USER MOD reduce.3.24.130724 H: found=0, std=0, add=710, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 712 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 187 HIS : no HD1:sc= -1.43! C(o=-0.47!,f=-6.3!) USER MOD Set 1.2: A 191 THR OG1 : rot -170:sc= 0.957 USER MOD Set 2.1: A 190 THR OG1 : rot 180:sc= 0.323 USER MOD Set 2.2: A 194 LYS NZ :NH3+ -128:sc= -0.0508 (180deg=-1.41!) USER MOD Set 3.1: A 173 ASN : amide:sc= -0.962 X(o=-1.4,f=-1.3) USER MOD Set 3.2: A 174 ASN : amide:sc= -0.406 X(o=-1.4,f=-1.3) USER MOD Set 4.1: A 150 TYR OH : rot 142:sc= 1.27 USER MOD Set 4.2: A 154 MET CE :methyl -138:sc= -0.449 (180deg=-5.48!) USER MOD Set 5.1: A 134 MET CE :methyl 177:sc= -1.88 (180deg=-1.7) USER MOD Set 5.2: A 217 GLN :FLIP amide:sc= -2.39! C(o=-5.8!,f=-4.3!) USER MOD Single : A 128 TYR OH : rot 142:sc= 0.698 USER MOD Single : A 129 MET CE :methyl 146:sc= -2.51! (180deg=-4.78!) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 36:sc= 0.0532 USER MOD Single : A 140 HIS :FLIP no HE2:sc= 0.128 F(o=-0.58,f=0.13) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 ASN :FLIP amide:sc=-0.00826 F(o=-1.3,f=-0.0083) USER MOD Single : A 155 HIS : no HD1:sc= 0 X(o=0,f=-0.0079) USER MOD Single : A 157 TYR OH : rot -143:sc= 0.276 USER MOD Single : A 159 ASN : amide:sc= -0.431 K(o=-0.43,f=-4.6!) USER MOD Single : A 160 GLN :FLIP amide:sc= -1.22 F(o=-3.7!,f=-1.2) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 TYR OH : rot 180:sc= 0 USER MOD Single : A 177 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 181 ASN : amide:sc= -4.5! C(o=-4.5!,f=-7!) USER MOD Single : A 183 THR OG1 : rot 68:sc= 1.31 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= -0.779! C(o=-0.78!,f=-0.98!) USER MOD Single : A 188 THR OG1 : rot -80:sc= 1.3 USER MOD Single : A 192 THR OG1 : rot -179:sc= -0.923 USER MOD Single : A 193 THR OG1 : rot 119:sc= 1.21 USER MOD Single : A 197 ASN : amide:sc= -0.228 X(o=-0.23,f=0) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0 USER MOD Single : A 200 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl -164:sc= -0.136 (180deg=-0.845) USER MOD Single : A 206 MET CE :methyl 173:sc= -2.73! (180deg=-2.84!) USER MOD Single : A 212 GLN :FLIP amide:sc= -0.0845 F(o=-0.9,f=-0.085) USER MOD Single : A 213 MET CE :methyl -129:sc= -0.724 (180deg=-2.6!) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 222 SER OG : rot -65:sc= 0.684 USER MOD ----------------------------------------------------------------- ATOM 26 N GLY A 127 12.300 3.766 -0.004 1.00 0.00 N ATOM 27 CA GLY A 127 11.740 5.096 0.117 1.00 0.00 C ATOM 28 C GLY A 127 10.257 5.048 0.419 1.00 0.00 C ATOM 29 O GLY A 127 9.539 6.027 0.220 1.00 0.00 O ATOM 0 HA2 GLY A 127 12.256 5.639 0.909 1.00 0.00 H new ATOM 0 HA3 GLY A 127 11.906 5.648 -0.808 1.00 0.00 H new ATOM 33 N TYR A 128 9.801 3.892 0.898 1.00 0.00 N ATOM 34 CA TYR A 128 8.398 3.695 1.229 1.00 0.00 C ATOM 35 C TYR A 128 8.219 3.475 2.725 1.00 0.00 C ATOM 36 O TYR A 128 9.154 3.082 3.425 1.00 0.00 O ATOM 37 CB TYR A 128 7.841 2.488 0.469 1.00 0.00 C ATOM 38 CG TYR A 128 7.771 2.686 -1.029 1.00 0.00 C ATOM 39 CD1 TYR A 128 8.921 2.652 -1.810 1.00 0.00 C ATOM 40 CD2 TYR A 128 6.554 2.902 -1.663 1.00 0.00 C ATOM 41 CE1 TYR A 128 8.859 2.831 -3.179 1.00 0.00 C ATOM 42 CE2 TYR A 128 6.485 3.081 -3.031 1.00 0.00 C ATOM 43 CZ TYR A 128 7.639 3.044 -3.784 1.00 0.00 C ATOM 44 OH TYR A 128 7.573 3.221 -5.148 1.00 0.00 O ATOM 0 H TYR A 128 10.389 3.076 1.065 1.00 0.00 H new ATOM 0 HA TYR A 128 7.854 4.593 0.938 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.463 1.618 0.682 1.00 0.00 H new ATOM 0 HB3 TYR A 128 6.842 2.265 0.843 1.00 0.00 H new ATOM 0 HD1 TYR A 128 9.878 2.483 -1.339 1.00 0.00 H new ATOM 0 HD2 TYR A 128 5.647 2.930 -1.077 1.00 0.00 H new ATOM 0 HE1 TYR A 128 9.762 2.804 -3.772 1.00 0.00 H new ATOM 0 HE2 TYR A 128 5.531 3.249 -3.509 1.00 0.00 H new ATOM 0 HH TYR A 128 6.772 2.777 -5.497 1.00 0.00 H new ATOM 54 N MET A 129 7.007 3.716 3.204 1.00 0.00 N ATOM 55 CA MET A 129 6.685 3.534 4.611 1.00 0.00 C ATOM 56 C MET A 129 5.719 2.372 4.772 1.00 0.00 C ATOM 57 O MET A 129 5.026 2.006 3.827 1.00 0.00 O ATOM 58 CB MET A 129 6.097 4.813 5.205 1.00 0.00 C ATOM 59 CG MET A 129 7.147 5.868 5.516 1.00 0.00 C ATOM 60 SD MET A 129 7.940 5.614 7.118 1.00 0.00 S ATOM 61 CE MET A 129 9.053 4.259 6.744 1.00 0.00 C ATOM 0 H MET A 129 6.226 4.040 2.634 1.00 0.00 H new ATOM 0 HA MET A 129 7.603 3.307 5.154 1.00 0.00 H new ATOM 0 HB2 MET A 129 5.369 5.228 4.508 1.00 0.00 H new ATOM 0 HB3 MET A 129 5.557 4.566 6.119 1.00 0.00 H new ATOM 0 HG2 MET A 129 7.907 5.860 4.734 1.00 0.00 H new ATOM 0 HG3 MET A 129 6.682 6.854 5.498 1.00 0.00 H new ATOM 0 HE1 MET A 129 9.966 4.365 7.330 1.00 0.00 H new ATOM 0 HE2 MET A 129 8.571 3.313 6.991 1.00 0.00 H new ATOM 0 HE3 MET A 129 9.300 4.274 5.682 1.00 0.00 H new ATOM 71 N LEU A 130 5.696 1.768 5.953 1.00 0.00 N ATOM 72 CA LEU A 130 4.830 0.620 6.188 1.00 0.00 C ATOM 73 C LEU A 130 3.726 0.924 7.193 1.00 0.00 C ATOM 74 O LEU A 130 3.982 1.406 8.297 1.00 0.00 O ATOM 75 CB LEU A 130 5.661 -0.562 6.686 1.00 0.00 C ATOM 76 CG LEU A 130 5.140 -1.947 6.295 1.00 0.00 C ATOM 77 CD1 LEU A 130 6.144 -3.020 6.684 1.00 0.00 C ATOM 78 CD2 LEU A 130 3.793 -2.225 6.945 1.00 0.00 C ATOM 0 H LEU A 130 6.260 2.050 6.755 1.00 0.00 H new ATOM 0 HA LEU A 130 4.354 0.374 5.239 1.00 0.00 H new ATOM 0 HB2 LEU A 130 6.677 -0.455 6.306 1.00 0.00 H new ATOM 0 HB3 LEU A 130 5.720 -0.509 7.773 1.00 0.00 H new ATOM 0 HG LEU A 130 5.007 -1.966 5.213 1.00 0.00 H new ATOM 0 HD11 LEU A 130 5.759 -3.999 6.399 1.00 0.00 H new ATOM 0 HD12 LEU A 130 7.088 -2.838 6.171 1.00 0.00 H new ATOM 0 HD13 LEU A 130 6.306 -2.993 7.762 1.00 0.00 H new ATOM 0 HD21 LEU A 130 3.445 -3.215 6.651 1.00 0.00 H new ATOM 0 HD22 LEU A 130 3.897 -2.184 8.029 1.00 0.00 H new ATOM 0 HD23 LEU A 130 3.071 -1.476 6.621 1.00 0.00 H new ATOM 90 N GLY A 131 2.500 0.599 6.800 1.00 0.00 N ATOM 91 CA GLY A 131 1.355 0.795 7.662 1.00 0.00 C ATOM 92 C GLY A 131 0.906 -0.518 8.267 1.00 0.00 C ATOM 93 O GLY A 131 0.540 -1.447 7.541 1.00 0.00 O ATOM 0 H GLY A 131 2.280 0.199 5.888 1.00 0.00 H new ATOM 0 HA2 GLY A 131 1.608 1.498 8.455 1.00 0.00 H new ATOM 0 HA3 GLY A 131 0.537 1.237 7.093 1.00 0.00 H new ATOM 97 N SER A 132 0.961 -0.601 9.594 1.00 0.00 N ATOM 98 CA SER A 132 0.583 -1.814 10.314 1.00 0.00 C ATOM 99 C SER A 132 -0.785 -2.335 9.879 1.00 0.00 C ATOM 100 O SER A 132 -1.527 -1.660 9.165 1.00 0.00 O ATOM 101 CB SER A 132 0.596 -1.550 11.819 1.00 0.00 C ATOM 102 OG SER A 132 -0.234 -0.451 12.152 1.00 0.00 O ATOM 0 H SER A 132 1.266 0.164 10.196 1.00 0.00 H new ATOM 0 HA SER A 132 1.315 -2.585 10.073 1.00 0.00 H new ATOM 0 HB2 SER A 132 0.257 -2.439 12.350 1.00 0.00 H new ATOM 0 HB3 SER A 132 1.616 -1.352 12.148 1.00 0.00 H new ATOM 0 HG SER A 132 -0.209 -0.304 13.121 1.00 0.00 H new ATOM 108 N ALA A 133 -1.102 -3.554 10.310 1.00 0.00 N ATOM 109 CA ALA A 133 -2.367 -4.192 9.963 1.00 0.00 C ATOM 110 C ALA A 133 -3.564 -3.383 10.446 1.00 0.00 C ATOM 111 O ALA A 133 -3.490 -2.673 11.449 1.00 0.00 O ATOM 112 CB ALA A 133 -2.420 -5.597 10.541 1.00 0.00 C ATOM 0 H ALA A 133 -0.496 -4.121 10.903 1.00 0.00 H new ATOM 0 HA ALA A 133 -2.421 -4.243 8.876 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -3.369 -6.064 10.276 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -1.599 -6.188 10.136 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -2.331 -5.548 11.626 1.00 0.00 H new ATOM 118 N MET A 134 -4.669 -3.505 9.718 1.00 0.00 N ATOM 119 CA MET A 134 -5.900 -2.800 10.054 1.00 0.00 C ATOM 120 C MET A 134 -7.096 -3.737 9.959 1.00 0.00 C ATOM 121 O MET A 134 -7.765 -4.013 10.956 1.00 0.00 O ATOM 122 CB MET A 134 -6.103 -1.599 9.124 1.00 0.00 C ATOM 123 CG MET A 134 -5.237 -1.630 7.875 1.00 0.00 C ATOM 124 SD MET A 134 -6.072 -0.941 6.434 1.00 0.00 S ATOM 125 CE MET A 134 -4.674 -0.537 5.391 1.00 0.00 C ATOM 0 H MET A 134 -4.737 -4.090 8.885 1.00 0.00 H new ATOM 0 HA MET A 134 -5.816 -2.440 11.080 1.00 0.00 H new ATOM 0 HB2 MET A 134 -7.151 -1.556 8.826 1.00 0.00 H new ATOM 0 HB3 MET A 134 -5.891 -0.684 9.678 1.00 0.00 H new ATOM 0 HG2 MET A 134 -4.319 -1.072 8.060 1.00 0.00 H new ATOM 0 HG3 MET A 134 -4.947 -2.659 7.664 1.00 0.00 H new ATOM 0 HE1 MET A 134 -5.032 -0.149 4.437 1.00 0.00 H new ATOM 0 HE2 MET A 134 -4.060 0.218 5.882 1.00 0.00 H new ATOM 0 HE3 MET A 134 -4.078 -1.433 5.218 1.00 0.00 H new ATOM 135 N SER A 135 -7.353 -4.224 8.751 1.00 0.00 N ATOM 136 CA SER A 135 -8.465 -5.135 8.507 1.00 0.00 C ATOM 137 C SER A 135 -8.415 -5.662 7.077 1.00 0.00 C ATOM 138 O SER A 135 -8.396 -4.883 6.125 1.00 0.00 O ATOM 139 CB SER A 135 -9.795 -4.424 8.761 1.00 0.00 C ATOM 140 OG SER A 135 -9.815 -3.144 8.153 1.00 0.00 O ATOM 0 H SER A 135 -6.803 -4.002 7.921 1.00 0.00 H new ATOM 0 HA SER A 135 -8.381 -5.979 9.192 1.00 0.00 H new ATOM 0 HB2 SER A 135 -10.614 -5.028 8.370 1.00 0.00 H new ATOM 0 HB3 SER A 135 -9.957 -4.323 9.834 1.00 0.00 H new ATOM 0 HG SER A 135 -9.333 -3.179 7.300 1.00 0.00 H new ATOM 146 N ARG A 136 -8.387 -6.984 6.933 1.00 0.00 N ATOM 147 CA ARG A 136 -8.330 -7.611 5.614 1.00 0.00 C ATOM 148 C ARG A 136 -9.579 -7.287 4.793 1.00 0.00 C ATOM 149 O ARG A 136 -10.668 -7.781 5.086 1.00 0.00 O ATOM 150 CB ARG A 136 -8.175 -9.127 5.751 1.00 0.00 C ATOM 151 CG ARG A 136 -7.093 -9.545 6.734 1.00 0.00 C ATOM 152 CD ARG A 136 -7.641 -10.487 7.794 1.00 0.00 C ATOM 153 NE ARG A 136 -8.972 -10.087 8.246 1.00 0.00 N ATOM 154 CZ ARG A 136 -9.237 -9.656 9.475 1.00 0.00 C ATOM 155 NH1 ARG A 136 -8.268 -9.582 10.378 1.00 0.00 N ATOM 156 NH2 ARG A 136 -10.470 -9.298 9.804 1.00 0.00 N ATOM 0 H ARG A 136 -8.403 -7.642 7.712 1.00 0.00 H new ATOM 0 HA ARG A 136 -7.463 -7.209 5.091 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -9.126 -9.553 6.069 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -7.947 -9.550 4.772 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -6.280 -10.033 6.197 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.673 -8.661 7.213 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -7.684 -11.499 7.392 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -6.961 -10.510 8.645 1.00 0.00 H new ATOM 0 HE ARG A 136 -9.742 -10.142 7.580 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -7.317 -9.856 10.130 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -8.474 -9.251 11.321 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -11.218 -9.353 9.113 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -10.670 -8.968 10.748 1.00 0.00 H new ATOM 170 N PRO A 137 -9.436 -6.445 3.748 1.00 0.00 N ATOM 171 CA PRO A 137 -10.556 -6.048 2.881 1.00 0.00 C ATOM 172 C PRO A 137 -11.265 -7.240 2.244 1.00 0.00 C ATOM 173 O PRO A 137 -10.640 -8.249 1.921 1.00 0.00 O ATOM 174 CB PRO A 137 -9.885 -5.201 1.795 1.00 0.00 C ATOM 175 CG PRO A 137 -8.632 -4.703 2.424 1.00 0.00 C ATOM 176 CD PRO A 137 -8.172 -5.803 3.334 1.00 0.00 C ATOM 0 HA PRO A 137 -11.328 -5.525 3.445 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -9.673 -5.794 0.905 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -10.526 -4.377 1.483 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -7.878 -4.477 1.670 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -8.812 -3.783 2.981 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -7.514 -6.503 2.820 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -7.618 -5.414 4.189 1.00 0.00 H new ATOM 184 N ILE A 138 -12.575 -7.105 2.052 1.00 0.00 N ATOM 185 CA ILE A 138 -13.372 -8.159 1.433 1.00 0.00 C ATOM 186 C ILE A 138 -13.402 -7.972 -0.079 1.00 0.00 C ATOM 187 O ILE A 138 -13.747 -6.898 -0.572 1.00 0.00 O ATOM 188 CB ILE A 138 -14.817 -8.171 1.975 1.00 0.00 C ATOM 189 CG1 ILE A 138 -14.823 -8.030 3.502 1.00 0.00 C ATOM 190 CG2 ILE A 138 -15.532 -9.446 1.551 1.00 0.00 C ATOM 191 CD1 ILE A 138 -14.066 -9.128 4.224 1.00 0.00 C ATOM 0 H ILE A 138 -13.106 -6.276 2.317 1.00 0.00 H new ATOM 0 HA ILE A 138 -12.905 -9.113 1.680 1.00 0.00 H new ATOM 0 HB ILE A 138 -15.351 -7.320 1.553 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -14.389 -7.067 3.770 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -15.855 -8.023 3.852 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -16.550 -9.439 1.941 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -15.561 -9.502 0.463 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -14.998 -10.311 1.945 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -14.116 -8.958 5.299 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -14.513 -10.094 3.988 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -13.024 -9.122 3.904 1.00 0.00 H new ATOM 203 N ILE A 139 -13.014 -9.011 -0.813 1.00 0.00 N ATOM 204 CA ILE A 139 -12.974 -8.936 -2.268 1.00 0.00 C ATOM 205 C ILE A 139 -13.852 -9.995 -2.927 1.00 0.00 C ATOM 206 O ILE A 139 -14.064 -11.077 -2.379 1.00 0.00 O ATOM 207 CB ILE A 139 -11.533 -9.101 -2.789 1.00 0.00 C ATOM 208 CG1 ILE A 139 -10.548 -8.347 -1.878 1.00 0.00 C ATOM 209 CG2 ILE A 139 -11.433 -8.635 -4.238 1.00 0.00 C ATOM 210 CD1 ILE A 139 -10.243 -6.929 -2.317 1.00 0.00 C ATOM 0 H ILE A 139 -12.725 -9.909 -0.426 1.00 0.00 H new ATOM 0 HA ILE A 139 -13.358 -7.950 -2.532 1.00 0.00 H new ATOM 0 HB ILE A 139 -11.264 -10.157 -2.766 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -10.955 -8.321 -0.867 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -9.614 -8.908 -1.831 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -10.409 -8.758 -4.590 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -12.104 -9.229 -4.858 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -11.715 -7.584 -4.302 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -9.541 -6.475 -1.618 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -9.803 -6.943 -3.314 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -11.165 -6.348 -2.335 1.00 0.00 H new ATOM 222 N HIS A 140 -14.337 -9.673 -4.122 1.00 0.00 N ATOM 223 CA HIS A 140 -15.173 -10.582 -4.897 1.00 0.00 C ATOM 224 C HIS A 140 -14.509 -10.868 -6.240 1.00 0.00 C ATOM 225 O HIS A 140 -14.300 -9.958 -7.042 1.00 0.00 O ATOM 226 CB HIS A 140 -16.563 -9.979 -5.113 1.00 0.00 C ATOM 227 CG HIS A 140 -17.418 -9.975 -3.882 1.00 0.00 C ATOM 228 ND1 HIS A 140 -17.431 -10.799 -2.806 1.00 0.00 N flip ATOM 229 CD2 HIS A 140 -18.408 -9.042 -3.659 1.00 0.00 C flip ATOM 230 CE1 HIS A 140 -18.419 -10.352 -1.964 1.00 0.00 C flip ATOM 231 NE2 HIS A 140 -18.993 -9.290 -2.500 1.00 0.00 N flip ATOM 0 H HIS A 140 -14.162 -8.778 -4.579 1.00 0.00 H new ATOM 0 HA HIS A 140 -15.286 -11.516 -4.346 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -16.453 -8.955 -5.471 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -17.074 -10.538 -5.897 1.00 0.00 H new ATOM 0 HD1 HIS A 140 -16.821 -11.601 -2.651 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -18.666 -8.234 -4.328 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -18.684 -10.797 -1.016 1.00 0.00 H new ATOM 240 N PHE A 141 -14.156 -12.129 -6.472 1.00 0.00 N ATOM 241 CA PHE A 141 -13.489 -12.514 -7.711 1.00 0.00 C ATOM 242 C PHE A 141 -14.459 -13.151 -8.707 1.00 0.00 C ATOM 243 O PHE A 141 -15.162 -12.445 -9.431 1.00 0.00 O ATOM 244 CB PHE A 141 -12.332 -13.469 -7.404 1.00 0.00 C ATOM 245 CG PHE A 141 -11.495 -13.031 -6.235 1.00 0.00 C ATOM 246 CD1 PHE A 141 -10.540 -12.038 -6.382 1.00 0.00 C ATOM 247 CD2 PHE A 141 -11.668 -13.611 -4.988 1.00 0.00 C ATOM 248 CE1 PHE A 141 -9.774 -11.630 -5.306 1.00 0.00 C ATOM 249 CE2 PHE A 141 -10.902 -13.208 -3.910 1.00 0.00 C ATOM 250 CZ PHE A 141 -9.954 -12.217 -4.069 1.00 0.00 C ATOM 0 H PHE A 141 -14.320 -12.898 -5.822 1.00 0.00 H new ATOM 0 HA PHE A 141 -13.097 -11.609 -8.176 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -12.733 -14.462 -7.203 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -11.697 -13.554 -8.285 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -10.392 -11.578 -7.348 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -12.409 -14.386 -4.857 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -9.035 -10.853 -5.433 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -11.045 -13.668 -2.944 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.355 -11.902 -3.228 1.00 0.00 H new ATOM 260 N GLY A 142 -14.485 -14.482 -8.753 1.00 0.00 N ATOM 261 CA GLY A 142 -15.363 -15.172 -9.680 1.00 0.00 C ATOM 262 C GLY A 142 -16.679 -15.584 -9.054 1.00 0.00 C ATOM 263 O GLY A 142 -17.714 -14.968 -9.305 1.00 0.00 O ATOM 0 H GLY A 142 -13.915 -15.092 -8.166 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -15.560 -14.525 -10.535 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -14.855 -16.058 -10.061 1.00 0.00 H new ATOM 267 N SER A 143 -16.641 -16.636 -8.244 1.00 0.00 N ATOM 268 CA SER A 143 -17.842 -17.137 -7.587 1.00 0.00 C ATOM 269 C SER A 143 -17.554 -17.525 -6.140 1.00 0.00 C ATOM 270 O SER A 143 -16.571 -17.073 -5.553 1.00 0.00 O ATOM 271 CB SER A 143 -18.396 -18.340 -8.353 1.00 0.00 C ATOM 272 OG SER A 143 -17.390 -19.313 -8.569 1.00 0.00 O ATOM 0 H SER A 143 -15.792 -17.158 -8.027 1.00 0.00 H new ATOM 0 HA SER A 143 -18.586 -16.340 -7.584 1.00 0.00 H new ATOM 0 HB2 SER A 143 -19.221 -18.783 -7.794 1.00 0.00 H new ATOM 0 HB3 SER A 143 -18.800 -18.011 -9.310 1.00 0.00 H new ATOM 0 HG SER A 143 -17.769 -20.072 -9.059 1.00 0.00 H new ATOM 278 N ASP A 144 -18.418 -18.362 -5.571 1.00 0.00 N ATOM 279 CA ASP A 144 -18.257 -18.809 -4.193 1.00 0.00 C ATOM 280 C ASP A 144 -16.928 -19.536 -4.006 1.00 0.00 C ATOM 281 O ASP A 144 -16.350 -19.514 -2.923 1.00 0.00 O ATOM 282 CB ASP A 144 -19.414 -19.725 -3.788 1.00 0.00 C ATOM 283 CG ASP A 144 -19.951 -20.534 -4.953 1.00 0.00 C ATOM 284 OD1 ASP A 144 -19.138 -21.152 -5.671 1.00 0.00 O ATOM 285 OD2 ASP A 144 -21.185 -20.548 -5.147 1.00 0.00 O ATOM 0 H ASP A 144 -19.237 -18.744 -6.045 1.00 0.00 H new ATOM 0 HA ASP A 144 -18.262 -17.927 -3.552 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -19.078 -20.403 -3.003 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -20.219 -19.123 -3.366 1.00 0.00 H new ATOM 290 N TYR A 145 -16.449 -20.177 -5.069 1.00 0.00 N ATOM 291 CA TYR A 145 -15.187 -20.906 -5.014 1.00 0.00 C ATOM 292 C TYR A 145 -14.045 -19.985 -4.588 1.00 0.00 C ATOM 293 O TYR A 145 -13.344 -20.258 -3.614 1.00 0.00 O ATOM 294 CB TYR A 145 -14.881 -21.537 -6.378 1.00 0.00 C ATOM 295 CG TYR A 145 -13.426 -21.906 -6.576 1.00 0.00 C ATOM 296 CD1 TYR A 145 -12.872 -23.003 -5.928 1.00 0.00 C ATOM 297 CD2 TYR A 145 -12.609 -21.157 -7.413 1.00 0.00 C ATOM 298 CE1 TYR A 145 -11.544 -23.342 -6.106 1.00 0.00 C ATOM 299 CE2 TYR A 145 -11.280 -21.490 -7.598 1.00 0.00 C ATOM 300 CZ TYR A 145 -10.752 -22.583 -6.942 1.00 0.00 C ATOM 301 OH TYR A 145 -9.430 -22.917 -7.123 1.00 0.00 O ATOM 0 H TYR A 145 -16.915 -20.206 -5.976 1.00 0.00 H new ATOM 0 HA TYR A 145 -15.281 -21.698 -4.271 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -15.491 -22.432 -6.497 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -15.178 -20.842 -7.163 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -13.490 -23.601 -5.274 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -13.019 -20.300 -7.928 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -11.129 -24.197 -5.593 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -10.658 -20.898 -8.253 1.00 0.00 H new ATOM 0 HH TYR A 145 -9.014 -22.282 -7.743 1.00 0.00 H new ATOM 311 N GLU A 146 -13.868 -18.891 -5.324 1.00 0.00 N ATOM 312 CA GLU A 146 -12.814 -17.928 -5.022 1.00 0.00 C ATOM 313 C GLU A 146 -13.121 -17.175 -3.732 1.00 0.00 C ATOM 314 O GLU A 146 -12.218 -16.858 -2.955 1.00 0.00 O ATOM 315 CB GLU A 146 -12.654 -16.937 -6.177 1.00 0.00 C ATOM 316 CG GLU A 146 -11.917 -17.511 -7.375 1.00 0.00 C ATOM 317 CD GLU A 146 -12.713 -17.391 -8.660 1.00 0.00 C ATOM 318 OE1 GLU A 146 -13.647 -18.196 -8.859 1.00 0.00 O ATOM 319 OE2 GLU A 146 -12.402 -16.490 -9.469 1.00 0.00 O ATOM 0 H GLU A 146 -14.440 -18.650 -6.133 1.00 0.00 H new ATOM 0 HA GLU A 146 -11.881 -18.476 -4.890 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -13.641 -16.601 -6.495 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -12.118 -16.058 -5.819 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -10.964 -16.995 -7.492 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -11.690 -18.561 -7.189 1.00 0.00 H new ATOM 326 N ASP A 147 -14.400 -16.886 -3.517 1.00 0.00 N ATOM 327 CA ASP A 147 -14.841 -16.163 -2.329 1.00 0.00 C ATOM 328 C ASP A 147 -14.400 -16.868 -1.050 1.00 0.00 C ATOM 329 O ASP A 147 -13.785 -16.257 -0.176 1.00 0.00 O ATOM 330 CB ASP A 147 -16.363 -16.011 -2.340 1.00 0.00 C ATOM 331 CG ASP A 147 -16.812 -14.746 -3.044 1.00 0.00 C ATOM 332 OD1 ASP A 147 -16.162 -13.697 -2.852 1.00 0.00 O ATOM 333 OD2 ASP A 147 -17.813 -14.805 -3.789 1.00 0.00 O ATOM 0 H ASP A 147 -15.154 -17.143 -4.154 1.00 0.00 H new ATOM 0 HA ASP A 147 -14.377 -15.177 -2.348 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -16.808 -16.875 -2.833 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -16.732 -16.003 -1.314 1.00 0.00 H new ATOM 338 N ARG A 148 -14.725 -18.152 -0.942 1.00 0.00 N ATOM 339 CA ARG A 148 -14.369 -18.935 0.237 1.00 0.00 C ATOM 340 C ARG A 148 -12.872 -19.226 0.274 1.00 0.00 C ATOM 341 O ARG A 148 -12.297 -19.421 1.345 1.00 0.00 O ATOM 342 CB ARG A 148 -15.156 -20.248 0.262 1.00 0.00 C ATOM 343 CG ARG A 148 -16.647 -20.076 0.013 1.00 0.00 C ATOM 344 CD ARG A 148 -17.317 -19.297 1.133 1.00 0.00 C ATOM 345 NE ARG A 148 -18.494 -18.568 0.665 1.00 0.00 N ATOM 346 CZ ARG A 148 -19.723 -19.075 0.665 1.00 0.00 C ATOM 347 NH1 ARG A 148 -19.938 -20.308 1.103 1.00 0.00 N ATOM 348 NH2 ARG A 148 -20.742 -18.347 0.225 1.00 0.00 N ATOM 0 H ARG A 148 -15.234 -18.673 -1.656 1.00 0.00 H new ATOM 0 HA ARG A 148 -14.626 -18.347 1.118 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -14.747 -20.920 -0.492 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -15.012 -20.729 1.230 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -16.801 -19.558 -0.933 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -17.116 -21.056 -0.080 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -17.608 -19.983 1.928 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -16.603 -18.595 1.564 1.00 0.00 H new ATOM 0 HE ARG A 148 -18.365 -17.617 0.319 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -19.159 -20.872 1.442 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -20.883 -20.692 1.101 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -20.582 -17.398 -0.113 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -21.685 -18.737 0.225 1.00 0.00 H new ATOM 362 N TYR A 149 -12.245 -19.253 -0.898 1.00 0.00 N ATOM 363 CA TYR A 149 -10.815 -19.519 -0.991 1.00 0.00 C ATOM 364 C TYR A 149 -10.018 -18.438 -0.270 1.00 0.00 C ATOM 365 O TYR A 149 -9.224 -18.729 0.624 1.00 0.00 O ATOM 366 CB TYR A 149 -10.383 -19.600 -2.457 1.00 0.00 C ATOM 367 CG TYR A 149 -8.954 -20.057 -2.646 1.00 0.00 C ATOM 368 CD1 TYR A 149 -8.618 -21.402 -2.557 1.00 0.00 C ATOM 369 CD2 TYR A 149 -7.942 -19.144 -2.917 1.00 0.00 C ATOM 370 CE1 TYR A 149 -7.313 -21.824 -2.731 1.00 0.00 C ATOM 371 CE2 TYR A 149 -6.634 -19.558 -3.092 1.00 0.00 C ATOM 372 CZ TYR A 149 -6.326 -20.898 -2.999 1.00 0.00 C ATOM 373 OH TYR A 149 -5.027 -21.315 -3.173 1.00 0.00 O ATOM 0 H TYR A 149 -12.704 -19.094 -1.795 1.00 0.00 H new ATOM 0 HA TYR A 149 -10.614 -20.476 -0.510 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -11.047 -20.285 -2.985 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -10.505 -18.620 -2.917 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -9.388 -22.130 -2.349 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -8.181 -18.093 -2.992 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -7.067 -22.873 -2.658 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -5.859 -18.836 -3.300 1.00 0.00 H new ATOM 0 HH TYR A 149 -4.456 -20.540 -3.355 1.00 0.00 H new ATOM 383 N TYR A 150 -10.242 -17.188 -0.664 1.00 0.00 N ATOM 384 CA TYR A 150 -9.550 -16.060 -0.052 1.00 0.00 C ATOM 385 C TYR A 150 -9.965 -15.896 1.408 1.00 0.00 C ATOM 386 O TYR A 150 -9.125 -15.672 2.279 1.00 0.00 O ATOM 387 CB TYR A 150 -9.837 -14.770 -0.829 1.00 0.00 C ATOM 388 CG TYR A 150 -9.541 -13.515 -0.039 1.00 0.00 C ATOM 389 CD1 TYR A 150 -8.236 -13.171 0.284 1.00 0.00 C ATOM 390 CD2 TYR A 150 -10.565 -12.683 0.393 1.00 0.00 C ATOM 391 CE1 TYR A 150 -7.957 -12.033 1.014 1.00 0.00 C ATOM 392 CE2 TYR A 150 -10.295 -11.542 1.125 1.00 0.00 C ATOM 393 CZ TYR A 150 -8.990 -11.222 1.433 1.00 0.00 C ATOM 394 OH TYR A 150 -8.717 -10.088 2.162 1.00 0.00 O ATOM 0 H TYR A 150 -10.896 -16.931 -1.403 1.00 0.00 H new ATOM 0 HA TYR A 150 -8.479 -16.261 -0.086 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -9.242 -14.765 -1.742 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -10.884 -14.762 -1.131 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -7.424 -13.805 -0.041 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -11.588 -12.931 0.153 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -6.935 -11.780 1.255 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -11.102 -10.904 1.454 1.00 0.00 H new ATOM 0 HH TYR A 150 -9.325 -9.369 1.889 1.00 0.00 H new ATOM 404 N ARG A 151 -11.269 -15.995 1.664 1.00 0.00 N ATOM 405 CA ARG A 151 -11.802 -15.845 3.015 1.00 0.00 C ATOM 406 C ARG A 151 -11.160 -16.837 3.980 1.00 0.00 C ATOM 407 O ARG A 151 -10.987 -16.544 5.164 1.00 0.00 O ATOM 408 CB ARG A 151 -13.321 -16.032 3.012 1.00 0.00 C ATOM 409 CG ARG A 151 -14.083 -14.826 2.486 1.00 0.00 C ATOM 410 CD ARG A 151 -14.086 -13.685 3.490 1.00 0.00 C ATOM 411 NE ARG A 151 -15.395 -13.043 3.585 1.00 0.00 N ATOM 412 CZ ARG A 151 -16.143 -13.048 4.684 1.00 0.00 C ATOM 413 NH1 ARG A 151 -15.715 -13.660 5.781 1.00 0.00 N ATOM 414 NH2 ARG A 151 -17.322 -12.440 4.687 1.00 0.00 N ATOM 0 H ARG A 151 -11.976 -16.179 0.952 1.00 0.00 H new ATOM 0 HA ARG A 151 -11.564 -14.837 3.354 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -13.570 -16.902 2.404 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -13.654 -16.247 4.027 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -13.632 -14.489 1.553 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -15.109 -15.114 2.259 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -13.796 -14.064 4.470 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -13.340 -12.945 3.200 1.00 0.00 H new ATOM 0 HE ARG A 151 -15.756 -12.563 2.760 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -14.809 -14.129 5.783 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -16.292 -13.662 6.622 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -17.655 -11.969 3.846 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -17.896 -12.444 5.530 1.00 0.00 H new ATOM 428 N GLU A 152 -10.809 -18.013 3.470 1.00 0.00 N ATOM 429 CA GLU A 152 -10.189 -19.046 4.289 1.00 0.00 C ATOM 430 C GLU A 152 -8.679 -18.849 4.376 1.00 0.00 C ATOM 431 O GLU A 152 -8.013 -19.446 5.221 1.00 0.00 O ATOM 432 CB GLU A 152 -10.500 -20.431 3.720 1.00 0.00 C ATOM 433 CG GLU A 152 -11.858 -20.970 4.139 1.00 0.00 C ATOM 434 CD GLU A 152 -11.770 -22.349 4.762 1.00 0.00 C ATOM 435 OE1 GLU A 152 -11.170 -22.472 5.851 1.00 0.00 O ATOM 436 OE2 GLU A 152 -12.303 -23.307 4.162 1.00 0.00 O ATOM 0 H GLU A 152 -10.944 -18.274 2.493 1.00 0.00 H new ATOM 0 HA GLU A 152 -10.603 -18.969 5.294 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -10.456 -20.386 2.632 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -9.727 -21.129 4.041 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -12.314 -20.282 4.851 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -12.514 -21.009 3.269 1.00 0.00 H new ATOM 443 N ASN A 153 -8.141 -18.014 3.491 1.00 0.00 N ATOM 444 CA ASN A 153 -6.706 -17.749 3.463 1.00 0.00 C ATOM 445 C ASN A 153 -6.380 -16.352 3.991 1.00 0.00 C ATOM 446 O ASN A 153 -5.225 -15.927 3.957 1.00 0.00 O ATOM 447 CB ASN A 153 -6.170 -17.904 2.039 1.00 0.00 C ATOM 448 CG ASN A 153 -5.971 -19.355 1.651 1.00 0.00 C ATOM 449 OD1 ASN A 153 -7.008 -20.164 1.837 1.00 0.00 O flip ATOM 450 ND2 ASN A 153 -4.899 -19.745 1.190 1.00 0.00 N flip ATOM 0 H ASN A 153 -8.677 -17.510 2.784 1.00 0.00 H new ATOM 0 HA ASN A 153 -6.223 -18.476 4.116 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -6.863 -17.436 1.340 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -5.222 -17.374 1.951 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -4.129 -19.088 1.064 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -4.780 -20.725 0.934 1.00 0.00 H new ATOM 457 N MET A 154 -7.397 -15.642 4.476 1.00 0.00 N ATOM 458 CA MET A 154 -7.203 -14.293 5.005 1.00 0.00 C ATOM 459 C MET A 154 -6.120 -14.274 6.079 1.00 0.00 C ATOM 460 O MET A 154 -5.299 -13.357 6.131 1.00 0.00 O ATOM 461 CB MET A 154 -8.510 -13.750 5.585 1.00 0.00 C ATOM 462 CG MET A 154 -9.669 -13.781 4.606 1.00 0.00 C ATOM 463 SD MET A 154 -11.103 -12.860 5.198 1.00 0.00 S ATOM 464 CE MET A 154 -10.721 -11.215 4.601 1.00 0.00 C ATOM 0 H MET A 154 -8.360 -15.976 4.514 1.00 0.00 H new ATOM 0 HA MET A 154 -6.885 -13.657 4.179 1.00 0.00 H new ATOM 0 HB2 MET A 154 -8.775 -14.332 6.468 1.00 0.00 H new ATOM 0 HB3 MET A 154 -8.352 -12.723 5.916 1.00 0.00 H new ATOM 0 HG2 MET A 154 -9.345 -13.367 3.652 1.00 0.00 H new ATOM 0 HG3 MET A 154 -9.957 -14.816 4.423 1.00 0.00 H new ATOM 0 HE1 MET A 154 -10.963 -10.483 5.372 1.00 0.00 H new ATOM 0 HE2 MET A 154 -9.660 -11.152 4.361 1.00 0.00 H new ATOM 0 HE3 MET A 154 -11.308 -11.007 3.706 1.00 0.00 H new ATOM 474 N HIS A 155 -6.128 -15.291 6.935 1.00 0.00 N ATOM 475 CA HIS A 155 -5.149 -15.394 8.011 1.00 0.00 C ATOM 476 C HIS A 155 -3.729 -15.457 7.456 1.00 0.00 C ATOM 477 O HIS A 155 -2.786 -14.971 8.080 1.00 0.00 O ATOM 478 CB HIS A 155 -5.430 -16.631 8.866 1.00 0.00 C ATOM 479 CG HIS A 155 -6.425 -16.393 9.958 1.00 0.00 C ATOM 480 ND1 HIS A 155 -6.119 -16.523 11.298 1.00 0.00 N ATOM 481 CD2 HIS A 155 -7.729 -16.029 9.906 1.00 0.00 C ATOM 482 CE1 HIS A 155 -7.191 -16.252 12.021 1.00 0.00 C ATOM 483 NE2 HIS A 155 -8.180 -15.949 11.201 1.00 0.00 N ATOM 0 H HIS A 155 -6.802 -16.056 6.904 1.00 0.00 H new ATOM 0 HA HIS A 155 -5.236 -14.502 8.632 1.00 0.00 H new ATOM 0 HB2 HIS A 155 -5.794 -17.432 8.222 1.00 0.00 H new ATOM 0 HB3 HIS A 155 -4.495 -16.977 9.307 1.00 0.00 H new ATOM 0 HD2 HIS A 155 -8.306 -15.838 9.013 1.00 0.00 H new ATOM 0 HE1 HIS A 155 -7.248 -16.275 13.099 1.00 0.00 H new ATOM 0 HE2 HIS A 155 -9.127 -15.696 11.484 1.00 0.00 H new ATOM 492 N ARG A 156 -3.586 -16.063 6.281 1.00 0.00 N ATOM 493 CA ARG A 156 -2.281 -16.195 5.642 1.00 0.00 C ATOM 494 C ARG A 156 -2.003 -15.020 4.708 1.00 0.00 C ATOM 495 O ARG A 156 -0.877 -14.844 4.241 1.00 0.00 O ATOM 496 CB ARG A 156 -2.205 -17.510 4.862 1.00 0.00 C ATOM 497 CG ARG A 156 -2.493 -18.738 5.712 1.00 0.00 C ATOM 498 CD ARG A 156 -3.625 -19.568 5.127 1.00 0.00 C ATOM 499 NE ARG A 156 -3.197 -20.927 4.806 1.00 0.00 N ATOM 500 CZ ARG A 156 -2.585 -21.261 3.675 1.00 0.00 C ATOM 501 NH1 ARG A 156 -2.325 -20.338 2.759 1.00 0.00 N ATOM 502 NH2 ARG A 156 -2.232 -22.521 3.457 1.00 0.00 N ATOM 0 H ARG A 156 -4.357 -16.470 5.752 1.00 0.00 H new ATOM 0 HA ARG A 156 -1.522 -16.196 6.425 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -2.916 -17.475 4.036 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -1.212 -17.606 4.424 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -1.593 -19.349 5.787 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -2.753 -18.428 6.724 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -4.451 -19.606 5.837 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -4.001 -19.084 4.226 1.00 0.00 H new ATOM 0 HE ARG A 156 -3.378 -21.662 5.490 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -2.595 -19.368 2.922 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -1.855 -20.598 1.892 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -2.430 -23.235 4.158 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -1.762 -22.776 2.588 1.00 0.00 H new ATOM 516 N TYR A 157 -3.031 -14.221 4.435 1.00 0.00 N ATOM 517 CA TYR A 157 -2.887 -13.068 3.551 1.00 0.00 C ATOM 518 C TYR A 157 -2.399 -11.840 4.320 1.00 0.00 C ATOM 519 O TYR A 157 -2.788 -11.621 5.468 1.00 0.00 O ATOM 520 CB TYR A 157 -4.214 -12.759 2.856 1.00 0.00 C ATOM 521 CG TYR A 157 -4.347 -13.411 1.497 1.00 0.00 C ATOM 522 CD1 TYR A 157 -3.621 -12.947 0.407 1.00 0.00 C ATOM 523 CD2 TYR A 157 -5.196 -14.494 1.305 1.00 0.00 C ATOM 524 CE1 TYR A 157 -3.739 -13.542 -0.835 1.00 0.00 C ATOM 525 CE2 TYR A 157 -5.317 -15.095 0.067 1.00 0.00 C ATOM 526 CZ TYR A 157 -4.587 -14.616 -0.999 1.00 0.00 C ATOM 527 OH TYR A 157 -4.705 -15.213 -2.233 1.00 0.00 O ATOM 0 H TYR A 157 -3.970 -14.350 4.812 1.00 0.00 H new ATOM 0 HA TYR A 157 -2.141 -13.317 2.797 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -5.035 -13.091 3.492 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -4.314 -11.679 2.744 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -2.953 -12.107 0.532 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -5.771 -14.872 2.137 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -3.170 -13.167 -1.673 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -5.981 -15.937 -0.065 1.00 0.00 H new ATOM 0 HH TYR A 157 -5.635 -15.488 -2.376 1.00 0.00 H new ATOM 537 N PRO A 158 -1.530 -11.021 3.694 1.00 0.00 N ATOM 538 CA PRO A 158 -0.981 -9.813 4.322 1.00 0.00 C ATOM 539 C PRO A 158 -2.056 -8.783 4.656 1.00 0.00 C ATOM 540 O PRO A 158 -3.079 -8.696 3.976 1.00 0.00 O ATOM 541 CB PRO A 158 -0.023 -9.250 3.264 1.00 0.00 C ATOM 542 CG PRO A 158 0.240 -10.380 2.329 1.00 0.00 C ATOM 543 CD PRO A 158 -1.009 -11.210 2.328 1.00 0.00 C ATOM 0 HA PRO A 158 -0.501 -10.045 5.273 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -0.468 -8.403 2.742 1.00 0.00 H new ATOM 0 HB3 PRO A 158 0.901 -8.894 3.720 1.00 0.00 H new ATOM 0 HG2 PRO A 158 0.467 -10.014 1.328 1.00 0.00 H new ATOM 0 HG3 PRO A 158 1.099 -10.966 2.656 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -1.719 -10.871 1.574 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -0.797 -12.258 2.118 1.00 0.00 H new ATOM 551 N ASN A 159 -1.811 -8.000 5.702 1.00 0.00 N ATOM 552 CA ASN A 159 -2.748 -6.967 6.126 1.00 0.00 C ATOM 553 C ASN A 159 -2.050 -5.614 6.227 1.00 0.00 C ATOM 554 O ASN A 159 -2.647 -4.627 6.660 1.00 0.00 O ATOM 555 CB ASN A 159 -3.379 -7.332 7.471 1.00 0.00 C ATOM 556 CG ASN A 159 -2.425 -8.092 8.373 1.00 0.00 C ATOM 557 OD1 ASN A 159 -1.229 -7.805 8.412 1.00 0.00 O ATOM 558 ND2 ASN A 159 -2.953 -9.066 9.104 1.00 0.00 N ATOM 0 H ASN A 159 -0.968 -8.062 6.273 1.00 0.00 H new ATOM 0 HA ASN A 159 -3.536 -6.898 5.376 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -3.703 -6.422 7.975 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -4.270 -7.936 7.299 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -2.361 -9.612 9.731 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -3.951 -9.269 9.039 1.00 0.00 H new ATOM 565 N GLN A 160 -0.783 -5.577 5.824 1.00 0.00 N ATOM 566 CA GLN A 160 0.000 -4.347 5.866 1.00 0.00 C ATOM 567 C GLN A 160 0.383 -3.898 4.460 1.00 0.00 C ATOM 568 O GLN A 160 0.570 -4.723 3.565 1.00 0.00 O ATOM 569 CB GLN A 160 1.258 -4.550 6.713 1.00 0.00 C ATOM 570 CG GLN A 160 0.972 -5.100 8.101 1.00 0.00 C ATOM 571 CD GLN A 160 2.219 -5.206 8.957 1.00 0.00 C ATOM 572 OE1 GLN A 160 2.767 -4.061 9.350 1.00 0.00 O flip ATOM 573 NE2 GLN A 160 2.684 -6.304 9.263 1.00 0.00 N flip ATOM 0 H GLN A 160 -0.277 -6.386 5.464 1.00 0.00 H new ATOM 0 HA GLN A 160 -0.613 -3.568 6.320 1.00 0.00 H new ATOM 0 HB2 GLN A 160 1.931 -5.231 6.192 1.00 0.00 H new ATOM 0 HB3 GLN A 160 1.780 -3.598 6.809 1.00 0.00 H new ATOM 0 HG2 GLN A 160 0.247 -4.457 8.600 1.00 0.00 H new ATOM 0 HG3 GLN A 160 0.514 -6.085 8.010 1.00 0.00 H new ATOM 0 HE21 GLN A 160 2.230 -7.158 8.939 1.00 0.00 H new ATOM 0 HE22 GLN A 160 3.523 -6.360 9.841 1.00 0.00 H new ATOM 582 N VAL A 161 0.492 -2.585 4.269 1.00 0.00 N ATOM 583 CA VAL A 161 0.847 -2.030 2.965 1.00 0.00 C ATOM 584 C VAL A 161 1.941 -0.976 3.081 1.00 0.00 C ATOM 585 O VAL A 161 2.245 -0.499 4.172 1.00 0.00 O ATOM 586 CB VAL A 161 -0.372 -1.407 2.260 1.00 0.00 C ATOM 587 CG1 VAL A 161 -1.348 -2.488 1.830 1.00 0.00 C ATOM 588 CG2 VAL A 161 -1.052 -0.388 3.163 1.00 0.00 C ATOM 0 H VAL A 161 0.340 -1.888 4.998 1.00 0.00 H new ATOM 0 HA VAL A 161 1.216 -2.865 2.370 1.00 0.00 H new ATOM 0 HB VAL A 161 -0.026 -0.887 1.367 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -2.203 -2.029 1.334 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -0.853 -3.172 1.141 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -1.690 -3.039 2.706 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -1.911 0.040 2.646 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -1.386 -0.878 4.077 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -0.347 0.404 3.413 1.00 0.00 H new ATOM 598 N TYR A 162 2.528 -0.617 1.943 1.00 0.00 N ATOM 599 CA TYR A 162 3.587 0.385 1.908 1.00 0.00 C ATOM 600 C TYR A 162 3.117 1.623 1.149 1.00 0.00 C ATOM 601 O TYR A 162 2.711 1.532 -0.010 1.00 0.00 O ATOM 602 CB TYR A 162 4.846 -0.190 1.252 1.00 0.00 C ATOM 603 CG TYR A 162 5.325 -1.480 1.883 1.00 0.00 C ATOM 604 CD1 TYR A 162 4.655 -2.677 1.660 1.00 0.00 C ATOM 605 CD2 TYR A 162 6.446 -1.500 2.702 1.00 0.00 C ATOM 606 CE1 TYR A 162 5.087 -3.855 2.237 1.00 0.00 C ATOM 607 CE2 TYR A 162 6.885 -2.675 3.282 1.00 0.00 C ATOM 608 CZ TYR A 162 6.203 -3.849 3.047 1.00 0.00 C ATOM 609 OH TYR A 162 6.636 -5.021 3.622 1.00 0.00 O ATOM 0 H TYR A 162 2.287 -1.006 1.031 1.00 0.00 H new ATOM 0 HA TYR A 162 3.828 0.671 2.932 1.00 0.00 H new ATOM 0 HB2 TYR A 162 4.647 -0.365 0.195 1.00 0.00 H new ATOM 0 HB3 TYR A 162 5.644 0.550 1.308 1.00 0.00 H new ATOM 0 HD1 TYR A 162 3.782 -2.686 1.025 1.00 0.00 H new ATOM 0 HD2 TYR A 162 6.984 -0.582 2.889 1.00 0.00 H new ATOM 0 HE1 TYR A 162 4.554 -4.776 2.055 1.00 0.00 H new ATOM 0 HE2 TYR A 162 7.759 -2.673 3.917 1.00 0.00 H new ATOM 0 HH TYR A 162 7.435 -4.845 4.162 1.00 0.00 H new ATOM 619 N TYR A 163 3.157 2.776 1.813 1.00 0.00 N ATOM 620 CA TYR A 163 2.716 4.026 1.201 1.00 0.00 C ATOM 621 C TYR A 163 3.839 5.058 1.150 1.00 0.00 C ATOM 622 O TYR A 163 4.770 5.019 1.953 1.00 0.00 O ATOM 623 CB TYR A 163 1.526 4.599 1.975 1.00 0.00 C ATOM 624 CG TYR A 163 1.877 5.057 3.375 1.00 0.00 C ATOM 625 CD1 TYR A 163 2.047 4.141 4.406 1.00 0.00 C ATOM 626 CD2 TYR A 163 2.039 6.406 3.663 1.00 0.00 C ATOM 627 CE1 TYR A 163 2.369 4.558 5.683 1.00 0.00 C ATOM 628 CE2 TYR A 163 2.361 6.830 4.938 1.00 0.00 C ATOM 629 CZ TYR A 163 2.525 5.902 5.944 1.00 0.00 C ATOM 630 OH TYR A 163 2.846 6.321 7.215 1.00 0.00 O ATOM 0 H TYR A 163 3.490 2.870 2.773 1.00 0.00 H new ATOM 0 HA TYR A 163 2.417 3.803 0.177 1.00 0.00 H new ATOM 0 HB2 TYR A 163 1.113 5.441 1.419 1.00 0.00 H new ATOM 0 HB3 TYR A 163 0.744 3.842 2.035 1.00 0.00 H new ATOM 0 HD1 TYR A 163 1.925 3.087 4.206 1.00 0.00 H new ATOM 0 HD2 TYR A 163 1.911 7.136 2.877 1.00 0.00 H new ATOM 0 HE1 TYR A 163 2.498 3.834 6.474 1.00 0.00 H new ATOM 0 HE2 TYR A 163 2.484 7.883 5.145 1.00 0.00 H new ATOM 0 HH TYR A 163 2.920 7.298 7.228 1.00 0.00 H new ATOM 640 N ARG A 164 3.733 5.987 0.204 1.00 0.00 N ATOM 641 CA ARG A 164 4.726 7.041 0.046 1.00 0.00 C ATOM 642 C ARG A 164 4.103 8.411 0.305 1.00 0.00 C ATOM 643 O ARG A 164 2.894 8.586 0.151 1.00 0.00 O ATOM 644 CB ARG A 164 5.324 7.004 -1.362 1.00 0.00 C ATOM 645 CG ARG A 164 6.701 6.369 -1.424 1.00 0.00 C ATOM 646 CD ARG A 164 7.607 7.096 -2.403 1.00 0.00 C ATOM 647 NE ARG A 164 7.109 7.016 -3.775 1.00 0.00 N ATOM 648 CZ ARG A 164 7.665 7.656 -4.800 1.00 0.00 C ATOM 649 NH1 ARG A 164 8.733 8.419 -4.611 1.00 0.00 N ATOM 650 NH2 ARG A 164 7.153 7.532 -6.017 1.00 0.00 N ATOM 0 H ARG A 164 2.965 6.030 -0.466 1.00 0.00 H new ATOM 0 HA ARG A 164 5.519 6.872 0.775 1.00 0.00 H new ATOM 0 HB2 ARG A 164 4.650 6.454 -2.019 1.00 0.00 H new ATOM 0 HB3 ARG A 164 5.385 8.022 -1.748 1.00 0.00 H new ATOM 0 HG2 ARG A 164 7.153 6.380 -0.432 1.00 0.00 H new ATOM 0 HG3 ARG A 164 6.608 5.324 -1.720 1.00 0.00 H new ATOM 0 HD2 ARG A 164 7.693 8.142 -2.109 1.00 0.00 H new ATOM 0 HD3 ARG A 164 8.609 6.669 -2.356 1.00 0.00 H new ATOM 0 HE ARG A 164 6.289 6.437 -3.957 1.00 0.00 H new ATOM 0 HH11 ARG A 164 9.131 8.517 -3.677 1.00 0.00 H new ATOM 0 HH12 ARG A 164 9.156 8.908 -5.400 1.00 0.00 H new ATOM 0 HH21 ARG A 164 6.332 6.946 -6.168 1.00 0.00 H new ATOM 0 HH22 ARG A 164 7.580 8.023 -6.802 1.00 0.00 H new ATOM 664 N PRO A 165 4.919 9.406 0.702 1.00 0.00 N ATOM 665 CA PRO A 165 4.438 10.765 0.978 1.00 0.00 C ATOM 666 C PRO A 165 3.655 11.349 -0.195 1.00 0.00 C ATOM 667 O PRO A 165 4.147 11.390 -1.323 1.00 0.00 O ATOM 668 CB PRO A 165 5.724 11.571 1.215 1.00 0.00 C ATOM 669 CG PRO A 165 6.831 10.707 0.711 1.00 0.00 C ATOM 670 CD PRO A 165 6.371 9.296 0.910 1.00 0.00 C ATOM 0 HA PRO A 165 3.751 10.785 1.824 1.00 0.00 H new ATOM 0 HB2 PRO A 165 5.695 12.522 0.684 1.00 0.00 H new ATOM 0 HB3 PRO A 165 5.855 11.800 2.273 1.00 0.00 H new ATOM 0 HG2 PRO A 165 7.035 10.907 -0.341 1.00 0.00 H new ATOM 0 HG3 PRO A 165 7.755 10.898 1.257 1.00 0.00 H new ATOM 0 HD2 PRO A 165 6.833 8.613 0.197 1.00 0.00 H new ATOM 0 HD3 PRO A 165 6.612 8.927 1.907 1.00 0.00 H new ATOM 785 N ASN A 173 -5.402 7.673 -7.091 1.00 0.00 N ATOM 786 CA ASN A 173 -5.020 6.670 -8.079 1.00 0.00 C ATOM 787 C ASN A 173 -3.517 6.401 -8.043 1.00 0.00 C ATOM 788 O ASN A 173 -3.090 5.248 -8.034 1.00 0.00 O ATOM 789 CB ASN A 173 -5.451 7.111 -9.483 1.00 0.00 C ATOM 790 CG ASN A 173 -4.496 8.109 -10.109 1.00 0.00 C ATOM 791 OD1 ASN A 173 -4.632 9.317 -9.925 1.00 0.00 O ATOM 792 ND2 ASN A 173 -3.521 7.604 -10.858 1.00 0.00 N ATOM 0 HA ASN A 173 -5.533 5.741 -7.829 1.00 0.00 H new ATOM 0 HB2 ASN A 173 -5.525 6.234 -10.127 1.00 0.00 H new ATOM 0 HB3 ASN A 173 -6.446 7.553 -9.430 1.00 0.00 H new ATOM 0 HD21 ASN A 173 -2.848 8.226 -11.307 1.00 0.00 H new ATOM 0 HD22 ASN A 173 -3.445 6.595 -10.984 1.00 0.00 H new ATOM 799 N ASN A 174 -2.722 7.466 -8.020 1.00 0.00 N ATOM 800 CA ASN A 174 -1.267 7.336 -7.984 1.00 0.00 C ATOM 801 C ASN A 174 -0.794 6.826 -6.628 1.00 0.00 C ATOM 802 O ASN A 174 0.233 6.153 -6.529 1.00 0.00 O ATOM 803 CB ASN A 174 -0.606 8.682 -8.290 1.00 0.00 C ATOM 804 CG ASN A 174 -1.435 9.538 -9.227 1.00 0.00 C ATOM 805 OD1 ASN A 174 -1.336 9.418 -10.448 1.00 0.00 O ATOM 806 ND2 ASN A 174 -2.261 10.409 -8.658 1.00 0.00 N ATOM 0 H ASN A 174 -3.059 8.429 -8.026 1.00 0.00 H new ATOM 0 HA ASN A 174 -0.977 6.611 -8.745 1.00 0.00 H new ATOM 0 HB2 ASN A 174 -0.443 9.223 -7.358 1.00 0.00 H new ATOM 0 HB3 ASN A 174 0.374 8.509 -8.734 1.00 0.00 H new ATOM 0 HD21 ASN A 174 -2.845 11.012 -9.238 1.00 0.00 H new ATOM 0 HD22 ASN A 174 -2.311 10.475 -7.641 1.00 0.00 H new ATOM 813 N PHE A 175 -1.545 7.159 -5.585 1.00 0.00 N ATOM 814 CA PHE A 175 -1.204 6.747 -4.228 1.00 0.00 C ATOM 815 C PHE A 175 -1.334 5.237 -4.052 1.00 0.00 C ATOM 816 O PHE A 175 -0.416 4.578 -3.563 1.00 0.00 O ATOM 817 CB PHE A 175 -2.106 7.467 -3.221 1.00 0.00 C ATOM 818 CG PHE A 175 -1.583 7.443 -1.812 1.00 0.00 C ATOM 819 CD1 PHE A 175 -1.835 6.361 -0.983 1.00 0.00 C ATOM 820 CD2 PHE A 175 -0.845 8.505 -1.315 1.00 0.00 C ATOM 821 CE1 PHE A 175 -1.359 6.339 0.315 1.00 0.00 C ATOM 822 CE2 PHE A 175 -0.366 8.488 -0.018 1.00 0.00 C ATOM 823 CZ PHE A 175 -0.624 7.405 0.798 1.00 0.00 C ATOM 0 H PHE A 175 -2.397 7.715 -5.653 1.00 0.00 H new ATOM 0 HA PHE A 175 -0.164 7.019 -4.048 1.00 0.00 H new ATOM 0 HB2 PHE A 175 -2.230 8.503 -3.535 1.00 0.00 H new ATOM 0 HB3 PHE A 175 -3.094 7.008 -3.240 1.00 0.00 H new ATOM 0 HD1 PHE A 175 -2.410 5.526 -1.355 1.00 0.00 H new ATOM 0 HD2 PHE A 175 -0.641 9.356 -1.948 1.00 0.00 H new ATOM 0 HE1 PHE A 175 -1.561 5.490 0.951 1.00 0.00 H new ATOM 0 HE2 PHE A 175 0.210 9.322 0.356 1.00 0.00 H new ATOM 0 HZ PHE A 175 -0.252 7.391 1.812 1.00 0.00 H new ATOM 833 N VAL A 176 -2.487 4.696 -4.435 1.00 0.00 N ATOM 834 CA VAL A 176 -2.743 3.267 -4.300 1.00 0.00 C ATOM 835 C VAL A 176 -2.013 2.445 -5.359 1.00 0.00 C ATOM 836 O VAL A 176 -1.593 1.321 -5.092 1.00 0.00 O ATOM 837 CB VAL A 176 -4.252 2.958 -4.371 1.00 0.00 C ATOM 838 CG1 VAL A 176 -5.003 3.733 -3.300 1.00 0.00 C ATOM 839 CG2 VAL A 176 -4.806 3.274 -5.753 1.00 0.00 C ATOM 0 H VAL A 176 -3.258 5.226 -4.841 1.00 0.00 H new ATOM 0 HA VAL A 176 -2.360 2.983 -3.320 1.00 0.00 H new ATOM 0 HB VAL A 176 -4.392 1.893 -4.188 1.00 0.00 H new ATOM 0 HG11 VAL A 176 -6.067 3.504 -3.364 1.00 0.00 H new ATOM 0 HG12 VAL A 176 -4.629 3.450 -2.316 1.00 0.00 H new ATOM 0 HG13 VAL A 176 -4.852 4.802 -3.451 1.00 0.00 H new ATOM 0 HG21 VAL A 176 -5.872 3.048 -5.778 1.00 0.00 H new ATOM 0 HG22 VAL A 176 -4.654 4.331 -5.973 1.00 0.00 H new ATOM 0 HG23 VAL A 176 -4.289 2.670 -6.499 1.00 0.00 H new ATOM 849 N HIS A 177 -1.871 3.000 -6.559 1.00 0.00 N ATOM 850 CA HIS A 177 -1.200 2.294 -7.649 1.00 0.00 C ATOM 851 C HIS A 177 0.220 1.890 -7.261 1.00 0.00 C ATOM 852 O HIS A 177 0.584 0.717 -7.341 1.00 0.00 O ATOM 853 CB HIS A 177 -1.167 3.163 -8.908 1.00 0.00 C ATOM 854 CG HIS A 177 -2.217 2.797 -9.913 1.00 0.00 C ATOM 855 ND1 HIS A 177 -1.926 2.467 -11.219 1.00 0.00 N ATOM 856 CD2 HIS A 177 -3.564 2.708 -9.796 1.00 0.00 C ATOM 857 CE1 HIS A 177 -3.047 2.192 -11.862 1.00 0.00 C ATOM 858 NE2 HIS A 177 -4.054 2.331 -11.021 1.00 0.00 N ATOM 0 H HIS A 177 -2.209 3.931 -6.802 1.00 0.00 H new ATOM 0 HA HIS A 177 -1.769 1.387 -7.853 1.00 0.00 H new ATOM 0 HB2 HIS A 177 -1.296 4.207 -8.623 1.00 0.00 H new ATOM 0 HB3 HIS A 177 -0.185 3.078 -9.373 1.00 0.00 H new ATOM 0 HD2 HIS A 177 -4.144 2.898 -8.905 1.00 0.00 H new ATOM 0 HE1 HIS A 177 -3.126 1.903 -12.900 1.00 0.00 H new ATOM 0 HE2 HIS A 177 -5.038 2.182 -11.245 1.00 0.00 H new ATOM 867 N ASP A 178 1.018 2.868 -6.844 1.00 0.00 N ATOM 868 CA ASP A 178 2.398 2.611 -6.450 1.00 0.00 C ATOM 869 C ASP A 178 2.460 1.756 -5.187 1.00 0.00 C ATOM 870 O ASP A 178 3.434 1.036 -4.960 1.00 0.00 O ATOM 871 CB ASP A 178 3.137 3.931 -6.223 1.00 0.00 C ATOM 872 CG ASP A 178 4.625 3.817 -6.494 1.00 0.00 C ATOM 873 OD1 ASP A 178 5.137 2.679 -6.534 1.00 0.00 O ATOM 874 OD2 ASP A 178 5.278 4.867 -6.668 1.00 0.00 O ATOM 0 H ASP A 178 0.733 3.845 -6.770 1.00 0.00 H new ATOM 0 HA ASP A 178 2.882 2.062 -7.258 1.00 0.00 H new ATOM 0 HB2 ASP A 178 2.711 4.698 -6.869 1.00 0.00 H new ATOM 0 HB3 ASP A 178 2.982 4.258 -5.195 1.00 0.00 H new ATOM 879 N CYS A 179 1.419 1.847 -4.367 1.00 0.00 N ATOM 880 CA CYS A 179 1.356 1.090 -3.121 1.00 0.00 C ATOM 881 C CYS A 179 1.108 -0.397 -3.377 1.00 0.00 C ATOM 882 O CYS A 179 1.627 -1.250 -2.660 1.00 0.00 O ATOM 883 CB CYS A 179 0.254 1.659 -2.224 1.00 0.00 C ATOM 884 SG CYS A 179 -0.302 0.529 -0.908 1.00 0.00 S ATOM 0 H CYS A 179 0.606 2.438 -4.542 1.00 0.00 H new ATOM 0 HA CYS A 179 2.320 1.184 -2.621 1.00 0.00 H new ATOM 0 HB2 CYS A 179 0.614 2.581 -1.767 1.00 0.00 H new ATOM 0 HB3 CYS A 179 -0.602 1.924 -2.844 1.00 0.00 H new ATOM 889 N VAL A 180 0.307 -0.702 -4.394 1.00 0.00 N ATOM 890 CA VAL A 180 -0.016 -2.088 -4.727 1.00 0.00 C ATOM 891 C VAL A 180 1.209 -2.870 -5.207 1.00 0.00 C ATOM 892 O VAL A 180 1.525 -3.931 -4.668 1.00 0.00 O ATOM 893 CB VAL A 180 -1.115 -2.162 -5.809 1.00 0.00 C ATOM 894 CG1 VAL A 180 -1.375 -3.603 -6.220 1.00 0.00 C ATOM 895 CG2 VAL A 180 -2.396 -1.509 -5.315 1.00 0.00 C ATOM 0 H VAL A 180 -0.130 -0.010 -5.002 1.00 0.00 H new ATOM 0 HA VAL A 180 -0.379 -2.544 -3.806 1.00 0.00 H new ATOM 0 HB VAL A 180 -0.765 -1.617 -6.685 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -2.153 -3.629 -6.983 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -0.459 -4.038 -6.620 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.699 -4.176 -5.351 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -3.159 -1.571 -6.091 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -2.746 -2.025 -4.421 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -2.203 -0.463 -5.079 1.00 0.00 H new ATOM 905 N ASN A 181 1.876 -2.353 -6.235 1.00 0.00 N ATOM 906 CA ASN A 181 3.048 -3.020 -6.804 1.00 0.00 C ATOM 907 C ASN A 181 4.158 -3.232 -5.776 1.00 0.00 C ATOM 908 O ASN A 181 4.906 -4.203 -5.865 1.00 0.00 O ATOM 909 CB ASN A 181 3.587 -2.225 -7.995 1.00 0.00 C ATOM 910 CG ASN A 181 3.841 -0.769 -7.657 1.00 0.00 C ATOM 911 OD1 ASN A 181 3.111 0.119 -8.100 1.00 0.00 O ATOM 912 ND2 ASN A 181 4.883 -0.515 -6.874 1.00 0.00 N ATOM 0 H ASN A 181 1.627 -1.476 -6.692 1.00 0.00 H new ATOM 0 HA ASN A 181 2.721 -4.005 -7.137 1.00 0.00 H new ATOM 0 HB2 ASN A 181 4.514 -2.681 -8.342 1.00 0.00 H new ATOM 0 HB3 ASN A 181 2.875 -2.284 -8.819 1.00 0.00 H new ATOM 0 HD21 ASN A 181 5.105 0.447 -6.617 1.00 0.00 H new ATOM 0 HD22 ASN A 181 5.461 -1.282 -6.530 1.00 0.00 H new ATOM 919 N ILE A 182 4.276 -2.323 -4.812 1.00 0.00 N ATOM 920 CA ILE A 182 5.318 -2.437 -3.795 1.00 0.00 C ATOM 921 C ILE A 182 4.923 -3.415 -2.687 1.00 0.00 C ATOM 922 O ILE A 182 5.737 -4.232 -2.256 1.00 0.00 O ATOM 923 CB ILE A 182 5.665 -1.056 -3.182 1.00 0.00 C ATOM 924 CG1 ILE A 182 6.751 -0.361 -4.012 1.00 0.00 C ATOM 925 CG2 ILE A 182 6.117 -1.191 -1.731 1.00 0.00 C ATOM 926 CD1 ILE A 182 8.019 -1.179 -4.175 1.00 0.00 C ATOM 0 H ILE A 182 3.671 -1.508 -4.713 1.00 0.00 H new ATOM 0 HA ILE A 182 6.204 -2.827 -4.296 1.00 0.00 H new ATOM 0 HB ILE A 182 4.761 -0.447 -3.199 1.00 0.00 H new ATOM 0 HG12 ILE A 182 6.349 -0.132 -4.999 1.00 0.00 H new ATOM 0 HG13 ILE A 182 7.002 0.590 -3.541 1.00 0.00 H new ATOM 0 HG21 ILE A 182 6.353 -0.205 -1.330 1.00 0.00 H new ATOM 0 HG22 ILE A 182 5.318 -1.641 -1.141 1.00 0.00 H new ATOM 0 HG23 ILE A 182 7.003 -1.824 -1.683 1.00 0.00 H new ATOM 0 HD11 ILE A 182 8.738 -0.620 -4.774 1.00 0.00 H new ATOM 0 HD12 ILE A 182 8.447 -1.387 -3.194 1.00 0.00 H new ATOM 0 HD13 ILE A 182 7.784 -2.119 -4.675 1.00 0.00 H new ATOM 938 N THR A 183 3.681 -3.322 -2.224 1.00 0.00 N ATOM 939 CA THR A 183 3.197 -4.196 -1.159 1.00 0.00 C ATOM 940 C THR A 183 3.337 -5.669 -1.534 1.00 0.00 C ATOM 941 O THR A 183 3.838 -6.471 -0.748 1.00 0.00 O ATOM 942 CB THR A 183 1.727 -3.900 -0.808 1.00 0.00 C ATOM 943 OG1 THR A 183 1.580 -2.529 -0.422 1.00 0.00 O ATOM 944 CG2 THR A 183 1.246 -4.798 0.323 1.00 0.00 C ATOM 0 H THR A 183 2.992 -2.653 -2.568 1.00 0.00 H new ATOM 0 HA THR A 183 3.818 -3.992 -0.286 1.00 0.00 H new ATOM 0 HB THR A 183 1.123 -4.098 -1.693 1.00 0.00 H new ATOM 0 HG1 THR A 183 1.732 -1.952 -1.200 1.00 0.00 H new ATOM 0 HG21 THR A 183 0.205 -4.569 0.552 1.00 0.00 H new ATOM 0 HG22 THR A 183 1.330 -5.842 0.020 1.00 0.00 H new ATOM 0 HG23 THR A 183 1.858 -4.627 1.209 1.00 0.00 H new ATOM 952 N ILE A 184 2.894 -6.021 -2.737 1.00 0.00 N ATOM 953 CA ILE A 184 2.976 -7.401 -3.202 1.00 0.00 C ATOM 954 C ILE A 184 4.424 -7.797 -3.484 1.00 0.00 C ATOM 955 O ILE A 184 4.850 -8.900 -3.144 1.00 0.00 O ATOM 956 CB ILE A 184 2.116 -7.619 -4.471 1.00 0.00 C ATOM 957 CG1 ILE A 184 0.643 -7.786 -4.091 1.00 0.00 C ATOM 958 CG2 ILE A 184 2.597 -8.831 -5.261 1.00 0.00 C ATOM 959 CD1 ILE A 184 -0.242 -6.668 -4.595 1.00 0.00 C ATOM 0 H ILE A 184 2.476 -5.373 -3.405 1.00 0.00 H new ATOM 0 HA ILE A 184 2.585 -8.035 -2.406 1.00 0.00 H new ATOM 0 HB ILE A 184 2.222 -6.739 -5.105 1.00 0.00 H new ATOM 0 HG12 ILE A 184 0.279 -8.734 -4.488 1.00 0.00 H new ATOM 0 HG13 ILE A 184 0.560 -7.843 -3.006 1.00 0.00 H new ATOM 0 HG21 ILE A 184 1.974 -8.959 -6.146 1.00 0.00 H new ATOM 0 HG22 ILE A 184 3.633 -8.680 -5.565 1.00 0.00 H new ATOM 0 HG23 ILE A 184 2.528 -9.722 -4.637 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -1.272 -6.853 -4.289 1.00 0.00 H new ATOM 0 HD12 ILE A 184 0.096 -5.720 -4.177 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -0.189 -6.625 -5.683 1.00 0.00 H new ATOM 971 N LYS A 185 5.176 -6.891 -4.101 1.00 0.00 N ATOM 972 CA LYS A 185 6.576 -7.152 -4.423 1.00 0.00 C ATOM 973 C LYS A 185 7.408 -7.312 -3.153 1.00 0.00 C ATOM 974 O LYS A 185 8.485 -7.908 -3.175 1.00 0.00 O ATOM 975 CB LYS A 185 7.144 -6.013 -5.274 1.00 0.00 C ATOM 976 CG LYS A 185 8.571 -6.247 -5.744 1.00 0.00 C ATOM 977 CD LYS A 185 9.291 -4.934 -6.010 1.00 0.00 C ATOM 978 CE LYS A 185 10.115 -4.496 -4.809 1.00 0.00 C ATOM 979 NZ LYS A 185 11.484 -4.063 -5.202 1.00 0.00 N ATOM 0 H LYS A 185 4.841 -5.971 -4.388 1.00 0.00 H new ATOM 0 HA LYS A 185 6.625 -8.083 -4.988 1.00 0.00 H new ATOM 0 HB2 LYS A 185 6.504 -5.869 -6.145 1.00 0.00 H new ATOM 0 HB3 LYS A 185 7.109 -5.089 -4.697 1.00 0.00 H new ATOM 0 HG2 LYS A 185 9.115 -6.816 -4.990 1.00 0.00 H new ATOM 0 HG3 LYS A 185 8.562 -6.849 -6.653 1.00 0.00 H new ATOM 0 HD2 LYS A 185 9.941 -5.044 -6.878 1.00 0.00 H new ATOM 0 HD3 LYS A 185 8.562 -4.161 -6.254 1.00 0.00 H new ATOM 0 HE2 LYS A 185 9.607 -3.677 -4.300 1.00 0.00 H new ATOM 0 HE3 LYS A 185 10.185 -5.319 -4.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 12.013 -3.772 -4.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 11.978 -4.852 -5.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 11.419 -3.261 -5.861 1.00 0.00 H new ATOM 993 N GLN A 186 6.907 -6.766 -2.051 1.00 0.00 N ATOM 994 CA GLN A 186 7.605 -6.833 -0.772 1.00 0.00 C ATOM 995 C GLN A 186 7.301 -8.127 -0.024 1.00 0.00 C ATOM 996 O GLN A 186 8.209 -8.792 0.473 1.00 0.00 O ATOM 997 CB GLN A 186 7.216 -5.638 0.099 1.00 0.00 C ATOM 998 CG GLN A 186 8.322 -4.605 0.289 1.00 0.00 C ATOM 999 CD GLN A 186 9.627 -4.977 -0.395 1.00 0.00 C ATOM 1000 OE1 GLN A 186 10.408 -5.774 0.124 1.00 0.00 O ATOM 1001 NE2 GLN A 186 9.870 -4.396 -1.564 1.00 0.00 N ATOM 0 H GLN A 186 6.016 -6.270 -2.018 1.00 0.00 H new ATOM 0 HA GLN A 186 8.674 -6.809 -0.982 1.00 0.00 H new ATOM 0 HB2 GLN A 186 6.351 -5.147 -0.346 1.00 0.00 H new ATOM 0 HB3 GLN A 186 6.906 -6.004 1.078 1.00 0.00 H new ATOM 0 HG2 GLN A 186 7.980 -3.644 -0.097 1.00 0.00 H new ATOM 0 HG3 GLN A 186 8.505 -4.473 1.355 1.00 0.00 H new ATOM 0 HE21 GLN A 186 9.195 -3.741 -1.958 1.00 0.00 H new ATOM 0 HE22 GLN A 186 10.732 -4.605 -2.068 1.00 0.00 H new ATOM 1010 N HIS A 187 6.020 -8.470 0.072 1.00 0.00 N ATOM 1011 CA HIS A 187 5.603 -9.673 0.786 1.00 0.00 C ATOM 1012 C HIS A 187 6.049 -10.939 0.060 1.00 0.00 C ATOM 1013 O HIS A 187 6.514 -11.889 0.687 1.00 0.00 O ATOM 1014 CB HIS A 187 4.083 -9.681 0.969 1.00 0.00 C ATOM 1015 CG HIS A 187 3.605 -8.753 2.045 1.00 0.00 C ATOM 1016 ND1 HIS A 187 3.640 -9.072 3.388 1.00 0.00 N ATOM 1017 CD2 HIS A 187 3.083 -7.505 1.974 1.00 0.00 C ATOM 1018 CE1 HIS A 187 3.162 -8.062 4.092 1.00 0.00 C ATOM 1019 NE2 HIS A 187 2.818 -7.100 3.258 1.00 0.00 N ATOM 0 H HIS A 187 5.254 -7.933 -0.335 1.00 0.00 H new ATOM 0 HA HIS A 187 6.083 -9.661 1.764 1.00 0.00 H new ATOM 0 HB2 HIS A 187 3.610 -9.406 0.026 1.00 0.00 H new ATOM 0 HB3 HIS A 187 3.759 -10.695 1.204 1.00 0.00 H new ATOM 0 HD2 HIS A 187 2.908 -6.935 1.074 1.00 0.00 H new ATOM 0 HE1 HIS A 187 3.069 -8.029 5.167 1.00 0.00 H new ATOM 0 HE2 HIS A 187 2.419 -6.200 3.525 1.00 0.00 H new ATOM 1028 N THR A 188 5.907 -10.954 -1.260 1.00 0.00 N ATOM 1029 CA THR A 188 6.297 -12.116 -2.052 1.00 0.00 C ATOM 1030 C THR A 188 7.767 -12.471 -1.834 1.00 0.00 C ATOM 1031 O THR A 188 8.171 -13.616 -2.029 1.00 0.00 O ATOM 1032 CB THR A 188 6.059 -11.885 -3.556 1.00 0.00 C ATOM 1033 OG1 THR A 188 6.664 -10.655 -3.968 1.00 0.00 O ATOM 1034 CG2 THR A 188 4.571 -11.859 -3.870 1.00 0.00 C ATOM 0 H THR A 188 5.527 -10.179 -1.803 1.00 0.00 H new ATOM 0 HA THR A 188 5.671 -12.943 -1.715 1.00 0.00 H new ATOM 0 HB THR A 188 6.515 -12.710 -4.104 1.00 0.00 H new ATOM 0 HG1 THR A 188 6.083 -9.906 -3.720 1.00 0.00 H new ATOM 0 HG21 THR A 188 4.427 -11.695 -4.938 1.00 0.00 H new ATOM 0 HG22 THR A 188 4.122 -12.811 -3.586 1.00 0.00 H new ATOM 0 HG23 THR A 188 4.095 -11.053 -3.312 1.00 0.00 H new ATOM 1042 N VAL A 189 8.566 -11.481 -1.445 1.00 0.00 N ATOM 1043 CA VAL A 189 9.990 -11.698 -1.218 1.00 0.00 C ATOM 1044 C VAL A 189 10.288 -12.186 0.202 1.00 0.00 C ATOM 1045 O VAL A 189 10.930 -13.220 0.384 1.00 0.00 O ATOM 1046 CB VAL A 189 10.800 -10.414 -1.491 1.00 0.00 C ATOM 1047 CG1 VAL A 189 12.266 -10.608 -1.130 1.00 0.00 C ATOM 1048 CG2 VAL A 189 10.658 -9.997 -2.947 1.00 0.00 C ATOM 0 H VAL A 189 8.252 -10.524 -1.281 1.00 0.00 H new ATOM 0 HA VAL A 189 10.292 -12.477 -1.918 1.00 0.00 H new ATOM 0 HB VAL A 189 10.400 -9.619 -0.861 1.00 0.00 H new ATOM 0 HG11 VAL A 189 12.815 -9.688 -1.332 1.00 0.00 H new ATOM 0 HG12 VAL A 189 12.350 -10.856 -0.072 1.00 0.00 H new ATOM 0 HG13 VAL A 189 12.684 -11.418 -1.727 1.00 0.00 H new ATOM 0 HG21 VAL A 189 11.235 -9.089 -3.124 1.00 0.00 H new ATOM 0 HG22 VAL A 189 11.029 -10.794 -3.592 1.00 0.00 H new ATOM 0 HG23 VAL A 189 9.608 -9.808 -3.171 1.00 0.00 H new ATOM 1058 N THR A 190 9.850 -11.425 1.203 1.00 0.00 N ATOM 1059 CA THR A 190 10.110 -11.779 2.600 1.00 0.00 C ATOM 1060 C THR A 190 9.073 -12.743 3.177 1.00 0.00 C ATOM 1061 O THR A 190 9.429 -13.775 3.743 1.00 0.00 O ATOM 1062 CB THR A 190 10.184 -10.527 3.496 1.00 0.00 C ATOM 1063 OG1 THR A 190 10.208 -10.913 4.875 1.00 0.00 O ATOM 1064 CG2 THR A 190 9.002 -9.600 3.248 1.00 0.00 C ATOM 0 H THR A 190 9.317 -10.565 1.076 1.00 0.00 H new ATOM 0 HA THR A 190 11.075 -12.285 2.594 1.00 0.00 H new ATOM 0 HB THR A 190 11.100 -9.991 3.248 1.00 0.00 H new ATOM 0 HG1 THR A 190 10.257 -10.112 5.438 1.00 0.00 H new ATOM 0 HG21 THR A 190 9.083 -8.726 3.895 1.00 0.00 H new ATOM 0 HG22 THR A 190 9.002 -9.281 2.206 1.00 0.00 H new ATOM 0 HG23 THR A 190 8.074 -10.128 3.466 1.00 0.00 H new ATOM 1072 N THR A 191 7.795 -12.390 3.060 1.00 0.00 N ATOM 1073 CA THR A 191 6.716 -13.217 3.601 1.00 0.00 C ATOM 1074 C THR A 191 6.751 -14.642 3.060 1.00 0.00 C ATOM 1075 O THR A 191 6.493 -15.597 3.795 1.00 0.00 O ATOM 1076 CB THR A 191 5.337 -12.603 3.304 1.00 0.00 C ATOM 1077 OG1 THR A 191 5.392 -11.183 3.477 1.00 0.00 O ATOM 1078 CG2 THR A 191 4.273 -13.191 4.219 1.00 0.00 C ATOM 0 H THR A 191 7.480 -11.538 2.596 1.00 0.00 H new ATOM 0 HA THR A 191 6.876 -13.252 4.679 1.00 0.00 H new ATOM 0 HB THR A 191 5.072 -12.836 2.273 1.00 0.00 H new ATOM 0 HG1 THR A 191 4.485 -10.814 3.445 1.00 0.00 H new ATOM 0 HG21 THR A 191 3.307 -12.741 3.990 1.00 0.00 H new ATOM 0 HG22 THR A 191 4.217 -14.269 4.066 1.00 0.00 H new ATOM 0 HG23 THR A 191 4.532 -12.985 5.258 1.00 0.00 H new ATOM 1086 N THR A 192 7.065 -14.789 1.778 1.00 0.00 N ATOM 1087 CA THR A 192 7.123 -16.109 1.159 1.00 0.00 C ATOM 1088 C THR A 192 8.317 -16.903 1.678 1.00 0.00 C ATOM 1089 O THR A 192 8.377 -18.124 1.533 1.00 0.00 O ATOM 1090 CB THR A 192 7.202 -16.011 -0.375 1.00 0.00 C ATOM 1091 OG1 THR A 192 6.273 -15.030 -0.851 1.00 0.00 O ATOM 1092 CG2 THR A 192 6.898 -17.355 -1.019 1.00 0.00 C ATOM 0 H THR A 192 7.282 -14.016 1.150 1.00 0.00 H new ATOM 0 HA THR A 192 6.203 -16.628 1.428 1.00 0.00 H new ATOM 0 HB THR A 192 8.215 -15.715 -0.646 1.00 0.00 H new ATOM 0 HG1 THR A 192 6.319 -14.984 -1.829 1.00 0.00 H new ATOM 0 HG21 THR A 192 6.960 -17.261 -2.103 1.00 0.00 H new ATOM 0 HG22 THR A 192 7.622 -18.094 -0.677 1.00 0.00 H new ATOM 0 HG23 THR A 192 5.894 -17.674 -0.739 1.00 0.00 H new ATOM 1100 N THR A 193 9.262 -16.199 2.292 1.00 0.00 N ATOM 1101 CA THR A 193 10.453 -16.832 2.846 1.00 0.00 C ATOM 1102 C THR A 193 10.326 -16.992 4.358 1.00 0.00 C ATOM 1103 O THR A 193 11.042 -17.784 4.973 1.00 0.00 O ATOM 1104 CB THR A 193 11.721 -16.015 2.529 1.00 0.00 C ATOM 1105 OG1 THR A 193 11.735 -15.652 1.142 1.00 0.00 O ATOM 1106 CG2 THR A 193 12.978 -16.807 2.860 1.00 0.00 C ATOM 0 H THR A 193 9.226 -15.188 2.419 1.00 0.00 H new ATOM 0 HA THR A 193 10.542 -17.815 2.382 1.00 0.00 H new ATOM 0 HB THR A 193 11.706 -15.115 3.144 1.00 0.00 H new ATOM 0 HG1 THR A 193 11.725 -14.676 1.059 1.00 0.00 H new ATOM 0 HG21 THR A 193 13.858 -16.207 2.627 1.00 0.00 H new ATOM 0 HG22 THR A 193 12.981 -17.058 3.921 1.00 0.00 H new ATOM 0 HG23 THR A 193 12.997 -17.723 2.270 1.00 0.00 H new ATOM 1114 N LYS A 194 9.405 -16.237 4.950 1.00 0.00 N ATOM 1115 CA LYS A 194 9.175 -16.292 6.388 1.00 0.00 C ATOM 1116 C LYS A 194 8.462 -17.584 6.773 1.00 0.00 C ATOM 1117 O LYS A 194 8.666 -18.115 7.865 1.00 0.00 O ATOM 1118 CB LYS A 194 8.346 -15.087 6.839 1.00 0.00 C ATOM 1119 CG LYS A 194 9.127 -13.783 6.852 1.00 0.00 C ATOM 1120 CD LYS A 194 9.184 -13.183 8.248 1.00 0.00 C ATOM 1121 CE LYS A 194 8.291 -11.957 8.365 1.00 0.00 C ATOM 1122 NZ LYS A 194 8.578 -10.957 7.300 1.00 0.00 N ATOM 0 H LYS A 194 8.805 -15.579 4.453 1.00 0.00 H new ATOM 0 HA LYS A 194 10.143 -16.267 6.888 1.00 0.00 H new ATOM 0 HB2 LYS A 194 7.486 -14.980 6.177 1.00 0.00 H new ATOM 0 HB3 LYS A 194 7.957 -15.278 7.839 1.00 0.00 H new ATOM 0 HG2 LYS A 194 10.139 -13.960 6.489 1.00 0.00 H new ATOM 0 HG3 LYS A 194 8.663 -13.073 6.168 1.00 0.00 H new ATOM 0 HD2 LYS A 194 8.875 -13.930 8.979 1.00 0.00 H new ATOM 0 HD3 LYS A 194 10.212 -12.910 8.486 1.00 0.00 H new ATOM 0 HE2 LYS A 194 7.246 -12.262 8.305 1.00 0.00 H new ATOM 0 HE3 LYS A 194 8.433 -11.497 9.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 8.739 -10.025 7.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 9.427 -11.245 6.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 7.769 -10.901 6.649 1.00 0.00 H new ATOM 1136 N GLY A 195 7.626 -18.083 5.867 1.00 0.00 N ATOM 1137 CA GLY A 195 6.894 -19.308 6.127 1.00 0.00 C ATOM 1138 C GLY A 195 5.600 -19.391 5.341 1.00 0.00 C ATOM 1139 O GLY A 195 4.872 -20.379 5.435 1.00 0.00 O ATOM 0 H GLY A 195 7.443 -17.660 4.957 1.00 0.00 H new ATOM 0 HA2 GLY A 195 7.522 -20.163 5.877 1.00 0.00 H new ATOM 0 HA3 GLY A 195 6.673 -19.376 7.192 1.00 0.00 H new ATOM 1143 N GLU A 196 5.312 -18.349 4.567 1.00 0.00 N ATOM 1144 CA GLU A 196 4.097 -18.309 3.763 1.00 0.00 C ATOM 1145 C GLU A 196 4.335 -18.905 2.379 1.00 0.00 C ATOM 1146 O GLU A 196 5.458 -19.275 2.036 1.00 0.00 O ATOM 1147 CB GLU A 196 3.594 -16.870 3.628 1.00 0.00 C ATOM 1148 CG GLU A 196 2.126 -16.704 3.983 1.00 0.00 C ATOM 1149 CD GLU A 196 1.879 -16.766 5.478 1.00 0.00 C ATOM 1150 OE1 GLU A 196 2.529 -15.999 6.219 1.00 0.00 O ATOM 1151 OE2 GLU A 196 1.035 -17.582 5.906 1.00 0.00 O ATOM 0 H GLU A 196 5.903 -17.522 4.480 1.00 0.00 H new ATOM 0 HA GLU A 196 3.340 -18.907 4.271 1.00 0.00 H new ATOM 0 HB2 GLU A 196 4.190 -16.223 4.272 1.00 0.00 H new ATOM 0 HB3 GLU A 196 3.752 -16.533 2.603 1.00 0.00 H new ATOM 0 HG2 GLU A 196 1.768 -15.749 3.598 1.00 0.00 H new ATOM 0 HG3 GLU A 196 1.546 -17.484 3.490 1.00 0.00 H new ATOM 1158 N ASN A 197 3.269 -18.992 1.590 1.00 0.00 N ATOM 1159 CA ASN A 197 3.356 -19.541 0.242 1.00 0.00 C ATOM 1160 C ASN A 197 2.410 -18.804 -0.701 1.00 0.00 C ATOM 1161 O ASN A 197 1.216 -19.098 -0.752 1.00 0.00 O ATOM 1162 CB ASN A 197 3.025 -21.034 0.252 1.00 0.00 C ATOM 1163 CG ASN A 197 3.865 -21.819 -0.736 1.00 0.00 C ATOM 1164 OD1 ASN A 197 4.555 -22.768 -0.365 1.00 0.00 O ATOM 1165 ND2 ASN A 197 3.810 -21.425 -2.004 1.00 0.00 N ATOM 0 H ASN A 197 2.334 -18.689 1.862 1.00 0.00 H new ATOM 0 HA ASN A 197 4.377 -19.408 -0.115 1.00 0.00 H new ATOM 0 HB2 ASN A 197 3.182 -21.431 1.255 1.00 0.00 H new ATOM 0 HB3 ASN A 197 1.970 -21.171 0.017 1.00 0.00 H new ATOM 0 HD21 ASN A 197 4.354 -21.915 -2.714 1.00 0.00 H new ATOM 0 HD22 ASN A 197 3.224 -20.633 -2.267 1.00 0.00 H new ATOM 1172 N PHE A 198 2.953 -17.841 -1.441 1.00 0.00 N ATOM 1173 CA PHE A 198 2.155 -17.059 -2.378 1.00 0.00 C ATOM 1174 C PHE A 198 2.347 -17.552 -3.809 1.00 0.00 C ATOM 1175 O PHE A 198 3.415 -17.378 -4.398 1.00 0.00 O ATOM 1176 CB PHE A 198 2.522 -15.576 -2.284 1.00 0.00 C ATOM 1177 CG PHE A 198 2.131 -14.939 -0.980 1.00 0.00 C ATOM 1178 CD1 PHE A 198 0.796 -14.811 -0.627 1.00 0.00 C ATOM 1179 CD2 PHE A 198 3.098 -14.467 -0.105 1.00 0.00 C ATOM 1180 CE1 PHE A 198 0.434 -14.225 0.571 1.00 0.00 C ATOM 1181 CE2 PHE A 198 2.741 -13.879 1.094 1.00 0.00 C ATOM 1182 CZ PHE A 198 1.407 -13.759 1.432 1.00 0.00 C ATOM 0 H PHE A 198 3.940 -17.585 -1.410 1.00 0.00 H new ATOM 0 HA PHE A 198 1.106 -17.185 -2.109 1.00 0.00 H new ATOM 0 HB2 PHE A 198 3.598 -15.467 -2.423 1.00 0.00 H new ATOM 0 HB3 PHE A 198 2.039 -15.039 -3.100 1.00 0.00 H new ATOM 0 HD1 PHE A 198 0.030 -15.174 -1.296 1.00 0.00 H new ATOM 0 HD2 PHE A 198 4.142 -14.560 -0.364 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -0.609 -14.132 0.833 1.00 0.00 H new ATOM 0 HE2 PHE A 198 3.504 -13.514 1.766 1.00 0.00 H new ATOM 0 HZ PHE A 198 1.126 -13.301 2.369 1.00 0.00 H new ATOM 1192 N THR A 199 1.303 -18.158 -4.364 1.00 0.00 N ATOM 1193 CA THR A 199 1.348 -18.669 -5.728 1.00 0.00 C ATOM 1194 C THR A 199 0.748 -17.659 -6.702 1.00 0.00 C ATOM 1195 O THR A 199 0.525 -16.502 -6.346 1.00 0.00 O ATOM 1196 CB THR A 199 0.591 -20.005 -5.855 1.00 0.00 C ATOM 1197 OG1 THR A 199 0.373 -20.571 -4.558 1.00 0.00 O ATOM 1198 CG2 THR A 199 1.370 -20.988 -6.717 1.00 0.00 C ATOM 0 H THR A 199 0.413 -18.307 -3.888 1.00 0.00 H new ATOM 0 HA THR A 199 2.397 -18.836 -5.975 1.00 0.00 H new ATOM 0 HB THR A 199 -0.370 -19.808 -6.331 1.00 0.00 H new ATOM 0 HG1 THR A 199 -0.110 -21.419 -4.648 1.00 0.00 H new ATOM 0 HG21 THR A 199 0.816 -21.924 -6.792 1.00 0.00 H new ATOM 0 HG22 THR A 199 1.509 -20.568 -7.713 1.00 0.00 H new ATOM 0 HG23 THR A 199 2.343 -21.178 -6.264 1.00 0.00 H new ATOM 1206 N LYS A 200 0.489 -18.101 -7.929 1.00 0.00 N ATOM 1207 CA LYS A 200 -0.087 -17.230 -8.948 1.00 0.00 C ATOM 1208 C LYS A 200 -1.427 -16.665 -8.490 1.00 0.00 C ATOM 1209 O LYS A 200 -1.665 -15.462 -8.573 1.00 0.00 O ATOM 1210 CB LYS A 200 -0.265 -17.987 -10.263 1.00 0.00 C ATOM 1211 CG LYS A 200 0.454 -17.340 -11.437 1.00 0.00 C ATOM 1212 CD LYS A 200 -0.480 -16.446 -12.236 1.00 0.00 C ATOM 1213 CE LYS A 200 0.262 -15.710 -13.340 1.00 0.00 C ATOM 1214 NZ LYS A 200 -0.101 -14.268 -13.389 1.00 0.00 N ATOM 0 H LYS A 200 0.668 -19.055 -8.241 1.00 0.00 H new ATOM 0 HA LYS A 200 0.603 -16.401 -9.107 1.00 0.00 H new ATOM 0 HB2 LYS A 200 0.102 -19.006 -10.139 1.00 0.00 H new ATOM 0 HB3 LYS A 200 -1.328 -18.057 -10.492 1.00 0.00 H new ATOM 0 HG2 LYS A 200 1.297 -16.753 -11.071 1.00 0.00 H new ATOM 0 HG3 LYS A 200 0.863 -18.114 -12.086 1.00 0.00 H new ATOM 0 HD2 LYS A 200 -1.278 -17.048 -12.671 1.00 0.00 H new ATOM 0 HD3 LYS A 200 -0.953 -15.724 -11.570 1.00 0.00 H new ATOM 0 HE2 LYS A 200 1.336 -15.808 -13.183 1.00 0.00 H new ATOM 0 HE3 LYS A 200 0.036 -16.174 -14.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 200 0.427 -13.803 -14.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 200 -1.122 -14.173 -13.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 200 0.138 -13.819 -12.482 1.00 0.00 H new ATOM 1228 N THR A 201 -2.302 -17.542 -8.009 1.00 0.00 N ATOM 1229 CA THR A 201 -3.615 -17.122 -7.540 1.00 0.00 C ATOM 1230 C THR A 201 -3.508 -16.295 -6.264 1.00 0.00 C ATOM 1231 O THR A 201 -4.374 -15.470 -5.975 1.00 0.00 O ATOM 1232 CB THR A 201 -4.540 -18.324 -7.285 1.00 0.00 C ATOM 1233 OG1 THR A 201 -4.456 -19.250 -8.377 1.00 0.00 O ATOM 1234 CG2 THR A 201 -5.979 -17.863 -7.114 1.00 0.00 C ATOM 0 H THR A 201 -2.126 -18.544 -7.934 1.00 0.00 H new ATOM 0 HA THR A 201 -4.046 -16.509 -8.332 1.00 0.00 H new ATOM 0 HB THR A 201 -4.218 -18.818 -6.368 1.00 0.00 H new ATOM 0 HG1 THR A 201 -5.047 -20.013 -8.205 1.00 0.00 H new ATOM 0 HG21 THR A 201 -6.619 -18.727 -6.934 1.00 0.00 H new ATOM 0 HG22 THR A 201 -6.044 -17.181 -6.266 1.00 0.00 H new ATOM 0 HG23 THR A 201 -6.307 -17.350 -8.018 1.00 0.00 H new ATOM 1242 N ASP A 202 -2.443 -16.517 -5.501 1.00 0.00 N ATOM 1243 CA ASP A 202 -2.235 -15.782 -4.259 1.00 0.00 C ATOM 1244 C ASP A 202 -1.993 -14.306 -4.545 1.00 0.00 C ATOM 1245 O ASP A 202 -2.591 -13.436 -3.911 1.00 0.00 O ATOM 1246 CB ASP A 202 -1.053 -16.362 -3.482 1.00 0.00 C ATOM 1247 CG ASP A 202 -1.470 -17.471 -2.535 1.00 0.00 C ATOM 1248 OD1 ASP A 202 -1.667 -18.611 -3.007 1.00 0.00 O ATOM 1249 OD2 ASP A 202 -1.600 -17.200 -1.323 1.00 0.00 O ATOM 0 H ASP A 202 -1.714 -17.196 -5.719 1.00 0.00 H new ATOM 0 HA ASP A 202 -3.136 -15.880 -3.653 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -0.314 -16.747 -4.185 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -0.569 -15.567 -2.915 1.00 0.00 H new ATOM 1254 N VAL A 203 -1.117 -14.030 -5.506 1.00 0.00 N ATOM 1255 CA VAL A 203 -0.805 -12.657 -5.876 1.00 0.00 C ATOM 1256 C VAL A 203 -2.003 -11.982 -6.535 1.00 0.00 C ATOM 1257 O VAL A 203 -2.156 -10.764 -6.456 1.00 0.00 O ATOM 1258 CB VAL A 203 0.415 -12.582 -6.817 1.00 0.00 C ATOM 1259 CG1 VAL A 203 1.600 -13.321 -6.212 1.00 0.00 C ATOM 1260 CG2 VAL A 203 0.081 -13.141 -8.192 1.00 0.00 C ATOM 0 H VAL A 203 -0.613 -14.738 -6.040 1.00 0.00 H new ATOM 0 HA VAL A 203 -0.561 -12.129 -4.954 1.00 0.00 H new ATOM 0 HB VAL A 203 0.685 -11.533 -6.938 1.00 0.00 H new ATOM 0 HG11 VAL A 203 2.452 -13.258 -6.889 1.00 0.00 H new ATOM 0 HG12 VAL A 203 1.862 -12.868 -5.256 1.00 0.00 H new ATOM 0 HG13 VAL A 203 1.336 -14.367 -6.057 1.00 0.00 H new ATOM 0 HG21 VAL A 203 0.959 -13.076 -8.834 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -0.222 -14.184 -8.097 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -0.734 -12.565 -8.631 1.00 0.00 H new ATOM 1270 N LYS A 204 -2.858 -12.780 -7.178 1.00 0.00 N ATOM 1271 CA LYS A 204 -4.045 -12.243 -7.832 1.00 0.00 C ATOM 1272 C LYS A 204 -4.966 -11.586 -6.804 1.00 0.00 C ATOM 1273 O LYS A 204 -5.372 -10.433 -6.968 1.00 0.00 O ATOM 1274 CB LYS A 204 -4.763 -13.331 -8.636 1.00 0.00 C ATOM 1275 CG LYS A 204 -5.970 -13.930 -7.957 1.00 0.00 C ATOM 1276 CD LYS A 204 -7.263 -13.273 -8.408 1.00 0.00 C ATOM 1277 CE LYS A 204 -8.161 -14.254 -9.142 1.00 0.00 C ATOM 1278 NZ LYS A 204 -8.551 -13.752 -10.489 1.00 0.00 N ATOM 0 H LYS A 204 -2.749 -13.791 -7.258 1.00 0.00 H new ATOM 0 HA LYS A 204 -3.740 -11.472 -8.540 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -5.074 -12.910 -9.592 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -4.053 -14.129 -8.854 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -6.013 -14.998 -8.170 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -5.868 -13.825 -6.877 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -7.791 -12.874 -7.542 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -7.035 -12.429 -9.059 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -7.646 -15.209 -9.246 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -9.058 -14.438 -8.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -9.163 -14.451 -10.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -9.065 -12.853 -10.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -7.697 -13.601 -11.064 1.00 0.00 H new ATOM 1292 N MET A 205 -5.271 -12.314 -5.731 1.00 0.00 N ATOM 1293 CA MET A 205 -6.115 -11.787 -4.672 1.00 0.00 C ATOM 1294 C MET A 205 -5.373 -10.690 -3.927 1.00 0.00 C ATOM 1295 O MET A 205 -5.966 -9.702 -3.504 1.00 0.00 O ATOM 1296 CB MET A 205 -6.530 -12.898 -3.704 1.00 0.00 C ATOM 1297 CG MET A 205 -6.723 -14.249 -4.375 1.00 0.00 C ATOM 1298 SD MET A 205 -7.601 -15.427 -3.330 1.00 0.00 S ATOM 1299 CE MET A 205 -8.800 -16.080 -4.490 1.00 0.00 C ATOM 0 H MET A 205 -4.945 -13.268 -5.577 1.00 0.00 H new ATOM 0 HA MET A 205 -7.019 -11.372 -5.118 1.00 0.00 H new ATOM 0 HB2 MET A 205 -5.772 -12.993 -2.926 1.00 0.00 H new ATOM 0 HB3 MET A 205 -7.459 -12.611 -3.211 1.00 0.00 H new ATOM 0 HG2 MET A 205 -7.275 -14.113 -5.305 1.00 0.00 H new ATOM 0 HG3 MET A 205 -5.749 -14.661 -4.640 1.00 0.00 H new ATOM 0 HE1 MET A 205 -9.589 -16.598 -3.945 1.00 0.00 H new ATOM 0 HE2 MET A 205 -9.233 -15.262 -5.065 1.00 0.00 H new ATOM 0 HE3 MET A 205 -8.308 -16.779 -5.167 1.00 0.00 H new ATOM 1309 N MET A 206 -4.063 -10.874 -3.784 1.00 0.00 N ATOM 1310 CA MET A 206 -3.218 -9.903 -3.103 1.00 0.00 C ATOM 1311 C MET A 206 -3.327 -8.538 -3.768 1.00 0.00 C ATOM 1312 O MET A 206 -3.386 -7.514 -3.096 1.00 0.00 O ATOM 1313 CB MET A 206 -1.761 -10.366 -3.115 1.00 0.00 C ATOM 1314 CG MET A 206 -1.389 -11.249 -1.936 1.00 0.00 C ATOM 1315 SD MET A 206 0.332 -11.055 -1.436 1.00 0.00 S ATOM 1316 CE MET A 206 1.178 -11.418 -2.972 1.00 0.00 C ATOM 0 H MET A 206 -3.564 -11.692 -4.133 1.00 0.00 H new ATOM 0 HA MET A 206 -3.559 -9.820 -2.071 1.00 0.00 H new ATOM 0 HB2 MET A 206 -1.570 -10.911 -4.040 1.00 0.00 H new ATOM 0 HB3 MET A 206 -1.111 -9.491 -3.121 1.00 0.00 H new ATOM 0 HG2 MET A 206 -2.037 -11.013 -1.092 1.00 0.00 H new ATOM 0 HG3 MET A 206 -1.572 -12.292 -2.196 1.00 0.00 H new ATOM 0 HE1 MET A 206 2.243 -11.218 -2.857 1.00 0.00 H new ATOM 0 HE2 MET A 206 1.031 -12.467 -3.229 1.00 0.00 H new ATOM 0 HE3 MET A 206 0.775 -10.790 -3.766 1.00 0.00 H new ATOM 1326 N GLU A 207 -3.351 -8.537 -5.097 1.00 0.00 N ATOM 1327 CA GLU A 207 -3.452 -7.300 -5.861 1.00 0.00 C ATOM 1328 C GLU A 207 -4.742 -6.554 -5.526 1.00 0.00 C ATOM 1329 O GLU A 207 -4.747 -5.330 -5.389 1.00 0.00 O ATOM 1330 CB GLU A 207 -3.400 -7.602 -7.360 1.00 0.00 C ATOM 1331 CG GLU A 207 -1.992 -7.594 -7.935 1.00 0.00 C ATOM 1332 CD GLU A 207 -1.980 -7.558 -9.451 1.00 0.00 C ATOM 1333 OE1 GLU A 207 -2.862 -8.193 -10.067 1.00 0.00 O ATOM 1334 OE2 GLU A 207 -1.088 -6.896 -10.022 1.00 0.00 O ATOM 0 H GLU A 207 -3.302 -9.381 -5.667 1.00 0.00 H new ATOM 0 HA GLU A 207 -2.608 -6.665 -5.592 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -3.852 -8.577 -7.541 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -4.004 -6.867 -7.891 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -1.452 -6.729 -7.551 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -1.459 -8.481 -7.592 1.00 0.00 H new ATOM 1341 N ARG A 208 -5.834 -7.303 -5.410 1.00 0.00 N ATOM 1342 CA ARG A 208 -7.141 -6.724 -5.107 1.00 0.00 C ATOM 1343 C ARG A 208 -7.246 -6.273 -3.650 1.00 0.00 C ATOM 1344 O ARG A 208 -7.746 -5.187 -3.362 1.00 0.00 O ATOM 1345 CB ARG A 208 -8.239 -7.743 -5.405 1.00 0.00 C ATOM 1346 CG ARG A 208 -8.179 -8.307 -6.814 1.00 0.00 C ATOM 1347 CD ARG A 208 -8.912 -7.417 -7.803 1.00 0.00 C ATOM 1348 NE ARG A 208 -9.336 -8.153 -8.991 1.00 0.00 N ATOM 1349 CZ ARG A 208 -10.117 -7.641 -9.937 1.00 0.00 C ATOM 1350 NH1 ARG A 208 -10.558 -6.393 -9.835 1.00 0.00 N ATOM 1351 NH2 ARG A 208 -10.460 -8.376 -10.986 1.00 0.00 N ATOM 0 H ARG A 208 -5.841 -8.317 -5.522 1.00 0.00 H new ATOM 0 HA ARG A 208 -7.263 -5.844 -5.738 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -8.165 -8.563 -4.691 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -9.211 -7.273 -5.252 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -7.138 -8.413 -7.120 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -8.618 -9.305 -6.826 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -9.784 -6.978 -7.318 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -8.263 -6.593 -8.099 1.00 0.00 H new ATOM 0 HE ARG A 208 -9.015 -9.115 -9.101 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -10.298 -5.824 -9.029 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -11.157 -6.003 -10.562 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -10.125 -9.336 -11.068 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -11.059 -7.982 -11.711 1.00 0.00 H new ATOM 1365 N VAL A 209 -6.792 -7.126 -2.739 1.00 0.00 N ATOM 1366 CA VAL A 209 -6.852 -6.836 -1.307 1.00 0.00 C ATOM 1367 C VAL A 209 -5.913 -5.702 -0.919 1.00 0.00 C ATOM 1368 O VAL A 209 -6.240 -4.882 -0.061 1.00 0.00 O ATOM 1369 CB VAL A 209 -6.501 -8.085 -0.478 1.00 0.00 C ATOM 1370 CG1 VAL A 209 -6.637 -7.808 1.010 1.00 0.00 C ATOM 1371 CG2 VAL A 209 -7.382 -9.251 -0.889 1.00 0.00 C ATOM 0 H VAL A 209 -6.376 -8.029 -2.966 1.00 0.00 H new ATOM 0 HA VAL A 209 -7.876 -6.530 -1.092 1.00 0.00 H new ATOM 0 HB VAL A 209 -5.461 -8.346 -0.675 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -6.383 -8.707 1.572 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -5.962 -7.000 1.293 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -7.664 -7.518 1.234 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -7.124 -10.128 -0.296 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -8.428 -8.994 -0.721 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -7.227 -9.469 -1.946 1.00 0.00 H new ATOM 1381 N VAL A 210 -4.749 -5.657 -1.550 1.00 0.00 N ATOM 1382 CA VAL A 210 -3.774 -4.618 -1.260 1.00 0.00 C ATOM 1383 C VAL A 210 -4.264 -3.270 -1.774 1.00 0.00 C ATOM 1384 O VAL A 210 -4.085 -2.247 -1.117 1.00 0.00 O ATOM 1385 CB VAL A 210 -2.395 -4.944 -1.876 1.00 0.00 C ATOM 1386 CG1 VAL A 210 -1.515 -3.703 -1.943 1.00 0.00 C ATOM 1387 CG2 VAL A 210 -1.707 -6.044 -1.083 1.00 0.00 C ATOM 0 H VAL A 210 -4.458 -6.325 -2.263 1.00 0.00 H new ATOM 0 HA VAL A 210 -3.659 -4.571 -0.177 1.00 0.00 H new ATOM 0 HB VAL A 210 -2.555 -5.296 -2.895 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -0.551 -3.963 -2.381 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -2.000 -2.946 -2.559 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -1.363 -3.310 -0.938 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -0.737 -6.262 -1.530 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -1.567 -5.717 -0.053 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -2.323 -6.943 -1.097 1.00 0.00 H new ATOM 1397 N GLU A 211 -4.892 -3.279 -2.947 1.00 0.00 N ATOM 1398 CA GLU A 211 -5.415 -2.053 -3.540 1.00 0.00 C ATOM 1399 C GLU A 211 -6.370 -1.361 -2.567 1.00 0.00 C ATOM 1400 O GLU A 211 -6.343 -0.140 -2.419 1.00 0.00 O ATOM 1401 CB GLU A 211 -6.110 -2.363 -4.877 1.00 0.00 C ATOM 1402 CG GLU A 211 -7.613 -2.117 -4.886 1.00 0.00 C ATOM 1403 CD GLU A 211 -8.176 -1.967 -6.286 1.00 0.00 C ATOM 1404 OE1 GLU A 211 -7.422 -2.190 -7.258 1.00 0.00 O ATOM 1405 OE2 GLU A 211 -9.370 -1.624 -6.412 1.00 0.00 O ATOM 0 H GLU A 211 -5.050 -4.119 -3.504 1.00 0.00 H new ATOM 0 HA GLU A 211 -4.587 -1.373 -3.740 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -5.652 -1.756 -5.658 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -5.925 -3.406 -5.134 1.00 0.00 H new ATOM 0 HG2 GLU A 211 -8.115 -2.944 -4.384 1.00 0.00 H new ATOM 0 HG3 GLU A 211 -7.832 -1.216 -4.313 1.00 0.00 H new ATOM 1412 N GLN A 212 -7.203 -2.156 -1.898 1.00 0.00 N ATOM 1413 CA GLN A 212 -8.155 -1.625 -0.930 1.00 0.00 C ATOM 1414 C GLN A 212 -7.424 -1.041 0.274 1.00 0.00 C ATOM 1415 O GLN A 212 -7.736 0.058 0.733 1.00 0.00 O ATOM 1416 CB GLN A 212 -9.118 -2.721 -0.470 1.00 0.00 C ATOM 1417 CG GLN A 212 -9.621 -3.608 -1.597 1.00 0.00 C ATOM 1418 CD GLN A 212 -11.131 -3.583 -1.728 1.00 0.00 C ATOM 1419 OE1 GLN A 212 -11.807 -4.401 -0.930 1.00 0.00 O flip ATOM 1420 NE2 GLN A 212 -11.684 -2.837 -2.537 1.00 0.00 N flip ATOM 0 H GLN A 212 -7.236 -3.169 -2.010 1.00 0.00 H new ATOM 0 HA GLN A 212 -8.726 -0.833 -1.414 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -8.618 -3.342 0.273 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -9.972 -2.258 0.024 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -9.173 -3.285 -2.537 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -9.292 -4.632 -1.423 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -11.125 -2.225 -3.131 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -12.701 -2.832 -2.613 1.00 0.00 H new ATOM 1429 N MET A 213 -6.447 -1.790 0.777 1.00 0.00 N ATOM 1430 CA MET A 213 -5.660 -1.361 1.927 1.00 0.00 C ATOM 1431 C MET A 213 -4.877 -0.093 1.606 1.00 0.00 C ATOM 1432 O MET A 213 -4.603 0.719 2.491 1.00 0.00 O ATOM 1433 CB MET A 213 -4.703 -2.473 2.356 1.00 0.00 C ATOM 1434 CG MET A 213 -5.388 -3.615 3.087 1.00 0.00 C ATOM 1435 SD MET A 213 -4.219 -4.714 3.908 1.00 0.00 S ATOM 1436 CE MET A 213 -3.653 -5.704 2.527 1.00 0.00 C ATOM 0 H MET A 213 -6.181 -2.701 0.404 1.00 0.00 H new ATOM 0 HA MET A 213 -6.345 -1.144 2.747 1.00 0.00 H new ATOM 0 HB2 MET A 213 -4.199 -2.868 1.474 1.00 0.00 H new ATOM 0 HB3 MET A 213 -3.933 -2.050 3.001 1.00 0.00 H new ATOM 0 HG2 MET A 213 -6.077 -3.207 3.826 1.00 0.00 H new ATOM 0 HG3 MET A 213 -5.984 -4.189 2.378 1.00 0.00 H new ATOM 0 HE1 MET A 213 -3.738 -6.761 2.778 1.00 0.00 H new ATOM 0 HE2 MET A 213 -4.264 -5.489 1.651 1.00 0.00 H new ATOM 0 HE3 MET A 213 -2.612 -5.465 2.311 1.00 0.00 H new ATOM 1446 N CYS A 214 -4.525 0.077 0.334 1.00 0.00 N ATOM 1447 CA CYS A 214 -3.783 1.253 -0.100 1.00 0.00 C ATOM 1448 C CYS A 214 -4.680 2.483 -0.053 1.00 0.00 C ATOM 1449 O CYS A 214 -4.239 3.574 0.306 1.00 0.00 O ATOM 1450 CB CYS A 214 -3.236 1.054 -1.515 1.00 0.00 C ATOM 1451 SG CYS A 214 -2.004 -0.282 -1.659 1.00 0.00 S ATOM 0 H CYS A 214 -4.742 -0.585 -0.411 1.00 0.00 H new ATOM 0 HA CYS A 214 -2.942 1.400 0.577 1.00 0.00 H new ATOM 0 HB2 CYS A 214 -4.067 0.840 -2.187 1.00 0.00 H new ATOM 0 HB3 CYS A 214 -2.785 1.987 -1.853 1.00 0.00 H new ATOM 1456 N ILE A 215 -5.951 2.289 -0.400 1.00 0.00 N ATOM 1457 CA ILE A 215 -6.922 3.374 -0.379 1.00 0.00 C ATOM 1458 C ILE A 215 -7.096 3.884 1.043 1.00 0.00 C ATOM 1459 O ILE A 215 -7.130 5.090 1.284 1.00 0.00 O ATOM 1460 CB ILE A 215 -8.290 2.921 -0.929 1.00 0.00 C ATOM 1461 CG1 ILE A 215 -8.172 2.550 -2.409 1.00 0.00 C ATOM 1462 CG2 ILE A 215 -9.336 4.008 -0.731 1.00 0.00 C ATOM 1463 CD1 ILE A 215 -9.145 1.474 -2.841 1.00 0.00 C ATOM 0 H ILE A 215 -6.329 1.390 -0.698 1.00 0.00 H new ATOM 0 HA ILE A 215 -6.543 4.171 -1.018 1.00 0.00 H new ATOM 0 HB ILE A 215 -8.609 2.038 -0.375 1.00 0.00 H new ATOM 0 HG12 ILE A 215 -8.337 3.442 -3.013 1.00 0.00 H new ATOM 0 HG13 ILE A 215 -7.156 2.212 -2.611 1.00 0.00 H new ATOM 0 HG21 ILE A 215 -10.293 3.668 -1.126 1.00 0.00 H new ATOM 0 HG22 ILE A 215 -9.438 4.225 0.332 1.00 0.00 H new ATOM 0 HG23 ILE A 215 -9.027 4.911 -1.257 1.00 0.00 H new ATOM 0 HD11 ILE A 215 -9.005 1.261 -3.901 1.00 0.00 H new ATOM 0 HD12 ILE A 215 -8.966 0.568 -2.262 1.00 0.00 H new ATOM 0 HD13 ILE A 215 -10.166 1.817 -2.671 1.00 0.00 H new ATOM 1475 N THR A 216 -7.190 2.948 1.983 1.00 0.00 N ATOM 1476 CA THR A 216 -7.340 3.287 3.388 1.00 0.00 C ATOM 1477 C THR A 216 -6.189 4.180 3.838 1.00 0.00 C ATOM 1478 O THR A 216 -6.384 5.133 4.591 1.00 0.00 O ATOM 1479 CB THR A 216 -7.387 2.020 4.267 1.00 0.00 C ATOM 1480 OG1 THR A 216 -8.610 1.311 4.037 1.00 0.00 O ATOM 1481 CG2 THR A 216 -7.271 2.367 5.746 1.00 0.00 C ATOM 0 H THR A 216 -7.164 1.946 1.793 1.00 0.00 H new ATOM 0 HA THR A 216 -8.283 3.821 3.504 1.00 0.00 H new ATOM 0 HB THR A 216 -6.539 1.392 3.994 1.00 0.00 H new ATOM 0 HG1 THR A 216 -8.632 0.507 4.597 1.00 0.00 H new ATOM 0 HG21 THR A 216 -7.307 1.453 6.338 1.00 0.00 H new ATOM 0 HG22 THR A 216 -6.326 2.879 5.927 1.00 0.00 H new ATOM 0 HG23 THR A 216 -8.097 3.018 6.033 1.00 0.00 H new ATOM 1489 N GLN A 217 -4.988 3.865 3.357 1.00 0.00 N ATOM 1490 CA GLN A 217 -3.800 4.638 3.695 1.00 0.00 C ATOM 1491 C GLN A 217 -3.876 6.032 3.084 1.00 0.00 C ATOM 1492 O GLN A 217 -3.412 7.006 3.676 1.00 0.00 O ATOM 1493 CB GLN A 217 -2.541 3.921 3.203 1.00 0.00 C ATOM 1494 CG GLN A 217 -1.441 3.836 4.249 1.00 0.00 C ATOM 1495 CD GLN A 217 -1.775 2.875 5.374 1.00 0.00 C ATOM 1496 OE1 GLN A 217 -2.487 1.803 5.048 1.00 0.00 O flip ATOM 1497 NE2 GLN A 217 -1.396 3.095 6.524 1.00 0.00 N flip ATOM 0 H GLN A 217 -4.814 3.078 2.731 1.00 0.00 H new ATOM 0 HA GLN A 217 -3.752 4.734 4.780 1.00 0.00 H new ATOM 0 HB2 GLN A 217 -2.808 2.913 2.886 1.00 0.00 H new ATOM 0 HB3 GLN A 217 -2.157 4.440 2.325 1.00 0.00 H new ATOM 0 HG2 GLN A 217 -0.514 3.520 3.770 1.00 0.00 H new ATOM 0 HG3 GLN A 217 -1.263 4.828 4.665 1.00 0.00 H new ATOM 0 HE21 GLN A 217 -0.851 3.932 6.730 1.00 0.00 H new ATOM 0 HE22 GLN A 217 -1.627 2.440 7.271 1.00 0.00 H new ATOM 1506 N TYR A 218 -4.473 6.121 1.897 1.00 0.00 N ATOM 1507 CA TYR A 218 -4.619 7.400 1.213 1.00 0.00 C ATOM 1508 C TYR A 218 -5.413 8.368 2.079 1.00 0.00 C ATOM 1509 O TYR A 218 -5.086 9.550 2.171 1.00 0.00 O ATOM 1510 CB TYR A 218 -5.313 7.206 -0.140 1.00 0.00 C ATOM 1511 CG TYR A 218 -5.757 8.499 -0.791 1.00 0.00 C ATOM 1512 CD1 TYR A 218 -4.843 9.326 -1.432 1.00 0.00 C ATOM 1513 CD2 TYR A 218 -7.090 8.891 -0.763 1.00 0.00 C ATOM 1514 CE1 TYR A 218 -5.245 10.507 -2.027 1.00 0.00 C ATOM 1515 CE2 TYR A 218 -7.499 10.069 -1.356 1.00 0.00 C ATOM 1516 CZ TYR A 218 -6.573 10.874 -1.987 1.00 0.00 C ATOM 1517 OH TYR A 218 -6.978 12.049 -2.578 1.00 0.00 O ATOM 0 H TYR A 218 -4.862 5.324 1.392 1.00 0.00 H new ATOM 0 HA TYR A 218 -3.628 7.817 1.037 1.00 0.00 H new ATOM 0 HB2 TYR A 218 -4.634 6.685 -0.815 1.00 0.00 H new ATOM 0 HB3 TYR A 218 -6.182 6.562 -0.003 1.00 0.00 H new ATOM 0 HD1 TYR A 218 -3.802 9.042 -1.466 1.00 0.00 H new ATOM 0 HD2 TYR A 218 -7.818 8.264 -0.269 1.00 0.00 H new ATOM 0 HE1 TYR A 218 -4.522 11.139 -2.521 1.00 0.00 H new ATOM 0 HE2 TYR A 218 -8.539 10.359 -1.326 1.00 0.00 H new ATOM 0 HH TYR A 218 -7.945 12.158 -2.460 1.00 0.00 H new ATOM 1527 N GLU A 219 -6.453 7.847 2.724 1.00 0.00 N ATOM 1528 CA GLU A 219 -7.291 8.654 3.599 1.00 0.00 C ATOM 1529 C GLU A 219 -6.544 8.982 4.886 1.00 0.00 C ATOM 1530 O GLU A 219 -6.775 10.021 5.503 1.00 0.00 O ATOM 1531 CB GLU A 219 -8.593 7.915 3.918 1.00 0.00 C ATOM 1532 CG GLU A 219 -9.585 7.905 2.766 1.00 0.00 C ATOM 1533 CD GLU A 219 -10.497 9.116 2.771 1.00 0.00 C ATOM 1534 OE1 GLU A 219 -9.978 10.250 2.856 1.00 0.00 O ATOM 1535 OE2 GLU A 219 -11.729 8.932 2.690 1.00 0.00 O ATOM 0 H GLU A 219 -6.734 6.869 2.656 1.00 0.00 H new ATOM 0 HA GLU A 219 -7.535 9.585 3.087 1.00 0.00 H new ATOM 0 HB2 GLU A 219 -8.359 6.887 4.194 1.00 0.00 H new ATOM 0 HB3 GLU A 219 -9.061 8.379 4.786 1.00 0.00 H new ATOM 0 HG2 GLU A 219 -9.040 7.869 1.823 1.00 0.00 H new ATOM 0 HG3 GLU A 219 -10.189 6.999 2.820 1.00 0.00 H new ATOM 1542 N ARG A 220 -5.638 8.088 5.275 1.00 0.00 N ATOM 1543 CA ARG A 220 -4.841 8.279 6.481 1.00 0.00 C ATOM 1544 C ARG A 220 -3.953 9.510 6.341 1.00 0.00 C ATOM 1545 O ARG A 220 -3.808 10.296 7.277 1.00 0.00 O ATOM 1546 CB ARG A 220 -3.978 7.044 6.752 1.00 0.00 C ATOM 1547 CG ARG A 220 -4.779 5.812 7.141 1.00 0.00 C ATOM 1548 CD ARG A 220 -3.871 4.673 7.573 1.00 0.00 C ATOM 1549 NE ARG A 220 -4.565 3.388 7.571 1.00 0.00 N ATOM 1550 CZ ARG A 220 -4.846 2.698 8.672 1.00 0.00 C ATOM 1551 NH1 ARG A 220 -4.496 3.166 9.862 1.00 0.00 N ATOM 1552 NH2 ARG A 220 -5.480 1.537 8.582 1.00 0.00 N ATOM 0 H ARG A 220 -5.438 7.224 4.771 1.00 0.00 H new ATOM 0 HA ARG A 220 -5.520 8.426 7.321 1.00 0.00 H new ATOM 0 HB2 ARG A 220 -3.392 6.819 5.861 1.00 0.00 H new ATOM 0 HB3 ARG A 220 -3.271 7.274 7.549 1.00 0.00 H new ATOM 0 HG2 ARG A 220 -5.462 6.062 7.952 1.00 0.00 H new ATOM 0 HG3 ARG A 220 -5.390 5.492 6.297 1.00 0.00 H new ATOM 0 HD2 ARG A 220 -3.011 4.622 6.905 1.00 0.00 H new ATOM 0 HD3 ARG A 220 -3.486 4.875 8.573 1.00 0.00 H new ATOM 0 HE ARG A 220 -4.851 2.997 6.673 1.00 0.00 H new ATOM 0 HH11 ARG A 220 -4.009 4.059 9.936 1.00 0.00 H new ATOM 0 HH12 ARG A 220 -4.714 2.633 10.704 1.00 0.00 H new ATOM 0 HH21 ARG A 220 -5.752 1.174 7.668 1.00 0.00 H new ATOM 0 HH22 ARG A 220 -5.696 1.007 9.426 1.00 0.00 H new ATOM 1566 N GLU A 221 -3.364 9.668 5.159 1.00 0.00 N ATOM 1567 CA GLU A 221 -2.491 10.801 4.880 1.00 0.00 C ATOM 1568 C GLU A 221 -3.310 12.018 4.462 1.00 0.00 C ATOM 1569 O GLU A 221 -2.838 13.153 4.537 1.00 0.00 O ATOM 1570 CB GLU A 221 -1.489 10.442 3.782 1.00 0.00 C ATOM 1571 CG GLU A 221 -0.277 9.674 4.286 1.00 0.00 C ATOM 1572 CD GLU A 221 -0.654 8.425 5.059 1.00 0.00 C ATOM 1573 OE1 GLU A 221 -0.839 7.367 4.423 1.00 0.00 O ATOM 1574 OE2 GLU A 221 -0.764 8.505 6.301 1.00 0.00 O ATOM 0 H GLU A 221 -3.477 9.022 4.377 1.00 0.00 H new ATOM 0 HA GLU A 221 -1.944 11.045 5.791 1.00 0.00 H new ATOM 0 HB2 GLU A 221 -1.995 9.847 3.022 1.00 0.00 H new ATOM 0 HB3 GLU A 221 -1.151 11.358 3.297 1.00 0.00 H new ATOM 0 HG2 GLU A 221 0.350 9.396 3.439 1.00 0.00 H new ATOM 0 HG3 GLU A 221 0.320 10.325 4.925 1.00 0.00 H new ATOM 1581 N SER A 222 -4.540 11.769 4.024 1.00 0.00 N ATOM 1582 CA SER A 222 -5.432 12.841 3.595 1.00 0.00 C ATOM 1583 C SER A 222 -5.912 13.652 4.793 1.00 0.00 C ATOM 1584 O SER A 222 -6.183 14.846 4.679 1.00 0.00 O ATOM 1585 CB SER A 222 -6.630 12.264 2.838 1.00 0.00 C ATOM 1586 OG SER A 222 -7.742 12.087 3.699 1.00 0.00 O ATOM 0 H SER A 222 -4.942 10.834 3.957 1.00 0.00 H new ATOM 0 HA SER A 222 -4.878 13.502 2.928 1.00 0.00 H new ATOM 0 HB2 SER A 222 -6.902 12.931 2.020 1.00 0.00 H new ATOM 0 HB3 SER A 222 -6.356 11.308 2.392 1.00 0.00 H new ATOM 0 HG SER A 222 -7.528 11.410 4.375 1.00 0.00 H new