USER MOD reduce.3.24.130724 H: found=0, std=0, add=612, rem=0, adj=12 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 63:sc= 1.18 USER MOD Single : A 76 THR OG1 : rot 63:sc= 0.0657 USER MOD Single : A 82 LYS NZ :NH3+ 152:sc= -0.471 (180deg=-1.75!) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot -24:sc= 0.12 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+ -160:sc=-0.00336 (180deg=-0.413) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 HIS : no HD1:sc= -0.0725 K(o=-0.072,f=-1.2) USER MOD Single : A 102 TYR OH : rot 93:sc= 0.867 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 -98:sc= 0.104 USER MOD Single : A 118 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0323) USER MOD Single : A 120 SER OG : rot 84:sc= 0.911 USER MOD Single : A 126 MET CE :methyl -172:sc= -0.0604 (180deg=-0.176) 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 K(o=0,f=-0.54) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 72 -5.923 -3.637 29.577 1.00 0.00 N ATOM 2 CA ARG A 72 -5.159 -3.637 28.335 1.00 0.00 C ATOM 3 C ARG A 72 -4.992 -5.056 27.799 1.00 0.00 C ATOM 4 O ARG A 72 -3.905 -5.447 27.374 1.00 0.00 O ATOM 5 CB ARG A 72 -3.785 -3.000 28.556 1.00 0.00 C ATOM 6 CG ARG A 72 -3.841 -1.499 28.788 1.00 0.00 C ATOM 7 CD ARG A 72 -4.599 -1.160 30.061 1.00 0.00 C ATOM 8 NE ARG A 72 -6.029 -0.991 29.819 1.00 0.00 N ATOM 9 CZ ARG A 72 -6.908 -0.706 30.773 1.00 0.00 C ATOM 10 NH1 ARG A 72 -6.504 -0.557 32.028 1.00 0.00 N ATOM 11 NH2 ARG A 72 -8.193 -0.568 30.474 1.00 0.00 N ATOM 0 HA ARG A 72 -5.710 -3.051 27.599 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -3.307 -3.474 29.413 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -3.156 -3.202 27.689 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -2.828 -1.101 28.850 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -4.322 -1.016 27.937 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -4.447 -1.951 30.795 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -4.194 -0.244 30.491 1.00 0.00 H new ATOM 0 HE ARG A 72 -6.372 -1.098 28.864 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -5.517 -0.661 32.262 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -7.181 -0.338 32.759 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -8.507 -0.681 29.510 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -8.867 -0.349 31.208 1.00 0.00 H new ATOM 25 N ARG A 73 -6.078 -5.823 27.823 1.00 0.00 N ATOM 26 CA ARG A 73 -6.052 -7.199 27.341 1.00 0.00 C ATOM 27 C ARG A 73 -6.259 -7.250 25.830 1.00 0.00 C ATOM 28 O ARG A 73 -6.375 -8.327 25.247 1.00 0.00 O ATOM 29 CB ARG A 73 -7.129 -8.028 28.043 1.00 0.00 C ATOM 30 CG ARG A 73 -6.891 -9.527 27.965 1.00 0.00 C ATOM 31 CD ARG A 73 -8.150 -10.309 28.308 1.00 0.00 C ATOM 32 NE ARG A 73 -8.276 -10.538 29.745 1.00 0.00 N ATOM 33 CZ ARG A 73 -8.808 -9.658 30.586 1.00 0.00 C ATOM 34 NH1 ARG A 73 -9.260 -8.496 30.135 1.00 0.00 N ATOM 35 NH2 ARG A 73 -8.888 -9.939 31.880 1.00 0.00 N ATOM 0 H ARG A 73 -6.986 -5.515 28.171 1.00 0.00 H new ATOM 0 HA ARG A 73 -5.073 -7.619 27.570 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -7.179 -7.731 29.090 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -8.098 -7.799 27.600 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -6.559 -9.792 26.961 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -6.090 -9.806 28.650 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -9.024 -9.765 27.949 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -8.135 -11.267 27.788 1.00 0.00 H new ATOM 0 HE ARG A 73 -7.937 -11.422 30.124 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -9.200 -8.276 29.141 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -9.668 -7.822 30.782 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -8.541 -10.832 32.230 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -9.297 -9.262 32.525 1.00 0.00 H new ATOM 49 N GLU A 74 -6.305 -6.078 25.204 1.00 0.00 N ATOM 50 CA GLU A 74 -6.500 -5.990 23.762 1.00 0.00 C ATOM 51 C GLU A 74 -5.160 -5.913 23.036 1.00 0.00 C ATOM 52 O GLU A 74 -5.055 -5.316 21.964 1.00 0.00 O ATOM 53 CB GLU A 74 -7.353 -4.768 23.414 1.00 0.00 C ATOM 54 CG GLU A 74 -8.845 -5.052 23.399 1.00 0.00 C ATOM 55 CD GLU A 74 -9.679 -3.786 23.346 1.00 0.00 C ATOM 56 OE1 GLU A 74 -9.532 -2.940 24.252 1.00 0.00 O ATOM 57 OE2 GLU A 74 -10.479 -3.643 22.398 1.00 0.00 O ATOM 0 H GLU A 74 -6.210 -5.177 25.673 1.00 0.00 H new ATOM 0 HA GLU A 74 -7.019 -6.891 23.435 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -7.150 -3.976 24.135 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -7.053 -4.393 22.435 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.084 -5.676 22.538 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -9.112 -5.621 24.289 1.00 0.00 H new ATOM 64 N THR A 75 -4.137 -6.521 23.628 1.00 0.00 N ATOM 65 CA THR A 75 -2.803 -6.520 23.040 1.00 0.00 C ATOM 66 C THR A 75 -2.801 -7.213 21.682 1.00 0.00 C ATOM 67 O THR A 75 -2.508 -8.404 21.580 1.00 0.00 O ATOM 68 CB THR A 75 -1.783 -7.217 23.960 1.00 0.00 C ATOM 69 OG1 THR A 75 -2.079 -8.615 24.049 1.00 0.00 O ATOM 70 CG2 THR A 75 -1.799 -6.600 25.351 1.00 0.00 C ATOM 0 H THR A 75 -4.207 -7.021 24.515 1.00 0.00 H new ATOM 0 HA THR A 75 -2.514 -5.477 22.914 1.00 0.00 H new ATOM 0 HB THR A 75 -0.790 -7.083 23.532 1.00 0.00 H new ATOM 0 HG1 THR A 75 -1.983 -9.027 23.165 1.00 0.00 H new ATOM 0 HG21 THR A 75 -1.071 -7.108 25.983 1.00 0.00 H new ATOM 0 HG22 THR A 75 -1.545 -5.542 25.283 1.00 0.00 H new ATOM 0 HG23 THR A 75 -2.793 -6.707 25.785 1.00 0.00 H new ATOM 78 N THR A 76 -3.129 -6.458 20.637 1.00 0.00 N ATOM 79 CA THR A 76 -3.165 -6.999 19.285 1.00 0.00 C ATOM 80 C THR A 76 -1.908 -6.622 18.508 1.00 0.00 C ATOM 81 O THR A 76 -1.156 -7.491 18.066 1.00 0.00 O ATOM 82 CB THR A 76 -4.401 -6.500 18.512 1.00 0.00 C ATOM 83 OG1 THR A 76 -5.596 -6.875 19.206 1.00 0.00 O ATOM 84 CG2 THR A 76 -4.426 -7.072 17.103 1.00 0.00 C ATOM 0 H THR A 76 -3.373 -5.470 20.702 1.00 0.00 H new ATOM 0 HA THR A 76 -3.219 -8.083 19.381 1.00 0.00 H new ATOM 0 HB THR A 76 -4.346 -5.414 18.444 1.00 0.00 H new ATOM 0 HG1 THR A 76 -5.618 -6.434 20.081 1.00 0.00 H new ATOM 0 HG21 THR A 76 -5.308 -6.705 16.577 1.00 0.00 H new ATOM 0 HG22 THR A 76 -3.529 -6.761 16.568 1.00 0.00 H new ATOM 0 HG23 THR A 76 -4.460 -8.160 17.153 1.00 0.00 H new ATOM 92 N ASP A 77 -1.686 -5.323 18.346 1.00 0.00 N ATOM 93 CA ASP A 77 -0.519 -4.831 17.624 1.00 0.00 C ATOM 94 C ASP A 77 0.723 -4.870 18.508 1.00 0.00 C ATOM 95 O ASP A 77 0.820 -4.136 19.492 1.00 0.00 O ATOM 96 CB ASP A 77 -0.762 -3.404 17.128 1.00 0.00 C ATOM 97 CG ASP A 77 0.146 -3.029 15.974 1.00 0.00 C ATOM 98 OD1 ASP A 77 1.304 -2.637 16.233 1.00 0.00 O ATOM 99 OD2 ASP A 77 -0.300 -3.128 14.812 1.00 0.00 O ATOM 0 H ASP A 77 -2.299 -4.591 18.705 1.00 0.00 H new ATOM 0 HA ASP A 77 -0.353 -5.482 16.766 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -1.802 -3.303 16.816 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -0.607 -2.705 17.950 1.00 0.00 H new ATOM 104 N ILE A 78 1.670 -5.732 18.152 1.00 0.00 N ATOM 105 CA ILE A 78 2.906 -5.866 18.913 1.00 0.00 C ATOM 106 C ILE A 78 3.948 -4.853 18.453 1.00 0.00 C ATOM 107 O ILE A 78 4.544 -4.147 19.266 1.00 0.00 O ATOM 108 CB ILE A 78 3.493 -7.284 18.786 1.00 0.00 C ATOM 109 CG1 ILE A 78 2.487 -8.324 19.284 1.00 0.00 C ATOM 110 CG2 ILE A 78 4.798 -7.388 19.562 1.00 0.00 C ATOM 111 CD1 ILE A 78 2.798 -9.732 18.830 1.00 0.00 C ATOM 0 H ILE A 78 1.605 -6.348 17.341 1.00 0.00 H new ATOM 0 HA ILE A 78 2.656 -5.677 19.957 1.00 0.00 H new ATOM 0 HB ILE A 78 3.700 -7.482 17.734 1.00 0.00 H new ATOM 0 HG12 ILE A 78 2.461 -8.300 20.373 1.00 0.00 H new ATOM 0 HG13 ILE A 78 1.491 -8.050 18.935 1.00 0.00 H new ATOM 0 HG21 ILE A 78 5.201 -8.396 19.463 1.00 0.00 H new ATOM 0 HG22 ILE A 78 5.515 -6.670 19.165 1.00 0.00 H new ATOM 0 HG23 ILE A 78 4.614 -7.173 20.615 1.00 0.00 H new ATOM 0 HD11 ILE A 78 2.044 -10.415 19.220 1.00 0.00 H new ATOM 0 HD12 ILE A 78 2.795 -9.772 17.741 1.00 0.00 H new ATOM 0 HD13 ILE A 78 3.780 -10.025 19.201 1.00 0.00 H new ATOM 123 N GLY A 79 4.163 -4.786 17.143 1.00 0.00 N ATOM 124 CA GLY A 79 5.133 -3.855 16.596 1.00 0.00 C ATOM 125 C GLY A 79 6.447 -4.525 16.247 1.00 0.00 C ATOM 126 O GLY A 79 7.494 -4.171 16.785 1.00 0.00 O ATOM 0 H GLY A 79 3.683 -5.360 16.450 1.00 0.00 H new ATOM 0 HA2 GLY A 79 4.719 -3.387 15.703 1.00 0.00 H new ATOM 0 HA3 GLY A 79 5.315 -3.059 17.318 1.00 0.00 H new ATOM 130 N GLY A 80 6.391 -5.498 15.342 1.00 0.00 N ATOM 131 CA GLY A 80 7.592 -6.205 14.939 1.00 0.00 C ATOM 132 C GLY A 80 8.186 -5.654 13.657 1.00 0.00 C ATOM 133 O GLY A 80 8.558 -6.411 12.762 1.00 0.00 O ATOM 0 H GLY A 80 5.536 -5.809 14.881 1.00 0.00 H new ATOM 0 HA2 GLY A 80 8.333 -6.141 15.736 1.00 0.00 H new ATOM 0 HA3 GLY A 80 7.360 -7.261 14.804 1.00 0.00 H new ATOM 137 N GLY A 81 8.274 -4.330 13.568 1.00 0.00 N ATOM 138 CA GLY A 81 8.825 -3.702 12.382 1.00 0.00 C ATOM 139 C GLY A 81 7.885 -3.778 11.195 1.00 0.00 C ATOM 140 O GLY A 81 7.183 -4.772 11.012 1.00 0.00 O ATOM 0 H GLY A 81 7.974 -3.682 14.296 1.00 0.00 H new ATOM 0 HA2 GLY A 81 9.048 -2.657 12.598 1.00 0.00 H new ATOM 0 HA3 GLY A 81 9.769 -4.183 12.125 1.00 0.00 H new ATOM 144 N LYS A 82 7.869 -2.724 10.386 1.00 0.00 N ATOM 145 CA LYS A 82 7.008 -2.673 9.211 1.00 0.00 C ATOM 146 C LYS A 82 7.725 -3.234 7.987 1.00 0.00 C ATOM 147 O LYS A 82 7.090 -3.735 7.059 1.00 0.00 O ATOM 148 CB LYS A 82 6.564 -1.234 8.940 1.00 0.00 C ATOM 149 CG LYS A 82 6.467 -0.381 10.193 1.00 0.00 C ATOM 150 CD LYS A 82 6.060 1.046 9.867 1.00 0.00 C ATOM 151 CE LYS A 82 6.647 2.034 10.863 1.00 0.00 C ATOM 152 NZ LYS A 82 8.099 1.795 11.093 1.00 0.00 N ATOM 0 H LYS A 82 8.444 -1.893 10.523 1.00 0.00 H new ATOM 0 HA LYS A 82 6.129 -3.286 9.409 1.00 0.00 H new ATOM 0 HB2 LYS A 82 7.267 -0.770 8.248 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.593 -1.249 8.445 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.741 -0.820 10.877 1.00 0.00 H new ATOM 0 HG3 LYS A 82 7.428 -0.378 10.707 1.00 0.00 H new ATOM 0 HD2 LYS A 82 6.394 1.300 8.861 1.00 0.00 H new ATOM 0 HD3 LYS A 82 4.973 1.126 9.872 1.00 0.00 H new ATOM 0 HE2 LYS A 82 6.500 3.050 10.496 1.00 0.00 H new ATOM 0 HE3 LYS A 82 6.112 1.956 11.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 8.560 2.688 11.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 8.220 1.102 11.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 8.533 1.428 10.222 1.00 0.00 H new ATOM 166 N TYR A 83 9.051 -3.147 7.992 1.00 0.00 N ATOM 167 CA TYR A 83 9.854 -3.645 6.881 1.00 0.00 C ATOM 168 C TYR A 83 9.867 -5.170 6.860 1.00 0.00 C ATOM 169 O TYR A 83 10.654 -5.807 7.561 1.00 0.00 O ATOM 170 CB TYR A 83 11.284 -3.113 6.980 1.00 0.00 C ATOM 171 CG TYR A 83 11.365 -1.676 7.444 1.00 0.00 C ATOM 172 CD1 TYR A 83 10.271 -0.827 7.332 1.00 0.00 C ATOM 173 CD2 TYR A 83 12.535 -1.167 7.994 1.00 0.00 C ATOM 174 CE1 TYR A 83 10.340 0.487 7.754 1.00 0.00 C ATOM 175 CE2 TYR A 83 12.613 0.144 8.420 1.00 0.00 C ATOM 176 CZ TYR A 83 11.513 0.968 8.298 1.00 0.00 C ATOM 177 OH TYR A 83 11.587 2.275 8.720 1.00 0.00 O ATOM 0 H TYR A 83 9.592 -2.736 8.753 1.00 0.00 H new ATOM 0 HA TYR A 83 9.405 -3.291 5.953 1.00 0.00 H new ATOM 0 HB2 TYR A 83 11.849 -3.741 7.669 1.00 0.00 H new ATOM 0 HB3 TYR A 83 11.763 -3.199 6.005 1.00 0.00 H new ATOM 0 HD1 TYR A 83 9.351 -1.200 6.908 1.00 0.00 H new ATOM 0 HD2 TYR A 83 13.399 -1.808 8.090 1.00 0.00 H new ATOM 0 HE1 TYR A 83 9.480 1.134 7.658 1.00 0.00 H new ATOM 0 HE2 TYR A 83 13.530 0.523 8.846 1.00 0.00 H new ATOM 0 HH TYR A 83 12.482 2.453 9.079 1.00 0.00 H new ATOM 187 N THR A 84 8.989 -5.752 6.048 1.00 0.00 N ATOM 188 CA THR A 84 8.898 -7.202 5.934 1.00 0.00 C ATOM 189 C THR A 84 9.350 -7.674 4.557 1.00 0.00 C ATOM 190 O THR A 84 9.668 -8.848 4.366 1.00 0.00 O ATOM 191 CB THR A 84 7.461 -7.696 6.188 1.00 0.00 C ATOM 192 OG1 THR A 84 7.449 -9.123 6.311 1.00 0.00 O ATOM 193 CG2 THR A 84 6.535 -7.272 5.058 1.00 0.00 C ATOM 0 H THR A 84 8.331 -5.241 5.460 1.00 0.00 H new ATOM 0 HA THR A 84 9.558 -7.621 6.693 1.00 0.00 H new ATOM 0 HB THR A 84 7.105 -7.248 7.116 1.00 0.00 H new ATOM 0 HG1 THR A 84 8.222 -9.498 5.839 1.00 0.00 H new ATOM 0 HG21 THR A 84 5.526 -7.632 5.260 1.00 0.00 H new ATOM 0 HG22 THR A 84 6.524 -6.184 4.985 1.00 0.00 H new ATOM 0 HG23 THR A 84 6.890 -7.695 4.118 1.00 0.00 H new ATOM 201 N PHE A 85 9.376 -6.753 3.600 1.00 0.00 N ATOM 202 CA PHE A 85 9.789 -7.076 2.239 1.00 0.00 C ATOM 203 C PHE A 85 8.860 -8.116 1.620 1.00 0.00 C ATOM 204 O PHE A 85 9.310 -9.039 0.942 1.00 0.00 O ATOM 205 CB PHE A 85 11.230 -7.592 2.230 1.00 0.00 C ATOM 206 CG PHE A 85 11.703 -8.024 0.871 1.00 0.00 C ATOM 207 CD1 PHE A 85 11.131 -7.498 -0.276 1.00 0.00 C ATOM 208 CD2 PHE A 85 12.720 -8.956 0.741 1.00 0.00 C ATOM 209 CE1 PHE A 85 11.564 -7.893 -1.528 1.00 0.00 C ATOM 210 CE2 PHE A 85 13.158 -9.354 -0.508 1.00 0.00 C ATOM 211 CZ PHE A 85 12.579 -8.823 -1.643 1.00 0.00 C ATOM 0 H PHE A 85 9.116 -5.777 3.741 1.00 0.00 H new ATOM 0 HA PHE A 85 9.733 -6.165 1.643 1.00 0.00 H new ATOM 0 HB2 PHE A 85 11.890 -6.809 2.604 1.00 0.00 H new ATOM 0 HB3 PHE A 85 11.311 -8.433 2.919 1.00 0.00 H new ATOM 0 HD1 PHE A 85 10.337 -6.771 -0.191 1.00 0.00 H new ATOM 0 HD2 PHE A 85 13.176 -9.376 1.626 1.00 0.00 H new ATOM 0 HE1 PHE A 85 11.110 -7.475 -2.414 1.00 0.00 H new ATOM 0 HE2 PHE A 85 13.953 -10.080 -0.596 1.00 0.00 H new ATOM 0 HZ PHE A 85 12.919 -9.134 -2.620 1.00 0.00 H new ATOM 221 N GLU A 86 7.562 -7.959 1.861 1.00 0.00 N ATOM 222 CA GLU A 86 6.570 -8.885 1.329 1.00 0.00 C ATOM 223 C GLU A 86 5.513 -8.143 0.516 1.00 0.00 C ATOM 224 O GLU A 86 4.848 -8.728 -0.340 1.00 0.00 O ATOM 225 CB GLU A 86 5.902 -9.661 2.467 1.00 0.00 C ATOM 226 CG GLU A 86 6.846 -10.596 3.203 1.00 0.00 C ATOM 227 CD GLU A 86 7.147 -11.857 2.418 1.00 0.00 C ATOM 228 OE1 GLU A 86 6.192 -12.481 1.909 1.00 0.00 O ATOM 229 OE2 GLU A 86 8.337 -12.222 2.313 1.00 0.00 O ATOM 0 H GLU A 86 7.174 -7.200 2.421 1.00 0.00 H new ATOM 0 HA GLU A 86 7.082 -9.587 0.671 1.00 0.00 H new ATOM 0 HB2 GLU A 86 5.478 -8.952 3.179 1.00 0.00 H new ATOM 0 HB3 GLU A 86 5.073 -10.241 2.062 1.00 0.00 H new ATOM 0 HG2 GLU A 86 7.779 -10.073 3.414 1.00 0.00 H new ATOM 0 HG3 GLU A 86 6.408 -10.866 4.164 1.00 0.00 H new ATOM 236 N LEU A 87 5.364 -6.852 0.790 1.00 0.00 N ATOM 237 CA LEU A 87 4.389 -6.028 0.084 1.00 0.00 C ATOM 238 C LEU A 87 4.261 -6.463 -1.372 1.00 0.00 C ATOM 239 O LEU A 87 3.170 -6.442 -1.944 1.00 0.00 O ATOM 240 CB LEU A 87 4.791 -4.554 0.155 1.00 0.00 C ATOM 241 CG LEU A 87 5.383 -4.082 1.483 1.00 0.00 C ATOM 242 CD1 LEU A 87 4.695 -4.775 2.650 1.00 0.00 C ATOM 243 CD2 LEU A 87 6.883 -4.336 1.519 1.00 0.00 C ATOM 0 H LEU A 87 5.906 -6.353 1.496 1.00 0.00 H new ATOM 0 HA LEU A 87 3.421 -6.158 0.569 1.00 0.00 H new ATOM 0 HB2 LEU A 87 5.518 -4.358 -0.634 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.912 -3.948 -0.064 1.00 0.00 H new ATOM 0 HG LEU A 87 5.214 -3.009 1.573 1.00 0.00 H new ATOM 0 HD11 LEU A 87 5.129 -4.427 3.587 1.00 0.00 H new ATOM 0 HD12 LEU A 87 3.630 -4.542 2.635 1.00 0.00 H new ATOM 0 HD13 LEU A 87 4.832 -5.853 2.565 1.00 0.00 H new ATOM 0 HD21 LEU A 87 7.287 -3.994 2.472 1.00 0.00 H new ATOM 0 HD22 LEU A 87 7.074 -5.403 1.406 1.00 0.00 H new ATOM 0 HD23 LEU A 87 7.364 -3.793 0.705 1.00 0.00 H new ATOM 255 N LYS A 88 5.381 -6.857 -1.967 1.00 0.00 N ATOM 256 CA LYS A 88 5.395 -7.301 -3.356 1.00 0.00 C ATOM 257 C LYS A 88 4.288 -8.319 -3.614 1.00 0.00 C ATOM 258 O LYS A 88 4.298 -9.415 -3.055 1.00 0.00 O ATOM 259 CB LYS A 88 6.755 -7.911 -3.705 1.00 0.00 C ATOM 260 CG LYS A 88 7.145 -7.733 -5.162 1.00 0.00 C ATOM 261 CD LYS A 88 8.178 -8.762 -5.592 1.00 0.00 C ATOM 262 CE LYS A 88 9.094 -8.213 -6.675 1.00 0.00 C ATOM 263 NZ LYS A 88 10.113 -9.213 -7.098 1.00 0.00 N ATOM 0 H LYS A 88 6.292 -6.878 -1.509 1.00 0.00 H new ATOM 0 HA LYS A 88 5.220 -6.432 -3.990 1.00 0.00 H new ATOM 0 HB2 LYS A 88 7.520 -7.457 -3.075 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.738 -8.975 -3.469 1.00 0.00 H new ATOM 0 HG2 LYS A 88 6.259 -7.821 -5.790 1.00 0.00 H new ATOM 0 HG3 LYS A 88 7.544 -6.730 -5.313 1.00 0.00 H new ATOM 0 HD2 LYS A 88 8.773 -9.064 -4.730 1.00 0.00 H new ATOM 0 HD3 LYS A 88 7.672 -9.655 -5.960 1.00 0.00 H new ATOM 0 HE2 LYS A 88 8.498 -7.914 -7.538 1.00 0.00 H new ATOM 0 HE3 LYS A 88 9.595 -7.317 -6.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 10.718 -8.801 -7.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 10.698 -9.480 -6.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 9.636 -10.058 -7.472 1.00 0.00 H new ATOM 277 N GLY A 89 3.336 -7.948 -4.465 1.00 0.00 N ATOM 278 CA GLY A 89 2.237 -8.841 -4.782 1.00 0.00 C ATOM 279 C GLY A 89 1.018 -8.590 -3.918 1.00 0.00 C ATOM 280 O GLY A 89 -0.116 -8.774 -4.361 1.00 0.00 O ATOM 0 H GLY A 89 3.306 -7.046 -4.940 1.00 0.00 H new ATOM 0 HA2 GLY A 89 1.966 -8.720 -5.831 1.00 0.00 H new ATOM 0 HA3 GLY A 89 2.563 -9.873 -4.654 1.00 0.00 H new ATOM 284 N LYS A 90 1.249 -8.169 -2.679 1.00 0.00 N ATOM 285 CA LYS A 90 0.161 -7.892 -1.748 1.00 0.00 C ATOM 286 C LYS A 90 -0.655 -6.688 -2.208 1.00 0.00 C ATOM 287 O LYS A 90 -0.158 -5.831 -2.939 1.00 0.00 O ATOM 288 CB LYS A 90 0.716 -7.639 -0.344 1.00 0.00 C ATOM 289 CG LYS A 90 1.079 -8.910 0.404 1.00 0.00 C ATOM 290 CD LYS A 90 1.343 -8.635 1.875 1.00 0.00 C ATOM 291 CE LYS A 90 1.991 -9.830 2.558 1.00 0.00 C ATOM 292 NZ LYS A 90 0.998 -10.893 2.877 1.00 0.00 N ATOM 0 H LYS A 90 2.181 -8.012 -2.296 1.00 0.00 H new ATOM 0 HA LYS A 90 -0.493 -8.764 -1.722 1.00 0.00 H new ATOM 0 HB2 LYS A 90 1.601 -7.007 -0.421 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -0.023 -7.085 0.235 1.00 0.00 H new ATOM 0 HG2 LYS A 90 0.270 -9.634 0.308 1.00 0.00 H new ATOM 0 HG3 LYS A 90 1.964 -9.359 -0.048 1.00 0.00 H new ATOM 0 HD2 LYS A 90 1.990 -7.764 1.973 1.00 0.00 H new ATOM 0 HD3 LYS A 90 0.405 -8.393 2.375 1.00 0.00 H new ATOM 0 HE2 LYS A 90 2.767 -10.240 1.912 1.00 0.00 H new ATOM 0 HE3 LYS A 90 2.480 -9.503 3.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 1.479 -11.690 3.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 0.271 -10.509 3.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 0.549 -11.224 1.999 1.00 0.00 H new ATOM 306 N VAL A 91 -1.910 -6.629 -1.774 1.00 0.00 N ATOM 307 CA VAL A 91 -2.794 -5.529 -2.139 1.00 0.00 C ATOM 308 C VAL A 91 -3.024 -4.593 -0.958 1.00 0.00 C ATOM 309 O VAL A 91 -3.173 -5.038 0.180 1.00 0.00 O ATOM 310 CB VAL A 91 -4.155 -6.046 -2.643 1.00 0.00 C ATOM 311 CG1 VAL A 91 -4.985 -4.904 -3.208 1.00 0.00 C ATOM 312 CG2 VAL A 91 -3.958 -7.138 -3.683 1.00 0.00 C ATOM 0 H VAL A 91 -2.337 -7.330 -1.169 1.00 0.00 H new ATOM 0 HA VAL A 91 -2.302 -4.981 -2.942 1.00 0.00 H new ATOM 0 HB VAL A 91 -4.696 -6.473 -1.799 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -5.942 -5.289 -3.559 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -5.156 -4.159 -2.431 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -4.452 -4.444 -4.040 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -4.930 -7.492 -4.028 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -3.396 -6.739 -4.528 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -3.407 -7.967 -3.240 1.00 0.00 H new ATOM 322 N GLY A 92 -3.051 -3.293 -1.236 1.00 0.00 N ATOM 323 CA GLY A 92 -3.264 -2.314 -0.186 1.00 0.00 C ATOM 324 C GLY A 92 -4.336 -1.305 -0.543 1.00 0.00 C ATOM 325 O GLY A 92 -4.869 -1.320 -1.653 1.00 0.00 O ATOM 0 H GLY A 92 -2.929 -2.900 -2.170 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -3.545 -2.827 0.734 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -2.329 -1.791 0.014 1.00 0.00 H new ATOM 329 N LYS A 93 -4.656 -0.425 0.400 1.00 0.00 N ATOM 330 CA LYS A 93 -5.672 0.597 0.180 1.00 0.00 C ATOM 331 C LYS A 93 -5.062 1.994 0.244 1.00 0.00 C ATOM 332 O LYS A 93 -4.480 2.382 1.256 1.00 0.00 O ATOM 333 CB LYS A 93 -6.787 0.468 1.220 1.00 0.00 C ATOM 334 CG LYS A 93 -7.919 1.462 1.025 1.00 0.00 C ATOM 335 CD LYS A 93 -7.606 2.799 1.677 1.00 0.00 C ATOM 336 CE LYS A 93 -8.870 3.492 2.163 1.00 0.00 C ATOM 337 NZ LYS A 93 -8.573 4.530 3.189 1.00 0.00 N ATOM 0 H LYS A 93 -4.226 -0.399 1.325 1.00 0.00 H new ATOM 0 HA LYS A 93 -6.092 0.448 -0.815 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -7.192 -0.543 1.182 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -6.362 0.604 2.215 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -8.096 1.608 -0.040 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -8.838 1.056 1.448 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -6.928 2.646 2.517 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -7.089 3.441 0.963 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -9.380 3.953 1.317 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -9.552 2.752 2.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -9.435 4.737 3.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -7.833 4.181 3.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -8.243 5.398 2.720 1.00 0.00 H new ATOM 351 N VAL A 94 -5.202 2.746 -0.844 1.00 0.00 N ATOM 352 CA VAL A 94 -4.666 4.100 -0.910 1.00 0.00 C ATOM 353 C VAL A 94 -5.339 5.008 0.113 1.00 0.00 C ATOM 354 O VAL A 94 -6.496 5.396 -0.051 1.00 0.00 O ATOM 355 CB VAL A 94 -4.847 4.707 -2.315 1.00 0.00 C ATOM 356 CG1 VAL A 94 -3.837 4.114 -3.286 1.00 0.00 C ATOM 357 CG2 VAL A 94 -6.268 4.487 -2.811 1.00 0.00 C ATOM 0 H VAL A 94 -5.682 2.440 -1.691 1.00 0.00 H new ATOM 0 HA VAL A 94 -3.602 4.030 -0.686 1.00 0.00 H new ATOM 0 HB VAL A 94 -4.670 5.781 -2.254 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -3.979 4.554 -4.273 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -2.827 4.327 -2.936 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -3.980 3.035 -3.346 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.378 4.922 -3.804 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -6.476 3.418 -2.858 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -6.970 4.963 -2.127 1.00 0.00 H new ATOM 367 N VAL A 95 -4.607 5.343 1.171 1.00 0.00 N ATOM 368 CA VAL A 95 -5.132 6.207 2.222 1.00 0.00 C ATOM 369 C VAL A 95 -5.026 7.677 1.829 1.00 0.00 C ATOM 370 O VAL A 95 -5.714 8.531 2.387 1.00 0.00 O ATOM 371 CB VAL A 95 -4.389 5.988 3.552 1.00 0.00 C ATOM 372 CG1 VAL A 95 -4.687 4.604 4.109 1.00 0.00 C ATOM 373 CG2 VAL A 95 -2.892 6.184 3.365 1.00 0.00 C ATOM 0 H VAL A 95 -3.648 5.029 1.323 1.00 0.00 H new ATOM 0 HA VAL A 95 -6.181 5.944 2.353 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.743 6.727 4.271 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -4.153 4.468 5.049 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.759 4.505 4.282 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -4.363 3.847 3.395 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.383 6.025 4.316 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.520 5.469 2.630 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -2.699 7.198 3.015 1.00 0.00 H new ATOM 383 N LYS A 96 -4.159 7.964 0.864 1.00 0.00 N ATOM 384 CA LYS A 96 -3.963 9.331 0.394 1.00 0.00 C ATOM 385 C LYS A 96 -3.047 9.360 -0.826 1.00 0.00 C ATOM 386 O LYS A 96 -2.339 8.392 -1.105 1.00 0.00 O ATOM 387 CB LYS A 96 -3.371 10.195 1.510 1.00 0.00 C ATOM 388 CG LYS A 96 -3.775 11.657 1.425 1.00 0.00 C ATOM 389 CD LYS A 96 -3.537 12.379 2.741 1.00 0.00 C ATOM 390 CE LYS A 96 -2.071 12.743 2.920 1.00 0.00 C ATOM 391 NZ LYS A 96 -1.849 13.567 4.140 1.00 0.00 N ATOM 0 H LYS A 96 -3.581 7.269 0.392 1.00 0.00 H new ATOM 0 HA LYS A 96 -4.934 9.734 0.107 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -3.686 9.795 2.474 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -2.284 10.124 1.475 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -3.208 12.146 0.633 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -4.828 11.729 1.155 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -4.144 13.283 2.776 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -3.859 11.746 3.568 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -1.476 11.832 2.984 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -1.723 13.290 2.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -0.838 13.794 4.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -2.397 14.448 4.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -2.157 13.035 4.979 1.00 0.00 H new ATOM 405 N ILE A 97 -3.066 10.475 -1.547 1.00 0.00 N ATOM 406 CA ILE A 97 -2.236 10.630 -2.735 1.00 0.00 C ATOM 407 C ILE A 97 -1.517 11.975 -2.732 1.00 0.00 C ATOM 408 O ILE A 97 -2.071 12.986 -2.301 1.00 0.00 O ATOM 409 CB ILE A 97 -3.070 10.510 -4.025 1.00 0.00 C ATOM 410 CG1 ILE A 97 -3.643 9.098 -4.157 1.00 0.00 C ATOM 411 CG2 ILE A 97 -2.222 10.860 -5.238 1.00 0.00 C ATOM 412 CD1 ILE A 97 -4.960 9.048 -4.900 1.00 0.00 C ATOM 0 H ILE A 97 -3.647 11.285 -1.330 1.00 0.00 H new ATOM 0 HA ILE A 97 -1.500 9.827 -2.712 1.00 0.00 H new ATOM 0 HB ILE A 97 -3.900 11.215 -3.972 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -2.919 8.468 -4.674 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -3.780 8.676 -3.162 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -2.825 10.771 -6.142 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -1.858 11.883 -5.144 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -1.374 10.177 -5.299 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -5.307 8.016 -4.956 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -5.699 9.651 -4.372 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -4.824 9.440 -5.908 1.00 0.00 H new ATOM 424 N ALA A 98 -0.279 11.979 -3.216 1.00 0.00 N ATOM 425 CA ALA A 98 0.515 13.200 -3.273 1.00 0.00 C ATOM 426 C ALA A 98 1.524 13.146 -4.415 1.00 0.00 C ATOM 427 O ALA A 98 2.204 12.139 -4.606 1.00 0.00 O ATOM 428 CB ALA A 98 1.226 13.429 -1.948 1.00 0.00 C ATOM 0 H ALA A 98 0.196 11.150 -3.574 1.00 0.00 H new ATOM 0 HA ALA A 98 -0.160 14.035 -3.459 1.00 0.00 H new ATOM 0 HB1 ALA A 98 1.815 14.344 -2.005 1.00 0.00 H new ATOM 0 HB2 ALA A 98 0.489 13.521 -1.151 1.00 0.00 H new ATOM 0 HB3 ALA A 98 1.884 12.586 -1.738 1.00 0.00 H new ATOM 434 N GLU A 99 1.615 14.237 -5.170 1.00 0.00 N ATOM 435 CA GLU A 99 2.541 14.311 -6.294 1.00 0.00 C ATOM 436 C GLU A 99 3.929 13.822 -5.889 1.00 0.00 C ATOM 437 O GLU A 99 4.524 12.983 -6.565 1.00 0.00 O ATOM 438 CB GLU A 99 2.627 15.746 -6.819 1.00 0.00 C ATOM 439 CG GLU A 99 2.955 15.834 -8.299 1.00 0.00 C ATOM 440 CD GLU A 99 2.724 17.222 -8.867 1.00 0.00 C ATOM 441 OE1 GLU A 99 1.827 17.928 -8.361 1.00 0.00 O ATOM 442 OE2 GLU A 99 3.441 17.600 -9.817 1.00 0.00 O ATOM 0 H GLU A 99 1.060 15.080 -5.024 1.00 0.00 H new ATOM 0 HA GLU A 99 2.163 13.664 -7.086 1.00 0.00 H new ATOM 0 HB2 GLU A 99 1.677 16.248 -6.636 1.00 0.00 H new ATOM 0 HB3 GLU A 99 3.387 16.285 -6.254 1.00 0.00 H new ATOM 0 HG2 GLU A 99 3.996 15.551 -8.454 1.00 0.00 H new ATOM 0 HG3 GLU A 99 2.344 15.116 -8.846 1.00 0.00 H new ATOM 449 N ASP A 100 4.437 14.354 -4.783 1.00 0.00 N ATOM 450 CA ASP A 100 5.754 13.972 -4.287 1.00 0.00 C ATOM 451 C ASP A 100 5.806 12.479 -3.977 1.00 0.00 C ATOM 452 O ASP A 100 6.843 11.836 -4.142 1.00 0.00 O ATOM 453 CB ASP A 100 6.104 14.777 -3.035 1.00 0.00 C ATOM 454 CG ASP A 100 7.444 14.381 -2.447 1.00 0.00 C ATOM 455 OD1 ASP A 100 8.394 14.164 -3.229 1.00 0.00 O ATOM 456 OD2 ASP A 100 7.544 14.289 -1.206 1.00 0.00 O ATOM 0 H ASP A 100 3.957 15.051 -4.213 1.00 0.00 H new ATOM 0 HA ASP A 100 6.485 14.189 -5.066 1.00 0.00 H new ATOM 0 HB2 ASP A 100 6.118 15.839 -3.282 1.00 0.00 H new ATOM 0 HB3 ASP A 100 5.325 14.634 -2.286 1.00 0.00 H new ATOM 461 N HIS A 101 4.681 11.933 -3.527 1.00 0.00 N ATOM 462 CA HIS A 101 4.598 10.516 -3.194 1.00 0.00 C ATOM 463 C HIS A 101 3.166 10.123 -2.841 1.00 0.00 C ATOM 464 O HIS A 101 2.347 10.973 -2.491 1.00 0.00 O ATOM 465 CB HIS A 101 5.531 10.189 -2.027 1.00 0.00 C ATOM 466 CG HIS A 101 5.166 10.888 -0.754 1.00 0.00 C ATOM 467 ND1 HIS A 101 5.261 12.254 -0.592 1.00 0.00 N ATOM 468 CD2 HIS A 101 4.702 10.402 0.421 1.00 0.00 C ATOM 469 CE1 HIS A 101 4.873 12.578 0.629 1.00 0.00 C ATOM 470 NE2 HIS A 101 4.528 11.473 1.263 1.00 0.00 N ATOM 0 H HIS A 101 3.814 12.451 -3.385 1.00 0.00 H new ATOM 0 HA HIS A 101 4.908 9.944 -4.069 1.00 0.00 H new ATOM 0 HB2 HIS A 101 5.522 9.113 -1.856 1.00 0.00 H new ATOM 0 HB3 HIS A 101 6.551 10.460 -2.301 1.00 0.00 H new ATOM 0 HD2 HIS A 101 4.505 9.366 0.653 1.00 0.00 H new ATOM 0 HE1 HIS A 101 4.843 13.577 1.038 1.00 0.00 H new ATOM 0 HE2 HIS A 101 4.187 11.423 2.223 1.00 0.00 H new ATOM 479 N TYR A 102 2.872 8.831 -2.936 1.00 0.00 N ATOM 480 CA TYR A 102 1.539 8.327 -2.630 1.00 0.00 C ATOM 481 C TYR A 102 1.546 7.517 -1.337 1.00 0.00 C ATOM 482 O TYR A 102 2.571 6.957 -0.947 1.00 0.00 O ATOM 483 CB TYR A 102 1.020 7.464 -3.782 1.00 0.00 C ATOM 484 CG TYR A 102 0.977 8.188 -5.108 1.00 0.00 C ATOM 485 CD1 TYR A 102 2.134 8.705 -5.678 1.00 0.00 C ATOM 486 CD2 TYR A 102 -0.221 8.354 -5.792 1.00 0.00 C ATOM 487 CE1 TYR A 102 2.098 9.368 -6.890 1.00 0.00 C ATOM 488 CE2 TYR A 102 -0.266 9.014 -7.005 1.00 0.00 C ATOM 489 CZ TYR A 102 0.896 9.520 -7.549 1.00 0.00 C ATOM 490 OH TYR A 102 0.857 10.178 -8.757 1.00 0.00 O ATOM 0 H TYR A 102 3.539 8.114 -3.222 1.00 0.00 H new ATOM 0 HA TYR A 102 0.877 9.183 -2.498 1.00 0.00 H new ATOM 0 HB2 TYR A 102 1.654 6.583 -3.879 1.00 0.00 H new ATOM 0 HB3 TYR A 102 0.018 7.111 -3.538 1.00 0.00 H new ATOM 0 HD1 TYR A 102 3.077 8.587 -5.165 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -1.133 7.960 -5.368 1.00 0.00 H new ATOM 0 HE1 TYR A 102 3.006 9.765 -7.319 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -1.206 9.133 -7.524 1.00 0.00 H new ATOM 0 HH TYR A 102 0.943 9.529 -9.486 1.00 0.00 H new ATOM 500 N LEU A 103 0.395 7.459 -0.676 1.00 0.00 N ATOM 501 CA LEU A 103 0.266 6.718 0.573 1.00 0.00 C ATOM 502 C LEU A 103 -0.604 5.479 0.384 1.00 0.00 C ATOM 503 O LEU A 103 -1.815 5.583 0.188 1.00 0.00 O ATOM 504 CB LEU A 103 -0.330 7.613 1.661 1.00 0.00 C ATOM 505 CG LEU A 103 0.622 8.633 2.287 1.00 0.00 C ATOM 506 CD1 LEU A 103 1.879 7.947 2.798 1.00 0.00 C ATOM 507 CD2 LEU A 103 0.975 9.719 1.282 1.00 0.00 C ATOM 0 H LEU A 103 -0.463 7.917 -0.985 1.00 0.00 H new ATOM 0 HA LEU A 103 1.261 6.397 0.881 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.178 8.150 1.237 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.720 6.976 2.454 1.00 0.00 H new ATOM 0 HG LEU A 103 0.119 9.099 3.134 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.544 8.689 3.240 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.609 7.207 3.551 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.386 7.453 1.969 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.653 10.436 1.744 1.00 0.00 H new ATOM 0 HD22 LEU A 103 1.459 9.269 0.415 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.066 10.231 0.965 1.00 0.00 H new ATOM 519 N VAL A 104 0.021 4.308 0.447 1.00 0.00 N ATOM 520 CA VAL A 104 -0.696 3.049 0.286 1.00 0.00 C ATOM 521 C VAL A 104 -0.608 2.201 1.550 1.00 0.00 C ATOM 522 O VAL A 104 0.483 1.868 2.010 1.00 0.00 O ATOM 523 CB VAL A 104 -0.147 2.238 -0.902 1.00 0.00 C ATOM 524 CG1 VAL A 104 -1.245 1.386 -1.521 1.00 0.00 C ATOM 525 CG2 VAL A 104 0.469 3.164 -1.940 1.00 0.00 C ATOM 0 H VAL A 104 1.023 4.205 0.608 1.00 0.00 H new ATOM 0 HA VAL A 104 -1.739 3.301 0.093 1.00 0.00 H new ATOM 0 HB VAL A 104 0.633 1.571 -0.534 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -0.838 0.820 -2.359 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -1.636 0.696 -0.773 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -2.050 2.030 -1.875 1.00 0.00 H new ATOM 0 HG21 VAL A 104 0.852 2.574 -2.773 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -0.289 3.857 -2.305 1.00 0.00 H new ATOM 0 HG23 VAL A 104 1.286 3.726 -1.487 1.00 0.00 H new ATOM 535 N GLU A 105 -1.765 1.855 2.106 1.00 0.00 N ATOM 536 CA GLU A 105 -1.818 1.045 3.317 1.00 0.00 C ATOM 537 C GLU A 105 -1.710 -0.440 2.985 1.00 0.00 C ATOM 538 O GLU A 105 -2.604 -1.015 2.363 1.00 0.00 O ATOM 539 CB GLU A 105 -3.116 1.315 4.081 1.00 0.00 C ATOM 540 CG GLU A 105 -3.255 0.497 5.354 1.00 0.00 C ATOM 541 CD GLU A 105 -4.598 0.692 6.030 1.00 0.00 C ATOM 542 OE1 GLU A 105 -5.607 0.844 5.309 1.00 0.00 O ATOM 543 OE2 GLU A 105 -4.641 0.692 7.278 1.00 0.00 O ATOM 0 H GLU A 105 -2.677 2.123 1.737 1.00 0.00 H new ATOM 0 HA GLU A 105 -0.971 1.321 3.945 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -3.166 2.374 4.333 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -3.963 1.102 3.428 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -3.121 -0.559 5.119 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -2.460 0.773 6.047 1.00 0.00 H new ATOM 550 N VAL A 106 -0.609 -1.056 3.403 1.00 0.00 N ATOM 551 CA VAL A 106 -0.383 -2.474 3.150 1.00 0.00 C ATOM 552 C VAL A 106 -0.222 -3.246 4.455 1.00 0.00 C ATOM 553 O VAL A 106 0.719 -3.014 5.213 1.00 0.00 O ATOM 554 CB VAL A 106 0.867 -2.696 2.278 1.00 0.00 C ATOM 555 CG1 VAL A 106 1.080 -4.180 2.019 1.00 0.00 C ATOM 556 CG2 VAL A 106 0.746 -1.930 0.970 1.00 0.00 C ATOM 0 H VAL A 106 0.141 -0.595 3.919 1.00 0.00 H new ATOM 0 HA VAL A 106 -1.259 -2.844 2.618 1.00 0.00 H new ATOM 0 HB VAL A 106 1.736 -2.317 2.815 1.00 0.00 H new ATOM 0 HG11 VAL A 106 1.967 -4.318 1.401 1.00 0.00 H new ATOM 0 HG12 VAL A 106 1.214 -4.699 2.968 1.00 0.00 H new ATOM 0 HG13 VAL A 106 0.211 -4.587 1.502 1.00 0.00 H new ATOM 0 HG21 VAL A 106 1.638 -2.098 0.366 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -0.132 -2.277 0.425 1.00 0.00 H new ATOM 0 HG23 VAL A 106 0.645 -0.865 1.180 1.00 0.00 H new ATOM 566 N GLU A 107 -1.149 -4.164 4.711 1.00 0.00 N ATOM 567 CA GLU A 107 -1.109 -4.971 5.925 1.00 0.00 C ATOM 568 C GLU A 107 -1.248 -4.093 7.166 1.00 0.00 C ATOM 569 O GLU A 107 -0.761 -4.438 8.241 1.00 0.00 O ATOM 570 CB GLU A 107 0.196 -5.766 5.994 1.00 0.00 C ATOM 571 CG GLU A 107 0.321 -6.825 4.911 1.00 0.00 C ATOM 572 CD GLU A 107 -0.368 -8.124 5.284 1.00 0.00 C ATOM 573 OE1 GLU A 107 -0.178 -8.590 6.426 1.00 0.00 O ATOM 574 OE2 GLU A 107 -1.096 -8.674 4.431 1.00 0.00 O ATOM 0 H GLU A 107 -1.936 -4.367 4.095 1.00 0.00 H new ATOM 0 HA GLU A 107 -1.948 -5.666 5.896 1.00 0.00 H new ATOM 0 HB2 GLU A 107 1.036 -5.076 5.915 1.00 0.00 H new ATOM 0 HB3 GLU A 107 0.268 -6.246 6.970 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -0.107 -6.444 3.984 1.00 0.00 H new ATOM 0 HG3 GLU A 107 1.376 -7.020 4.718 1.00 0.00 H new ATOM 581 N GLY A 108 -1.917 -2.955 7.006 1.00 0.00 N ATOM 582 CA GLY A 108 -2.108 -2.044 8.120 1.00 0.00 C ATOM 583 C GLY A 108 -0.917 -1.132 8.334 1.00 0.00 C ATOM 584 O GLY A 108 -0.668 -0.677 9.451 1.00 0.00 O ATOM 0 H GLY A 108 -2.330 -2.648 6.125 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -2.997 -1.439 7.942 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -2.289 -2.619 9.028 1.00 0.00 H new ATOM 588 N ASP A 109 -0.179 -0.865 7.263 1.00 0.00 N ATOM 589 CA ASP A 109 0.993 -0.001 7.338 1.00 0.00 C ATOM 590 C ASP A 109 1.154 0.811 6.056 1.00 0.00 C ATOM 591 O ASP A 109 1.399 0.257 4.984 1.00 0.00 O ATOM 592 CB ASP A 109 2.252 -0.833 7.590 1.00 0.00 C ATOM 593 CG ASP A 109 2.489 -1.092 9.065 1.00 0.00 C ATOM 594 OD1 ASP A 109 2.452 -0.122 9.851 1.00 0.00 O ATOM 595 OD2 ASP A 109 2.711 -2.264 9.433 1.00 0.00 O ATOM 0 H ASP A 109 -0.371 -1.235 6.332 1.00 0.00 H new ATOM 0 HA ASP A 109 0.851 0.690 8.169 1.00 0.00 H new ATOM 0 HB2 ASP A 109 2.166 -1.785 7.066 1.00 0.00 H new ATOM 0 HB3 ASP A 109 3.116 -0.316 7.171 1.00 0.00 H new ATOM 600 N LYS A 110 1.012 2.127 6.174 1.00 0.00 N ATOM 601 CA LYS A 110 1.140 3.016 5.025 1.00 0.00 C ATOM 602 C LYS A 110 2.553 2.966 4.453 1.00 0.00 C ATOM 603 O LYS A 110 3.534 2.974 5.197 1.00 0.00 O ATOM 604 CB LYS A 110 0.791 4.452 5.425 1.00 0.00 C ATOM 605 CG LYS A 110 -0.569 4.585 6.087 1.00 0.00 C ATOM 606 CD LYS A 110 -1.076 6.017 6.037 1.00 0.00 C ATOM 607 CE LYS A 110 -0.604 6.817 7.241 1.00 0.00 C ATOM 608 NZ LYS A 110 -1.562 6.725 8.378 1.00 0.00 N ATOM 0 H LYS A 110 0.808 2.601 7.054 1.00 0.00 H new ATOM 0 HA LYS A 110 0.444 2.679 4.257 1.00 0.00 H new ATOM 0 HB2 LYS A 110 1.555 4.827 6.106 1.00 0.00 H new ATOM 0 HB3 LYS A 110 0.817 5.084 4.537 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -1.283 3.928 5.590 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -0.503 4.257 7.125 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -0.728 6.496 5.122 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -2.165 6.018 6.003 1.00 0.00 H new ATOM 0 HE2 LYS A 110 0.373 6.453 7.559 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -0.478 7.862 6.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -1.205 7.284 9.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -2.488 7.096 8.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -1.664 5.731 8.667 1.00 0.00 H new ATOM 622 N TRP A 111 2.649 2.915 3.130 1.00 0.00 N ATOM 623 CA TRP A 111 3.943 2.864 2.459 1.00 0.00 C ATOM 624 C TRP A 111 4.144 4.088 1.571 1.00 0.00 C ATOM 625 O TRP A 111 3.253 4.929 1.448 1.00 0.00 O ATOM 626 CB TRP A 111 4.058 1.588 1.623 1.00 0.00 C ATOM 627 CG TRP A 111 4.187 0.346 2.452 1.00 0.00 C ATOM 628 CD1 TRP A 111 3.171 -0.381 3.004 1.00 0.00 C ATOM 629 CD2 TRP A 111 5.403 -0.314 2.823 1.00 0.00 C ATOM 630 NE1 TRP A 111 3.682 -1.453 3.696 1.00 0.00 N ATOM 631 CE2 TRP A 111 5.048 -1.434 3.600 1.00 0.00 C ATOM 632 CE3 TRP A 111 6.756 -0.068 2.574 1.00 0.00 C ATOM 633 CZ2 TRP A 111 5.998 -2.304 4.128 1.00 0.00 C ATOM 634 CZ3 TRP A 111 7.697 -0.932 3.099 1.00 0.00 C ATOM 635 CH2 TRP A 111 7.315 -2.040 3.868 1.00 0.00 C ATOM 0 H TRP A 111 1.847 2.908 2.500 1.00 0.00 H new ATOM 0 HA TRP A 111 4.720 2.860 3.223 1.00 0.00 H new ATOM 0 HB2 TRP A 111 3.179 1.500 0.984 1.00 0.00 H new ATOM 0 HB3 TRP A 111 4.924 1.669 0.966 1.00 0.00 H new ATOM 0 HD1 TRP A 111 2.121 -0.148 2.910 1.00 0.00 H new ATOM 0 HE1 TRP A 111 3.133 -2.150 4.199 1.00 0.00 H new ATOM 0 HE3 TRP A 111 7.060 0.782 1.982 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 5.706 -3.157 4.722 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 8.745 -0.751 2.914 1.00 0.00 H new ATOM 0 HH2 TRP A 111 8.075 -2.698 4.263 1.00 0.00 H new ATOM 646 N ILE A 112 5.317 4.180 0.954 1.00 0.00 N ATOM 647 CA ILE A 112 5.632 5.300 0.077 1.00 0.00 C ATOM 648 C ILE A 112 5.854 4.830 -1.357 1.00 0.00 C ATOM 649 O ILE A 112 6.964 4.453 -1.732 1.00 0.00 O ATOM 650 CB ILE A 112 6.885 6.056 0.557 1.00 0.00 C ATOM 651 CG1 ILE A 112 6.689 6.553 1.991 1.00 0.00 C ATOM 652 CG2 ILE A 112 7.193 7.218 -0.375 1.00 0.00 C ATOM 653 CD1 ILE A 112 7.087 5.541 3.042 1.00 0.00 C ATOM 0 H ILE A 112 6.065 3.492 1.045 1.00 0.00 H new ATOM 0 HA ILE A 112 4.777 5.975 0.108 1.00 0.00 H new ATOM 0 HB ILE A 112 7.732 5.371 0.542 1.00 0.00 H new ATOM 0 HG12 ILE A 112 7.273 7.462 2.135 1.00 0.00 H new ATOM 0 HG13 ILE A 112 5.642 6.820 2.134 1.00 0.00 H new ATOM 0 HG21 ILE A 112 8.081 7.742 -0.022 1.00 0.00 H new ATOM 0 HG22 ILE A 112 7.371 6.840 -1.382 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.348 7.906 -0.390 1.00 0.00 H new ATOM 0 HD11 ILE A 112 6.921 5.962 4.034 1.00 0.00 H new ATOM 0 HD12 ILE A 112 6.486 4.639 2.925 1.00 0.00 H new ATOM 0 HD13 ILE A 112 8.142 5.291 2.926 1.00 0.00 H new ATOM 665 N ALA A 113 4.791 4.857 -2.154 1.00 0.00 N ATOM 666 CA ALA A 113 4.870 4.438 -3.548 1.00 0.00 C ATOM 667 C ALA A 113 4.454 5.566 -4.485 1.00 0.00 C ATOM 668 O ALA A 113 3.854 6.552 -4.057 1.00 0.00 O ATOM 669 CB ALA A 113 4.003 3.210 -3.779 1.00 0.00 C ATOM 0 H ALA A 113 3.865 5.165 -1.858 1.00 0.00 H new ATOM 0 HA ALA A 113 5.907 4.184 -3.767 1.00 0.00 H new ATOM 0 HB1 ALA A 113 4.071 2.908 -4.824 1.00 0.00 H new ATOM 0 HB2 ALA A 113 4.349 2.396 -3.142 1.00 0.00 H new ATOM 0 HB3 ALA A 113 2.967 3.445 -3.536 1.00 0.00 H new ATOM 675 N TYR A 114 4.777 5.416 -5.765 1.00 0.00 N ATOM 676 CA TYR A 114 4.439 6.424 -6.762 1.00 0.00 C ATOM 677 C TYR A 114 3.869 5.776 -8.020 1.00 0.00 C ATOM 678 O TYR A 114 4.478 4.876 -8.599 1.00 0.00 O ATOM 679 CB TYR A 114 5.673 7.255 -7.117 1.00 0.00 C ATOM 680 CG TYR A 114 6.895 6.420 -7.429 1.00 0.00 C ATOM 681 CD1 TYR A 114 7.579 5.751 -6.422 1.00 0.00 C ATOM 682 CD2 TYR A 114 7.365 6.302 -8.731 1.00 0.00 C ATOM 683 CE1 TYR A 114 8.696 4.988 -6.703 1.00 0.00 C ATOM 684 CE2 TYR A 114 8.481 5.540 -9.021 1.00 0.00 C ATOM 685 CZ TYR A 114 9.143 4.886 -8.004 1.00 0.00 C ATOM 686 OH TYR A 114 10.255 4.127 -8.288 1.00 0.00 O ATOM 0 H TYR A 114 5.273 4.606 -6.136 1.00 0.00 H new ATOM 0 HA TYR A 114 3.679 7.079 -6.336 1.00 0.00 H new ATOM 0 HB2 TYR A 114 5.443 7.883 -7.978 1.00 0.00 H new ATOM 0 HB3 TYR A 114 5.902 7.923 -6.287 1.00 0.00 H new ATOM 0 HD1 TYR A 114 7.232 5.829 -5.402 1.00 0.00 H new ATOM 0 HD2 TYR A 114 6.850 6.814 -9.530 1.00 0.00 H new ATOM 0 HE1 TYR A 114 9.216 4.474 -5.908 1.00 0.00 H new ATOM 0 HE2 TYR A 114 8.832 5.457 -10.039 1.00 0.00 H new ATOM 0 HH TYR A 114 10.436 4.159 -9.251 1.00 0.00 H new ATOM 696 N SER A 115 2.696 6.241 -8.438 1.00 0.00 N ATOM 697 CA SER A 115 2.041 5.706 -9.626 1.00 0.00 C ATOM 698 C SER A 115 1.766 6.812 -10.640 1.00 0.00 C ATOM 699 O SER A 115 1.186 7.845 -10.306 1.00 0.00 O ATOM 700 CB SER A 115 0.732 5.012 -9.243 1.00 0.00 C ATOM 701 OG SER A 115 -0.081 4.792 -10.383 1.00 0.00 O ATOM 0 H SER A 115 2.180 6.987 -7.972 1.00 0.00 H new ATOM 0 HA SER A 115 2.711 4.977 -10.083 1.00 0.00 H new ATOM 0 HB2 SER A 115 0.950 4.060 -8.758 1.00 0.00 H new ATOM 0 HB3 SER A 115 0.192 5.622 -8.519 1.00 0.00 H new ATOM 0 HG SER A 115 -0.759 5.497 -10.443 1.00 0.00 H new ATOM 707 N ASP A 116 2.187 6.587 -11.880 1.00 0.00 N ATOM 708 CA ASP A 116 1.986 7.564 -12.944 1.00 0.00 C ATOM 709 C ASP A 116 0.502 7.859 -13.137 1.00 0.00 C ATOM 710 O ASP A 116 0.128 8.945 -13.580 1.00 0.00 O ATOM 711 CB ASP A 116 2.591 7.055 -14.253 1.00 0.00 C ATOM 712 CG ASP A 116 3.864 6.261 -14.032 1.00 0.00 C ATOM 713 OD1 ASP A 116 4.903 6.881 -13.722 1.00 0.00 O ATOM 714 OD2 ASP A 116 3.822 5.020 -14.170 1.00 0.00 O ATOM 0 H ASP A 116 2.669 5.737 -12.173 1.00 0.00 H new ATOM 0 HA ASP A 116 2.488 8.488 -12.655 1.00 0.00 H new ATOM 0 HB2 ASP A 116 1.861 6.430 -14.768 1.00 0.00 H new ATOM 0 HB3 ASP A 116 2.803 7.902 -14.905 1.00 0.00 H new ATOM 719 N GLU A 117 -0.339 6.886 -12.802 1.00 0.00 N ATOM 720 CA GLU A 117 -1.782 7.042 -12.941 1.00 0.00 C ATOM 721 C GLU A 117 -2.387 7.650 -11.679 1.00 0.00 C ATOM 722 O GLU A 117 -2.352 7.046 -10.606 1.00 0.00 O ATOM 723 CB GLU A 117 -2.438 5.691 -13.234 1.00 0.00 C ATOM 724 CG GLU A 117 -2.152 5.166 -14.631 1.00 0.00 C ATOM 725 CD GLU A 117 -2.376 3.671 -14.750 1.00 0.00 C ATOM 726 OE1 GLU A 117 -1.785 2.918 -13.948 1.00 0.00 O ATOM 727 OE2 GLU A 117 -3.141 3.255 -15.644 1.00 0.00 O ATOM 0 H GLU A 117 -0.046 5.982 -12.433 1.00 0.00 H new ATOM 0 HA GLU A 117 -1.970 7.717 -13.776 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -2.090 4.961 -12.503 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -3.516 5.784 -13.104 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -2.790 5.683 -15.347 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -1.121 5.397 -14.898 1.00 0.00 H new ATOM 734 N LYS A 118 -2.941 8.850 -11.814 1.00 0.00 N ATOM 735 CA LYS A 118 -3.555 9.542 -10.687 1.00 0.00 C ATOM 736 C LYS A 118 -4.580 8.649 -9.994 1.00 0.00 C ATOM 737 O LYS A 118 -5.725 8.543 -10.435 1.00 0.00 O ATOM 738 CB LYS A 118 -4.225 10.834 -11.158 1.00 0.00 C ATOM 739 CG LYS A 118 -4.998 10.681 -12.457 1.00 0.00 C ATOM 740 CD LYS A 118 -6.145 11.673 -12.544 1.00 0.00 C ATOM 741 CE LYS A 118 -7.333 11.227 -11.704 1.00 0.00 C ATOM 742 NZ LYS A 118 -8.089 10.122 -12.356 1.00 0.00 N ATOM 0 H LYS A 118 -2.977 9.364 -12.694 1.00 0.00 H new ATOM 0 HA LYS A 118 -2.770 9.787 -9.972 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -4.903 11.186 -10.381 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -3.463 11.602 -11.287 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -4.325 10.827 -13.301 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -5.387 9.666 -12.532 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -5.807 12.653 -12.206 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -6.454 11.783 -13.583 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -6.983 10.900 -10.725 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -7.999 12.074 -11.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -8.963 9.938 -11.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -8.328 10.393 -13.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -7.504 9.262 -12.369 1.00 0.00 H new ATOM 756 N LEU A 119 -4.163 8.012 -8.906 1.00 0.00 N ATOM 757 CA LEU A 119 -5.045 7.130 -8.150 1.00 0.00 C ATOM 758 C LEU A 119 -6.168 7.921 -7.487 1.00 0.00 C ATOM 759 O LEU A 119 -6.269 9.136 -7.656 1.00 0.00 O ATOM 760 CB LEU A 119 -4.250 6.366 -7.090 1.00 0.00 C ATOM 761 CG LEU A 119 -2.989 5.654 -7.581 1.00 0.00 C ATOM 762 CD1 LEU A 119 -2.309 4.921 -6.435 1.00 0.00 C ATOM 763 CD2 LEU A 119 -3.325 4.690 -8.709 1.00 0.00 C ATOM 0 H LEU A 119 -3.219 8.090 -8.527 1.00 0.00 H new ATOM 0 HA LEU A 119 -5.488 6.418 -8.846 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.965 7.065 -6.304 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -4.908 5.625 -6.635 1.00 0.00 H new ATOM 0 HG LEU A 119 -2.298 6.404 -7.966 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.414 4.420 -6.804 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -2.032 5.635 -5.660 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.993 4.181 -6.019 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -2.415 4.193 -9.046 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -4.035 3.944 -8.351 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.766 5.241 -9.540 1.00 0.00 H new ATOM 775 N SER A 120 -7.010 7.224 -6.730 1.00 0.00 N ATOM 776 CA SER A 120 -8.127 7.861 -6.043 1.00 0.00 C ATOM 777 C SER A 120 -8.311 7.275 -4.646 1.00 0.00 C ATOM 778 O SER A 120 -8.275 6.057 -4.461 1.00 0.00 O ATOM 779 CB SER A 120 -9.414 7.693 -6.852 1.00 0.00 C ATOM 780 OG SER A 120 -9.142 7.665 -8.243 1.00 0.00 O ATOM 0 H SER A 120 -6.939 6.218 -6.577 1.00 0.00 H new ATOM 0 HA SER A 120 -7.903 8.923 -5.946 1.00 0.00 H new ATOM 0 HB2 SER A 120 -9.915 6.771 -6.557 1.00 0.00 H new ATOM 0 HB3 SER A 120 -10.097 8.512 -6.628 1.00 0.00 H new ATOM 0 HG SER A 120 -8.892 6.756 -8.509 1.00 0.00 H new ATOM 786 N LEU A 121 -8.508 8.149 -3.666 1.00 0.00 N ATOM 787 CA LEU A 121 -8.698 7.720 -2.284 1.00 0.00 C ATOM 788 C LEU A 121 -9.665 6.543 -2.208 1.00 0.00 C ATOM 789 O LEU A 121 -10.813 6.641 -2.637 1.00 0.00 O ATOM 790 CB LEU A 121 -9.221 8.881 -1.436 1.00 0.00 C ATOM 791 CG LEU A 121 -8.160 9.795 -0.822 1.00 0.00 C ATOM 792 CD1 LEU A 121 -7.289 9.020 0.154 1.00 0.00 C ATOM 793 CD2 LEU A 121 -7.309 10.431 -1.911 1.00 0.00 C ATOM 0 H LEU A 121 -8.540 9.159 -3.802 1.00 0.00 H new ATOM 0 HA LEU A 121 -7.733 7.399 -1.893 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -9.881 9.489 -2.055 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -9.829 8.471 -0.630 1.00 0.00 H new ATOM 0 HG LEU A 121 -8.665 10.590 -0.274 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -6.540 9.686 0.581 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -7.910 8.613 0.952 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -6.792 8.204 -0.371 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -6.559 11.078 -1.456 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -6.813 9.650 -2.487 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -7.945 11.021 -2.571 1.00 0.00 H new ATOM 805 N GLY A 122 -9.192 5.429 -1.656 1.00 0.00 N ATOM 806 CA GLY A 122 -10.028 4.250 -1.532 1.00 0.00 C ATOM 807 C GLY A 122 -9.865 3.297 -2.699 1.00 0.00 C ATOM 808 O GLY A 122 -10.569 2.292 -2.792 1.00 0.00 O ATOM 0 H GLY A 122 -8.245 5.323 -1.293 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -9.782 3.730 -0.606 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -11.072 4.555 -1.459 1.00 0.00 H new ATOM 812 N ASP A 123 -8.935 3.614 -3.593 1.00 0.00 N ATOM 813 CA ASP A 123 -8.681 2.779 -4.761 1.00 0.00 C ATOM 814 C ASP A 123 -7.758 1.616 -4.408 1.00 0.00 C ATOM 815 O ASP A 123 -6.643 1.820 -3.928 1.00 0.00 O ATOM 816 CB ASP A 123 -8.065 3.612 -5.887 1.00 0.00 C ATOM 817 CG ASP A 123 -9.070 4.545 -6.533 1.00 0.00 C ATOM 818 OD1 ASP A 123 -10.198 4.656 -6.009 1.00 0.00 O ATOM 819 OD2 ASP A 123 -8.729 5.164 -7.563 1.00 0.00 O ATOM 0 H ASP A 123 -8.344 4.443 -3.531 1.00 0.00 H new ATOM 0 HA ASP A 123 -9.634 2.373 -5.100 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -7.234 4.196 -5.490 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -7.653 2.945 -6.645 1.00 0.00 H new ATOM 824 N ARG A 124 -8.231 0.398 -4.649 1.00 0.00 N ATOM 825 CA ARG A 124 -7.449 -0.797 -4.354 1.00 0.00 C ATOM 826 C ARG A 124 -6.303 -0.956 -5.349 1.00 0.00 C ATOM 827 O ARG A 124 -6.513 -0.941 -6.562 1.00 0.00 O ATOM 828 CB ARG A 124 -8.342 -2.038 -4.387 1.00 0.00 C ATOM 829 CG ARG A 124 -7.869 -3.154 -3.469 1.00 0.00 C ATOM 830 CD ARG A 124 -9.032 -3.997 -2.972 1.00 0.00 C ATOM 831 NE ARG A 124 -8.581 -5.233 -2.338 1.00 0.00 N ATOM 832 CZ ARG A 124 -9.368 -6.283 -2.131 1.00 0.00 C ATOM 833 NH1 ARG A 124 -10.639 -6.247 -2.505 1.00 0.00 N ATOM 834 NH2 ARG A 124 -8.883 -7.372 -1.548 1.00 0.00 N ATOM 0 H ARG A 124 -9.151 0.212 -5.048 1.00 0.00 H new ATOM 0 HA ARG A 124 -7.028 -0.687 -3.355 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -9.356 -1.753 -4.106 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -8.388 -2.415 -5.409 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -7.160 -3.788 -4.001 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -7.338 -2.726 -2.618 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -9.621 -3.418 -2.260 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -9.689 -4.237 -3.808 1.00 0.00 H new ATOM 0 HE ARG A 124 -7.608 -5.293 -2.038 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -11.015 -5.412 -2.953 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -11.241 -7.055 -2.345 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -7.905 -7.403 -1.259 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -9.488 -8.178 -1.389 1.00 0.00 H new ATOM 848 N VAL A 125 -5.090 -1.107 -4.827 1.00 0.00 N ATOM 849 CA VAL A 125 -3.910 -1.270 -5.669 1.00 0.00 C ATOM 850 C VAL A 125 -3.063 -2.450 -5.207 1.00 0.00 C ATOM 851 O VAL A 125 -3.233 -2.952 -4.096 1.00 0.00 O ATOM 852 CB VAL A 125 -3.041 0.002 -5.669 1.00 0.00 C ATOM 853 CG1 VAL A 125 -3.821 1.182 -6.230 1.00 0.00 C ATOM 854 CG2 VAL A 125 -2.539 0.303 -4.265 1.00 0.00 C ATOM 0 H VAL A 125 -4.898 -1.120 -3.825 1.00 0.00 H new ATOM 0 HA VAL A 125 -4.268 -1.458 -6.681 1.00 0.00 H new ATOM 0 HB VAL A 125 -2.177 -0.169 -6.311 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -3.191 2.071 -6.222 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -4.127 0.963 -7.253 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -4.705 1.358 -5.617 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -1.927 1.205 -4.283 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -3.389 0.455 -3.599 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -1.941 -0.534 -3.905 1.00 0.00 H new ATOM 864 N MET A 126 -2.151 -2.889 -6.068 1.00 0.00 N ATOM 865 CA MET A 126 -1.275 -4.011 -5.747 1.00 0.00 C ATOM 866 C MET A 126 0.182 -3.662 -6.033 1.00 0.00 C ATOM 867 O MET A 126 0.486 -2.972 -7.005 1.00 0.00 O ATOM 868 CB MET A 126 -1.683 -5.249 -6.548 1.00 0.00 C ATOM 869 CG MET A 126 -0.786 -6.452 -6.305 1.00 0.00 C ATOM 870 SD MET A 126 -1.183 -7.843 -7.382 1.00 0.00 S ATOM 871 CE MET A 126 -2.611 -8.524 -6.542 1.00 0.00 C ATOM 0 H MET A 126 -1.999 -2.486 -6.993 1.00 0.00 H new ATOM 0 HA MET A 126 -1.376 -4.226 -4.683 1.00 0.00 H new ATOM 0 HB2 MET A 126 -2.709 -5.514 -6.294 1.00 0.00 H new ATOM 0 HB3 MET A 126 -1.670 -5.005 -7.610 1.00 0.00 H new ATOM 0 HG2 MET A 126 0.253 -6.163 -6.460 1.00 0.00 H new ATOM 0 HG3 MET A 126 -0.878 -6.765 -5.265 1.00 0.00 H new ATOM 0 HE1 MET A 126 -2.888 -9.472 -7.004 1.00 0.00 H new ATOM 0 HE2 MET A 126 -2.371 -8.689 -5.492 1.00 0.00 H new ATOM 0 HE3 MET A 126 -3.445 -7.826 -6.618 1.00 0.00 H new ATOM 881 N VAL A 127 1.079 -4.144 -5.179 1.00 0.00 N ATOM 882 CA VAL A 127 2.505 -3.884 -5.340 1.00 0.00 C ATOM 883 C VAL A 127 3.096 -4.737 -6.456 1.00 0.00 C ATOM 884 O VAL A 127 3.332 -5.933 -6.280 1.00 0.00 O ATOM 885 CB VAL A 127 3.277 -4.157 -4.036 1.00 0.00 C ATOM 886 CG1 VAL A 127 4.736 -3.753 -4.184 1.00 0.00 C ATOM 887 CG2 VAL A 127 2.628 -3.425 -2.870 1.00 0.00 C ATOM 0 H VAL A 127 0.844 -4.717 -4.368 1.00 0.00 H new ATOM 0 HA VAL A 127 2.607 -2.830 -5.599 1.00 0.00 H new ATOM 0 HB VAL A 127 3.241 -5.227 -3.830 1.00 0.00 H new ATOM 0 HG11 VAL A 127 5.265 -3.953 -3.252 1.00 0.00 H new ATOM 0 HG12 VAL A 127 5.192 -4.326 -4.991 1.00 0.00 H new ATOM 0 HG13 VAL A 127 4.797 -2.689 -4.415 1.00 0.00 H new ATOM 0 HG21 VAL A 127 3.186 -3.629 -1.956 1.00 0.00 H new ATOM 0 HG22 VAL A 127 2.632 -2.353 -3.066 1.00 0.00 H new ATOM 0 HG23 VAL A 127 1.600 -3.768 -2.752 1.00 0.00 H new ATOM 897 N VAL A 128 3.336 -4.115 -7.606 1.00 0.00 N ATOM 898 CA VAL A 128 3.902 -4.817 -8.752 1.00 0.00 C ATOM 899 C VAL A 128 5.407 -4.998 -8.597 1.00 0.00 C ATOM 900 O VAL A 128 6.020 -5.810 -9.290 1.00 0.00 O ATOM 901 CB VAL A 128 3.619 -4.066 -10.066 1.00 0.00 C ATOM 902 CG1 VAL A 128 4.035 -2.608 -9.949 1.00 0.00 C ATOM 903 CG2 VAL A 128 4.331 -4.741 -11.229 1.00 0.00 C ATOM 0 H VAL A 128 3.147 -3.126 -7.769 1.00 0.00 H new ATOM 0 HA VAL A 128 3.424 -5.796 -8.791 1.00 0.00 H new ATOM 0 HB VAL A 128 2.547 -4.098 -10.258 1.00 0.00 H new ATOM 0 HG11 VAL A 128 3.827 -2.094 -10.887 1.00 0.00 H new ATOM 0 HG12 VAL A 128 3.475 -2.133 -9.143 1.00 0.00 H new ATOM 0 HG13 VAL A 128 5.102 -2.550 -9.732 1.00 0.00 H new ATOM 0 HG21 VAL A 128 4.120 -4.197 -12.150 1.00 0.00 H new ATOM 0 HG22 VAL A 128 5.406 -4.742 -11.046 1.00 0.00 H new ATOM 0 HG23 VAL A 128 3.978 -5.768 -11.325 1.00 0.00 H new ATOM 913 N ASP A 129 5.998 -4.237 -7.682 1.00 0.00 N ATOM 914 CA ASP A 129 7.432 -4.314 -7.433 1.00 0.00 C ATOM 915 C ASP A 129 7.829 -3.424 -6.260 1.00 0.00 C ATOM 916 O ASP A 129 7.170 -2.424 -5.974 1.00 0.00 O ATOM 917 CB ASP A 129 8.211 -3.906 -8.685 1.00 0.00 C ATOM 918 CG ASP A 129 9.640 -3.506 -8.373 1.00 0.00 C ATOM 919 OD1 ASP A 129 10.456 -4.403 -8.073 1.00 0.00 O ATOM 920 OD2 ASP A 129 9.942 -2.296 -8.430 1.00 0.00 O ATOM 0 H ASP A 129 5.505 -3.559 -7.100 1.00 0.00 H new ATOM 0 HA ASP A 129 7.677 -5.346 -7.182 1.00 0.00 H new ATOM 0 HB2 ASP A 129 8.215 -4.735 -9.393 1.00 0.00 H new ATOM 0 HB3 ASP A 129 7.702 -3.074 -9.171 1.00 0.00 H new ATOM 925 N VAL A 130 8.911 -3.795 -5.581 1.00 0.00 N ATOM 926 CA VAL A 130 9.396 -3.031 -4.438 1.00 0.00 C ATOM 927 C VAL A 130 10.826 -3.420 -4.084 1.00 0.00 C ATOM 928 O VAL A 130 11.162 -4.603 -4.024 1.00 0.00 O ATOM 929 CB VAL A 130 8.498 -3.237 -3.203 1.00 0.00 C ATOM 930 CG1 VAL A 130 8.519 -4.694 -2.766 1.00 0.00 C ATOM 931 CG2 VAL A 130 8.936 -2.324 -2.068 1.00 0.00 C ATOM 0 H VAL A 130 9.468 -4.620 -5.803 1.00 0.00 H new ATOM 0 HA VAL A 130 9.369 -1.980 -4.726 1.00 0.00 H new ATOM 0 HB VAL A 130 7.474 -2.978 -3.472 1.00 0.00 H new ATOM 0 HG11 VAL A 130 7.879 -4.821 -1.893 1.00 0.00 H new ATOM 0 HG12 VAL A 130 8.154 -5.323 -3.578 1.00 0.00 H new ATOM 0 HG13 VAL A 130 9.539 -4.984 -2.514 1.00 0.00 H new ATOM 0 HG21 VAL A 130 8.291 -2.483 -1.204 1.00 0.00 H new ATOM 0 HG22 VAL A 130 9.967 -2.549 -1.797 1.00 0.00 H new ATOM 0 HG23 VAL A 130 8.864 -1.285 -2.389 1.00 0.00 H new ATOM 941 N ASP A 131 11.666 -2.417 -3.850 1.00 0.00 N ATOM 942 CA ASP A 131 13.061 -2.654 -3.499 1.00 0.00 C ATOM 943 C ASP A 131 13.443 -1.884 -2.239 1.00 0.00 C ATOM 944 O ASP A 131 14.447 -1.174 -2.213 1.00 0.00 O ATOM 945 CB ASP A 131 13.976 -2.249 -4.656 1.00 0.00 C ATOM 946 CG ASP A 131 14.114 -3.345 -5.695 1.00 0.00 C ATOM 947 OD1 ASP A 131 14.808 -4.345 -5.414 1.00 0.00 O ATOM 948 OD2 ASP A 131 13.529 -3.202 -6.788 1.00 0.00 O ATOM 0 H ASP A 131 11.405 -1.432 -3.897 1.00 0.00 H new ATOM 0 HA ASP A 131 13.185 -3.719 -3.304 1.00 0.00 H new ATOM 0 HB2 ASP A 131 13.582 -1.350 -5.130 1.00 0.00 H new ATOM 0 HB3 ASP A 131 14.962 -1.997 -4.265 1.00 0.00 H new ATOM 953 N GLY A 132 12.633 -2.029 -1.194 1.00 0.00 N ATOM 954 CA GLY A 132 12.903 -1.341 0.055 1.00 0.00 C ATOM 955 C GLY A 132 11.667 -0.677 0.629 1.00 0.00 C ATOM 956 O GLY A 132 10.851 -1.328 1.283 1.00 0.00 O ATOM 0 H GLY A 132 11.795 -2.611 -1.190 1.00 0.00 H new ATOM 0 HA2 GLY A 132 13.300 -2.052 0.780 1.00 0.00 H new ATOM 0 HA3 GLY A 132 13.674 -0.588 -0.108 1.00 0.00 H new ATOM 960 N LEU A 133 11.528 0.622 0.387 1.00 0.00 N ATOM 961 CA LEU A 133 10.383 1.375 0.886 1.00 0.00 C ATOM 962 C LEU A 133 9.529 1.895 -0.266 1.00 0.00 C ATOM 963 O LEU A 133 8.499 2.534 -0.050 1.00 0.00 O ATOM 964 CB LEU A 133 10.855 2.543 1.754 1.00 0.00 C ATOM 965 CG LEU A 133 11.655 2.171 3.003 1.00 0.00 C ATOM 966 CD1 LEU A 133 12.429 3.374 3.518 1.00 0.00 C ATOM 967 CD2 LEU A 133 10.733 1.625 4.083 1.00 0.00 C ATOM 0 H LEU A 133 12.194 1.176 -0.152 1.00 0.00 H new ATOM 0 HA LEU A 133 9.774 0.704 1.491 1.00 0.00 H new ATOM 0 HB2 LEU A 133 11.466 3.203 1.139 1.00 0.00 H new ATOM 0 HB3 LEU A 133 9.981 3.116 2.064 1.00 0.00 H new ATOM 0 HG LEU A 133 12.370 1.392 2.736 1.00 0.00 H new ATOM 0 HD11 LEU A 133 12.992 3.091 4.407 1.00 0.00 H new ATOM 0 HD12 LEU A 133 13.117 3.721 2.747 1.00 0.00 H new ATOM 0 HD13 LEU A 133 11.733 4.174 3.769 1.00 0.00 H new ATOM 0 HD21 LEU A 133 11.319 1.365 4.965 1.00 0.00 H new ATOM 0 HD22 LEU A 133 9.995 2.382 4.348 1.00 0.00 H new ATOM 0 HD23 LEU A 133 10.224 0.736 3.711 1.00 0.00 H new ATOM 979 N LYS A 134 9.962 1.614 -1.490 1.00 0.00 N ATOM 980 CA LYS A 134 9.237 2.050 -2.678 1.00 0.00 C ATOM 981 C LYS A 134 8.570 0.867 -3.373 1.00 0.00 C ATOM 982 O LYS A 134 9.217 0.123 -4.111 1.00 0.00 O ATOM 983 CB LYS A 134 10.185 2.758 -3.648 1.00 0.00 C ATOM 984 CG LYS A 134 10.943 3.915 -3.023 1.00 0.00 C ATOM 985 CD LYS A 134 11.596 4.790 -4.080 1.00 0.00 C ATOM 986 CE LYS A 134 11.700 6.236 -3.620 1.00 0.00 C ATOM 987 NZ LYS A 134 12.826 6.950 -4.284 1.00 0.00 N ATOM 0 H LYS A 134 10.812 1.086 -1.686 1.00 0.00 H new ATOM 0 HA LYS A 134 8.461 2.748 -2.364 1.00 0.00 H new ATOM 0 HB2 LYS A 134 10.901 2.034 -4.037 1.00 0.00 H new ATOM 0 HB3 LYS A 134 9.612 3.127 -4.498 1.00 0.00 H new ATOM 0 HG2 LYS A 134 10.260 4.516 -2.423 1.00 0.00 H new ATOM 0 HG3 LYS A 134 11.706 3.529 -2.347 1.00 0.00 H new ATOM 0 HD2 LYS A 134 12.591 4.407 -4.307 1.00 0.00 H new ATOM 0 HD3 LYS A 134 11.017 4.741 -5.002 1.00 0.00 H new ATOM 0 HE2 LYS A 134 10.765 6.753 -3.835 1.00 0.00 H new ATOM 0 HE3 LYS A 134 11.839 6.264 -2.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 12.863 7.932 -3.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 13.721 6.471 -4.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 12.681 6.946 -5.314 1.00 0.00 H new ATOM 1001 N LEU A 135 7.274 0.700 -3.133 1.00 0.00 N ATOM 1002 CA LEU A 135 6.520 -0.392 -3.738 1.00 0.00 C ATOM 1003 C LEU A 135 5.614 0.123 -4.852 1.00 0.00 C ATOM 1004 O LEU A 135 4.584 0.746 -4.591 1.00 0.00 O ATOM 1005 CB LEU A 135 5.684 -1.110 -2.676 1.00 0.00 C ATOM 1006 CG LEU A 135 5.242 -0.262 -1.483 1.00 0.00 C ATOM 1007 CD1 LEU A 135 4.097 -0.936 -0.744 1.00 0.00 C ATOM 1008 CD2 LEU A 135 6.413 -0.013 -0.543 1.00 0.00 C ATOM 0 H LEU A 135 6.724 1.306 -2.524 1.00 0.00 H new ATOM 0 HA LEU A 135 7.231 -1.096 -4.170 1.00 0.00 H new ATOM 0 HB2 LEU A 135 4.794 -1.517 -3.157 1.00 0.00 H new ATOM 0 HB3 LEU A 135 6.259 -1.957 -2.301 1.00 0.00 H new ATOM 0 HG LEU A 135 4.890 0.700 -1.856 1.00 0.00 H new ATOM 0 HD11 LEU A 135 3.796 -0.318 0.102 1.00 0.00 H new ATOM 0 HD12 LEU A 135 3.252 -1.062 -1.420 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.421 -1.912 -0.383 1.00 0.00 H new ATOM 0 HD21 LEU A 135 6.080 0.592 0.300 1.00 0.00 H new ATOM 0 HD22 LEU A 135 6.795 -0.966 -0.177 1.00 0.00 H new ATOM 0 HD23 LEU A 135 7.203 0.514 -1.078 1.00 0.00 H new ATOM 1020 N LYS A 136 6.002 -0.143 -6.094 1.00 0.00 N ATOM 1021 CA LYS A 136 5.225 0.291 -7.249 1.00 0.00 C ATOM 1022 C LYS A 136 3.806 -0.267 -7.190 1.00 0.00 C ATOM 1023 O LYS A 136 3.601 -1.478 -7.265 1.00 0.00 O ATOM 1024 CB LYS A 136 5.905 -0.156 -8.545 1.00 0.00 C ATOM 1025 CG LYS A 136 6.903 0.854 -9.086 1.00 0.00 C ATOM 1026 CD LYS A 136 7.134 0.666 -10.576 1.00 0.00 C ATOM 1027 CE LYS A 136 8.241 1.574 -11.087 1.00 0.00 C ATOM 1028 NZ LYS A 136 8.077 1.889 -12.534 1.00 0.00 N ATOM 0 H LYS A 136 6.851 -0.658 -6.327 1.00 0.00 H new ATOM 0 HA LYS A 136 5.171 1.380 -7.231 1.00 0.00 H new ATOM 0 HB2 LYS A 136 6.417 -1.102 -8.370 1.00 0.00 H new ATOM 0 HB3 LYS A 136 5.142 -0.342 -9.301 1.00 0.00 H new ATOM 0 HG2 LYS A 136 6.538 1.864 -8.898 1.00 0.00 H new ATOM 0 HG3 LYS A 136 7.849 0.753 -8.554 1.00 0.00 H new ATOM 0 HD2 LYS A 136 7.393 -0.374 -10.777 1.00 0.00 H new ATOM 0 HD3 LYS A 136 6.211 0.875 -11.118 1.00 0.00 H new ATOM 0 HE2 LYS A 136 8.246 2.500 -10.512 1.00 0.00 H new ATOM 0 HE3 LYS A 136 9.207 1.095 -10.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 8.851 2.510 -12.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 8.098 1.008 -13.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 7.167 2.369 -12.684 1.00 0.00 H new ATOM 1042 N VAL A 137 2.830 0.625 -7.055 1.00 0.00 N ATOM 1043 CA VAL A 137 1.430 0.222 -6.989 1.00 0.00 C ATOM 1044 C VAL A 137 0.722 0.475 -8.315 1.00 0.00 C ATOM 1045 O VAL A 137 1.075 1.394 -9.055 1.00 0.00 O ATOM 1046 CB VAL A 137 0.683 0.971 -5.869 1.00 0.00 C ATOM 1047 CG1 VAL A 137 1.221 0.567 -4.505 1.00 0.00 C ATOM 1048 CG2 VAL A 137 0.792 2.475 -6.070 1.00 0.00 C ATOM 0 H VAL A 137 2.983 1.631 -6.989 1.00 0.00 H new ATOM 0 HA VAL A 137 1.418 -0.846 -6.773 1.00 0.00 H new ATOM 0 HB VAL A 137 -0.371 0.697 -5.913 1.00 0.00 H new ATOM 0 HG11 VAL A 137 0.681 1.106 -3.727 1.00 0.00 H new ATOM 0 HG12 VAL A 137 1.086 -0.505 -4.364 1.00 0.00 H new ATOM 0 HG13 VAL A 137 2.282 0.810 -4.446 1.00 0.00 H new ATOM 0 HG21 VAL A 137 0.259 2.989 -5.270 1.00 0.00 H new ATOM 0 HG22 VAL A 137 1.841 2.769 -6.054 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.354 2.746 -7.031 1.00 0.00 H new ATOM 1058 N LYS A 138 -0.281 -0.345 -8.610 1.00 0.00 N ATOM 1059 CA LYS A 138 -1.042 -0.211 -9.846 1.00 0.00 C ATOM 1060 C LYS A 138 -2.530 -0.432 -9.596 1.00 0.00 C ATOM 1061 O LYS A 138 -2.920 -1.378 -8.911 1.00 0.00 O ATOM 1062 CB LYS A 138 -0.536 -1.208 -10.891 1.00 0.00 C ATOM 1063 CG LYS A 138 0.701 -0.735 -11.634 1.00 0.00 C ATOM 1064 CD LYS A 138 0.843 -1.428 -12.979 1.00 0.00 C ATOM 1065 CE LYS A 138 2.290 -1.450 -13.445 1.00 0.00 C ATOM 1066 NZ LYS A 138 2.395 -1.583 -14.925 1.00 0.00 N ATOM 0 H LYS A 138 -0.586 -1.110 -8.009 1.00 0.00 H new ATOM 0 HA LYS A 138 -0.902 0.803 -10.221 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -0.314 -2.155 -10.400 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -1.331 -1.401 -11.612 1.00 0.00 H new ATOM 0 HG2 LYS A 138 0.647 0.343 -11.783 1.00 0.00 H new ATOM 0 HG3 LYS A 138 1.586 -0.929 -11.029 1.00 0.00 H new ATOM 0 HD2 LYS A 138 0.468 -2.449 -12.905 1.00 0.00 H new ATOM 0 HD3 LYS A 138 0.229 -0.916 -13.720 1.00 0.00 H new ATOM 0 HE2 LYS A 138 2.788 -0.534 -13.127 1.00 0.00 H new ATOM 0 HE3 LYS A 138 2.812 -2.279 -12.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 3.397 -1.594 -15.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 1.942 -2.469 -15.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 1.919 -0.778 -15.381 1.00 0.00 H new ATOM 1080 N ARG A 139 -3.356 0.446 -10.156 1.00 0.00 N ATOM 1081 CA ARG A 139 -4.802 0.346 -9.994 1.00 0.00 C ATOM 1082 C ARG A 139 -5.314 -1.001 -10.498 1.00 0.00 C ATOM 1083 O ARG A 139 -5.105 -1.360 -11.657 1.00 0.00 O ATOM 1084 CB ARG A 139 -5.500 1.482 -10.743 1.00 0.00 C ATOM 1085 CG ARG A 139 -7.011 1.327 -10.813 1.00 0.00 C ATOM 1086 CD ARG A 139 -7.696 1.999 -9.634 1.00 0.00 C ATOM 1087 NE ARG A 139 -9.039 1.473 -9.408 1.00 0.00 N ATOM 1088 CZ ARG A 139 -10.076 1.745 -10.192 1.00 0.00 C ATOM 1089 NH1 ARG A 139 -9.925 2.533 -11.247 1.00 0.00 N ATOM 1090 NH2 ARG A 139 -11.268 1.228 -9.921 1.00 0.00 N ATOM 0 H ARG A 139 -3.049 1.234 -10.726 1.00 0.00 H new ATOM 0 HA ARG A 139 -5.030 0.427 -8.931 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -5.262 2.427 -10.255 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -5.101 1.537 -11.756 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -7.379 1.759 -11.743 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -7.269 0.268 -10.829 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -7.095 1.856 -8.736 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -7.753 3.073 -9.812 1.00 0.00 H new ATOM 0 HE ARG A 139 -9.189 0.863 -8.604 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -9.011 2.932 -11.459 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -10.723 2.740 -11.847 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -11.388 0.621 -9.110 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -12.064 1.438 -10.524 1.00 0.00 H new ATOM 1104 N ILE A 140 -5.983 -1.739 -9.619 1.00 0.00 N ATOM 1105 CA ILE A 140 -6.525 -3.045 -9.976 1.00 0.00 C ATOM 1106 C ILE A 140 -8.042 -3.072 -9.821 1.00 0.00 C ATOM 1107 O ILE A 140 -8.603 -2.538 -8.864 1.00 0.00 O ATOM 1108 CB ILE A 140 -5.912 -4.163 -9.112 1.00 0.00 C ATOM 1109 CG1 ILE A 140 -5.996 -3.796 -7.629 1.00 0.00 C ATOM 1110 CG2 ILE A 140 -4.469 -4.417 -9.519 1.00 0.00 C ATOM 1111 CD1 ILE A 140 -5.682 -4.950 -6.702 1.00 0.00 C ATOM 0 H ILE A 140 -6.163 -1.456 -8.656 1.00 0.00 H new ATOM 0 HA ILE A 140 -6.266 -3.220 -11.020 1.00 0.00 H new ATOM 0 HB ILE A 140 -6.481 -5.079 -9.273 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -5.304 -2.979 -7.426 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -6.998 -3.427 -7.410 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -4.050 -5.210 -8.899 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -4.434 -4.718 -10.566 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -3.887 -3.505 -9.384 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -5.761 -4.617 -5.667 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -6.389 -5.761 -6.877 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -4.669 -5.305 -6.893 1.00 0.00 H new ATOM 1123 N PRO A 141 -8.723 -3.710 -10.784 1.00 0.00 N ATOM 1124 CA PRO A 141 -10.185 -3.824 -10.776 1.00 0.00 C ATOM 1125 C PRO A 141 -10.689 -4.747 -9.672 1.00 0.00 C ATOM 1126 O PRO A 141 -9.927 -5.499 -9.063 1.00 0.00 O ATOM 1127 CB PRO A 141 -10.502 -4.414 -12.153 1.00 0.00 C ATOM 1128 CG PRO A 141 -9.265 -5.144 -12.546 1.00 0.00 C ATOM 1129 CD PRO A 141 -8.120 -4.369 -11.954 1.00 0.00 C ATOM 0 HA PRO A 141 -10.667 -2.865 -10.586 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -11.360 -5.085 -12.108 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -10.746 -3.632 -12.872 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -9.280 -6.167 -12.170 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -9.176 -5.205 -13.631 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -7.297 -5.024 -11.667 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -7.718 -3.643 -12.661 1.00 0.00 H new ATOM 1137 N PRO A 142 -12.002 -4.691 -9.406 1.00 0.00 N ATOM 1138 CA PRO A 142 -12.637 -5.517 -8.375 1.00 0.00 C ATOM 1139 C PRO A 142 -12.677 -6.993 -8.757 1.00 0.00 C ATOM 1140 O PRO A 142 -12.493 -7.346 -9.921 1.00 0.00 O ATOM 1141 CB PRO A 142 -14.055 -4.948 -8.288 1.00 0.00 C ATOM 1142 CG PRO A 142 -14.300 -4.336 -9.624 1.00 0.00 C ATOM 1143 CD PRO A 142 -12.969 -3.818 -10.093 1.00 0.00 C ATOM 0 HA PRO A 142 -12.091 -5.483 -7.432 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -14.783 -5.730 -8.071 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -14.136 -4.207 -7.492 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -14.701 -5.071 -10.322 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -15.030 -3.530 -9.556 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -12.871 -3.884 -11.177 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -12.828 -2.771 -9.824 1.00 0.00 H new ATOM 1151 N GLN A 143 -12.919 -7.849 -7.769 1.00 0.00 N ATOM 1152 CA GLN A 143 -12.983 -9.286 -8.004 1.00 0.00 C ATOM 1153 C GLN A 143 -14.408 -9.722 -8.330 1.00 0.00 C ATOM 1154 O GLN A 143 -14.861 -10.779 -7.888 1.00 0.00 O ATOM 1155 CB GLN A 143 -12.472 -10.047 -6.779 1.00 0.00 C ATOM 1156 CG GLN A 143 -10.996 -9.818 -6.493 1.00 0.00 C ATOM 1157 CD GLN A 143 -10.570 -10.373 -5.148 1.00 0.00 C ATOM 1158 OE1 GLN A 143 -11.197 -11.289 -4.614 1.00 0.00 O ATOM 1159 NE2 GLN A 143 -9.498 -9.821 -4.592 1.00 0.00 N ATOM 0 H GLN A 143 -13.074 -7.572 -6.800 1.00 0.00 H new ATOM 0 HA GLN A 143 -12.348 -9.518 -8.859 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -13.053 -9.748 -5.907 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -12.644 -11.113 -6.926 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -10.401 -10.283 -7.279 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -10.785 -8.749 -6.524 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -9.008 -9.064 -5.069 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -9.164 -10.154 -3.688 1.00 0.00 H new ATOM 1168 N LEU A 144 -15.109 -8.901 -9.104 1.00 0.00 N ATOM 1169 CA LEU A 144 -16.484 -9.202 -9.489 1.00 0.00 C ATOM 1170 C LEU A 144 -16.586 -10.595 -10.102 1.00 0.00 C ATOM 1171 O LEU A 144 -17.545 -11.324 -9.852 1.00 0.00 O ATOM 1172 CB LEU A 144 -16.996 -8.157 -10.482 1.00 0.00 C ATOM 1173 CG LEU A 144 -16.399 -8.219 -11.889 1.00 0.00 C ATOM 1174 CD1 LEU A 144 -17.199 -9.169 -12.767 1.00 0.00 C ATOM 1175 CD2 LEU A 144 -16.351 -6.830 -12.509 1.00 0.00 C ATOM 0 H LEU A 144 -14.749 -8.023 -9.477 1.00 0.00 H new ATOM 0 HA LEU A 144 -17.101 -9.175 -8.591 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -18.078 -8.261 -10.563 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -16.801 -7.167 -10.070 1.00 0.00 H new ATOM 0 HG LEU A 144 -15.380 -8.598 -11.814 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -16.760 -9.200 -13.764 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -17.182 -10.168 -12.332 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -18.230 -8.820 -12.835 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -15.924 -6.893 -13.510 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -17.361 -6.424 -12.571 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -15.734 -6.177 -11.891 1.00 0.00 H new ATOM 1187 N GLU A 145 -15.589 -10.958 -10.903 1.00 0.00 N ATOM 1188 CA GLU A 145 -15.567 -12.265 -11.550 1.00 0.00 C ATOM 1189 C GLU A 145 -15.016 -13.330 -10.605 1.00 0.00 C ATOM 1190 O GLU A 145 -15.260 -14.522 -10.789 1.00 0.00 O ATOM 1191 CB GLU A 145 -14.723 -12.213 -12.825 1.00 0.00 C ATOM 1192 CG GLU A 145 -13.238 -12.022 -12.565 1.00 0.00 C ATOM 1193 CD GLU A 145 -12.393 -12.270 -13.799 1.00 0.00 C ATOM 1194 OE1 GLU A 145 -12.723 -11.711 -14.866 1.00 0.00 O ATOM 1195 OE2 GLU A 145 -11.402 -13.023 -13.699 1.00 0.00 O ATOM 0 H GLU A 145 -14.787 -10.366 -11.119 1.00 0.00 H new ATOM 0 HA GLU A 145 -16.591 -12.530 -11.812 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -14.869 -13.136 -13.385 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -15.081 -11.398 -13.454 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -13.063 -11.007 -12.208 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -12.922 -12.699 -11.771 1.00 0.00 H new TER 1202 GLU A 145