 0.00 N ATOM 865 CA MET A 126 -1.630 -4.269 -6.120 1.00 0.00 C ATOM 866 C MET A 126 -0.170 -3.905 -6.370 1.00 0.00 C ATOM 867 O MET A 126 0.177 -3.382 -7.429 1.00 0.00 O ATOM 868 CB MET A 126 -2.021 -5.475 -6.978 1.00 0.00 C ATOM 869 CG MET A 126 -1.153 -6.699 -6.736 1.00 0.00 C ATOM 870 SD MET A 126 -1.557 -8.066 -7.841 1.00 0.00 S ATOM 871 CE MET A 126 -2.608 -9.057 -6.782 1.00 0.00 C ATOM 0 H MET A 126 -2.543 -2.874 -7.392 1.00 0.00 H new ATOM 0 HA MET A 126 -1.746 -4.527 -5.067 1.00 0.00 H new ATOM 0 HB2 MET A 126 -3.061 -5.732 -6.777 1.00 0.00 H new ATOM 0 HB3 MET A 126 -1.959 -5.198 -8.030 1.00 0.00 H new ATOM 0 HG2 MET A 126 -0.105 -6.428 -6.867 1.00 0.00 H new ATOM 0 HG3 MET A 126 -1.271 -7.025 -5.703 1.00 0.00 H new ATOM 0 HE1 MET A 126 -3.347 -9.579 -7.389 1.00 0.00 H new ATOM 0 HE2 MET A 126 -2.000 -9.785 -6.244 1.00 0.00 H new ATOM 0 HE3 MET A 126 -3.117 -8.411 -6.067 1.00 0.00 H new ATOM 881 N VAL A 127 0.681 -4.183 -5.387 1.00 0.00 N ATOM 882 CA VAL A 127 2.104 -3.885 -5.501 1.00 0.00 C ATOM 883 C VAL A 127 2.742 -4.675 -6.638 1.00 0.00 C ATOM 884 O VAL A 127 2.618 -5.898 -6.704 1.00 0.00 O ATOM 885 CB VAL A 127 2.849 -4.199 -4.190 1.00 0.00 C ATOM 886 CG1 VAL A 127 4.350 -4.035 -4.377 1.00 0.00 C ATOM 887 CG2 VAL A 127 2.343 -3.311 -3.064 1.00 0.00 C ATOM 0 H VAL A 127 0.410 -4.614 -4.503 1.00 0.00 H new ATOM 0 HA VAL A 127 2.189 -2.819 -5.712 1.00 0.00 H new ATOM 0 HB VAL A 127 2.652 -5.236 -3.919 1.00 0.00 H new ATOM 0 HG11 VAL A 127 4.860 -4.261 -3.441 1.00 0.00 H new ATOM 0 HG12 VAL A 127 4.697 -4.718 -5.153 1.00 0.00 H new ATOM 0 HG13 VAL A 127 4.570 -3.009 -4.672 1.00 0.00 H new ATOM 0 HG21 VAL A 127 2.880 -3.547 -2.145 1.00 0.00 H new ATOM 0 HG22 VAL A 127 2.508 -2.265 -3.323 1.00 0.00 H new ATOM 0 HG23 VAL A 127 1.277 -3.484 -2.915 1.00 0.00 H new ATOM 897 N VAL A 128 3.425 -3.968 -7.532 1.00 0.00 N ATOM 898 CA VAL A 128 4.085 -4.603 -8.667 1.00 0.00 C ATOM 899 C VAL A 128 5.525 -4.973 -8.329 1.00 0.00 C ATOM 900 O VAL A 128 6.065 -5.948 -8.851 1.00 0.00 O ATOM 901 CB VAL A 128 4.079 -3.687 -9.905 1.00 0.00 C ATOM 902 CG1 VAL A 128 4.695 -2.336 -9.573 1.00 0.00 C ATOM 903 CG2 VAL A 128 4.814 -4.348 -11.060 1.00 0.00 C ATOM 0 H VAL A 128 3.536 -2.955 -7.493 1.00 0.00 H new ATOM 0 HA VAL A 128 3.523 -5.509 -8.893 1.00 0.00 H new ATOM 0 HB VAL A 128 3.045 -3.523 -10.209 1.00 0.00 H new ATOM 0 HG11 VAL A 128 4.682 -1.702 -10.460 1.00 0.00 H new ATOM 0 HG12 VAL A 128 4.121 -1.860 -8.778 1.00 0.00 H new ATOM 0 HG13 VAL A 128 5.724 -2.477 -9.243 1.00 0.00 H new ATOM 0 HG21 VAL A 128 4.800 -3.687 -11.926 1.00 0.00 H new ATOM 0 HG22 VAL A 128 5.846 -4.544 -10.770 1.00 0.00 H new ATOM 0 HG23 VAL A 128 4.324 -5.288 -11.313 1.00 0.00 H new ATOM 913 N ASP A 129 6.141 -4.188 -7.452 1.00 0.00 N ATOM 914 CA ASP A 129 7.519 -4.434 -7.042 1.00 0.00 C ATOM 915 C ASP A 129 7.857 -3.650 -5.778 1.00 0.00 C ATOM 916 O ASP A 129 7.235 -2.630 -5.482 1.00 0.00 O ATOM 917 CB ASP A 129 8.483 -4.054 -8.166 1.00 0.00 C ATOM 918 CG ASP A 129 9.794 -4.811 -8.085 1.00 0.00 C ATOM 919 OD1 ASP A 129 9.775 -5.987 -7.665 1.00 0.00 O ATOM 920 OD2 ASP A 129 10.839 -4.227 -8.441 1.00 0.00 O ATOM 0 H ASP A 129 5.708 -3.376 -7.011 1.00 0.00 H new ATOM 0 HA ASP A 129 7.625 -5.497 -6.828 1.00 0.00 H new ATOM 0 HB2 ASP A 129 8.011 -4.253 -9.128 1.00 0.00 H new ATOM 0 HB3 ASP A 129 8.682 -2.983 -8.124 1.00 0.00 H new ATOM 925 N VAL A 130 8.848 -4.134 -5.035 1.00 0.00 N ATOM 926 CA VAL A 130 9.270 -3.479 -3.803 1.00 0.00 C ATOM 927 C VAL A 130 10.783 -3.296 -3.767 1.00 0.00 C ATOM 928 O VAL A 130 11.534 -4.267 -3.672 1.00 0.00 O ATOM 929 CB VAL A 130 8.831 -4.280 -2.563 1.00 0.00 C ATOM 930 CG1 VAL A 130 9.284 -3.583 -1.289 1.00 0.00 C ATOM 931 CG2 VAL A 130 7.323 -4.480 -2.564 1.00 0.00 C ATOM 0 H VAL A 130 9.373 -4.977 -5.265 1.00 0.00 H new ATOM 0 HA VAL A 130 8.789 -2.501 -3.784 1.00 0.00 H new ATOM 0 HB VAL A 130 9.304 -5.261 -2.600 1.00 0.00 H new ATOM 0 HG11 VAL A 130 8.965 -4.164 -0.423 1.00 0.00 H new ATOM 0 HG12 VAL A 130 10.371 -3.497 -1.288 1.00 0.00 H new ATOM 0 HG13 VAL A 130 8.842 -2.588 -1.242 1.00 0.00 H new ATOM 0 HG21 VAL A 130 7.031 -5.048 -1.681 1.00 0.00 H new ATOM 0 HG22 VAL A 130 6.827 -3.509 -2.552 1.00 0.00 H new ATOM 0 HG23 VAL A 130 7.029 -5.026 -3.460 1.00 0.00 H new ATOM 941 N ASP A 131 11.224 -2.046 -3.844 1.00 0.00 N ATOM 942 CA ASP A 131 12.649 -1.734 -3.819 1.00 0.00 C ATOM 943 C ASP A 131 13.102 -1.379 -2.407 1.00 0.00 C ATOM 944 O ASP A 131 14.109 -0.696 -2.221 1.00 0.00 O ATOM 945 CB ASP A 131 12.957 -0.579 -4.773 1.00 0.00 C ATOM 946 CG ASP A 131 14.357 -0.662 -5.349 1.00 0.00 C ATOM 947 OD1 ASP A 131 14.798 -1.783 -5.676 1.00 0.00 O ATOM 948 OD2 ASP A 131 15.012 0.395 -5.472 1.00 0.00 O ATOM 0 H ASP A 131 10.616 -1.231 -3.924 1.00 0.00 H new ATOM 0 HA ASP A 131 13.196 -2.619 -4.145 1.00 0.00 H new ATOM 0 HB2 ASP A 131 12.232 -0.580 -5.587 1.00 0.00 H new ATOM 0 HB3 ASP A 131 12.840 0.367 -4.244 1.00 0.00 H new ATOM 953 N GLY A 132 12.352 -1.847 -1.414 1.00 0.00 N ATOM 954 CA GLY A 132 12.693 -1.567 -0.031 1.00 0.00 C ATOM 955 C GLY A 132 11.631 -0.745 0.673 1.00 0.00 C ATOM 956 O GLY A 132 10.629 -1.285 1.144 1.00 0.00 O ATOM 0 H GLY A 132 11.515 -2.415 -1.542 1.00 0.00 H new ATOM 0 HA2 GLY A 132 12.834 -2.507 0.503 1.00 0.00 H new ATOM 0 HA3 GLY A 132 13.643 -1.035 0.005 1.00 0.00 H new ATOM 960 N LEU A 133 11.850 0.563 0.746 1.00 0.00 N ATOM 961 CA LEU A 133 10.904 1.461 1.400 1.00 0.00 C ATOM 962 C LEU A 133 9.970 2.104 0.379 1.00 0.00 C ATOM 963 O LEU A 133 9.219 3.024 0.702 1.00 0.00 O ATOM 964 CB LEU A 133 11.654 2.545 2.176 1.00 0.00 C ATOM 965 CG LEU A 133 11.998 2.214 3.629 1.00 0.00 C ATOM 966 CD1 LEU A 133 13.059 1.126 3.691 1.00 0.00 C ATOM 967 CD2 LEU A 133 12.466 3.461 4.364 1.00 0.00 C ATOM 0 H LEU A 133 12.674 1.025 0.361 1.00 0.00 H new ATOM 0 HA LEU A 133 10.304 0.874 2.095 1.00 0.00 H new ATOM 0 HB2 LEU A 133 12.580 2.768 1.646 1.00 0.00 H new ATOM 0 HB3 LEU A 133 11.053 3.454 2.164 1.00 0.00 H new ATOM 0 HG LEU A 133 11.098 1.844 4.120 1.00 0.00 H new ATOM 0 HD11 LEU A 133 13.291 0.903 4.732 1.00 0.00 H new ATOM 0 HD12 LEU A 133 12.686 0.226 3.202 1.00 0.00 H new ATOM 0 HD13 LEU A 133 13.961 1.468 3.183 1.00 0.00 H new ATOM 0 HD21 LEU A 133 12.706 3.206 5.396 1.00 0.00 H new ATOM 0 HD22 LEU A 133 13.353 3.861 3.873 1.00 0.00 H new ATOM 0 HD23 LEU A 133 11.674 4.210 4.350 1.00 0.00 H new ATOM 979 N LYS A 134 10.021 1.613 -0.854 1.00 0.00 N ATOM 980 CA LYS A 134 9.178 2.136 -1.922 1.00 0.00 C ATOM 981 C LYS A 134 8.676 1.010 -2.820 1.00 0.00 C ATOM 982 O LYS A 134 9.466 0.297 -3.441 1.00 0.00 O ATOM 983 CB LYS A 134 9.952 3.160 -2.756 1.00 0.00 C ATOM 984 CG LYS A 134 10.438 4.355 -1.954 1.00 0.00 C ATOM 985 CD LYS A 134 10.888 5.489 -2.859 1.00 0.00 C ATOM 986 CE LYS A 134 12.154 5.125 -3.620 1.00 0.00 C ATOM 987 NZ LYS A 134 13.358 5.165 -2.745 1.00 0.00 N ATOM 0 H LYS A 134 10.638 0.852 -1.139 1.00 0.00 H new ATOM 0 HA LYS A 134 8.317 2.624 -1.465 1.00 0.00 H new ATOM 0 HB2 LYS A 134 10.810 2.668 -3.215 1.00 0.00 H new ATOM 0 HB3 LYS A 134 9.314 3.512 -3.567 1.00 0.00 H new ATOM 0 HG2 LYS A 134 9.639 4.705 -1.301 1.00 0.00 H new ATOM 0 HG3 LYS A 134 11.265 4.051 -1.312 1.00 0.00 H new ATOM 0 HD2 LYS A 134 10.094 5.729 -3.566 1.00 0.00 H new ATOM 0 HD3 LYS A 134 11.065 6.384 -2.262 1.00 0.00 H new ATOM 0 HE2 LYS A 134 12.048 4.127 -4.046 1.00 0.00 H new ATOM 0 HE3 LYS A 134 12.288 5.815 -4.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 14.209 4.994 -3.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 13.427 6.099 -2.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 13.280 4.430 -2.013 1.00 0.00 H new ATOM 1001 N LEU A 135 7.358 0.855 -2.886 1.00 0.00 N ATOM 1002 CA LEU A 135 6.750 -0.184 -3.709 1.00 0.00 C ATOM 1003 C LEU A 135 5.787 0.421 -4.726 1.00 0.00 C ATOM 1004 O LEU A 135 4.902 1.201 -4.371 1.00 0.00 O ATOM 1005 CB LEU A 135 6.012 -1.194 -2.829 1.00 0.00 C ATOM 1006 CG LEU A 135 5.383 -0.637 -1.551 1.00 0.00 C ATOM 1007 CD1 LEU A 135 4.146 -1.437 -1.172 1.00 0.00 C ATOM 1008 CD2 LEU A 135 6.393 -0.642 -0.413 1.00 0.00 C ATOM 0 H LEU A 135 6.690 1.436 -2.379 1.00 0.00 H new ATOM 0 HA LEU A 135 7.546 -0.696 -4.249 1.00 0.00 H new ATOM 0 HB2 LEU A 135 5.226 -1.659 -3.424 1.00 0.00 H new ATOM 0 HB3 LEU A 135 6.711 -1.983 -2.552 1.00 0.00 H new ATOM 0 HG LEU A 135 5.081 0.394 -1.737 1.00 0.00 H new ATOM 0 HD11 LEU A 135 3.712 -1.026 -0.260 1.00 0.00 H new ATOM 0 HD12 LEU A 135 3.415 -1.381 -1.979 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.423 -2.478 -1.005 1.00 0.00 H new ATOM 0 HD21 LEU A 135 5.928 -0.242 0.488 1.00 0.00 H new ATOM 0 HD22 LEU A 135 6.726 -1.663 -0.227 1.00 0.00 H new ATOM 0 HD23 LEU A 135 7.249 -0.024 -0.684 1.00 0.00 H new ATOM 1020 N LYS A 136 5.962 0.055 -5.991 1.00 0.00 N ATOM 1021 CA LYS A 136 5.108 0.558 -7.059 1.00 0.00 C ATOM 1022 C LYS A 136 3.733 -0.102 -7.013 1.00 0.00 C ATOM 1023 O LYS A 136 3.621 -1.311 -6.810 1.00 0.00 O ATOM 1024 CB LYS A 136 5.759 0.310 -8.421 1.00 0.00 C ATOM 1025 CG LYS A 136 6.782 1.364 -8.808 1.00 0.00 C ATOM 1026 CD LYS A 136 7.153 1.269 -10.278 1.00 0.00 C ATOM 1027 CE LYS A 136 8.150 2.348 -10.672 1.00 0.00 C ATOM 1028 NZ LYS A 136 8.677 2.140 -12.050 1.00 0.00 N ATOM 0 H LYS A 136 6.689 -0.589 -6.302 1.00 0.00 H new ATOM 0 HA LYS A 136 4.982 1.631 -6.914 1.00 0.00 H new ATOM 0 HB2 LYS A 136 6.243 -0.667 -8.411 1.00 0.00 H new ATOM 0 HB3 LYS A 136 4.982 0.273 -9.184 1.00 0.00 H new ATOM 0 HG2 LYS A 136 6.382 2.356 -8.596 1.00 0.00 H new ATOM 0 HG3 LYS A 136 7.677 1.245 -8.198 1.00 0.00 H new ATOM 0 HD2 LYS A 136 7.578 0.287 -10.484 1.00 0.00 H new ATOM 0 HD3 LYS A 136 6.254 1.362 -10.888 1.00 0.00 H new ATOM 0 HE2 LYS A 136 7.671 3.325 -10.610 1.00 0.00 H new ATOM 0 HE3 LYS A 136 8.978 2.353 -9.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 9.353 2.896 -12.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 9.156 1.219 -12.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 7.890 2.160 -12.729 1.00 0.00 H new ATOM 1042 N VAL A 137 2.690 0.699 -7.205 1.00 0.00 N ATOM 1043 CA VAL A 137 1.323 0.191 -7.188 1.00 0.00 C ATOM 1044 C VAL A 137 0.673 0.318 -8.561 1.00 0.00 C ATOM 1045 O VAL A 137 0.857 1.316 -9.258 1.00 0.00 O ATOM 1046 CB VAL A 137 0.461 0.937 -6.153 1.00 0.00 C ATOM 1047 CG1 VAL A 137 0.997 0.709 -4.748 1.00 0.00 C ATOM 1048 CG2 VAL A 137 0.404 2.422 -6.477 1.00 0.00 C ATOM 0 H VAL A 137 2.765 1.702 -7.374 1.00 0.00 H new ATOM 0 HA VAL A 137 1.379 -0.862 -6.912 1.00 0.00 H new ATOM 0 HB VAL A 137 -0.553 0.541 -6.198 1.00 0.00 H new ATOM 0 HG11 VAL A 137 0.375 1.244 -4.030 1.00 0.00 H new ATOM 0 HG12 VAL A 137 0.979 -0.357 -4.520 1.00 0.00 H new ATOM 0 HG13 VAL A 137 2.021 1.076 -4.685 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -0.209 2.933 -5.735 1.00 0.00 H new ATOM 0 HG22 VAL A 137 1.412 2.837 -6.462 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -0.031 2.562 -7.466 1.00 0.00 H new ATOM 1058 N LYS A 138 -0.090 -0.700 -8.945 1.00 0.00 N ATOM 1059 CA LYS A 138 -0.771 -0.703 -10.234 1.00 0.00 C ATOM 1060 C LYS A 138 -2.276 -0.869 -10.055 1.00 0.00 C ATOM 1061 O LYS A 138 -2.741 -1.884 -9.535 1.00 0.00 O ATOM 1062 CB LYS A 138 -0.225 -1.827 -11.119 1.00 0.00 C ATOM 1063 CG LYS A 138 1.156 -1.541 -11.683 1.00 0.00 C ATOM 1064 CD LYS A 138 1.383 -2.267 -12.998 1.00 0.00 C ATOM 1065 CE LYS A 138 1.483 -3.771 -12.794 1.00 0.00 C ATOM 1066 NZ LYS A 138 0.149 -4.430 -12.859 1.00 0.00 N ATOM 0 H LYS A 138 -0.252 -1.534 -8.381 1.00 0.00 H new ATOM 0 HA LYS A 138 -0.585 0.256 -10.717 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -0.187 -2.749 -10.539 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -0.917 -1.997 -11.944 1.00 0.00 H new ATOM 0 HG2 LYS A 138 1.273 -0.468 -11.834 1.00 0.00 H new ATOM 0 HG3 LYS A 138 1.915 -1.846 -10.962 1.00 0.00 H new ATOM 0 HD2 LYS A 138 0.565 -2.045 -13.683 1.00 0.00 H new ATOM 0 HD3 LYS A 138 2.298 -1.900 -13.464 1.00 0.00 H new ATOM 0 HE2 LYS A 138 2.136 -4.198 -13.555 1.00 0.00 H new ATOM 0 HE3 LYS A 138 1.943 -3.977 -11.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 0.240 -5.353 -13.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -0.218 -4.567 -11.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -0.508 -3.831 -13.398 1.00 0.00 H new ATOM 1080 N ARG A 139 -3.033 0.133 -10.489 1.00 0.00 N ATOM 1081 CA ARG A 139 -4.486 0.098 -10.375 1.00 0.00 C ATOM 1082 C ARG A 139 -5.031 -1.265 -10.793 1.00 0.00 C ATOM 1083 O ARG A 139 -4.682 -1.785 -11.853 1.00 0.00 O ATOM 1084 CB ARG A 139 -5.113 1.195 -11.237 1.00 0.00 C ATOM 1085 CG ARG A 139 -6.621 1.070 -11.381 1.00 0.00 C ATOM 1086 CD ARG A 139 -7.349 1.744 -10.228 1.00 0.00 C ATOM 1087 NE ARG A 139 -8.693 1.206 -10.040 1.00 0.00 N ATOM 1088 CZ ARG A 139 -9.753 1.619 -10.725 1.00 0.00 C ATOM 1089 NH1 ARG A 139 -9.625 2.571 -11.640 1.00 0.00 N ATOM 1090 NH2 ARG A 139 -10.944 1.081 -10.497 1.00 0.00 N ATOM 0 H ARG A 139 -2.664 0.979 -10.923 1.00 0.00 H new ATOM 0 HA ARG A 139 -4.748 0.271 -9.331 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -4.877 2.166 -10.802 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -4.659 1.171 -12.228 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -6.936 1.518 -12.323 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -6.898 0.016 -11.421 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -6.775 1.613 -9.311 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -7.411 2.816 -10.415 1.00 0.00 H new ATOM 0 HE ARG A 139 -8.825 0.472 -9.344 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -8.711 2.987 -11.819 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -10.441 2.887 -12.165 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -11.047 0.349 -9.794 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -11.757 1.400 -11.024 1.00 0.00 H new ATOM 1104 N ILE A 140 -5.887 -1.837 -9.953 1.00 0.00 N ATOM 1105 CA ILE A 140 -6.479 -3.139 -10.236 1.00 0.00 C ATOM 1106 C ILE A 140 -8.000 -3.083 -10.139 1.00 0.00 C ATOM 1107 O ILE A 140 -8.568 -2.447 -9.251 1.00 0.00 O ATOM 1108 CB ILE A 140 -5.954 -4.218 -9.270 1.00 0.00 C ATOM 1109 CG1 ILE A 140 -6.354 -3.884 -7.831 1.00 0.00 C ATOM 1110 CG2 ILE A 140 -4.443 -4.346 -9.390 1.00 0.00 C ATOM 1111 CD1 ILE A 140 -6.027 -4.981 -6.843 1.00 0.00 C ATOM 0 H ILE A 140 -6.186 -1.420 -9.072 1.00 0.00 H new ATOM 0 HA ILE A 140 -6.191 -3.403 -11.254 1.00 0.00 H new ATOM 0 HB ILE A 140 -6.402 -5.175 -9.539 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -5.848 -2.968 -7.525 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -7.425 -3.683 -7.797 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -4.087 -5.112 -8.701 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -4.181 -4.626 -10.411 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -3.976 -3.392 -9.144 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -6.338 -4.676 -5.844 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -6.554 -5.893 -7.124 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -4.953 -5.167 -6.848 1.00 0.00 H new ATOM 1123 N PRO A 141 -8.677 -3.765 -11.075 1.00 0.00 N ATOM 1124 CA PRO A 141 -10.142 -3.811 -11.116 1.00 0.00 C ATOM 1125 C PRO A 141 -10.730 -4.617 -9.962 1.00 0.00 C ATOM 1126 O PRO A 141 -10.052 -5.429 -9.332 1.00 0.00 O ATOM 1127 CB PRO A 141 -10.438 -4.496 -12.452 1.00 0.00 C ATOM 1128 CG PRO A 141 -9.225 -5.313 -12.736 1.00 0.00 C ATOM 1129 CD PRO A 141 -8.066 -4.545 -12.163 1.00 0.00 C ATOM 0 HA PRO A 141 -10.583 -2.819 -11.023 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -11.329 -5.120 -12.388 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -10.617 -3.765 -13.241 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -9.303 -6.300 -12.280 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -9.100 -5.467 -13.808 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -7.287 -5.211 -11.791 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -7.604 -3.899 -12.910 1.00 0.00 H new ATOM 1137 N PRO A 142 -12.020 -4.389 -9.677 1.00 0.00 N ATOM 1138 CA PRO A 142 -12.728 -5.085 -8.598 1.00 0.00 C ATOM 1139 C PRO A 142 -12.955 -6.560 -8.912 1.00 0.00 C ATOM 1140 O PRO A 142 -12.540 -7.052 -9.960 1.00 0.00 O ATOM 1141 CB PRO A 142 -14.064 -4.344 -8.514 1.00 0.00 C ATOM 1142 CG PRO A 142 -14.263 -3.766 -9.873 1.00 0.00 C ATOM 1143 CD PRO A 142 -12.889 -3.435 -10.387 1.00 0.00 C ATOM 0 HA PRO A 142 -12.162 -5.076 -7.667 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -14.876 -5.021 -8.249 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -14.037 -3.565 -7.752 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -14.765 -4.477 -10.530 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -14.889 -2.875 -9.830 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -12.824 -3.559 -11.468 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -12.616 -2.403 -10.168 1.00 0.00 H new ATOM 1151 N GLN A 143 -13.618 -7.259 -7.996 1.00 0.00 N ATOM 1152 CA GLN A 143 -13.900 -8.679 -8.176 1.00 0.00 C ATOM 1153 C GLN A 143 -15.389 -8.912 -8.411 1.00 0.00 C ATOM 1154 O GLN A 143 -15.966 -9.872 -7.899 1.00 0.00 O ATOM 1155 CB GLN A 143 -13.435 -9.472 -6.954 1.00 0.00 C ATOM 1156 CG GLN A 143 -11.929 -9.442 -6.747 1.00 0.00 C ATOM 1157 CD GLN A 143 -11.514 -10.002 -5.401 1.00 0.00 C ATOM 1158 OE1 GLN A 143 -12.183 -9.784 -4.391 1.00 0.00 O ATOM 1159 NE2 GLN A 143 -10.403 -10.730 -5.380 1.00 0.00 N ATOM 0 H GLN A 143 -13.970 -6.866 -7.123 1.00 0.00 H new ATOM 0 HA GLN A 143 -13.353 -9.024 -9.054 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -13.924 -9.073 -6.065 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -13.759 -10.508 -7.058 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -11.446 -10.014 -7.539 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -11.574 -8.415 -6.834 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -9.879 -10.886 -6.241 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -10.074 -11.133 -4.503 1.00 0.00 H new ATOM 1168 N LEU A 144 -16.006 -8.028 -9.188 1.00 0.00 N ATOM 1169 CA LEU A 144 -17.428 -8.138 -9.492 1.00 0.00 C ATOM 1170 C LEU A 144 -17.767 -9.529 -10.019 1.00 0.00 C ATOM 1171 O LEU A 144 -18.804 -10.096 -9.676 1.00 0.00 O ATOM 1172 CB LEU A 144 -17.834 -7.078 -10.518 1.00 0.00 C ATOM 1173 CG LEU A 144 -17.562 -5.626 -10.126 1.00 0.00 C ATOM 1174 CD1 LEU A 144 -17.829 -4.697 -11.301 1.00 0.00 C ATOM 1175 CD2 LEU A 144 -18.411 -5.229 -8.927 1.00 0.00 C ATOM 0 H LEU A 144 -15.543 -7.227 -9.619 1.00 0.00 H new ATOM 0 HA LEU A 144 -17.985 -7.974 -8.570 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -17.311 -7.285 -11.451 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -18.900 -7.185 -10.719 1.00 0.00 H new ATOM 0 HG LEU A 144 -16.512 -5.535 -9.848 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -17.630 -3.667 -11.003 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -17.178 -4.966 -12.133 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -18.870 -4.791 -11.610 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -18.204 -4.192 -8.662 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -19.467 -5.336 -9.177 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -18.171 -5.874 -8.082 1.00 0.00 H new ATOM 1187 N GLU A 145 -16.885 -10.072 -10.851 1.00 0.00 N ATOM 1188 CA GLU A 145 -17.091 -11.397 -11.424 1.00 0.00 C ATOM 1189 C GLU A 145 -18.543 -11.585 -11.852 1.00 0.00 C ATOM 1190 O GLU A 145 -19.154 -12.617 -11.576 1.00 0.00 O ATOM 1191 CB GLU A 145 -16.702 -12.479 -10.414 1.00 0.00 C ATOM 1192 CG GLU A 145 -16.343 -13.809 -11.055 1.00 0.00 C ATOM 1193 CD GLU A 145 -15.937 -14.857 -10.037 1.00 0.00 C ATOM 1194 OE1 GLU A 145 -14.754 -14.869 -9.637 1.00 0.00 O ATOM 1195 OE2 GLU A 145 -16.802 -15.665 -9.641 1.00 0.00 O ATOM 0 H GLU A 145 -16.021 -9.615 -11.143 1.00 0.00 H new ATOM 0 HA GLU A 145 -16.456 -11.486 -12.305 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -15.854 -12.128 -9.827 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -17.529 -12.631 -9.720 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -17.196 -14.175 -11.627 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -15.527 -13.659 -11.762 1.00 0.00 H new TER 1202 GLU A 145