USER MOD reduce.3.24.130724 H: found=0, std=0, add=807, rem=0, adj=33 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 190 THR OG1 : rot 180:sc= -0.0542 USER MOD Set 1.2: A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 187 HIS : no HD1:sc= -2.22 K(o=-2.7,f=-4.6!) USER MOD Set 2.2: A 188 THR OG1 : rot -130:sc= 0 USER MOD Set 2.3: A 206 MET CE :methyl -168:sc= -0.514 (180deg=-0.868) USER MOD Set 3.1: A 177 HIS :FLIP no HD1:sc= -0.0255 F(o=-0.58,f=-0.06) USER MOD Set 3.2: A 181 ASN : amide:sc= -0.0348 K(o=-0.06,f=-0.94) USER MOD Set 4.1: A 171 ASN : amide:sc= 0.946 K(o=1.1,f=-0.061) USER MOD Set 4.2: A 174 ASN : amide:sc= 0.115 K(o=1.1,f=-0.061) USER MOD Set 5.1: A 138 MET CE :methyl -120:sc= -0.323 (180deg=-1.43!) USER MOD Set 5.2: A 154 MET CE :methyl -175:sc= -0.405 (180deg=-0.482) USER MOD Set 6.1: A 134 MET CE :methyl -175:sc= -0.92 (180deg=-0.968) USER MOD Set 6.2: A 217 GLN : amide:sc= -0.255 K(o=-1.2,f=-3) USER MOD Single : A 128 TYR OH : rot -165:sc= 1.26 USER MOD Single : A 129 MET CE :methyl 160:sc= -1.68 (180deg=-3.56!) USER MOD Single : A 132 SER OG : rot 180:sc=0.000387 USER MOD Single : A 135 SER OG : rot 180:sc= -0.0124 USER MOD Single : A 140 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 143 ASN : amide:sc= 1.06 K(o=1.1,f=-0.18) USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot 154:sc= 0.913 USER MOD Single : A 153 ASN : amide:sc= 1.07 K(o=1.1,f=-2.7!) USER MOD Single : A 155 TYR OH : rot 126:sc= 1.07 USER MOD Single : A 157 TYR OH : rot 30:sc= -0.0291 USER MOD Single : A 159 ASN : amide:sc= 1.16 K(o=1.2,f=-0.032) USER MOD Single : A 160 GLN : amide:sc= 1.06 K(o=1.1,f=0) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 GLN :FLIP amide:sc= -0.0278 F(o=-0.66,f=-0.028) USER MOD Single : A 170 SER OG : rot 180:sc= 0.106 USER MOD Single : A 172 GLN : amide:sc= 0 X(o=0,f=0.12) USER MOD Single : A 173 ASN : amide:sc= -0.159 X(o=-0.16,f=0) USER MOD Single : A 183 THR OG1 : rot 77:sc= 1.1 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= -2.27! C(o=-2.3!,f=-2!) USER MOD Single : A 191 THR OG1 : rot -160:sc= -0.689 USER MOD Single : A 192 THR OG1 : rot -51:sc= -0.84 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 197 ASN : amide:sc=-0.00289 X(o=-0.0029,f=-0.094) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ -132:sc= 1.3 (180deg=-0.503) USER MOD Single : A 205 MET CE :methyl -149:sc= -0.0606 (180deg=-0.679) USER MOD Single : A 212 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 213 MET CE :methyl 173:sc= -0.617 (180deg=-0.794) USER MOD Single : A 216 THR OG1 : rot 79:sc= 0.0141 USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN :FLIP amide:sc= 0 F(o=-1.2,f=0) USER MOD Single : A 220 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 SER OG : rot 180:sc= 0 USER MOD Single : A 223 GLN :FLIP amide:sc= -0.141 F(o=-0.88,f=-0.14) USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 125 8.579 -13.370 -1.386 1.00 0.00 N ATOM 66 CA LEU A 125 8.841 -12.492 -2.491 1.00 0.00 C ATOM 67 C LEU A 125 10.235 -12.728 -3.060 1.00 0.00 C ATOM 68 O LEU A 125 10.746 -13.845 -2.970 1.00 0.00 O ATOM 69 CB LEU A 125 8.421 -11.059 -2.145 1.00 0.00 C ATOM 70 CG LEU A 125 6.903 -10.854 -2.012 1.00 0.00 C ATOM 71 CD1 LEU A 125 6.592 -9.360 -2.005 1.00 0.00 C ATOM 72 CD2 LEU A 125 6.076 -11.510 -3.125 1.00 0.00 C ATOM 0 HA LEU A 125 8.209 -12.724 -3.349 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.897 -10.770 -1.208 1.00 0.00 H new ATOM 0 HB3 LEU A 125 8.800 -10.387 -2.915 1.00 0.00 H new ATOM 0 HG LEU A 125 6.620 -11.338 -1.077 1.00 0.00 H new ATOM 0 HD11 LEU A 125 5.516 -9.213 -1.911 1.00 0.00 H new ATOM 0 HD12 LEU A 125 7.098 -8.887 -1.163 1.00 0.00 H new ATOM 0 HD13 LEU A 125 6.939 -8.912 -2.936 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.017 -11.316 -2.954 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.370 -11.095 -4.089 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.253 -12.586 -3.124 1.00 0.00 H new ATOM 84 N GLY A 126 10.881 -11.716 -3.628 1.00 0.00 N ATOM 85 CA GLY A 126 12.299 -11.783 -3.956 1.00 0.00 C ATOM 86 C GLY A 126 13.200 -11.724 -2.716 1.00 0.00 C ATOM 87 O GLY A 126 14.372 -11.384 -2.844 1.00 0.00 O ATOM 0 H GLY A 126 10.438 -10.830 -3.873 1.00 0.00 H new ATOM 0 HA2 GLY A 126 12.498 -12.706 -4.500 1.00 0.00 H new ATOM 0 HA3 GLY A 126 12.552 -10.959 -4.623 1.00 0.00 H new ATOM 91 N GLY A 127 12.682 -11.986 -1.506 1.00 0.00 N ATOM 92 CA GLY A 127 13.316 -11.504 -0.282 1.00 0.00 C ATOM 93 C GLY A 127 13.126 -9.994 -0.211 1.00 0.00 C ATOM 94 O GLY A 127 14.074 -9.255 0.054 1.00 0.00 O ATOM 0 H GLY A 127 11.830 -12.527 -1.355 1.00 0.00 H new ATOM 0 HA2 GLY A 127 12.873 -11.984 0.590 1.00 0.00 H new ATOM 0 HA3 GLY A 127 14.377 -11.754 -0.279 1.00 0.00 H new ATOM 98 N TYR A 128 11.901 -9.550 -0.501 1.00 0.00 N ATOM 99 CA TYR A 128 11.482 -8.166 -0.355 1.00 0.00 C ATOM 100 C TYR A 128 11.527 -7.779 1.127 1.00 0.00 C ATOM 101 O TYR A 128 11.506 -8.625 2.031 1.00 0.00 O ATOM 102 CB TYR A 128 10.055 -7.999 -0.911 1.00 0.00 C ATOM 103 CG TYR A 128 9.928 -7.748 -2.401 1.00 0.00 C ATOM 104 CD1 TYR A 128 10.663 -8.504 -3.329 1.00 0.00 C ATOM 105 CD2 TYR A 128 8.984 -6.816 -2.866 1.00 0.00 C ATOM 106 CE1 TYR A 128 10.388 -8.410 -4.702 1.00 0.00 C ATOM 107 CE2 TYR A 128 8.718 -6.698 -4.241 1.00 0.00 C ATOM 108 CZ TYR A 128 9.396 -7.518 -5.167 1.00 0.00 C ATOM 109 OH TYR A 128 9.113 -7.438 -6.495 1.00 0.00 O ATOM 0 H TYR A 128 11.162 -10.160 -0.851 1.00 0.00 H new ATOM 0 HA TYR A 128 12.154 -7.514 -0.913 1.00 0.00 H new ATOM 0 HB2 TYR A 128 9.488 -8.898 -0.668 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.580 -7.171 -0.385 1.00 0.00 H new ATOM 0 HD1 TYR A 128 11.446 -9.163 -2.983 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.460 -6.187 -2.162 1.00 0.00 H new ATOM 0 HE1 TYR A 128 10.936 -9.021 -5.404 1.00 0.00 H new ATOM 0 HE2 TYR A 128 7.993 -5.978 -4.589 1.00 0.00 H new ATOM 0 HH TYR A 128 8.595 -6.625 -6.671 1.00 0.00 H new ATOM 119 N MET A 129 11.536 -6.479 1.366 1.00 0.00 N ATOM 120 CA MET A 129 11.433 -5.853 2.669 1.00 0.00 C ATOM 121 C MET A 129 9.977 -5.515 2.933 1.00 0.00 C ATOM 122 O MET A 129 9.191 -5.414 1.990 1.00 0.00 O ATOM 123 CB MET A 129 12.270 -4.567 2.675 1.00 0.00 C ATOM 124 CG MET A 129 13.712 -4.662 2.150 1.00 0.00 C ATOM 125 SD MET A 129 14.972 -5.310 3.278 1.00 0.00 S ATOM 126 CE MET A 129 14.250 -6.901 3.724 1.00 0.00 C ATOM 0 H MET A 129 11.620 -5.796 0.613 1.00 0.00 H new ATOM 0 HA MET A 129 11.801 -6.527 3.442 1.00 0.00 H new ATOM 0 HB2 MET A 129 11.744 -3.819 2.082 1.00 0.00 H new ATOM 0 HB3 MET A 129 12.307 -4.194 3.698 1.00 0.00 H new ATOM 0 HG2 MET A 129 13.705 -5.289 1.258 1.00 0.00 H new ATOM 0 HG3 MET A 129 14.022 -3.665 1.836 1.00 0.00 H new ATOM 0 HE1 MET A 129 15.029 -7.559 4.109 1.00 0.00 H new ATOM 0 HE2 MET A 129 13.489 -6.753 4.490 1.00 0.00 H new ATOM 0 HE3 MET A 129 13.795 -7.354 2.843 1.00 0.00 H new ATOM 136 N LEU A 130 9.628 -5.297 4.200 1.00 0.00 N ATOM 137 CA LEU A 130 8.312 -4.866 4.638 1.00 0.00 C ATOM 138 C LEU A 130 8.477 -3.654 5.552 1.00 0.00 C ATOM 139 O LEU A 130 9.461 -3.549 6.286 1.00 0.00 O ATOM 140 CB LEU A 130 7.581 -6.052 5.293 1.00 0.00 C ATOM 141 CG LEU A 130 6.202 -5.703 5.885 1.00 0.00 C ATOM 142 CD1 LEU A 130 5.144 -5.505 4.801 1.00 0.00 C ATOM 143 CD2 LEU A 130 5.740 -6.824 6.813 1.00 0.00 C ATOM 0 H LEU A 130 10.281 -5.422 4.973 1.00 0.00 H new ATOM 0 HA LEU A 130 7.688 -4.550 3.802 1.00 0.00 H new ATOM 0 HB2 LEU A 130 7.455 -6.840 4.550 1.00 0.00 H new ATOM 0 HB3 LEU A 130 8.210 -6.458 6.085 1.00 0.00 H new ATOM 0 HG LEU A 130 6.315 -4.767 6.432 1.00 0.00 H new ATOM 0 HD11 LEU A 130 4.189 -5.261 5.265 1.00 0.00 H new ATOM 0 HD12 LEU A 130 5.446 -4.691 4.142 1.00 0.00 H new ATOM 0 HD13 LEU A 130 5.041 -6.422 4.221 1.00 0.00 H new ATOM 0 HD21 LEU A 130 4.764 -6.573 7.229 1.00 0.00 H new ATOM 0 HD22 LEU A 130 5.666 -7.755 6.250 1.00 0.00 H new ATOM 0 HD23 LEU A 130 6.460 -6.946 7.623 1.00 0.00 H new ATOM 155 N GLY A 131 7.535 -2.719 5.464 1.00 0.00 N ATOM 156 CA GLY A 131 7.478 -1.502 6.253 1.00 0.00 C ATOM 157 C GLY A 131 6.498 -1.636 7.412 1.00 0.00 C ATOM 158 O GLY A 131 5.792 -2.637 7.546 1.00 0.00 O ATOM 0 H GLY A 131 6.757 -2.797 4.809 1.00 0.00 H new ATOM 0 HA2 GLY A 131 8.471 -1.270 6.639 1.00 0.00 H new ATOM 0 HA3 GLY A 131 7.180 -0.668 5.617 1.00 0.00 H new ATOM 162 N SER A 132 6.439 -0.620 8.263 1.00 0.00 N ATOM 163 CA SER A 132 5.593 -0.613 9.441 1.00 0.00 C ATOM 164 C SER A 132 4.132 -0.359 9.085 1.00 0.00 C ATOM 165 O SER A 132 3.803 0.057 7.972 1.00 0.00 O ATOM 166 CB SER A 132 6.053 0.487 10.389 1.00 0.00 C ATOM 167 OG SER A 132 7.456 0.671 10.428 1.00 0.00 O ATOM 0 H SER A 132 6.987 0.233 8.149 1.00 0.00 H new ATOM 0 HA SER A 132 5.674 -1.593 9.911 1.00 0.00 H new ATOM 0 HB2 SER A 132 5.583 1.425 10.094 1.00 0.00 H new ATOM 0 HB3 SER A 132 5.700 0.256 11.394 1.00 0.00 H new ATOM 0 HG SER A 132 7.674 1.392 11.055 1.00 0.00 H new ATOM 173 N ALA A 133 3.240 -0.588 10.048 1.00 0.00 N ATOM 174 CA ALA A 133 1.823 -0.335 9.871 1.00 0.00 C ATOM 175 C ALA A 133 1.594 1.170 9.908 1.00 0.00 C ATOM 176 O ALA A 133 1.744 1.781 10.967 1.00 0.00 O ATOM 177 CB ALA A 133 1.014 -1.085 10.929 1.00 0.00 C ATOM 0 H ALA A 133 3.485 -0.953 10.968 1.00 0.00 H new ATOM 0 HA ALA A 133 1.481 -0.707 8.905 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -0.048 -0.886 10.784 1.00 0.00 H new ATOM 0 HB2 ALA A 133 1.198 -2.155 10.837 1.00 0.00 H new ATOM 0 HB3 ALA A 133 1.314 -0.749 11.922 1.00 0.00 H new ATOM 183 N MET A 134 1.262 1.743 8.752 1.00 0.00 N ATOM 184 CA MET A 134 0.975 3.151 8.570 1.00 0.00 C ATOM 185 C MET A 134 -0.481 3.418 8.887 1.00 0.00 C ATOM 186 O MET A 134 -1.337 2.527 8.837 1.00 0.00 O ATOM 187 CB MET A 134 1.177 3.588 7.117 1.00 0.00 C ATOM 188 CG MET A 134 2.589 3.409 6.597 1.00 0.00 C ATOM 189 SD MET A 134 2.904 4.563 5.238 1.00 0.00 S ATOM 190 CE MET A 134 4.340 3.701 4.607 1.00 0.00 C ATOM 0 H MET A 134 1.185 1.210 7.886 1.00 0.00 H new ATOM 0 HA MET A 134 1.651 3.697 9.228 1.00 0.00 H new ATOM 0 HB2 MET A 134 0.495 3.022 6.483 1.00 0.00 H new ATOM 0 HB3 MET A 134 0.900 4.638 7.025 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.305 3.578 7.401 1.00 0.00 H new ATOM 0 HG3 MET A 134 2.731 2.384 6.254 1.00 0.00 H new ATOM 0 HE1 MET A 134 4.783 4.278 3.796 1.00 0.00 H new ATOM 0 HE2 MET A 134 5.071 3.578 5.406 1.00 0.00 H new ATOM 0 HE3 MET A 134 4.042 2.721 4.234 1.00 0.00 H new ATOM 200 N SER A 135 -0.785 4.686 9.090 1.00 0.00 N ATOM 201 CA SER A 135 -2.139 5.154 9.273 1.00 0.00 C ATOM 202 C SER A 135 -2.850 5.299 7.936 1.00 0.00 C ATOM 203 O SER A 135 -2.222 5.292 6.872 1.00 0.00 O ATOM 204 CB SER A 135 -2.084 6.472 10.041 1.00 0.00 C ATOM 205 OG SER A 135 -3.364 6.827 10.499 1.00 0.00 O ATOM 0 H SER A 135 -0.086 5.428 9.132 1.00 0.00 H new ATOM 0 HA SER A 135 -2.717 4.429 9.847 1.00 0.00 H new ATOM 0 HB2 SER A 135 -1.401 6.380 10.886 1.00 0.00 H new ATOM 0 HB3 SER A 135 -1.690 7.259 9.398 1.00 0.00 H new ATOM 0 HG SER A 135 -3.312 7.673 10.991 1.00 0.00 H new ATOM 211 N ARG A 136 -4.177 5.425 7.984 1.00 0.00 N ATOM 212 CA ARG A 136 -4.977 5.551 6.791 1.00 0.00 C ATOM 213 C ARG A 136 -4.806 6.981 6.280 1.00 0.00 C ATOM 214 O ARG A 136 -5.040 7.924 7.037 1.00 0.00 O ATOM 215 CB ARG A 136 -6.434 5.113 7.023 1.00 0.00 C ATOM 216 CG ARG A 136 -7.361 5.972 7.908 1.00 0.00 C ATOM 217 CD ARG A 136 -7.716 5.338 9.261 1.00 0.00 C ATOM 218 NE ARG A 136 -6.691 5.518 10.300 1.00 0.00 N ATOM 219 CZ ARG A 136 -6.685 6.464 11.252 1.00 0.00 C ATOM 220 NH1 ARG A 136 -7.627 7.402 11.305 1.00 0.00 N ATOM 221 NH2 ARG A 136 -5.727 6.480 12.168 1.00 0.00 N ATOM 0 H ARG A 136 -4.714 5.441 8.851 1.00 0.00 H new ATOM 0 HA ARG A 136 -4.638 4.868 6.012 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -6.907 5.026 6.045 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -6.408 4.112 7.455 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -6.882 6.935 8.087 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -8.283 6.171 7.361 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -8.654 5.765 9.615 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -7.886 4.271 9.116 1.00 0.00 H new ATOM 0 HE ARG A 136 -5.910 4.861 10.297 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -8.376 7.413 10.612 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -7.601 8.110 12.038 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -4.992 5.772 12.150 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -5.724 7.200 12.891 1.00 0.00 H new ATOM 235 N PRO A 137 -4.384 7.191 5.030 1.00 0.00 N ATOM 236 CA PRO A 137 -4.397 8.521 4.435 1.00 0.00 C ATOM 237 C PRO A 137 -5.848 9.006 4.257 1.00 0.00 C ATOM 238 O PRO A 137 -6.794 8.217 4.333 1.00 0.00 O ATOM 239 CB PRO A 137 -3.655 8.361 3.106 1.00 0.00 C ATOM 240 CG PRO A 137 -3.814 6.881 2.754 1.00 0.00 C ATOM 241 CD PRO A 137 -3.973 6.166 4.089 1.00 0.00 C ATOM 0 HA PRO A 137 -3.914 9.277 5.054 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -4.082 9.001 2.334 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -2.605 8.635 3.202 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -4.682 6.720 2.115 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -2.945 6.510 2.210 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -4.717 5.372 4.023 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -3.037 5.701 4.399 1.00 0.00 H new ATOM 249 N MET A 138 -6.050 10.295 4.000 1.00 0.00 N ATOM 250 CA MET A 138 -7.306 10.827 3.491 1.00 0.00 C ATOM 251 C MET A 138 -7.229 10.832 1.973 1.00 0.00 C ATOM 252 O MET A 138 -6.217 11.247 1.403 1.00 0.00 O ATOM 253 CB MET A 138 -7.540 12.241 4.028 1.00 0.00 C ATOM 254 CG MET A 138 -8.483 12.291 5.230 1.00 0.00 C ATOM 255 SD MET A 138 -8.344 11.031 6.539 1.00 0.00 S ATOM 256 CE MET A 138 -9.572 9.769 6.058 1.00 0.00 C ATOM 0 H MET A 138 -5.334 11.008 4.142 1.00 0.00 H new ATOM 0 HA MET A 138 -8.142 10.209 3.819 1.00 0.00 H new ATOM 0 HB2 MET A 138 -6.582 12.677 4.310 1.00 0.00 H new ATOM 0 HB3 MET A 138 -7.949 12.861 3.230 1.00 0.00 H new ATOM 0 HG2 MET A 138 -8.358 13.266 5.702 1.00 0.00 H new ATOM 0 HG3 MET A 138 -9.502 12.251 4.846 1.00 0.00 H new ATOM 0 HE1 MET A 138 -10.314 9.663 6.850 1.00 0.00 H new ATOM 0 HE2 MET A 138 -10.066 10.075 5.136 1.00 0.00 H new ATOM 0 HE3 MET A 138 -9.070 8.814 5.901 1.00 0.00 H new ATOM 266 N ILE A 139 -8.300 10.368 1.331 1.00 0.00 N ATOM 267 CA ILE A 139 -8.422 10.292 -0.117 1.00 0.00 C ATOM 268 C ILE A 139 -9.833 10.755 -0.432 1.00 0.00 C ATOM 269 O ILE A 139 -10.796 10.077 -0.084 1.00 0.00 O ATOM 270 CB ILE A 139 -8.118 8.882 -0.673 1.00 0.00 C ATOM 271 CG1 ILE A 139 -6.914 8.240 0.053 1.00 0.00 C ATOM 272 CG2 ILE A 139 -7.885 8.994 -2.195 1.00 0.00 C ATOM 273 CD1 ILE A 139 -6.416 6.972 -0.617 1.00 0.00 C ATOM 0 H ILE A 139 -9.127 10.026 1.820 1.00 0.00 H new ATOM 0 HA ILE A 139 -7.681 10.925 -0.605 1.00 0.00 H new ATOM 0 HB ILE A 139 -8.967 8.223 -0.492 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -6.099 8.962 0.099 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -7.197 8.013 1.081 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -7.669 8.007 -2.604 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -8.779 9.396 -2.671 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -7.042 9.658 -2.386 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -5.570 6.573 -0.057 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -7.217 6.234 -0.640 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -6.102 7.198 -1.636 1.00 0.00 H new ATOM 285 N HIS A 140 -9.939 11.938 -1.022 1.00 0.00 N ATOM 286 CA HIS A 140 -11.189 12.601 -1.378 1.00 0.00 C ATOM 287 C HIS A 140 -11.250 12.596 -2.896 1.00 0.00 C ATOM 288 O HIS A 140 -11.009 13.604 -3.561 1.00 0.00 O ATOM 289 CB HIS A 140 -11.285 14.013 -0.779 1.00 0.00 C ATOM 290 CG HIS A 140 -11.880 14.047 0.601 1.00 0.00 C ATOM 291 ND1 HIS A 140 -12.975 14.787 0.993 1.00 0.00 N ATOM 292 CD2 HIS A 140 -11.450 13.331 1.679 1.00 0.00 C ATOM 293 CE1 HIS A 140 -13.184 14.527 2.294 1.00 0.00 C ATOM 294 NE2 HIS A 140 -12.273 13.659 2.762 1.00 0.00 N ATOM 0 H HIS A 140 -9.119 12.488 -1.278 1.00 0.00 H new ATOM 0 HA HIS A 140 -12.048 12.076 -0.962 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -10.288 14.452 -0.746 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -11.886 14.638 -1.439 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -10.623 12.636 1.694 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -13.979 14.958 2.885 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -12.196 13.308 3.717 1.00 0.00 H new ATOM 302 N PHE A 141 -11.547 11.408 -3.414 1.00 0.00 N ATOM 303 CA PHE A 141 -11.572 11.067 -4.829 1.00 0.00 C ATOM 304 C PHE A 141 -12.291 12.141 -5.642 1.00 0.00 C ATOM 305 O PHE A 141 -11.702 12.793 -6.506 1.00 0.00 O ATOM 306 CB PHE A 141 -12.298 9.732 -5.015 1.00 0.00 C ATOM 307 CG PHE A 141 -11.556 8.492 -4.575 1.00 0.00 C ATOM 308 CD1 PHE A 141 -11.361 8.201 -3.209 1.00 0.00 C ATOM 309 CD2 PHE A 141 -11.117 7.586 -5.557 1.00 0.00 C ATOM 310 CE1 PHE A 141 -10.655 7.044 -2.837 1.00 0.00 C ATOM 311 CE2 PHE A 141 -10.437 6.418 -5.180 1.00 0.00 C ATOM 312 CZ PHE A 141 -10.176 6.163 -3.822 1.00 0.00 C ATOM 0 H PHE A 141 -11.790 10.614 -2.822 1.00 0.00 H new ATOM 0 HA PHE A 141 -10.543 10.994 -5.182 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -13.240 9.777 -4.468 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -12.547 9.624 -6.071 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -11.752 8.864 -2.452 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -11.303 7.789 -6.601 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -10.480 6.832 -1.793 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -10.114 5.715 -5.933 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.608 5.290 -3.536 1.00 0.00 H new ATOM 322 N GLY A 142 -13.579 12.318 -5.367 1.00 0.00 N ATOM 323 CA GLY A 142 -14.477 13.221 -6.054 1.00 0.00 C ATOM 324 C GLY A 142 -15.880 12.764 -5.704 1.00 0.00 C ATOM 325 O GLY A 142 -16.614 13.479 -5.025 1.00 0.00 O ATOM 0 H GLY A 142 -14.043 11.805 -4.618 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -14.312 14.251 -5.737 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -14.314 13.189 -7.131 1.00 0.00 H new ATOM 329 N ASN A 143 -16.220 11.526 -6.073 1.00 0.00 N ATOM 330 CA ASN A 143 -17.517 10.950 -5.752 1.00 0.00 C ATOM 331 C ASN A 143 -17.645 10.872 -4.237 1.00 0.00 C ATOM 332 O ASN A 143 -16.718 10.435 -3.552 1.00 0.00 O ATOM 333 CB ASN A 143 -17.681 9.538 -6.319 1.00 0.00 C ATOM 334 CG ASN A 143 -17.455 9.434 -7.815 1.00 0.00 C ATOM 335 OD1 ASN A 143 -18.378 9.529 -8.620 1.00 0.00 O ATOM 336 ND2 ASN A 143 -16.228 9.206 -8.230 1.00 0.00 N ATOM 0 H ASN A 143 -15.606 10.904 -6.598 1.00 0.00 H new ATOM 0 HA ASN A 143 -18.285 11.584 -6.195 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -16.983 8.872 -5.811 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -18.685 9.182 -6.090 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -16.037 9.107 -9.227 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -15.467 9.129 -7.555 1.00 0.00 H new ATOM 343 N ASP A 144 -18.810 11.247 -3.727 1.00 0.00 N ATOM 344 CA ASP A 144 -19.174 11.083 -2.328 1.00 0.00 C ATOM 345 C ASP A 144 -19.510 9.622 -2.019 1.00 0.00 C ATOM 346 O ASP A 144 -19.553 9.253 -0.851 1.00 0.00 O ATOM 347 CB ASP A 144 -20.378 11.984 -2.017 1.00 0.00 C ATOM 348 CG ASP A 144 -20.882 11.852 -0.577 1.00 0.00 C ATOM 349 OD1 ASP A 144 -20.180 12.317 0.349 1.00 0.00 O ATOM 350 OD2 ASP A 144 -22.020 11.353 -0.384 1.00 0.00 O ATOM 0 H ASP A 144 -19.543 11.683 -4.287 1.00 0.00 H new ATOM 0 HA ASP A 144 -18.328 11.369 -1.703 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -20.103 13.022 -2.204 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -21.190 11.741 -2.702 1.00 0.00 H new ATOM 355 N TRP A 145 -19.729 8.765 -3.029 1.00 0.00 N ATOM 356 CA TRP A 145 -19.744 7.325 -2.785 1.00 0.00 C ATOM 357 C TRP A 145 -18.319 6.819 -2.588 1.00 0.00 C ATOM 358 O TRP A 145 -18.083 6.101 -1.629 1.00 0.00 O ATOM 359 CB TRP A 145 -20.531 6.543 -3.844 1.00 0.00 C ATOM 360 CG TRP A 145 -20.093 6.634 -5.275 1.00 0.00 C ATOM 361 CD1 TRP A 145 -20.625 7.460 -6.198 1.00 0.00 C ATOM 362 CD2 TRP A 145 -19.108 5.835 -5.995 1.00 0.00 C ATOM 363 NE1 TRP A 145 -20.019 7.261 -7.420 1.00 0.00 N ATOM 364 CE2 TRP A 145 -19.025 6.312 -7.336 1.00 0.00 C ATOM 365 CE3 TRP A 145 -18.270 4.757 -5.650 1.00 0.00 C ATOM 366 CZ2 TRP A 145 -18.089 5.808 -8.254 1.00 0.00 C ATOM 367 CZ3 TRP A 145 -17.386 4.187 -6.587 1.00 0.00 C ATOM 368 CH2 TRP A 145 -17.267 4.733 -7.877 1.00 0.00 C ATOM 0 H TRP A 145 -19.894 9.040 -3.997 1.00 0.00 H new ATOM 0 HA TRP A 145 -20.292 7.142 -1.861 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -20.515 5.491 -3.559 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -21.569 6.871 -3.794 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -21.412 8.174 -6.008 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -20.274 7.753 -8.276 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -18.306 4.359 -4.647 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -18.002 6.242 -9.239 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -16.796 3.325 -6.313 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -16.548 4.328 -8.574 1.00 0.00 H new ATOM 379 N GLU A 146 -17.359 7.208 -3.435 1.00 0.00 N ATOM 380 CA GLU A 146 -15.977 6.730 -3.297 1.00 0.00 C ATOM 381 C GLU A 146 -15.378 7.146 -1.953 1.00 0.00 C ATOM 382 O GLU A 146 -14.855 6.297 -1.241 1.00 0.00 O ATOM 383 CB GLU A 146 -15.067 7.234 -4.434 1.00 0.00 C ATOM 384 CG GLU A 146 -15.345 6.514 -5.757 1.00 0.00 C ATOM 385 CD GLU A 146 -14.410 6.918 -6.898 1.00 0.00 C ATOM 386 OE1 GLU A 146 -14.097 8.121 -7.006 1.00 0.00 O ATOM 387 OE2 GLU A 146 -14.047 6.058 -7.739 1.00 0.00 O ATOM 0 H GLU A 146 -17.510 7.846 -4.216 1.00 0.00 H new ATOM 0 HA GLU A 146 -16.026 5.643 -3.353 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.214 8.306 -4.567 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -14.024 7.088 -4.154 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -15.262 5.439 -5.597 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -16.374 6.713 -6.057 1.00 0.00 H new ATOM 394 N ASP A 147 -15.459 8.428 -1.590 1.00 0.00 N ATOM 395 CA ASP A 147 -14.913 8.932 -0.324 1.00 0.00 C ATOM 396 C ASP A 147 -15.548 8.248 0.887 1.00 0.00 C ATOM 397 O ASP A 147 -14.858 7.832 1.817 1.00 0.00 O ATOM 398 CB ASP A 147 -15.201 10.422 -0.204 1.00 0.00 C ATOM 399 CG ASP A 147 -14.685 11.002 1.115 1.00 0.00 C ATOM 400 OD1 ASP A 147 -13.537 10.735 1.521 1.00 0.00 O ATOM 401 OD2 ASP A 147 -15.463 11.758 1.737 1.00 0.00 O ATOM 0 H ASP A 147 -15.903 9.146 -2.162 1.00 0.00 H new ATOM 0 HA ASP A 147 -13.843 8.726 -0.333 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -14.737 10.949 -1.038 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -16.275 10.591 -0.278 1.00 0.00 H new ATOM 406 N ARG A 148 -16.876 8.120 0.875 1.00 0.00 N ATOM 407 CA ARG A 148 -17.611 7.476 1.944 1.00 0.00 C ATOM 408 C ARG A 148 -17.209 6.018 2.031 1.00 0.00 C ATOM 409 O ARG A 148 -16.856 5.571 3.110 1.00 0.00 O ATOM 410 CB ARG A 148 -19.101 7.631 1.669 1.00 0.00 C ATOM 411 CG ARG A 148 -19.968 6.906 2.693 1.00 0.00 C ATOM 412 CD ARG A 148 -21.403 7.125 2.254 1.00 0.00 C ATOM 413 NE ARG A 148 -22.372 6.486 3.147 1.00 0.00 N ATOM 414 CZ ARG A 148 -23.666 6.405 2.840 1.00 0.00 C ATOM 415 NH1 ARG A 148 -24.106 6.929 1.701 1.00 0.00 N ATOM 416 NH2 ARG A 148 -24.514 5.812 3.669 1.00 0.00 N ATOM 0 H ARG A 148 -17.466 8.464 0.117 1.00 0.00 H new ATOM 0 HA ARG A 148 -17.382 7.940 2.904 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -19.357 8.690 1.667 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -19.324 7.247 0.674 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -19.728 5.843 2.726 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -19.802 7.301 3.695 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -21.606 8.195 2.211 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -21.533 6.735 1.245 1.00 0.00 H new ATOM 0 HE ARG A 148 -22.047 6.091 4.030 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -23.454 7.390 1.067 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -25.096 6.870 1.461 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -24.177 5.415 4.546 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -25.504 5.752 3.430 1.00 0.00 H new ATOM 430 N TYR A 149 -17.264 5.272 0.932 1.00 0.00 N ATOM 431 CA TYR A 149 -16.919 3.858 0.870 1.00 0.00 C ATOM 432 C TYR A 149 -15.474 3.642 1.319 1.00 0.00 C ATOM 433 O TYR A 149 -15.174 2.674 2.023 1.00 0.00 O ATOM 434 CB TYR A 149 -17.135 3.396 -0.577 1.00 0.00 C ATOM 435 CG TYR A 149 -16.973 1.916 -0.860 1.00 0.00 C ATOM 436 CD1 TYR A 149 -15.703 1.312 -0.893 1.00 0.00 C ATOM 437 CD2 TYR A 149 -18.101 1.165 -1.219 1.00 0.00 C ATOM 438 CE1 TYR A 149 -15.575 -0.059 -1.198 1.00 0.00 C ATOM 439 CE2 TYR A 149 -17.976 -0.188 -1.573 1.00 0.00 C ATOM 440 CZ TYR A 149 -16.715 -0.818 -1.548 1.00 0.00 C ATOM 441 OH TYR A 149 -16.612 -2.138 -1.877 1.00 0.00 O ATOM 0 H TYR A 149 -17.560 5.649 0.031 1.00 0.00 H new ATOM 0 HA TYR A 149 -17.548 3.273 1.542 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -18.140 3.690 -0.880 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -16.438 3.941 -1.214 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -14.822 1.901 -0.684 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -19.075 1.631 -1.223 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -14.604 -0.530 -1.164 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -18.851 -0.749 -1.866 1.00 0.00 H new ATOM 0 HH TYR A 149 -17.501 -2.493 -2.087 1.00 0.00 H new ATOM 451 N TYR A 150 -14.569 4.544 0.940 1.00 0.00 N ATOM 452 CA TYR A 150 -13.217 4.581 1.456 1.00 0.00 C ATOM 453 C TYR A 150 -13.263 4.678 2.985 1.00 0.00 C ATOM 454 O TYR A 150 -12.777 3.770 3.667 1.00 0.00 O ATOM 455 CB TYR A 150 -12.425 5.724 0.805 1.00 0.00 C ATOM 456 CG TYR A 150 -11.039 5.843 1.383 1.00 0.00 C ATOM 457 CD1 TYR A 150 -10.090 4.846 1.109 1.00 0.00 C ATOM 458 CD2 TYR A 150 -10.737 6.888 2.272 1.00 0.00 C ATOM 459 CE1 TYR A 150 -8.856 4.856 1.775 1.00 0.00 C ATOM 460 CE2 TYR A 150 -9.492 6.924 2.916 1.00 0.00 C ATOM 461 CZ TYR A 150 -8.562 5.887 2.696 1.00 0.00 C ATOM 462 OH TYR A 150 -7.398 5.868 3.392 1.00 0.00 O ATOM 0 H TYR A 150 -14.765 5.275 0.257 1.00 0.00 H new ATOM 0 HA TYR A 150 -12.690 3.662 1.201 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -12.358 5.554 -0.270 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -12.960 6.663 0.946 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.310 4.073 0.387 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -11.464 7.664 2.460 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -8.132 4.078 1.585 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -9.247 7.742 3.577 1.00 0.00 H new ATOM 0 HH TYR A 150 -7.155 6.782 3.648 1.00 0.00 H new ATOM 472 N ARG A 151 -13.884 5.732 3.530 1.00 0.00 N ATOM 473 CA ARG A 151 -13.961 5.949 4.977 1.00 0.00 C ATOM 474 C ARG A 151 -14.670 4.801 5.718 1.00 0.00 C ATOM 475 O ARG A 151 -14.195 4.397 6.777 1.00 0.00 O ATOM 476 CB ARG A 151 -14.571 7.342 5.257 1.00 0.00 C ATOM 477 CG ARG A 151 -13.558 8.459 4.914 1.00 0.00 C ATOM 478 CD ARG A 151 -14.178 9.802 4.506 1.00 0.00 C ATOM 479 NE ARG A 151 -14.619 10.637 5.631 1.00 0.00 N ATOM 480 CZ ARG A 151 -15.046 11.905 5.529 1.00 0.00 C ATOM 481 NH1 ARG A 151 -15.169 12.515 4.354 1.00 0.00 N ATOM 482 NH2 ARG A 151 -15.359 12.579 6.631 1.00 0.00 N ATOM 0 H ARG A 151 -14.346 6.456 2.980 1.00 0.00 H new ATOM 0 HA ARG A 151 -12.951 5.940 5.386 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -15.478 7.473 4.667 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -14.859 7.415 6.306 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -12.915 8.622 5.779 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -12.919 8.111 4.103 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -13.449 10.361 3.919 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -15.032 9.611 3.856 1.00 0.00 H new ATOM 0 HE ARG A 151 -14.599 10.221 6.562 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -14.936 12.018 3.494 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -15.497 13.480 4.312 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -15.274 12.132 7.544 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -15.684 13.543 6.564 1.00 0.00 H new ATOM 496 N GLU A 152 -15.724 4.204 5.157 1.00 0.00 N ATOM 497 CA GLU A 152 -16.499 3.110 5.746 1.00 0.00 C ATOM 498 C GLU A 152 -15.665 1.853 5.984 1.00 0.00 C ATOM 499 O GLU A 152 -16.077 1.009 6.784 1.00 0.00 O ATOM 500 CB GLU A 152 -17.704 2.715 4.863 1.00 0.00 C ATOM 501 CG GLU A 152 -18.905 3.668 4.945 1.00 0.00 C ATOM 502 CD GLU A 152 -20.244 2.924 4.864 1.00 0.00 C ATOM 503 OE1 GLU A 152 -20.544 2.275 3.832 1.00 0.00 O ATOM 504 OE2 GLU A 152 -21.026 3.020 5.842 1.00 0.00 O ATOM 0 H GLU A 152 -16.076 4.482 4.241 1.00 0.00 H new ATOM 0 HA GLU A 152 -16.845 3.498 6.704 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -17.373 2.659 3.826 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -18.032 1.715 5.147 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -18.859 4.228 5.879 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -18.846 4.394 4.135 1.00 0.00 H new ATOM 511 N ASN A 153 -14.525 1.705 5.307 1.00 0.00 N ATOM 512 CA ASN A 153 -13.720 0.487 5.315 1.00 0.00 C ATOM 513 C ASN A 153 -12.258 0.800 5.630 1.00 0.00 C ATOM 514 O ASN A 153 -11.415 -0.085 5.495 1.00 0.00 O ATOM 515 CB ASN A 153 -13.822 -0.213 3.951 1.00 0.00 C ATOM 516 CG ASN A 153 -15.218 -0.694 3.586 1.00 0.00 C ATOM 517 OD1 ASN A 153 -15.669 -1.748 4.031 1.00 0.00 O ATOM 518 ND2 ASN A 153 -15.932 0.054 2.767 1.00 0.00 N ATOM 0 H ASN A 153 -14.129 2.445 4.727 1.00 0.00 H new ATOM 0 HA ASN A 153 -14.104 -0.173 6.093 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -13.476 0.474 3.179 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -13.145 -1.067 3.945 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -16.870 -0.240 2.495 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -15.546 0.926 2.405 1.00 0.00 H new ATOM 525 N MET A 154 -11.932 2.030 6.050 1.00 0.00 N ATOM 526 CA MET A 154 -10.558 2.516 6.212 1.00 0.00 C ATOM 527 C MET A 154 -9.691 1.604 7.093 1.00 0.00 C ATOM 528 O MET A 154 -8.470 1.562 6.940 1.00 0.00 O ATOM 529 CB MET A 154 -10.576 3.956 6.756 1.00 0.00 C ATOM 530 CG MET A 154 -11.184 4.053 8.171 1.00 0.00 C ATOM 531 SD MET A 154 -11.124 5.651 9.031 1.00 0.00 S ATOM 532 CE MET A 154 -11.638 6.797 7.732 1.00 0.00 C ATOM 0 H MET A 154 -12.634 2.730 6.292 1.00 0.00 H new ATOM 0 HA MET A 154 -10.094 2.504 5.226 1.00 0.00 H new ATOM 0 HB2 MET A 154 -9.558 4.345 6.776 1.00 0.00 H new ATOM 0 HB3 MET A 154 -11.146 4.589 6.076 1.00 0.00 H new ATOM 0 HG2 MET A 154 -12.229 3.751 8.104 1.00 0.00 H new ATOM 0 HG3 MET A 154 -10.680 3.319 8.800 1.00 0.00 H new ATOM 0 HE1 MET A 154 -11.559 7.821 8.098 1.00 0.00 H new ATOM 0 HE2 MET A 154 -10.994 6.672 6.861 1.00 0.00 H new ATOM 0 HE3 MET A 154 -12.671 6.590 7.452 1.00 0.00 H new ATOM 542 N TYR A 155 -10.326 0.894 8.023 1.00 0.00 N ATOM 543 CA TYR A 155 -9.716 -0.022 8.972 1.00 0.00 C ATOM 544 C TYR A 155 -9.383 -1.372 8.322 1.00 0.00 C ATOM 545 O TYR A 155 -8.429 -2.025 8.731 1.00 0.00 O ATOM 546 CB TYR A 155 -10.660 -0.206 10.184 1.00 0.00 C ATOM 547 CG TYR A 155 -12.085 0.307 10.012 1.00 0.00 C ATOM 548 CD1 TYR A 155 -12.370 1.661 10.269 1.00 0.00 C ATOM 549 CD2 TYR A 155 -13.106 -0.537 9.538 1.00 0.00 C ATOM 550 CE1 TYR A 155 -13.656 2.174 10.038 1.00 0.00 C ATOM 551 CE2 TYR A 155 -14.401 -0.035 9.322 1.00 0.00 C ATOM 552 CZ TYR A 155 -14.681 1.324 9.582 1.00 0.00 C ATOM 553 OH TYR A 155 -15.933 1.821 9.405 1.00 0.00 O ATOM 0 H TYR A 155 -11.338 0.949 8.137 1.00 0.00 H new ATOM 0 HA TYR A 155 -8.773 0.405 9.312 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -10.705 -1.268 10.425 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -10.216 0.297 11.043 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -11.594 2.310 10.647 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -12.893 -1.577 9.339 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -13.859 3.221 10.210 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -15.180 -0.688 8.958 1.00 0.00 H new ATOM 0 HH TYR A 155 -16.234 1.632 8.492 1.00 0.00 H new ATOM 563 N ARG A 156 -10.152 -1.820 7.326 1.00 0.00 N ATOM 564 CA ARG A 156 -10.026 -3.167 6.761 1.00 0.00 C ATOM 565 C ARG A 156 -8.815 -3.267 5.831 1.00 0.00 C ATOM 566 O ARG A 156 -8.234 -4.348 5.722 1.00 0.00 O ATOM 567 CB ARG A 156 -11.324 -3.553 6.027 1.00 0.00 C ATOM 568 CG ARG A 156 -12.536 -3.586 6.980 1.00 0.00 C ATOM 569 CD ARG A 156 -13.876 -3.691 6.247 1.00 0.00 C ATOM 570 NE ARG A 156 -14.071 -5.010 5.640 1.00 0.00 N ATOM 571 CZ ARG A 156 -14.871 -5.998 6.053 1.00 0.00 C ATOM 572 NH1 ARG A 156 -15.583 -5.897 7.168 1.00 0.00 N ATOM 573 NH2 ARG A 156 -14.951 -7.100 5.324 1.00 0.00 N ATOM 0 H ARG A 156 -10.881 -1.258 6.887 1.00 0.00 H new ATOM 0 HA ARG A 156 -9.866 -3.871 7.577 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -11.513 -2.840 5.224 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -11.201 -4.531 5.562 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -12.433 -4.432 7.659 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -12.534 -2.684 7.592 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -14.688 -3.491 6.946 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -13.926 -2.925 5.473 1.00 0.00 H new ATOM 0 HE ARG A 156 -13.529 -5.198 4.797 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -15.528 -5.050 7.733 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -16.186 -6.667 7.460 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -14.408 -7.184 4.465 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -15.556 -7.866 5.622 1.00 0.00 H new ATOM 587 N TYR A 157 -8.433 -2.163 5.185 1.00 0.00 N ATOM 588 CA TYR A 157 -7.289 -2.066 4.279 1.00 0.00 C ATOM 589 C TYR A 157 -5.968 -2.398 4.989 1.00 0.00 C ATOM 590 O TYR A 157 -5.912 -2.319 6.223 1.00 0.00 O ATOM 591 CB TYR A 157 -7.252 -0.631 3.731 1.00 0.00 C ATOM 592 CG TYR A 157 -8.496 -0.191 2.981 1.00 0.00 C ATOM 593 CD1 TYR A 157 -9.156 -1.076 2.104 1.00 0.00 C ATOM 594 CD2 TYR A 157 -9.001 1.110 3.174 1.00 0.00 C ATOM 595 CE1 TYR A 157 -10.348 -0.689 1.479 1.00 0.00 C ATOM 596 CE2 TYR A 157 -10.193 1.510 2.544 1.00 0.00 C ATOM 597 CZ TYR A 157 -10.884 0.598 1.710 1.00 0.00 C ATOM 598 OH TYR A 157 -12.072 0.945 1.143 1.00 0.00 O ATOM 0 H TYR A 157 -8.932 -1.279 5.283 1.00 0.00 H new ATOM 0 HA TYR A 157 -7.402 -2.791 3.473 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -7.088 0.054 4.563 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -6.394 -0.536 3.066 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -8.741 -2.055 1.914 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -8.470 1.804 3.809 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -10.858 -1.375 0.819 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -10.579 2.507 2.695 1.00 0.00 H new ATOM 0 HH TYR A 157 -12.629 0.146 1.036 1.00 0.00 H new ATOM 608 N PRO A 158 -4.886 -2.749 4.266 1.00 0.00 N ATOM 609 CA PRO A 158 -3.614 -3.042 4.910 1.00 0.00 C ATOM 610 C PRO A 158 -3.023 -1.754 5.476 1.00 0.00 C ATOM 611 O PRO A 158 -3.296 -0.653 4.986 1.00 0.00 O ATOM 612 CB PRO A 158 -2.711 -3.644 3.831 1.00 0.00 C ATOM 613 CG PRO A 158 -3.293 -3.135 2.513 1.00 0.00 C ATOM 614 CD PRO A 158 -4.751 -2.790 2.814 1.00 0.00 C ATOM 0 HA PRO A 158 -3.725 -3.739 5.740 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -1.676 -3.325 3.957 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -2.716 -4.733 3.872 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.749 -2.261 2.156 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -3.223 -3.894 1.734 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -5.019 -1.829 2.374 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -5.421 -3.535 2.385 1.00 0.00 H new ATOM 622 N ASN A 159 -2.169 -1.892 6.483 1.00 0.00 N ATOM 623 CA ASN A 159 -1.404 -0.785 7.037 1.00 0.00 C ATOM 624 C ASN A 159 0.029 -0.828 6.519 1.00 0.00 C ATOM 625 O ASN A 159 0.647 0.227 6.427 1.00 0.00 O ATOM 626 CB ASN A 159 -1.339 -0.884 8.558 1.00 0.00 C ATOM 627 CG ASN A 159 -2.657 -0.680 9.270 1.00 0.00 C ATOM 628 OD1 ASN A 159 -3.478 -1.582 9.380 1.00 0.00 O ATOM 629 ND2 ASN A 159 -2.856 0.480 9.858 1.00 0.00 N ATOM 0 H ASN A 159 -1.987 -2.785 6.941 1.00 0.00 H new ATOM 0 HA ASN A 159 -1.899 0.139 6.738 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -0.947 -1.865 8.826 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -0.627 -0.145 8.925 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -3.699 0.634 10.411 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -2.167 1.226 9.761 1.00 0.00 H new ATOM 636 N GLN A 160 0.589 -2.016 6.258 1.00 0.00 N ATOM 637 CA GLN A 160 2.009 -2.186 5.966 1.00 0.00 C ATOM 638 C GLN A 160 2.168 -2.391 4.466 1.00 0.00 C ATOM 639 O GLN A 160 1.288 -2.985 3.834 1.00 0.00 O ATOM 640 CB GLN A 160 2.558 -3.429 6.697 1.00 0.00 C ATOM 641 CG GLN A 160 2.380 -3.447 8.217 1.00 0.00 C ATOM 642 CD GLN A 160 3.055 -4.638 8.892 1.00 0.00 C ATOM 643 OE1 GLN A 160 2.398 -5.562 9.370 1.00 0.00 O ATOM 644 NE2 GLN A 160 4.373 -4.616 8.976 1.00 0.00 N ATOM 0 H GLN A 160 0.062 -2.889 6.245 1.00 0.00 H new ATOM 0 HA GLN A 160 2.557 -1.305 6.299 1.00 0.00 H new ATOM 0 HB2 GLN A 160 2.072 -4.313 6.284 1.00 0.00 H new ATOM 0 HB3 GLN A 160 3.621 -3.516 6.475 1.00 0.00 H new ATOM 0 HG2 GLN A 160 2.785 -2.525 8.634 1.00 0.00 H new ATOM 0 HG3 GLN A 160 1.315 -3.462 8.451 1.00 0.00 H new ATOM 0 HE21 GLN A 160 4.897 -3.840 8.572 1.00 0.00 H new ATOM 0 HE22 GLN A 160 4.867 -5.376 9.445 1.00 0.00 H new ATOM 653 N VAL A 161 3.314 -1.996 3.914 1.00 0.00 N ATOM 654 CA VAL A 161 3.619 -2.179 2.493 1.00 0.00 C ATOM 655 C VAL A 161 5.006 -2.805 2.329 1.00 0.00 C ATOM 656 O VAL A 161 5.894 -2.555 3.146 1.00 0.00 O ATOM 657 CB VAL A 161 3.489 -0.842 1.738 1.00 0.00 C ATOM 658 CG1 VAL A 161 2.081 -0.244 1.831 1.00 0.00 C ATOM 659 CG2 VAL A 161 4.478 0.217 2.231 1.00 0.00 C ATOM 0 H VAL A 161 4.060 -1.539 4.439 1.00 0.00 H new ATOM 0 HA VAL A 161 2.896 -2.866 2.054 1.00 0.00 H new ATOM 0 HB VAL A 161 3.712 -1.097 0.702 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.048 0.697 1.281 1.00 0.00 H new ATOM 0 HG12 VAL A 161 1.361 -0.941 1.402 1.00 0.00 H new ATOM 0 HG13 VAL A 161 1.831 -0.062 2.876 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.340 1.137 1.663 1.00 0.00 H new ATOM 0 HG22 VAL A 161 4.303 0.414 3.289 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.497 -0.145 2.093 1.00 0.00 H new ATOM 669 N TYR A 162 5.194 -3.624 1.293 1.00 0.00 N ATOM 670 CA TYR A 162 6.491 -4.220 0.969 1.00 0.00 C ATOM 671 C TYR A 162 7.296 -3.302 0.045 1.00 0.00 C ATOM 672 O TYR A 162 6.720 -2.434 -0.613 1.00 0.00 O ATOM 673 CB TYR A 162 6.274 -5.574 0.286 1.00 0.00 C ATOM 674 CG TYR A 162 5.681 -6.655 1.171 1.00 0.00 C ATOM 675 CD1 TYR A 162 6.527 -7.439 1.973 1.00 0.00 C ATOM 676 CD2 TYR A 162 4.292 -6.864 1.229 1.00 0.00 C ATOM 677 CE1 TYR A 162 5.998 -8.364 2.888 1.00 0.00 C ATOM 678 CE2 TYR A 162 3.753 -7.809 2.115 1.00 0.00 C ATOM 679 CZ TYR A 162 4.601 -8.540 2.979 1.00 0.00 C ATOM 680 OH TYR A 162 4.081 -9.335 3.956 1.00 0.00 O ATOM 0 H TYR A 162 4.448 -3.894 0.652 1.00 0.00 H new ATOM 0 HA TYR A 162 7.052 -4.357 1.894 1.00 0.00 H new ATOM 0 HB2 TYR A 162 5.618 -5.429 -0.573 1.00 0.00 H new ATOM 0 HB3 TYR A 162 7.231 -5.926 -0.099 1.00 0.00 H new ATOM 0 HD1 TYR A 162 7.598 -7.329 1.885 1.00 0.00 H new ATOM 0 HD2 TYR A 162 3.636 -6.294 0.588 1.00 0.00 H new ATOM 0 HE1 TYR A 162 6.659 -8.939 3.520 1.00 0.00 H new ATOM 0 HE2 TYR A 162 2.687 -7.979 2.137 1.00 0.00 H new ATOM 0 HH TYR A 162 3.104 -9.349 3.881 1.00 0.00 H new ATOM 690 N TYR A 163 8.607 -3.526 -0.080 1.00 0.00 N ATOM 691 CA TYR A 163 9.444 -2.873 -1.082 1.00 0.00 C ATOM 692 C TYR A 163 10.639 -3.765 -1.420 1.00 0.00 C ATOM 693 O TYR A 163 11.032 -4.606 -0.614 1.00 0.00 O ATOM 694 CB TYR A 163 9.904 -1.492 -0.574 1.00 0.00 C ATOM 695 CG TYR A 163 10.547 -1.426 0.805 1.00 0.00 C ATOM 696 CD1 TYR A 163 9.757 -1.403 1.976 1.00 0.00 C ATOM 697 CD2 TYR A 163 11.947 -1.345 0.913 1.00 0.00 C ATOM 698 CE1 TYR A 163 10.371 -1.365 3.244 1.00 0.00 C ATOM 699 CE2 TYR A 163 12.563 -1.301 2.174 1.00 0.00 C ATOM 700 CZ TYR A 163 11.781 -1.334 3.346 1.00 0.00 C ATOM 701 OH TYR A 163 12.379 -1.338 4.570 1.00 0.00 O ATOM 0 H TYR A 163 9.119 -4.173 0.519 1.00 0.00 H new ATOM 0 HA TYR A 163 8.864 -2.719 -1.992 1.00 0.00 H new ATOM 0 HB2 TYR A 163 10.614 -1.088 -1.295 1.00 0.00 H new ATOM 0 HB3 TYR A 163 9.039 -0.829 -0.573 1.00 0.00 H new ATOM 0 HD1 TYR A 163 8.680 -1.415 1.899 1.00 0.00 H new ATOM 0 HD2 TYR A 163 12.553 -1.316 0.019 1.00 0.00 H new ATOM 0 HE1 TYR A 163 9.765 -1.360 4.138 1.00 0.00 H new ATOM 0 HE2 TYR A 163 13.639 -1.242 2.246 1.00 0.00 H new ATOM 0 HH TYR A 163 13.352 -1.315 4.459 1.00 0.00 H new ATOM 711 N ARG A 164 11.266 -3.569 -2.582 1.00 0.00 N ATOM 712 CA ARG A 164 12.686 -3.886 -2.746 1.00 0.00 C ATOM 713 C ARG A 164 13.475 -2.620 -2.422 1.00 0.00 C ATOM 714 O ARG A 164 12.906 -1.527 -2.494 1.00 0.00 O ATOM 715 CB ARG A 164 12.981 -4.362 -4.175 1.00 0.00 C ATOM 716 CG ARG A 164 12.427 -5.772 -4.421 1.00 0.00 C ATOM 717 CD ARG A 164 13.200 -6.531 -5.511 1.00 0.00 C ATOM 718 NE ARG A 164 12.425 -6.689 -6.746 1.00 0.00 N ATOM 719 CZ ARG A 164 12.657 -7.599 -7.696 1.00 0.00 C ATOM 720 NH1 ARG A 164 13.730 -8.386 -7.644 1.00 0.00 N ATOM 721 NH2 ARG A 164 11.794 -7.728 -8.693 1.00 0.00 N ATOM 0 H ARG A 164 10.817 -3.195 -3.418 1.00 0.00 H new ATOM 0 HA ARG A 164 12.973 -4.697 -2.077 1.00 0.00 H new ATOM 0 HB2 ARG A 164 12.541 -3.667 -4.890 1.00 0.00 H new ATOM 0 HB3 ARG A 164 14.057 -4.357 -4.347 1.00 0.00 H new ATOM 0 HG2 ARG A 164 12.465 -6.340 -3.492 1.00 0.00 H new ATOM 0 HG3 ARG A 164 11.378 -5.701 -4.708 1.00 0.00 H new ATOM 0 HD2 ARG A 164 14.125 -5.999 -5.733 1.00 0.00 H new ATOM 0 HD3 ARG A 164 13.481 -7.515 -5.134 1.00 0.00 H new ATOM 0 HE ARG A 164 11.643 -6.050 -6.892 1.00 0.00 H new ATOM 0 HH11 ARG A 164 14.389 -8.299 -6.871 1.00 0.00 H new ATOM 0 HH12 ARG A 164 13.893 -9.076 -8.378 1.00 0.00 H new ATOM 0 HH21 ARG A 164 10.964 -7.136 -8.729 1.00 0.00 H new ATOM 0 HH22 ARG A 164 11.960 -8.419 -9.425 1.00 0.00 H new ATOM 735 N PRO A 165 14.761 -2.722 -2.059 1.00 0.00 N ATOM 736 CA PRO A 165 15.529 -1.540 -1.710 1.00 0.00 C ATOM 737 C PRO A 165 15.717 -0.646 -2.936 1.00 0.00 C ATOM 738 O PRO A 165 15.674 -1.102 -4.087 1.00 0.00 O ATOM 739 CB PRO A 165 16.858 -2.057 -1.155 1.00 0.00 C ATOM 740 CG PRO A 165 17.009 -3.425 -1.813 1.00 0.00 C ATOM 741 CD PRO A 165 15.569 -3.925 -1.928 1.00 0.00 C ATOM 0 HA PRO A 165 15.024 -0.921 -0.968 1.00 0.00 H new ATOM 0 HB2 PRO A 165 17.685 -1.395 -1.411 1.00 0.00 H new ATOM 0 HB3 PRO A 165 16.836 -2.134 -0.068 1.00 0.00 H new ATOM 0 HG2 PRO A 165 17.487 -3.350 -2.790 1.00 0.00 H new ATOM 0 HG3 PRO A 165 17.620 -4.096 -1.209 1.00 0.00 H new ATOM 0 HD2 PRO A 165 15.446 -4.579 -2.792 1.00 0.00 H new ATOM 0 HD3 PRO A 165 15.280 -4.501 -1.049 1.00 0.00 H new ATOM 749 N VAL A 166 15.963 0.638 -2.683 1.00 0.00 N ATOM 750 CA VAL A 166 16.408 1.580 -3.689 1.00 0.00 C ATOM 751 C VAL A 166 17.864 1.279 -3.979 1.00 0.00 C ATOM 752 O VAL A 166 18.753 1.783 -3.290 1.00 0.00 O ATOM 753 CB VAL A 166 16.203 3.045 -3.249 1.00 0.00 C ATOM 754 CG1 VAL A 166 14.849 3.509 -3.757 1.00 0.00 C ATOM 755 CG2 VAL A 166 16.238 3.301 -1.739 1.00 0.00 C ATOM 0 H VAL A 166 15.855 1.052 -1.757 1.00 0.00 H new ATOM 0 HA VAL A 166 15.810 1.465 -4.593 1.00 0.00 H new ATOM 0 HB VAL A 166 17.047 3.592 -3.669 1.00 0.00 H new ATOM 0 HG11 VAL A 166 14.683 4.544 -3.457 1.00 0.00 H new ATOM 0 HG12 VAL A 166 14.825 3.438 -4.844 1.00 0.00 H new ATOM 0 HG13 VAL A 166 14.066 2.879 -3.335 1.00 0.00 H new ATOM 0 HG21 VAL A 166 16.083 4.363 -1.546 1.00 0.00 H new ATOM 0 HG22 VAL A 166 15.450 2.725 -1.254 1.00 0.00 H new ATOM 0 HG23 VAL A 166 17.206 2.997 -1.341 1.00 0.00 H new ATOM 765 N ASP A 167 18.101 0.472 -5.005 1.00 0.00 N ATOM 766 CA ASP A 167 19.416 0.392 -5.614 1.00 0.00 C ATOM 767 C ASP A 167 19.277 0.244 -7.118 1.00 0.00 C ATOM 768 O ASP A 167 19.908 1.005 -7.847 1.00 0.00 O ATOM 769 CB ASP A 167 20.253 -0.759 -5.028 1.00 0.00 C ATOM 770 CG ASP A 167 21.310 -0.298 -4.031 1.00 0.00 C ATOM 771 OD1 ASP A 167 22.050 0.664 -4.335 1.00 0.00 O ATOM 772 OD2 ASP A 167 21.438 -0.957 -2.974 1.00 0.00 O ATOM 0 H ASP A 167 17.399 -0.134 -5.430 1.00 0.00 H new ATOM 0 HA ASP A 167 19.947 1.317 -5.391 1.00 0.00 H new ATOM 0 HB2 ASP A 167 19.587 -1.468 -4.537 1.00 0.00 H new ATOM 0 HB3 ASP A 167 20.742 -1.293 -5.843 1.00 0.00 H new ATOM 777 N GLN A 168 18.467 -0.714 -7.590 1.00 0.00 N ATOM 778 CA GLN A 168 18.196 -0.865 -9.013 1.00 0.00 C ATOM 779 C GLN A 168 16.960 -0.021 -9.336 1.00 0.00 C ATOM 780 O GLN A 168 17.051 0.987 -10.036 1.00 0.00 O ATOM 781 CB GLN A 168 17.997 -2.346 -9.411 1.00 0.00 C ATOM 782 CG GLN A 168 19.265 -3.226 -9.438 1.00 0.00 C ATOM 783 CD GLN A 168 19.533 -3.940 -8.111 1.00 0.00 C ATOM 784 OE1 GLN A 168 20.299 -3.367 -7.201 1.00 0.00 O flip ATOM 785 NE2 GLN A 168 19.048 -5.042 -7.874 1.00 0.00 N flip ATOM 0 H GLN A 168 17.990 -1.395 -6.999 1.00 0.00 H new ATOM 0 HA GLN A 168 19.052 -0.520 -9.593 1.00 0.00 H new ATOM 0 HB2 GLN A 168 17.285 -2.794 -8.717 1.00 0.00 H new ATOM 0 HB3 GLN A 168 17.540 -2.375 -10.400 1.00 0.00 H new ATOM 0 HG2 GLN A 168 19.167 -3.969 -10.229 1.00 0.00 H new ATOM 0 HG3 GLN A 168 20.125 -2.605 -9.689 1.00 0.00 H new ATOM 0 HE21 GLN A 168 18.454 -5.498 -8.567 1.00 0.00 H new ATOM 0 HE22 GLN A 168 19.239 -5.502 -6.984 1.00 0.00 H new ATOM 794 N ALA A 169 15.790 -0.429 -8.837 1.00 0.00 N ATOM 795 CA ALA A 169 14.491 0.057 -9.308 1.00 0.00 C ATOM 796 C ALA A 169 14.041 1.332 -8.570 1.00 0.00 C ATOM 797 O ALA A 169 12.939 1.404 -8.016 1.00 0.00 O ATOM 798 CB ALA A 169 13.476 -1.086 -9.227 1.00 0.00 C ATOM 0 H ALA A 169 15.718 -1.115 -8.085 1.00 0.00 H new ATOM 0 HA ALA A 169 14.574 0.363 -10.351 1.00 0.00 H new ATOM 0 HB1 ALA A 169 12.505 -0.735 -9.575 1.00 0.00 H new ATOM 0 HB2 ALA A 169 13.809 -1.913 -9.853 1.00 0.00 H new ATOM 0 HB3 ALA A 169 13.391 -1.424 -8.194 1.00 0.00 H new ATOM 804 N SER A 170 14.905 2.340 -8.526 1.00 0.00 N ATOM 805 CA SER A 170 14.696 3.639 -7.914 1.00 0.00 C ATOM 806 C SER A 170 13.938 4.578 -8.862 1.00 0.00 C ATOM 807 O SER A 170 14.532 5.385 -9.578 1.00 0.00 O ATOM 808 CB SER A 170 16.059 4.194 -7.473 1.00 0.00 C ATOM 809 OG SER A 170 17.101 3.846 -8.371 1.00 0.00 O ATOM 0 H SER A 170 15.831 2.262 -8.946 1.00 0.00 H new ATOM 0 HA SER A 170 14.065 3.547 -7.030 1.00 0.00 H new ATOM 0 HB2 SER A 170 15.998 5.279 -7.395 1.00 0.00 H new ATOM 0 HB3 SER A 170 16.298 3.816 -6.479 1.00 0.00 H new ATOM 0 HG SER A 170 17.948 4.221 -8.051 1.00 0.00 H new ATOM 815 N ASN A 171 12.608 4.489 -8.862 1.00 0.00 N ATOM 816 CA ASN A 171 11.711 5.516 -9.390 1.00 0.00 C ATOM 817 C ASN A 171 10.459 5.549 -8.530 1.00 0.00 C ATOM 818 O ASN A 171 10.114 4.547 -7.909 1.00 0.00 O ATOM 819 CB ASN A 171 11.230 5.180 -10.800 1.00 0.00 C ATOM 820 CG ASN A 171 12.193 5.516 -11.919 1.00 0.00 C ATOM 821 OD1 ASN A 171 12.720 6.619 -12.012 1.00 0.00 O ATOM 822 ND2 ASN A 171 12.337 4.607 -12.860 1.00 0.00 N ATOM 0 H ASN A 171 12.113 3.681 -8.485 1.00 0.00 H new ATOM 0 HA ASN A 171 12.260 6.457 -9.394 1.00 0.00 H new ATOM 0 HB2 ASN A 171 11.008 4.114 -10.844 1.00 0.00 H new ATOM 0 HB3 ASN A 171 10.294 5.708 -10.980 1.00 0.00 H new ATOM 0 HD21 ASN A 171 12.896 4.814 -13.688 1.00 0.00 H new ATOM 0 HD22 ASN A 171 11.889 3.696 -12.762 1.00 0.00 H new ATOM 829 N GLN A 172 9.676 6.620 -8.639 1.00 0.00 N ATOM 830 CA GLN A 172 8.428 6.792 -7.898 1.00 0.00 C ATOM 831 C GLN A 172 7.238 6.254 -8.705 1.00 0.00 C ATOM 832 O GLN A 172 6.122 6.220 -8.199 1.00 0.00 O ATOM 833 CB GLN A 172 8.267 8.262 -7.458 1.00 0.00 C ATOM 834 CG GLN A 172 7.176 8.452 -6.378 1.00 0.00 C ATOM 835 CD GLN A 172 7.314 9.758 -5.583 1.00 0.00 C ATOM 836 OE1 GLN A 172 8.365 10.088 -5.043 1.00 0.00 O ATOM 837 NE2 GLN A 172 6.250 10.534 -5.459 1.00 0.00 N ATOM 0 H GLN A 172 9.894 7.404 -9.254 1.00 0.00 H new ATOM 0 HA GLN A 172 8.459 6.199 -6.984 1.00 0.00 H new ATOM 0 HB2 GLN A 172 9.219 8.627 -7.073 1.00 0.00 H new ATOM 0 HB3 GLN A 172 8.020 8.871 -8.328 1.00 0.00 H new ATOM 0 HG2 GLN A 172 6.197 8.430 -6.856 1.00 0.00 H new ATOM 0 HG3 GLN A 172 7.212 7.611 -5.686 1.00 0.00 H new ATOM 0 HE21 GLN A 172 5.371 10.269 -5.904 1.00 0.00 H new ATOM 0 HE22 GLN A 172 6.308 11.397 -4.919 1.00 0.00 H new ATOM 846 N ASN A 173 7.445 5.777 -9.938 1.00 0.00 N ATOM 847 CA ASN A 173 6.472 4.953 -10.616 1.00 0.00 C ATOM 848 C ASN A 173 6.663 3.510 -10.180 1.00 0.00 C ATOM 849 O ASN A 173 5.741 2.922 -9.639 1.00 0.00 O ATOM 850 CB ASN A 173 6.667 5.050 -12.120 1.00 0.00 C ATOM 851 CG ASN A 173 5.643 4.211 -12.845 1.00 0.00 C ATOM 852 OD1 ASN A 173 4.573 4.687 -13.197 1.00 0.00 O ATOM 853 ND2 ASN A 173 5.967 2.971 -13.143 1.00 0.00 N ATOM 0 H ASN A 173 8.290 5.957 -10.480 1.00 0.00 H new ATOM 0 HA ASN A 173 5.468 5.294 -10.364 1.00 0.00 H new ATOM 0 HB2 ASN A 173 6.583 6.090 -12.436 1.00 0.00 H new ATOM 0 HB3 ASN A 173 7.671 4.717 -12.384 1.00 0.00 H new ATOM 0 HD21 ASN A 173 5.321 2.389 -13.676 1.00 0.00 H new ATOM 0 HD22 ASN A 173 6.864 2.592 -12.841 1.00 0.00 H new ATOM 860 N ASN A 174 7.831 2.909 -10.445 1.00 0.00 N ATOM 861 CA ASN A 174 7.926 1.451 -10.493 1.00 0.00 C ATOM 862 C ASN A 174 8.217 0.791 -9.165 1.00 0.00 C ATOM 863 O ASN A 174 7.824 -0.353 -8.951 1.00 0.00 O ATOM 864 CB ASN A 174 8.946 1.002 -11.524 1.00 0.00 C ATOM 865 CG ASN A 174 10.305 1.661 -11.547 1.00 0.00 C ATOM 866 OD1 ASN A 174 10.562 2.414 -12.479 1.00 0.00 O ATOM 867 ND2 ASN A 174 11.178 1.447 -10.582 1.00 0.00 N ATOM 0 H ASN A 174 8.705 3.402 -10.626 1.00 0.00 H new ATOM 0 HA ASN A 174 6.929 1.121 -10.783 1.00 0.00 H new ATOM 0 HB2 ASN A 174 9.102 -0.068 -11.388 1.00 0.00 H new ATOM 0 HB3 ASN A 174 8.499 1.136 -12.509 1.00 0.00 H new ATOM 0 HD21 ASN A 174 12.086 1.912 -10.603 1.00 0.00 H new ATOM 0 HD22 ASN A 174 10.946 0.817 -9.815 1.00 0.00 H new ATOM 874 N PHE A 175 8.868 1.519 -8.271 1.00 0.00 N ATOM 875 CA PHE A 175 8.870 1.158 -6.855 1.00 0.00 C ATOM 876 C PHE A 175 7.418 1.091 -6.372 1.00 0.00 C ATOM 877 O PHE A 175 6.983 0.099 -5.796 1.00 0.00 O ATOM 878 CB PHE A 175 9.722 2.153 -6.048 1.00 0.00 C ATOM 879 CG PHE A 175 9.896 1.853 -4.571 1.00 0.00 C ATOM 880 CD1 PHE A 175 8.835 2.094 -3.676 1.00 0.00 C ATOM 881 CD2 PHE A 175 11.153 1.466 -4.064 1.00 0.00 C ATOM 882 CE1 PHE A 175 9.033 1.983 -2.291 1.00 0.00 C ATOM 883 CE2 PHE A 175 11.346 1.342 -2.677 1.00 0.00 C ATOM 884 CZ PHE A 175 10.291 1.612 -1.788 1.00 0.00 C ATOM 0 H PHE A 175 9.400 2.360 -8.495 1.00 0.00 H new ATOM 0 HA PHE A 175 9.326 0.179 -6.706 1.00 0.00 H new ATOM 0 HB2 PHE A 175 10.710 2.204 -6.504 1.00 0.00 H new ATOM 0 HB3 PHE A 175 9.275 3.142 -6.145 1.00 0.00 H new ATOM 0 HD1 PHE A 175 7.862 2.366 -4.058 1.00 0.00 H new ATOM 0 HD2 PHE A 175 11.969 1.264 -4.742 1.00 0.00 H new ATOM 0 HE1 PHE A 175 8.218 2.183 -1.612 1.00 0.00 H new ATOM 0 HE2 PHE A 175 12.309 1.038 -2.293 1.00 0.00 H new ATOM 0 HZ PHE A 175 10.447 1.534 -0.722 1.00 0.00 H new ATOM 894 N VAL A 176 6.658 2.149 -6.642 1.00 0.00 N ATOM 895 CA VAL A 176 5.308 2.359 -6.150 1.00 0.00 C ATOM 896 C VAL A 176 4.319 1.359 -6.773 1.00 0.00 C ATOM 897 O VAL A 176 3.529 0.772 -6.041 1.00 0.00 O ATOM 898 CB VAL A 176 4.977 3.849 -6.376 1.00 0.00 C ATOM 899 CG1 VAL A 176 3.545 4.251 -6.012 1.00 0.00 C ATOM 900 CG2 VAL A 176 5.917 4.719 -5.512 1.00 0.00 C ATOM 0 H VAL A 176 6.984 2.913 -7.235 1.00 0.00 H new ATOM 0 HA VAL A 176 5.221 2.154 -5.083 1.00 0.00 H new ATOM 0 HB VAL A 176 5.104 4.008 -7.447 1.00 0.00 H new ATOM 0 HG11 VAL A 176 3.406 5.315 -6.204 1.00 0.00 H new ATOM 0 HG12 VAL A 176 2.842 3.678 -6.616 1.00 0.00 H new ATOM 0 HG13 VAL A 176 3.367 4.047 -4.956 1.00 0.00 H new ATOM 0 HG21 VAL A 176 5.685 5.772 -5.670 1.00 0.00 H new ATOM 0 HG22 VAL A 176 5.778 4.471 -4.460 1.00 0.00 H new ATOM 0 HG23 VAL A 176 6.952 4.529 -5.796 1.00 0.00 H new ATOM 910 N HIS A 177 4.362 1.118 -8.086 1.00 0.00 N ATOM 911 CA HIS A 177 3.477 0.185 -8.775 1.00 0.00 C ATOM 912 C HIS A 177 3.749 -1.233 -8.269 1.00 0.00 C ATOM 913 O HIS A 177 2.827 -1.899 -7.809 1.00 0.00 O ATOM 914 CB HIS A 177 3.647 0.315 -10.302 1.00 0.00 C ATOM 915 CG HIS A 177 2.616 -0.404 -11.156 1.00 0.00 C ATOM 916 ND1 HIS A 177 1.794 -1.438 -10.792 1.00 0.00 N flip ATOM 917 CD2 HIS A 177 2.343 -0.137 -12.483 1.00 0.00 C flip ATOM 918 CE1 HIS A 177 1.024 -1.794 -11.899 1.00 0.00 C flip ATOM 919 NE2 HIS A 177 1.382 -0.977 -12.900 1.00 0.00 N flip ATOM 0 H HIS A 177 5.027 1.577 -8.709 1.00 0.00 H new ATOM 0 HA HIS A 177 2.436 0.421 -8.557 1.00 0.00 H new ATOM 0 HB2 HIS A 177 3.627 1.374 -10.560 1.00 0.00 H new ATOM 0 HB3 HIS A 177 4.635 -0.060 -10.570 1.00 0.00 H new ATOM 0 HD2 HIS A 177 2.822 0.621 -13.085 1.00 0.00 H new ATOM 0 HE1 HIS A 177 0.282 -2.577 -11.942 1.00 0.00 H new ATOM 0 HE2 HIS A 177 0.984 -0.991 -13.839 1.00 0.00 H new ATOM 927 N ASP A 178 4.997 -1.704 -8.321 1.00 0.00 N ATOM 928 CA ASP A 178 5.374 -3.030 -7.821 1.00 0.00 C ATOM 929 C ASP A 178 4.958 -3.204 -6.362 1.00 0.00 C ATOM 930 O ASP A 178 4.471 -4.264 -5.991 1.00 0.00 O ATOM 931 CB ASP A 178 6.883 -3.243 -7.962 1.00 0.00 C ATOM 932 CG ASP A 178 7.315 -4.687 -7.728 1.00 0.00 C ATOM 933 OD1 ASP A 178 7.035 -5.553 -8.588 1.00 0.00 O ATOM 934 OD2 ASP A 178 8.061 -4.930 -6.750 1.00 0.00 O ATOM 0 H ASP A 178 5.777 -1.176 -8.712 1.00 0.00 H new ATOM 0 HA ASP A 178 4.851 -3.776 -8.419 1.00 0.00 H new ATOM 0 HB2 ASP A 178 7.194 -2.936 -8.960 1.00 0.00 H new ATOM 0 HB3 ASP A 178 7.401 -2.597 -7.254 1.00 0.00 H new ATOM 939 N CYS A 179 5.107 -2.160 -5.546 1.00 0.00 N ATOM 940 CA CYS A 179 4.645 -2.106 -4.162 1.00 0.00 C ATOM 941 C CYS A 179 3.122 -2.266 -4.038 1.00 0.00 C ATOM 942 O CYS A 179 2.667 -3.006 -3.164 1.00 0.00 O ATOM 943 CB CYS A 179 5.127 -0.796 -3.539 1.00 0.00 C ATOM 944 SG CYS A 179 4.571 -0.472 -1.859 1.00 0.00 S ATOM 0 H CYS A 179 5.569 -1.300 -5.842 1.00 0.00 H new ATOM 0 HA CYS A 179 5.069 -2.951 -3.620 1.00 0.00 H new ATOM 0 HB2 CYS A 179 6.217 -0.792 -3.547 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.800 0.027 -4.174 1.00 0.00 H new ATOM 949 N VAL A 180 2.338 -1.596 -4.885 1.00 0.00 N ATOM 950 CA VAL A 180 0.885 -1.721 -4.966 1.00 0.00 C ATOM 951 C VAL A 180 0.527 -3.158 -5.351 1.00 0.00 C ATOM 952 O VAL A 180 -0.074 -3.853 -4.532 1.00 0.00 O ATOM 953 CB VAL A 180 0.326 -0.602 -5.879 1.00 0.00 C ATOM 954 CG1 VAL A 180 -1.105 -0.839 -6.374 1.00 0.00 C ATOM 955 CG2 VAL A 180 0.352 0.730 -5.110 1.00 0.00 C ATOM 0 H VAL A 180 2.714 -0.927 -5.557 1.00 0.00 H new ATOM 0 HA VAL A 180 0.396 -1.561 -4.005 1.00 0.00 H new ATOM 0 HB VAL A 180 0.966 -0.589 -6.761 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.414 -0.006 -7.006 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -1.143 -1.764 -6.949 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.778 -0.915 -5.520 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -0.040 1.524 -5.745 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -0.263 0.645 -4.214 1.00 0.00 H new ATOM 0 HG23 VAL A 180 1.377 0.966 -4.825 1.00 0.00 H new ATOM 965 N ASN A 181 0.957 -3.615 -6.536 1.00 0.00 N ATOM 966 CA ASN A 181 0.831 -4.981 -7.049 1.00 0.00 C ATOM 967 C ASN A 181 1.080 -5.982 -5.942 1.00 0.00 C ATOM 968 O ASN A 181 0.264 -6.882 -5.754 1.00 0.00 O ATOM 969 CB ASN A 181 1.860 -5.281 -8.159 1.00 0.00 C ATOM 970 CG ASN A 181 1.399 -4.954 -9.564 1.00 0.00 C ATOM 971 OD1 ASN A 181 0.222 -5.032 -9.900 1.00 0.00 O ATOM 972 ND2 ASN A 181 2.336 -4.611 -10.426 1.00 0.00 N ATOM 0 H ASN A 181 1.430 -3.001 -7.199 1.00 0.00 H new ATOM 0 HA ASN A 181 -0.180 -5.066 -7.448 1.00 0.00 H new ATOM 0 HB2 ASN A 181 2.770 -4.719 -7.951 1.00 0.00 H new ATOM 0 HB3 ASN A 181 2.121 -6.338 -8.115 1.00 0.00 H new ATOM 0 HD21 ASN A 181 2.088 -4.404 -11.394 1.00 0.00 H new ATOM 0 HD22 ASN A 181 3.309 -4.552 -10.125 1.00 0.00 H new ATOM 979 N ILE A 182 2.218 -5.846 -5.257 1.00 0.00 N ATOM 980 CA ILE A 182 2.607 -6.715 -4.172 1.00 0.00 C ATOM 981 C ILE A 182 1.633 -6.585 -3.013 1.00 0.00 C ATOM 982 O ILE A 182 1.040 -7.587 -2.662 1.00 0.00 O ATOM 983 CB ILE A 182 4.089 -6.495 -3.777 1.00 0.00 C ATOM 984 CG1 ILE A 182 5.085 -7.242 -4.694 1.00 0.00 C ATOM 985 CG2 ILE A 182 4.371 -6.935 -2.342 1.00 0.00 C ATOM 986 CD1 ILE A 182 4.686 -8.661 -5.106 1.00 0.00 C ATOM 0 H ILE A 182 2.899 -5.112 -5.453 1.00 0.00 H new ATOM 0 HA ILE A 182 2.550 -7.751 -4.504 1.00 0.00 H new ATOM 0 HB ILE A 182 4.239 -5.421 -3.885 1.00 0.00 H new ATOM 0 HG12 ILE A 182 5.230 -6.650 -5.598 1.00 0.00 H new ATOM 0 HG13 ILE A 182 6.049 -7.290 -4.187 1.00 0.00 H new ATOM 0 HG21 ILE A 182 5.422 -6.763 -2.108 1.00 0.00 H new ATOM 0 HG22 ILE A 182 3.748 -6.361 -1.656 1.00 0.00 H new ATOM 0 HG23 ILE A 182 4.145 -7.996 -2.236 1.00 0.00 H new ATOM 0 HD11 ILE A 182 5.459 -9.085 -5.747 1.00 0.00 H new ATOM 0 HD12 ILE A 182 4.573 -9.280 -4.216 1.00 0.00 H new ATOM 0 HD13 ILE A 182 3.741 -8.630 -5.649 1.00 0.00 H new ATOM 998 N THR A 183 1.495 -5.438 -2.357 1.00 0.00 N ATOM 999 CA THR A 183 0.836 -5.362 -1.056 1.00 0.00 C ATOM 1000 C THR A 183 -0.594 -5.880 -1.187 1.00 0.00 C ATOM 1001 O THR A 183 -1.015 -6.686 -0.354 1.00 0.00 O ATOM 1002 CB THR A 183 0.880 -3.925 -0.537 1.00 0.00 C ATOM 1003 OG1 THR A 183 2.228 -3.484 -0.468 1.00 0.00 O ATOM 1004 CG2 THR A 183 0.211 -3.797 0.836 1.00 0.00 C ATOM 0 H THR A 183 1.833 -4.542 -2.707 1.00 0.00 H new ATOM 0 HA THR A 183 1.356 -5.987 -0.330 1.00 0.00 H new ATOM 0 HB THR A 183 0.323 -3.297 -1.233 1.00 0.00 H new ATOM 0 HG1 THR A 183 2.548 -3.268 -1.369 1.00 0.00 H new ATOM 0 HG21 THR A 183 0.263 -2.761 1.171 1.00 0.00 H new ATOM 0 HG22 THR A 183 -0.833 -4.103 0.762 1.00 0.00 H new ATOM 0 HG23 THR A 183 0.726 -4.436 1.553 1.00 0.00 H new ATOM 1012 N ILE A 184 -1.271 -5.501 -2.275 1.00 0.00 N ATOM 1013 CA ILE A 184 -2.516 -6.078 -2.754 1.00 0.00 C ATOM 1014 C ILE A 184 -2.339 -7.594 -2.854 1.00 0.00 C ATOM 1015 O ILE A 184 -2.891 -8.336 -2.052 1.00 0.00 O ATOM 1016 CB ILE A 184 -2.878 -5.382 -4.086 1.00 0.00 C ATOM 1017 CG1 ILE A 184 -3.248 -3.910 -3.796 1.00 0.00 C ATOM 1018 CG2 ILE A 184 -3.983 -6.064 -4.899 1.00 0.00 C ATOM 1019 CD1 ILE A 184 -3.586 -3.104 -5.042 1.00 0.00 C ATOM 0 H ILE A 184 -0.942 -4.742 -2.872 1.00 0.00 H new ATOM 0 HA ILE A 184 -3.354 -5.915 -2.076 1.00 0.00 H new ATOM 0 HB ILE A 184 -1.993 -5.452 -4.718 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -4.101 -3.887 -3.117 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -2.416 -3.431 -3.280 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -4.163 -5.499 -5.814 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -3.675 -7.078 -5.153 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -4.899 -6.100 -4.309 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -3.835 -2.082 -4.758 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -2.727 -3.095 -5.713 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.438 -3.557 -5.549 1.00 0.00 H new ATOM 1031 N LYS A 185 -1.491 -8.112 -3.737 1.00 0.00 N ATOM 1032 CA LYS A 185 -1.192 -9.539 -3.811 1.00 0.00 C ATOM 1033 C LYS A 185 -0.795 -10.186 -2.479 1.00 0.00 C ATOM 1034 O LYS A 185 -0.780 -11.408 -2.426 1.00 0.00 O ATOM 1035 CB LYS A 185 -0.132 -9.733 -4.900 1.00 0.00 C ATOM 1036 CG LYS A 185 0.299 -11.175 -5.182 1.00 0.00 C ATOM 1037 CD LYS A 185 0.537 -11.334 -6.681 1.00 0.00 C ATOM 1038 CE LYS A 185 1.194 -12.659 -7.066 1.00 0.00 C ATOM 1039 NZ LYS A 185 0.299 -13.476 -7.907 1.00 0.00 N ATOM 0 H LYS A 185 -0.989 -7.551 -4.425 1.00 0.00 H new ATOM 0 HA LYS A 185 -2.110 -10.067 -4.068 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -0.512 -9.303 -5.827 1.00 0.00 H new ATOM 0 HB3 LYS A 185 0.753 -9.160 -4.621 1.00 0.00 H new ATOM 0 HG2 LYS A 185 1.208 -11.412 -4.629 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -0.470 -11.871 -4.846 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -0.417 -11.248 -7.202 1.00 0.00 H new ATOM 0 HD3 LYS A 185 1.165 -10.514 -7.028 1.00 0.00 H new ATOM 0 HE2 LYS A 185 2.123 -12.465 -7.602 1.00 0.00 H new ATOM 0 HE3 LYS A 185 1.456 -13.213 -6.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 0.772 -14.369 -8.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -0.577 -13.681 -7.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 0.070 -12.955 -8.778 1.00 0.00 H new ATOM 1053 N GLN A 186 -0.502 -9.494 -1.372 1.00 0.00 N ATOM 1054 CA GLN A 186 -0.107 -10.100 -0.112 1.00 0.00 C ATOM 1055 C GLN A 186 -1.171 -9.820 0.958 1.00 0.00 C ATOM 1056 O GLN A 186 -0.895 -9.965 2.150 1.00 0.00 O ATOM 1057 CB GLN A 186 1.273 -9.572 0.294 1.00 0.00 C ATOM 1058 CG GLN A 186 2.463 -9.719 -0.669 1.00 0.00 C ATOM 1059 CD GLN A 186 2.799 -11.086 -1.252 1.00 0.00 C ATOM 1060 OE1 GLN A 186 3.874 -11.609 -1.035 1.00 0.00 O ATOM 1061 NE2 GLN A 186 1.968 -11.691 -2.072 1.00 0.00 N ATOM 0 H GLN A 186 -0.536 -8.475 -1.335 1.00 0.00 H new ATOM 0 HA GLN A 186 -0.033 -11.182 -0.221 1.00 0.00 H new ATOM 0 HB2 GLN A 186 1.163 -8.510 0.514 1.00 0.00 H new ATOM 0 HB3 GLN A 186 1.547 -10.064 1.227 1.00 0.00 H new ATOM 0 HG2 GLN A 186 2.290 -9.042 -1.506 1.00 0.00 H new ATOM 0 HG3 GLN A 186 3.350 -9.361 -0.147 1.00 0.00 H new ATOM 0 HE21 GLN A 186 1.058 -11.276 -2.274 1.00 0.00 H new ATOM 0 HE22 GLN A 186 2.233 -12.575 -2.506 1.00 0.00 H new ATOM 1070 N HIS A 187 -2.365 -9.406 0.535 1.00 0.00 N ATOM 1071 CA HIS A 187 -3.498 -9.024 1.360 1.00 0.00 C ATOM 1072 C HIS A 187 -4.840 -9.279 0.632 1.00 0.00 C ATOM 1073 O HIS A 187 -5.908 -9.292 1.234 1.00 0.00 O ATOM 1074 CB HIS A 187 -3.280 -7.556 1.704 1.00 0.00 C ATOM 1075 CG HIS A 187 -4.387 -6.928 2.465 1.00 0.00 C ATOM 1076 ND1 HIS A 187 -4.592 -6.835 3.819 1.00 0.00 N ATOM 1077 CD2 HIS A 187 -5.402 -6.315 1.824 1.00 0.00 C ATOM 1078 CE1 HIS A 187 -5.741 -6.157 3.978 1.00 0.00 C ATOM 1079 NE2 HIS A 187 -6.261 -5.798 2.792 1.00 0.00 N ATOM 0 H HIS A 187 -2.575 -9.325 -0.460 1.00 0.00 H new ATOM 0 HA HIS A 187 -3.561 -9.623 2.268 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -2.361 -7.465 2.283 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -3.130 -6.998 0.779 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -5.527 -6.238 0.754 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -6.188 -5.930 4.934 1.00 0.00 H new ATOM 0 HE2 HIS A 187 -7.111 -5.257 2.633 1.00 0.00 H new ATOM 1087 N THR A 188 -4.783 -9.573 -0.663 1.00 0.00 N ATOM 1088 CA THR A 188 -5.888 -9.792 -1.591 1.00 0.00 C ATOM 1089 C THR A 188 -5.864 -11.255 -2.053 1.00 0.00 C ATOM 1090 O THR A 188 -6.780 -11.735 -2.726 1.00 0.00 O ATOM 1091 CB THR A 188 -5.834 -8.776 -2.742 1.00 0.00 C ATOM 1092 OG1 THR A 188 -5.589 -7.473 -2.243 1.00 0.00 O ATOM 1093 CG2 THR A 188 -7.129 -8.670 -3.544 1.00 0.00 C ATOM 0 H THR A 188 -3.883 -9.673 -1.132 1.00 0.00 H new ATOM 0 HA THR A 188 -6.846 -9.624 -1.099 1.00 0.00 H new ATOM 0 HB THR A 188 -5.037 -9.144 -3.388 1.00 0.00 H new ATOM 0 HG1 THR A 188 -6.244 -6.850 -2.620 1.00 0.00 H new ATOM 0 HG21 THR A 188 -7.007 -7.932 -4.337 1.00 0.00 H new ATOM 0 HG22 THR A 188 -7.365 -9.639 -3.984 1.00 0.00 H new ATOM 0 HG23 THR A 188 -7.941 -8.363 -2.885 1.00 0.00 H new ATOM 1101 N VAL A 189 -4.833 -11.994 -1.628 1.00 0.00 N ATOM 1102 CA VAL A 189 -4.731 -13.431 -1.743 1.00 0.00 C ATOM 1103 C VAL A 189 -4.494 -13.974 -0.343 1.00 0.00 C ATOM 1104 O VAL A 189 -5.331 -14.701 0.187 1.00 0.00 O ATOM 1105 CB VAL A 189 -3.685 -13.800 -2.825 1.00 0.00 C ATOM 1106 CG1 VAL A 189 -2.251 -14.083 -2.387 1.00 0.00 C ATOM 1107 CG2 VAL A 189 -4.201 -14.982 -3.643 1.00 0.00 C ATOM 0 H VAL A 189 -4.018 -11.577 -1.177 1.00 0.00 H new ATOM 0 HA VAL A 189 -5.641 -13.909 -2.105 1.00 0.00 H new ATOM 0 HB VAL A 189 -3.592 -12.878 -3.400 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -1.645 -14.325 -3.260 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -1.841 -13.202 -1.894 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -2.242 -14.924 -1.694 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -3.468 -15.245 -4.405 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -4.363 -15.836 -2.986 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -5.141 -14.710 -4.122 1.00 0.00 H new ATOM 1117 N THR A 190 -3.416 -13.546 0.321 1.00 0.00 N ATOM 1118 CA THR A 190 -2.909 -14.306 1.474 1.00 0.00 C ATOM 1119 C THR A 190 -3.532 -13.837 2.809 1.00 0.00 C ATOM 1120 O THR A 190 -2.933 -13.937 3.877 1.00 0.00 O ATOM 1121 CB THR A 190 -1.373 -14.456 1.372 1.00 0.00 C ATOM 1122 OG1 THR A 190 -0.945 -15.678 1.936 1.00 0.00 O ATOM 1123 CG2 THR A 190 -0.543 -13.310 1.945 1.00 0.00 C ATOM 0 H THR A 190 -2.889 -12.703 0.092 1.00 0.00 H new ATOM 0 HA THR A 190 -3.259 -15.338 1.454 1.00 0.00 H new ATOM 0 HB THR A 190 -1.186 -14.434 0.298 1.00 0.00 H new ATOM 0 HG1 THR A 190 0.029 -15.751 1.858 1.00 0.00 H new ATOM 0 HG21 THR A 190 0.517 -13.528 1.816 1.00 0.00 H new ATOM 0 HG22 THR A 190 -0.789 -12.386 1.422 1.00 0.00 H new ATOM 0 HG23 THR A 190 -0.763 -13.197 3.006 1.00 0.00 H new ATOM 1131 N THR A 191 -4.772 -13.363 2.727 1.00 0.00 N ATOM 1132 CA THR A 191 -5.587 -12.778 3.787 1.00 0.00 C ATOM 1133 C THR A 191 -7.046 -13.065 3.405 1.00 0.00 C ATOM 1134 O THR A 191 -7.807 -13.659 4.161 1.00 0.00 O ATOM 1135 CB THR A 191 -5.271 -11.275 3.817 1.00 0.00 C ATOM 1136 OG1 THR A 191 -3.890 -11.062 4.030 1.00 0.00 O ATOM 1137 CG2 THR A 191 -6.087 -10.442 4.790 1.00 0.00 C ATOM 0 H THR A 191 -5.276 -13.380 1.840 1.00 0.00 H new ATOM 0 HA THR A 191 -5.394 -13.184 4.780 1.00 0.00 H new ATOM 0 HB THR A 191 -5.570 -10.918 2.831 1.00 0.00 H new ATOM 0 HG1 THR A 191 -3.747 -10.150 4.359 1.00 0.00 H new ATOM 0 HG21 THR A 191 -5.778 -9.399 4.724 1.00 0.00 H new ATOM 0 HG22 THR A 191 -7.145 -10.523 4.540 1.00 0.00 H new ATOM 0 HG23 THR A 191 -5.925 -10.805 5.805 1.00 0.00 H new ATOM 1145 N THR A 192 -7.402 -12.801 2.146 1.00 0.00 N ATOM 1146 CA THR A 192 -8.665 -13.111 1.463 1.00 0.00 C ATOM 1147 C THR A 192 -8.930 -14.622 1.294 1.00 0.00 C ATOM 1148 O THR A 192 -9.875 -15.055 0.623 1.00 0.00 O ATOM 1149 CB THR A 192 -8.623 -12.417 0.097 1.00 0.00 C ATOM 1150 OG1 THR A 192 -7.804 -11.275 0.173 1.00 0.00 O ATOM 1151 CG2 THR A 192 -9.980 -11.970 -0.438 1.00 0.00 C ATOM 0 H THR A 192 -6.756 -12.321 1.519 1.00 0.00 H new ATOM 0 HA THR A 192 -9.488 -12.748 2.079 1.00 0.00 H new ATOM 0 HB THR A 192 -8.236 -13.170 -0.590 1.00 0.00 H new ATOM 0 HG1 THR A 192 -8.081 -10.724 0.935 1.00 0.00 H new ATOM 0 HG21 THR A 192 -9.849 -11.490 -1.408 1.00 0.00 H new ATOM 0 HG22 THR A 192 -10.632 -12.837 -0.547 1.00 0.00 H new ATOM 0 HG23 THR A 192 -10.431 -11.263 0.258 1.00 0.00 H new ATOM 1159 N THR A 193 -8.059 -15.442 1.869 1.00 0.00 N ATOM 1160 CA THR A 193 -8.173 -16.881 1.960 1.00 0.00 C ATOM 1161 C THR A 193 -7.861 -17.349 3.396 1.00 0.00 C ATOM 1162 O THR A 193 -7.594 -18.528 3.618 1.00 0.00 O ATOM 1163 CB THR A 193 -7.314 -17.463 0.818 1.00 0.00 C ATOM 1164 OG1 THR A 193 -7.934 -18.619 0.300 1.00 0.00 O ATOM 1165 CG2 THR A 193 -5.833 -17.690 1.152 1.00 0.00 C ATOM 0 H THR A 193 -7.207 -15.094 2.308 1.00 0.00 H new ATOM 0 HA THR A 193 -9.183 -17.260 1.806 1.00 0.00 H new ATOM 0 HB THR A 193 -7.273 -16.693 0.048 1.00 0.00 H new ATOM 0 HG1 THR A 193 -7.387 -18.986 -0.426 1.00 0.00 H new ATOM 0 HG21 THR A 193 -5.322 -18.101 0.281 1.00 0.00 H new ATOM 0 HG22 THR A 193 -5.373 -16.741 1.429 1.00 0.00 H new ATOM 0 HG23 THR A 193 -5.751 -18.389 1.984 1.00 0.00 H new ATOM 1173 N LYS A 194 -7.842 -16.430 4.372 1.00 0.00 N ATOM 1174 CA LYS A 194 -7.470 -16.649 5.771 1.00 0.00 C ATOM 1175 C LYS A 194 -8.405 -15.921 6.750 1.00 0.00 C ATOM 1176 O LYS A 194 -8.141 -15.957 7.951 1.00 0.00 O ATOM 1177 CB LYS A 194 -6.026 -16.186 6.036 1.00 0.00 C ATOM 1178 CG LYS A 194 -4.978 -16.662 5.019 1.00 0.00 C ATOM 1179 CD LYS A 194 -3.585 -16.502 5.633 1.00 0.00 C ATOM 1180 CE LYS A 194 -2.493 -16.860 4.627 1.00 0.00 C ATOM 1181 NZ LYS A 194 -1.148 -16.773 5.232 1.00 0.00 N ATOM 0 H LYS A 194 -8.101 -15.460 4.193 1.00 0.00 H new ATOM 0 HA LYS A 194 -7.558 -17.722 5.941 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -6.012 -15.096 6.062 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -5.729 -16.532 7.026 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -5.156 -17.704 4.754 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -5.054 -16.082 4.099 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -3.449 -15.474 5.970 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -3.497 -17.140 6.512 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -2.660 -17.870 4.252 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -2.552 -16.188 3.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -0.431 -17.022 4.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -0.980 -15.803 5.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -1.085 -17.432 6.034 1.00 0.00 H new ATOM 1195 N GLY A 195 -9.476 -15.276 6.282 1.00 0.00 N ATOM 1196 CA GLY A 195 -10.386 -14.509 7.133 1.00 0.00 C ATOM 1197 C GLY A 195 -10.956 -13.256 6.476 1.00 0.00 C ATOM 1198 O GLY A 195 -11.550 -12.434 7.176 1.00 0.00 O ATOM 0 H GLY A 195 -9.737 -15.272 5.296 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -11.211 -15.154 7.435 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -9.858 -14.220 8.042 1.00 0.00 H new ATOM 1202 N GLU A 196 -10.780 -13.077 5.164 1.00 0.00 N ATOM 1203 CA GLU A 196 -11.309 -11.934 4.433 1.00 0.00 C ATOM 1204 C GLU A 196 -11.926 -12.377 3.106 1.00 0.00 C ATOM 1205 O GLU A 196 -11.657 -13.486 2.630 1.00 0.00 O ATOM 1206 CB GLU A 196 -10.175 -10.917 4.194 1.00 0.00 C ATOM 1207 CG GLU A 196 -10.210 -9.741 5.176 1.00 0.00 C ATOM 1208 CD GLU A 196 -11.404 -8.806 4.944 1.00 0.00 C ATOM 1209 OE1 GLU A 196 -12.371 -9.173 4.240 1.00 0.00 O ATOM 1210 OE2 GLU A 196 -11.381 -7.663 5.461 1.00 0.00 O ATOM 0 H GLU A 196 -10.260 -13.731 4.578 1.00 0.00 H new ATOM 0 HA GLU A 196 -12.096 -11.464 5.023 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -9.215 -11.425 4.278 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -10.245 -10.535 3.175 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -10.249 -10.126 6.195 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -9.285 -9.171 5.086 1.00 0.00 H new ATOM 1217 N ASN A 197 -12.697 -11.493 2.466 1.00 0.00 N ATOM 1218 CA ASN A 197 -13.258 -11.681 1.134 1.00 0.00 C ATOM 1219 C ASN A 197 -13.594 -10.337 0.477 1.00 0.00 C ATOM 1220 O ASN A 197 -14.750 -10.038 0.175 1.00 0.00 O ATOM 1221 CB ASN A 197 -14.481 -12.598 1.198 1.00 0.00 C ATOM 1222 CG ASN A 197 -14.809 -13.068 -0.205 1.00 0.00 C ATOM 1223 OD1 ASN A 197 -13.998 -13.746 -0.830 1.00 0.00 O ATOM 1224 ND2 ASN A 197 -15.945 -12.701 -0.754 1.00 0.00 N ATOM 0 H ASN A 197 -12.954 -10.597 2.880 1.00 0.00 H new ATOM 0 HA ASN A 197 -12.506 -12.163 0.509 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -14.280 -13.452 1.845 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -15.330 -12.066 1.627 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -16.162 -12.979 -1.711 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -16.609 -12.138 -0.223 1.00 0.00 H new ATOM 1231 N PHE A 198 -12.568 -9.515 0.272 1.00 0.00 N ATOM 1232 CA PHE A 198 -12.662 -8.242 -0.438 1.00 0.00 C ATOM 1233 C PHE A 198 -13.201 -8.405 -1.871 1.00 0.00 C ATOM 1234 O PHE A 198 -13.106 -9.475 -2.481 1.00 0.00 O ATOM 1235 CB PHE A 198 -11.274 -7.605 -0.526 1.00 0.00 C ATOM 1236 CG PHE A 198 -10.545 -7.352 0.780 1.00 0.00 C ATOM 1237 CD1 PHE A 198 -10.720 -6.148 1.493 1.00 0.00 C ATOM 1238 CD2 PHE A 198 -9.613 -8.301 1.239 1.00 0.00 C ATOM 1239 CE1 PHE A 198 -9.977 -5.907 2.660 1.00 0.00 C ATOM 1240 CE2 PHE A 198 -8.882 -8.066 2.414 1.00 0.00 C ATOM 1241 CZ PHE A 198 -9.080 -6.876 3.131 1.00 0.00 C ATOM 0 H PHE A 198 -11.625 -9.721 0.603 1.00 0.00 H new ATOM 0 HA PHE A 198 -13.356 -7.616 0.123 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -10.646 -8.246 -1.145 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -11.371 -6.654 -1.049 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -11.426 -5.410 1.141 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -9.459 -9.215 0.684 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -10.096 -4.976 3.194 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -8.170 -8.798 2.765 1.00 0.00 H new ATOM 0 HZ PHE A 198 -8.539 -6.706 4.050 1.00 0.00 H new ATOM 1251 N THR A 199 -13.668 -7.303 -2.451 1.00 0.00 N ATOM 1252 CA THR A 199 -14.281 -7.212 -3.773 1.00 0.00 C ATOM 1253 C THR A 199 -13.450 -6.301 -4.688 1.00 0.00 C ATOM 1254 O THR A 199 -12.643 -5.523 -4.197 1.00 0.00 O ATOM 1255 CB THR A 199 -15.746 -6.753 -3.590 1.00 0.00 C ATOM 1256 OG1 THR A 199 -15.949 -5.901 -2.466 1.00 0.00 O ATOM 1257 CG2 THR A 199 -16.616 -7.980 -3.328 1.00 0.00 C ATOM 0 H THR A 199 -13.626 -6.397 -1.984 1.00 0.00 H new ATOM 0 HA THR A 199 -14.297 -8.180 -4.273 1.00 0.00 H new ATOM 0 HB THR A 199 -16.000 -6.210 -4.500 1.00 0.00 H new ATOM 0 HG1 THR A 199 -16.895 -5.649 -2.413 1.00 0.00 H new ATOM 0 HG21 THR A 199 -17.653 -7.670 -3.197 1.00 0.00 H new ATOM 0 HG22 THR A 199 -16.546 -8.663 -4.174 1.00 0.00 H new ATOM 0 HG23 THR A 199 -16.271 -8.484 -2.425 1.00 0.00 H new ATOM 1265 N GLU A 200 -13.649 -6.324 -6.009 1.00 0.00 N ATOM 1266 CA GLU A 200 -12.952 -5.478 -6.968 1.00 0.00 C ATOM 1267 C GLU A 200 -12.996 -4.005 -6.558 1.00 0.00 C ATOM 1268 O GLU A 200 -11.978 -3.322 -6.627 1.00 0.00 O ATOM 1269 CB GLU A 200 -13.616 -5.778 -8.315 1.00 0.00 C ATOM 1270 CG GLU A 200 -12.885 -5.244 -9.541 1.00 0.00 C ATOM 1271 CD GLU A 200 -13.035 -3.736 -9.756 1.00 0.00 C ATOM 1272 OE1 GLU A 200 -14.129 -3.193 -9.474 1.00 0.00 O ATOM 1273 OE2 GLU A 200 -12.059 -3.079 -10.203 1.00 0.00 O ATOM 0 H GLU A 200 -14.321 -6.953 -6.449 1.00 0.00 H new ATOM 0 HA GLU A 200 -11.884 -5.689 -7.021 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -13.719 -6.858 -8.417 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -14.623 -5.362 -8.304 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -11.825 -5.483 -9.450 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -13.254 -5.764 -10.425 1.00 0.00 H new ATOM 1280 N THR A 201 -14.134 -3.528 -6.062 1.00 0.00 N ATOM 1281 CA THR A 201 -14.298 -2.154 -5.612 1.00 0.00 C ATOM 1282 C THR A 201 -13.546 -1.852 -4.299 1.00 0.00 C ATOM 1283 O THR A 201 -13.178 -0.697 -4.087 1.00 0.00 O ATOM 1284 CB THR A 201 -15.805 -1.928 -5.470 1.00 0.00 C ATOM 1285 OG1 THR A 201 -16.443 -2.284 -6.691 1.00 0.00 O ATOM 1286 CG2 THR A 201 -16.196 -0.492 -5.123 1.00 0.00 C ATOM 0 H THR A 201 -14.977 -4.094 -5.961 1.00 0.00 H new ATOM 0 HA THR A 201 -13.859 -1.468 -6.336 1.00 0.00 H new ATOM 0 HB THR A 201 -16.128 -2.552 -4.637 1.00 0.00 H new ATOM 0 HG1 THR A 201 -17.409 -2.144 -6.608 1.00 0.00 H new ATOM 0 HG21 THR A 201 -17.281 -0.420 -5.041 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.741 -0.210 -4.173 1.00 0.00 H new ATOM 0 HG23 THR A 201 -15.846 0.180 -5.907 1.00 0.00 H new ATOM 1294 N ASP A 202 -13.270 -2.848 -3.443 1.00 0.00 N ATOM 1295 CA ASP A 202 -12.282 -2.682 -2.371 1.00 0.00 C ATOM 1296 C ASP A 202 -10.944 -2.435 -3.035 1.00 0.00 C ATOM 1297 O ASP A 202 -10.269 -1.470 -2.697 1.00 0.00 O ATOM 1298 CB ASP A 202 -12.147 -3.902 -1.438 1.00 0.00 C ATOM 1299 CG ASP A 202 -10.699 -4.093 -0.969 1.00 0.00 C ATOM 1300 OD1 ASP A 202 -10.359 -3.480 0.058 1.00 0.00 O ATOM 1301 OD2 ASP A 202 -9.965 -4.859 -1.626 1.00 0.00 O ATOM 0 H ASP A 202 -13.713 -3.766 -3.473 1.00 0.00 H new ATOM 0 HA ASP A 202 -12.614 -1.856 -1.742 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -12.797 -3.773 -0.573 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -12.483 -4.799 -1.959 1.00 0.00 H new ATOM 1306 N VAL A 203 -10.572 -3.291 -3.987 1.00 0.00 N ATOM 1307 CA VAL A 203 -9.202 -3.306 -4.467 1.00 0.00 C ATOM 1308 C VAL A 203 -8.893 -1.950 -5.117 1.00 0.00 C ATOM 1309 O VAL A 203 -7.799 -1.431 -4.943 1.00 0.00 O ATOM 1310 CB VAL A 203 -8.947 -4.530 -5.367 1.00 0.00 C ATOM 1311 CG1 VAL A 203 -7.543 -4.508 -5.991 1.00 0.00 C ATOM 1312 CG2 VAL A 203 -9.116 -5.841 -4.584 1.00 0.00 C ATOM 0 H VAL A 203 -11.192 -3.969 -4.430 1.00 0.00 H new ATOM 0 HA VAL A 203 -8.499 -3.427 -3.642 1.00 0.00 H new ATOM 0 HB VAL A 203 -9.688 -4.478 -6.165 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -7.409 -5.390 -6.617 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -7.429 -3.611 -6.599 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -6.793 -4.507 -5.200 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -8.930 -6.687 -5.246 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -8.407 -5.865 -3.757 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -10.132 -5.903 -4.193 1.00 0.00 H new ATOM 1322 N LYS A 204 -9.871 -1.311 -5.769 1.00 0.00 N ATOM 1323 CA LYS A 204 -9.768 0.050 -6.306 1.00 0.00 C ATOM 1324 C LYS A 204 -9.456 1.091 -5.227 1.00 0.00 C ATOM 1325 O LYS A 204 -8.711 2.035 -5.502 1.00 0.00 O ATOM 1326 CB LYS A 204 -11.083 0.402 -7.023 1.00 0.00 C ATOM 1327 CG LYS A 204 -11.343 -0.481 -8.256 1.00 0.00 C ATOM 1328 CD LYS A 204 -10.470 -0.129 -9.467 1.00 0.00 C ATOM 1329 CE LYS A 204 -9.235 -1.034 -9.539 1.00 0.00 C ATOM 1330 NZ LYS A 204 -8.309 -0.631 -10.607 1.00 0.00 N ATOM 0 H LYS A 204 -10.781 -1.738 -5.942 1.00 0.00 H new ATOM 0 HA LYS A 204 -8.933 0.072 -7.006 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -11.913 0.296 -6.324 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -11.056 1.448 -7.329 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -11.171 -1.523 -7.987 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -12.392 -0.394 -8.539 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -11.054 -0.232 -10.382 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -10.158 0.913 -9.403 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -8.714 -1.011 -8.582 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -9.551 -2.064 -9.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -8.037 -1.466 -11.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -8.775 0.062 -11.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -7.459 -0.203 -10.187 1.00 0.00 H new ATOM 1344 N MET A 205 -10.011 0.953 -4.026 1.00 0.00 N ATOM 1345 CA MET A 205 -9.648 1.785 -2.883 1.00 0.00 C ATOM 1346 C MET A 205 -8.249 1.418 -2.408 1.00 0.00 C ATOM 1347 O MET A 205 -7.460 2.292 -2.051 1.00 0.00 O ATOM 1348 CB MET A 205 -10.647 1.590 -1.731 1.00 0.00 C ATOM 1349 CG MET A 205 -12.055 2.021 -2.124 1.00 0.00 C ATOM 1350 SD MET A 205 -12.137 3.792 -2.445 1.00 0.00 S ATOM 1351 CE MET A 205 -13.775 3.876 -3.180 1.00 0.00 C ATOM 0 H MET A 205 -10.728 0.258 -3.818 1.00 0.00 H new ATOM 0 HA MET A 205 -9.671 2.830 -3.193 1.00 0.00 H new ATOM 0 HB2 MET A 205 -10.658 0.542 -1.433 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.319 2.165 -0.865 1.00 0.00 H new ATOM 0 HG2 MET A 205 -12.369 1.474 -3.013 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.752 1.762 -1.327 1.00 0.00 H new ATOM 0 HE1 MET A 205 -13.806 4.686 -3.908 1.00 0.00 H new ATOM 0 HE2 MET A 205 -14.000 2.932 -3.677 1.00 0.00 H new ATOM 0 HE3 MET A 205 -14.514 4.060 -2.401 1.00 0.00 H new ATOM 1361 N MET A 206 -7.926 0.128 -2.406 1.00 0.00 N ATOM 1362 CA MET A 206 -6.657 -0.360 -1.922 1.00 0.00 C ATOM 1363 C MET A 206 -5.508 0.129 -2.802 1.00 0.00 C ATOM 1364 O MET A 206 -4.478 0.509 -2.257 1.00 0.00 O ATOM 1365 CB MET A 206 -6.690 -1.885 -1.836 1.00 0.00 C ATOM 1366 CG MET A 206 -5.574 -2.366 -0.909 1.00 0.00 C ATOM 1367 SD MET A 206 -5.387 -4.157 -0.743 1.00 0.00 S ATOM 1368 CE MET A 206 -7.124 -4.684 -0.764 1.00 0.00 C ATOM 0 H MET A 206 -8.548 -0.606 -2.744 1.00 0.00 H new ATOM 0 HA MET A 206 -6.483 0.037 -0.922 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.658 -2.218 -1.461 1.00 0.00 H new ATOM 0 HB3 MET A 206 -6.566 -2.319 -2.828 1.00 0.00 H new ATOM 0 HG2 MET A 206 -4.630 -1.955 -1.268 1.00 0.00 H new ATOM 0 HG3 MET A 206 -5.748 -1.947 0.082 1.00 0.00 H new ATOM 0 HE1 MET A 206 -7.191 -5.728 -0.459 1.00 0.00 H new ATOM 0 HE2 MET A 206 -7.700 -4.067 -0.074 1.00 0.00 H new ATOM 0 HE3 MET A 206 -7.526 -4.573 -1.771 1.00 0.00 H new ATOM 1378 N GLU A 207 -5.663 0.198 -4.129 1.00 0.00 N ATOM 1379 CA GLU A 207 -4.602 0.678 -5.012 1.00 0.00 C ATOM 1380 C GLU A 207 -4.237 2.117 -4.641 1.00 0.00 C ATOM 1381 O GLU A 207 -3.076 2.508 -4.738 1.00 0.00 O ATOM 1382 CB GLU A 207 -4.980 0.606 -6.507 1.00 0.00 C ATOM 1383 CG GLU A 207 -5.576 -0.713 -7.021 1.00 0.00 C ATOM 1384 CD GLU A 207 -5.344 -0.941 -8.514 1.00 0.00 C ATOM 1385 OE1 GLU A 207 -5.946 -0.203 -9.327 1.00 0.00 O ATOM 1386 OE2 GLU A 207 -4.605 -1.875 -8.904 1.00 0.00 O ATOM 0 H GLU A 207 -6.518 -0.075 -4.614 1.00 0.00 H new ATOM 0 HA GLU A 207 -3.747 0.018 -4.870 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -5.696 1.402 -6.713 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -4.086 0.822 -7.092 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -5.141 -1.542 -6.462 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -6.648 -0.721 -6.822 1.00 0.00 H new ATOM 1393 N ARG A 208 -5.221 2.903 -4.197 1.00 0.00 N ATOM 1394 CA ARG A 208 -5.055 4.293 -3.795 1.00 0.00 C ATOM 1395 C ARG A 208 -4.413 4.375 -2.420 1.00 0.00 C ATOM 1396 O ARG A 208 -3.445 5.114 -2.238 1.00 0.00 O ATOM 1397 CB ARG A 208 -6.437 4.961 -3.792 1.00 0.00 C ATOM 1398 CG ARG A 208 -6.879 5.399 -5.185 1.00 0.00 C ATOM 1399 CD ARG A 208 -6.200 6.716 -5.542 1.00 0.00 C ATOM 1400 NE ARG A 208 -6.885 7.382 -6.647 1.00 0.00 N ATOM 1401 CZ ARG A 208 -6.694 8.627 -7.079 1.00 0.00 C ATOM 1402 NH1 ARG A 208 -5.778 9.420 -6.523 1.00 0.00 N ATOM 1403 NH2 ARG A 208 -7.461 9.062 -8.066 1.00 0.00 N ATOM 0 H ARG A 208 -6.183 2.575 -4.106 1.00 0.00 H new ATOM 0 HA ARG A 208 -4.398 4.809 -4.495 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -7.171 4.267 -3.383 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -6.416 5.828 -3.132 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -6.621 4.634 -5.917 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -7.962 5.516 -5.215 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -6.189 7.370 -4.670 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -5.161 6.530 -5.814 1.00 0.00 H new ATOM 0 HE ARG A 208 -7.587 6.833 -7.142 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -5.207 9.076 -5.751 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -5.648 10.370 -6.870 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -8.169 8.449 -8.469 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -7.344 10.010 -8.423 1.00 0.00 H new ATOM 1417 N VAL A 209 -4.952 3.638 -1.450 1.00 0.00 N ATOM 1418 CA VAL A 209 -4.455 3.669 -0.084 1.00 0.00 C ATOM 1419 C VAL A 209 -2.995 3.216 -0.062 1.00 0.00 C ATOM 1420 O VAL A 209 -2.139 3.890 0.509 1.00 0.00 O ATOM 1421 CB VAL A 209 -5.422 2.885 0.835 1.00 0.00 C ATOM 1422 CG1 VAL A 209 -5.096 1.412 1.085 1.00 0.00 C ATOM 1423 CG2 VAL A 209 -5.535 3.557 2.196 1.00 0.00 C ATOM 0 H VAL A 209 -5.741 3.007 -1.592 1.00 0.00 H new ATOM 0 HA VAL A 209 -4.441 4.680 0.322 1.00 0.00 H new ATOM 0 HB VAL A 209 -6.354 2.903 0.269 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -5.849 0.979 1.743 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -5.091 0.874 0.137 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -4.115 1.331 1.553 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -6.220 2.989 2.826 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -4.553 3.592 2.667 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -5.914 4.571 2.071 1.00 0.00 H new ATOM 1433 N VAL A 210 -2.696 2.108 -0.738 1.00 0.00 N ATOM 1434 CA VAL A 210 -1.366 1.551 -0.802 1.00 0.00 C ATOM 1435 C VAL A 210 -0.468 2.466 -1.632 1.00 0.00 C ATOM 1436 O VAL A 210 0.699 2.556 -1.298 1.00 0.00 O ATOM 1437 CB VAL A 210 -1.441 0.102 -1.320 1.00 0.00 C ATOM 1438 CG1 VAL A 210 -0.079 -0.532 -1.574 1.00 0.00 C ATOM 1439 CG2 VAL A 210 -2.162 -0.820 -0.325 1.00 0.00 C ATOM 0 H VAL A 210 -3.388 1.572 -1.261 1.00 0.00 H new ATOM 0 HA VAL A 210 -0.913 1.498 0.188 1.00 0.00 H new ATOM 0 HB VAL A 210 -1.985 0.189 -2.260 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -0.214 -1.551 -1.937 1.00 0.00 H new ATOM 0 HG12 VAL A 210 0.460 0.051 -2.321 1.00 0.00 H new ATOM 0 HG13 VAL A 210 0.493 -0.550 -0.646 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -2.195 -1.833 -0.726 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -1.625 -0.822 0.624 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -3.178 -0.460 -0.166 1.00 0.00 H new ATOM 1449 N GLU A 211 -0.955 3.199 -2.637 1.00 0.00 N ATOM 1450 CA GLU A 211 -0.142 4.129 -3.410 1.00 0.00 C ATOM 1451 C GLU A 211 0.368 5.216 -2.473 1.00 0.00 C ATOM 1452 O GLU A 211 1.576 5.391 -2.361 1.00 0.00 O ATOM 1453 CB GLU A 211 -0.945 4.697 -4.590 1.00 0.00 C ATOM 1454 CG GLU A 211 -0.260 5.891 -5.254 1.00 0.00 C ATOM 1455 CD GLU A 211 -1.076 6.445 -6.420 1.00 0.00 C ATOM 1456 OE1 GLU A 211 -2.121 7.096 -6.181 1.00 0.00 O ATOM 1457 OE2 GLU A 211 -0.628 6.303 -7.584 1.00 0.00 O ATOM 0 H GLU A 211 -1.930 3.160 -2.935 1.00 0.00 H new ATOM 0 HA GLU A 211 0.716 3.617 -3.845 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -1.096 3.912 -5.331 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -1.932 4.999 -4.240 1.00 0.00 H new ATOM 0 HG2 GLU A 211 -0.105 6.677 -4.515 1.00 0.00 H new ATOM 0 HG3 GLU A 211 0.725 5.591 -5.611 1.00 0.00 H new ATOM 1464 N GLN A 212 -0.531 5.904 -1.764 1.00 0.00 N ATOM 1465 CA GLN A 212 -0.188 6.912 -0.766 1.00 0.00 C ATOM 1466 C GLN A 212 0.864 6.380 0.223 1.00 0.00 C ATOM 1467 O GLN A 212 1.772 7.113 0.616 1.00 0.00 O ATOM 1468 CB GLN A 212 -1.466 7.305 -0.017 1.00 0.00 C ATOM 1469 CG GLN A 212 -2.535 8.000 -0.873 1.00 0.00 C ATOM 1470 CD GLN A 212 -2.488 9.516 -0.738 1.00 0.00 C ATOM 1471 OE1 GLN A 212 -3.138 10.101 0.123 1.00 0.00 O ATOM 1472 NE2 GLN A 212 -1.690 10.191 -1.544 1.00 0.00 N ATOM 0 H GLN A 212 -1.536 5.771 -1.872 1.00 0.00 H new ATOM 0 HA GLN A 212 0.241 7.781 -1.265 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -1.902 6.408 0.422 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -1.197 7.965 0.807 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -2.395 7.726 -1.919 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -3.522 7.642 -0.579 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -1.152 9.700 -2.258 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -1.611 11.204 -1.453 1.00 0.00 H new ATOM 1481 N MET A 213 0.754 5.106 0.615 1.00 0.00 N ATOM 1482 CA MET A 213 1.692 4.471 1.539 1.00 0.00 C ATOM 1483 C MET A 213 3.040 4.196 0.858 1.00 0.00 C ATOM 1484 O MET A 213 4.075 4.623 1.359 1.00 0.00 O ATOM 1485 CB MET A 213 1.054 3.197 2.117 1.00 0.00 C ATOM 1486 CG MET A 213 -0.002 3.545 3.179 1.00 0.00 C ATOM 1487 SD MET A 213 -1.505 2.528 3.288 1.00 0.00 S ATOM 1488 CE MET A 213 -0.835 0.854 3.169 1.00 0.00 C ATOM 0 H MET A 213 0.008 4.487 0.298 1.00 0.00 H new ATOM 0 HA MET A 213 1.903 5.149 2.366 1.00 0.00 H new ATOM 0 HB2 MET A 213 0.593 2.621 1.315 1.00 0.00 H new ATOM 0 HB3 MET A 213 1.826 2.567 2.559 1.00 0.00 H new ATOM 0 HG2 MET A 213 0.487 3.516 4.153 1.00 0.00 H new ATOM 0 HG3 MET A 213 -0.313 4.576 3.009 1.00 0.00 H new ATOM 0 HE1 MET A 213 -1.630 0.130 3.346 1.00 0.00 H new ATOM 0 HE2 MET A 213 -0.418 0.699 2.174 1.00 0.00 H new ATOM 0 HE3 MET A 213 -0.051 0.722 3.915 1.00 0.00 H new ATOM 1498 N CYS A 214 3.046 3.510 -0.285 1.00 0.00 N ATOM 1499 CA CYS A 214 4.219 3.163 -1.078 1.00 0.00 C ATOM 1500 C CYS A 214 5.002 4.406 -1.484 1.00 0.00 C ATOM 1501 O CYS A 214 6.228 4.367 -1.484 1.00 0.00 O ATOM 1502 CB CYS A 214 3.793 2.424 -2.350 1.00 0.00 C ATOM 1503 SG CYS A 214 3.033 0.801 -2.118 1.00 0.00 S ATOM 0 H CYS A 214 2.183 3.163 -0.703 1.00 0.00 H new ATOM 0 HA CYS A 214 4.853 2.526 -0.461 1.00 0.00 H new ATOM 0 HB2 CYS A 214 3.091 3.056 -2.894 1.00 0.00 H new ATOM 0 HB3 CYS A 214 4.670 2.303 -2.985 1.00 0.00 H new ATOM 1508 N VAL A 215 4.316 5.495 -1.833 1.00 0.00 N ATOM 1509 CA VAL A 215 4.923 6.778 -2.139 1.00 0.00 C ATOM 1510 C VAL A 215 5.737 7.230 -0.930 1.00 0.00 C ATOM 1511 O VAL A 215 6.925 7.499 -1.080 1.00 0.00 O ATOM 1512 CB VAL A 215 3.836 7.782 -2.580 1.00 0.00 C ATOM 1513 CG1 VAL A 215 4.338 9.233 -2.564 1.00 0.00 C ATOM 1514 CG2 VAL A 215 3.366 7.454 -4.006 1.00 0.00 C ATOM 0 H VAL A 215 3.299 5.503 -1.911 1.00 0.00 H new ATOM 0 HA VAL A 215 5.613 6.704 -2.980 1.00 0.00 H new ATOM 0 HB VAL A 215 3.017 7.690 -1.866 1.00 0.00 H new ATOM 0 HG11 VAL A 215 3.536 9.899 -2.882 1.00 0.00 H new ATOM 0 HG12 VAL A 215 4.651 9.499 -1.554 1.00 0.00 H new ATOM 0 HG13 VAL A 215 5.184 9.333 -3.244 1.00 0.00 H new ATOM 0 HG21 VAL A 215 2.599 8.167 -4.309 1.00 0.00 H new ATOM 0 HG22 VAL A 215 4.211 7.517 -4.691 1.00 0.00 H new ATOM 0 HG23 VAL A 215 2.954 6.445 -4.030 1.00 0.00 H new ATOM 1524 N THR A 216 5.155 7.311 0.267 1.00 0.00 N ATOM 1525 CA THR A 216 5.940 7.691 1.431 1.00 0.00 C ATOM 1526 C THR A 216 7.039 6.665 1.707 1.00 0.00 C ATOM 1527 O THR A 216 8.135 7.091 2.038 1.00 0.00 O ATOM 1528 CB THR A 216 5.013 7.843 2.644 1.00 0.00 C ATOM 1529 OG1 THR A 216 4.013 8.803 2.355 1.00 0.00 O ATOM 1530 CG2 THR A 216 5.741 8.204 3.947 1.00 0.00 C ATOM 0 H THR A 216 4.169 7.123 0.450 1.00 0.00 H new ATOM 0 HA THR A 216 6.427 8.646 1.235 1.00 0.00 H new ATOM 0 HB THR A 216 4.566 6.865 2.820 1.00 0.00 H new ATOM 0 HG1 THR A 216 3.314 8.392 1.805 1.00 0.00 H new ATOM 0 HG21 THR A 216 5.016 8.293 4.756 1.00 0.00 H new ATOM 0 HG22 THR A 216 6.461 7.423 4.190 1.00 0.00 H new ATOM 0 HG23 THR A 216 6.263 9.153 3.821 1.00 0.00 H new ATOM 1538 N GLN A 217 6.805 5.357 1.561 1.00 0.00 N ATOM 1539 CA GLN A 217 7.840 4.360 1.822 1.00 0.00 C ATOM 1540 C GLN A 217 9.038 4.534 0.887 1.00 0.00 C ATOM 1541 O GLN A 217 10.181 4.406 1.324 1.00 0.00 O ATOM 1542 CB GLN A 217 7.285 2.927 1.707 1.00 0.00 C ATOM 1543 CG GLN A 217 7.177 2.134 3.014 1.00 0.00 C ATOM 1544 CD GLN A 217 8.305 2.376 3.997 1.00 0.00 C ATOM 1545 OE1 GLN A 217 8.201 3.234 4.866 1.00 0.00 O ATOM 1546 NE2 GLN A 217 9.397 1.643 3.906 1.00 0.00 N ATOM 0 H GLN A 217 5.910 4.968 1.264 1.00 0.00 H new ATOM 0 HA GLN A 217 8.178 4.518 2.846 1.00 0.00 H new ATOM 0 HB2 GLN A 217 6.294 2.979 1.255 1.00 0.00 H new ATOM 0 HB3 GLN A 217 7.920 2.368 1.019 1.00 0.00 H new ATOM 0 HG2 GLN A 217 6.232 2.383 3.497 1.00 0.00 H new ATOM 0 HG3 GLN A 217 7.142 1.071 2.776 1.00 0.00 H new ATOM 0 HE21 GLN A 217 9.474 0.931 3.179 1.00 0.00 H new ATOM 0 HE22 GLN A 217 10.164 1.788 4.562 1.00 0.00 H new ATOM 1555 N TYR A 218 8.790 4.852 -0.384 1.00 0.00 N ATOM 1556 CA TYR A 218 9.831 5.205 -1.331 1.00 0.00 C ATOM 1557 C TYR A 218 10.586 6.424 -0.814 1.00 0.00 C ATOM 1558 O TYR A 218 11.814 6.422 -0.745 1.00 0.00 O ATOM 1559 CB TYR A 218 9.211 5.491 -2.704 1.00 0.00 C ATOM 1560 CG TYR A 218 10.220 5.978 -3.720 1.00 0.00 C ATOM 1561 CD1 TYR A 218 11.240 5.116 -4.153 1.00 0.00 C ATOM 1562 CD2 TYR A 218 10.189 7.306 -4.179 1.00 0.00 C ATOM 1563 CE1 TYR A 218 12.194 5.554 -5.083 1.00 0.00 C ATOM 1564 CE2 TYR A 218 11.151 7.758 -5.097 1.00 0.00 C ATOM 1565 CZ TYR A 218 12.137 6.871 -5.586 1.00 0.00 C ATOM 1566 OH TYR A 218 13.042 7.267 -6.523 1.00 0.00 O ATOM 0 H TYR A 218 7.851 4.870 -0.782 1.00 0.00 H new ATOM 0 HA TYR A 218 10.530 4.376 -1.439 1.00 0.00 H new ATOM 0 HB2 TYR A 218 8.736 4.584 -3.078 1.00 0.00 H new ATOM 0 HB3 TYR A 218 8.426 6.239 -2.593 1.00 0.00 H new ATOM 0 HD1 TYR A 218 11.290 4.109 -3.767 1.00 0.00 H new ATOM 0 HD2 TYR A 218 9.424 7.981 -3.825 1.00 0.00 H new ATOM 0 HE1 TYR A 218 12.973 4.883 -5.414 1.00 0.00 H new ATOM 0 HE2 TYR A 218 11.137 8.785 -5.430 1.00 0.00 H new ATOM 0 HH TYR A 218 12.871 8.200 -6.769 1.00 0.00 H new ATOM 1576 N GLN A 219 9.852 7.477 -0.449 1.00 0.00 N ATOM 1577 CA GLN A 219 10.449 8.729 -0.025 1.00 0.00 C ATOM 1578 C GLN A 219 11.266 8.556 1.256 1.00 0.00 C ATOM 1579 O GLN A 219 12.373 9.102 1.317 1.00 0.00 O ATOM 1580 CB GLN A 219 9.379 9.825 0.080 1.00 0.00 C ATOM 1581 CG GLN A 219 8.843 10.116 -1.328 1.00 0.00 C ATOM 1582 CD GLN A 219 8.018 11.383 -1.421 1.00 0.00 C ATOM 1583 OE1 GLN A 219 6.736 11.270 -1.700 1.00 0.00 O flip ATOM 1584 NE2 GLN A 219 8.547 12.484 -1.299 1.00 0.00 N flip ATOM 0 H GLN A 219 8.832 7.479 -0.442 1.00 0.00 H new ATOM 0 HA GLN A 219 11.160 9.054 -0.785 1.00 0.00 H new ATOM 0 HB2 GLN A 219 8.569 9.503 0.735 1.00 0.00 H new ATOM 0 HB3 GLN A 219 9.803 10.728 0.518 1.00 0.00 H new ATOM 0 HG2 GLN A 219 9.684 10.190 -2.018 1.00 0.00 H new ATOM 0 HG3 GLN A 219 8.235 9.273 -1.656 1.00 0.00 H new ATOM 0 HE21 GLN A 219 9.542 12.551 -1.083 1.00 0.00 H new ATOM 0 HE22 GLN A 219 7.992 13.332 -1.414 1.00 0.00 H new ATOM 1593 N LYS A 220 10.775 7.770 2.223 1.00 0.00 N ATOM 1594 CA LYS A 220 11.481 7.298 3.395 1.00 0.00 C ATOM 1595 C LYS A 220 12.761 6.627 2.950 1.00 0.00 C ATOM 1596 O LYS A 220 13.811 7.157 3.277 1.00 0.00 O ATOM 1597 CB LYS A 220 10.660 6.303 4.229 1.00 0.00 C ATOM 1598 CG LYS A 220 9.559 6.870 5.126 1.00 0.00 C ATOM 1599 CD LYS A 220 9.484 6.019 6.402 1.00 0.00 C ATOM 1600 CE LYS A 220 8.188 6.275 7.151 1.00 0.00 C ATOM 1601 NZ LYS A 220 8.353 6.165 8.617 1.00 0.00 N ATOM 0 H LYS A 220 9.813 7.432 2.195 1.00 0.00 H new ATOM 0 HA LYS A 220 11.680 8.162 4.029 1.00 0.00 H new ATOM 0 HB2 LYS A 220 10.201 5.589 3.545 1.00 0.00 H new ATOM 0 HB3 LYS A 220 11.351 5.742 4.859 1.00 0.00 H new ATOM 0 HG2 LYS A 220 9.772 7.909 5.376 1.00 0.00 H new ATOM 0 HG3 LYS A 220 8.602 6.857 4.605 1.00 0.00 H new ATOM 0 HD2 LYS A 220 9.556 4.963 6.144 1.00 0.00 H new ATOM 0 HD3 LYS A 220 10.332 6.248 7.047 1.00 0.00 H new ATOM 0 HE2 LYS A 220 7.819 7.270 6.903 1.00 0.00 H new ATOM 0 HE3 LYS A 220 7.433 5.563 6.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 7.442 6.348 9.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 8.680 5.208 8.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 9.054 6.862 8.941 1.00 0.00 H new ATOM 1615 N GLU A 221 12.704 5.510 2.222 1.00 0.00 N ATOM 1616 CA GLU A 221 13.888 4.729 1.879 1.00 0.00 C ATOM 1617 C GLU A 221 14.937 5.595 1.171 1.00 0.00 C ATOM 1618 O GLU A 221 16.109 5.522 1.542 1.00 0.00 O ATOM 1619 CB GLU A 221 13.521 3.509 1.018 1.00 0.00 C ATOM 1620 CG GLU A 221 13.087 2.259 1.796 1.00 0.00 C ATOM 1621 CD GLU A 221 14.242 1.642 2.602 1.00 0.00 C ATOM 1622 OE1 GLU A 221 15.057 0.859 2.054 1.00 0.00 O ATOM 1623 OE2 GLU A 221 14.342 1.935 3.817 1.00 0.00 O ATOM 0 H GLU A 221 11.834 5.124 1.855 1.00 0.00 H new ATOM 0 HA GLU A 221 14.322 4.366 2.811 1.00 0.00 H new ATOM 0 HB2 GLU A 221 12.715 3.793 0.341 1.00 0.00 H new ATOM 0 HB3 GLU A 221 14.380 3.251 0.399 1.00 0.00 H new ATOM 0 HG2 GLU A 221 12.273 2.520 2.473 1.00 0.00 H new ATOM 0 HG3 GLU A 221 12.697 1.517 1.099 1.00 0.00 H new ATOM 1630 N SER A 222 14.530 6.440 0.216 1.00 0.00 N ATOM 1631 CA SER A 222 15.395 7.427 -0.421 1.00 0.00 C ATOM 1632 C SER A 222 16.071 8.324 0.618 1.00 0.00 C ATOM 1633 O SER A 222 17.294 8.451 0.615 1.00 0.00 O ATOM 1634 CB SER A 222 14.587 8.281 -1.407 1.00 0.00 C ATOM 1635 OG SER A 222 14.332 7.606 -2.621 1.00 0.00 O ATOM 0 H SER A 222 13.574 6.453 -0.138 1.00 0.00 H new ATOM 0 HA SER A 222 16.173 6.891 -0.964 1.00 0.00 H new ATOM 0 HB2 SER A 222 13.641 8.565 -0.947 1.00 0.00 H new ATOM 0 HB3 SER A 222 15.130 9.203 -1.614 1.00 0.00 H new ATOM 0 HG SER A 222 13.814 8.187 -3.216 1.00 0.00 H new ATOM 1641 N GLN A 223 15.305 8.946 1.516 1.00 0.00 N ATOM 1642 CA GLN A 223 15.842 9.842 2.517 1.00 0.00 C ATOM 1643 C GLN A 223 16.751 9.075 3.472 1.00 0.00 C ATOM 1644 O GLN A 223 17.821 9.556 3.808 1.00 0.00 O ATOM 1645 CB GLN A 223 14.678 10.567 3.208 1.00 0.00 C ATOM 1646 CG GLN A 223 14.931 11.009 4.656 1.00 0.00 C ATOM 1647 CD GLN A 223 14.468 10.055 5.763 1.00 0.00 C ATOM 1648 OE1 GLN A 223 13.769 8.962 5.473 1.00 0.00 O flip ATOM 1649 NE2 GLN A 223 14.729 10.342 6.925 1.00 0.00 N flip ATOM 0 H GLN A 223 14.292 8.836 1.562 1.00 0.00 H new ATOM 0 HA GLN A 223 16.471 10.608 2.064 1.00 0.00 H new ATOM 0 HB2 GLN A 223 14.422 11.448 2.619 1.00 0.00 H new ATOM 0 HB3 GLN A 223 13.807 9.911 3.195 1.00 0.00 H new ATOM 0 HG2 GLN A 223 16.001 11.176 4.778 1.00 0.00 H new ATOM 0 HG3 GLN A 223 14.439 11.970 4.808 1.00 0.00 H new ATOM 0 HE21 GLN A 223 15.266 11.183 7.134 1.00 0.00 H new ATOM 0 HE22 GLN A 223 14.409 9.739 7.683 1.00 0.00 H new ATOM 1658 N ALA A 224 16.363 7.886 3.907 1.00 0.00 N ATOM 1659 CA ALA A 224 17.106 7.107 4.873 1.00 0.00 C ATOM 1660 C ALA A 224 18.436 6.615 4.288 1.00 0.00 C ATOM 1661 O ALA A 224 19.388 6.419 5.034 1.00 0.00 O ATOM 1662 CB ALA A 224 16.192 5.977 5.343 1.00 0.00 C ATOM 0 H ALA A 224 15.507 7.431 3.590 1.00 0.00 H new ATOM 0 HA ALA A 224 17.390 7.713 5.733 1.00 0.00 H new ATOM 0 HB1 ALA A 224 16.718 5.364 6.075 1.00 0.00 H new ATOM 0 HB2 ALA A 224 15.297 6.399 5.799 1.00 0.00 H new ATOM 0 HB3 ALA A 224 15.908 5.360 4.490 1.00 0.00 H new ATOM 1668 N ALA A 225 18.536 6.503 2.962 1.00 0.00 N ATOM 1669 CA ALA A 225 19.770 6.274 2.234 1.00 0.00 C ATOM 1670 C ALA A 225 20.575 7.580 2.238 1.00 0.00 C ATOM 1671 O ALA A 225 21.699 7.635 2.736 1.00 0.00 O ATOM 1672 CB ALA A 225 19.436 5.785 0.807 1.00 0.00 C ATOM 0 H ALA A 225 17.724 6.573 2.349 1.00 0.00 H new ATOM 0 HA ALA A 225 20.376 5.499 2.703 1.00 0.00 H new ATOM 0 HB1 ALA A 225 20.360 5.612 0.256 1.00 0.00 H new ATOM 0 HB2 ALA A 225 18.868 4.856 0.864 1.00 0.00 H new ATOM 0 HB3 ALA A 225 18.844 6.542 0.292 1.00 0.00 H new ATOM 1678 N ALA A 226 19.966 8.641 1.707 1.00 0.00 N ATOM 1679 CA ALA A 226 20.576 9.930 1.418 1.00 0.00 C ATOM 1680 C ALA A 226 21.011 10.743 2.633 1.00 0.00 C ATOM 1681 O ALA A 226 21.869 11.613 2.493 1.00 0.00 O ATOM 1682 CB ALA A 226 19.543 10.757 0.661 1.00 0.00 C ATOM 0 H ALA A 226 18.978 8.618 1.455 1.00 0.00 H new ATOM 0 HA ALA A 226 21.487 9.717 0.858 1.00 0.00 H new ATOM 0 HB1 ALA A 226 19.962 11.735 0.424 1.00 0.00 H new ATOM 0 HB2 ALA A 226 19.273 10.245 -0.262 1.00 0.00 H new ATOM 0 HB3 ALA A 226 18.654 10.883 1.279 1.00 0.00 H new ATOM 1688 N ASP A 227 20.368 10.503 3.769 1.00 0.00 N ATOM 1689 CA ASP A 227 20.527 11.174 5.055 1.00 0.00 C ATOM 1690 C ASP A 227 21.001 10.150 6.095 1.00 0.00 C ATOM 1691 O ASP A 227 21.268 10.499 7.241 1.00 0.00 O ATOM 1692 CB ASP A 227 19.182 11.815 5.460 1.00 0.00 C ATOM 1693 CG ASP A 227 19.227 12.891 6.554 1.00 0.00 C ATOM 1694 OD1 ASP A 227 20.315 13.341 6.990 1.00 0.00 O ATOM 1695 OD2 ASP A 227 18.116 13.293 6.981 1.00 0.00 O ATOM 0 H ASP A 227 19.660 9.770 3.819 1.00 0.00 H new ATOM 0 HA ASP A 227 21.273 11.966 4.990 1.00 0.00 H new ATOM 0 HB2 ASP A 227 18.734 12.255 4.569 1.00 0.00 H new ATOM 0 HB3 ASP A 227 18.514 11.020 5.793 1.00 0.00 H new ATOM 1700 N GLY A 228 21.079 8.858 5.738 1.00 0.00 N ATOM 1701 CA GLY A 228 21.573 7.814 6.635 1.00 0.00 C ATOM 1702 C GLY A 228 20.592 7.479 7.764 1.00 0.00 C ATOM 1703 O GLY A 228 20.958 6.775 8.706 1.00 0.00 O ATOM 0 H GLY A 228 20.800 8.513 4.819 1.00 0.00 H new ATOM 0 HA2 GLY A 228 21.775 6.912 6.057 1.00 0.00 H new ATOM 0 HA3 GLY A 228 22.521 8.134 7.068 1.00 0.00 H new ATOM 1707 N ARG A 229 19.354 7.982 7.701 1.00 0.00 N ATOM 1708 CA ARG A 229 18.281 7.836 8.690 1.00 0.00 C ATOM 1709 C ARG A 229 17.592 6.469 8.544 1.00 0.00 C ATOM 1710 O ARG A 229 16.370 6.389 8.388 1.00 0.00 O ATOM 1711 CB ARG A 229 17.276 8.991 8.503 1.00 0.00 C ATOM 1712 CG ARG A 229 17.864 10.393 8.709 1.00 0.00 C ATOM 1713 CD ARG A 229 17.824 10.864 10.166 1.00 0.00 C ATOM 1714 NE ARG A 229 19.033 11.633 10.492 1.00 0.00 N ATOM 1715 CZ ARG A 229 19.256 12.452 11.521 1.00 0.00 C ATOM 1716 NH1 ARG A 229 18.274 12.834 12.333 1.00 0.00 N ATOM 1717 NH2 ARG A 229 20.493 12.890 11.705 1.00 0.00 N ATOM 0 H ARG A 229 19.055 8.541 6.902 1.00 0.00 H new ATOM 0 HA ARG A 229 18.697 7.882 9.696 1.00 0.00 H new ATOM 0 HB2 ARG A 229 16.858 8.931 7.498 1.00 0.00 H new ATOM 0 HB3 ARG A 229 16.450 8.852 9.201 1.00 0.00 H new ATOM 0 HG2 ARG A 229 18.897 10.400 8.361 1.00 0.00 H new ATOM 0 HG3 ARG A 229 17.315 11.103 8.091 1.00 0.00 H new ATOM 0 HD2 ARG A 229 16.939 11.479 10.331 1.00 0.00 H new ATOM 0 HD3 ARG A 229 17.743 10.004 10.830 1.00 0.00 H new ATOM 0 HE ARG A 229 19.810 11.526 9.840 1.00 0.00 H new ATOM 0 HH11 ARG A 229 17.323 12.500 12.176 1.00 0.00 H new ATOM 0 HH12 ARG A 229 18.472 13.461 13.113 1.00 0.00 H new ATOM 0 HH21 ARG A 229 21.237 12.599 11.070 1.00 0.00 H new ATOM 0 HH22 ARG A 229 20.702 13.518 12.481 1.00 0.00 H new