USER MOD reduce.3.24.130724 H: found=0, std=0, add=807, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 805 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 199 THR OG1 : rot -97:sc= 1.56 USER MOD Set 1.2: A 201 THR OG1 : rot 180:sc= 0.033 USER MOD Set 2.1: A 188 THR OG1 : rot 95:sc= 1.28 USER MOD Set 2.2: A 206 MET CE :methyl 172:sc= -0.0022 (180deg=-0.163) USER MOD Set 3.1: A 186 GLN : amide:sc= -0.459 X(o=-0.46,f=-0.74) USER MOD Set 3.2: A 190 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 177 HIS :FLIP no HD1:sc= -0.0115 F(o=-0.64,f=-0.065) USER MOD Set 4.2: A 181 ASN : amide:sc= -0.0531 K(o=-0.065,f=-1.4!) USER MOD Set 5.1: A 163 TYR OH : rot -177:sc= 0.601 USER MOD Set 5.2: A 217 GLN : amide:sc= -0.0311 K(o=0.57,f=-1.9) USER MOD Set 6.1: A 153 ASN : amide:sc= 0.0764 K(o=0.62,f=-0.33) USER MOD Set 6.2: A 157 TYR OH : rot 85:sc= 0.543 USER MOD Set 7.1: A 138 MET CE :methyl -123:sc= -1.26 (180deg=-2.1!) USER MOD Set 7.2: A 154 MET CE :methyl 170:sc= -0.839 (180deg=-0.423) USER MOD Single : A 128 TYR OH : rot -127:sc= 1.23 USER MOD Single : A 129 MET CE :methyl -146:sc= -2.39! (180deg=-5.28!) USER MOD Single : A 132 SER OG : rot 180:sc= 0.0742 USER MOD Single : A 134 MET CE :methyl -177:sc= -0.034 (180deg=-0.0396) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 143 ASN : amide:sc= 0.355 K(o=0.36,f=-0.62) USER MOD Single : A 149 TYR OH : rot -174:sc= 1.27 USER MOD Single : A 150 TYR OH : rot 152:sc= 0.568 USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 159 ASN : amide:sc= -0.0638 K(o=-0.064,f=-1.3) USER MOD Single : A 160 GLN : amide:sc= 1.23 K(o=1.2,f=-0.0027) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= -0.408 X(o=-0.41,f=-0.031) USER MOD Single : A 170 SER OG : rot 180:sc= 0 USER MOD Single : A 171 ASN : amide:sc= -0.365 K(o=-0.36,f=-2.1) USER MOD Single : A 172 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 174 ASN : amide:sc= -1.18 K(o=-1.2,f=-5.9!) USER MOD Single : A 183 THR OG1 : rot 81:sc= 0.373 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 187 HIS : no HD1:sc= -0.279 X(o=-0.28,f=-0.016) USER MOD Single : A 191 THR OG1 : rot 90:sc= 0 USER MOD Single : A 192 THR OG1 : rot 67:sc= 1.25 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= -0.119 X(o=-0.12,f=0) USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl 137:sc= -0.624 (180deg=-1.92) USER MOD Single : A 212 GLN : amide:sc= 0 X(o=0,f=-0.064) USER MOD Single : A 213 MET CE :methyl 172:sc= -0.218 (180deg=-0.34) USER MOD Single : A 216 THR OG1 : rot 90:sc= 1.29 USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN :FLIP amide:sc= 0 F(o=-0.72,f=0) USER MOD Single : A 220 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0912) USER MOD Single : A 222 SER OG : rot 87:sc= 0.611 USER MOD Single : A 223 GLN : amide:sc= -0.837 X(o=-0.84,f=-0.86) USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 125 8.935 -13.728 -1.131 1.00 0.00 N ATOM 66 CA LEU A 125 9.240 -12.842 -2.251 1.00 0.00 C ATOM 67 C LEU A 125 10.750 -12.875 -2.522 1.00 0.00 C ATOM 68 O LEU A 125 11.519 -13.463 -1.755 1.00 0.00 O ATOM 69 CB LEU A 125 8.699 -11.428 -1.968 1.00 0.00 C ATOM 70 CG LEU A 125 7.163 -11.324 -1.862 1.00 0.00 C ATOM 71 CD1 LEU A 125 6.708 -9.880 -1.607 1.00 0.00 C ATOM 72 CD2 LEU A 125 6.450 -11.785 -3.134 1.00 0.00 C ATOM 0 HA LEU A 125 8.743 -13.182 -3.159 1.00 0.00 H new ATOM 0 HB2 LEU A 125 9.137 -11.068 -1.037 1.00 0.00 H new ATOM 0 HB3 LEU A 125 9.039 -10.760 -2.760 1.00 0.00 H new ATOM 0 HG LEU A 125 6.898 -11.974 -1.028 1.00 0.00 H new ATOM 0 HD11 LEU A 125 5.621 -9.848 -1.539 1.00 0.00 H new ATOM 0 HD12 LEU A 125 7.141 -9.522 -0.673 1.00 0.00 H new ATOM 0 HD13 LEU A 125 7.039 -9.244 -2.428 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.372 -11.690 -3.002 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.769 -11.167 -3.974 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.700 -12.827 -3.334 1.00 0.00 H new ATOM 84 N GLY A 126 11.200 -12.215 -3.588 1.00 0.00 N ATOM 85 CA GLY A 126 12.590 -12.106 -4.019 1.00 0.00 C ATOM 86 C GLY A 126 13.383 -11.152 -3.128 1.00 0.00 C ATOM 87 O GLY A 126 13.928 -10.149 -3.594 1.00 0.00 O ATOM 0 H GLY A 126 10.566 -11.713 -4.209 1.00 0.00 H new ATOM 0 HA2 GLY A 126 13.055 -13.092 -4.002 1.00 0.00 H new ATOM 0 HA3 GLY A 126 12.625 -11.755 -5.050 1.00 0.00 H new ATOM 91 N GLY A 127 13.386 -11.418 -1.823 1.00 0.00 N ATOM 92 CA GLY A 127 14.152 -10.657 -0.848 1.00 0.00 C ATOM 93 C GLY A 127 13.595 -9.252 -0.676 1.00 0.00 C ATOM 94 O GLY A 127 14.354 -8.308 -0.445 1.00 0.00 O ATOM 0 H GLY A 127 12.847 -12.180 -1.411 1.00 0.00 H new ATOM 0 HA2 GLY A 127 14.139 -11.175 0.111 1.00 0.00 H new ATOM 0 HA3 GLY A 127 15.193 -10.601 -1.165 1.00 0.00 H new ATOM 98 N TYR A 128 12.279 -9.115 -0.829 1.00 0.00 N ATOM 99 CA TYR A 128 11.559 -7.877 -0.630 1.00 0.00 C ATOM 100 C TYR A 128 11.590 -7.549 0.862 1.00 0.00 C ATOM 101 O TYR A 128 11.602 -8.447 1.717 1.00 0.00 O ATOM 102 CB TYR A 128 10.128 -8.045 -1.162 1.00 0.00 C ATOM 103 CG TYR A 128 9.997 -7.930 -2.672 1.00 0.00 C ATOM 104 CD1 TYR A 128 10.604 -8.862 -3.532 1.00 0.00 C ATOM 105 CD2 TYR A 128 9.214 -6.909 -3.224 1.00 0.00 C ATOM 106 CE1 TYR A 128 10.386 -8.822 -4.919 1.00 0.00 C ATOM 107 CE2 TYR A 128 8.991 -6.846 -4.614 1.00 0.00 C ATOM 108 CZ TYR A 128 9.556 -7.820 -5.463 1.00 0.00 C ATOM 109 OH TYR A 128 9.315 -7.809 -6.803 1.00 0.00 O ATOM 0 H TYR A 128 11.675 -9.890 -1.103 1.00 0.00 H new ATOM 0 HA TYR A 128 12.015 -7.049 -1.173 1.00 0.00 H new ATOM 0 HB2 TYR A 128 9.751 -9.019 -0.851 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.491 -7.293 -0.697 1.00 0.00 H new ATOM 0 HD1 TYR A 128 11.250 -9.623 -3.119 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.777 -6.162 -2.578 1.00 0.00 H new ATOM 0 HE1 TYR A 128 10.851 -9.553 -5.564 1.00 0.00 H new ATOM 0 HE2 TYR A 128 8.388 -6.052 -5.029 1.00 0.00 H new ATOM 0 HH TYR A 128 9.518 -6.921 -7.165 1.00 0.00 H new ATOM 119 N MET A 129 11.632 -6.255 1.142 1.00 0.00 N ATOM 120 CA MET A 129 11.476 -5.618 2.439 1.00 0.00 C ATOM 121 C MET A 129 9.995 -5.487 2.737 1.00 0.00 C ATOM 122 O MET A 129 9.182 -5.551 1.814 1.00 0.00 O ATOM 123 CB MET A 129 12.127 -4.225 2.377 1.00 0.00 C ATOM 124 CG MET A 129 13.615 -4.129 2.740 1.00 0.00 C ATOM 125 SD MET A 129 14.806 -5.370 2.144 1.00 0.00 S ATOM 126 CE MET A 129 14.327 -6.761 3.193 1.00 0.00 C ATOM 0 H MET A 129 11.789 -5.567 0.405 1.00 0.00 H new ATOM 0 HA MET A 129 11.951 -6.207 3.223 1.00 0.00 H new ATOM 0 HB2 MET A 129 12.000 -3.838 1.366 1.00 0.00 H new ATOM 0 HB3 MET A 129 11.573 -3.564 3.043 1.00 0.00 H new ATOM 0 HG2 MET A 129 13.966 -3.157 2.394 1.00 0.00 H new ATOM 0 HG3 MET A 129 13.679 -4.122 3.828 1.00 0.00 H new ATOM 0 HE1 MET A 129 15.209 -7.352 3.439 1.00 0.00 H new ATOM 0 HE2 MET A 129 13.874 -6.386 4.111 1.00 0.00 H new ATOM 0 HE3 MET A 129 13.608 -7.386 2.663 1.00 0.00 H new ATOM 136 N LEU A 130 9.668 -5.229 4.003 1.00 0.00 N ATOM 137 CA LEU A 130 8.349 -4.814 4.437 1.00 0.00 C ATOM 138 C LEU A 130 8.501 -3.632 5.386 1.00 0.00 C ATOM 139 O LEU A 130 9.386 -3.646 6.243 1.00 0.00 O ATOM 140 CB LEU A 130 7.621 -5.993 5.096 1.00 0.00 C ATOM 141 CG LEU A 130 6.239 -5.634 5.675 1.00 0.00 C ATOM 142 CD1 LEU A 130 5.208 -5.279 4.599 1.00 0.00 C ATOM 143 CD2 LEU A 130 5.735 -6.795 6.527 1.00 0.00 C ATOM 0 H LEU A 130 10.336 -5.307 4.770 1.00 0.00 H new ATOM 0 HA LEU A 130 7.744 -4.499 3.587 1.00 0.00 H new ATOM 0 HB2 LEU A 130 7.500 -6.788 4.360 1.00 0.00 H new ATOM 0 HB3 LEU A 130 8.246 -6.391 5.896 1.00 0.00 H new ATOM 0 HG LEU A 130 6.364 -4.739 6.285 1.00 0.00 H new ATOM 0 HD11 LEU A 130 4.257 -5.036 5.073 1.00 0.00 H new ATOM 0 HD12 LEU A 130 5.559 -4.419 4.028 1.00 0.00 H new ATOM 0 HD13 LEU A 130 5.074 -6.129 3.929 1.00 0.00 H new ATOM 0 HD21 LEU A 130 4.757 -6.546 6.939 1.00 0.00 H new ATOM 0 HD22 LEU A 130 5.652 -7.690 5.910 1.00 0.00 H new ATOM 0 HD23 LEU A 130 6.436 -6.980 7.341 1.00 0.00 H new ATOM 155 N GLY A 131 7.647 -2.625 5.224 1.00 0.00 N ATOM 156 CA GLY A 131 7.598 -1.434 6.053 1.00 0.00 C ATOM 157 C GLY A 131 6.750 -1.616 7.314 1.00 0.00 C ATOM 158 O GLY A 131 6.099 -2.642 7.499 1.00 0.00 O ATOM 0 H GLY A 131 6.946 -2.620 4.483 1.00 0.00 H new ATOM 0 HA2 GLY A 131 8.612 -1.157 6.341 1.00 0.00 H new ATOM 0 HA3 GLY A 131 7.196 -0.607 5.468 1.00 0.00 H new ATOM 162 N SER A 132 6.718 -0.605 8.180 1.00 0.00 N ATOM 163 CA SER A 132 5.932 -0.605 9.413 1.00 0.00 C ATOM 164 C SER A 132 4.464 -0.276 9.147 1.00 0.00 C ATOM 165 O SER A 132 4.100 0.170 8.059 1.00 0.00 O ATOM 166 CB SER A 132 6.531 0.349 10.457 1.00 0.00 C ATOM 167 OG SER A 132 7.441 1.295 9.909 1.00 0.00 O ATOM 0 H SER A 132 7.249 0.255 8.042 1.00 0.00 H new ATOM 0 HA SER A 132 5.972 -1.615 9.821 1.00 0.00 H new ATOM 0 HB2 SER A 132 5.722 0.883 10.956 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.044 -0.237 11.220 1.00 0.00 H new ATOM 0 HG SER A 132 7.784 1.871 10.624 1.00 0.00 H new ATOM 173 N ALA A 133 3.599 -0.535 10.132 1.00 0.00 N ATOM 174 CA ALA A 133 2.165 -0.331 9.974 1.00 0.00 C ATOM 175 C ALA A 133 1.820 1.144 10.125 1.00 0.00 C ATOM 176 O ALA A 133 2.016 1.723 11.194 1.00 0.00 O ATOM 177 CB ALA A 133 1.393 -1.165 10.981 1.00 0.00 C ATOM 0 H ALA A 133 3.873 -0.888 11.049 1.00 0.00 H new ATOM 0 HA ALA A 133 1.879 -0.653 8.973 1.00 0.00 H new ATOM 0 HB1 ALA A 133 0.324 -0.999 10.847 1.00 0.00 H new ATOM 0 HB2 ALA A 133 1.618 -2.220 10.828 1.00 0.00 H new ATOM 0 HB3 ALA A 133 1.682 -0.875 11.991 1.00 0.00 H new ATOM 183 N MET A 134 1.316 1.724 9.047 1.00 0.00 N ATOM 184 CA MET A 134 0.993 3.130 8.890 1.00 0.00 C ATOM 185 C MET A 134 -0.492 3.348 9.151 1.00 0.00 C ATOM 186 O MET A 134 -1.289 2.407 9.100 1.00 0.00 O ATOM 187 CB MET A 134 1.268 3.563 7.445 1.00 0.00 C ATOM 188 CG MET A 134 2.562 3.014 6.845 1.00 0.00 C ATOM 189 SD MET A 134 2.453 3.109 5.052 1.00 0.00 S ATOM 190 CE MET A 134 4.087 3.652 4.596 1.00 0.00 C ATOM 0 H MET A 134 1.109 1.188 8.204 1.00 0.00 H new ATOM 0 HA MET A 134 1.599 3.705 9.591 1.00 0.00 H new ATOM 0 HB2 MET A 134 0.432 3.247 6.821 1.00 0.00 H new ATOM 0 HB3 MET A 134 1.300 4.652 7.407 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.417 3.588 7.202 1.00 0.00 H new ATOM 0 HG3 MET A 134 2.716 1.982 7.160 1.00 0.00 H new ATOM 0 HE1 MET A 134 4.133 3.801 3.517 1.00 0.00 H new ATOM 0 HE2 MET A 134 4.313 4.591 5.102 1.00 0.00 H new ATOM 0 HE3 MET A 134 4.816 2.897 4.890 1.00 0.00 H new ATOM 200 N SER A 135 -0.896 4.605 9.306 1.00 0.00 N ATOM 201 CA SER A 135 -2.299 4.971 9.439 1.00 0.00 C ATOM 202 C SER A 135 -2.876 5.435 8.095 1.00 0.00 C ATOM 203 O SER A 135 -2.191 5.386 7.066 1.00 0.00 O ATOM 204 CB SER A 135 -2.455 5.965 10.587 1.00 0.00 C ATOM 205 OG SER A 135 -3.759 5.835 11.129 1.00 0.00 O ATOM 0 H SER A 135 -0.257 5.399 9.343 1.00 0.00 H new ATOM 0 HA SER A 135 -2.900 4.102 9.705 1.00 0.00 H new ATOM 0 HB2 SER A 135 -1.706 5.775 11.356 1.00 0.00 H new ATOM 0 HB3 SER A 135 -2.294 6.982 10.230 1.00 0.00 H new ATOM 0 HG SER A 135 -3.870 6.468 11.869 1.00 0.00 H new ATOM 211 N ARG A 136 -4.156 5.822 8.067 1.00 0.00 N ATOM 212 CA ARG A 136 -4.936 5.830 6.834 1.00 0.00 C ATOM 213 C ARG A 136 -5.054 7.249 6.249 1.00 0.00 C ATOM 214 O ARG A 136 -5.548 8.149 6.936 1.00 0.00 O ATOM 215 CB ARG A 136 -6.280 5.107 7.012 1.00 0.00 C ATOM 216 CG ARG A 136 -7.241 5.691 8.062 1.00 0.00 C ATOM 217 CD ARG A 136 -7.524 4.779 9.262 1.00 0.00 C ATOM 218 NE ARG A 136 -6.970 5.297 10.529 1.00 0.00 N ATOM 219 CZ ARG A 136 -7.325 4.855 11.741 1.00 0.00 C ATOM 220 NH1 ARG A 136 -8.077 3.765 11.836 1.00 0.00 N ATOM 221 NH2 ARG A 136 -6.931 5.488 12.839 1.00 0.00 N ATOM 0 H ARG A 136 -4.671 6.134 8.890 1.00 0.00 H new ATOM 0 HA ARG A 136 -4.397 5.253 6.082 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -6.792 5.097 6.050 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -6.077 4.069 7.276 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -6.827 6.630 8.429 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -8.187 5.928 7.575 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -8.601 4.653 9.368 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -7.106 3.792 9.067 1.00 0.00 H new ATOM 0 HE ARG A 136 -6.272 6.039 10.477 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -8.376 3.277 10.992 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -8.356 3.416 12.753 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -6.350 6.323 12.766 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -7.209 5.139 13.756 1.00 0.00 H new ATOM 235 N PRO A 137 -4.598 7.471 5.003 1.00 0.00 N ATOM 236 CA PRO A 137 -4.670 8.771 4.334 1.00 0.00 C ATOM 237 C PRO A 137 -6.131 9.126 4.008 1.00 0.00 C ATOM 238 O PRO A 137 -6.918 8.235 3.689 1.00 0.00 O ATOM 239 CB PRO A 137 -3.796 8.612 3.071 1.00 0.00 C ATOM 240 CG PRO A 137 -3.847 7.117 2.769 1.00 0.00 C ATOM 241 CD PRO A 137 -4.023 6.459 4.130 1.00 0.00 C ATOM 0 HA PRO A 137 -4.309 9.592 4.953 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -4.186 9.200 2.240 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -2.774 8.948 3.248 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -4.674 6.875 2.101 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -2.933 6.779 2.280 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -4.677 5.590 4.060 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -3.067 6.108 4.519 1.00 0.00 H new ATOM 249 N MET A 138 -6.518 10.403 4.057 1.00 0.00 N ATOM 250 CA MET A 138 -7.799 10.876 3.538 1.00 0.00 C ATOM 251 C MET A 138 -7.719 10.946 2.021 1.00 0.00 C ATOM 252 O MET A 138 -6.815 11.591 1.482 1.00 0.00 O ATOM 253 CB MET A 138 -8.130 12.258 4.115 1.00 0.00 C ATOM 254 CG MET A 138 -9.249 12.239 5.151 1.00 0.00 C ATOM 255 SD MET A 138 -9.043 11.220 6.642 1.00 0.00 S ATOM 256 CE MET A 138 -9.747 9.620 6.139 1.00 0.00 C ATOM 0 H MET A 138 -5.944 11.143 4.462 1.00 0.00 H new ATOM 0 HA MET A 138 -8.589 10.186 3.833 1.00 0.00 H new ATOM 0 HB2 MET A 138 -7.232 12.676 4.571 1.00 0.00 H new ATOM 0 HB3 MET A 138 -8.413 12.924 3.300 1.00 0.00 H new ATOM 0 HG2 MET A 138 -9.418 13.266 5.474 1.00 0.00 H new ATOM 0 HG3 MET A 138 -10.158 11.909 4.649 1.00 0.00 H new ATOM 0 HE1 MET A 138 -10.548 9.343 6.824 1.00 0.00 H new ATOM 0 HE2 MET A 138 -10.146 9.700 5.128 1.00 0.00 H new ATOM 0 HE3 MET A 138 -8.969 8.857 6.163 1.00 0.00 H new ATOM 266 N ILE A 139 -8.673 10.320 1.335 1.00 0.00 N ATOM 267 CA ILE A 139 -8.753 10.260 -0.118 1.00 0.00 C ATOM 268 C ILE A 139 -10.198 10.605 -0.442 1.00 0.00 C ATOM 269 O ILE A 139 -11.109 9.860 -0.090 1.00 0.00 O ATOM 270 CB ILE A 139 -8.312 8.882 -0.669 1.00 0.00 C ATOM 271 CG1 ILE A 139 -7.048 8.380 0.065 1.00 0.00 C ATOM 272 CG2 ILE A 139 -8.116 8.964 -2.196 1.00 0.00 C ATOM 273 CD1 ILE A 139 -6.219 7.355 -0.699 1.00 0.00 C ATOM 0 H ILE A 139 -9.437 9.824 1.794 1.00 0.00 H new ATOM 0 HA ILE A 139 -8.068 10.958 -0.599 1.00 0.00 H new ATOM 0 HB ILE A 139 -9.095 8.148 -0.480 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -6.415 9.238 0.294 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -7.349 7.943 1.017 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -7.806 7.991 -2.576 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -9.054 9.256 -2.668 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -7.349 9.704 -2.425 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -5.355 7.066 -0.100 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -6.828 6.475 -0.905 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -5.880 7.789 -1.639 1.00 0.00 H new ATOM 285 N HIS A 140 -10.403 11.779 -1.035 1.00 0.00 N ATOM 286 CA HIS A 140 -11.746 12.280 -1.314 1.00 0.00 C ATOM 287 C HIS A 140 -12.299 11.727 -2.626 1.00 0.00 C ATOM 288 O HIS A 140 -13.500 11.818 -2.863 1.00 0.00 O ATOM 289 CB HIS A 140 -11.786 13.814 -1.294 1.00 0.00 C ATOM 290 CG HIS A 140 -11.379 14.471 -2.590 1.00 0.00 C ATOM 291 ND1 HIS A 140 -12.244 14.903 -3.571 1.00 0.00 N ATOM 292 CD2 HIS A 140 -10.105 14.698 -3.028 1.00 0.00 C ATOM 293 CE1 HIS A 140 -11.505 15.372 -4.590 1.00 0.00 C ATOM 294 NE2 HIS A 140 -10.196 15.289 -4.294 1.00 0.00 N ATOM 0 H HIS A 140 -9.653 12.403 -1.332 1.00 0.00 H new ATOM 0 HA HIS A 140 -12.395 11.921 -0.515 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -12.797 14.135 -1.041 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -11.130 14.171 -0.500 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -9.195 14.464 -2.496 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -11.905 15.760 -5.515 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -9.419 15.597 -4.879 1.00 0.00 H new ATOM 302 N PHE A 141 -11.423 11.162 -3.464 1.00 0.00 N ATOM 303 CA PHE A 141 -11.663 10.654 -4.802 1.00 0.00 C ATOM 304 C PHE A 141 -12.215 11.757 -5.704 1.00 0.00 C ATOM 305 O PHE A 141 -11.442 12.366 -6.443 1.00 0.00 O ATOM 306 CB PHE A 141 -12.478 9.358 -4.764 1.00 0.00 C ATOM 307 CG PHE A 141 -11.763 8.125 -4.276 1.00 0.00 C ATOM 308 CD1 PHE A 141 -11.520 7.959 -2.902 1.00 0.00 C ATOM 309 CD2 PHE A 141 -11.411 7.112 -5.187 1.00 0.00 C ATOM 310 CE1 PHE A 141 -10.838 6.824 -2.445 1.00 0.00 C ATOM 311 CE2 PHE A 141 -10.733 5.970 -4.726 1.00 0.00 C ATOM 312 CZ PHE A 141 -10.424 5.842 -3.359 1.00 0.00 C ATOM 0 H PHE A 141 -10.447 11.042 -3.192 1.00 0.00 H new ATOM 0 HA PHE A 141 -10.720 10.362 -5.264 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -13.348 9.521 -4.128 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -12.851 9.160 -5.769 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -11.859 8.706 -2.199 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -11.660 7.211 -6.233 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -10.631 6.705 -1.392 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -10.450 5.192 -5.420 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.866 4.985 -3.012 1.00 0.00 H new ATOM 322 N GLY A 142 -13.506 12.048 -5.654 1.00 0.00 N ATOM 323 CA GLY A 142 -14.121 13.095 -6.453 1.00 0.00 C ATOM 324 C GLY A 142 -15.646 13.068 -6.538 1.00 0.00 C ATOM 325 O GLY A 142 -16.190 13.935 -7.217 1.00 0.00 O ATOM 0 H GLY A 142 -14.164 11.557 -5.049 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -13.817 14.060 -6.047 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -13.720 13.035 -7.465 1.00 0.00 H new ATOM 329 N ASN A 143 -16.340 12.112 -5.920 1.00 0.00 N ATOM 330 CA ASN A 143 -17.793 12.036 -5.776 1.00 0.00 C ATOM 331 C ASN A 143 -18.059 12.339 -4.293 1.00 0.00 C ATOM 332 O ASN A 143 -17.447 13.238 -3.710 1.00 0.00 O ATOM 333 CB ASN A 143 -18.426 10.705 -6.291 1.00 0.00 C ATOM 334 CG ASN A 143 -17.970 10.142 -7.645 1.00 0.00 C ATOM 335 OD1 ASN A 143 -18.768 9.897 -8.553 1.00 0.00 O ATOM 336 ND2 ASN A 143 -16.707 9.772 -7.763 1.00 0.00 N ATOM 0 H ASN A 143 -15.872 11.320 -5.479 1.00 0.00 H new ATOM 0 HA ASN A 143 -18.291 12.760 -6.420 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -18.243 9.939 -5.537 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -19.505 10.851 -6.341 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -16.395 9.285 -8.603 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -16.045 9.973 -7.014 1.00 0.00 H new ATOM 343 N ASP A 144 -19.043 11.674 -3.701 1.00 0.00 N ATOM 344 CA ASP A 144 -19.186 11.553 -2.239 1.00 0.00 C ATOM 345 C ASP A 144 -19.260 10.090 -1.799 1.00 0.00 C ATOM 346 O ASP A 144 -18.689 9.712 -0.775 1.00 0.00 O ATOM 347 CB ASP A 144 -20.440 12.316 -1.784 1.00 0.00 C ATOM 348 CG ASP A 144 -21.040 11.780 -0.479 1.00 0.00 C ATOM 349 OD1 ASP A 144 -20.366 11.793 0.567 1.00 0.00 O ATOM 350 OD2 ASP A 144 -22.238 11.399 -0.504 1.00 0.00 O ATOM 0 H ASP A 144 -19.778 11.194 -4.221 1.00 0.00 H new ATOM 0 HA ASP A 144 -18.303 11.988 -1.770 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -20.188 13.369 -1.654 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -21.193 12.263 -2.570 1.00 0.00 H new ATOM 355 N TRP A 145 -19.952 9.251 -2.580 1.00 0.00 N ATOM 356 CA TRP A 145 -20.173 7.853 -2.227 1.00 0.00 C ATOM 357 C TRP A 145 -18.865 7.101 -2.053 1.00 0.00 C ATOM 358 O TRP A 145 -18.837 6.138 -1.289 1.00 0.00 O ATOM 359 CB TRP A 145 -21.034 7.163 -3.286 1.00 0.00 C ATOM 360 CG TRP A 145 -20.546 7.256 -4.703 1.00 0.00 C ATOM 361 CD1 TRP A 145 -20.894 8.221 -5.578 1.00 0.00 C ATOM 362 CD2 TRP A 145 -19.605 6.396 -5.416 1.00 0.00 C ATOM 363 NE1 TRP A 145 -20.281 7.987 -6.792 1.00 0.00 N ATOM 364 CE2 TRP A 145 -19.453 6.888 -6.745 1.00 0.00 C ATOM 365 CE3 TRP A 145 -18.819 5.284 -5.056 1.00 0.00 C ATOM 366 CZ2 TRP A 145 -18.573 6.305 -7.670 1.00 0.00 C ATOM 367 CZ3 TRP A 145 -17.924 4.693 -5.970 1.00 0.00 C ATOM 368 CH2 TRP A 145 -17.793 5.206 -7.273 1.00 0.00 C ATOM 0 H TRP A 145 -20.370 9.525 -3.469 1.00 0.00 H new ATOM 0 HA TRP A 145 -20.697 7.839 -1.271 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -21.121 6.109 -3.023 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -22.037 7.587 -3.241 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -21.552 9.050 -5.362 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -20.424 8.559 -7.624 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -18.904 4.876 -4.060 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -18.496 6.696 -8.674 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -17.334 3.840 -5.668 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -17.096 4.757 -7.965 1.00 0.00 H new ATOM 379 N GLU A 146 -17.814 7.503 -2.762 1.00 0.00 N ATOM 380 CA GLU A 146 -16.533 6.819 -2.734 1.00 0.00 C ATOM 381 C GLU A 146 -15.749 7.227 -1.492 1.00 0.00 C ATOM 382 O GLU A 146 -15.311 6.336 -0.777 1.00 0.00 O ATOM 383 CB GLU A 146 -15.692 7.018 -4.001 1.00 0.00 C ATOM 384 CG GLU A 146 -16.308 7.850 -5.089 1.00 0.00 C ATOM 385 CD GLU A 146 -15.940 9.270 -4.780 1.00 0.00 C ATOM 386 OE1 GLU A 146 -16.488 9.852 -3.820 1.00 0.00 O ATOM 387 OE2 GLU A 146 -15.149 9.797 -5.575 1.00 0.00 O ATOM 0 H GLU A 146 -17.831 8.318 -3.375 1.00 0.00 H new ATOM 0 HA GLU A 146 -16.755 5.752 -2.696 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -14.746 7.477 -3.714 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -15.458 6.036 -4.413 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -15.931 7.553 -6.068 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -17.390 7.723 -5.112 1.00 0.00 H new ATOM 394 N ASP A 147 -15.600 8.526 -1.199 1.00 0.00 N ATOM 395 CA ASP A 147 -14.950 8.997 0.038 1.00 0.00 C ATOM 396 C ASP A 147 -15.603 8.304 1.230 1.00 0.00 C ATOM 397 O ASP A 147 -14.938 7.732 2.097 1.00 0.00 O ATOM 398 CB ASP A 147 -15.103 10.517 0.215 1.00 0.00 C ATOM 399 CG ASP A 147 -14.161 11.133 1.270 1.00 0.00 C ATOM 400 OD1 ASP A 147 -13.623 10.451 2.172 1.00 0.00 O ATOM 401 OD2 ASP A 147 -13.954 12.367 1.230 1.00 0.00 O ATOM 0 H ASP A 147 -15.924 9.278 -1.807 1.00 0.00 H new ATOM 0 HA ASP A 147 -13.888 8.761 -0.025 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -14.922 11.002 -0.744 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -16.134 10.736 0.494 1.00 0.00 H new ATOM 406 N ARG A 148 -16.943 8.296 1.242 1.00 0.00 N ATOM 407 CA ARG A 148 -17.691 7.646 2.285 1.00 0.00 C ATOM 408 C ARG A 148 -17.424 6.147 2.296 1.00 0.00 C ATOM 409 O ARG A 148 -17.089 5.630 3.353 1.00 0.00 O ATOM 410 CB ARG A 148 -19.178 7.983 2.144 1.00 0.00 C ATOM 411 CG ARG A 148 -19.861 7.387 3.368 1.00 0.00 C ATOM 412 CD ARG A 148 -21.277 7.899 3.607 1.00 0.00 C ATOM 413 NE ARG A 148 -21.583 7.804 5.040 1.00 0.00 N ATOM 414 CZ ARG A 148 -21.747 6.689 5.759 1.00 0.00 C ATOM 415 NH1 ARG A 148 -21.891 5.509 5.161 1.00 0.00 N ATOM 416 NH2 ARG A 148 -21.785 6.774 7.081 1.00 0.00 N ATOM 0 H ARG A 148 -17.519 8.741 0.528 1.00 0.00 H new ATOM 0 HA ARG A 148 -17.361 8.020 3.254 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -19.331 9.061 2.098 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -19.588 7.563 1.225 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -19.892 6.303 3.260 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -19.256 7.602 4.248 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -21.366 8.932 3.271 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -21.992 7.313 3.029 1.00 0.00 H new ATOM 0 HE ARG A 148 -21.681 8.686 5.542 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -21.877 5.448 4.143 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -22.015 4.665 5.721 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -21.690 7.682 7.537 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -21.910 5.932 7.643 1.00 0.00 H new ATOM 430 N TYR A 149 -17.605 5.440 1.179 1.00 0.00 N ATOM 431 CA TYR A 149 -17.446 3.990 1.156 1.00 0.00 C ATOM 432 C TYR A 149 -16.056 3.600 1.643 1.00 0.00 C ATOM 433 O TYR A 149 -15.943 2.721 2.494 1.00 0.00 O ATOM 434 CB TYR A 149 -17.742 3.421 -0.235 1.00 0.00 C ATOM 435 CG TYR A 149 -17.572 1.917 -0.319 1.00 0.00 C ATOM 436 CD1 TYR A 149 -18.288 1.088 0.563 1.00 0.00 C ATOM 437 CD2 TYR A 149 -16.681 1.344 -1.245 1.00 0.00 C ATOM 438 CE1 TYR A 149 -18.131 -0.302 0.501 1.00 0.00 C ATOM 439 CE2 TYR A 149 -16.503 -0.050 -1.305 1.00 0.00 C ATOM 440 CZ TYR A 149 -17.257 -0.881 -0.444 1.00 0.00 C ATOM 441 OH TYR A 149 -17.179 -2.238 -0.491 1.00 0.00 O ATOM 0 H TYR A 149 -17.861 5.850 0.281 1.00 0.00 H new ATOM 0 HA TYR A 149 -18.174 3.553 1.839 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -18.763 3.680 -0.516 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -17.082 3.895 -0.961 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -18.959 1.524 1.288 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -16.127 1.982 -1.918 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -18.682 -0.935 1.181 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -15.798 -0.481 -2.001 1.00 0.00 H new ATOM 0 HH TYR A 149 -16.468 -2.504 -1.112 1.00 0.00 H new ATOM 451 N TYR A 150 -15.023 4.294 1.165 1.00 0.00 N ATOM 452 CA TYR A 150 -13.649 4.147 1.609 1.00 0.00 C ATOM 453 C TYR A 150 -13.579 4.267 3.126 1.00 0.00 C ATOM 454 O TYR A 150 -13.075 3.356 3.784 1.00 0.00 O ATOM 455 CB TYR A 150 -12.803 5.243 0.927 1.00 0.00 C ATOM 456 CG TYR A 150 -11.401 5.422 1.463 1.00 0.00 C ATOM 457 CD1 TYR A 150 -10.490 4.358 1.401 1.00 0.00 C ATOM 458 CD2 TYR A 150 -11.009 6.653 2.022 1.00 0.00 C ATOM 459 CE1 TYR A 150 -9.203 4.495 1.949 1.00 0.00 C ATOM 460 CE2 TYR A 150 -9.716 6.812 2.538 1.00 0.00 C ATOM 461 CZ TYR A 150 -8.813 5.727 2.512 1.00 0.00 C ATOM 462 OH TYR A 150 -7.599 5.839 3.105 1.00 0.00 O ATOM 0 H TYR A 150 -15.130 4.996 0.433 1.00 0.00 H new ATOM 0 HA TYR A 150 -13.260 3.166 1.336 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -12.738 5.016 -0.137 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -13.331 6.192 1.019 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.778 3.430 0.930 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -11.707 7.477 2.053 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -8.517 3.661 1.939 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -9.411 7.761 2.954 1.00 0.00 H new ATOM 0 HH TYR A 150 -7.285 6.765 3.036 1.00 0.00 H new ATOM 472 N ARG A 151 -14.113 5.355 3.695 1.00 0.00 N ATOM 473 CA ARG A 151 -14.173 5.520 5.144 1.00 0.00 C ATOM 474 C ARG A 151 -14.860 4.334 5.821 1.00 0.00 C ATOM 475 O ARG A 151 -14.333 3.796 6.789 1.00 0.00 O ATOM 476 CB ARG A 151 -14.835 6.850 5.498 1.00 0.00 C ATOM 477 CG ARG A 151 -13.915 8.013 5.117 1.00 0.00 C ATOM 478 CD ARG A 151 -14.716 9.312 5.076 1.00 0.00 C ATOM 479 NE ARG A 151 -13.834 10.473 5.154 1.00 0.00 N ATOM 480 CZ ARG A 151 -13.242 10.925 6.261 1.00 0.00 C ATOM 481 NH1 ARG A 151 -13.465 10.337 7.436 1.00 0.00 N ATOM 482 NH2 ARG A 151 -12.411 11.946 6.174 1.00 0.00 N ATOM 0 H ARG A 151 -14.509 6.133 3.168 1.00 0.00 H new ATOM 0 HA ARG A 151 -13.154 5.542 5.529 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -15.787 6.942 4.975 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -15.054 6.884 6.565 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -13.103 8.098 5.839 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -13.459 7.825 4.145 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -15.299 9.355 4.156 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -15.425 9.333 5.904 1.00 0.00 H new ATOM 0 HE ARG A 151 -13.655 10.982 4.288 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -14.092 9.535 7.494 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -13.008 10.689 8.277 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -12.228 12.379 5.269 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -11.951 12.302 7.012 1.00 0.00 H new ATOM 496 N GLU A 152 -15.987 3.862 5.297 1.00 0.00 N ATOM 497 CA GLU A 152 -16.752 2.764 5.875 1.00 0.00 C ATOM 498 C GLU A 152 -16.008 1.434 5.958 1.00 0.00 C ATOM 499 O GLU A 152 -16.466 0.547 6.687 1.00 0.00 O ATOM 500 CB GLU A 152 -18.067 2.576 5.136 1.00 0.00 C ATOM 501 CG GLU A 152 -19.021 3.760 5.279 1.00 0.00 C ATOM 502 CD GLU A 152 -18.973 4.503 6.615 1.00 0.00 C ATOM 503 OE1 GLU A 152 -19.222 3.850 7.661 1.00 0.00 O ATOM 504 OE2 GLU A 152 -18.703 5.721 6.658 1.00 0.00 O ATOM 0 H GLU A 152 -16.401 4.239 4.444 1.00 0.00 H new ATOM 0 HA GLU A 152 -16.935 3.065 6.906 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -17.860 2.412 4.078 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -18.558 1.677 5.508 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -18.806 4.472 4.482 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -20.038 3.402 5.121 1.00 0.00 H new ATOM 511 N ASN A 153 -14.884 1.284 5.256 1.00 0.00 N ATOM 512 CA ASN A 153 -13.988 0.128 5.368 1.00 0.00 C ATOM 513 C ASN A 153 -12.513 0.495 5.592 1.00 0.00 C ATOM 514 O ASN A 153 -11.641 -0.365 5.477 1.00 0.00 O ATOM 515 CB ASN A 153 -14.238 -0.897 4.250 1.00 0.00 C ATOM 516 CG ASN A 153 -13.968 -0.469 2.820 1.00 0.00 C ATOM 517 OD1 ASN A 153 -12.960 -0.810 2.219 1.00 0.00 O ATOM 518 ND2 ASN A 153 -14.928 0.197 2.200 1.00 0.00 N ATOM 0 H ASN A 153 -14.563 1.976 4.579 1.00 0.00 H new ATOM 0 HA ASN A 153 -14.251 -0.380 6.296 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -13.625 -1.774 4.458 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -15.279 -1.213 4.313 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -14.831 0.430 1.212 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -15.766 0.477 2.710 1.00 0.00 H new ATOM 525 N MET A 154 -12.224 1.725 6.040 1.00 0.00 N ATOM 526 CA MET A 154 -10.882 2.302 6.226 1.00 0.00 C ATOM 527 C MET A 154 -9.956 1.569 7.208 1.00 0.00 C ATOM 528 O MET A 154 -8.813 1.982 7.393 1.00 0.00 O ATOM 529 CB MET A 154 -11.010 3.776 6.648 1.00 0.00 C ATOM 530 CG MET A 154 -11.535 3.975 8.087 1.00 0.00 C ATOM 531 SD MET A 154 -12.254 5.594 8.533 1.00 0.00 S ATOM 532 CE MET A 154 -11.207 6.741 7.607 1.00 0.00 C ATOM 0 H MET A 154 -12.961 2.382 6.297 1.00 0.00 H new ATOM 0 HA MET A 154 -10.399 2.192 5.255 1.00 0.00 H new ATOM 0 HB2 MET A 154 -10.035 4.255 6.559 1.00 0.00 H new ATOM 0 HB3 MET A 154 -11.679 4.285 5.954 1.00 0.00 H new ATOM 0 HG2 MET A 154 -12.292 3.213 8.273 1.00 0.00 H new ATOM 0 HG3 MET A 154 -10.710 3.778 8.772 1.00 0.00 H new ATOM 0 HE1 MET A 154 -11.640 7.741 7.645 1.00 0.00 H new ATOM 0 HE2 MET A 154 -10.210 6.760 8.048 1.00 0.00 H new ATOM 0 HE3 MET A 154 -11.139 6.414 6.569 1.00 0.00 H new ATOM 542 N TYR A 155 -10.436 0.523 7.874 1.00 0.00 N ATOM 543 CA TYR A 155 -9.711 -0.268 8.857 1.00 0.00 C ATOM 544 C TYR A 155 -9.271 -1.623 8.277 1.00 0.00 C ATOM 545 O TYR A 155 -8.322 -2.219 8.791 1.00 0.00 O ATOM 546 CB TYR A 155 -10.604 -0.426 10.102 1.00 0.00 C ATOM 547 CG TYR A 155 -11.952 -1.085 9.844 1.00 0.00 C ATOM 548 CD1 TYR A 155 -13.021 -0.350 9.288 1.00 0.00 C ATOM 549 CD2 TYR A 155 -12.127 -2.448 10.141 1.00 0.00 C ATOM 550 CE1 TYR A 155 -14.246 -0.973 8.995 1.00 0.00 C ATOM 551 CE2 TYR A 155 -13.348 -3.080 9.860 1.00 0.00 C ATOM 552 CZ TYR A 155 -14.403 -2.353 9.265 1.00 0.00 C ATOM 553 OH TYR A 155 -15.543 -3.011 8.920 1.00 0.00 O ATOM 0 H TYR A 155 -11.390 0.189 7.734 1.00 0.00 H new ATOM 0 HA TYR A 155 -8.791 0.243 9.141 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -10.065 -1.013 10.846 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -10.775 0.559 10.536 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -12.896 0.703 9.085 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -11.320 -3.010 10.587 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -15.059 -0.404 8.568 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -13.481 -4.125 10.099 1.00 0.00 H new ATOM 0 HH TYR A 155 -15.470 -3.952 9.183 1.00 0.00 H new ATOM 563 N ARG A 156 -9.912 -2.098 7.198 1.00 0.00 N ATOM 564 CA ARG A 156 -9.668 -3.425 6.625 1.00 0.00 C ATOM 565 C ARG A 156 -8.461 -3.465 5.695 1.00 0.00 C ATOM 566 O ARG A 156 -7.988 -4.554 5.382 1.00 0.00 O ATOM 567 CB ARG A 156 -10.936 -3.910 5.893 1.00 0.00 C ATOM 568 CG ARG A 156 -11.953 -4.439 6.912 1.00 0.00 C ATOM 569 CD ARG A 156 -13.306 -4.813 6.301 1.00 0.00 C ATOM 570 NE ARG A 156 -13.228 -5.948 5.367 1.00 0.00 N ATOM 571 CZ ARG A 156 -13.314 -7.250 5.678 1.00 0.00 C ATOM 572 NH1 ARG A 156 -13.313 -7.661 6.942 1.00 0.00 N ATOM 573 NH2 ARG A 156 -13.438 -8.156 4.720 1.00 0.00 N ATOM 0 H ARG A 156 -10.621 -1.564 6.696 1.00 0.00 H new ATOM 0 HA ARG A 156 -9.434 -4.097 7.451 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -11.373 -3.091 5.321 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -10.679 -4.694 5.181 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -11.534 -5.315 7.407 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -12.109 -3.682 7.681 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -14.004 -5.058 7.102 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -13.712 -3.948 5.778 1.00 0.00 H new ATOM 0 HE ARG A 156 -13.095 -5.721 4.382 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -13.246 -6.981 7.699 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -13.379 -8.656 7.155 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -13.468 -7.864 3.743 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -13.503 -9.145 4.959 1.00 0.00 H new ATOM 587 N TYR A 157 -7.978 -2.319 5.225 1.00 0.00 N ATOM 588 CA TYR A 157 -6.897 -2.220 4.245 1.00 0.00 C ATOM 589 C TYR A 157 -5.542 -2.710 4.769 1.00 0.00 C ATOM 590 O TYR A 157 -5.400 -2.928 5.976 1.00 0.00 O ATOM 591 CB TYR A 157 -6.804 -0.749 3.825 1.00 0.00 C ATOM 592 CG TYR A 157 -7.987 -0.294 3.007 1.00 0.00 C ATOM 593 CD1 TYR A 157 -8.390 -1.021 1.867 1.00 0.00 C ATOM 594 CD2 TYR A 157 -8.686 0.858 3.398 1.00 0.00 C ATOM 595 CE1 TYR A 157 -9.510 -0.616 1.126 1.00 0.00 C ATOM 596 CE2 TYR A 157 -9.794 1.281 2.654 1.00 0.00 C ATOM 597 CZ TYR A 157 -10.200 0.552 1.517 1.00 0.00 C ATOM 598 OH TYR A 157 -11.243 1.003 0.785 1.00 0.00 O ATOM 0 H TYR A 157 -8.335 -1.410 5.521 1.00 0.00 H new ATOM 0 HA TYR A 157 -7.131 -2.873 3.404 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -6.725 -0.127 4.716 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -5.891 -0.598 3.249 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -7.833 -1.895 1.563 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -8.371 1.415 4.268 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -9.839 -1.188 0.271 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -10.338 2.166 2.951 1.00 0.00 H new ATOM 0 HH TYR A 157 -12.060 0.536 1.058 1.00 0.00 H new ATOM 608 N PRO A 158 -4.522 -2.842 3.891 1.00 0.00 N ATOM 609 CA PRO A 158 -3.139 -2.918 4.331 1.00 0.00 C ATOM 610 C PRO A 158 -2.804 -1.714 5.210 1.00 0.00 C ATOM 611 O PRO A 158 -3.318 -0.613 4.983 1.00 0.00 O ATOM 612 CB PRO A 158 -2.274 -2.865 3.062 1.00 0.00 C ATOM 613 CG PRO A 158 -3.215 -3.226 1.917 1.00 0.00 C ATOM 614 CD PRO A 158 -4.575 -2.775 2.435 1.00 0.00 C ATOM 0 HA PRO A 158 -2.963 -3.827 4.906 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -1.844 -1.873 2.920 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -1.442 -3.567 3.124 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.944 -2.712 0.995 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -3.199 -4.295 1.703 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -4.796 -1.760 2.104 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -5.367 -3.417 2.048 1.00 0.00 H new ATOM 622 N ASN A 159 -1.832 -1.886 6.103 1.00 0.00 N ATOM 623 CA ASN A 159 -1.166 -0.787 6.801 1.00 0.00 C ATOM 624 C ASN A 159 0.331 -0.821 6.520 1.00 0.00 C ATOM 625 O ASN A 159 0.983 0.195 6.718 1.00 0.00 O ATOM 626 CB ASN A 159 -1.371 -0.854 8.320 1.00 0.00 C ATOM 627 CG ASN A 159 -2.748 -0.406 8.794 1.00 0.00 C ATOM 628 OD1 ASN A 159 -3.770 -0.548 8.142 1.00 0.00 O ATOM 629 ND2 ASN A 159 -2.814 0.141 9.991 1.00 0.00 N ATOM 0 H ASN A 159 -1.479 -2.806 6.366 1.00 0.00 H new ATOM 0 HA ASN A 159 -1.611 0.137 6.430 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -1.203 -1.879 8.651 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -0.615 -0.235 8.803 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -3.714 0.442 10.365 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -1.965 0.264 10.543 1.00 0.00 H new ATOM 636 N GLN A 160 0.902 -1.944 6.086 1.00 0.00 N ATOM 637 CA GLN A 160 2.328 -2.092 5.807 1.00 0.00 C ATOM 638 C GLN A 160 2.488 -2.308 4.306 1.00 0.00 C ATOM 639 O GLN A 160 1.594 -2.904 3.696 1.00 0.00 O ATOM 640 CB GLN A 160 2.899 -3.313 6.554 1.00 0.00 C ATOM 641 CG GLN A 160 2.703 -3.314 8.073 1.00 0.00 C ATOM 642 CD GLN A 160 3.325 -4.526 8.769 1.00 0.00 C ATOM 643 OE1 GLN A 160 2.629 -5.386 9.315 1.00 0.00 O ATOM 644 NE2 GLN A 160 4.641 -4.592 8.838 1.00 0.00 N ATOM 0 H GLN A 160 0.371 -2.798 5.915 1.00 0.00 H new ATOM 0 HA GLN A 160 2.864 -1.202 6.137 1.00 0.00 H new ATOM 0 HB2 GLN A 160 2.439 -4.213 6.146 1.00 0.00 H new ATOM 0 HB3 GLN A 160 3.967 -3.378 6.344 1.00 0.00 H new ATOM 0 HG2 GLN A 160 3.138 -2.404 8.488 1.00 0.00 H new ATOM 0 HG3 GLN A 160 1.636 -3.287 8.293 1.00 0.00 H new ATOM 0 HE21 GLN A 160 5.212 -3.878 8.385 1.00 0.00 H new ATOM 0 HE22 GLN A 160 5.087 -5.357 9.344 1.00 0.00 H new ATOM 653 N VAL A 161 3.629 -1.933 3.724 1.00 0.00 N ATOM 654 CA VAL A 161 3.881 -2.134 2.294 1.00 0.00 C ATOM 655 C VAL A 161 5.189 -2.898 2.079 1.00 0.00 C ATOM 656 O VAL A 161 6.182 -2.610 2.751 1.00 0.00 O ATOM 657 CB VAL A 161 3.834 -0.782 1.552 1.00 0.00 C ATOM 658 CG1 VAL A 161 2.468 -0.092 1.709 1.00 0.00 C ATOM 659 CG2 VAL A 161 4.922 0.215 1.969 1.00 0.00 C ATOM 0 H VAL A 161 4.398 -1.486 4.224 1.00 0.00 H new ATOM 0 HA VAL A 161 3.093 -2.754 1.867 1.00 0.00 H new ATOM 0 HB VAL A 161 4.014 -1.053 0.512 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.476 0.857 1.172 1.00 0.00 H new ATOM 0 HG12 VAL A 161 1.687 -0.734 1.301 1.00 0.00 H new ATOM 0 HG13 VAL A 161 2.272 0.091 2.766 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.811 1.136 1.396 1.00 0.00 H new ATOM 0 HG22 VAL A 161 4.825 0.436 3.032 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.904 -0.216 1.776 1.00 0.00 H new ATOM 669 N TYR A 162 5.184 -3.899 1.195 1.00 0.00 N ATOM 670 CA TYR A 162 6.402 -4.592 0.786 1.00 0.00 C ATOM 671 C TYR A 162 7.062 -3.827 -0.354 1.00 0.00 C ATOM 672 O TYR A 162 6.352 -3.413 -1.269 1.00 0.00 O ATOM 673 CB TYR A 162 6.082 -5.985 0.256 1.00 0.00 C ATOM 674 CG TYR A 162 5.551 -6.978 1.267 1.00 0.00 C ATOM 675 CD1 TYR A 162 6.473 -7.738 2.011 1.00 0.00 C ATOM 676 CD2 TYR A 162 4.167 -7.117 1.502 1.00 0.00 C ATOM 677 CE1 TYR A 162 6.026 -8.563 3.055 1.00 0.00 C ATOM 678 CE2 TYR A 162 3.716 -7.969 2.522 1.00 0.00 C ATOM 679 CZ TYR A 162 4.644 -8.678 3.321 1.00 0.00 C ATOM 680 OH TYR A 162 4.205 -9.452 4.351 1.00 0.00 O ATOM 0 H TYR A 162 4.338 -4.249 0.746 1.00 0.00 H new ATOM 0 HA TYR A 162 7.054 -4.659 1.657 1.00 0.00 H new ATOM 0 HB2 TYR A 162 5.350 -5.887 -0.545 1.00 0.00 H new ATOM 0 HB3 TYR A 162 6.987 -6.399 -0.188 1.00 0.00 H new ATOM 0 HD1 TYR A 162 7.526 -7.686 1.778 1.00 0.00 H new ATOM 0 HD2 TYR A 162 3.457 -6.570 0.899 1.00 0.00 H new ATOM 0 HE1 TYR A 162 6.739 -9.110 3.655 1.00 0.00 H new ATOM 0 HE2 TYR A 162 2.657 -8.084 2.698 1.00 0.00 H new ATOM 0 HH TYR A 162 3.226 -9.417 4.392 1.00 0.00 H new ATOM 690 N TYR A 163 8.390 -3.729 -0.381 1.00 0.00 N ATOM 691 CA TYR A 163 9.128 -3.051 -1.448 1.00 0.00 C ATOM 692 C TYR A 163 10.463 -3.760 -1.710 1.00 0.00 C ATOM 693 O TYR A 163 10.835 -4.666 -0.968 1.00 0.00 O ATOM 694 CB TYR A 163 9.314 -1.575 -1.060 1.00 0.00 C ATOM 695 CG TYR A 163 10.082 -1.325 0.231 1.00 0.00 C ATOM 696 CD1 TYR A 163 9.404 -1.217 1.465 1.00 0.00 C ATOM 697 CD2 TYR A 163 11.479 -1.145 0.192 1.00 0.00 C ATOM 698 CE1 TYR A 163 10.125 -0.994 2.654 1.00 0.00 C ATOM 699 CE2 TYR A 163 12.199 -0.879 1.370 1.00 0.00 C ATOM 700 CZ TYR A 163 11.524 -0.804 2.609 1.00 0.00 C ATOM 701 OH TYR A 163 12.215 -0.510 3.747 1.00 0.00 O ATOM 0 H TYR A 163 8.991 -4.122 0.344 1.00 0.00 H new ATOM 0 HA TYR A 163 8.567 -3.091 -2.382 1.00 0.00 H new ATOM 0 HB2 TYR A 163 9.831 -1.067 -1.874 1.00 0.00 H new ATOM 0 HB3 TYR A 163 8.330 -1.115 -0.971 1.00 0.00 H new ATOM 0 HD1 TYR A 163 8.328 -1.306 1.497 1.00 0.00 H new ATOM 0 HD2 TYR A 163 12.001 -1.212 -0.751 1.00 0.00 H new ATOM 0 HE1 TYR A 163 9.608 -0.968 3.602 1.00 0.00 H new ATOM 0 HE2 TYR A 163 13.268 -0.732 1.328 1.00 0.00 H new ATOM 0 HH TYR A 163 13.159 -0.366 3.528 1.00 0.00 H new ATOM 711 N ARG A 164 11.225 -3.364 -2.736 1.00 0.00 N ATOM 712 CA ARG A 164 12.623 -3.787 -2.901 1.00 0.00 C ATOM 713 C ARG A 164 13.518 -2.609 -2.572 1.00 0.00 C ATOM 714 O ARG A 164 13.225 -1.502 -3.033 1.00 0.00 O ATOM 715 CB ARG A 164 12.930 -4.211 -4.335 1.00 0.00 C ATOM 716 CG ARG A 164 12.657 -5.696 -4.597 1.00 0.00 C ATOM 717 CD ARG A 164 13.693 -6.673 -4.019 1.00 0.00 C ATOM 718 NE ARG A 164 15.078 -6.342 -4.413 1.00 0.00 N ATOM 719 CZ ARG A 164 16.171 -7.058 -4.120 1.00 0.00 C ATOM 720 NH1 ARG A 164 16.067 -8.304 -3.668 1.00 0.00 N ATOM 721 NH2 ARG A 164 17.375 -6.511 -4.270 1.00 0.00 N ATOM 0 H ARG A 164 10.893 -2.743 -3.474 1.00 0.00 H new ATOM 0 HA ARG A 164 12.795 -4.638 -2.242 1.00 0.00 H new ATOM 0 HB2 ARG A 164 12.331 -3.612 -5.020 1.00 0.00 H new ATOM 0 HB3 ARG A 164 13.976 -3.996 -4.555 1.00 0.00 H new ATOM 0 HG2 ARG A 164 11.679 -5.946 -4.185 1.00 0.00 H new ATOM 0 HG3 ARG A 164 12.598 -5.852 -5.674 1.00 0.00 H new ATOM 0 HD2 ARG A 164 13.620 -6.671 -2.931 1.00 0.00 H new ATOM 0 HD3 ARG A 164 13.457 -7.684 -4.352 1.00 0.00 H new ATOM 0 HE ARG A 164 15.214 -5.490 -4.958 1.00 0.00 H new ATOM 0 HH11 ARG A 164 15.147 -8.725 -3.541 1.00 0.00 H new ATOM 0 HH12 ARG A 164 16.907 -8.839 -3.449 1.00 0.00 H new ATOM 0 HH21 ARG A 164 17.461 -5.552 -4.606 1.00 0.00 H new ATOM 0 HH22 ARG A 164 18.212 -7.051 -4.049 1.00 0.00 H new ATOM 735 N PRO A 165 14.612 -2.827 -1.834 1.00 0.00 N ATOM 736 CA PRO A 165 15.374 -1.723 -1.305 1.00 0.00 C ATOM 737 C PRO A 165 16.085 -0.956 -2.421 1.00 0.00 C ATOM 738 O PRO A 165 16.508 -1.553 -3.422 1.00 0.00 O ATOM 739 CB PRO A 165 16.319 -2.333 -0.264 1.00 0.00 C ATOM 740 CG PRO A 165 16.473 -3.783 -0.721 1.00 0.00 C ATOM 741 CD PRO A 165 15.137 -4.105 -1.383 1.00 0.00 C ATOM 0 HA PRO A 165 14.745 -0.970 -0.830 1.00 0.00 H new ATOM 0 HB2 PRO A 165 17.278 -1.816 -0.242 1.00 0.00 H new ATOM 0 HB3 PRO A 165 15.901 -2.272 0.741 1.00 0.00 H new ATOM 0 HG2 PRO A 165 17.302 -3.895 -1.420 1.00 0.00 H new ATOM 0 HG3 PRO A 165 16.672 -4.447 0.120 1.00 0.00 H new ATOM 0 HD2 PRO A 165 15.268 -4.793 -2.218 1.00 0.00 H new ATOM 0 HD3 PRO A 165 14.455 -4.584 -0.680 1.00 0.00 H new ATOM 749 N VAL A 166 16.177 0.364 -2.250 1.00 0.00 N ATOM 750 CA VAL A 166 16.642 1.318 -3.247 1.00 0.00 C ATOM 751 C VAL A 166 18.119 1.116 -3.552 1.00 0.00 C ATOM 752 O VAL A 166 18.988 1.494 -2.759 1.00 0.00 O ATOM 753 CB VAL A 166 16.345 2.773 -2.828 1.00 0.00 C ATOM 754 CG1 VAL A 166 15.029 3.203 -3.461 1.00 0.00 C ATOM 755 CG2 VAL A 166 16.269 3.047 -1.320 1.00 0.00 C ATOM 0 H VAL A 166 15.917 0.813 -1.372 1.00 0.00 H new ATOM 0 HA VAL A 166 16.085 1.130 -4.165 1.00 0.00 H new ATOM 0 HB VAL A 166 17.203 3.346 -3.179 1.00 0.00 H new ATOM 0 HG11 VAL A 166 14.806 4.230 -3.174 1.00 0.00 H new ATOM 0 HG12 VAL A 166 15.109 3.139 -4.546 1.00 0.00 H new ATOM 0 HG13 VAL A 166 14.229 2.548 -3.117 1.00 0.00 H new ATOM 0 HG21 VAL A 166 16.055 4.103 -1.152 1.00 0.00 H new ATOM 0 HG22 VAL A 166 15.476 2.442 -0.880 1.00 0.00 H new ATOM 0 HG23 VAL A 166 17.221 2.791 -0.855 1.00 0.00 H new ATOM 765 N ASP A 167 18.403 0.532 -4.717 1.00 0.00 N ATOM 766 CA ASP A 167 19.767 0.424 -5.205 1.00 0.00 C ATOM 767 C ASP A 167 19.821 0.330 -6.714 1.00 0.00 C ATOM 768 O ASP A 167 20.485 1.151 -7.342 1.00 0.00 O ATOM 769 CB ASP A 167 20.482 -0.772 -4.573 1.00 0.00 C ATOM 770 CG ASP A 167 21.675 -0.338 -3.732 1.00 0.00 C ATOM 771 OD1 ASP A 167 22.495 0.469 -4.231 1.00 0.00 O ATOM 772 OD2 ASP A 167 21.824 -0.834 -2.596 1.00 0.00 O ATOM 0 H ASP A 167 17.701 0.128 -5.337 1.00 0.00 H new ATOM 0 HA ASP A 167 20.284 1.337 -4.910 1.00 0.00 H new ATOM 0 HB2 ASP A 167 19.781 -1.327 -3.950 1.00 0.00 H new ATOM 0 HB3 ASP A 167 20.818 -1.451 -5.357 1.00 0.00 H new ATOM 777 N GLN A 168 19.117 -0.642 -7.303 1.00 0.00 N ATOM 778 CA GLN A 168 19.029 -0.751 -8.752 1.00 0.00 C ATOM 779 C GLN A 168 17.773 -0.041 -9.241 1.00 0.00 C ATOM 780 O GLN A 168 17.838 0.880 -10.063 1.00 0.00 O ATOM 781 CB GLN A 168 19.026 -2.223 -9.213 1.00 0.00 C ATOM 782 CG GLN A 168 20.410 -2.893 -9.224 1.00 0.00 C ATOM 783 CD GLN A 168 20.664 -3.717 -7.973 1.00 0.00 C ATOM 784 OE1 GLN A 168 20.163 -4.828 -7.834 1.00 0.00 O ATOM 785 NE2 GLN A 168 21.442 -3.215 -7.032 1.00 0.00 N ATOM 0 H GLN A 168 18.602 -1.361 -6.794 1.00 0.00 H new ATOM 0 HA GLN A 168 19.910 -0.276 -9.184 1.00 0.00 H new ATOM 0 HB2 GLN A 168 18.366 -2.793 -8.559 1.00 0.00 H new ATOM 0 HB3 GLN A 168 18.604 -2.275 -10.217 1.00 0.00 H new ATOM 0 HG2 GLN A 168 20.493 -3.534 -10.101 1.00 0.00 H new ATOM 0 HG3 GLN A 168 21.181 -2.127 -9.314 1.00 0.00 H new ATOM 0 HE21 GLN A 168 21.856 -2.291 -7.152 1.00 0.00 H new ATOM 0 HE22 GLN A 168 21.629 -3.751 -6.185 1.00 0.00 H new ATOM 794 N ALA A 169 16.617 -0.539 -8.791 1.00 0.00 N ATOM 795 CA ALA A 169 15.349 -0.267 -9.454 1.00 0.00 C ATOM 796 C ALA A 169 14.892 1.179 -9.252 1.00 0.00 C ATOM 797 O ALA A 169 14.478 1.818 -10.219 1.00 0.00 O ATOM 798 CB ALA A 169 14.301 -1.253 -8.955 1.00 0.00 C ATOM 0 H ALA A 169 16.539 -1.134 -7.966 1.00 0.00 H new ATOM 0 HA ALA A 169 15.485 -0.397 -10.528 1.00 0.00 H new ATOM 0 HB1 ALA A 169 13.350 -1.054 -9.448 1.00 0.00 H new ATOM 0 HB2 ALA A 169 14.621 -2.270 -9.182 1.00 0.00 H new ATOM 0 HB3 ALA A 169 14.181 -1.142 -7.877 1.00 0.00 H new ATOM 804 N SER A 170 14.949 1.646 -8.000 1.00 0.00 N ATOM 805 CA SER A 170 14.882 3.009 -7.491 1.00 0.00 C ATOM 806 C SER A 170 14.159 4.008 -8.397 1.00 0.00 C ATOM 807 O SER A 170 14.793 4.874 -9.013 1.00 0.00 O ATOM 808 CB SER A 170 16.305 3.501 -7.141 1.00 0.00 C ATOM 809 OG SER A 170 17.171 2.469 -6.701 1.00 0.00 O ATOM 0 H SER A 170 15.057 0.989 -7.227 1.00 0.00 H new ATOM 0 HA SER A 170 14.263 2.965 -6.595 1.00 0.00 H new ATOM 0 HB2 SER A 170 16.741 3.980 -8.018 1.00 0.00 H new ATOM 0 HB3 SER A 170 16.236 4.262 -6.364 1.00 0.00 H new ATOM 0 HG SER A 170 18.053 2.846 -6.498 1.00 0.00 H new ATOM 815 N ASN A 171 12.823 3.921 -8.480 1.00 0.00 N ATOM 816 CA ASN A 171 12.057 4.853 -9.308 1.00 0.00 C ATOM 817 C ASN A 171 10.618 4.959 -8.815 1.00 0.00 C ATOM 818 O ASN A 171 10.042 3.964 -8.373 1.00 0.00 O ATOM 819 CB ASN A 171 12.091 4.329 -10.740 1.00 0.00 C ATOM 820 CG ASN A 171 11.429 5.238 -11.744 1.00 0.00 C ATOM 821 OD1 ASN A 171 11.277 6.437 -11.539 1.00 0.00 O ATOM 822 ND2 ASN A 171 10.978 4.677 -12.846 1.00 0.00 N ATOM 0 H ASN A 171 12.261 3.225 -7.990 1.00 0.00 H new ATOM 0 HA ASN A 171 12.493 5.851 -9.254 1.00 0.00 H new ATOM 0 HB2 ASN A 171 13.129 4.175 -11.035 1.00 0.00 H new ATOM 0 HB3 ASN A 171 11.603 3.355 -10.771 1.00 0.00 H new ATOM 0 HD21 ASN A 171 10.494 5.241 -13.544 1.00 0.00 H new ATOM 0 HD22 ASN A 171 11.113 3.678 -13.002 1.00 0.00 H new ATOM 829 N GLN A 172 9.993 6.119 -9.015 1.00 0.00 N ATOM 830 CA GLN A 172 8.648 6.441 -8.525 1.00 0.00 C ATOM 831 C GLN A 172 7.579 5.786 -9.406 1.00 0.00 C ATOM 832 O GLN A 172 6.413 5.726 -9.026 1.00 0.00 O ATOM 833 CB GLN A 172 8.446 7.971 -8.414 1.00 0.00 C ATOM 834 CG GLN A 172 7.083 8.343 -7.796 1.00 0.00 C ATOM 835 CD GLN A 172 6.954 9.806 -7.376 1.00 0.00 C ATOM 836 OE1 GLN A 172 6.953 10.708 -8.206 1.00 0.00 O ATOM 837 NE2 GLN A 172 6.766 10.068 -6.090 1.00 0.00 N ATOM 0 H GLN A 172 10.419 6.885 -9.537 1.00 0.00 H new ATOM 0 HA GLN A 172 8.542 6.031 -7.521 1.00 0.00 H new ATOM 0 HB2 GLN A 172 9.245 8.397 -7.807 1.00 0.00 H new ATOM 0 HB3 GLN A 172 8.526 8.418 -9.405 1.00 0.00 H new ATOM 0 HG2 GLN A 172 6.298 8.115 -8.517 1.00 0.00 H new ATOM 0 HG3 GLN A 172 6.909 7.712 -6.925 1.00 0.00 H new ATOM 0 HE21 GLN A 172 6.769 9.309 -5.409 1.00 0.00 H new ATOM 0 HE22 GLN A 172 6.618 11.029 -5.782 1.00 0.00 H new ATOM 846 N ASN A 173 7.958 5.249 -10.567 1.00 0.00 N ATOM 847 CA ASN A 173 7.112 4.296 -11.256 1.00 0.00 C ATOM 848 C ASN A 173 7.259 2.965 -10.544 1.00 0.00 C ATOM 849 O ASN A 173 6.315 2.455 -9.952 1.00 0.00 O ATOM 850 CB ASN A 173 7.521 4.131 -12.723 1.00 0.00 C ATOM 851 CG ASN A 173 6.455 4.631 -13.661 1.00 0.00 C ATOM 852 OD1 ASN A 173 5.595 3.867 -14.088 1.00 0.00 O ATOM 853 ND2 ASN A 173 6.532 5.893 -14.030 1.00 0.00 N ATOM 0 H ASN A 173 8.837 5.460 -11.039 1.00 0.00 H new ATOM 0 HA ASN A 173 6.082 4.652 -11.242 1.00 0.00 H new ATOM 0 HB2 ASN A 173 8.449 4.674 -12.905 1.00 0.00 H new ATOM 0 HB3 ASN A 173 7.721 3.079 -12.928 1.00 0.00 H new ATOM 0 HD21 ASN A 173 5.859 6.271 -14.697 1.00 0.00 H new ATOM 0 HD22 ASN A 173 7.264 6.492 -13.649 1.00 0.00 H new ATOM 860 N ASN A 174 8.449 2.363 -10.661 1.00 0.00 N ATOM 861 CA ASN A 174 8.501 0.911 -10.602 1.00 0.00 C ATOM 862 C ASN A 174 8.558 0.409 -9.168 1.00 0.00 C ATOM 863 O ASN A 174 7.971 -0.632 -8.886 1.00 0.00 O ATOM 864 CB ASN A 174 9.620 0.353 -11.488 1.00 0.00 C ATOM 865 CG ASN A 174 10.954 0.172 -10.777 1.00 0.00 C ATOM 866 OD1 ASN A 174 11.119 -0.680 -9.911 1.00 0.00 O ATOM 867 ND2 ASN A 174 11.923 0.990 -11.136 1.00 0.00 N ATOM 0 H ASN A 174 9.343 2.836 -10.791 1.00 0.00 H new ATOM 0 HA ASN A 174 7.570 0.524 -11.015 1.00 0.00 H new ATOM 0 HB2 ASN A 174 9.303 -0.609 -11.890 1.00 0.00 H new ATOM 0 HB3 ASN A 174 9.762 1.022 -12.337 1.00 0.00 H new ATOM 0 HD21 ASN A 174 12.838 0.923 -10.690 1.00 0.00 H new ATOM 0 HD22 ASN A 174 11.758 1.690 -11.860 1.00 0.00 H new ATOM 874 N PHE A 175 9.188 1.170 -8.262 1.00 0.00 N ATOM 875 CA PHE A 175 9.157 0.862 -6.838 1.00 0.00 C ATOM 876 C PHE A 175 7.690 0.882 -6.417 1.00 0.00 C ATOM 877 O PHE A 175 7.184 -0.096 -5.881 1.00 0.00 O ATOM 878 CB PHE A 175 10.021 1.871 -6.049 1.00 0.00 C ATOM 879 CG PHE A 175 10.144 1.647 -4.548 1.00 0.00 C ATOM 880 CD1 PHE A 175 9.052 1.905 -3.695 1.00 0.00 C ATOM 881 CD2 PHE A 175 11.388 1.306 -3.979 1.00 0.00 C ATOM 882 CE1 PHE A 175 9.207 1.846 -2.299 1.00 0.00 C ATOM 883 CE2 PHE A 175 11.543 1.250 -2.581 1.00 0.00 C ATOM 884 CZ PHE A 175 10.456 1.536 -1.739 1.00 0.00 C ATOM 0 H PHE A 175 9.725 2.004 -8.498 1.00 0.00 H new ATOM 0 HA PHE A 175 9.582 -0.119 -6.625 1.00 0.00 H new ATOM 0 HB2 PHE A 175 11.024 1.866 -6.476 1.00 0.00 H new ATOM 0 HB3 PHE A 175 9.611 2.868 -6.211 1.00 0.00 H new ATOM 0 HD1 PHE A 175 8.089 2.150 -4.117 1.00 0.00 H new ATOM 0 HD2 PHE A 175 12.228 1.086 -4.621 1.00 0.00 H new ATOM 0 HE1 PHE A 175 8.362 2.040 -1.655 1.00 0.00 H new ATOM 0 HE2 PHE A 175 12.500 0.987 -2.155 1.00 0.00 H new ATOM 0 HZ PHE A 175 10.581 1.517 -0.666 1.00 0.00 H new ATOM 894 N VAL A 176 6.996 1.988 -6.703 1.00 0.00 N ATOM 895 CA VAL A 176 5.613 2.223 -6.315 1.00 0.00 C ATOM 896 C VAL A 176 4.694 1.134 -6.884 1.00 0.00 C ATOM 897 O VAL A 176 3.876 0.589 -6.144 1.00 0.00 O ATOM 898 CB VAL A 176 5.215 3.642 -6.776 1.00 0.00 C ATOM 899 CG1 VAL A 176 3.735 3.961 -6.513 1.00 0.00 C ATOM 900 CG2 VAL A 176 6.057 4.693 -6.025 1.00 0.00 C ATOM 0 H VAL A 176 7.399 2.765 -7.227 1.00 0.00 H new ATOM 0 HA VAL A 176 5.505 2.168 -5.232 1.00 0.00 H new ATOM 0 HB VAL A 176 5.394 3.675 -7.851 1.00 0.00 H new ATOM 0 HG11 VAL A 176 3.514 4.971 -6.858 1.00 0.00 H new ATOM 0 HG12 VAL A 176 3.108 3.249 -7.050 1.00 0.00 H new ATOM 0 HG13 VAL A 176 3.532 3.889 -5.445 1.00 0.00 H new ATOM 0 HG21 VAL A 176 5.771 5.692 -6.355 1.00 0.00 H new ATOM 0 HG22 VAL A 176 5.882 4.601 -4.953 1.00 0.00 H new ATOM 0 HG23 VAL A 176 7.114 4.530 -6.235 1.00 0.00 H new ATOM 910 N HIS A 177 4.802 0.828 -8.180 1.00 0.00 N ATOM 911 CA HIS A 177 3.934 -0.123 -8.854 1.00 0.00 C ATOM 912 C HIS A 177 4.141 -1.518 -8.250 1.00 0.00 C ATOM 913 O HIS A 177 3.188 -2.098 -7.738 1.00 0.00 O ATOM 914 CB HIS A 177 4.161 -0.065 -10.381 1.00 0.00 C ATOM 915 CG HIS A 177 3.071 -0.708 -11.217 1.00 0.00 C ATOM 916 ND1 HIS A 177 2.191 -1.676 -10.809 1.00 0.00 N flip ATOM 917 CD2 HIS A 177 2.736 -0.383 -12.520 1.00 0.00 C flip ATOM 918 CE1 HIS A 177 1.322 -1.941 -11.863 1.00 0.00 C flip ATOM 919 NE2 HIS A 177 1.703 -1.164 -12.887 1.00 0.00 N flip ATOM 0 H HIS A 177 5.505 1.242 -8.792 1.00 0.00 H new ATOM 0 HA HIS A 177 2.887 0.136 -8.698 1.00 0.00 H new ATOM 0 HB2 HIS A 177 4.258 0.979 -10.679 1.00 0.00 H new ATOM 0 HB3 HIS A 177 5.109 -0.552 -10.611 1.00 0.00 H new ATOM 0 HD2 HIS A 177 3.218 0.364 -13.133 1.00 0.00 H new ATOM 0 HE1 HIS A 177 0.498 -2.639 -11.857 1.00 0.00 H new ATOM 0 HE2 HIS A 177 1.272 -1.165 -13.811 1.00 0.00 H new ATOM 927 N ASP A 178 5.361 -2.057 -8.283 1.00 0.00 N ATOM 928 CA ASP A 178 5.683 -3.407 -7.806 1.00 0.00 C ATOM 929 C ASP A 178 5.353 -3.586 -6.318 1.00 0.00 C ATOM 930 O ASP A 178 4.922 -4.657 -5.882 1.00 0.00 O ATOM 931 CB ASP A 178 7.176 -3.668 -8.068 1.00 0.00 C ATOM 932 CG ASP A 178 7.569 -5.144 -7.990 1.00 0.00 C ATOM 933 OD1 ASP A 178 6.718 -6.023 -8.217 1.00 0.00 O ATOM 934 OD2 ASP A 178 8.780 -5.431 -7.813 1.00 0.00 O ATOM 0 H ASP A 178 6.172 -1.558 -8.650 1.00 0.00 H new ATOM 0 HA ASP A 178 5.072 -4.129 -8.347 1.00 0.00 H new ATOM 0 HB2 ASP A 178 7.434 -3.285 -9.055 1.00 0.00 H new ATOM 0 HB3 ASP A 178 7.766 -3.106 -7.344 1.00 0.00 H new ATOM 939 N CYS A 179 5.497 -2.506 -5.548 1.00 0.00 N ATOM 940 CA CYS A 179 5.041 -2.366 -4.172 1.00 0.00 C ATOM 941 C CYS A 179 3.533 -2.567 -4.074 1.00 0.00 C ATOM 942 O CYS A 179 3.114 -3.535 -3.440 1.00 0.00 O ATOM 943 CB CYS A 179 5.528 -1.018 -3.639 1.00 0.00 C ATOM 944 SG CYS A 179 5.302 -0.673 -1.895 1.00 0.00 S ATOM 0 H CYS A 179 5.960 -1.664 -5.889 1.00 0.00 H new ATOM 0 HA CYS A 179 5.467 -3.144 -3.539 1.00 0.00 H new ATOM 0 HB2 CYS A 179 6.592 -0.936 -3.861 1.00 0.00 H new ATOM 0 HB3 CYS A 179 5.023 -0.234 -4.203 1.00 0.00 H new ATOM 949 N VAL A 180 2.726 -1.693 -4.689 1.00 0.00 N ATOM 950 CA VAL A 180 1.268 -1.816 -4.710 1.00 0.00 C ATOM 951 C VAL A 180 0.875 -3.216 -5.152 1.00 0.00 C ATOM 952 O VAL A 180 0.141 -3.859 -4.408 1.00 0.00 O ATOM 953 CB VAL A 180 0.648 -0.680 -5.551 1.00 0.00 C ATOM 954 CG1 VAL A 180 -0.809 -0.952 -5.936 1.00 0.00 C ATOM 955 CG2 VAL A 180 0.666 0.619 -4.733 1.00 0.00 C ATOM 0 H VAL A 180 3.073 -0.875 -5.189 1.00 0.00 H new ATOM 0 HA VAL A 180 0.858 -1.693 -3.708 1.00 0.00 H new ATOM 0 HB VAL A 180 1.241 -0.606 -6.462 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.191 -0.119 -6.526 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -0.865 -1.869 -6.523 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.409 -1.062 -5.033 1.00 0.00 H new ATOM 0 HG21 VAL A 180 0.229 1.426 -5.322 1.00 0.00 H new ATOM 0 HG22 VAL A 180 0.087 0.482 -3.820 1.00 0.00 H new ATOM 0 HG23 VAL A 180 1.694 0.873 -4.476 1.00 0.00 H new ATOM 965 N ASN A 181 1.397 -3.702 -6.282 1.00 0.00 N ATOM 966 CA ASN A 181 1.109 -5.025 -6.820 1.00 0.00 C ATOM 967 C ASN A 181 1.242 -6.077 -5.741 1.00 0.00 C ATOM 968 O ASN A 181 0.299 -6.836 -5.538 1.00 0.00 O ATOM 969 CB ASN A 181 2.066 -5.401 -7.961 1.00 0.00 C ATOM 970 CG ASN A 181 1.622 -4.917 -9.323 1.00 0.00 C ATOM 971 OD1 ASN A 181 0.439 -4.710 -9.588 1.00 0.00 O ATOM 972 ND2 ASN A 181 2.577 -4.742 -10.213 1.00 0.00 N ATOM 0 H ASN A 181 2.048 -3.169 -6.859 1.00 0.00 H new ATOM 0 HA ASN A 181 0.089 -4.989 -7.201 1.00 0.00 H new ATOM 0 HB2 ASN A 181 3.052 -4.990 -7.745 1.00 0.00 H new ATOM 0 HB3 ASN A 181 2.172 -6.485 -7.989 1.00 0.00 H new ATOM 0 HD21 ASN A 181 2.345 -4.426 -11.155 1.00 0.00 H new ATOM 0 HD22 ASN A 181 3.549 -4.923 -9.961 1.00 0.00 H new ATOM 979 N ILE A 182 2.400 -6.146 -5.081 1.00 0.00 N ATOM 980 CA ILE A 182 2.657 -7.127 -4.045 1.00 0.00 C ATOM 981 C ILE A 182 1.696 -6.938 -2.879 1.00 0.00 C ATOM 982 O ILE A 182 1.085 -7.921 -2.473 1.00 0.00 O ATOM 983 CB ILE A 182 4.138 -7.072 -3.602 1.00 0.00 C ATOM 984 CG1 ILE A 182 5.127 -7.877 -4.474 1.00 0.00 C ATOM 985 CG2 ILE A 182 4.329 -7.546 -2.163 1.00 0.00 C ATOM 986 CD1 ILE A 182 4.608 -9.216 -5.008 1.00 0.00 C ATOM 0 H ILE A 182 3.184 -5.517 -5.257 1.00 0.00 H new ATOM 0 HA ILE A 182 2.479 -8.124 -4.447 1.00 0.00 H new ATOM 0 HB ILE A 182 4.373 -6.013 -3.714 1.00 0.00 H new ATOM 0 HG12 ILE A 182 5.421 -7.258 -5.322 1.00 0.00 H new ATOM 0 HG13 ILE A 182 6.028 -8.065 -3.889 1.00 0.00 H new ATOM 0 HG21 ILE A 182 5.385 -7.489 -1.898 1.00 0.00 H new ATOM 0 HG22 ILE A 182 3.752 -6.911 -1.491 1.00 0.00 H new ATOM 0 HG23 ILE A 182 3.987 -8.577 -2.071 1.00 0.00 H new ATOM 0 HD11 ILE A 182 5.384 -9.695 -5.606 1.00 0.00 H new ATOM 0 HD12 ILE A 182 4.343 -9.863 -4.172 1.00 0.00 H new ATOM 0 HD13 ILE A 182 3.727 -9.044 -5.627 1.00 0.00 H new ATOM 998 N THR A 183 1.615 -5.750 -2.283 1.00 0.00 N ATOM 999 CA THR A 183 0.879 -5.568 -1.039 1.00 0.00 C ATOM 1000 C THR A 183 -0.595 -5.911 -1.286 1.00 0.00 C ATOM 1001 O THR A 183 -1.209 -6.667 -0.535 1.00 0.00 O ATOM 1002 CB THR A 183 1.112 -4.138 -0.541 1.00 0.00 C ATOM 1003 OG1 THR A 183 2.500 -3.863 -0.457 1.00 0.00 O ATOM 1004 CG2 THR A 183 0.515 -3.909 0.841 1.00 0.00 C ATOM 0 H THR A 183 2.051 -4.901 -2.643 1.00 0.00 H new ATOM 0 HA THR A 183 1.226 -6.236 -0.251 1.00 0.00 H new ATOM 0 HB THR A 183 0.625 -3.479 -1.259 1.00 0.00 H new ATOM 0 HG1 THR A 183 2.843 -3.636 -1.347 1.00 0.00 H new ATOM 0 HG21 THR A 183 0.704 -2.882 1.154 1.00 0.00 H new ATOM 0 HG22 THR A 183 -0.560 -4.086 0.807 1.00 0.00 H new ATOM 0 HG23 THR A 183 0.973 -4.595 1.553 1.00 0.00 H new ATOM 1012 N ILE A 184 -1.136 -5.485 -2.424 1.00 0.00 N ATOM 1013 CA ILE A 184 -2.425 -5.936 -2.910 1.00 0.00 C ATOM 1014 C ILE A 184 -2.448 -7.455 -2.991 1.00 0.00 C ATOM 1015 O ILE A 184 -3.317 -8.060 -2.375 1.00 0.00 O ATOM 1016 CB ILE A 184 -2.728 -5.217 -4.233 1.00 0.00 C ATOM 1017 CG1 ILE A 184 -3.226 -3.819 -3.816 1.00 0.00 C ATOM 1018 CG2 ILE A 184 -3.658 -5.989 -5.168 1.00 0.00 C ATOM 1019 CD1 ILE A 184 -3.684 -2.928 -4.947 1.00 0.00 C ATOM 0 H ILE A 184 -0.682 -4.809 -3.038 1.00 0.00 H new ATOM 0 HA ILE A 184 -3.229 -5.676 -2.222 1.00 0.00 H new ATOM 0 HB ILE A 184 -1.841 -5.137 -4.861 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -4.052 -3.941 -3.115 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -2.424 -3.312 -3.279 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -3.820 -5.412 -6.078 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -3.205 -6.947 -5.422 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -4.613 -6.160 -4.672 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -4.014 -1.970 -4.545 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -2.858 -2.766 -5.640 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.511 -3.404 -5.473 1.00 0.00 H new ATOM 1031 N LYS A 185 -1.507 -8.095 -3.683 1.00 0.00 N ATOM 1032 CA LYS A 185 -1.467 -9.548 -3.828 1.00 0.00 C ATOM 1033 C LYS A 185 -1.522 -10.267 -2.483 1.00 0.00 C ATOM 1034 O LYS A 185 -2.094 -11.349 -2.381 1.00 0.00 O ATOM 1035 CB LYS A 185 -0.215 -9.944 -4.614 1.00 0.00 C ATOM 1036 CG LYS A 185 -0.444 -11.241 -5.381 1.00 0.00 C ATOM 1037 CD LYS A 185 0.712 -11.475 -6.363 1.00 0.00 C ATOM 1038 CE LYS A 185 0.356 -12.457 -7.488 1.00 0.00 C ATOM 1039 NZ LYS A 185 0.185 -13.839 -7.004 1.00 0.00 N ATOM 0 H LYS A 185 -0.745 -7.615 -4.162 1.00 0.00 H new ATOM 0 HA LYS A 185 -2.355 -9.860 -4.378 1.00 0.00 H new ATOM 0 HB2 LYS A 185 0.050 -9.147 -5.309 1.00 0.00 H new ATOM 0 HB3 LYS A 185 0.626 -10.064 -3.931 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -0.518 -12.077 -4.686 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -1.389 -11.192 -5.922 1.00 0.00 H new ATOM 0 HD2 LYS A 185 1.008 -10.522 -6.801 1.00 0.00 H new ATOM 0 HD3 LYS A 185 1.574 -11.856 -5.816 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -0.564 -12.130 -7.973 1.00 0.00 H new ATOM 0 HE3 LYS A 185 1.140 -12.436 -8.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 -0.054 -14.460 -7.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 1.070 -14.165 -6.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 -0.581 -13.868 -6.302 1.00 0.00 H new ATOM 1053 N GLN A 186 -0.955 -9.672 -1.439 1.00 0.00 N ATOM 1054 CA GLN A 186 -0.927 -10.202 -0.100 1.00 0.00 C ATOM 1055 C GLN A 186 -2.348 -10.081 0.438 1.00 0.00 C ATOM 1056 O GLN A 186 -2.965 -11.095 0.761 1.00 0.00 O ATOM 1057 CB GLN A 186 0.176 -9.476 0.711 1.00 0.00 C ATOM 1058 CG GLN A 186 1.582 -9.862 0.248 1.00 0.00 C ATOM 1059 CD GLN A 186 1.808 -11.358 0.264 1.00 0.00 C ATOM 1060 OE1 GLN A 186 1.564 -12.031 1.258 1.00 0.00 O ATOM 1061 NE2 GLN A 186 2.276 -11.906 -0.839 1.00 0.00 N ATOM 0 H GLN A 186 -0.485 -8.770 -1.517 1.00 0.00 H new ATOM 0 HA GLN A 186 -0.651 -11.255 -0.039 1.00 0.00 H new ATOM 0 HB2 GLN A 186 0.046 -8.398 0.614 1.00 0.00 H new ATOM 0 HB3 GLN A 186 0.065 -9.716 1.768 1.00 0.00 H new ATOM 0 HG2 GLN A 186 1.745 -9.484 -0.761 1.00 0.00 H new ATOM 0 HG3 GLN A 186 2.318 -9.380 0.892 1.00 0.00 H new ATOM 0 HE21 GLN A 186 2.472 -11.325 -1.654 1.00 0.00 H new ATOM 0 HE22 GLN A 186 2.443 -12.912 -0.878 1.00 0.00 H new ATOM 1070 N HIS A 187 -2.954 -8.898 0.381 1.00 0.00 N ATOM 1071 CA HIS A 187 -4.296 -8.691 0.894 1.00 0.00 C ATOM 1072 C HIS A 187 -5.377 -9.400 0.068 1.00 0.00 C ATOM 1073 O HIS A 187 -6.501 -9.590 0.533 1.00 0.00 O ATOM 1074 CB HIS A 187 -4.547 -7.188 1.045 1.00 0.00 C ATOM 1075 CG HIS A 187 -4.658 -6.816 2.502 1.00 0.00 C ATOM 1076 ND1 HIS A 187 -5.684 -6.145 3.130 1.00 0.00 N ATOM 1077 CD2 HIS A 187 -3.757 -7.187 3.463 1.00 0.00 C ATOM 1078 CE1 HIS A 187 -5.378 -6.094 4.441 1.00 0.00 C ATOM 1079 NE2 HIS A 187 -4.202 -6.691 4.684 1.00 0.00 N ATOM 0 H HIS A 187 -2.527 -8.063 -0.021 1.00 0.00 H new ATOM 0 HA HIS A 187 -4.365 -9.158 1.877 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -3.734 -6.629 0.582 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -5.463 -6.912 0.522 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -2.858 -7.764 3.302 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -5.998 -5.633 5.196 1.00 0.00 H new ATOM 0 HE2 HIS A 187 -3.728 -6.766 5.584 1.00 0.00 H new ATOM 1087 N THR A 188 -5.038 -9.884 -1.121 1.00 0.00 N ATOM 1088 CA THR A 188 -5.978 -10.326 -2.146 1.00 0.00 C ATOM 1089 C THR A 188 -5.757 -11.806 -2.464 1.00 0.00 C ATOM 1090 O THR A 188 -6.408 -12.386 -3.332 1.00 0.00 O ATOM 1091 CB THR A 188 -5.867 -9.377 -3.350 1.00 0.00 C ATOM 1092 OG1 THR A 188 -5.873 -8.035 -2.903 1.00 0.00 O ATOM 1093 CG2 THR A 188 -7.028 -9.467 -4.325 1.00 0.00 C ATOM 0 H THR A 188 -4.065 -9.983 -1.409 1.00 0.00 H new ATOM 0 HA THR A 188 -7.010 -10.269 -1.800 1.00 0.00 H new ATOM 0 HB THR A 188 -4.946 -9.675 -3.851 1.00 0.00 H new ATOM 0 HG1 THR A 188 -4.951 -7.718 -2.808 1.00 0.00 H new ATOM 0 HG21 THR A 188 -6.871 -8.765 -5.144 1.00 0.00 H new ATOM 0 HG22 THR A 188 -7.092 -10.480 -4.722 1.00 0.00 H new ATOM 0 HG23 THR A 188 -7.956 -9.220 -3.809 1.00 0.00 H new ATOM 1101 N VAL A 189 -4.864 -12.454 -1.720 1.00 0.00 N ATOM 1102 CA VAL A 189 -4.717 -13.896 -1.737 1.00 0.00 C ATOM 1103 C VAL A 189 -4.371 -14.383 -0.349 1.00 0.00 C ATOM 1104 O VAL A 189 -5.068 -15.222 0.199 1.00 0.00 O ATOM 1105 CB VAL A 189 -3.706 -14.298 -2.830 1.00 0.00 C ATOM 1106 CG1 VAL A 189 -2.254 -14.574 -2.417 1.00 0.00 C ATOM 1107 CG2 VAL A 189 -4.282 -15.507 -3.563 1.00 0.00 C ATOM 0 H VAL A 189 -4.219 -11.983 -1.085 1.00 0.00 H new ATOM 0 HA VAL A 189 -5.653 -14.388 -2.002 1.00 0.00 H new ATOM 0 HB VAL A 189 -3.598 -13.409 -3.452 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -1.670 -14.844 -3.297 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -1.829 -13.680 -1.960 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -2.229 -15.394 -1.700 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -3.592 -15.821 -4.346 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -4.426 -16.325 -2.858 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -5.240 -15.240 -4.009 1.00 0.00 H new ATOM 1117 N THR A 190 -3.350 -13.797 0.264 1.00 0.00 N ATOM 1118 CA THR A 190 -2.868 -14.267 1.567 1.00 0.00 C ATOM 1119 C THR A 190 -3.851 -13.948 2.716 1.00 0.00 C ATOM 1120 O THR A 190 -3.724 -14.504 3.809 1.00 0.00 O ATOM 1121 CB THR A 190 -1.421 -13.759 1.729 1.00 0.00 C ATOM 1122 OG1 THR A 190 -0.599 -14.544 0.874 1.00 0.00 O ATOM 1123 CG2 THR A 190 -0.821 -13.792 3.128 1.00 0.00 C ATOM 0 H THR A 190 -2.839 -12.999 -0.114 1.00 0.00 H new ATOM 0 HA THR A 190 -2.834 -15.355 1.618 1.00 0.00 H new ATOM 0 HB THR A 190 -1.461 -12.699 1.479 1.00 0.00 H new ATOM 0 HG1 THR A 190 0.331 -14.246 0.951 1.00 0.00 H new ATOM 0 HG21 THR A 190 0.198 -13.407 3.096 1.00 0.00 H new ATOM 0 HG22 THR A 190 -1.421 -13.174 3.796 1.00 0.00 H new ATOM 0 HG23 THR A 190 -0.810 -14.818 3.495 1.00 0.00 H new ATOM 1131 N THR A 191 -4.877 -13.151 2.427 1.00 0.00 N ATOM 1132 CA THR A 191 -5.821 -12.557 3.365 1.00 0.00 C ATOM 1133 C THR A 191 -7.239 -12.893 2.865 1.00 0.00 C ATOM 1134 O THR A 191 -7.997 -13.574 3.549 1.00 0.00 O ATOM 1135 CB THR A 191 -5.454 -11.061 3.379 1.00 0.00 C ATOM 1136 OG1 THR A 191 -4.127 -10.866 3.839 1.00 0.00 O ATOM 1137 CG2 THR A 191 -6.375 -10.066 4.062 1.00 0.00 C ATOM 0 H THR A 191 -5.083 -12.886 1.464 1.00 0.00 H new ATOM 0 HA THR A 191 -5.784 -12.926 4.390 1.00 0.00 H new ATOM 0 HB THR A 191 -5.579 -10.815 2.324 1.00 0.00 H new ATOM 0 HG1 THR A 191 -3.510 -10.889 3.078 1.00 0.00 H new ATOM 0 HG21 THR A 191 -5.958 -9.063 3.972 1.00 0.00 H new ATOM 0 HG22 THR A 191 -7.356 -10.094 3.589 1.00 0.00 H new ATOM 0 HG23 THR A 191 -6.473 -10.325 5.116 1.00 0.00 H new ATOM 1145 N THR A 192 -7.568 -12.556 1.612 1.00 0.00 N ATOM 1146 CA THR A 192 -8.847 -12.847 0.937 1.00 0.00 C ATOM 1147 C THR A 192 -9.150 -14.346 0.690 1.00 0.00 C ATOM 1148 O THR A 192 -10.159 -14.718 0.089 1.00 0.00 O ATOM 1149 CB THR A 192 -8.835 -12.019 -0.348 1.00 0.00 C ATOM 1150 OG1 THR A 192 -8.865 -10.660 0.012 1.00 0.00 O ATOM 1151 CG2 THR A 192 -10.007 -12.186 -1.304 1.00 0.00 C ATOM 0 H THR A 192 -6.921 -12.048 1.009 1.00 0.00 H new ATOM 0 HA THR A 192 -9.671 -12.570 1.595 1.00 0.00 H new ATOM 0 HB THR A 192 -7.945 -12.370 -0.870 1.00 0.00 H new ATOM 0 HG1 THR A 192 -8.026 -10.421 0.458 1.00 0.00 H new ATOM 0 HG21 THR A 192 -9.865 -11.539 -2.170 1.00 0.00 H new ATOM 0 HG22 THR A 192 -10.064 -13.224 -1.632 1.00 0.00 H new ATOM 0 HG23 THR A 192 -10.932 -11.914 -0.796 1.00 0.00 H new ATOM 1159 N THR A 193 -8.287 -15.235 1.157 1.00 0.00 N ATOM 1160 CA THR A 193 -8.509 -16.683 1.163 1.00 0.00 C ATOM 1161 C THR A 193 -8.684 -17.214 2.596 1.00 0.00 C ATOM 1162 O THR A 193 -8.921 -18.399 2.812 1.00 0.00 O ATOM 1163 CB THR A 193 -7.389 -17.334 0.329 1.00 0.00 C ATOM 1164 OG1 THR A 193 -7.899 -18.374 -0.477 1.00 0.00 O ATOM 1165 CG2 THR A 193 -6.204 -17.807 1.172 1.00 0.00 C ATOM 0 H THR A 193 -7.386 -14.968 1.554 1.00 0.00 H new ATOM 0 HA THR A 193 -9.451 -16.955 0.687 1.00 0.00 H new ATOM 0 HB THR A 193 -6.997 -16.554 -0.323 1.00 0.00 H new ATOM 0 HG1 THR A 193 -7.170 -18.771 -0.998 1.00 0.00 H new ATOM 0 HG21 THR A 193 -5.452 -18.255 0.523 1.00 0.00 H new ATOM 0 HG22 THR A 193 -5.769 -16.957 1.698 1.00 0.00 H new ATOM 0 HG23 THR A 193 -6.545 -18.546 1.897 1.00 0.00 H new ATOM 1173 N LYS A 194 -8.594 -16.327 3.583 1.00 0.00 N ATOM 1174 CA LYS A 194 -8.728 -16.565 4.991 1.00 0.00 C ATOM 1175 C LYS A 194 -10.053 -15.961 5.413 1.00 0.00 C ATOM 1176 O LYS A 194 -11.104 -16.573 5.250 1.00 0.00 O ATOM 1177 CB LYS A 194 -7.459 -16.090 5.717 1.00 0.00 C ATOM 1178 CG LYS A 194 -6.229 -16.884 5.244 1.00 0.00 C ATOM 1179 CD LYS A 194 -5.165 -17.057 6.329 1.00 0.00 C ATOM 1180 CE LYS A 194 -4.615 -15.718 6.825 1.00 0.00 C ATOM 1181 NZ LYS A 194 -3.245 -15.846 7.362 1.00 0.00 N ATOM 0 H LYS A 194 -8.409 -15.343 3.386 1.00 0.00 H new ATOM 0 HA LYS A 194 -8.782 -17.617 5.269 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -7.305 -15.027 5.531 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -7.584 -16.211 6.793 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -6.550 -17.867 4.900 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -5.785 -16.376 4.388 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -5.592 -17.605 7.169 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -4.346 -17.661 5.938 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -4.617 -14.999 6.005 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -5.272 -15.321 7.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -2.911 -14.916 7.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -3.246 -16.512 8.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -2.612 -16.200 6.617 1.00 0.00 H new ATOM 1195 N GLY A 195 -9.987 -14.802 6.038 1.00 0.00 N ATOM 1196 CA GLY A 195 -11.116 -14.121 6.664 1.00 0.00 C ATOM 1197 C GLY A 195 -11.492 -12.824 5.979 1.00 0.00 C ATOM 1198 O GLY A 195 -12.142 -11.981 6.600 1.00 0.00 O ATOM 0 H GLY A 195 -9.113 -14.284 6.130 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -11.979 -14.787 6.662 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -10.874 -13.915 7.707 1.00 0.00 H new ATOM 1202 N GLU A 196 -11.068 -12.616 4.735 1.00 0.00 N ATOM 1203 CA GLU A 196 -11.393 -11.409 3.999 1.00 0.00 C ATOM 1204 C GLU A 196 -12.031 -11.785 2.678 1.00 0.00 C ATOM 1205 O GLU A 196 -11.846 -12.906 2.197 1.00 0.00 O ATOM 1206 CB GLU A 196 -10.117 -10.582 3.797 1.00 0.00 C ATOM 1207 CG GLU A 196 -9.696 -9.803 5.055 1.00 0.00 C ATOM 1208 CD GLU A 196 -9.161 -10.614 6.262 1.00 0.00 C ATOM 1209 OE1 GLU A 196 -8.442 -11.637 6.126 1.00 0.00 O ATOM 1210 OE2 GLU A 196 -9.433 -10.194 7.414 1.00 0.00 O ATOM 0 H GLU A 196 -10.493 -13.279 4.216 1.00 0.00 H new ATOM 0 HA GLU A 196 -12.106 -10.801 4.557 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -9.305 -11.245 3.499 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -10.272 -9.880 2.978 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -8.926 -9.088 4.764 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -10.556 -9.225 5.394 1.00 0.00 H new ATOM 1217 N ASN A 197 -12.757 -10.834 2.087 1.00 0.00 N ATOM 1218 CA ASN A 197 -13.202 -10.911 0.711 1.00 0.00 C ATOM 1219 C ASN A 197 -13.576 -9.522 0.217 1.00 0.00 C ATOM 1220 O ASN A 197 -14.748 -9.137 0.234 1.00 0.00 O ATOM 1221 CB ASN A 197 -14.331 -11.926 0.532 1.00 0.00 C ATOM 1222 CG ASN A 197 -14.338 -12.440 -0.899 1.00 0.00 C ATOM 1223 OD1 ASN A 197 -13.967 -13.582 -1.146 1.00 0.00 O ATOM 1224 ND2 ASN A 197 -14.670 -11.621 -1.882 1.00 0.00 N ATOM 0 H ASN A 197 -13.051 -9.982 2.564 1.00 0.00 H new ATOM 0 HA ASN A 197 -12.381 -11.278 0.095 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -14.200 -12.756 1.226 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -15.289 -11.463 0.767 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -14.618 -11.939 -2.850 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -14.978 -10.672 -1.673 1.00 0.00 H new ATOM 1231 N PHE A 198 -12.548 -8.789 -0.206 1.00 0.00 N ATOM 1232 CA PHE A 198 -12.665 -7.510 -0.908 1.00 0.00 C ATOM 1233 C PHE A 198 -13.425 -7.694 -2.243 1.00 0.00 C ATOM 1234 O PHE A 198 -13.900 -8.790 -2.566 1.00 0.00 O ATOM 1235 CB PHE A 198 -11.252 -6.903 -1.073 1.00 0.00 C ATOM 1236 CG PHE A 198 -10.526 -6.616 0.240 1.00 0.00 C ATOM 1237 CD1 PHE A 198 -10.837 -5.490 1.029 1.00 0.00 C ATOM 1238 CD2 PHE A 198 -9.537 -7.504 0.700 1.00 0.00 C ATOM 1239 CE1 PHE A 198 -10.191 -5.282 2.260 1.00 0.00 C ATOM 1240 CE2 PHE A 198 -8.899 -7.313 1.933 1.00 0.00 C ATOM 1241 CZ PHE A 198 -9.238 -6.205 2.720 1.00 0.00 C ATOM 0 H PHE A 198 -11.580 -9.077 -0.066 1.00 0.00 H new ATOM 0 HA PHE A 198 -13.258 -6.801 -0.330 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -10.645 -7.586 -1.667 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -11.333 -5.975 -1.638 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -11.577 -4.782 0.685 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -9.263 -8.352 0.089 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -10.428 -4.411 2.853 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -8.152 -8.015 2.274 1.00 0.00 H new ATOM 0 HZ PHE A 198 -8.766 -6.061 3.681 1.00 0.00 H new ATOM 1251 N THR A 199 -13.573 -6.620 -3.017 1.00 0.00 N ATOM 1252 CA THR A 199 -14.257 -6.586 -4.307 1.00 0.00 C ATOM 1253 C THR A 199 -13.384 -5.828 -5.303 1.00 0.00 C ATOM 1254 O THR A 199 -12.367 -5.266 -4.901 1.00 0.00 O ATOM 1255 CB THR A 199 -15.645 -5.938 -4.152 1.00 0.00 C ATOM 1256 OG1 THR A 199 -15.555 -4.562 -3.821 1.00 0.00 O ATOM 1257 CG2 THR A 199 -16.516 -6.699 -3.151 1.00 0.00 C ATOM 0 H THR A 199 -13.202 -5.709 -2.749 1.00 0.00 H new ATOM 0 HA THR A 199 -14.414 -7.597 -4.682 1.00 0.00 H new ATOM 0 HB THR A 199 -16.134 -6.002 -5.124 1.00 0.00 H new ATOM 0 HG1 THR A 199 -15.648 -4.452 -2.852 1.00 0.00 H new ATOM 0 HG21 THR A 199 -17.487 -6.211 -3.069 1.00 0.00 H new ATOM 0 HG22 THR A 199 -16.653 -7.725 -3.494 1.00 0.00 H new ATOM 0 HG23 THR A 199 -16.029 -6.704 -2.176 1.00 0.00 H new ATOM 1265 N GLU A 200 -13.776 -5.741 -6.578 1.00 0.00 N ATOM 1266 CA GLU A 200 -13.151 -4.819 -7.515 1.00 0.00 C ATOM 1267 C GLU A 200 -13.181 -3.407 -6.944 1.00 0.00 C ATOM 1268 O GLU A 200 -12.143 -2.759 -6.916 1.00 0.00 O ATOM 1269 CB GLU A 200 -13.851 -4.923 -8.876 1.00 0.00 C ATOM 1270 CG GLU A 200 -12.879 -4.916 -10.071 1.00 0.00 C ATOM 1271 CD GLU A 200 -12.503 -3.550 -10.684 1.00 0.00 C ATOM 1272 OE1 GLU A 200 -13.147 -2.511 -10.402 1.00 0.00 O ATOM 1273 OE2 GLU A 200 -11.592 -3.502 -11.550 1.00 0.00 O ATOM 0 H GLU A 200 -14.526 -6.303 -6.980 1.00 0.00 H new ATOM 0 HA GLU A 200 -12.104 -5.080 -7.667 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -14.440 -5.840 -8.903 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -14.549 -4.092 -8.981 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -11.958 -5.407 -9.757 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -13.314 -5.529 -10.860 1.00 0.00 H new ATOM 1280 N THR A 201 -14.322 -2.954 -6.417 1.00 0.00 N ATOM 1281 CA THR A 201 -14.435 -1.639 -5.804 1.00 0.00 C ATOM 1282 C THR A 201 -13.417 -1.498 -4.663 1.00 0.00 C ATOM 1283 O THR A 201 -12.663 -0.527 -4.640 1.00 0.00 O ATOM 1284 CB THR A 201 -15.875 -1.421 -5.284 1.00 0.00 C ATOM 1285 OG1 THR A 201 -16.848 -2.015 -6.130 1.00 0.00 O ATOM 1286 CG2 THR A 201 -16.201 0.070 -5.145 1.00 0.00 C ATOM 0 H THR A 201 -15.189 -3.492 -6.406 1.00 0.00 H new ATOM 0 HA THR A 201 -14.218 -0.876 -6.552 1.00 0.00 H new ATOM 0 HB THR A 201 -15.913 -1.901 -4.306 1.00 0.00 H new ATOM 0 HG1 THR A 201 -17.742 -1.854 -5.763 1.00 0.00 H new ATOM 0 HG21 THR A 201 -17.220 0.187 -4.777 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.507 0.530 -4.442 1.00 0.00 H new ATOM 0 HG23 THR A 201 -16.108 0.555 -6.117 1.00 0.00 H new ATOM 1294 N ASP A 202 -13.376 -2.449 -3.723 1.00 0.00 N ATOM 1295 CA ASP A 202 -12.515 -2.330 -2.545 1.00 0.00 C ATOM 1296 C ASP A 202 -11.042 -2.411 -2.932 1.00 0.00 C ATOM 1297 O ASP A 202 -10.241 -1.680 -2.357 1.00 0.00 O ATOM 1298 CB ASP A 202 -12.791 -3.383 -1.463 1.00 0.00 C ATOM 1299 CG ASP A 202 -14.141 -3.283 -0.756 1.00 0.00 C ATOM 1300 OD1 ASP A 202 -15.165 -3.485 -1.453 1.00 0.00 O ATOM 1301 OD2 ASP A 202 -14.189 -3.103 0.481 1.00 0.00 O ATOM 0 H ASP A 202 -13.928 -3.306 -3.756 1.00 0.00 H new ATOM 0 HA ASP A 202 -12.751 -1.353 -2.124 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -12.715 -4.371 -1.918 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -12.004 -3.317 -0.711 1.00 0.00 H new ATOM 1306 N VAL A 203 -10.668 -3.244 -3.908 1.00 0.00 N ATOM 1307 CA VAL A 203 -9.322 -3.256 -4.474 1.00 0.00 C ATOM 1308 C VAL A 203 -9.050 -1.895 -5.101 1.00 0.00 C ATOM 1309 O VAL A 203 -8.016 -1.323 -4.803 1.00 0.00 O ATOM 1310 CB VAL A 203 -9.100 -4.452 -5.423 1.00 0.00 C ATOM 1311 CG1 VAL A 203 -7.703 -4.387 -6.063 1.00 0.00 C ATOM 1312 CG2 VAL A 203 -9.173 -5.786 -4.654 1.00 0.00 C ATOM 0 H VAL A 203 -11.295 -3.930 -4.327 1.00 0.00 H new ATOM 0 HA VAL A 203 -8.584 -3.412 -3.687 1.00 0.00 H new ATOM 0 HB VAL A 203 -9.880 -4.400 -6.182 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -7.568 -5.240 -6.728 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -7.607 -3.463 -6.633 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -6.943 -4.412 -5.282 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -9.013 -6.614 -5.345 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -8.403 -5.804 -3.883 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -10.154 -5.885 -4.190 1.00 0.00 H new ATOM 1322 N LYS A 204 -9.949 -1.297 -5.880 1.00 0.00 N ATOM 1323 CA LYS A 204 -9.701 0.019 -6.481 1.00 0.00 C ATOM 1324 C LYS A 204 -9.481 1.091 -5.415 1.00 0.00 C ATOM 1325 O LYS A 204 -8.660 1.986 -5.604 1.00 0.00 O ATOM 1326 CB LYS A 204 -10.866 0.405 -7.397 1.00 0.00 C ATOM 1327 CG LYS A 204 -11.024 -0.598 -8.548 1.00 0.00 C ATOM 1328 CD LYS A 204 -10.480 -0.109 -9.882 1.00 0.00 C ATOM 1329 CE LYS A 204 -9.570 -1.197 -10.464 1.00 0.00 C ATOM 1330 NZ LYS A 204 -9.246 -0.935 -11.874 1.00 0.00 N ATOM 0 H LYS A 204 -10.857 -1.700 -6.112 1.00 0.00 H new ATOM 0 HA LYS A 204 -8.788 -0.047 -7.073 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -11.789 0.446 -6.818 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -10.698 1.403 -7.802 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -10.517 -1.525 -8.279 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -12.081 -0.836 -8.665 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -11.299 0.107 -10.568 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -9.923 0.818 -9.747 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -8.650 -1.251 -9.883 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -10.060 -2.167 -10.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -8.629 -1.691 -12.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -10.123 -0.908 -12.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -8.756 -0.021 -11.954 1.00 0.00 H new ATOM 1344 N MET A 205 -10.191 1.015 -4.291 1.00 0.00 N ATOM 1345 CA MET A 205 -9.969 1.919 -3.175 1.00 0.00 C ATOM 1346 C MET A 205 -8.654 1.600 -2.468 1.00 0.00 C ATOM 1347 O MET A 205 -7.923 2.502 -2.055 1.00 0.00 O ATOM 1348 CB MET A 205 -11.127 1.828 -2.188 1.00 0.00 C ATOM 1349 CG MET A 205 -12.454 2.246 -2.810 1.00 0.00 C ATOM 1350 SD MET A 205 -13.603 2.883 -1.594 1.00 0.00 S ATOM 1351 CE MET A 205 -14.478 4.010 -2.689 1.00 0.00 C ATOM 0 H MET A 205 -10.930 0.329 -4.133 1.00 0.00 H new ATOM 0 HA MET A 205 -9.911 2.935 -3.566 1.00 0.00 H new ATOM 0 HB2 MET A 205 -11.208 0.805 -1.820 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.917 2.462 -1.326 1.00 0.00 H new ATOM 0 HG2 MET A 205 -12.273 3.007 -3.569 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.901 1.390 -3.316 1.00 0.00 H new ATOM 0 HE1 MET A 205 -15.550 3.940 -2.502 1.00 0.00 H new ATOM 0 HE2 MET A 205 -14.143 5.031 -2.504 1.00 0.00 H new ATOM 0 HE3 MET A 205 -14.273 3.743 -3.726 1.00 0.00 H new ATOM 1361 N MET A 206 -8.323 0.322 -2.325 1.00 0.00 N ATOM 1362 CA MET A 206 -7.066 -0.120 -1.763 1.00 0.00 C ATOM 1363 C MET A 206 -5.921 0.380 -2.641 1.00 0.00 C ATOM 1364 O MET A 206 -4.958 0.909 -2.108 1.00 0.00 O ATOM 1365 CB MET A 206 -7.071 -1.645 -1.619 1.00 0.00 C ATOM 1366 CG MET A 206 -5.726 -2.205 -1.162 1.00 0.00 C ATOM 1367 SD MET A 206 -5.757 -3.915 -0.545 1.00 0.00 S ATOM 1368 CE MET A 206 -6.880 -4.729 -1.711 1.00 0.00 C ATOM 0 H MET A 206 -8.936 -0.444 -2.603 1.00 0.00 H new ATOM 0 HA MET A 206 -6.925 0.296 -0.765 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.841 -1.934 -0.904 1.00 0.00 H new ATOM 0 HB3 MET A 206 -7.339 -2.094 -2.575 1.00 0.00 H new ATOM 0 HG2 MET A 206 -5.028 -2.151 -1.997 1.00 0.00 H new ATOM 0 HG3 MET A 206 -5.333 -1.561 -0.376 1.00 0.00 H new ATOM 0 HE1 MET A 206 -6.874 -5.804 -1.532 1.00 0.00 H new ATOM 0 HE2 MET A 206 -7.890 -4.344 -1.572 1.00 0.00 H new ATOM 0 HE3 MET A 206 -6.553 -4.529 -2.731 1.00 0.00 H new ATOM 1378 N GLU A 207 -6.041 0.312 -3.965 1.00 0.00 N ATOM 1379 CA GLU A 207 -5.045 0.711 -4.952 1.00 0.00 C ATOM 1380 C GLU A 207 -4.664 2.171 -4.786 1.00 0.00 C ATOM 1381 O GLU A 207 -3.595 2.550 -5.251 1.00 0.00 O ATOM 1382 CB GLU A 207 -5.554 0.505 -6.397 1.00 0.00 C ATOM 1383 CG GLU A 207 -5.513 -0.946 -6.886 1.00 0.00 C ATOM 1384 CD GLU A 207 -5.846 -1.131 -8.368 1.00 0.00 C ATOM 1385 OE1 GLU A 207 -5.545 -0.241 -9.204 1.00 0.00 O ATOM 1386 OE2 GLU A 207 -6.313 -2.238 -8.716 1.00 0.00 O ATOM 0 H GLU A 207 -6.890 -0.046 -4.403 1.00 0.00 H new ATOM 0 HA GLU A 207 -4.175 0.077 -4.782 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -6.580 0.868 -6.462 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -4.955 1.119 -7.070 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -4.518 -1.351 -6.698 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -6.214 -1.535 -6.294 1.00 0.00 H new ATOM 1393 N ARG A 208 -5.511 2.979 -4.146 1.00 0.00 N ATOM 1394 CA ARG A 208 -5.266 4.376 -3.823 1.00 0.00 C ATOM 1395 C ARG A 208 -4.632 4.505 -2.444 1.00 0.00 C ATOM 1396 O ARG A 208 -3.650 5.232 -2.290 1.00 0.00 O ATOM 1397 CB ARG A 208 -6.601 5.123 -3.881 1.00 0.00 C ATOM 1398 CG ARG A 208 -7.010 5.499 -5.312 1.00 0.00 C ATOM 1399 CD ARG A 208 -6.684 6.967 -5.583 1.00 0.00 C ATOM 1400 NE ARG A 208 -5.253 7.221 -5.829 1.00 0.00 N ATOM 1401 CZ ARG A 208 -4.658 8.416 -5.746 1.00 0.00 C ATOM 1402 NH1 ARG A 208 -5.315 9.502 -5.356 1.00 0.00 N ATOM 1403 NH2 ARG A 208 -3.377 8.540 -6.056 1.00 0.00 N ATOM 0 H ARG A 208 -6.425 2.658 -3.827 1.00 0.00 H new ATOM 0 HA ARG A 208 -4.570 4.808 -4.542 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -7.379 4.502 -3.437 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -6.532 6.028 -3.278 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -6.486 4.864 -6.027 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -8.077 5.324 -5.452 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -7.257 7.304 -6.447 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -7.009 7.565 -4.732 1.00 0.00 H new ATOM 0 HE ARG A 208 -4.671 6.423 -6.082 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -6.303 9.439 -5.109 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -4.832 10.399 -5.303 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -2.844 7.724 -6.358 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -2.923 9.451 -5.993 1.00 0.00 H new ATOM 1417 N VAL A 209 -5.178 3.812 -1.444 1.00 0.00 N ATOM 1418 CA VAL A 209 -4.635 3.825 -0.088 1.00 0.00 C ATOM 1419 C VAL A 209 -3.172 3.379 -0.073 1.00 0.00 C ATOM 1420 O VAL A 209 -2.291 4.088 0.418 1.00 0.00 O ATOM 1421 CB VAL A 209 -5.553 3.033 0.878 1.00 0.00 C ATOM 1422 CG1 VAL A 209 -5.243 1.555 1.159 1.00 0.00 C ATOM 1423 CG2 VAL A 209 -5.480 3.695 2.241 1.00 0.00 C ATOM 0 H VAL A 209 -6.007 3.228 -1.552 1.00 0.00 H new ATOM 0 HA VAL A 209 -4.626 4.849 0.285 1.00 0.00 H new ATOM 0 HB VAL A 209 -6.510 3.050 0.357 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -5.981 1.154 1.854 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -5.279 0.992 0.226 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -4.248 1.469 1.597 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -6.118 3.157 2.942 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -4.451 3.677 2.600 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -5.818 4.728 2.162 1.00 0.00 H new ATOM 1433 N VAL A 210 -2.909 2.204 -0.638 1.00 0.00 N ATOM 1434 CA VAL A 210 -1.614 1.549 -0.615 1.00 0.00 C ATOM 1435 C VAL A 210 -0.653 2.224 -1.609 1.00 0.00 C ATOM 1436 O VAL A 210 0.565 2.071 -1.498 1.00 0.00 O ATOM 1437 CB VAL A 210 -1.875 0.036 -0.775 1.00 0.00 C ATOM 1438 CG1 VAL A 210 -2.330 -0.462 -2.139 1.00 0.00 C ATOM 1439 CG2 VAL A 210 -0.702 -0.837 -0.367 1.00 0.00 C ATOM 0 H VAL A 210 -3.617 1.668 -1.139 1.00 0.00 H new ATOM 0 HA VAL A 210 -1.077 1.660 0.327 1.00 0.00 H new ATOM 0 HB VAL A 210 -2.716 -0.066 -0.089 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -2.474 -1.542 -2.103 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -3.270 0.020 -2.408 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -1.573 -0.222 -2.885 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -0.963 -1.886 -0.508 1.00 0.00 H new ATOM 0 HG22 VAL A 210 0.164 -0.593 -0.981 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -0.464 -0.660 0.682 1.00 0.00 H new ATOM 1449 N GLU A 211 -1.210 3.046 -2.506 1.00 0.00 N ATOM 1450 CA GLU A 211 -0.511 4.027 -3.326 1.00 0.00 C ATOM 1451 C GLU A 211 0.100 5.063 -2.396 1.00 0.00 C ATOM 1452 O GLU A 211 1.308 5.059 -2.234 1.00 0.00 O ATOM 1453 CB GLU A 211 -1.443 4.725 -4.331 1.00 0.00 C ATOM 1454 CG GLU A 211 -0.941 4.739 -5.772 1.00 0.00 C ATOM 1455 CD GLU A 211 -1.602 5.913 -6.488 1.00 0.00 C ATOM 1456 OE1 GLU A 211 -2.780 5.820 -6.913 1.00 0.00 O ATOM 1457 OE2 GLU A 211 -0.978 6.997 -6.538 1.00 0.00 O ATOM 0 H GLU A 211 -2.214 3.040 -2.684 1.00 0.00 H new ATOM 0 HA GLU A 211 0.253 3.511 -3.908 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -2.415 4.232 -4.305 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -1.598 5.754 -4.006 1.00 0.00 H new ATOM 0 HG2 GLU A 211 0.144 4.839 -5.797 1.00 0.00 H new ATOM 0 HG3 GLU A 211 -1.186 3.801 -6.270 1.00 0.00 H new ATOM 1464 N GLN A 212 -0.703 5.937 -1.772 1.00 0.00 N ATOM 1465 CA GLN A 212 -0.239 7.069 -0.968 1.00 0.00 C ATOM 1466 C GLN A 212 0.765 6.589 0.084 1.00 0.00 C ATOM 1467 O GLN A 212 1.785 7.233 0.336 1.00 0.00 O ATOM 1468 CB GLN A 212 -1.447 7.740 -0.292 1.00 0.00 C ATOM 1469 CG GLN A 212 -2.572 8.157 -1.259 1.00 0.00 C ATOM 1470 CD GLN A 212 -2.817 9.658 -1.332 1.00 0.00 C ATOM 1471 OE1 GLN A 212 -3.784 10.196 -0.793 1.00 0.00 O ATOM 1472 NE2 GLN A 212 -1.929 10.357 -2.011 1.00 0.00 N ATOM 0 H GLN A 212 -1.720 5.871 -1.816 1.00 0.00 H new ATOM 0 HA GLN A 212 0.259 7.794 -1.612 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -1.858 7.056 0.450 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -1.102 8.623 0.246 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -2.330 7.792 -2.257 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -3.496 7.665 -0.955 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -1.136 9.887 -2.448 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -2.035 11.368 -2.099 1.00 0.00 H new ATOM 1481 N MET A 213 0.506 5.412 0.650 1.00 0.00 N ATOM 1482 CA MET A 213 1.411 4.721 1.541 1.00 0.00 C ATOM 1483 C MET A 213 2.743 4.428 0.860 1.00 0.00 C ATOM 1484 O MET A 213 3.752 4.963 1.313 1.00 0.00 O ATOM 1485 CB MET A 213 0.705 3.474 2.063 1.00 0.00 C ATOM 1486 CG MET A 213 -0.263 3.923 3.164 1.00 0.00 C ATOM 1487 SD MET A 213 -1.598 2.778 3.604 1.00 0.00 S ATOM 1488 CE MET A 213 -0.661 1.243 3.733 1.00 0.00 C ATOM 0 H MET A 213 -0.365 4.906 0.492 1.00 0.00 H new ATOM 0 HA MET A 213 1.665 5.350 2.394 1.00 0.00 H new ATOM 0 HB2 MET A 213 0.166 2.973 1.259 1.00 0.00 H new ATOM 0 HB3 MET A 213 1.428 2.759 2.456 1.00 0.00 H new ATOM 0 HG2 MET A 213 0.318 4.127 4.063 1.00 0.00 H new ATOM 0 HG3 MET A 213 -0.714 4.866 2.855 1.00 0.00 H new ATOM 0 HE1 MET A 213 -1.302 0.458 4.136 1.00 0.00 H new ATOM 0 HE2 MET A 213 -0.305 0.950 2.745 1.00 0.00 H new ATOM 0 HE3 MET A 213 0.191 1.392 4.396 1.00 0.00 H new ATOM 1498 N CYS A 214 2.802 3.618 -0.202 1.00 0.00 N ATOM 1499 CA CYS A 214 4.096 3.285 -0.789 1.00 0.00 C ATOM 1500 C CYS A 214 4.751 4.465 -1.519 1.00 0.00 C ATOM 1501 O CYS A 214 5.977 4.528 -1.587 1.00 0.00 O ATOM 1502 CB CYS A 214 4.018 2.046 -1.673 1.00 0.00 C ATOM 1503 SG CYS A 214 5.663 1.303 -1.781 1.00 0.00 S ATOM 0 H CYS A 214 1.994 3.194 -0.658 1.00 0.00 H new ATOM 0 HA CYS A 214 4.751 3.049 0.049 1.00 0.00 H new ATOM 0 HB2 CYS A 214 3.307 1.331 -1.259 1.00 0.00 H new ATOM 0 HB3 CYS A 214 3.659 2.313 -2.667 1.00 0.00 H new ATOM 1508 N VAL A 215 3.975 5.444 -1.990 1.00 0.00 N ATOM 1509 CA VAL A 215 4.476 6.723 -2.462 1.00 0.00 C ATOM 1510 C VAL A 215 5.312 7.327 -1.337 1.00 0.00 C ATOM 1511 O VAL A 215 6.471 7.669 -1.560 1.00 0.00 O ATOM 1512 CB VAL A 215 3.333 7.666 -2.904 1.00 0.00 C ATOM 1513 CG1 VAL A 215 3.851 9.099 -3.131 1.00 0.00 C ATOM 1514 CG2 VAL A 215 2.635 7.203 -4.191 1.00 0.00 C ATOM 0 H VAL A 215 2.960 5.361 -2.052 1.00 0.00 H new ATOM 0 HA VAL A 215 5.090 6.580 -3.351 1.00 0.00 H new ATOM 0 HB VAL A 215 2.610 7.644 -2.089 1.00 0.00 H new ATOM 0 HG11 VAL A 215 3.025 9.740 -3.441 1.00 0.00 H new ATOM 0 HG12 VAL A 215 4.279 9.482 -2.205 1.00 0.00 H new ATOM 0 HG13 VAL A 215 4.615 9.091 -3.908 1.00 0.00 H new ATOM 0 HG21 VAL A 215 1.843 7.906 -4.449 1.00 0.00 H new ATOM 0 HG22 VAL A 215 3.361 7.160 -5.003 1.00 0.00 H new ATOM 0 HG23 VAL A 215 2.205 6.213 -4.036 1.00 0.00 H new ATOM 1524 N THR A 216 4.743 7.459 -0.141 1.00 0.00 N ATOM 1525 CA THR A 216 5.444 7.997 1.012 1.00 0.00 C ATOM 1526 C THR A 216 6.635 7.096 1.362 1.00 0.00 C ATOM 1527 O THR A 216 7.727 7.611 1.557 1.00 0.00 O ATOM 1528 CB THR A 216 4.446 8.089 2.187 1.00 0.00 C ATOM 1529 OG1 THR A 216 3.268 8.828 1.888 1.00 0.00 O ATOM 1530 CG2 THR A 216 5.071 8.681 3.443 1.00 0.00 C ATOM 0 H THR A 216 3.777 7.193 0.052 1.00 0.00 H new ATOM 0 HA THR A 216 5.834 8.992 0.796 1.00 0.00 H new ATOM 0 HB THR A 216 4.166 7.051 2.366 1.00 0.00 H new ATOM 0 HG1 THR A 216 2.586 8.224 1.527 1.00 0.00 H new ATOM 0 HG21 THR A 216 4.325 8.722 4.236 1.00 0.00 H new ATOM 0 HG22 THR A 216 5.906 8.058 3.762 1.00 0.00 H new ATOM 0 HG23 THR A 216 5.430 9.688 3.231 1.00 0.00 H new ATOM 1538 N GLN A 217 6.456 5.773 1.436 1.00 0.00 N ATOM 1539 CA GLN A 217 7.498 4.841 1.858 1.00 0.00 C ATOM 1540 C GLN A 217 8.726 4.961 0.948 1.00 0.00 C ATOM 1541 O GLN A 217 9.840 5.099 1.450 1.00 0.00 O ATOM 1542 CB GLN A 217 6.918 3.412 1.933 1.00 0.00 C ATOM 1543 CG GLN A 217 7.472 2.625 3.127 1.00 0.00 C ATOM 1544 CD GLN A 217 8.919 2.183 2.945 1.00 0.00 C ATOM 1545 OE1 GLN A 217 9.419 2.058 1.834 1.00 0.00 O ATOM 1546 NE2 GLN A 217 9.605 1.919 4.042 1.00 0.00 N ATOM 0 H GLN A 217 5.574 5.318 1.202 1.00 0.00 H new ATOM 0 HA GLN A 217 7.844 5.092 2.860 1.00 0.00 H new ATOM 0 HB2 GLN A 217 5.832 3.466 2.008 1.00 0.00 H new ATOM 0 HB3 GLN A 217 7.148 2.879 1.010 1.00 0.00 H new ATOM 0 HG2 GLN A 217 7.399 3.241 4.023 1.00 0.00 H new ATOM 0 HG3 GLN A 217 6.850 1.745 3.293 1.00 0.00 H new ATOM 0 HE21 GLN A 217 9.167 2.031 4.956 1.00 0.00 H new ATOM 0 HE22 GLN A 217 10.573 1.604 3.975 1.00 0.00 H new ATOM 1555 N TYR A 218 8.523 5.041 -0.371 1.00 0.00 N ATOM 1556 CA TYR A 218 9.596 5.278 -1.327 1.00 0.00 C ATOM 1557 C TYR A 218 10.355 6.568 -1.012 1.00 0.00 C ATOM 1558 O TYR A 218 11.586 6.581 -1.077 1.00 0.00 O ATOM 1559 CB TYR A 218 9.028 5.357 -2.751 1.00 0.00 C ATOM 1560 CG TYR A 218 10.079 5.610 -3.818 1.00 0.00 C ATOM 1561 CD1 TYR A 218 11.222 4.791 -3.887 1.00 0.00 C ATOM 1562 CD2 TYR A 218 9.969 6.707 -4.695 1.00 0.00 C ATOM 1563 CE1 TYR A 218 12.240 5.067 -4.813 1.00 0.00 C ATOM 1564 CE2 TYR A 218 10.962 6.955 -5.654 1.00 0.00 C ATOM 1565 CZ TYR A 218 12.105 6.140 -5.715 1.00 0.00 C ATOM 1566 OH TYR A 218 13.087 6.418 -6.609 1.00 0.00 O ATOM 0 H TYR A 218 7.604 4.942 -0.802 1.00 0.00 H new ATOM 0 HA TYR A 218 10.292 4.443 -1.253 1.00 0.00 H new ATOM 0 HB2 TYR A 218 8.511 4.425 -2.978 1.00 0.00 H new ATOM 0 HB3 TYR A 218 8.284 6.152 -2.792 1.00 0.00 H new ATOM 0 HD1 TYR A 218 11.316 3.945 -3.223 1.00 0.00 H new ATOM 0 HD2 TYR A 218 9.113 7.362 -4.628 1.00 0.00 H new ATOM 0 HE1 TYR A 218 13.129 4.455 -4.834 1.00 0.00 H new ATOM 0 HE2 TYR A 218 10.848 7.775 -6.348 1.00 0.00 H new ATOM 0 HH TYR A 218 12.825 7.190 -7.153 1.00 0.00 H new ATOM 1576 N GLN A 219 9.634 7.650 -0.693 1.00 0.00 N ATOM 1577 CA GLN A 219 10.233 8.925 -0.325 1.00 0.00 C ATOM 1578 C GLN A 219 11.061 8.754 0.950 1.00 0.00 C ATOM 1579 O GLN A 219 12.227 9.147 0.956 1.00 0.00 O ATOM 1580 CB GLN A 219 9.180 10.042 -0.201 1.00 0.00 C ATOM 1581 CG GLN A 219 8.487 10.303 -1.547 1.00 0.00 C ATOM 1582 CD GLN A 219 7.473 11.435 -1.506 1.00 0.00 C ATOM 1583 OE1 GLN A 219 6.252 11.187 -1.938 1.00 0.00 O flip ATOM 1584 NE2 GLN A 219 7.786 12.570 -1.160 1.00 0.00 N flip ATOM 0 H GLN A 219 8.614 7.659 -0.685 1.00 0.00 H new ATOM 0 HA GLN A 219 10.903 9.242 -1.124 1.00 0.00 H new ATOM 0 HB2 GLN A 219 8.437 9.764 0.546 1.00 0.00 H new ATOM 0 HB3 GLN A 219 9.657 10.958 0.149 1.00 0.00 H new ATOM 0 HG2 GLN A 219 9.244 10.533 -2.296 1.00 0.00 H new ATOM 0 HG3 GLN A 219 7.986 9.390 -1.870 1.00 0.00 H new ATOM 0 HE21 GLN A 219 8.731 12.759 -0.826 1.00 0.00 H new ATOM 0 HE22 GLN A 219 7.101 13.324 -1.206 1.00 0.00 H new ATOM 1593 N LYS A 220 10.495 8.150 2.001 1.00 0.00 N ATOM 1594 CA LYS A 220 11.142 7.890 3.281 1.00 0.00 C ATOM 1595 C LYS A 220 12.417 7.083 3.084 1.00 0.00 C ATOM 1596 O LYS A 220 13.473 7.565 3.473 1.00 0.00 O ATOM 1597 CB LYS A 220 10.170 7.204 4.259 1.00 0.00 C ATOM 1598 CG LYS A 220 9.046 8.162 4.681 1.00 0.00 C ATOM 1599 CD LYS A 220 7.959 7.545 5.574 1.00 0.00 C ATOM 1600 CE LYS A 220 8.297 7.455 7.061 1.00 0.00 C ATOM 1601 NZ LYS A 220 8.406 8.793 7.689 1.00 0.00 N ATOM 0 H LYS A 220 9.531 7.817 1.976 1.00 0.00 H new ATOM 0 HA LYS A 220 11.426 8.844 3.727 1.00 0.00 H new ATOM 0 HB2 LYS A 220 9.741 6.319 3.790 1.00 0.00 H new ATOM 0 HB3 LYS A 220 10.714 6.865 5.141 1.00 0.00 H new ATOM 0 HG2 LYS A 220 9.490 9.007 5.208 1.00 0.00 H new ATOM 0 HG3 LYS A 220 8.573 8.559 3.783 1.00 0.00 H new ATOM 0 HD2 LYS A 220 7.047 8.131 5.462 1.00 0.00 H new ATOM 0 HD3 LYS A 220 7.740 6.542 5.208 1.00 0.00 H new ATOM 0 HE2 LYS A 220 7.528 6.876 7.573 1.00 0.00 H new ATOM 0 HE3 LYS A 220 9.237 6.918 7.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 8.450 8.689 8.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 9.269 9.266 7.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 7.576 9.365 7.434 1.00 0.00 H new ATOM 1615 N GLU A 221 12.363 5.904 2.465 1.00 0.00 N ATOM 1616 CA GLU A 221 13.542 5.062 2.269 1.00 0.00 C ATOM 1617 C GLU A 221 14.594 5.772 1.424 1.00 0.00 C ATOM 1618 O GLU A 221 15.771 5.736 1.787 1.00 0.00 O ATOM 1619 CB GLU A 221 13.160 3.727 1.612 1.00 0.00 C ATOM 1620 CG GLU A 221 12.631 2.717 2.632 1.00 0.00 C ATOM 1621 CD GLU A 221 13.740 2.114 3.503 1.00 0.00 C ATOM 1622 OE1 GLU A 221 14.362 1.106 3.088 1.00 0.00 O ATOM 1623 OE2 GLU A 221 13.945 2.585 4.646 1.00 0.00 O ATOM 0 H GLU A 221 11.503 5.507 2.086 1.00 0.00 H new ATOM 0 HA GLU A 221 13.966 4.862 3.253 1.00 0.00 H new ATOM 0 HB2 GLU A 221 12.402 3.902 0.849 1.00 0.00 H new ATOM 0 HB3 GLU A 221 14.031 3.309 1.106 1.00 0.00 H new ATOM 0 HG2 GLU A 221 11.897 3.206 3.273 1.00 0.00 H new ATOM 0 HG3 GLU A 221 12.112 1.915 2.107 1.00 0.00 H new ATOM 1630 N SER A 222 14.188 6.422 0.326 1.00 0.00 N ATOM 1631 CA SER A 222 15.111 7.170 -0.517 1.00 0.00 C ATOM 1632 C SER A 222 15.808 8.259 0.290 1.00 0.00 C ATOM 1633 O SER A 222 17.031 8.380 0.232 1.00 0.00 O ATOM 1634 CB SER A 222 14.388 7.792 -1.714 1.00 0.00 C ATOM 1635 OG SER A 222 13.967 6.783 -2.611 1.00 0.00 O ATOM 0 H SER A 222 13.220 6.441 0.005 1.00 0.00 H new ATOM 0 HA SER A 222 15.858 6.471 -0.892 1.00 0.00 H new ATOM 0 HB2 SER A 222 13.527 8.365 -1.370 1.00 0.00 H new ATOM 0 HB3 SER A 222 15.051 8.490 -2.226 1.00 0.00 H new ATOM 0 HG SER A 222 13.091 6.444 -2.334 1.00 0.00 H new ATOM 1641 N GLN A 223 15.050 9.045 1.058 1.00 0.00 N ATOM 1642 CA GLN A 223 15.605 10.153 1.791 1.00 0.00 C ATOM 1643 C GLN A 223 16.500 9.593 2.883 1.00 0.00 C ATOM 1644 O GLN A 223 17.636 10.019 3.011 1.00 0.00 O ATOM 1645 CB GLN A 223 14.467 11.050 2.307 1.00 0.00 C ATOM 1646 CG GLN A 223 14.775 11.830 3.591 1.00 0.00 C ATOM 1647 CD GLN A 223 14.396 11.074 4.860 1.00 0.00 C ATOM 1648 OE1 GLN A 223 15.160 11.028 5.815 1.00 0.00 O ATOM 1649 NE2 GLN A 223 13.205 10.503 4.911 1.00 0.00 N ATOM 0 H GLN A 223 14.045 8.922 1.180 1.00 0.00 H new ATOM 0 HA GLN A 223 16.223 10.793 1.162 1.00 0.00 H new ATOM 0 HB2 GLN A 223 14.204 11.761 1.524 1.00 0.00 H new ATOM 0 HB3 GLN A 223 13.588 10.429 2.481 1.00 0.00 H new ATOM 0 HG2 GLN A 223 15.839 12.064 3.620 1.00 0.00 H new ATOM 0 HG3 GLN A 223 14.240 12.780 3.568 1.00 0.00 H new ATOM 0 HE21 GLN A 223 12.581 10.551 4.105 1.00 0.00 H new ATOM 0 HE22 GLN A 223 12.910 10.014 5.756 1.00 0.00 H new ATOM 1658 N ALA A 224 16.042 8.616 3.660 1.00 0.00 N ATOM 1659 CA ALA A 224 16.812 8.104 4.777 1.00 0.00 C ATOM 1660 C ALA A 224 18.115 7.439 4.303 1.00 0.00 C ATOM 1661 O ALA A 224 19.047 7.325 5.092 1.00 0.00 O ATOM 1662 CB ALA A 224 15.925 7.183 5.640 1.00 0.00 C ATOM 0 H ALA A 224 15.136 8.164 3.531 1.00 0.00 H new ATOM 0 HA ALA A 224 17.128 8.931 5.412 1.00 0.00 H new ATOM 0 HB1 ALA A 224 16.506 6.800 6.479 1.00 0.00 H new ATOM 0 HB2 ALA A 224 15.073 7.748 6.017 1.00 0.00 H new ATOM 0 HB3 ALA A 224 15.569 6.350 5.035 1.00 0.00 H new ATOM 1668 N ALA A 225 18.227 7.062 3.023 1.00 0.00 N ATOM 1669 CA ALA A 225 19.484 6.699 2.387 1.00 0.00 C ATOM 1670 C ALA A 225 20.275 7.964 2.054 1.00 0.00 C ATOM 1671 O ALA A 225 21.329 8.193 2.643 1.00 0.00 O ATOM 1672 CB ALA A 225 19.238 5.843 1.137 1.00 0.00 C ATOM 0 H ALA A 225 17.426 7.002 2.394 1.00 0.00 H new ATOM 0 HA ALA A 225 20.073 6.096 3.078 1.00 0.00 H new ATOM 0 HB1 ALA A 225 20.193 5.584 0.679 1.00 0.00 H new ATOM 0 HB2 ALA A 225 18.712 4.931 1.418 1.00 0.00 H new ATOM 0 HB3 ALA A 225 18.634 6.405 0.424 1.00 0.00 H new ATOM 1678 N ALA A 226 19.767 8.787 1.136 1.00 0.00 N ATOM 1679 CA ALA A 226 20.438 9.961 0.583 1.00 0.00 C ATOM 1680 C ALA A 226 20.927 10.927 1.667 1.00 0.00 C ATOM 1681 O ALA A 226 22.007 11.518 1.567 1.00 0.00 O ATOM 1682 CB ALA A 226 19.445 10.664 -0.349 1.00 0.00 C ATOM 0 H ALA A 226 18.837 8.646 0.742 1.00 0.00 H new ATOM 0 HA ALA A 226 21.328 9.638 0.043 1.00 0.00 H new ATOM 0 HB1 ALA A 226 19.914 11.548 -0.781 1.00 0.00 H new ATOM 0 HB2 ALA A 226 19.151 9.983 -1.147 1.00 0.00 H new ATOM 0 HB3 ALA A 226 18.563 10.962 0.217 1.00 0.00 H new ATOM 1688 N ASP A 227 20.131 11.069 2.720 1.00 0.00 N ATOM 1689 CA ASP A 227 20.283 12.013 3.815 1.00 0.00 C ATOM 1690 C ASP A 227 20.731 11.282 5.082 1.00 0.00 C ATOM 1691 O ASP A 227 20.934 11.910 6.121 1.00 0.00 O ATOM 1692 CB ASP A 227 18.965 12.802 3.989 1.00 0.00 C ATOM 1693 CG ASP A 227 18.678 13.662 2.745 1.00 0.00 C ATOM 1694 OD1 ASP A 227 19.628 14.266 2.200 1.00 0.00 O ATOM 1695 OD2 ASP A 227 17.521 13.739 2.270 1.00 0.00 O ATOM 0 H ASP A 227 19.304 10.484 2.837 1.00 0.00 H new ATOM 0 HA ASP A 227 21.065 12.739 3.594 1.00 0.00 H new ATOM 0 HB2 ASP A 227 18.140 12.110 4.157 1.00 0.00 H new ATOM 0 HB3 ASP A 227 19.030 13.439 4.871 1.00 0.00 H new ATOM 1700 N GLY A 228 20.917 9.957 5.006 1.00 0.00 N ATOM 1701 CA GLY A 228 21.606 9.173 6.028 1.00 0.00 C ATOM 1702 C GLY A 228 20.755 8.923 7.271 1.00 0.00 C ATOM 1703 O GLY A 228 21.250 8.443 8.290 1.00 0.00 O ATOM 0 H GLY A 228 20.587 9.397 4.220 1.00 0.00 H new ATOM 0 HA2 GLY A 228 21.905 8.215 5.602 1.00 0.00 H new ATOM 0 HA3 GLY A 228 22.520 9.691 6.319 1.00 0.00 H new ATOM 1707 N ARG A 229 19.465 9.246 7.221 1.00 0.00 N ATOM 1708 CA ARG A 229 18.541 9.189 8.347 1.00 0.00 C ATOM 1709 C ARG A 229 18.015 7.782 8.654 1.00 0.00 C ATOM 1710 O ARG A 229 16.942 7.690 9.242 1.00 0.00 O ATOM 1711 CB ARG A 229 17.411 10.209 8.088 1.00 0.00 C ATOM 1712 CG ARG A 229 17.849 11.678 7.948 1.00 0.00 C ATOM 1713 CD ARG A 229 18.292 12.325 9.267 1.00 0.00 C ATOM 1714 NE ARG A 229 19.659 11.934 9.644 1.00 0.00 N ATOM 1715 CZ ARG A 229 20.051 11.328 10.771 1.00 0.00 C ATOM 1716 NH1 ARG A 229 19.191 10.843 11.662 1.00 0.00 N ATOM 1717 NH2 ARG A 229 21.346 11.156 10.980 1.00 0.00 N ATOM 0 H ARG A 229 19.019 9.567 6.361 1.00 0.00 H new ATOM 0 HA ARG A 229 19.082 9.456 9.255 1.00 0.00 H new ATOM 0 HB2 ARG A 229 16.887 9.918 7.177 1.00 0.00 H new ATOM 0 HB3 ARG A 229 16.692 10.141 8.905 1.00 0.00 H new ATOM 0 HG2 ARG A 229 18.670 11.735 7.233 1.00 0.00 H new ATOM 0 HG3 ARG A 229 17.023 12.255 7.532 1.00 0.00 H new ATOM 0 HD2 ARG A 229 18.238 13.410 9.174 1.00 0.00 H new ATOM 0 HD3 ARG A 229 17.602 12.039 10.060 1.00 0.00 H new ATOM 0 HE ARG A 229 20.393 12.150 8.969 1.00 0.00 H new ATOM 0 HH11 ARG A 229 18.187 10.926 11.500 1.00 0.00 H new ATOM 0 HH12 ARG A 229 19.535 10.388 12.508 1.00 0.00 H new ATOM 0 HH21 ARG A 229 22.022 11.483 10.289 1.00 0.00 H new ATOM 0 HH22 ARG A 229 21.669 10.697 11.832 1.00 0.00 H new