USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, 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 163 TYR OH : rot 148:sc= 2 USER MOD Set 1.2: A 217 GLN : amide:sc= 0.5 K(o=2.5,f=0.8) USER MOD Set 2.1: A 172 GLN : amide:sc= 1.19 X(o=2.2,f=2) USER MOD Set 2.2: A 215 THR OG1 : rot 180:sc= 0.996 USER MOD Set 3.1: A 149 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 199 THR OG1 : rot -70:sc= 2.17 USER MOD Set 3.3: A 201 THR OG1 : rot 65:sc= 1.35 USER MOD Set 4.1: A 181 ASN : amide:sc= -0.873 K(o=-0.87,f=-2.5!) USER MOD Set 4.2: A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 171 ASN : amide:sc= 2.15 K(o=3.1,f=-0.89) USER MOD Set 5.2: A 173 ASN : amide:sc= 0.409 K(o=3.1,f=-1.5) USER MOD Set 5.3: A 174 ASN : amide:sc= 0.507 K(o=3.1,f=-8!) USER MOD Single : A 128 TYR OH : rot 30:sc= 0 USER MOD Single : A 129 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 81:sc= 0.345 USER MOD Single : A 134 MET CE :methyl 150:sc= -2.07 (180deg=-4.61!) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 138 MET CE :methyl -177:sc= 0 (180deg=-0.014) USER MOD Single : A 139 MET CE :methyl 150:sc= -1.28 (180deg=-2.92!) USER MOD Single : A 140 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 143 ASN :FLIP amide:sc= -0.118 F(o=-1.2!,f=-0.12) USER MOD Single : A 150 TYR OH : rot 30:sc= 0.647 USER MOD Single : A 153 ASN : amide:sc= 0.878 K(o=0.88,f=-0.14) USER MOD Single : A 154 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 155 ASN : amide:sc= -0.0419 X(o=-0.042,f=-0.018) USER MOD Single : A 157 TYR OH : rot -126:sc= 1.42 USER MOD Single : A 159 ASN : amide:sc= -0.0233 K(o=-0.023,f=-1.9!) USER MOD Single : A 160 GLN :FLIP amide:sc= -0.0792 F(o=-4.3!,f=-0.079) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 169 TYR OH : rot 180:sc= -0.0609 USER MOD Single : A 170 ASN : amide:sc= -0.0108 K(o=-0.011,f=-1.3) USER MOD Single : A 177 HIS : no HD1:sc= -0.0601 X(o=-0.06,f=-0.5) USER MOD Single : A 183 THR OG1 : rot -122:sc= 0.683 USER MOD Single : A 186 GLN : amide:sc= -0.0166 K(o=-0.017,f=-1.8!) USER MOD Single : A 187 HIS : no HD1:sc= -0.0408 X(o=-0.041,f=-0.041) USER MOD Single : A 188 THR OG1 : rot -82:sc= 1.04 USER MOD Single : A 190 THR OG1 : rot 50:sc= 1.16 USER MOD Single : A 191 THR OG1 : rot 180:sc= 0 USER MOD Single : A 192 THR OG1 : rot 95:sc= 1.11 USER MOD Single : A 193 THR OG1 : rot -26:sc= 0.671 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 204 LYS NZ :NH3+ 172:sc= 0.857 (180deg=0.683) USER MOD Single : A 206 MET CE :methyl -173:sc= -1.45 (180deg=-1.68) USER MOD Single : A 212 GLN : amide:sc= 1.1 K(o=1.1,f=-0.043) USER MOD Single : A 213 MET CE :methyl -165:sc= -0.101 (180deg=-0.45) USER MOD Single : A 216 THR OG1 : rot 95:sc= 1.16 USER MOD Single : A 218 TYR OH : rot 100:sc= 0 USER MOD Single : A 219 GLN : amide:sc= -0.887 X(o=-0.89,f=-1.1) USER MOD Single : A 220 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 SER OG : rot -170:sc= 0 USER MOD Single : A 223 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 225 TYR OH : rot 77:sc= 0.0281 USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 125 12.017 -12.453 -4.248 1.00 0.00 N ATOM 2 CA LEU A 125 11.246 -11.310 -4.762 1.00 0.00 C ATOM 3 C LEU A 125 11.654 -10.865 -6.176 1.00 0.00 C ATOM 4 O LEU A 125 10.815 -10.547 -7.026 1.00 0.00 O ATOM 5 CB LEU A 125 11.446 -10.135 -3.795 1.00 0.00 C ATOM 6 CG LEU A 125 10.962 -10.372 -2.356 1.00 0.00 C ATOM 7 CD1 LEU A 125 10.852 -9.028 -1.655 1.00 0.00 C ATOM 8 CD2 LEU A 125 9.597 -11.033 -2.288 1.00 0.00 C ATOM 0 HA LEU A 125 10.205 -11.625 -4.830 1.00 0.00 H new ATOM 0 HB2 LEU A 125 12.507 -9.887 -3.767 1.00 0.00 H new ATOM 0 HB3 LEU A 125 10.926 -9.265 -4.196 1.00 0.00 H new ATOM 0 HG LEU A 125 11.685 -11.036 -1.882 1.00 0.00 H new ATOM 0 HD11 LEU A 125 10.509 -9.179 -0.631 1.00 0.00 H new ATOM 0 HD12 LEU A 125 11.828 -8.543 -1.643 1.00 0.00 H new ATOM 0 HD13 LEU A 125 10.140 -8.397 -2.187 1.00 0.00 H new ATOM 0 HD21 LEU A 125 9.312 -11.173 -1.245 1.00 0.00 H new ATOM 0 HD22 LEU A 125 8.861 -10.400 -2.783 1.00 0.00 H new ATOM 0 HD23 LEU A 125 9.637 -12.002 -2.786 1.00 0.00 H new ATOM 20 N GLY A 126 12.967 -10.778 -6.367 1.00 0.00 N ATOM 21 CA GLY A 126 13.682 -10.302 -7.559 1.00 0.00 C ATOM 22 C GLY A 126 14.435 -8.987 -7.344 1.00 0.00 C ATOM 23 O GLY A 126 15.487 -8.775 -7.945 1.00 0.00 O ATOM 0 H GLY A 126 13.617 -11.061 -5.634 1.00 0.00 H new ATOM 0 HA2 GLY A 126 14.390 -11.068 -7.876 1.00 0.00 H new ATOM 0 HA3 GLY A 126 12.968 -10.172 -8.372 1.00 0.00 H new ATOM 27 N GLY A 127 13.937 -8.130 -6.450 1.00 0.00 N ATOM 28 CA GLY A 127 14.606 -6.909 -6.002 1.00 0.00 C ATOM 29 C GLY A 127 13.618 -5.886 -5.458 1.00 0.00 C ATOM 30 O GLY A 127 13.616 -4.753 -5.928 1.00 0.00 O ATOM 0 H GLY A 127 13.030 -8.272 -6.005 1.00 0.00 H new ATOM 0 HA2 GLY A 127 15.334 -7.157 -5.230 1.00 0.00 H new ATOM 0 HA3 GLY A 127 15.159 -6.472 -6.833 1.00 0.00 H new ATOM 34 N TYR A 128 12.796 -6.277 -4.472 1.00 0.00 N ATOM 35 CA TYR A 128 11.877 -5.378 -3.787 1.00 0.00 C ATOM 36 C TYR A 128 12.198 -5.351 -2.297 1.00 0.00 C ATOM 37 O TYR A 128 12.927 -6.198 -1.783 1.00 0.00 O ATOM 38 CB TYR A 128 10.426 -5.810 -4.003 1.00 0.00 C ATOM 39 CG TYR A 128 9.932 -5.679 -5.420 1.00 0.00 C ATOM 40 CD1 TYR A 128 10.316 -6.628 -6.384 1.00 0.00 C ATOM 41 CD2 TYR A 128 9.064 -4.630 -5.762 1.00 0.00 C ATOM 42 CE1 TYR A 128 9.843 -6.516 -7.702 1.00 0.00 C ATOM 43 CE2 TYR A 128 8.574 -4.517 -7.070 1.00 0.00 C ATOM 44 CZ TYR A 128 8.974 -5.455 -8.041 1.00 0.00 C ATOM 45 OH TYR A 128 8.522 -5.328 -9.310 1.00 0.00 O ATOM 0 H TYR A 128 12.756 -7.237 -4.130 1.00 0.00 H new ATOM 0 HA TYR A 128 11.999 -4.378 -4.202 1.00 0.00 H new ATOM 0 HB2 TYR A 128 10.321 -6.849 -3.691 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.784 -5.216 -3.353 1.00 0.00 H new ATOM 0 HD1 TYR A 128 10.973 -7.441 -6.112 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.773 -3.907 -5.014 1.00 0.00 H new ATOM 0 HE1 TYR A 128 10.141 -7.235 -8.450 1.00 0.00 H new ATOM 0 HE2 TYR A 128 7.896 -3.718 -7.331 1.00 0.00 H new ATOM 0 HH TYR A 128 8.464 -6.213 -9.727 1.00 0.00 H new ATOM 55 N MET A 129 11.647 -4.337 -1.636 1.00 0.00 N ATOM 56 CA MET A 129 11.966 -3.925 -0.285 1.00 0.00 C ATOM 57 C MET A 129 10.737 -3.317 0.385 1.00 0.00 C ATOM 58 O MET A 129 10.167 -2.342 -0.108 1.00 0.00 O ATOM 59 CB MET A 129 13.064 -2.864 -0.323 1.00 0.00 C ATOM 60 CG MET A 129 14.364 -3.289 -1.015 1.00 0.00 C ATOM 61 SD MET A 129 15.773 -2.244 -0.575 1.00 0.00 S ATOM 62 CE MET A 129 17.104 -3.134 -1.425 1.00 0.00 C ATOM 0 H MET A 129 10.926 -3.752 -2.058 1.00 0.00 H new ATOM 0 HA MET A 129 12.298 -4.799 0.276 1.00 0.00 H new ATOM 0 HB2 MET A 129 12.675 -1.980 -0.829 1.00 0.00 H new ATOM 0 HB3 MET A 129 13.296 -2.569 0.700 1.00 0.00 H new ATOM 0 HG2 MET A 129 14.589 -4.322 -0.751 1.00 0.00 H new ATOM 0 HG3 MET A 129 14.220 -3.260 -2.095 1.00 0.00 H new ATOM 0 HE1 MET A 129 18.051 -2.620 -1.256 1.00 0.00 H new ATOM 0 HE2 MET A 129 17.168 -4.150 -1.036 1.00 0.00 H new ATOM 0 HE3 MET A 129 16.895 -3.167 -2.494 1.00 0.00 H new ATOM 72 N LEU A 130 10.342 -3.850 1.532 1.00 0.00 N ATOM 73 CA LEU A 130 9.223 -3.400 2.336 1.00 0.00 C ATOM 74 C LEU A 130 9.574 -2.138 3.153 1.00 0.00 C ATOM 75 O LEU A 130 10.390 -2.191 4.077 1.00 0.00 O ATOM 76 CB LEU A 130 8.784 -4.595 3.190 1.00 0.00 C ATOM 77 CG LEU A 130 7.295 -4.644 3.519 1.00 0.00 C ATOM 78 CD1 LEU A 130 6.999 -5.823 4.441 1.00 0.00 C ATOM 79 CD2 LEU A 130 6.861 -3.351 4.169 1.00 0.00 C ATOM 0 H LEU A 130 10.821 -4.650 1.946 1.00 0.00 H new ATOM 0 HA LEU A 130 8.388 -3.081 1.713 1.00 0.00 H new ATOM 0 HB2 LEU A 130 9.055 -5.513 2.669 1.00 0.00 H new ATOM 0 HB3 LEU A 130 9.346 -4.580 4.124 1.00 0.00 H new ATOM 0 HG LEU A 130 6.735 -4.774 2.593 1.00 0.00 H new ATOM 0 HD11 LEU A 130 5.933 -5.848 4.669 1.00 0.00 H new ATOM 0 HD12 LEU A 130 7.286 -6.752 3.948 1.00 0.00 H new ATOM 0 HD13 LEU A 130 7.565 -5.713 5.366 1.00 0.00 H new ATOM 0 HD21 LEU A 130 5.797 -3.399 4.399 1.00 0.00 H new ATOM 0 HD22 LEU A 130 7.425 -3.199 5.090 1.00 0.00 H new ATOM 0 HD23 LEU A 130 7.048 -2.521 3.488 1.00 0.00 H new ATOM 91 N GLY A 131 8.933 -1.007 2.824 1.00 0.00 N ATOM 92 CA GLY A 131 9.152 0.302 3.458 1.00 0.00 C ATOM 93 C GLY A 131 8.858 0.345 4.957 1.00 0.00 C ATOM 94 O GLY A 131 9.507 1.092 5.692 1.00 0.00 O ATOM 0 H GLY A 131 8.227 -0.977 2.088 1.00 0.00 H new ATOM 0 HA2 GLY A 131 10.188 0.599 3.297 1.00 0.00 H new ATOM 0 HA3 GLY A 131 8.526 1.041 2.958 1.00 0.00 H new ATOM 98 N SER A 132 7.895 -0.473 5.384 1.00 0.00 N ATOM 99 CA SER A 132 7.312 -0.751 6.697 1.00 0.00 C ATOM 100 C SER A 132 5.848 -0.309 6.683 1.00 0.00 C ATOM 101 O SER A 132 5.303 0.162 5.684 1.00 0.00 O ATOM 102 CB SER A 132 8.077 -0.184 7.895 1.00 0.00 C ATOM 103 OG SER A 132 9.408 -0.662 7.902 1.00 0.00 O ATOM 0 H SER A 132 7.427 -1.056 4.690 1.00 0.00 H new ATOM 0 HA SER A 132 7.387 -1.827 6.854 1.00 0.00 H new ATOM 0 HB2 SER A 132 8.075 0.905 7.853 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.577 -0.468 8.821 1.00 0.00 H new ATOM 0 HG SER A 132 9.948 -0.135 7.276 1.00 0.00 H new ATOM 109 N ALA A 133 5.197 -0.579 7.802 1.00 0.00 N ATOM 110 CA ALA A 133 3.783 -0.344 8.015 1.00 0.00 C ATOM 111 C ALA A 133 3.418 1.144 8.019 1.00 0.00 C ATOM 112 O ALA A 133 4.120 2.001 8.575 1.00 0.00 O ATOM 113 CB ALA A 133 3.390 -1.044 9.313 1.00 0.00 C ATOM 0 H ALA A 133 5.659 -0.983 8.617 1.00 0.00 H new ATOM 0 HA ALA A 133 3.216 -0.758 7.181 1.00 0.00 H new ATOM 0 HB1 ALA A 133 2.328 -0.887 9.504 1.00 0.00 H new ATOM 0 HB2 ALA A 133 3.589 -2.112 9.225 1.00 0.00 H new ATOM 0 HB3 ALA A 133 3.972 -0.634 10.138 1.00 0.00 H new ATOM 119 N MET A 134 2.258 1.425 7.426 1.00 0.00 N ATOM 120 CA MET A 134 1.614 2.731 7.451 1.00 0.00 C ATOM 121 C MET A 134 1.286 3.166 8.879 1.00 0.00 C ATOM 122 O MET A 134 0.557 2.491 9.620 1.00 0.00 O ATOM 123 CB MET A 134 0.389 2.741 6.532 1.00 0.00 C ATOM 124 CG MET A 134 -0.717 1.788 6.983 1.00 0.00 C ATOM 125 SD MET A 134 -2.034 1.438 5.795 1.00 0.00 S ATOM 126 CE MET A 134 -1.126 1.138 4.259 1.00 0.00 C ATOM 0 H MET A 134 1.728 0.729 6.901 1.00 0.00 H new ATOM 0 HA MET A 134 2.314 3.471 7.063 1.00 0.00 H new ATOM 0 HB2 MET A 134 -0.012 3.754 6.484 1.00 0.00 H new ATOM 0 HB3 MET A 134 0.700 2.473 5.522 1.00 0.00 H new ATOM 0 HG2 MET A 134 -0.255 0.842 7.265 1.00 0.00 H new ATOM 0 HG3 MET A 134 -1.173 2.200 7.883 1.00 0.00 H new ATOM 0 HE1 MET A 134 -1.682 0.435 3.639 1.00 0.00 H new ATOM 0 HE2 MET A 134 -1.002 2.077 3.720 1.00 0.00 H new ATOM 0 HE3 MET A 134 -0.146 0.721 4.491 1.00 0.00 H new ATOM 136 N SER A 135 1.857 4.317 9.244 1.00 0.00 N ATOM 137 CA SER A 135 1.650 5.025 10.498 1.00 0.00 C ATOM 138 C SER A 135 0.226 5.595 10.585 1.00 0.00 C ATOM 139 O SER A 135 0.021 6.807 10.508 1.00 0.00 O ATOM 140 CB SER A 135 2.730 6.099 10.636 1.00 0.00 C ATOM 141 OG SER A 135 2.945 6.370 12.008 1.00 0.00 O ATOM 0 H SER A 135 2.513 4.803 8.633 1.00 0.00 H new ATOM 0 HA SER A 135 1.742 4.336 11.338 1.00 0.00 H new ATOM 0 HB2 SER A 135 3.656 5.762 10.170 1.00 0.00 H new ATOM 0 HB3 SER A 135 2.424 7.008 10.117 1.00 0.00 H new ATOM 0 HG SER A 135 3.638 7.057 12.101 1.00 0.00 H new ATOM 147 N ARG A 136 -0.744 4.681 10.705 1.00 0.00 N ATOM 148 CA ARG A 136 -2.187 4.827 10.908 1.00 0.00 C ATOM 149 C ARG A 136 -2.778 6.074 10.221 1.00 0.00 C ATOM 150 O ARG A 136 -3.064 7.068 10.895 1.00 0.00 O ATOM 151 CB ARG A 136 -2.489 4.731 12.418 1.00 0.00 C ATOM 152 CG ARG A 136 -1.752 3.630 13.208 1.00 0.00 C ATOM 153 CD ARG A 136 -1.943 2.217 12.643 1.00 0.00 C ATOM 154 NE ARG A 136 -3.275 1.689 12.959 1.00 0.00 N ATOM 155 CZ ARG A 136 -3.789 0.521 12.615 1.00 0.00 C ATOM 156 NH1 ARG A 136 -3.210 -0.327 11.791 1.00 0.00 N ATOM 157 NH2 ARG A 136 -4.941 0.231 13.156 1.00 0.00 N ATOM 0 H ARG A 136 -0.500 3.692 10.655 1.00 0.00 H new ATOM 0 HA ARG A 136 -2.702 4.007 10.408 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -2.251 5.692 12.873 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -3.561 4.577 12.541 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -0.687 3.862 13.225 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -2.098 3.646 14.241 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -1.804 2.234 11.562 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -1.181 1.554 13.052 1.00 0.00 H new ATOM 0 HE ARG A 136 -3.878 2.298 13.512 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -2.307 -0.098 11.375 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -3.664 -1.213 11.569 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -5.383 0.889 13.797 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -5.399 -0.654 12.937 1.00 0.00 H new ATOM 171 N PRO A 137 -2.976 6.019 8.885 1.00 0.00 N ATOM 172 CA PRO A 137 -3.279 7.168 8.035 1.00 0.00 C ATOM 173 C PRO A 137 -4.234 8.266 8.507 1.00 0.00 C ATOM 174 O PRO A 137 -3.872 9.445 8.437 1.00 0.00 O ATOM 175 CB PRO A 137 -3.794 6.577 6.738 1.00 0.00 C ATOM 176 CG PRO A 137 -3.173 5.199 6.626 1.00 0.00 C ATOM 177 CD PRO A 137 -2.689 4.864 8.024 1.00 0.00 C ATOM 0 HA PRO A 137 -2.348 7.733 7.993 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -4.882 6.514 6.744 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -3.515 7.200 5.888 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -3.901 4.467 6.276 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -2.349 5.196 5.913 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -3.192 3.973 8.399 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -1.621 4.648 8.017 1.00 0.00 H new ATOM 185 N MET A 138 -5.465 7.897 8.888 1.00 0.00 N ATOM 186 CA MET A 138 -6.609 8.798 9.098 1.00 0.00 C ATOM 187 C MET A 138 -6.924 9.600 7.824 1.00 0.00 C ATOM 188 O MET A 138 -7.289 10.779 7.857 1.00 0.00 O ATOM 189 CB MET A 138 -6.434 9.645 10.371 1.00 0.00 C ATOM 190 CG MET A 138 -6.473 8.735 11.600 1.00 0.00 C ATOM 191 SD MET A 138 -8.080 7.953 11.931 1.00 0.00 S ATOM 192 CE MET A 138 -9.036 9.367 12.539 1.00 0.00 C ATOM 0 H MET A 138 -5.702 6.921 9.066 1.00 0.00 H new ATOM 0 HA MET A 138 -7.501 8.201 9.285 1.00 0.00 H new ATOM 0 HB2 MET A 138 -5.487 10.184 10.334 1.00 0.00 H new ATOM 0 HB3 MET A 138 -7.224 10.393 10.434 1.00 0.00 H new ATOM 0 HG2 MET A 138 -5.724 7.952 11.477 1.00 0.00 H new ATOM 0 HG3 MET A 138 -6.184 9.319 12.474 1.00 0.00 H new ATOM 0 HE1 MET A 138 -10.031 9.034 12.835 1.00 0.00 H new ATOM 0 HE2 MET A 138 -8.530 9.806 13.399 1.00 0.00 H new ATOM 0 HE3 MET A 138 -9.123 10.114 11.750 1.00 0.00 H new ATOM 202 N MET A 139 -6.742 8.935 6.681 1.00 0.00 N ATOM 203 CA MET A 139 -6.968 9.389 5.321 1.00 0.00 C ATOM 204 C MET A 139 -8.427 9.163 4.902 1.00 0.00 C ATOM 205 O MET A 139 -9.296 8.839 5.730 1.00 0.00 O ATOM 206 CB MET A 139 -5.993 8.628 4.410 1.00 0.00 C ATOM 207 CG MET A 139 -6.295 7.120 4.333 1.00 0.00 C ATOM 208 SD MET A 139 -6.741 6.506 2.698 1.00 0.00 S ATOM 209 CE MET A 139 -5.137 6.730 1.895 1.00 0.00 C ATOM 0 H MET A 139 -6.400 7.974 6.694 1.00 0.00 H new ATOM 0 HA MET A 139 -6.788 10.461 5.241 1.00 0.00 H new ATOM 0 HB2 MET A 139 -6.034 9.053 3.407 1.00 0.00 H new ATOM 0 HB3 MET A 139 -4.976 8.771 4.775 1.00 0.00 H new ATOM 0 HG2 MET A 139 -5.419 6.573 4.682 1.00 0.00 H new ATOM 0 HG3 MET A 139 -7.108 6.893 5.022 1.00 0.00 H new ATOM 0 HE1 MET A 139 -5.012 5.979 1.115 1.00 0.00 H new ATOM 0 HE2 MET A 139 -5.088 7.725 1.452 1.00 0.00 H new ATOM 0 HE3 MET A 139 -4.342 6.622 2.633 1.00 0.00 H new ATOM 219 N HIS A 140 -8.709 9.384 3.617 1.00 0.00 N ATOM 220 CA HIS A 140 -10.040 9.307 3.057 1.00 0.00 C ATOM 221 C HIS A 140 -10.045 9.005 1.555 1.00 0.00 C ATOM 222 O HIS A 140 -9.041 9.160 0.850 1.00 0.00 O ATOM 223 CB HIS A 140 -10.725 10.629 3.409 1.00 0.00 C ATOM 224 CG HIS A 140 -9.942 11.886 3.106 1.00 0.00 C ATOM 225 ND1 HIS A 140 -9.616 12.388 1.858 1.00 0.00 N ATOM 226 CD2 HIS A 140 -9.414 12.728 4.050 1.00 0.00 C ATOM 227 CE1 HIS A 140 -8.917 13.517 2.053 1.00 0.00 C ATOM 228 NE2 HIS A 140 -8.772 13.741 3.369 1.00 0.00 N ATOM 0 H HIS A 140 -7.996 9.626 2.929 1.00 0.00 H new ATOM 0 HA HIS A 140 -10.588 8.466 3.481 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -11.673 10.678 2.873 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -10.961 10.620 4.473 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -9.487 12.619 5.122 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -8.529 14.150 1.269 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -8.274 14.524 3.792 1.00 0.00 H new ATOM 237 N PHE A 141 -11.228 8.591 1.106 1.00 0.00 N ATOM 238 CA PHE A 141 -11.574 8.122 -0.235 1.00 0.00 C ATOM 239 C PHE A 141 -12.643 9.004 -0.884 1.00 0.00 C ATOM 240 O PHE A 141 -12.731 9.108 -2.112 1.00 0.00 O ATOM 241 CB PHE A 141 -12.107 6.683 -0.116 1.00 0.00 C ATOM 242 CG PHE A 141 -11.354 5.823 0.881 1.00 0.00 C ATOM 243 CD1 PHE A 141 -10.083 5.329 0.562 1.00 0.00 C ATOM 244 CD2 PHE A 141 -11.891 5.587 2.159 1.00 0.00 C ATOM 245 CE1 PHE A 141 -9.333 4.624 1.515 1.00 0.00 C ATOM 246 CE2 PHE A 141 -11.131 4.888 3.117 1.00 0.00 C ATOM 247 CZ PHE A 141 -9.845 4.427 2.802 1.00 0.00 C ATOM 0 H PHE A 141 -12.039 8.573 1.724 1.00 0.00 H new ATOM 0 HA PHE A 141 -10.684 8.164 -0.863 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -13.158 6.719 0.172 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -12.062 6.208 -1.096 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -9.677 5.492 -0.425 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -12.882 5.940 2.405 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -8.360 4.233 1.255 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -11.541 4.706 4.099 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.252 3.922 3.550 1.00 0.00 H new ATOM 257 N GLY A 142 -13.480 9.610 -0.043 1.00 0.00 N ATOM 258 CA GLY A 142 -14.657 10.372 -0.440 1.00 0.00 C ATOM 259 C GLY A 142 -15.827 9.469 -0.816 1.00 0.00 C ATOM 260 O GLY A 142 -16.748 9.910 -1.501 1.00 0.00 O ATOM 0 H GLY A 142 -13.350 9.581 0.968 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -14.955 11.029 0.377 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -14.406 11.010 -1.287 1.00 0.00 H new ATOM 264 N ASN A 143 -15.768 8.207 -0.377 1.00 0.00 N ATOM 265 CA ASN A 143 -16.826 7.223 -0.481 1.00 0.00 C ATOM 266 C ASN A 143 -16.931 6.616 0.929 1.00 0.00 C ATOM 267 O ASN A 143 -16.022 5.949 1.419 1.00 0.00 O ATOM 268 CB ASN A 143 -16.534 6.183 -1.584 1.00 0.00 C ATOM 269 CG ASN A 143 -15.520 6.586 -2.648 1.00 0.00 C ATOM 270 OD1 ASN A 143 -14.461 5.825 -2.790 1.00 0.00 O flip ATOM 271 ND2 ASN A 143 -15.678 7.529 -3.419 1.00 0.00 N flip ATOM 0 H ASN A 143 -14.936 7.836 0.081 1.00 0.00 H new ATOM 0 HA ASN A 143 -17.778 7.658 -0.787 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -16.182 5.269 -1.106 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -17.473 5.941 -2.082 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -16.495 8.133 -3.326 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -14.992 7.708 -4.153 1.00 0.00 H new ATOM 278 N ASP A 144 -18.013 6.920 1.633 1.00 0.00 N ATOM 279 CA ASP A 144 -18.160 6.648 3.060 1.00 0.00 C ATOM 280 C ASP A 144 -18.252 5.168 3.406 1.00 0.00 C ATOM 281 O ASP A 144 -17.817 4.746 4.476 1.00 0.00 O ATOM 282 CB ASP A 144 -19.325 7.446 3.634 1.00 0.00 C ATOM 283 CG ASP A 144 -18.918 8.912 3.596 1.00 0.00 C ATOM 284 OD1 ASP A 144 -18.050 9.300 4.430 1.00 0.00 O ATOM 285 OD2 ASP A 144 -19.340 9.607 2.635 1.00 0.00 O ATOM 0 H ASP A 144 -18.830 7.371 1.222 1.00 0.00 H new ATOM 0 HA ASP A 144 -17.238 6.982 3.536 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -20.231 7.281 3.050 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -19.542 7.132 4.655 1.00 0.00 H new ATOM 290 N TRP A 145 -18.720 4.376 2.443 1.00 0.00 N ATOM 291 CA TRP A 145 -18.758 2.922 2.508 1.00 0.00 C ATOM 292 C TRP A 145 -17.344 2.312 2.459 1.00 0.00 C ATOM 293 O TRP A 145 -17.161 1.162 2.855 1.00 0.00 O ATOM 294 CB TRP A 145 -19.636 2.423 1.355 1.00 0.00 C ATOM 295 CG TRP A 145 -18.920 2.160 0.065 1.00 0.00 C ATOM 296 CD1 TRP A 145 -18.088 3.011 -0.576 1.00 0.00 C ATOM 297 CD2 TRP A 145 -18.911 0.934 -0.721 1.00 0.00 C ATOM 298 NE1 TRP A 145 -17.476 2.361 -1.628 1.00 0.00 N ATOM 299 CE2 TRP A 145 -17.961 1.081 -1.774 1.00 0.00 C ATOM 300 CE3 TRP A 145 -19.624 -0.284 -0.653 1.00 0.00 C ATOM 301 CZ2 TRP A 145 -17.712 0.058 -2.699 1.00 0.00 C ATOM 302 CZ3 TRP A 145 -19.401 -1.305 -1.593 1.00 0.00 C ATOM 303 CH2 TRP A 145 -18.449 -1.137 -2.611 1.00 0.00 C ATOM 0 H TRP A 145 -19.095 4.744 1.569 1.00 0.00 H new ATOM 0 HA TRP A 145 -19.184 2.604 3.459 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -20.131 1.504 1.670 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -20.418 3.160 1.172 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -17.927 4.044 -0.305 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -16.757 2.775 -2.221 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -20.350 -0.433 0.132 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -16.965 0.185 -3.468 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -19.965 -2.224 -1.532 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -18.282 -1.927 -3.328 1.00 0.00 H new ATOM 314 N GLU A 146 -16.355 3.103 2.032 1.00 0.00 N ATOM 315 CA GLU A 146 -14.923 2.835 2.035 1.00 0.00 C ATOM 316 C GLU A 146 -14.270 3.438 3.288 1.00 0.00 C ATOM 317 O GLU A 146 -13.520 2.754 3.981 1.00 0.00 O ATOM 318 CB GLU A 146 -14.323 3.371 0.725 1.00 0.00 C ATOM 319 CG GLU A 146 -14.067 2.272 -0.317 1.00 0.00 C ATOM 320 CD GLU A 146 -13.946 2.864 -1.716 1.00 0.00 C ATOM 321 OE1 GLU A 146 -14.981 3.228 -2.317 1.00 0.00 O ATOM 322 OE2 GLU A 146 -12.816 3.034 -2.232 1.00 0.00 O ATOM 0 H GLU A 146 -16.558 4.024 1.644 1.00 0.00 H new ATOM 0 HA GLU A 146 -14.729 1.763 2.080 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -14.998 4.115 0.301 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -13.385 3.881 0.944 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -13.153 1.733 -0.066 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -14.881 1.547 -0.294 1.00 0.00 H new ATOM 329 N ASP A 147 -14.635 4.675 3.645 1.00 0.00 N ATOM 330 CA ASP A 147 -14.206 5.371 4.867 1.00 0.00 C ATOM 331 C ASP A 147 -14.397 4.483 6.102 1.00 0.00 C ATOM 332 O ASP A 147 -13.485 4.342 6.927 1.00 0.00 O ATOM 333 CB ASP A 147 -15.018 6.657 4.984 1.00 0.00 C ATOM 334 CG ASP A 147 -14.311 7.829 5.652 1.00 0.00 C ATOM 335 OD1 ASP A 147 -13.237 8.280 5.158 1.00 0.00 O ATOM 336 OD2 ASP A 147 -14.892 8.360 6.628 1.00 0.00 O ATOM 0 H ASP A 147 -15.260 5.241 3.071 1.00 0.00 H new ATOM 0 HA ASP A 147 -13.143 5.606 4.810 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -15.323 6.964 3.984 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -15.928 6.440 5.543 1.00 0.00 H new ATOM 341 N ARG A 148 -15.582 3.856 6.168 1.00 0.00 N ATOM 342 CA ARG A 148 -15.920 2.802 7.128 1.00 0.00 C ATOM 343 C ARG A 148 -15.175 1.487 6.893 1.00 0.00 C ATOM 344 O ARG A 148 -14.670 0.931 7.861 1.00 0.00 O ATOM 345 CB ARG A 148 -17.442 2.627 7.276 1.00 0.00 C ATOM 346 CG ARG A 148 -18.146 2.129 6.008 1.00 0.00 C ATOM 347 CD ARG A 148 -18.669 0.692 6.102 1.00 0.00 C ATOM 348 NE ARG A 148 -18.808 0.098 4.765 1.00 0.00 N ATOM 349 CZ ARG A 148 -19.359 -1.060 4.435 1.00 0.00 C ATOM 350 NH1 ARG A 148 -19.953 -1.824 5.316 1.00 0.00 N ATOM 351 NH2 ARG A 148 -19.272 -1.476 3.190 1.00 0.00 N ATOM 0 H ARG A 148 -16.351 4.077 5.535 1.00 0.00 H new ATOM 0 HA ARG A 148 -15.552 3.147 8.095 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -17.638 1.925 8.086 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -17.879 3.582 7.569 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -18.981 2.793 5.785 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -17.452 2.197 5.170 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -17.987 0.091 6.703 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -19.633 0.684 6.610 1.00 0.00 H new ATOM 0 HE ARG A 148 -18.432 0.648 3.993 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -20.002 -1.533 6.292 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -20.367 -2.710 5.026 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -18.786 -0.909 2.496 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -19.691 -2.366 2.919 1.00 0.00 H new ATOM 365 N TYR A 149 -15.033 0.990 5.655 1.00 0.00 N ATOM 366 CA TYR A 149 -14.378 -0.295 5.412 1.00 0.00 C ATOM 367 C TYR A 149 -12.938 -0.316 5.924 1.00 0.00 C ATOM 368 O TYR A 149 -12.501 -1.321 6.479 1.00 0.00 O ATOM 369 CB TYR A 149 -14.378 -0.632 3.927 1.00 0.00 C ATOM 370 CG TYR A 149 -14.724 -2.077 3.685 1.00 0.00 C ATOM 371 CD1 TYR A 149 -16.075 -2.435 3.746 1.00 0.00 C ATOM 372 CD2 TYR A 149 -13.737 -3.062 3.499 1.00 0.00 C ATOM 373 CE1 TYR A 149 -16.466 -3.769 3.574 1.00 0.00 C ATOM 374 CE2 TYR A 149 -14.125 -4.411 3.353 1.00 0.00 C ATOM 375 CZ TYR A 149 -15.494 -4.768 3.360 1.00 0.00 C ATOM 376 OH TYR A 149 -15.904 -6.048 3.125 1.00 0.00 O ATOM 0 H TYR A 149 -15.363 1.460 4.812 1.00 0.00 H new ATOM 0 HA TYR A 149 -14.951 -1.041 5.962 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -15.094 0.006 3.409 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -13.396 -0.417 3.505 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -16.822 -1.677 3.927 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -12.693 -2.789 3.468 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -17.513 -4.033 3.605 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -13.372 -5.176 3.235 1.00 0.00 H new ATOM 0 HH TYR A 149 -15.121 -6.624 2.995 1.00 0.00 H new ATOM 386 N TYR A 150 -12.233 0.806 5.769 1.00 0.00 N ATOM 387 CA TYR A 150 -10.940 1.071 6.388 1.00 0.00 C ATOM 388 C TYR A 150 -11.021 0.801 7.899 1.00 0.00 C ATOM 389 O TYR A 150 -10.443 -0.183 8.368 1.00 0.00 O ATOM 390 CB TYR A 150 -10.527 2.501 5.994 1.00 0.00 C ATOM 391 CG TYR A 150 -9.357 3.165 6.697 1.00 0.00 C ATOM 392 CD1 TYR A 150 -8.273 2.425 7.205 1.00 0.00 C ATOM 393 CD2 TYR A 150 -9.356 4.567 6.826 1.00 0.00 C ATOM 394 CE1 TYR A 150 -7.249 3.076 7.919 1.00 0.00 C ATOM 395 CE2 TYR A 150 -8.318 5.229 7.507 1.00 0.00 C ATOM 396 CZ TYR A 150 -7.270 4.478 8.080 1.00 0.00 C ATOM 397 OH TYR A 150 -6.286 5.101 8.785 1.00 0.00 O ATOM 0 H TYR A 150 -12.560 1.579 5.189 1.00 0.00 H new ATOM 0 HA TYR A 150 -10.155 0.403 6.034 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -10.305 2.494 4.927 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -11.398 3.142 6.134 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -8.227 1.358 7.047 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -10.163 5.142 6.396 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -6.442 2.499 8.346 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -8.323 6.306 7.591 1.00 0.00 H new ATOM 0 HH TYR A 150 -5.453 4.592 8.703 1.00 0.00 H new ATOM 407 N ARG A 151 -11.793 1.597 8.654 1.00 0.00 N ATOM 408 CA ARG A 151 -11.880 1.451 10.123 1.00 0.00 C ATOM 409 C ARG A 151 -12.487 0.125 10.623 1.00 0.00 C ATOM 410 O ARG A 151 -12.301 -0.222 11.796 1.00 0.00 O ATOM 411 CB ARG A 151 -12.534 2.681 10.762 1.00 0.00 C ATOM 412 CG ARG A 151 -13.877 3.071 10.147 1.00 0.00 C ATOM 413 CD ARG A 151 -14.302 4.441 10.645 1.00 0.00 C ATOM 414 NE ARG A 151 -15.542 4.924 10.000 1.00 0.00 N ATOM 415 CZ ARG A 151 -15.709 5.947 9.164 1.00 0.00 C ATOM 416 NH1 ARG A 151 -14.710 6.685 8.741 1.00 0.00 N ATOM 417 NH2 ARG A 151 -16.916 6.233 8.728 1.00 0.00 N ATOM 0 H ARG A 151 -12.368 2.350 8.276 1.00 0.00 H new ATOM 0 HA ARG A 151 -10.847 1.395 10.465 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -12.677 2.491 11.826 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -11.850 3.526 10.678 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -13.799 3.079 9.060 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -14.633 2.330 10.407 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -14.451 4.401 11.724 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -13.499 5.155 10.460 1.00 0.00 H new ATOM 0 HE ARG A 151 -16.387 4.400 10.227 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -13.760 6.484 9.053 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -14.884 7.460 8.100 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -17.713 5.673 9.030 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -17.055 7.014 8.087 1.00 0.00 H new ATOM 431 N GLU A 152 -13.175 -0.637 9.769 1.00 0.00 N ATOM 432 CA GLU A 152 -13.804 -1.923 10.054 1.00 0.00 C ATOM 433 C GLU A 152 -12.978 -3.151 9.652 1.00 0.00 C ATOM 434 O GLU A 152 -13.291 -4.258 10.114 1.00 0.00 O ATOM 435 CB GLU A 152 -15.116 -2.012 9.271 1.00 0.00 C ATOM 436 CG GLU A 152 -16.236 -1.135 9.836 1.00 0.00 C ATOM 437 CD GLU A 152 -17.643 -1.694 9.587 1.00 0.00 C ATOM 438 OE1 GLU A 152 -17.822 -2.903 9.267 1.00 0.00 O ATOM 439 OE2 GLU A 152 -18.625 -0.933 9.793 1.00 0.00 O ATOM 0 H GLU A 152 -13.315 -0.352 8.800 1.00 0.00 H new ATOM 0 HA GLU A 152 -13.929 -1.948 11.136 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -14.930 -1.725 8.236 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -15.451 -3.049 9.259 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -16.086 -1.017 10.909 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -16.166 -0.142 9.393 1.00 0.00 H new ATOM 446 N ASN A 153 -11.959 -3.007 8.790 1.00 0.00 N ATOM 447 CA ASN A 153 -11.245 -4.158 8.226 1.00 0.00 C ATOM 448 C ASN A 153 -9.720 -4.000 8.238 1.00 0.00 C ATOM 449 O ASN A 153 -9.022 -4.983 8.015 1.00 0.00 O ATOM 450 CB ASN A 153 -11.780 -4.537 6.832 1.00 0.00 C ATOM 451 CG ASN A 153 -13.291 -4.712 6.808 1.00 0.00 C ATOM 452 OD1 ASN A 153 -13.835 -5.797 6.998 1.00 0.00 O ATOM 453 ND2 ASN A 153 -13.999 -3.624 6.623 1.00 0.00 N ATOM 0 H ASN A 153 -11.613 -2.103 8.470 1.00 0.00 H new ATOM 0 HA ASN A 153 -11.454 -4.994 8.894 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -11.497 -3.765 6.117 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -11.306 -5.463 6.505 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -15.018 -3.670 6.636 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -13.531 -2.731 6.467 1.00 0.00 H new ATOM 460 N MET A 154 -9.177 -2.824 8.579 1.00 0.00 N ATOM 461 CA MET A 154 -7.743 -2.539 8.622 1.00 0.00 C ATOM 462 C MET A 154 -6.908 -3.452 9.529 1.00 0.00 C ATOM 463 O MET A 154 -5.684 -3.515 9.412 1.00 0.00 O ATOM 464 CB MET A 154 -7.505 -1.076 9.004 1.00 0.00 C ATOM 465 CG MET A 154 -7.995 -0.766 10.416 1.00 0.00 C ATOM 466 SD MET A 154 -7.775 0.969 10.889 1.00 0.00 S ATOM 467 CE MET A 154 -8.503 0.916 12.546 1.00 0.00 C ATOM 0 H MET A 154 -9.747 -2.019 8.841 1.00 0.00 H new ATOM 0 HA MET A 154 -7.393 -2.746 7.611 1.00 0.00 H new ATOM 0 HB2 MET A 154 -6.441 -0.851 8.932 1.00 0.00 H new ATOM 0 HB3 MET A 154 -8.016 -0.428 8.292 1.00 0.00 H new ATOM 0 HG2 MET A 154 -9.051 -1.024 10.491 1.00 0.00 H new ATOM 0 HG3 MET A 154 -7.461 -1.399 11.125 1.00 0.00 H new ATOM 0 HE1 MET A 154 -8.455 1.907 12.996 1.00 0.00 H new ATOM 0 HE2 MET A 154 -9.544 0.599 12.476 1.00 0.00 H new ATOM 0 HE3 MET A 154 -7.949 0.209 13.164 1.00 0.00 H new ATOM 477 N ASN A 155 -7.560 -4.174 10.439 1.00 0.00 N ATOM 478 CA ASN A 155 -6.963 -5.243 11.217 1.00 0.00 C ATOM 479 C ASN A 155 -6.490 -6.362 10.288 1.00 0.00 C ATOM 480 O ASN A 155 -5.320 -6.765 10.301 1.00 0.00 O ATOM 481 CB ASN A 155 -8.022 -5.722 12.218 1.00 0.00 C ATOM 482 CG ASN A 155 -8.389 -4.577 13.137 1.00 0.00 C ATOM 483 OD1 ASN A 155 -7.575 -4.173 13.964 1.00 0.00 O ATOM 484 ND2 ASN A 155 -9.555 -4.000 12.936 1.00 0.00 N ATOM 0 H ASN A 155 -8.545 -4.022 10.657 1.00 0.00 H new ATOM 0 HA ASN A 155 -6.083 -4.902 11.762 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -8.906 -6.077 11.689 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -7.639 -6.562 12.798 1.00 0.00 H new ATOM 0 HD21 ASN A 155 -9.818 -3.178 13.480 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -10.196 -4.375 12.237 1.00 0.00 H new ATOM 491 N ARG A 156 -7.421 -6.816 9.446 1.00 0.00 N ATOM 492 CA ARG A 156 -7.238 -7.803 8.399 1.00 0.00 C ATOM 493 C ARG A 156 -6.402 -7.241 7.250 1.00 0.00 C ATOM 494 O ARG A 156 -5.558 -7.966 6.721 1.00 0.00 O ATOM 495 CB ARG A 156 -8.600 -8.291 7.863 1.00 0.00 C ATOM 496 CG ARG A 156 -9.762 -8.335 8.867 1.00 0.00 C ATOM 497 CD ARG A 156 -9.542 -9.276 10.049 1.00 0.00 C ATOM 498 NE ARG A 156 -9.688 -10.667 9.612 1.00 0.00 N ATOM 499 CZ ARG A 156 -8.936 -11.705 9.923 1.00 0.00 C ATOM 500 NH1 ARG A 156 -7.963 -11.640 10.798 1.00 0.00 N ATOM 501 NH2 ARG A 156 -9.170 -12.835 9.321 1.00 0.00 N ATOM 0 H ARG A 156 -8.382 -6.477 9.487 1.00 0.00 H new ATOM 0 HA ARG A 156 -6.705 -8.648 8.835 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -8.891 -7.645 7.035 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -8.466 -9.292 7.454 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -9.935 -7.328 9.248 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -10.668 -8.637 8.342 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -8.549 -9.120 10.469 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -10.260 -9.056 10.839 1.00 0.00 H new ATOM 0 HE ARG A 156 -10.472 -10.857 8.987 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -7.761 -10.759 11.271 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -7.408 -12.470 11.006 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -9.918 -12.900 8.630 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -8.606 -13.656 9.540 1.00 0.00 H new ATOM 515 N TYR A 157 -6.588 -5.956 6.907 1.00 0.00 N ATOM 516 CA TYR A 157 -6.052 -5.390 5.670 1.00 0.00 C ATOM 517 C TYR A 157 -4.511 -5.374 5.634 1.00 0.00 C ATOM 518 O TYR A 157 -3.866 -5.237 6.682 1.00 0.00 O ATOM 519 CB TYR A 157 -6.779 -4.054 5.338 1.00 0.00 C ATOM 520 CG TYR A 157 -6.188 -2.659 5.572 1.00 0.00 C ATOM 521 CD1 TYR A 157 -5.176 -2.382 6.516 1.00 0.00 C ATOM 522 CD2 TYR A 157 -6.853 -1.569 4.968 1.00 0.00 C ATOM 523 CE1 TYR A 157 -4.802 -1.057 6.809 1.00 0.00 C ATOM 524 CE2 TYR A 157 -6.505 -0.240 5.284 1.00 0.00 C ATOM 525 CZ TYR A 157 -5.461 0.017 6.190 1.00 0.00 C ATOM 526 OH TYR A 157 -5.147 1.296 6.524 1.00 0.00 O ATOM 0 H TYR A 157 -7.110 -5.290 7.477 1.00 0.00 H new ATOM 0 HA TYR A 157 -6.280 -6.051 4.834 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -7.028 -4.102 4.278 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -7.720 -4.079 5.888 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -4.681 -3.199 7.021 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -7.640 -1.757 4.253 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -4.005 -0.866 7.513 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -7.040 0.581 4.830 1.00 0.00 H new ATOM 0 HH TYR A 157 -5.961 1.774 6.788 1.00 0.00 H new ATOM 536 N PRO A 158 -3.875 -5.577 4.467 1.00 0.00 N ATOM 537 CA PRO A 158 -2.462 -5.285 4.302 1.00 0.00 C ATOM 538 C PRO A 158 -2.273 -3.779 4.361 1.00 0.00 C ATOM 539 O PRO A 158 -2.992 -2.993 3.745 1.00 0.00 O ATOM 540 CB PRO A 158 -2.028 -5.901 2.987 1.00 0.00 C ATOM 541 CG PRO A 158 -3.320 -6.071 2.214 1.00 0.00 C ATOM 542 CD PRO A 158 -4.401 -6.228 3.283 1.00 0.00 C ATOM 0 HA PRO A 158 -1.841 -5.709 5.091 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -1.328 -5.256 2.456 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -1.527 -6.857 3.141 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -3.516 -5.208 1.578 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -3.279 -6.944 1.563 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -5.336 -5.768 2.965 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -4.613 -7.280 3.475 1.00 0.00 H new ATOM 550 N ASN A 159 -1.273 -3.410 5.142 1.00 0.00 N ATOM 551 CA ASN A 159 -0.989 -2.076 5.606 1.00 0.00 C ATOM 552 C ASN A 159 0.513 -1.774 5.505 1.00 0.00 C ATOM 553 O ASN A 159 1.001 -0.834 6.135 1.00 0.00 O ATOM 554 CB ASN A 159 -1.491 -2.030 7.051 1.00 0.00 C ATOM 555 CG ASN A 159 -0.602 -2.814 7.989 1.00 0.00 C ATOM 556 OD1 ASN A 159 -0.302 -3.988 7.795 1.00 0.00 O ATOM 557 ND2 ASN A 159 -0.174 -2.160 9.031 1.00 0.00 N ATOM 0 H ASN A 159 -0.594 -4.087 5.489 1.00 0.00 H new ATOM 0 HA ASN A 159 -1.482 -1.315 5.001 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -1.542 -0.993 7.383 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -2.504 -2.429 7.095 1.00 0.00 H new ATOM 0 HD21 ASN A 159 0.427 -2.623 9.712 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -0.440 -1.185 9.166 1.00 0.00 H new ATOM 564 N GLN A 160 1.254 -2.575 4.730 1.00 0.00 N ATOM 565 CA GLN A 160 2.650 -2.314 4.458 1.00 0.00 C ATOM 566 C GLN A 160 3.055 -2.618 3.011 1.00 0.00 C ATOM 567 O GLN A 160 2.547 -3.576 2.428 1.00 0.00 O ATOM 568 CB GLN A 160 3.545 -3.121 5.372 1.00 0.00 C ATOM 569 CG GLN A 160 3.123 -3.653 6.744 1.00 0.00 C ATOM 570 CD GLN A 160 4.330 -4.222 7.508 1.00 0.00 C ATOM 571 OE1 GLN A 160 5.530 -4.152 6.941 1.00 0.00 O flip ATOM 572 NE2 GLN A 160 4.180 -4.739 8.608 1.00 0.00 N flip ATOM 0 H GLN A 160 0.893 -3.417 4.281 1.00 0.00 H new ATOM 0 HA GLN A 160 2.778 -1.246 4.635 1.00 0.00 H new ATOM 0 HB2 GLN A 160 3.863 -3.990 4.795 1.00 0.00 H new ATOM 0 HB3 GLN A 160 4.432 -2.511 5.544 1.00 0.00 H new ATOM 0 HG2 GLN A 160 2.666 -2.852 7.324 1.00 0.00 H new ATOM 0 HG3 GLN A 160 2.367 -4.429 6.621 1.00 0.00 H new ATOM 0 HE21 GLN A 160 3.252 -4.784 9.028 1.00 0.00 H new ATOM 0 HE22 GLN A 160 4.983 -5.125 9.104 1.00 0.00 H new ATOM 581 N VAL A 161 4.037 -1.878 2.475 1.00 0.00 N ATOM 582 CA VAL A 161 4.291 -1.825 1.027 1.00 0.00 C ATOM 583 C VAL A 161 5.724 -2.228 0.629 1.00 0.00 C ATOM 584 O VAL A 161 6.697 -1.655 1.123 1.00 0.00 O ATOM 585 CB VAL A 161 3.831 -0.448 0.471 1.00 0.00 C ATOM 586 CG1 VAL A 161 3.007 0.391 1.455 1.00 0.00 C ATOM 587 CG2 VAL A 161 4.946 0.457 -0.035 1.00 0.00 C ATOM 0 H VAL A 161 4.673 -1.303 3.028 1.00 0.00 H new ATOM 0 HA VAL A 161 3.688 -2.594 0.545 1.00 0.00 H new ATOM 0 HB VAL A 161 3.214 -0.770 -0.368 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.729 1.334 0.985 1.00 0.00 H new ATOM 0 HG12 VAL A 161 2.106 -0.155 1.733 1.00 0.00 H new ATOM 0 HG13 VAL A 161 3.600 0.592 2.347 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.519 1.391 -0.401 1.00 0.00 H new ATOM 0 HG22 VAL A 161 5.640 0.669 0.778 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.479 -0.040 -0.846 1.00 0.00 H new ATOM 597 N TYR A 162 5.847 -3.194 -0.286 1.00 0.00 N ATOM 598 CA TYR A 162 7.091 -3.593 -0.965 1.00 0.00 C ATOM 599 C TYR A 162 7.358 -2.707 -2.189 1.00 0.00 C ATOM 600 O TYR A 162 6.451 -2.496 -2.987 1.00 0.00 O ATOM 601 CB TYR A 162 6.957 -5.037 -1.458 1.00 0.00 C ATOM 602 CG TYR A 162 7.257 -6.112 -0.443 1.00 0.00 C ATOM 603 CD1 TYR A 162 8.580 -6.427 -0.080 1.00 0.00 C ATOM 604 CD2 TYR A 162 6.187 -6.830 0.105 1.00 0.00 C ATOM 605 CE1 TYR A 162 8.825 -7.447 0.860 1.00 0.00 C ATOM 606 CE2 TYR A 162 6.418 -7.844 1.046 1.00 0.00 C ATOM 607 CZ TYR A 162 7.743 -8.154 1.430 1.00 0.00 C ATOM 608 OH TYR A 162 7.970 -9.145 2.333 1.00 0.00 O ATOM 0 H TYR A 162 5.046 -3.747 -0.590 1.00 0.00 H new ATOM 0 HA TYR A 162 7.910 -3.491 -0.254 1.00 0.00 H new ATOM 0 HB2 TYR A 162 5.940 -5.183 -1.823 1.00 0.00 H new ATOM 0 HB3 TYR A 162 7.624 -5.173 -2.310 1.00 0.00 H new ATOM 0 HD1 TYR A 162 9.405 -5.888 -0.521 1.00 0.00 H new ATOM 0 HD2 TYR A 162 5.176 -6.601 -0.199 1.00 0.00 H new ATOM 0 HE1 TYR A 162 9.839 -7.688 1.145 1.00 0.00 H new ATOM 0 HE2 TYR A 162 5.588 -8.385 1.475 1.00 0.00 H new ATOM 0 HH TYR A 162 7.115 -9.525 2.624 1.00 0.00 H new ATOM 618 N TYR A 163 8.599 -2.257 -2.409 1.00 0.00 N ATOM 619 CA TYR A 163 8.989 -1.556 -3.643 1.00 0.00 C ATOM 620 C TYR A 163 10.431 -1.841 -4.046 1.00 0.00 C ATOM 621 O TYR A 163 11.270 -2.123 -3.193 1.00 0.00 O ATOM 622 CB TYR A 163 8.804 -0.043 -3.484 1.00 0.00 C ATOM 623 CG TYR A 163 9.304 0.570 -2.191 1.00 0.00 C ATOM 624 CD1 TYR A 163 8.474 0.572 -1.057 1.00 0.00 C ATOM 625 CD2 TYR A 163 10.570 1.178 -2.131 1.00 0.00 C ATOM 626 CE1 TYR A 163 8.873 1.241 0.111 1.00 0.00 C ATOM 627 CE2 TYR A 163 10.986 1.827 -0.958 1.00 0.00 C ATOM 628 CZ TYR A 163 10.126 1.891 0.164 1.00 0.00 C ATOM 629 OH TYR A 163 10.516 2.529 1.305 1.00 0.00 O ATOM 0 H TYR A 163 9.361 -2.367 -1.740 1.00 0.00 H new ATOM 0 HA TYR A 163 8.337 -1.933 -4.431 1.00 0.00 H new ATOM 0 HB2 TYR A 163 9.310 0.451 -4.313 1.00 0.00 H new ATOM 0 HB3 TYR A 163 7.742 0.182 -3.579 1.00 0.00 H new ATOM 0 HD1 TYR A 163 7.525 0.057 -1.084 1.00 0.00 H new ATOM 0 HD2 TYR A 163 11.224 1.146 -2.990 1.00 0.00 H new ATOM 0 HE1 TYR A 163 8.220 1.259 0.971 1.00 0.00 H new ATOM 0 HE2 TYR A 163 11.966 2.279 -0.912 1.00 0.00 H new ATOM 0 HH TYR A 163 11.490 2.473 1.395 1.00 0.00 H new ATOM 639 N ARG A 164 10.733 -1.746 -5.348 1.00 0.00 N ATOM 640 CA ARG A 164 12.121 -1.722 -5.822 1.00 0.00 C ATOM 641 C ARG A 164 12.758 -0.408 -5.349 1.00 0.00 C ATOM 642 O ARG A 164 12.034 0.572 -5.212 1.00 0.00 O ATOM 643 CB ARG A 164 12.184 -1.827 -7.355 1.00 0.00 C ATOM 644 CG ARG A 164 11.553 -3.136 -7.865 1.00 0.00 C ATOM 645 CD ARG A 164 12.142 -3.711 -9.158 1.00 0.00 C ATOM 646 NE ARG A 164 13.577 -4.041 -9.046 1.00 0.00 N ATOM 647 CZ ARG A 164 14.221 -5.098 -9.520 1.00 0.00 C ATOM 648 NH1 ARG A 164 13.606 -6.050 -10.178 1.00 0.00 N ATOM 649 NH2 ARG A 164 15.524 -5.190 -9.360 1.00 0.00 N ATOM 0 H ARG A 164 10.035 -1.685 -6.090 1.00 0.00 H new ATOM 0 HA ARG A 164 12.664 -2.576 -5.417 1.00 0.00 H new ATOM 0 HB2 ARG A 164 11.666 -0.977 -7.799 1.00 0.00 H new ATOM 0 HB3 ARG A 164 13.223 -1.773 -7.681 1.00 0.00 H new ATOM 0 HG2 ARG A 164 11.645 -3.889 -7.082 1.00 0.00 H new ATOM 0 HG3 ARG A 164 10.488 -2.965 -8.020 1.00 0.00 H new ATOM 0 HD2 ARG A 164 11.589 -4.609 -9.434 1.00 0.00 H new ATOM 0 HD3 ARG A 164 12.003 -2.991 -9.965 1.00 0.00 H new ATOM 0 HE ARG A 164 14.148 -3.366 -8.537 1.00 0.00 H new ATOM 0 HH11 ARG A 164 12.601 -5.991 -10.339 1.00 0.00 H new ATOM 0 HH12 ARG A 164 14.133 -6.850 -10.529 1.00 0.00 H new ATOM 0 HH21 ARG A 164 16.032 -4.451 -8.874 1.00 0.00 H new ATOM 0 HH22 ARG A 164 16.026 -6.001 -9.722 1.00 0.00 H new ATOM 663 N PRO A 165 14.070 -0.318 -5.092 1.00 0.00 N ATOM 664 CA PRO A 165 14.691 0.963 -4.756 1.00 0.00 C ATOM 665 C PRO A 165 14.504 2.021 -5.845 1.00 0.00 C ATOM 666 O PRO A 165 14.540 1.698 -7.032 1.00 0.00 O ATOM 667 CB PRO A 165 16.162 0.649 -4.513 1.00 0.00 C ATOM 668 CG PRO A 165 16.120 -0.811 -4.086 1.00 0.00 C ATOM 669 CD PRO A 165 15.016 -1.406 -4.951 1.00 0.00 C ATOM 0 HA PRO A 165 14.220 1.402 -3.876 1.00 0.00 H new ATOM 0 HB2 PRO A 165 16.761 0.792 -5.412 1.00 0.00 H new ATOM 0 HB3 PRO A 165 16.591 1.286 -3.739 1.00 0.00 H new ATOM 0 HG2 PRO A 165 17.075 -1.307 -4.258 1.00 0.00 H new ATOM 0 HG3 PRO A 165 15.896 -0.912 -3.024 1.00 0.00 H new ATOM 0 HD2 PRO A 165 15.397 -1.734 -5.918 1.00 0.00 H new ATOM 0 HD3 PRO A 165 14.560 -2.275 -4.477 1.00 0.00 H new ATOM 677 N VAL A 166 14.351 3.289 -5.462 1.00 0.00 N ATOM 678 CA VAL A 166 14.072 4.408 -6.398 1.00 0.00 C ATOM 679 C VAL A 166 15.205 4.733 -7.381 1.00 0.00 C ATOM 680 O VAL A 166 15.021 5.529 -8.306 1.00 0.00 O ATOM 681 CB VAL A 166 13.729 5.699 -5.647 1.00 0.00 C ATOM 682 CG1 VAL A 166 12.354 5.624 -4.978 1.00 0.00 C ATOM 683 CG2 VAL A 166 14.827 6.077 -4.654 1.00 0.00 C ATOM 0 H VAL A 166 14.416 3.584 -4.488 1.00 0.00 H new ATOM 0 HA VAL A 166 13.224 4.045 -6.978 1.00 0.00 H new ATOM 0 HB VAL A 166 13.674 6.497 -6.387 1.00 0.00 H new ATOM 0 HG11 VAL A 166 12.151 6.560 -4.457 1.00 0.00 H new ATOM 0 HG12 VAL A 166 11.589 5.458 -5.736 1.00 0.00 H new ATOM 0 HG13 VAL A 166 12.341 4.801 -4.264 1.00 0.00 H new ATOM 0 HG21 VAL A 166 14.551 6.997 -4.139 1.00 0.00 H new ATOM 0 HG22 VAL A 166 14.950 5.276 -3.925 1.00 0.00 H new ATOM 0 HG23 VAL A 166 15.765 6.228 -5.189 1.00 0.00 H new ATOM 693 N ASP A 167 16.380 4.145 -7.174 1.00 0.00 N ATOM 694 CA ASP A 167 17.612 4.484 -7.881 1.00 0.00 C ATOM 695 C ASP A 167 17.600 4.276 -9.406 1.00 0.00 C ATOM 696 O ASP A 167 18.236 5.064 -10.115 1.00 0.00 O ATOM 697 CB ASP A 167 18.820 3.813 -7.212 1.00 0.00 C ATOM 698 CG ASP A 167 18.698 2.318 -6.894 1.00 0.00 C ATOM 699 OD1 ASP A 167 18.086 1.526 -7.652 1.00 0.00 O ATOM 700 OD2 ASP A 167 19.262 1.926 -5.845 1.00 0.00 O ATOM 0 H ASP A 167 16.505 3.398 -6.490 1.00 0.00 H new ATOM 0 HA ASP A 167 17.699 5.566 -7.786 1.00 0.00 H new ATOM 0 HB2 ASP A 167 19.686 3.952 -7.859 1.00 0.00 H new ATOM 0 HB3 ASP A 167 19.029 4.341 -6.282 1.00 0.00 H new ATOM 705 N GLN A 168 16.854 3.304 -9.947 1.00 0.00 N ATOM 706 CA GLN A 168 16.712 3.111 -11.397 1.00 0.00 C ATOM 707 C GLN A 168 15.679 4.037 -12.042 1.00 0.00 C ATOM 708 O GLN A 168 15.594 4.157 -13.269 1.00 0.00 O ATOM 709 CB GLN A 168 16.274 1.669 -11.679 1.00 0.00 C ATOM 710 CG GLN A 168 17.430 0.885 -12.280 1.00 0.00 C ATOM 711 CD GLN A 168 18.475 0.544 -11.235 1.00 0.00 C ATOM 712 OE1 GLN A 168 19.519 1.182 -11.112 1.00 0.00 O ATOM 713 NE2 GLN A 168 18.200 -0.472 -10.452 1.00 0.00 N ATOM 0 H GLN A 168 16.331 2.628 -9.391 1.00 0.00 H new ATOM 0 HA GLN A 168 17.687 3.341 -11.827 1.00 0.00 H new ATOM 0 HB2 GLN A 168 15.942 1.194 -10.756 1.00 0.00 H new ATOM 0 HB3 GLN A 168 15.426 1.665 -12.363 1.00 0.00 H new ATOM 0 HG2 GLN A 168 17.053 -0.033 -12.731 1.00 0.00 H new ATOM 0 HG3 GLN A 168 17.889 1.467 -13.079 1.00 0.00 H new ATOM 0 HE21 GLN A 168 17.328 -0.987 -10.572 1.00 0.00 H new ATOM 0 HE22 GLN A 168 18.858 -0.747 -9.723 1.00 0.00 H new ATOM 722 N TYR A 169 14.883 4.681 -11.203 1.00 0.00 N ATOM 723 CA TYR A 169 13.654 5.363 -11.531 1.00 0.00 C ATOM 724 C TYR A 169 13.787 6.870 -11.364 1.00 0.00 C ATOM 725 O TYR A 169 14.801 7.406 -10.893 1.00 0.00 O ATOM 726 CB TYR A 169 12.550 4.762 -10.642 1.00 0.00 C ATOM 727 CG TYR A 169 12.488 3.249 -10.718 1.00 0.00 C ATOM 728 CD1 TYR A 169 11.748 2.613 -11.732 1.00 0.00 C ATOM 729 CD2 TYR A 169 13.226 2.478 -9.804 1.00 0.00 C ATOM 730 CE1 TYR A 169 11.806 1.214 -11.874 1.00 0.00 C ATOM 731 CE2 TYR A 169 13.273 1.082 -9.931 1.00 0.00 C ATOM 732 CZ TYR A 169 12.586 0.445 -10.981 1.00 0.00 C ATOM 733 OH TYR A 169 12.715 -0.903 -11.119 1.00 0.00 O ATOM 0 H TYR A 169 15.099 4.741 -10.208 1.00 0.00 H new ATOM 0 HA TYR A 169 13.399 5.217 -12.581 1.00 0.00 H new ATOM 0 HB2 TYR A 169 12.720 5.062 -9.608 1.00 0.00 H new ATOM 0 HB3 TYR A 169 11.586 5.175 -10.939 1.00 0.00 H new ATOM 0 HD1 TYR A 169 11.135 3.199 -12.401 1.00 0.00 H new ATOM 0 HD2 TYR A 169 13.760 2.963 -9.000 1.00 0.00 H new ATOM 0 HE1 TYR A 169 11.254 0.728 -12.665 1.00 0.00 H new ATOM 0 HE2 TYR A 169 13.837 0.495 -9.222 1.00 0.00 H new ATOM 0 HH TYR A 169 13.293 -1.251 -10.408 1.00 0.00 H new ATOM 743 N ASN A 170 12.721 7.542 -11.775 1.00 0.00 N ATOM 744 CA ASN A 170 12.581 8.986 -11.847 1.00 0.00 C ATOM 745 C ASN A 170 11.126 9.464 -11.704 1.00 0.00 C ATOM 746 O ASN A 170 10.847 10.669 -11.764 1.00 0.00 O ATOM 747 CB ASN A 170 13.201 9.405 -13.184 1.00 0.00 C ATOM 748 CG ASN A 170 12.577 8.812 -14.448 1.00 0.00 C ATOM 749 OD1 ASN A 170 11.661 7.986 -14.445 1.00 0.00 O ATOM 750 ND2 ASN A 170 13.098 9.211 -15.589 1.00 0.00 N ATOM 0 H ASN A 170 11.878 7.060 -12.087 1.00 0.00 H new ATOM 0 HA ASN A 170 13.092 9.457 -11.008 1.00 0.00 H new ATOM 0 HB2 ASN A 170 13.150 10.491 -13.257 1.00 0.00 H new ATOM 0 HB3 ASN A 170 14.257 9.136 -13.168 1.00 0.00 H new ATOM 0 HD21 ASN A 170 12.744 8.837 -16.470 1.00 0.00 H new ATOM 0 HD22 ASN A 170 13.856 9.894 -15.593 1.00 0.00 H new ATOM 757 N ASN A 171 10.182 8.538 -11.519 1.00 0.00 N ATOM 758 CA ASN A 171 8.760 8.810 -11.537 1.00 0.00 C ATOM 759 C ASN A 171 8.033 7.792 -10.671 1.00 0.00 C ATOM 760 O ASN A 171 8.477 6.654 -10.510 1.00 0.00 O ATOM 761 CB ASN A 171 8.248 8.747 -12.977 1.00 0.00 C ATOM 762 CG ASN A 171 6.942 9.485 -13.150 1.00 0.00 C ATOM 763 OD1 ASN A 171 6.871 10.703 -13.011 1.00 0.00 O ATOM 764 ND2 ASN A 171 5.894 8.745 -13.422 1.00 0.00 N ATOM 0 H ASN A 171 10.401 7.556 -11.349 1.00 0.00 H new ATOM 0 HA ASN A 171 8.572 9.807 -11.138 1.00 0.00 H new ATOM 0 HB2 ASN A 171 8.996 9.173 -13.646 1.00 0.00 H new ATOM 0 HB3 ASN A 171 8.116 7.705 -13.269 1.00 0.00 H new ATOM 0 HD21 ASN A 171 4.977 9.179 -13.526 1.00 0.00 H new ATOM 0 HD22 ASN A 171 5.996 7.736 -13.530 1.00 0.00 H new ATOM 771 N GLN A 172 6.897 8.223 -10.140 1.00 0.00 N ATOM 772 CA GLN A 172 6.190 7.502 -9.115 1.00 0.00 C ATOM 773 C GLN A 172 5.120 6.578 -9.662 1.00 0.00 C ATOM 774 O GLN A 172 5.147 5.407 -9.331 1.00 0.00 O ATOM 775 CB GLN A 172 5.598 8.549 -8.177 1.00 0.00 C ATOM 776 CG GLN A 172 6.642 8.903 -7.117 1.00 0.00 C ATOM 777 CD GLN A 172 6.372 10.230 -6.445 1.00 0.00 C ATOM 778 OE1 GLN A 172 7.073 11.225 -6.638 1.00 0.00 O ATOM 779 NE2 GLN A 172 5.315 10.312 -5.682 1.00 0.00 N ATOM 0 H GLN A 172 6.444 9.093 -10.418 1.00 0.00 H new ATOM 0 HA GLN A 172 6.880 6.841 -8.591 1.00 0.00 H new ATOM 0 HB2 GLN A 172 5.311 9.439 -8.737 1.00 0.00 H new ATOM 0 HB3 GLN A 172 4.694 8.165 -7.704 1.00 0.00 H new ATOM 0 HG2 GLN A 172 6.666 8.117 -6.362 1.00 0.00 H new ATOM 0 HG3 GLN A 172 7.628 8.930 -7.581 1.00 0.00 H new ATOM 0 HE21 GLN A 172 4.736 9.488 -5.523 1.00 0.00 H new ATOM 0 HE22 GLN A 172 5.069 11.200 -5.245 1.00 0.00 H new ATOM 788 N ASN A 173 4.210 7.051 -10.512 1.00 0.00 N ATOM 789 CA ASN A 173 2.977 6.322 -10.841 1.00 0.00 C ATOM 790 C ASN A 173 3.207 4.880 -11.295 1.00 0.00 C ATOM 791 O ASN A 173 2.497 3.968 -10.862 1.00 0.00 O ATOM 792 CB ASN A 173 2.126 7.112 -11.847 1.00 0.00 C ATOM 793 CG ASN A 173 2.888 7.684 -13.034 1.00 0.00 C ATOM 794 OD1 ASN A 173 3.207 8.869 -13.079 1.00 0.00 O ATOM 795 ND2 ASN A 173 3.259 6.852 -13.983 1.00 0.00 N ATOM 0 H ASN A 173 4.302 7.946 -10.992 1.00 0.00 H new ATOM 0 HA ASN A 173 2.419 6.236 -9.909 1.00 0.00 H new ATOM 0 HB2 ASN A 173 1.338 6.460 -12.222 1.00 0.00 H new ATOM 0 HB3 ASN A 173 1.638 7.932 -11.320 1.00 0.00 H new ATOM 0 HD21 ASN A 173 3.818 7.189 -14.767 1.00 0.00 H new ATOM 0 HD22 ASN A 173 2.988 5.870 -13.935 1.00 0.00 H new ATOM 802 N ASN A 174 4.218 4.706 -12.142 1.00 0.00 N ATOM 803 CA ASN A 174 4.676 3.461 -12.724 1.00 0.00 C ATOM 804 C ASN A 174 5.319 2.535 -11.684 1.00 0.00 C ATOM 805 O ASN A 174 4.876 1.397 -11.520 1.00 0.00 O ATOM 806 CB ASN A 174 5.638 3.808 -13.869 1.00 0.00 C ATOM 807 CG ASN A 174 6.706 4.826 -13.501 1.00 0.00 C ATOM 808 OD1 ASN A 174 6.413 6.010 -13.412 1.00 0.00 O ATOM 809 ND2 ASN A 174 7.927 4.405 -13.235 1.00 0.00 N ATOM 0 H ASN A 174 4.777 5.497 -12.460 1.00 0.00 H new ATOM 0 HA ASN A 174 3.826 2.900 -13.113 1.00 0.00 H new ATOM 0 HB2 ASN A 174 6.125 2.894 -14.208 1.00 0.00 H new ATOM 0 HB3 ASN A 174 5.060 4.192 -14.710 1.00 0.00 H new ATOM 0 HD21 ASN A 174 8.645 5.071 -12.950 1.00 0.00 H new ATOM 0 HD22 ASN A 174 8.153 3.414 -13.315 1.00 0.00 H new ATOM 816 N PHE A 175 6.338 3.020 -10.976 1.00 0.00 N ATOM 817 CA PHE A 175 7.005 2.370 -9.851 1.00 0.00 C ATOM 818 C PHE A 175 6.006 1.933 -8.789 1.00 0.00 C ATOM 819 O PHE A 175 6.032 0.819 -8.279 1.00 0.00 O ATOM 820 CB PHE A 175 7.941 3.425 -9.270 1.00 0.00 C ATOM 821 CG PHE A 175 8.686 3.059 -8.006 1.00 0.00 C ATOM 822 CD1 PHE A 175 8.052 3.142 -6.748 1.00 0.00 C ATOM 823 CD2 PHE A 175 10.055 2.763 -8.077 1.00 0.00 C ATOM 824 CE1 PHE A 175 8.797 3.008 -5.566 1.00 0.00 C ATOM 825 CE2 PHE A 175 10.800 2.632 -6.898 1.00 0.00 C ATOM 826 CZ PHE A 175 10.179 2.786 -5.646 1.00 0.00 C ATOM 0 H PHE A 175 6.744 3.932 -11.186 1.00 0.00 H new ATOM 0 HA PHE A 175 7.532 1.473 -10.176 1.00 0.00 H new ATOM 0 HB2 PHE A 175 8.675 3.684 -10.033 1.00 0.00 H new ATOM 0 HB3 PHE A 175 7.357 4.324 -9.071 1.00 0.00 H new ATOM 0 HD1 PHE A 175 6.986 3.310 -6.694 1.00 0.00 H new ATOM 0 HD2 PHE A 175 10.533 2.637 -9.037 1.00 0.00 H new ATOM 0 HE1 PHE A 175 8.310 3.075 -4.604 1.00 0.00 H new ATOM 0 HE2 PHE A 175 11.856 2.412 -6.951 1.00 0.00 H new ATOM 0 HZ PHE A 175 10.769 2.733 -4.743 1.00 0.00 H new ATOM 836 N VAL A 176 5.102 2.846 -8.458 1.00 0.00 N ATOM 837 CA VAL A 176 4.047 2.673 -7.481 1.00 0.00 C ATOM 838 C VAL A 176 3.042 1.620 -7.936 1.00 0.00 C ATOM 839 O VAL A 176 2.503 0.920 -7.084 1.00 0.00 O ATOM 840 CB VAL A 176 3.413 4.030 -7.173 1.00 0.00 C ATOM 841 CG1 VAL A 176 2.072 3.928 -6.472 1.00 0.00 C ATOM 842 CG2 VAL A 176 4.415 4.837 -6.344 1.00 0.00 C ATOM 0 H VAL A 176 5.088 3.771 -8.888 1.00 0.00 H new ATOM 0 HA VAL A 176 4.464 2.291 -6.549 1.00 0.00 H new ATOM 0 HB VAL A 176 3.196 4.532 -8.116 1.00 0.00 H new ATOM 0 HG11 VAL A 176 1.682 4.929 -6.285 1.00 0.00 H new ATOM 0 HG12 VAL A 176 1.373 3.378 -7.102 1.00 0.00 H new ATOM 0 HG13 VAL A 176 2.196 3.404 -5.524 1.00 0.00 H new ATOM 0 HG21 VAL A 176 3.990 5.813 -6.108 1.00 0.00 H new ATOM 0 HG22 VAL A 176 4.635 4.304 -5.419 1.00 0.00 H new ATOM 0 HG23 VAL A 176 5.335 4.970 -6.914 1.00 0.00 H new ATOM 852 N HIS A 177 2.862 1.430 -9.251 1.00 0.00 N ATOM 853 CA HIS A 177 2.039 0.321 -9.751 1.00 0.00 C ATOM 854 C HIS A 177 2.658 -1.015 -9.349 1.00 0.00 C ATOM 855 O HIS A 177 1.998 -1.834 -8.715 1.00 0.00 O ATOM 856 CB HIS A 177 1.843 0.406 -11.268 1.00 0.00 C ATOM 857 CG HIS A 177 0.725 -0.488 -11.753 1.00 0.00 C ATOM 858 ND1 HIS A 177 0.738 -1.871 -11.729 1.00 0.00 N ATOM 859 CD2 HIS A 177 -0.496 -0.088 -12.226 1.00 0.00 C ATOM 860 CE1 HIS A 177 -0.456 -2.302 -12.169 1.00 0.00 C ATOM 861 NE2 HIS A 177 -1.224 -1.241 -12.474 1.00 0.00 N ATOM 0 H HIS A 177 3.268 2.020 -9.977 1.00 0.00 H new ATOM 0 HA HIS A 177 1.052 0.397 -9.296 1.00 0.00 H new ATOM 0 HB2 HIS A 177 1.627 1.437 -11.547 1.00 0.00 H new ATOM 0 HB3 HIS A 177 2.771 0.128 -11.768 1.00 0.00 H new ATOM 0 HD2 HIS A 177 -0.828 0.929 -12.377 1.00 0.00 H new ATOM 0 HE1 HIS A 177 -0.752 -3.336 -12.263 1.00 0.00 H new ATOM 0 HE2 HIS A 177 -2.180 -1.278 -12.828 1.00 0.00 H new ATOM 870 N ASP A 178 3.939 -1.193 -9.688 1.00 0.00 N ATOM 871 CA ASP A 178 4.739 -2.355 -9.271 1.00 0.00 C ATOM 872 C ASP A 178 4.755 -2.529 -7.749 1.00 0.00 C ATOM 873 O ASP A 178 4.686 -3.655 -7.248 1.00 0.00 O ATOM 874 CB ASP A 178 6.205 -2.230 -9.702 1.00 0.00 C ATOM 875 CG ASP A 178 6.462 -2.476 -11.191 1.00 0.00 C ATOM 876 OD1 ASP A 178 6.638 -3.653 -11.617 1.00 0.00 O ATOM 877 OD2 ASP A 178 6.545 -1.483 -11.955 1.00 0.00 O ATOM 0 H ASP A 178 4.457 -0.530 -10.265 1.00 0.00 H new ATOM 0 HA ASP A 178 4.263 -3.208 -9.754 1.00 0.00 H new ATOM 0 HB2 ASP A 178 6.560 -1.231 -9.447 1.00 0.00 H new ATOM 0 HB3 ASP A 178 6.800 -2.937 -9.124 1.00 0.00 H new ATOM 882 N CYS A 179 4.866 -1.403 -7.039 1.00 0.00 N ATOM 883 CA CYS A 179 4.935 -1.325 -5.595 1.00 0.00 C ATOM 884 C CYS A 179 3.692 -1.963 -4.946 1.00 0.00 C ATOM 885 O CYS A 179 3.778 -2.975 -4.242 1.00 0.00 O ATOM 886 CB CYS A 179 5.093 0.134 -5.178 1.00 0.00 C ATOM 887 SG CYS A 179 5.128 0.446 -3.408 1.00 0.00 S ATOM 0 H CYS A 179 4.911 -0.486 -7.484 1.00 0.00 H new ATOM 0 HA CYS A 179 5.801 -1.888 -5.246 1.00 0.00 H new ATOM 0 HB2 CYS A 179 6.016 0.518 -5.613 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.273 0.706 -5.612 1.00 0.00 H new ATOM 892 N VAL A 180 2.513 -1.377 -5.221 1.00 0.00 N ATOM 893 CA VAL A 180 1.248 -1.845 -4.650 1.00 0.00 C ATOM 894 C VAL A 180 0.960 -3.286 -5.031 1.00 0.00 C ATOM 895 O VAL A 180 0.508 -4.067 -4.193 1.00 0.00 O ATOM 896 CB VAL A 180 0.041 -0.974 -5.044 1.00 0.00 C ATOM 897 CG1 VAL A 180 0.217 0.430 -4.494 1.00 0.00 C ATOM 898 CG2 VAL A 180 -0.347 -0.801 -6.514 1.00 0.00 C ATOM 0 H VAL A 180 2.416 -0.573 -5.841 1.00 0.00 H new ATOM 0 HA VAL A 180 1.380 -1.768 -3.571 1.00 0.00 H new ATOM 0 HB VAL A 180 -0.768 -1.565 -4.615 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -0.640 1.041 -4.776 1.00 0.00 H new ATOM 0 HG12 VAL A 180 0.291 0.388 -3.407 1.00 0.00 H new ATOM 0 HG13 VAL A 180 1.127 0.870 -4.903 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -1.221 -0.153 -6.586 1.00 0.00 H new ATOM 0 HG22 VAL A 180 0.483 -0.352 -7.059 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -0.580 -1.774 -6.946 1.00 0.00 H new ATOM 908 N ASN A 181 1.279 -3.627 -6.282 1.00 0.00 N ATOM 909 CA ASN A 181 1.224 -4.956 -6.853 1.00 0.00 C ATOM 910 C ASN A 181 1.919 -5.980 -5.962 1.00 0.00 C ATOM 911 O ASN A 181 1.260 -6.923 -5.525 1.00 0.00 O ATOM 912 CB ASN A 181 1.797 -4.861 -8.268 1.00 0.00 C ATOM 913 CG ASN A 181 2.257 -6.158 -8.885 1.00 0.00 C ATOM 914 OD1 ASN A 181 1.486 -6.877 -9.513 1.00 0.00 O ATOM 915 ND2 ASN A 181 3.529 -6.467 -8.738 1.00 0.00 N ATOM 0 H ASN A 181 1.601 -2.933 -6.957 1.00 0.00 H new ATOM 0 HA ASN A 181 0.199 -5.321 -6.916 1.00 0.00 H new ATOM 0 HB2 ASN A 181 1.039 -4.422 -8.917 1.00 0.00 H new ATOM 0 HB3 ASN A 181 2.640 -4.171 -8.251 1.00 0.00 H new ATOM 0 HD21 ASN A 181 3.897 -7.324 -9.152 1.00 0.00 H new ATOM 0 HD22 ASN A 181 4.146 -5.850 -8.210 1.00 0.00 H new ATOM 922 N ILE A 182 3.222 -5.825 -5.692 1.00 0.00 N ATOM 923 CA ILE A 182 3.959 -6.897 -5.033 1.00 0.00 C ATOM 924 C ILE A 182 3.586 -7.044 -3.554 1.00 0.00 C ATOM 925 O ILE A 182 3.484 -8.180 -3.088 1.00 0.00 O ATOM 926 CB ILE A 182 5.476 -6.802 -5.299 1.00 0.00 C ATOM 927 CG1 ILE A 182 6.228 -8.017 -4.726 1.00 0.00 C ATOM 928 CG2 ILE A 182 6.100 -5.506 -4.754 1.00 0.00 C ATOM 929 CD1 ILE A 182 5.791 -9.360 -5.327 1.00 0.00 C ATOM 0 H ILE A 182 3.769 -4.993 -5.914 1.00 0.00 H new ATOM 0 HA ILE A 182 3.645 -7.836 -5.490 1.00 0.00 H new ATOM 0 HB ILE A 182 5.583 -6.792 -6.384 1.00 0.00 H new ATOM 0 HG12 ILE A 182 7.296 -7.884 -4.897 1.00 0.00 H new ATOM 0 HG13 ILE A 182 6.079 -8.048 -3.647 1.00 0.00 H new ATOM 0 HG21 ILE A 182 7.168 -5.497 -4.971 1.00 0.00 H new ATOM 0 HG22 ILE A 182 5.626 -4.647 -5.228 1.00 0.00 H new ATOM 0 HG23 ILE A 182 5.949 -5.455 -3.676 1.00 0.00 H new ATOM 0 HD11 ILE A 182 6.366 -10.166 -4.872 1.00 0.00 H new ATOM 0 HD12 ILE A 182 4.730 -9.517 -5.133 1.00 0.00 H new ATOM 0 HD13 ILE A 182 5.966 -9.351 -6.403 1.00 0.00 H new ATOM 941 N THR A 183 3.299 -5.944 -2.831 1.00 0.00 N ATOM 942 CA THR A 183 2.704 -6.072 -1.495 1.00 0.00 C ATOM 943 C THR A 183 1.398 -6.825 -1.600 1.00 0.00 C ATOM 944 O THR A 183 1.290 -7.910 -1.036 1.00 0.00 O ATOM 945 CB THR A 183 2.597 -4.737 -0.726 1.00 0.00 C ATOM 946 OG1 THR A 183 3.439 -4.862 0.394 1.00 0.00 O ATOM 947 CG2 THR A 183 1.226 -4.322 -0.171 1.00 0.00 C ATOM 0 H THR A 183 3.465 -4.986 -3.141 1.00 0.00 H new ATOM 0 HA THR A 183 3.384 -6.656 -0.875 1.00 0.00 H new ATOM 0 HB THR A 183 2.848 -3.974 -1.463 1.00 0.00 H new ATOM 0 HG1 THR A 183 2.918 -4.723 1.212 1.00 0.00 H new ATOM 0 HG21 THR A 183 1.316 -3.364 0.341 1.00 0.00 H new ATOM 0 HG22 THR A 183 0.514 -4.229 -0.991 1.00 0.00 H new ATOM 0 HG23 THR A 183 0.874 -5.078 0.531 1.00 0.00 H new ATOM 955 N ILE A 184 0.434 -6.297 -2.357 1.00 0.00 N ATOM 956 CA ILE A 184 -0.904 -6.889 -2.395 1.00 0.00 C ATOM 957 C ILE A 184 -0.814 -8.361 -2.810 1.00 0.00 C ATOM 958 O ILE A 184 -1.355 -9.184 -2.075 1.00 0.00 O ATOM 959 CB ILE A 184 -1.898 -6.031 -3.222 1.00 0.00 C ATOM 960 CG1 ILE A 184 -2.248 -4.756 -2.412 1.00 0.00 C ATOM 961 CG2 ILE A 184 -3.197 -6.794 -3.542 1.00 0.00 C ATOM 962 CD1 ILE A 184 -3.149 -3.727 -3.108 1.00 0.00 C ATOM 0 H ILE A 184 0.552 -5.472 -2.945 1.00 0.00 H new ATOM 0 HA ILE A 184 -1.332 -6.885 -1.393 1.00 0.00 H new ATOM 0 HB ILE A 184 -1.419 -5.779 -4.168 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -2.734 -5.063 -1.486 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -1.317 -4.262 -2.135 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -3.862 -6.154 -4.122 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -2.961 -7.689 -4.118 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -3.689 -7.081 -2.613 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -3.320 -2.883 -2.440 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -2.664 -3.376 -4.019 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.103 -4.190 -3.360 1.00 0.00 H new ATOM 974 N LYS A 185 -0.065 -8.740 -3.861 1.00 0.00 N ATOM 975 CA LYS A 185 0.169 -10.153 -4.219 1.00 0.00 C ATOM 976 C LYS A 185 0.562 -10.991 -3.003 1.00 0.00 C ATOM 977 O LYS A 185 -0.172 -11.895 -2.602 1.00 0.00 O ATOM 978 CB LYS A 185 1.254 -10.279 -5.302 1.00 0.00 C ATOM 979 CG LYS A 185 0.724 -9.962 -6.703 1.00 0.00 C ATOM 980 CD LYS A 185 1.853 -10.102 -7.732 1.00 0.00 C ATOM 981 CE LYS A 185 1.300 -10.014 -9.155 1.00 0.00 C ATOM 982 NZ LYS A 185 2.368 -10.244 -10.151 1.00 0.00 N ATOM 0 H LYS A 185 0.395 -8.078 -4.486 1.00 0.00 H new ATOM 0 HA LYS A 185 -0.773 -10.536 -4.611 1.00 0.00 H new ATOM 0 HB2 LYS A 185 2.077 -9.604 -5.067 1.00 0.00 H new ATOM 0 HB3 LYS A 185 1.658 -11.291 -5.290 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -0.094 -10.638 -6.953 1.00 0.00 H new ATOM 0 HG3 LYS A 185 0.320 -8.950 -6.728 1.00 0.00 H new ATOM 0 HD2 LYS A 185 2.594 -9.318 -7.575 1.00 0.00 H new ATOM 0 HD3 LYS A 185 2.363 -11.055 -7.593 1.00 0.00 H new ATOM 0 HE2 LYS A 185 0.508 -10.751 -9.288 1.00 0.00 H new ATOM 0 HE3 LYS A 185 0.853 -9.033 -9.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 1.969 -10.179 -11.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 3.111 -9.525 -10.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 2.777 -11.190 -10.009 1.00 0.00 H new ATOM 996 N GLN A 186 1.702 -10.670 -2.392 1.00 0.00 N ATOM 997 CA GLN A 186 2.260 -11.497 -1.324 1.00 0.00 C ATOM 998 C GLN A 186 1.427 -11.513 -0.042 1.00 0.00 C ATOM 999 O GLN A 186 1.378 -12.544 0.647 1.00 0.00 O ATOM 1000 CB GLN A 186 3.664 -11.017 -1.000 1.00 0.00 C ATOM 1001 CG GLN A 186 4.594 -11.297 -2.190 1.00 0.00 C ATOM 1002 CD GLN A 186 6.047 -11.289 -1.767 1.00 0.00 C ATOM 1003 OE1 GLN A 186 6.788 -12.249 -1.960 1.00 0.00 O ATOM 1004 NE2 GLN A 186 6.507 -10.220 -1.153 1.00 0.00 N ATOM 0 H GLN A 186 2.256 -9.844 -2.618 1.00 0.00 H new ATOM 0 HA GLN A 186 2.263 -12.520 -1.701 1.00 0.00 H new ATOM 0 HB2 GLN A 186 3.652 -9.950 -0.779 1.00 0.00 H new ATOM 0 HB3 GLN A 186 4.035 -11.523 -0.109 1.00 0.00 H new ATOM 0 HG2 GLN A 186 4.346 -12.264 -2.628 1.00 0.00 H new ATOM 0 HG3 GLN A 186 4.434 -10.546 -2.964 1.00 0.00 H new ATOM 0 HE21 GLN A 186 5.894 -9.421 -0.991 1.00 0.00 H new ATOM 0 HE22 GLN A 186 7.477 -10.190 -0.839 1.00 0.00 H new ATOM 1013 N HIS A 187 0.773 -10.392 0.284 1.00 0.00 N ATOM 1014 CA HIS A 187 0.119 -10.160 1.563 1.00 0.00 C ATOM 1015 C HIS A 187 -1.294 -10.696 1.521 1.00 0.00 C ATOM 1016 O HIS A 187 -1.765 -11.236 2.514 1.00 0.00 O ATOM 1017 CB HIS A 187 0.101 -8.663 1.895 1.00 0.00 C ATOM 1018 CG HIS A 187 0.851 -8.345 3.166 1.00 0.00 C ATOM 1019 ND1 HIS A 187 0.480 -8.663 4.463 1.00 0.00 N ATOM 1020 CD2 HIS A 187 2.129 -7.856 3.201 1.00 0.00 C ATOM 1021 CE1 HIS A 187 1.523 -8.377 5.263 1.00 0.00 C ATOM 1022 NE2 HIS A 187 2.531 -7.887 4.521 1.00 0.00 N ATOM 0 H HIS A 187 0.686 -9.604 -0.357 1.00 0.00 H new ATOM 0 HA HIS A 187 0.679 -10.680 2.340 1.00 0.00 H new ATOM 0 HB2 HIS A 187 0.540 -8.105 1.068 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -0.932 -8.328 1.992 1.00 0.00 H new ATOM 0 HD2 HIS A 187 2.711 -7.512 2.358 1.00 0.00 H new ATOM 0 HE1 HIS A 187 1.547 -8.519 6.333 1.00 0.00 H new ATOM 0 HE2 HIS A 187 3.440 -7.588 4.874 1.00 0.00 H new ATOM 1031 N THR A 188 -1.942 -10.571 0.360 1.00 0.00 N ATOM 1032 CA THR A 188 -3.266 -11.139 0.129 1.00 0.00 C ATOM 1033 C THR A 188 -3.222 -12.652 0.220 1.00 0.00 C ATOM 1034 O THR A 188 -4.043 -13.229 0.926 1.00 0.00 O ATOM 1035 CB THR A 188 -3.903 -10.704 -1.182 1.00 0.00 C ATOM 1036 OG1 THR A 188 -3.106 -10.899 -2.328 1.00 0.00 O ATOM 1037 CG2 THR A 188 -4.311 -9.239 -1.089 1.00 0.00 C ATOM 0 H THR A 188 -1.561 -10.073 -0.444 1.00 0.00 H new ATOM 0 HA THR A 188 -3.902 -10.743 0.920 1.00 0.00 H new ATOM 0 HB THR A 188 -4.769 -11.353 -1.315 1.00 0.00 H new ATOM 0 HG1 THR A 188 -2.477 -10.153 -2.420 1.00 0.00 H new ATOM 0 HG21 THR A 188 -4.767 -8.928 -2.029 1.00 0.00 H new ATOM 0 HG22 THR A 188 -5.028 -9.112 -0.278 1.00 0.00 H new ATOM 0 HG23 THR A 188 -3.430 -8.628 -0.894 1.00 0.00 H new ATOM 1045 N VAL A 189 -2.225 -13.284 -0.405 1.00 0.00 N ATOM 1046 CA VAL A 189 -1.928 -14.709 -0.198 1.00 0.00 C ATOM 1047 C VAL A 189 -1.696 -14.995 1.286 1.00 0.00 C ATOM 1048 O VAL A 189 -2.420 -15.803 1.869 1.00 0.00 O ATOM 1049 CB VAL A 189 -0.736 -15.146 -1.057 1.00 0.00 C ATOM 1050 CG1 VAL A 189 -0.235 -16.560 -0.727 1.00 0.00 C ATOM 1051 CG2 VAL A 189 -1.093 -15.109 -2.550 1.00 0.00 C ATOM 0 H VAL A 189 -1.600 -12.826 -1.068 1.00 0.00 H new ATOM 0 HA VAL A 189 -2.789 -15.297 -0.517 1.00 0.00 H new ATOM 0 HB VAL A 189 0.059 -14.436 -0.828 1.00 0.00 H new ATOM 0 HG11 VAL A 189 0.609 -16.806 -1.371 1.00 0.00 H new ATOM 0 HG12 VAL A 189 0.080 -16.600 0.316 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -1.038 -17.278 -0.891 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -0.231 -15.423 -3.138 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -1.928 -15.783 -2.741 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -1.374 -14.094 -2.832 1.00 0.00 H new ATOM 1061 N THR A 190 -0.729 -14.282 1.886 1.00 0.00 N ATOM 1062 CA THR A 190 -0.304 -14.415 3.295 1.00 0.00 C ATOM 1063 C THR A 190 -1.518 -14.467 4.220 1.00 0.00 C ATOM 1064 O THR A 190 -1.653 -15.403 5.008 1.00 0.00 O ATOM 1065 CB THR A 190 0.637 -13.264 3.732 1.00 0.00 C ATOM 1066 OG1 THR A 190 1.858 -13.271 3.018 1.00 0.00 O ATOM 1067 CG2 THR A 190 1.001 -13.280 5.219 1.00 0.00 C ATOM 0 H THR A 190 -0.199 -13.568 1.386 1.00 0.00 H new ATOM 0 HA THR A 190 0.252 -15.349 3.372 1.00 0.00 H new ATOM 0 HB THR A 190 0.054 -12.369 3.514 1.00 0.00 H new ATOM 0 HG1 THR A 190 1.675 -13.327 2.057 1.00 0.00 H new ATOM 0 HG21 THR A 190 1.662 -12.442 5.441 1.00 0.00 H new ATOM 0 HG22 THR A 190 0.093 -13.195 5.817 1.00 0.00 H new ATOM 0 HG23 THR A 190 1.507 -14.215 5.460 1.00 0.00 H new ATOM 1075 N THR A 191 -2.383 -13.451 4.112 1.00 0.00 N ATOM 1076 CA THR A 191 -3.546 -13.210 4.956 1.00 0.00 C ATOM 1077 C THR A 191 -4.742 -14.090 4.613 1.00 0.00 C ATOM 1078 O THR A 191 -5.433 -14.555 5.521 1.00 0.00 O ATOM 1079 CB THR A 191 -3.909 -11.720 4.931 1.00 0.00 C ATOM 1080 OG1 THR A 191 -4.618 -11.404 6.099 1.00 0.00 O ATOM 1081 CG2 THR A 191 -4.692 -11.220 3.716 1.00 0.00 C ATOM 0 H THR A 191 -2.279 -12.738 3.390 1.00 0.00 H new ATOM 0 HA THR A 191 -3.270 -13.493 5.972 1.00 0.00 H new ATOM 0 HB THR A 191 -2.950 -11.205 4.864 1.00 0.00 H new ATOM 0 HG1 THR A 191 -4.853 -10.453 6.092 1.00 0.00 H new ATOM 0 HG21 THR A 191 -4.885 -10.152 3.821 1.00 0.00 H new ATOM 0 HG22 THR A 191 -4.111 -11.396 2.811 1.00 0.00 H new ATOM 0 HG23 THR A 191 -5.639 -11.755 3.649 1.00 0.00 H new ATOM 1089 N THR A 192 -4.961 -14.404 3.329 1.00 0.00 N ATOM 1090 CA THR A 192 -6.025 -15.328 2.922 1.00 0.00 C ATOM 1091 C THR A 192 -5.822 -16.661 3.641 1.00 0.00 C ATOM 1092 O THR A 192 -6.743 -17.162 4.289 1.00 0.00 O ATOM 1093 CB THR A 192 -6.089 -15.522 1.398 1.00 0.00 C ATOM 1094 OG1 THR A 192 -6.327 -14.279 0.785 1.00 0.00 O ATOM 1095 CG2 THR A 192 -7.212 -16.458 0.951 1.00 0.00 C ATOM 0 H THR A 192 -4.414 -14.030 2.554 1.00 0.00 H new ATOM 0 HA THR A 192 -6.984 -14.895 3.207 1.00 0.00 H new ATOM 0 HB THR A 192 -5.135 -15.962 1.107 1.00 0.00 H new ATOM 0 HG1 THR A 192 -5.474 -13.879 0.515 1.00 0.00 H new ATOM 0 HG21 THR A 192 -7.199 -16.549 -0.135 1.00 0.00 H new ATOM 0 HG22 THR A 192 -7.067 -17.441 1.400 1.00 0.00 H new ATOM 0 HG23 THR A 192 -8.172 -16.052 1.269 1.00 0.00 H new ATOM 1103 N THR A 193 -4.589 -17.189 3.636 1.00 0.00 N ATOM 1104 CA THR A 193 -4.274 -18.419 4.371 1.00 0.00 C ATOM 1105 C THR A 193 -4.189 -18.254 5.907 1.00 0.00 C ATOM 1106 O THR A 193 -4.009 -19.269 6.590 1.00 0.00 O ATOM 1107 CB THR A 193 -3.061 -19.146 3.771 1.00 0.00 C ATOM 1108 OG1 THR A 193 -2.988 -20.434 4.336 1.00 0.00 O ATOM 1109 CG2 THR A 193 -1.736 -18.440 4.017 1.00 0.00 C ATOM 0 H THR A 193 -3.799 -16.785 3.133 1.00 0.00 H new ATOM 0 HA THR A 193 -5.139 -19.067 4.232 1.00 0.00 H new ATOM 0 HB THR A 193 -3.212 -19.172 2.692 1.00 0.00 H new ATOM 0 HG1 THR A 193 -3.414 -20.429 5.219 1.00 0.00 H new ATOM 0 HG21 THR A 193 -0.928 -19.014 3.563 1.00 0.00 H new ATOM 0 HG22 THR A 193 -1.767 -17.444 3.574 1.00 0.00 H new ATOM 0 HG23 THR A 193 -1.563 -18.355 5.090 1.00 0.00 H new ATOM 1117 N LYS A 194 -4.293 -17.034 6.476 1.00 0.00 N ATOM 1118 CA LYS A 194 -4.510 -16.809 7.918 1.00 0.00 C ATOM 1119 C LYS A 194 -5.991 -16.917 8.298 1.00 0.00 C ATOM 1120 O LYS A 194 -6.281 -17.034 9.497 1.00 0.00 O ATOM 1121 CB LYS A 194 -4.091 -15.397 8.368 1.00 0.00 C ATOM 1122 CG LYS A 194 -2.598 -15.090 8.348 1.00 0.00 C ATOM 1123 CD LYS A 194 -2.401 -13.672 8.890 1.00 0.00 C ATOM 1124 CE LYS A 194 -0.985 -13.143 8.694 1.00 0.00 C ATOM 1125 NZ LYS A 194 0.031 -13.868 9.487 1.00 0.00 N ATOM 0 H LYS A 194 -4.228 -16.169 5.939 1.00 0.00 H new ATOM 0 HA LYS A 194 -3.905 -17.576 8.401 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -4.597 -14.672 7.730 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -4.458 -15.240 9.382 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -2.052 -15.810 8.957 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -2.206 -15.169 7.334 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -3.104 -13.001 8.396 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -2.642 -13.660 9.953 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -0.724 -13.208 7.638 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -0.960 -12.087 8.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 0.970 -13.458 9.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -0.195 -13.785 10.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 0.033 -14.871 9.214 1.00 0.00 H new ATOM 1139 N GLY A 195 -6.900 -16.772 7.319 1.00 0.00 N ATOM 1140 CA GLY A 195 -8.356 -16.731 7.501 1.00 0.00 C ATOM 1141 C GLY A 195 -9.118 -15.635 6.745 1.00 0.00 C ATOM 1142 O GLY A 195 -10.350 -15.563 6.863 1.00 0.00 O ATOM 0 H GLY A 195 -6.627 -16.677 6.341 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -8.763 -17.696 7.200 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -8.562 -16.615 8.565 1.00 0.00 H new ATOM 1146 N GLU A 196 -8.429 -14.746 6.024 1.00 0.00 N ATOM 1147 CA GLU A 196 -9.076 -13.719 5.208 1.00 0.00 C ATOM 1148 C GLU A 196 -9.681 -14.195 3.887 1.00 0.00 C ATOM 1149 O GLU A 196 -9.495 -15.317 3.417 1.00 0.00 O ATOM 1150 CB GLU A 196 -8.118 -12.544 4.955 1.00 0.00 C ATOM 1151 CG GLU A 196 -8.530 -11.304 5.738 1.00 0.00 C ATOM 1152 CD GLU A 196 -9.811 -10.609 5.245 1.00 0.00 C ATOM 1153 OE1 GLU A 196 -10.883 -11.255 5.337 1.00 0.00 O ATOM 1154 OE2 GLU A 196 -9.792 -9.433 4.806 1.00 0.00 O ATOM 0 H GLU A 196 -7.410 -14.719 5.991 1.00 0.00 H new ATOM 0 HA GLU A 196 -9.929 -13.402 5.808 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -7.105 -12.833 5.237 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -8.099 -12.313 3.890 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -8.667 -11.583 6.783 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -7.711 -10.585 5.705 1.00 0.00 H new ATOM 1161 N ASN A 197 -10.417 -13.251 3.315 1.00 0.00 N ATOM 1162 CA ASN A 197 -10.986 -13.187 1.991 1.00 0.00 C ATOM 1163 C ASN A 197 -11.266 -11.716 1.699 1.00 0.00 C ATOM 1164 O ASN A 197 -12.232 -11.143 2.214 1.00 0.00 O ATOM 1165 CB ASN A 197 -12.251 -14.023 1.903 1.00 0.00 C ATOM 1166 CG ASN A 197 -12.906 -13.886 0.530 1.00 0.00 C ATOM 1167 OD1 ASN A 197 -12.342 -14.276 -0.483 1.00 0.00 O ATOM 1168 ND2 ASN A 197 -14.075 -13.281 0.444 1.00 0.00 N ATOM 0 H ASN A 197 -10.654 -12.411 3.842 1.00 0.00 H new ATOM 0 HA ASN A 197 -10.298 -13.596 1.251 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -12.013 -15.070 2.093 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -12.952 -13.710 2.677 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -14.509 -13.138 -0.468 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -14.545 -12.956 1.289 1.00 0.00 H new ATOM 1175 N PHE A 198 -10.375 -11.092 0.933 1.00 0.00 N ATOM 1176 CA PHE A 198 -10.604 -9.740 0.461 1.00 0.00 C ATOM 1177 C PHE A 198 -11.732 -9.697 -0.575 1.00 0.00 C ATOM 1178 O PHE A 198 -11.996 -10.652 -1.311 1.00 0.00 O ATOM 1179 CB PHE A 198 -9.296 -9.128 -0.072 1.00 0.00 C ATOM 1180 CG PHE A 198 -8.790 -9.599 -1.423 1.00 0.00 C ATOM 1181 CD1 PHE A 198 -9.496 -9.278 -2.598 1.00 0.00 C ATOM 1182 CD2 PHE A 198 -7.527 -10.208 -1.529 1.00 0.00 C ATOM 1183 CE1 PHE A 198 -8.966 -9.568 -3.861 1.00 0.00 C ATOM 1184 CE2 PHE A 198 -6.979 -10.453 -2.802 1.00 0.00 C ATOM 1185 CZ PHE A 198 -7.698 -10.154 -3.969 1.00 0.00 C ATOM 0 H PHE A 198 -9.492 -11.504 0.630 1.00 0.00 H new ATOM 0 HA PHE A 198 -10.931 -9.129 1.302 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -9.429 -8.047 -0.123 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -8.514 -9.319 0.663 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -10.462 -8.800 -2.524 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -6.981 -10.486 -0.640 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -9.534 -9.340 -4.751 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -5.989 -10.878 -2.882 1.00 0.00 H new ATOM 0 HZ PHE A 198 -7.279 -10.373 -4.940 1.00 0.00 H new ATOM 1195 N THR A 199 -12.303 -8.509 -0.710 1.00 0.00 N ATOM 1196 CA THR A 199 -13.277 -8.089 -1.709 1.00 0.00 C ATOM 1197 C THR A 199 -12.740 -6.886 -2.463 1.00 0.00 C ATOM 1198 O THR A 199 -11.823 -6.226 -1.987 1.00 0.00 O ATOM 1199 CB THR A 199 -14.585 -7.671 -1.022 1.00 0.00 C ATOM 1200 OG1 THR A 199 -14.402 -6.587 -0.116 1.00 0.00 O ATOM 1201 CG2 THR A 199 -15.227 -8.849 -0.307 1.00 0.00 C ATOM 0 H THR A 199 -12.078 -7.749 -0.069 1.00 0.00 H new ATOM 0 HA THR A 199 -13.459 -8.920 -2.390 1.00 0.00 H new ATOM 0 HB THR A 199 -15.254 -7.328 -1.812 1.00 0.00 H new ATOM 0 HG1 THR A 199 -13.901 -6.896 0.667 1.00 0.00 H new ATOM 0 HG21 THR A 199 -16.152 -8.525 0.171 1.00 0.00 H new ATOM 0 HG22 THR A 199 -15.448 -9.636 -1.028 1.00 0.00 H new ATOM 0 HG23 THR A 199 -14.543 -9.232 0.450 1.00 0.00 H new ATOM 1209 N GLU A 200 -13.367 -6.518 -3.578 1.00 0.00 N ATOM 1210 CA GLU A 200 -13.104 -5.250 -4.253 1.00 0.00 C ATOM 1211 C GLU A 200 -13.172 -4.070 -3.277 1.00 0.00 C ATOM 1212 O GLU A 200 -12.417 -3.120 -3.432 1.00 0.00 O ATOM 1213 CB GLU A 200 -14.085 -5.045 -5.399 1.00 0.00 C ATOM 1214 CG GLU A 200 -13.871 -3.677 -6.044 1.00 0.00 C ATOM 1215 CD GLU A 200 -14.622 -3.553 -7.358 1.00 0.00 C ATOM 1216 OE1 GLU A 200 -15.887 -3.540 -7.320 1.00 0.00 O ATOM 1217 OE2 GLU A 200 -13.919 -3.490 -8.409 1.00 0.00 O ATOM 0 H GLU A 200 -14.073 -7.092 -4.039 1.00 0.00 H new ATOM 0 HA GLU A 200 -12.092 -5.292 -4.656 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -13.953 -5.830 -6.144 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -15.107 -5.124 -5.030 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -14.203 -2.896 -5.360 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -12.807 -3.518 -6.217 1.00 0.00 H new ATOM 1224 N THR A 201 -14.021 -4.144 -2.246 1.00 0.00 N ATOM 1225 CA THR A 201 -14.031 -3.180 -1.157 1.00 0.00 C ATOM 1226 C THR A 201 -12.691 -3.110 -0.437 1.00 0.00 C ATOM 1227 O THR A 201 -12.064 -2.057 -0.437 1.00 0.00 O ATOM 1228 CB THR A 201 -15.149 -3.424 -0.120 1.00 0.00 C ATOM 1229 OG1 THR A 201 -15.956 -4.553 -0.422 1.00 0.00 O ATOM 1230 CG2 THR A 201 -16.038 -2.198 -0.004 1.00 0.00 C ATOM 0 H THR A 201 -14.721 -4.880 -2.150 1.00 0.00 H new ATOM 0 HA THR A 201 -14.232 -2.226 -1.644 1.00 0.00 H new ATOM 0 HB THR A 201 -14.646 -3.623 0.826 1.00 0.00 H new ATOM 0 HG1 THR A 201 -15.412 -5.367 -0.374 1.00 0.00 H new ATOM 0 HG21 THR A 201 -16.821 -2.385 0.731 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.440 -1.344 0.313 1.00 0.00 H new ATOM 0 HG23 THR A 201 -16.492 -1.985 -0.972 1.00 0.00 H new ATOM 1238 N ASP A 202 -12.240 -4.234 0.133 1.00 0.00 N ATOM 1239 CA ASP A 202 -10.957 -4.371 0.832 1.00 0.00 C ATOM 1240 C ASP A 202 -9.829 -3.867 -0.059 1.00 0.00 C ATOM 1241 O ASP A 202 -9.002 -3.064 0.357 1.00 0.00 O ATOM 1242 CB ASP A 202 -10.646 -5.842 1.123 1.00 0.00 C ATOM 1243 CG ASP A 202 -11.592 -6.549 2.074 1.00 0.00 C ATOM 1244 OD1 ASP A 202 -12.686 -6.982 1.625 1.00 0.00 O ATOM 1245 OD2 ASP A 202 -11.198 -6.742 3.249 1.00 0.00 O ATOM 0 H ASP A 202 -12.776 -5.102 0.120 1.00 0.00 H new ATOM 0 HA ASP A 202 -11.031 -3.801 1.758 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -10.641 -6.385 0.178 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -9.638 -5.905 1.532 1.00 0.00 H new ATOM 1250 N ILE A 203 -9.853 -4.332 -1.307 1.00 0.00 N ATOM 1251 CA ILE A 203 -8.933 -4.006 -2.379 1.00 0.00 C ATOM 1252 C ILE A 203 -8.896 -2.514 -2.572 1.00 0.00 C ATOM 1253 O ILE A 203 -7.836 -1.922 -2.432 1.00 0.00 O ATOM 1254 CB ILE A 203 -9.384 -4.754 -3.649 1.00 0.00 C ATOM 1255 CG1 ILE A 203 -9.069 -6.242 -3.501 1.00 0.00 C ATOM 1256 CG2 ILE A 203 -8.867 -4.224 -4.993 1.00 0.00 C ATOM 1257 CD1 ILE A 203 -7.576 -6.555 -3.509 1.00 0.00 C ATOM 0 H ILE A 203 -10.569 -4.992 -1.610 1.00 0.00 H new ATOM 0 HA ILE A 203 -7.918 -4.322 -2.140 1.00 0.00 H new ATOM 0 HB ILE A 203 -10.457 -4.570 -3.707 1.00 0.00 H new ATOM 0 HG12 ILE A 203 -9.503 -6.606 -2.569 1.00 0.00 H new ATOM 0 HG13 ILE A 203 -9.551 -6.789 -4.312 1.00 0.00 H new ATOM 0 HG21 ILE A 203 -9.259 -4.840 -5.802 1.00 0.00 H new ATOM 0 HG22 ILE A 203 -9.196 -3.194 -5.129 1.00 0.00 H new ATOM 0 HG23 ILE A 203 -7.778 -4.261 -5.004 1.00 0.00 H new ATOM 0 HD11 ILE A 203 -7.429 -7.630 -3.400 1.00 0.00 H new ATOM 0 HD12 ILE A 203 -7.140 -6.223 -4.451 1.00 0.00 H new ATOM 0 HD13 ILE A 203 -7.091 -6.037 -2.682 1.00 0.00 H new ATOM 1269 N LYS A 204 -10.043 -1.891 -2.839 1.00 0.00 N ATOM 1270 CA LYS A 204 -10.095 -0.458 -3.054 1.00 0.00 C ATOM 1271 C LYS A 204 -9.654 0.344 -1.831 1.00 0.00 C ATOM 1272 O LYS A 204 -9.190 1.472 -2.005 1.00 0.00 O ATOM 1273 CB LYS A 204 -11.490 -0.024 -3.500 1.00 0.00 C ATOM 1274 CG LYS A 204 -11.660 -0.140 -5.026 1.00 0.00 C ATOM 1275 CD LYS A 204 -12.138 1.192 -5.612 1.00 0.00 C ATOM 1276 CE LYS A 204 -13.545 1.543 -5.114 1.00 0.00 C ATOM 1277 NZ LYS A 204 -13.682 2.987 -4.852 1.00 0.00 N ATOM 0 H LYS A 204 -10.945 -2.362 -2.910 1.00 0.00 H new ATOM 0 HA LYS A 204 -9.382 -0.241 -3.850 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -12.239 -0.639 -3.002 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -11.667 1.006 -3.191 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -10.713 -0.427 -5.483 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -12.378 -0.926 -5.260 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -11.443 1.985 -5.335 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -12.138 1.134 -6.700 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -14.282 1.236 -5.856 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -13.759 0.985 -4.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -14.677 3.210 -4.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -13.094 3.249 -4.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -13.371 3.522 -5.688 1.00 0.00 H new ATOM 1291 N ILE A 205 -9.786 -0.205 -0.617 1.00 0.00 N ATOM 1292 CA ILE A 205 -9.125 0.381 0.548 1.00 0.00 C ATOM 1293 C ILE A 205 -7.618 0.225 0.381 1.00 0.00 C ATOM 1294 O ILE A 205 -6.924 1.225 0.250 1.00 0.00 O ATOM 1295 CB ILE A 205 -9.570 -0.207 1.897 1.00 0.00 C ATOM 1296 CG1 ILE A 205 -11.070 -0.131 2.139 1.00 0.00 C ATOM 1297 CG2 ILE A 205 -8.872 0.558 3.021 1.00 0.00 C ATOM 1298 CD1 ILE A 205 -11.624 1.284 2.123 1.00 0.00 C ATOM 0 H ILE A 205 -10.336 -1.041 -0.420 1.00 0.00 H new ATOM 0 HA ILE A 205 -9.418 1.430 0.582 1.00 0.00 H new ATOM 0 HB ILE A 205 -9.299 -1.263 1.878 1.00 0.00 H new ATOM 0 HG12 ILE A 205 -11.582 -0.720 1.378 1.00 0.00 H new ATOM 0 HG13 ILE A 205 -11.297 -0.589 3.102 1.00 0.00 H new ATOM 0 HG21 ILE A 205 -9.179 0.150 3.984 1.00 0.00 H new ATOM 0 HG22 ILE A 205 -7.792 0.458 2.913 1.00 0.00 H new ATOM 0 HG23 ILE A 205 -9.146 1.612 2.969 1.00 0.00 H new ATOM 0 HD11 ILE A 205 -12.699 1.256 2.303 1.00 0.00 H new ATOM 0 HD12 ILE A 205 -11.141 1.873 2.903 1.00 0.00 H new ATOM 0 HD13 ILE A 205 -11.430 1.740 1.152 1.00 0.00 H new ATOM 1310 N MET A 206 -7.124 -1.018 0.372 1.00 0.00 N ATOM 1311 CA MET A 206 -5.719 -1.397 0.276 1.00 0.00 C ATOM 1312 C MET A 206 -5.039 -0.567 -0.794 1.00 0.00 C ATOM 1313 O MET A 206 -4.274 0.316 -0.440 1.00 0.00 O ATOM 1314 CB MET A 206 -5.591 -2.903 -0.025 1.00 0.00 C ATOM 1315 CG MET A 206 -6.042 -3.816 1.116 1.00 0.00 C ATOM 1316 SD MET A 206 -6.691 -5.448 0.604 1.00 0.00 S ATOM 1317 CE MET A 206 -5.497 -6.026 -0.633 1.00 0.00 C ATOM 0 H MET A 206 -7.735 -1.832 0.436 1.00 0.00 H new ATOM 0 HA MET A 206 -5.227 -1.204 1.229 1.00 0.00 H new ATOM 0 HB2 MET A 206 -6.179 -3.135 -0.913 1.00 0.00 H new ATOM 0 HB3 MET A 206 -4.551 -3.126 -0.263 1.00 0.00 H new ATOM 0 HG2 MET A 206 -5.198 -3.974 1.788 1.00 0.00 H new ATOM 0 HG3 MET A 206 -6.813 -3.300 1.688 1.00 0.00 H new ATOM 0 HE1 MET A 206 -5.865 -6.944 -1.093 1.00 0.00 H new ATOM 0 HE2 MET A 206 -5.369 -5.262 -1.400 1.00 0.00 H new ATOM 0 HE3 MET A 206 -4.539 -6.220 -0.151 1.00 0.00 H new ATOM 1327 N GLU A 207 -5.392 -0.775 -2.063 1.00 0.00 N ATOM 1328 CA GLU A 207 -4.998 -0.047 -3.271 1.00 0.00 C ATOM 1329 C GLU A 207 -4.995 1.470 -3.126 1.00 0.00 C ATOM 1330 O GLU A 207 -4.206 2.123 -3.805 1.00 0.00 O ATOM 1331 CB GLU A 207 -5.946 -0.398 -4.420 1.00 0.00 C ATOM 1332 CG GLU A 207 -5.971 -1.890 -4.751 1.00 0.00 C ATOM 1333 CD GLU A 207 -5.187 -2.233 -6.015 1.00 0.00 C ATOM 1334 OE1 GLU A 207 -3.965 -1.937 -6.067 1.00 0.00 O ATOM 1335 OE2 GLU A 207 -5.796 -2.704 -7.017 1.00 0.00 O ATOM 0 H GLU A 207 -6.028 -1.538 -2.295 1.00 0.00 H new ATOM 0 HA GLU A 207 -3.972 -0.358 -3.467 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -6.954 -0.074 -4.162 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -5.650 0.159 -5.309 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -5.559 -2.450 -3.911 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -7.005 -2.212 -4.873 1.00 0.00 H new ATOM 1342 N ARG A 208 -5.828 2.060 -2.263 1.00 0.00 N ATOM 1343 CA ARG A 208 -5.693 3.476 -1.943 1.00 0.00 C ATOM 1344 C ARG A 208 -4.489 3.746 -1.060 1.00 0.00 C ATOM 1345 O ARG A 208 -3.642 4.567 -1.416 1.00 0.00 O ATOM 1346 CB ARG A 208 -6.930 3.992 -1.210 1.00 0.00 C ATOM 1347 CG ARG A 208 -6.930 5.529 -1.141 1.00 0.00 C ATOM 1348 CD ARG A 208 -7.278 6.131 -2.487 1.00 0.00 C ATOM 1349 NE ARG A 208 -8.580 5.658 -2.978 1.00 0.00 N ATOM 1350 CZ ARG A 208 -9.086 5.751 -4.192 1.00 0.00 C ATOM 1351 NH1 ARG A 208 -8.433 6.260 -5.204 1.00 0.00 N ATOM 1352 NH2 ARG A 208 -10.287 5.273 -4.362 1.00 0.00 N ATOM 0 H ARG A 208 -6.591 1.584 -1.782 1.00 0.00 H new ATOM 0 HA ARG A 208 -5.570 3.991 -2.896 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -7.829 3.648 -1.720 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -6.958 3.579 -0.202 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -7.648 5.863 -0.392 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -5.949 5.883 -0.823 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -7.294 7.218 -2.406 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -6.503 5.877 -3.210 1.00 0.00 H new ATOM 0 HE ARG A 208 -9.171 5.196 -2.287 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -7.484 6.610 -5.074 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -8.873 6.307 -6.123 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -10.785 4.854 -3.577 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -10.728 5.318 -5.280 1.00 0.00 H new ATOM 1366 N VAL A 209 -4.474 3.108 0.114 1.00 0.00 N ATOM 1367 CA VAL A 209 -3.587 3.440 1.224 1.00 0.00 C ATOM 1368 C VAL A 209 -2.190 2.940 0.932 1.00 0.00 C ATOM 1369 O VAL A 209 -1.214 3.631 1.211 1.00 0.00 O ATOM 1370 CB VAL A 209 -4.114 2.868 2.558 1.00 0.00 C ATOM 1371 CG1 VAL A 209 -3.516 3.637 3.732 1.00 0.00 C ATOM 1372 CG2 VAL A 209 -5.642 2.950 2.691 1.00 0.00 C ATOM 0 H VAL A 209 -5.096 2.326 0.320 1.00 0.00 H new ATOM 0 HA VAL A 209 -3.557 4.525 1.329 1.00 0.00 H new ATOM 0 HB VAL A 209 -3.818 1.819 2.567 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -3.895 3.225 4.667 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -2.430 3.548 3.710 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -3.796 4.688 3.659 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -5.947 2.532 3.650 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -5.957 3.992 2.633 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -6.108 2.385 1.884 1.00 0.00 H new ATOM 1382 N VAL A 210 -2.103 1.774 0.292 1.00 0.00 N ATOM 1383 CA VAL A 210 -0.850 1.219 -0.179 1.00 0.00 C ATOM 1384 C VAL A 210 -0.261 2.064 -1.303 1.00 0.00 C ATOM 1385 O VAL A 210 0.940 2.283 -1.286 1.00 0.00 O ATOM 1386 CB VAL A 210 -1.068 -0.251 -0.548 1.00 0.00 C ATOM 1387 CG1 VAL A 210 -1.913 -0.495 -1.791 1.00 0.00 C ATOM 1388 CG2 VAL A 210 0.241 -0.987 -0.781 1.00 0.00 C ATOM 0 H VAL A 210 -2.913 1.188 0.088 1.00 0.00 H new ATOM 0 HA VAL A 210 -0.099 1.247 0.611 1.00 0.00 H new ATOM 0 HB VAL A 210 -1.604 -0.628 0.323 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -2.006 -1.567 -1.963 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -2.904 -0.064 -1.648 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -1.435 -0.029 -2.653 1.00 0.00 H new ATOM 0 HG21 VAL A 210 0.034 -2.025 -1.040 1.00 0.00 H new ATOM 0 HG22 VAL A 210 0.786 -0.512 -1.597 1.00 0.00 H new ATOM 0 HG23 VAL A 210 0.844 -0.953 0.126 1.00 0.00 H new ATOM 1398 N GLU A 211 -1.065 2.606 -2.229 1.00 0.00 N ATOM 1399 CA GLU A 211 -0.568 3.466 -3.302 1.00 0.00 C ATOM 1400 C GLU A 211 -0.093 4.831 -2.776 1.00 0.00 C ATOM 1401 O GLU A 211 0.988 5.294 -3.143 1.00 0.00 O ATOM 1402 CB GLU A 211 -1.658 3.562 -4.368 1.00 0.00 C ATOM 1403 CG GLU A 211 -1.183 4.302 -5.606 1.00 0.00 C ATOM 1404 CD GLU A 211 -2.304 4.710 -6.555 1.00 0.00 C ATOM 1405 OE1 GLU A 211 -3.196 3.886 -6.900 1.00 0.00 O ATOM 1406 OE2 GLU A 211 -2.290 5.896 -6.978 1.00 0.00 O ATOM 0 H GLU A 211 -2.074 2.459 -2.252 1.00 0.00 H new ATOM 0 HA GLU A 211 0.324 3.032 -3.755 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -1.981 2.559 -4.647 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -2.527 4.072 -3.952 1.00 0.00 H new ATOM 0 HG2 GLU A 211 -0.640 5.195 -5.297 1.00 0.00 H new ATOM 0 HG3 GLU A 211 -0.477 3.671 -6.145 1.00 0.00 H new ATOM 1413 N GLN A 212 -0.861 5.433 -1.864 1.00 0.00 N ATOM 1414 CA GLN A 212 -0.513 6.602 -1.075 1.00 0.00 C ATOM 1415 C GLN A 212 0.787 6.403 -0.294 1.00 0.00 C ATOM 1416 O GLN A 212 1.648 7.279 -0.299 1.00 0.00 O ATOM 1417 CB GLN A 212 -1.692 6.853 -0.126 1.00 0.00 C ATOM 1418 CG GLN A 212 -2.563 8.038 -0.537 1.00 0.00 C ATOM 1419 CD GLN A 212 -2.925 8.136 -2.019 1.00 0.00 C ATOM 1420 OE1 GLN A 212 -2.836 9.207 -2.620 1.00 0.00 O ATOM 1421 NE2 GLN A 212 -3.359 7.065 -2.659 1.00 0.00 N ATOM 0 H GLN A 212 -1.798 5.091 -1.649 1.00 0.00 H new ATOM 0 HA GLN A 212 -0.337 7.459 -1.726 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -2.310 5.956 -0.082 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -1.308 7.026 0.880 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -3.488 7.997 0.038 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -2.049 8.955 -0.250 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -3.436 6.174 -2.169 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -3.617 7.129 -3.644 1.00 0.00 H new ATOM 1430 N MET A 213 0.959 5.260 0.364 1.00 0.00 N ATOM 1431 CA MET A 213 2.224 4.905 1.006 1.00 0.00 C ATOM 1432 C MET A 213 3.349 4.679 0.005 1.00 0.00 C ATOM 1433 O MET A 213 4.415 5.234 0.194 1.00 0.00 O ATOM 1434 CB MET A 213 2.036 3.648 1.830 1.00 0.00 C ATOM 1435 CG MET A 213 1.321 3.945 3.131 1.00 0.00 C ATOM 1436 SD MET A 213 2.244 4.896 4.379 1.00 0.00 S ATOM 1437 CE MET A 213 3.686 3.822 4.647 1.00 0.00 C ATOM 0 H MET A 213 0.229 4.555 0.468 1.00 0.00 H new ATOM 0 HA MET A 213 2.510 5.746 1.638 1.00 0.00 H new ATOM 0 HB2 MET A 213 1.465 2.917 1.257 1.00 0.00 H new ATOM 0 HB3 MET A 213 3.007 3.200 2.040 1.00 0.00 H new ATOM 0 HG2 MET A 213 0.406 4.489 2.899 1.00 0.00 H new ATOM 0 HG3 MET A 213 1.023 2.997 3.579 1.00 0.00 H new ATOM 0 HE1 MET A 213 4.201 4.125 5.559 1.00 0.00 H new ATOM 0 HE2 MET A 213 3.356 2.787 4.743 1.00 0.00 H new ATOM 0 HE3 MET A 213 4.367 3.909 3.800 1.00 0.00 H new ATOM 1447 N CYS A 214 3.134 3.898 -1.050 1.00 0.00 N ATOM 1448 CA CYS A 214 4.087 3.645 -2.136 1.00 0.00 C ATOM 1449 C CYS A 214 4.660 4.944 -2.711 1.00 0.00 C ATOM 1450 O CYS A 214 5.866 5.187 -2.628 1.00 0.00 O ATOM 1451 CB CYS A 214 3.381 2.849 -3.231 1.00 0.00 C ATOM 1452 SG CYS A 214 3.251 1.070 -2.960 1.00 0.00 S ATOM 0 H CYS A 214 2.253 3.401 -1.181 1.00 0.00 H new ATOM 0 HA CYS A 214 4.927 3.077 -1.735 1.00 0.00 H new ATOM 0 HB2 CYS A 214 2.376 3.252 -3.354 1.00 0.00 H new ATOM 0 HB3 CYS A 214 3.908 3.015 -4.170 1.00 0.00 H new ATOM 1457 N THR A 215 3.792 5.791 -3.282 1.00 0.00 N ATOM 1458 CA THR A 215 4.148 7.131 -3.746 1.00 0.00 C ATOM 1459 C THR A 215 4.853 7.938 -2.653 1.00 0.00 C ATOM 1460 O THR A 215 5.854 8.577 -2.944 1.00 0.00 O ATOM 1461 CB THR A 215 2.897 7.820 -4.329 1.00 0.00 C ATOM 1462 OG1 THR A 215 3.186 8.576 -5.479 1.00 0.00 O ATOM 1463 CG2 THR A 215 2.202 8.736 -3.342 1.00 0.00 C ATOM 0 H THR A 215 2.811 5.557 -3.435 1.00 0.00 H new ATOM 0 HA THR A 215 4.880 7.060 -4.551 1.00 0.00 H new ATOM 0 HB THR A 215 2.233 6.993 -4.581 1.00 0.00 H new ATOM 0 HG1 THR A 215 2.364 8.992 -5.812 1.00 0.00 H new ATOM 0 HG21 THR A 215 1.331 9.188 -3.816 1.00 0.00 H new ATOM 0 HG22 THR A 215 1.884 8.160 -2.473 1.00 0.00 H new ATOM 0 HG23 THR A 215 2.890 9.520 -3.026 1.00 0.00 H new ATOM 1471 N THR A 216 4.390 7.885 -1.397 1.00 0.00 N ATOM 1472 CA THR A 216 5.016 8.618 -0.288 1.00 0.00 C ATOM 1473 C THR A 216 6.416 8.107 0.002 1.00 0.00 C ATOM 1474 O THR A 216 7.344 8.902 0.076 1.00 0.00 O ATOM 1475 CB THR A 216 4.158 8.561 0.985 1.00 0.00 C ATOM 1476 OG1 THR A 216 2.909 9.158 0.723 1.00 0.00 O ATOM 1477 CG2 THR A 216 4.795 9.291 2.162 1.00 0.00 C ATOM 0 H THR A 216 3.576 7.336 -1.122 1.00 0.00 H new ATOM 0 HA THR A 216 5.090 9.659 -0.604 1.00 0.00 H new ATOM 0 HB THR A 216 4.057 7.510 1.256 1.00 0.00 H new ATOM 0 HG1 THR A 216 2.261 8.466 0.474 1.00 0.00 H new ATOM 0 HG21 THR A 216 4.143 9.216 3.032 1.00 0.00 H new ATOM 0 HG22 THR A 216 5.760 8.839 2.391 1.00 0.00 H new ATOM 0 HG23 THR A 216 4.938 10.341 1.905 1.00 0.00 H new ATOM 1485 N GLN A 217 6.598 6.794 0.126 1.00 0.00 N ATOM 1486 CA GLN A 217 7.896 6.181 0.313 1.00 0.00 C ATOM 1487 C GLN A 217 8.836 6.583 -0.819 1.00 0.00 C ATOM 1488 O GLN A 217 9.960 6.983 -0.523 1.00 0.00 O ATOM 1489 CB GLN A 217 7.757 4.664 0.466 1.00 0.00 C ATOM 1490 CG GLN A 217 7.141 4.257 1.818 1.00 0.00 C ATOM 1491 CD GLN A 217 7.956 4.755 3.007 1.00 0.00 C ATOM 1492 OE1 GLN A 217 7.524 5.607 3.776 1.00 0.00 O ATOM 1493 NE2 GLN A 217 9.161 4.255 3.176 1.00 0.00 N ATOM 0 H GLN A 217 5.831 6.122 0.098 1.00 0.00 H new ATOM 0 HA GLN A 217 8.341 6.546 1.239 1.00 0.00 H new ATOM 0 HB2 GLN A 217 7.137 4.277 -0.342 1.00 0.00 H new ATOM 0 HB3 GLN A 217 8.739 4.201 0.365 1.00 0.00 H new ATOM 0 HG2 GLN A 217 6.128 4.653 1.885 1.00 0.00 H new ATOM 0 HG3 GLN A 217 7.063 3.171 1.865 1.00 0.00 H new ATOM 0 HE21 GLN A 217 9.514 3.547 2.533 1.00 0.00 H new ATOM 0 HE22 GLN A 217 9.742 4.576 3.950 1.00 0.00 H new ATOM 1502 N TYR A 218 8.360 6.626 -2.076 1.00 0.00 N ATOM 1503 CA TYR A 218 9.127 7.206 -3.172 1.00 0.00 C ATOM 1504 C TYR A 218 9.677 8.578 -2.805 1.00 0.00 C ATOM 1505 O TYR A 218 10.871 8.775 -2.949 1.00 0.00 O ATOM 1506 CB TYR A 218 8.314 7.320 -4.462 1.00 0.00 C ATOM 1507 CG TYR A 218 9.170 7.458 -5.707 1.00 0.00 C ATOM 1508 CD1 TYR A 218 9.910 8.631 -5.956 1.00 0.00 C ATOM 1509 CD2 TYR A 218 9.211 6.408 -6.634 1.00 0.00 C ATOM 1510 CE1 TYR A 218 10.782 8.697 -7.058 1.00 0.00 C ATOM 1511 CE2 TYR A 218 10.059 6.474 -7.756 1.00 0.00 C ATOM 1512 CZ TYR A 218 10.887 7.601 -7.937 1.00 0.00 C ATOM 1513 OH TYR A 218 11.805 7.627 -8.938 1.00 0.00 O ATOM 0 H TYR A 218 7.447 6.264 -2.349 1.00 0.00 H new ATOM 0 HA TYR A 218 9.955 6.520 -3.349 1.00 0.00 H new ATOM 0 HB2 TYR A 218 7.681 6.438 -4.562 1.00 0.00 H new ATOM 0 HB3 TYR A 218 7.651 8.182 -4.389 1.00 0.00 H new ATOM 0 HD1 TYR A 218 9.807 9.482 -5.299 1.00 0.00 H new ATOM 0 HD2 TYR A 218 8.586 5.540 -6.486 1.00 0.00 H new ATOM 0 HE1 TYR A 218 11.370 9.586 -7.230 1.00 0.00 H new ATOM 0 HE2 TYR A 218 10.075 5.667 -8.473 1.00 0.00 H new ATOM 0 HH TYR A 218 12.591 7.105 -8.674 1.00 0.00 H new ATOM 1523 N GLN A 219 8.856 9.513 -2.307 1.00 0.00 N ATOM 1524 CA GLN A 219 9.275 10.862 -1.937 1.00 0.00 C ATOM 1525 C GLN A 219 10.534 10.803 -1.042 1.00 0.00 C ATOM 1526 O GLN A 219 11.572 11.374 -1.380 1.00 0.00 O ATOM 1527 CB GLN A 219 8.116 11.616 -1.251 1.00 0.00 C ATOM 1528 CG GLN A 219 6.760 11.687 -1.987 1.00 0.00 C ATOM 1529 CD GLN A 219 5.588 12.143 -1.107 1.00 0.00 C ATOM 1530 OE1 GLN A 219 5.742 12.658 0.001 1.00 0.00 O ATOM 1531 NE2 GLN A 219 4.367 11.914 -1.555 1.00 0.00 N ATOM 0 H GLN A 219 7.863 9.344 -2.149 1.00 0.00 H new ATOM 0 HA GLN A 219 9.536 11.416 -2.838 1.00 0.00 H new ATOM 0 HB2 GLN A 219 7.945 11.152 -0.280 1.00 0.00 H new ATOM 0 HB3 GLN A 219 8.447 12.637 -1.063 1.00 0.00 H new ATOM 0 HG2 GLN A 219 6.853 12.371 -2.831 1.00 0.00 H new ATOM 0 HG3 GLN A 219 6.530 10.704 -2.397 1.00 0.00 H new ATOM 0 HE21 GLN A 219 4.232 11.488 -2.472 1.00 0.00 H new ATOM 0 HE22 GLN A 219 3.559 12.163 -0.984 1.00 0.00 H new ATOM 1540 N LYS A 220 10.460 10.035 0.056 1.00 0.00 N ATOM 1541 CA LYS A 220 11.512 9.949 1.102 1.00 0.00 C ATOM 1542 C LYS A 220 12.767 9.227 0.613 1.00 0.00 C ATOM 1543 O LYS A 220 13.897 9.575 0.962 1.00 0.00 O ATOM 1544 CB LYS A 220 11.034 9.242 2.399 1.00 0.00 C ATOM 1545 CG LYS A 220 9.535 8.969 2.539 1.00 0.00 C ATOM 1546 CD LYS A 220 8.678 10.234 2.555 1.00 0.00 C ATOM 1547 CE LYS A 220 8.679 10.853 3.943 1.00 0.00 C ATOM 1548 NZ LYS A 220 8.015 12.175 3.942 1.00 0.00 N ATOM 0 H LYS A 220 9.654 9.441 0.253 1.00 0.00 H new ATOM 0 HA LYS A 220 11.745 10.990 1.328 1.00 0.00 H new ATOM 0 HB2 LYS A 220 11.559 8.290 2.477 1.00 0.00 H new ATOM 0 HB3 LYS A 220 11.347 9.849 3.249 1.00 0.00 H new ATOM 0 HG2 LYS A 220 9.212 8.333 1.715 1.00 0.00 H new ATOM 0 HG3 LYS A 220 9.361 8.411 3.459 1.00 0.00 H new ATOM 0 HD2 LYS A 220 9.062 10.951 1.829 1.00 0.00 H new ATOM 0 HD3 LYS A 220 7.657 9.994 2.257 1.00 0.00 H new ATOM 0 HE2 LYS A 220 8.169 10.188 4.640 1.00 0.00 H new ATOM 0 HE3 LYS A 220 9.705 10.959 4.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 8.031 12.572 4.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 8.517 12.815 3.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 7.029 12.068 3.628 1.00 0.00 H new ATOM 1562 N GLU A 221 12.565 8.160 -0.150 1.00 0.00 N ATOM 1563 CA GLU A 221 13.610 7.356 -0.778 1.00 0.00 C ATOM 1564 C GLU A 221 14.321 8.160 -1.865 1.00 0.00 C ATOM 1565 O GLU A 221 15.539 8.058 -2.002 1.00 0.00 O ATOM 1566 CB GLU A 221 12.946 6.118 -1.383 1.00 0.00 C ATOM 1567 CG GLU A 221 12.313 5.204 -0.323 1.00 0.00 C ATOM 1568 CD GLU A 221 13.274 4.193 0.314 1.00 0.00 C ATOM 1569 OE1 GLU A 221 14.456 4.093 -0.096 1.00 0.00 O ATOM 1570 OE2 GLU A 221 12.819 3.435 1.218 1.00 0.00 O ATOM 0 H GLU A 221 11.628 7.815 -0.358 1.00 0.00 H new ATOM 0 HA GLU A 221 14.356 7.064 -0.039 1.00 0.00 H new ATOM 0 HB2 GLU A 221 12.179 6.432 -2.090 1.00 0.00 H new ATOM 0 HB3 GLU A 221 13.688 5.553 -1.947 1.00 0.00 H new ATOM 0 HG2 GLU A 221 11.888 5.826 0.465 1.00 0.00 H new ATOM 0 HG3 GLU A 221 11.487 4.660 -0.780 1.00 0.00 H new ATOM 1577 N SER A 222 13.553 8.968 -2.608 1.00 0.00 N ATOM 1578 CA SER A 222 13.994 9.773 -3.763 1.00 0.00 C ATOM 1579 C SER A 222 14.808 10.983 -3.338 1.00 0.00 C ATOM 1580 O SER A 222 15.849 11.279 -3.934 1.00 0.00 O ATOM 1581 CB SER A 222 12.787 10.221 -4.582 1.00 0.00 C ATOM 1582 OG SER A 222 13.173 10.748 -5.829 1.00 0.00 O ATOM 0 H SER A 222 12.559 9.086 -2.413 1.00 0.00 H new ATOM 0 HA SER A 222 14.638 9.140 -4.374 1.00 0.00 H new ATOM 0 HB2 SER A 222 12.117 9.375 -4.736 1.00 0.00 H new ATOM 0 HB3 SER A 222 12.228 10.974 -4.026 1.00 0.00 H new ATOM 0 HG SER A 222 12.400 11.168 -6.260 1.00 0.00 H new ATOM 1588 N GLN A 223 14.350 11.648 -2.273 1.00 0.00 N ATOM 1589 CA GLN A 223 15.105 12.666 -1.549 1.00 0.00 C ATOM 1590 C GLN A 223 16.432 12.102 -1.058 1.00 0.00 C ATOM 1591 O GLN A 223 17.462 12.742 -1.243 1.00 0.00 O ATOM 1592 CB GLN A 223 14.303 13.128 -0.331 1.00 0.00 C ATOM 1593 CG GLN A 223 13.184 14.119 -0.691 1.00 0.00 C ATOM 1594 CD GLN A 223 12.394 14.549 0.542 1.00 0.00 C ATOM 1595 OE1 GLN A 223 11.286 14.091 0.806 1.00 0.00 O ATOM 1596 NE2 GLN A 223 12.943 15.446 1.337 1.00 0.00 N ATOM 0 H GLN A 223 13.421 11.487 -1.884 1.00 0.00 H new ATOM 0 HA GLN A 223 15.290 13.499 -2.227 1.00 0.00 H new ATOM 0 HB2 GLN A 223 13.867 12.259 0.161 1.00 0.00 H new ATOM 0 HB3 GLN A 223 14.978 13.595 0.386 1.00 0.00 H new ATOM 0 HG2 GLN A 223 13.616 14.997 -1.171 1.00 0.00 H new ATOM 0 HG3 GLN A 223 12.510 13.660 -1.414 1.00 0.00 H new ATOM 0 HE21 GLN A 223 13.864 15.827 1.118 1.00 0.00 H new ATOM 0 HE22 GLN A 223 12.447 15.759 2.171 1.00 0.00 H new ATOM 1605 N ALA A 224 16.415 10.913 -0.450 1.00 0.00 N ATOM 1606 CA ALA A 224 17.596 10.235 0.053 1.00 0.00 C ATOM 1607 C ALA A 224 18.537 9.806 -1.083 1.00 0.00 C ATOM 1608 O ALA A 224 19.754 9.958 -1.000 1.00 0.00 O ATOM 1609 CB ALA A 224 17.134 9.043 0.886 1.00 0.00 C ATOM 0 H ALA A 224 15.554 10.388 -0.294 1.00 0.00 H new ATOM 0 HA ALA A 224 18.176 10.918 0.674 1.00 0.00 H new ATOM 0 HB1 ALA A 224 18.003 8.514 1.277 1.00 0.00 H new ATOM 0 HB2 ALA A 224 16.520 9.395 1.715 1.00 0.00 H new ATOM 0 HB3 ALA A 224 16.549 8.368 0.262 1.00 0.00 H new ATOM 1615 N TYR A 225 17.972 9.330 -2.194 1.00 0.00 N ATOM 1616 CA TYR A 225 18.701 8.949 -3.393 1.00 0.00 C ATOM 1617 C TYR A 225 19.398 10.161 -4.030 1.00 0.00 C ATOM 1618 O TYR A 225 20.524 10.036 -4.535 1.00 0.00 O ATOM 1619 CB TYR A 225 17.693 8.285 -4.329 1.00 0.00 C ATOM 1620 CG TYR A 225 18.144 8.147 -5.755 1.00 0.00 C ATOM 1621 CD1 TYR A 225 19.229 7.317 -6.071 1.00 0.00 C ATOM 1622 CD2 TYR A 225 17.487 8.883 -6.752 1.00 0.00 C ATOM 1623 CE1 TYR A 225 19.675 7.241 -7.400 1.00 0.00 C ATOM 1624 CE2 TYR A 225 17.927 8.804 -8.085 1.00 0.00 C ATOM 1625 CZ TYR A 225 19.038 7.998 -8.405 1.00 0.00 C ATOM 1626 OH TYR A 225 19.519 7.975 -9.677 1.00 0.00 O ATOM 0 H TYR A 225 16.964 9.197 -2.281 1.00 0.00 H new ATOM 0 HA TYR A 225 19.504 8.249 -3.163 1.00 0.00 H new ATOM 0 HB2 TYR A 225 17.458 7.294 -3.941 1.00 0.00 H new ATOM 0 HB3 TYR A 225 16.768 8.862 -4.311 1.00 0.00 H new ATOM 0 HD1 TYR A 225 19.717 6.741 -5.299 1.00 0.00 H new ATOM 0 HD2 TYR A 225 16.645 9.509 -6.496 1.00 0.00 H new ATOM 0 HE1 TYR A 225 20.508 6.601 -7.653 1.00 0.00 H new ATOM 0 HE2 TYR A 225 17.417 9.358 -8.859 1.00 0.00 H new ATOM 0 HH TYR A 225 19.252 7.139 -10.112 1.00 0.00 H new ATOM 1636 N TYR A 226 18.752 11.334 -3.961 1.00 0.00 N ATOM 1637 CA TYR A 226 19.329 12.632 -4.301 1.00 0.00 C ATOM 1638 C TYR A 226 20.388 13.075 -3.276 1.00 0.00 C ATOM 1639 O TYR A 226 21.442 13.590 -3.660 1.00 0.00 O ATOM 1640 CB TYR A 226 18.225 13.686 -4.419 1.00 0.00 C ATOM 1641 CG TYR A 226 18.668 14.922 -5.170 1.00 0.00 C ATOM 1642 CD1 TYR A 226 19.271 15.996 -4.487 1.00 0.00 C ATOM 1643 CD2 TYR A 226 18.508 14.973 -6.568 1.00 0.00 C ATOM 1644 CE1 TYR A 226 19.732 17.115 -5.206 1.00 0.00 C ATOM 1645 CE2 TYR A 226 18.968 16.088 -7.291 1.00 0.00 C ATOM 1646 CZ TYR A 226 19.588 17.161 -6.610 1.00 0.00 C ATOM 1647 OH TYR A 226 20.041 18.241 -7.303 1.00 0.00 O ATOM 0 H TYR A 226 17.781 11.402 -3.656 1.00 0.00 H new ATOM 0 HA TYR A 226 19.830 12.529 -5.263 1.00 0.00 H new ATOM 0 HB2 TYR A 226 17.365 13.248 -4.925 1.00 0.00 H new ATOM 0 HB3 TYR A 226 17.895 13.973 -3.420 1.00 0.00 H new ATOM 0 HD1 TYR A 226 19.380 15.961 -3.413 1.00 0.00 H new ATOM 0 HD2 TYR A 226 18.031 14.154 -7.086 1.00 0.00 H new ATOM 0 HE1 TYR A 226 20.196 17.939 -4.684 1.00 0.00 H new ATOM 0 HE2 TYR A 226 18.848 16.125 -8.364 1.00 0.00 H new ATOM 0 HH TYR A 226 19.866 18.114 -8.259 1.00 0.00 H new ATOM 1657 N ASP A 227 20.112 12.856 -1.985 1.00 0.00 N ATOM 1658 CA ASP A 227 20.954 13.206 -0.848 1.00 0.00 C ATOM 1659 C ASP A 227 22.273 12.430 -0.750 1.00 0.00 C ATOM 1660 O ASP A 227 23.241 12.946 -0.177 1.00 0.00 O ATOM 1661 CB ASP A 227 20.145 13.055 0.449 1.00 0.00 C ATOM 1662 CG ASP A 227 20.837 13.723 1.624 1.00 0.00 C ATOM 1663 OD1 ASP A 227 21.022 14.965 1.543 1.00 0.00 O ATOM 1664 OD2 ASP A 227 21.235 12.977 2.555 1.00 0.00 O ATOM 0 H ASP A 227 19.245 12.404 -1.696 1.00 0.00 H new ATOM 0 HA ASP A 227 21.254 14.242 -1.005 1.00 0.00 H new ATOM 0 HB2 ASP A 227 19.155 13.491 0.313 1.00 0.00 H new ATOM 0 HB3 ASP A 227 20.000 11.997 0.666 1.00 0.00 H new ATOM 1669 N GLY A 228 22.320 11.212 -1.291 1.00 0.00 N ATOM 1670 CA GLY A 228 23.468 10.311 -1.188 1.00 0.00 C ATOM 1671 C GLY A 228 23.239 9.188 -0.176 1.00 0.00 C ATOM 1672 O GLY A 228 24.154 8.848 0.582 1.00 0.00 O ATOM 0 H GLY A 228 21.545 10.816 -1.824 1.00 0.00 H new ATOM 0 HA2 GLY A 228 23.675 9.878 -2.167 1.00 0.00 H new ATOM 0 HA3 GLY A 228 24.350 10.882 -0.899 1.00 0.00 H new TER 1676 GLY A 228