USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=29 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 172 GLN : amide:sc= 1.11 X(o=2.1,f=1.8) USER MOD Set 1.2: A 215 THR OG1 : rot -146:sc= 0.948 USER MOD Set 2.1: A 139 MET CE :methyl 163:sc= -1.45 (180deg=-2.79) USER MOD Set 2.2: A 212 GLN : amide:sc= 0.182 K(o=-1.3,f=-8.3!) USER MOD Set 3.1: A 192 THR OG1 : rot 1:sc= 1.21 USER MOD Set 3.2: A 197 ASN : amide:sc= 0 X(o=1.2,f=1) USER MOD Set 4.1: A 181 ASN : amide:sc= 0.967 K(o=2.2,f=-4.4) USER MOD Set 4.2: A 185 LYS NZ :NH3+ 169:sc= 1.28 (180deg=-0.0434) USER MOD Set 5.1: A 169 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 222 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 149 TYR OH : rot 180:sc= 0 USER MOD Set 6.2: A 199 THR OG1 : rot -92:sc= 2.47 USER MOD Set 6.3: A 201 THR OG1 : rot 24:sc= 1.28 USER MOD Set 7.1: A 132 SER OG : rot 56:sc= 1.24 USER MOD Set 7.2: A 163 TYR OH : rot 38:sc= 0.991 USER MOD Set 7.3: A 217 GLN : amide:sc= 0.216 X(o=2.4,f=2.8) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 134 MET CE :methyl 138:sc= -1.68 (180deg=-5.41!) USER MOD Single : A 135 SER OG : rot 180:sc= 0.0429 USER MOD Single : A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 140 HIS : no HE2:sc= 1.04 K(o=1,f=-4.3!) USER MOD Single : A 143 ASN : amide:sc= -0.418 X(o=-0.42,f=-0.0059) USER MOD Single : A 150 TYR OH : rot 43:sc= 1.18 USER MOD Single : A 153 ASN : amide:sc= 1.02 K(o=1,f=-0.4) USER MOD Single : A 154 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 155 ASN : amide:sc= -0.0426 K(o=-0.043,f=-1.9!) USER MOD Single : A 157 TYR OH : rot -131:sc= 0.0891 USER MOD Single : A 159 ASN : amide:sc= -0.463 X(o=-0.46,f=-0.024) USER MOD Single : A 160 GLN : amide:sc= -0.794 K(o=-0.79,f=-0.096) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= 0.713 K(o=0.71,f=-1.2) USER MOD Single : A 170 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 171 ASN : amide:sc= -0.084 X(o=-0.084,f=-0.084) USER MOD Single : A 173 ASN : amide:sc= 0.0316 K(o=0.032,f=-1.4!) USER MOD Single : A 174 ASN : amide:sc= -0.427 X(o=-0.43,f=-0.56) USER MOD Single : A 177 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 183 THR OG1 : rot 105:sc= 0.858 USER MOD Single : A 186 GLN : amide:sc= -0.564 X(o=-0.56,f=-0.56) USER MOD Single : A 187 HIS : no HD1:sc= -0.541 X(o=-0.54,f=-0.61) USER MOD Single : A 188 THR OG1 : rot -79:sc= 1.11 USER MOD Single : A 190 THR OG1 : rot 105:sc= 1.12 USER MOD Single : A 191 THR OG1 : rot -30:sc= 0.344 USER MOD Single : A 193 THR OG1 : rot -35:sc= 1.32 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 206 MET CE :methyl 169:sc= -1.32 (180deg=-1.38) USER MOD Single : A 213 MET CE :methyl -168:sc= -0.421 (180deg=-0.63) USER MOD Single : A 216 THR OG1 : rot 101:sc= 1.26 USER MOD Single : A 218 TYR OH : rot -29:sc= 0.641 USER MOD Single : A 219 GLN : amide:sc= -1.63! C(o=-1.6!,f=-1.9!) USER MOD Single : A 220 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 223 GLN : amide:sc= 1.06 K(o=1.1,f=0) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 125 10.406 -12.890 -3.673 1.00 0.00 N ATOM 2 CA LEU A 125 9.461 -11.917 -4.215 1.00 0.00 C ATOM 3 C LEU A 125 9.730 -11.657 -5.696 1.00 0.00 C ATOM 4 O LEU A 125 8.842 -11.843 -6.531 1.00 0.00 O ATOM 5 CB LEU A 125 9.488 -10.627 -3.386 1.00 0.00 C ATOM 6 CG LEU A 125 9.100 -10.786 -1.906 1.00 0.00 C ATOM 7 CD1 LEU A 125 8.519 -9.463 -1.414 1.00 0.00 C ATOM 8 CD2 LEU A 125 8.045 -11.853 -1.659 1.00 0.00 C ATOM 0 HA LEU A 125 8.455 -12.330 -4.146 1.00 0.00 H new ATOM 0 HB2 LEU A 125 10.491 -10.203 -3.438 1.00 0.00 H new ATOM 0 HB3 LEU A 125 8.813 -9.905 -3.846 1.00 0.00 H new ATOM 0 HG LEU A 125 10.007 -11.082 -1.379 1.00 0.00 H new ATOM 0 HD11 LEU A 125 8.238 -9.557 -0.365 1.00 0.00 H new ATOM 0 HD12 LEU A 125 9.265 -8.676 -1.521 1.00 0.00 H new ATOM 0 HD13 LEU A 125 7.638 -9.210 -2.005 1.00 0.00 H new ATOM 0 HD21 LEU A 125 7.824 -11.906 -0.593 1.00 0.00 H new ATOM 0 HD22 LEU A 125 7.137 -11.600 -2.206 1.00 0.00 H new ATOM 0 HD23 LEU A 125 8.417 -12.819 -2.001 1.00 0.00 H new ATOM 20 N GLY A 126 10.967 -11.260 -5.989 1.00 0.00 N ATOM 21 CA GLY A 126 11.543 -11.084 -7.326 1.00 0.00 C ATOM 22 C GLY A 126 12.499 -9.888 -7.439 1.00 0.00 C ATOM 23 O GLY A 126 13.269 -9.802 -8.395 1.00 0.00 O ATOM 0 H GLY A 126 11.638 -11.038 -5.254 1.00 0.00 H new ATOM 0 HA2 GLY A 126 12.079 -11.992 -7.603 1.00 0.00 H new ATOM 0 HA3 GLY A 126 10.734 -10.959 -8.046 1.00 0.00 H new ATOM 27 N GLY A 127 12.473 -8.986 -6.452 1.00 0.00 N ATOM 28 CA GLY A 127 13.288 -7.768 -6.411 1.00 0.00 C ATOM 29 C GLY A 127 12.653 -6.641 -5.598 1.00 0.00 C ATOM 30 O GLY A 127 12.862 -5.476 -5.928 1.00 0.00 O ATOM 0 H GLY A 127 11.868 -9.086 -5.637 1.00 0.00 H new ATOM 0 HA2 GLY A 127 14.264 -8.006 -5.988 1.00 0.00 H new ATOM 0 HA3 GLY A 127 13.459 -7.420 -7.430 1.00 0.00 H new ATOM 34 N TYR A 128 11.869 -6.972 -4.560 1.00 0.00 N ATOM 35 CA TYR A 128 11.099 -6.004 -3.793 1.00 0.00 C ATOM 36 C TYR A 128 11.583 -5.996 -2.332 1.00 0.00 C ATOM 37 O TYR A 128 12.310 -6.894 -1.911 1.00 0.00 O ATOM 38 CB TYR A 128 9.603 -6.326 -3.911 1.00 0.00 C ATOM 39 CG TYR A 128 9.070 -6.579 -5.320 1.00 0.00 C ATOM 40 CD1 TYR A 128 9.224 -7.853 -5.904 1.00 0.00 C ATOM 41 CD2 TYR A 128 8.386 -5.578 -6.035 1.00 0.00 C ATOM 42 CE1 TYR A 128 8.747 -8.119 -7.201 1.00 0.00 C ATOM 43 CE2 TYR A 128 7.875 -5.845 -7.321 1.00 0.00 C ATOM 44 CZ TYR A 128 8.085 -7.106 -7.923 1.00 0.00 C ATOM 45 OH TYR A 128 7.718 -7.324 -9.216 1.00 0.00 O ATOM 0 H TYR A 128 11.757 -7.932 -4.233 1.00 0.00 H new ATOM 0 HA TYR A 128 11.250 -5.001 -4.191 1.00 0.00 H new ATOM 0 HB2 TYR A 128 9.395 -7.207 -3.304 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.041 -5.499 -3.477 1.00 0.00 H new ATOM 0 HD1 TYR A 128 9.716 -8.637 -5.347 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.252 -4.600 -5.596 1.00 0.00 H new ATOM 0 HE1 TYR A 128 8.888 -9.095 -7.641 1.00 0.00 H new ATOM 0 HE2 TYR A 128 7.321 -5.083 -7.848 1.00 0.00 H new ATOM 0 HH TYR A 128 7.271 -6.526 -9.568 1.00 0.00 H new ATOM 55 N MET A 129 11.201 -4.953 -1.588 1.00 0.00 N ATOM 56 CA MET A 129 11.715 -4.550 -0.270 1.00 0.00 C ATOM 57 C MET A 129 10.592 -3.896 0.560 1.00 0.00 C ATOM 58 O MET A 129 9.956 -2.961 0.079 1.00 0.00 O ATOM 59 CB MET A 129 12.801 -3.498 -0.536 1.00 0.00 C ATOM 60 CG MET A 129 14.005 -3.994 -1.340 1.00 0.00 C ATOM 61 SD MET A 129 15.305 -2.744 -1.480 1.00 0.00 S ATOM 62 CE MET A 129 16.342 -3.516 -2.746 1.00 0.00 C ATOM 0 H MET A 129 10.470 -4.320 -1.913 1.00 0.00 H new ATOM 0 HA MET A 129 12.097 -5.412 0.278 1.00 0.00 H new ATOM 0 HB2 MET A 129 12.350 -2.660 -1.067 1.00 0.00 H new ATOM 0 HB3 MET A 129 13.156 -3.115 0.421 1.00 0.00 H new ATOM 0 HG2 MET A 129 14.413 -4.886 -0.865 1.00 0.00 H new ATOM 0 HG3 MET A 129 13.677 -4.286 -2.338 1.00 0.00 H new ATOM 0 HE1 MET A 129 17.198 -2.874 -2.956 1.00 0.00 H new ATOM 0 HE2 MET A 129 16.693 -4.484 -2.388 1.00 0.00 H new ATOM 0 HE3 MET A 129 15.760 -3.656 -3.657 1.00 0.00 H new ATOM 72 N LEU A 130 10.320 -4.373 1.783 1.00 0.00 N ATOM 73 CA LEU A 130 9.283 -3.845 2.677 1.00 0.00 C ATOM 74 C LEU A 130 9.761 -2.592 3.431 1.00 0.00 C ATOM 75 O LEU A 130 10.370 -2.699 4.504 1.00 0.00 O ATOM 76 CB LEU A 130 8.867 -4.972 3.629 1.00 0.00 C ATOM 77 CG LEU A 130 7.574 -4.758 4.415 1.00 0.00 C ATOM 78 CD1 LEU A 130 6.358 -4.625 3.507 1.00 0.00 C ATOM 79 CD2 LEU A 130 7.368 -5.938 5.363 1.00 0.00 C ATOM 0 H LEU A 130 10.830 -5.158 2.187 1.00 0.00 H new ATOM 0 HA LEU A 130 8.420 -3.520 2.096 1.00 0.00 H new ATOM 0 HB2 LEU A 130 8.766 -5.889 3.048 1.00 0.00 H new ATOM 0 HB3 LEU A 130 9.676 -5.133 4.341 1.00 0.00 H new ATOM 0 HG LEU A 130 7.672 -3.824 4.969 1.00 0.00 H new ATOM 0 HD11 LEU A 130 5.465 -4.475 4.114 1.00 0.00 H new ATOM 0 HD12 LEU A 130 6.492 -3.772 2.842 1.00 0.00 H new ATOM 0 HD13 LEU A 130 6.245 -5.533 2.915 1.00 0.00 H new ATOM 0 HD21 LEU A 130 6.447 -5.794 5.928 1.00 0.00 H new ATOM 0 HD22 LEU A 130 7.299 -6.860 4.786 1.00 0.00 H new ATOM 0 HD23 LEU A 130 8.210 -6.003 6.052 1.00 0.00 H new ATOM 91 N GLY A 131 9.490 -1.418 2.855 1.00 0.00 N ATOM 92 CA GLY A 131 9.977 -0.100 3.279 1.00 0.00 C ATOM 93 C GLY A 131 9.962 0.174 4.781 1.00 0.00 C ATOM 94 O GLY A 131 10.999 0.192 5.453 1.00 0.00 O ATOM 0 H GLY A 131 8.890 -1.357 2.032 1.00 0.00 H new ATOM 0 HA2 GLY A 131 10.999 0.019 2.919 1.00 0.00 H new ATOM 0 HA3 GLY A 131 9.374 0.663 2.786 1.00 0.00 H new ATOM 98 N SER A 132 8.752 0.443 5.271 1.00 0.00 N ATOM 99 CA SER A 132 8.406 0.907 6.602 1.00 0.00 C ATOM 100 C SER A 132 6.879 0.994 6.670 1.00 0.00 C ATOM 101 O SER A 132 6.194 1.032 5.645 1.00 0.00 O ATOM 102 CB SER A 132 9.028 2.281 6.928 1.00 0.00 C ATOM 103 OG SER A 132 9.465 3.056 5.823 1.00 0.00 O ATOM 0 H SER A 132 7.921 0.330 4.691 1.00 0.00 H new ATOM 0 HA SER A 132 8.802 0.208 7.339 1.00 0.00 H new ATOM 0 HB2 SER A 132 8.295 2.864 7.485 1.00 0.00 H new ATOM 0 HB3 SER A 132 9.879 2.122 7.591 1.00 0.00 H new ATOM 0 HG SER A 132 8.721 3.183 5.198 1.00 0.00 H new ATOM 109 N ALA A 133 6.338 0.965 7.884 1.00 0.00 N ATOM 110 CA ALA A 133 4.905 1.026 8.111 1.00 0.00 C ATOM 111 C ALA A 133 4.309 2.423 7.969 1.00 0.00 C ATOM 112 O ALA A 133 4.954 3.451 8.218 1.00 0.00 O ATOM 113 CB ALA A 133 4.623 0.438 9.490 1.00 0.00 C ATOM 0 H ALA A 133 6.888 0.898 8.740 1.00 0.00 H new ATOM 0 HA ALA A 133 4.415 0.444 7.331 1.00 0.00 H new ATOM 0 HB1 ALA A 133 3.552 0.471 9.688 1.00 0.00 H new ATOM 0 HB2 ALA A 133 4.966 -0.596 9.522 1.00 0.00 H new ATOM 0 HB3 ALA A 133 5.150 1.018 10.248 1.00 0.00 H new ATOM 119 N MET A 134 3.030 2.419 7.599 1.00 0.00 N ATOM 120 CA MET A 134 2.210 3.605 7.454 1.00 0.00 C ATOM 121 C MET A 134 1.827 4.229 8.783 1.00 0.00 C ATOM 122 O MET A 134 1.522 3.577 9.789 1.00 0.00 O ATOM 123 CB MET A 134 0.977 3.295 6.603 1.00 0.00 C ATOM 124 CG MET A 134 -0.009 2.329 7.250 1.00 0.00 C ATOM 125 SD MET A 134 -1.459 1.935 6.234 1.00 0.00 S ATOM 126 CE MET A 134 -0.669 1.290 4.727 1.00 0.00 C ATOM 0 H MET A 134 2.526 1.558 7.386 1.00 0.00 H new ATOM 0 HA MET A 134 2.814 4.353 6.939 1.00 0.00 H new ATOM 0 HB2 MET A 134 0.460 4.228 6.381 1.00 0.00 H new ATOM 0 HB3 MET A 134 1.304 2.878 5.651 1.00 0.00 H new ATOM 0 HG2 MET A 134 0.514 1.403 7.488 1.00 0.00 H new ATOM 0 HG3 MET A 134 -0.348 2.755 8.194 1.00 0.00 H new ATOM 0 HE1 MET A 134 -1.212 0.411 4.379 1.00 0.00 H new ATOM 0 HE2 MET A 134 -0.684 2.056 3.952 1.00 0.00 H new ATOM 0 HE3 MET A 134 0.363 1.016 4.946 1.00 0.00 H new ATOM 136 N SER A 135 1.832 5.550 8.709 1.00 0.00 N ATOM 137 CA SER A 135 1.691 6.548 9.731 1.00 0.00 C ATOM 138 C SER A 135 0.229 6.695 10.160 1.00 0.00 C ATOM 139 O SER A 135 -0.321 7.797 10.142 1.00 0.00 O ATOM 140 CB SER A 135 2.309 7.821 9.137 1.00 0.00 C ATOM 141 OG SER A 135 3.330 7.565 8.169 1.00 0.00 O ATOM 0 H SER A 135 1.952 5.996 7.800 1.00 0.00 H new ATOM 0 HA SER A 135 2.204 6.288 10.657 1.00 0.00 H new ATOM 0 HB2 SER A 135 1.521 8.415 8.673 1.00 0.00 H new ATOM 0 HB3 SER A 135 2.728 8.422 9.944 1.00 0.00 H new ATOM 0 HG SER A 135 3.680 8.415 7.830 1.00 0.00 H new ATOM 147 N ARG A 136 -0.392 5.561 10.529 1.00 0.00 N ATOM 148 CA ARG A 136 -1.821 5.321 10.787 1.00 0.00 C ATOM 149 C ARG A 136 -2.718 6.389 10.138 1.00 0.00 C ATOM 150 O ARG A 136 -3.172 7.319 10.816 1.00 0.00 O ATOM 151 CB ARG A 136 -2.093 5.059 12.280 1.00 0.00 C ATOM 152 CG ARG A 136 -1.740 6.125 13.335 1.00 0.00 C ATOM 153 CD ARG A 136 -0.240 6.166 13.655 1.00 0.00 C ATOM 154 NE ARG A 136 0.411 7.356 13.094 1.00 0.00 N ATOM 155 CZ ARG A 136 1.712 7.609 13.083 1.00 0.00 C ATOM 156 NH1 ARG A 136 2.603 6.754 13.515 1.00 0.00 N ATOM 157 NH2 ARG A 136 2.182 8.723 12.582 1.00 0.00 N ATOM 0 H ARG A 136 0.148 4.707 10.667 1.00 0.00 H new ATOM 0 HA ARG A 136 -2.105 4.396 10.286 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -3.157 4.845 12.381 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -1.558 4.149 12.550 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -2.058 7.104 12.977 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -2.297 5.924 14.250 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -0.100 6.152 14.736 1.00 0.00 H new ATOM 0 HD3 ARG A 136 0.239 5.270 13.260 1.00 0.00 H new ATOM 0 HE ARG A 136 -0.198 8.057 12.671 1.00 0.00 H new ATOM 0 HH11 ARG A 136 2.306 5.849 13.880 1.00 0.00 H new ATOM 0 HH12 ARG A 136 3.594 6.993 13.487 1.00 0.00 H new ATOM 0 HH21 ARG A 136 1.544 9.415 12.191 1.00 0.00 H new ATOM 0 HH22 ARG A 136 3.187 8.899 12.583 1.00 0.00 H new ATOM 171 N PRO A 137 -2.899 6.325 8.805 1.00 0.00 N ATOM 172 CA PRO A 137 -3.500 7.428 8.077 1.00 0.00 C ATOM 173 C PRO A 137 -4.968 7.640 8.445 1.00 0.00 C ATOM 174 O PRO A 137 -5.716 6.702 8.730 1.00 0.00 O ATOM 175 CB PRO A 137 -3.290 7.118 6.594 1.00 0.00 C ATOM 176 CG PRO A 137 -3.152 5.602 6.549 1.00 0.00 C ATOM 177 CD PRO A 137 -2.520 5.252 7.889 1.00 0.00 C ATOM 0 HA PRO A 137 -3.029 8.376 8.339 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -4.132 7.460 5.992 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -2.399 7.611 6.206 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -4.120 5.116 6.425 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -2.526 5.282 5.716 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -2.877 4.287 8.249 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -1.436 5.178 7.802 1.00 0.00 H new ATOM 185 N MET A 138 -5.373 8.905 8.351 1.00 0.00 N ATOM 186 CA MET A 138 -6.749 9.396 8.494 1.00 0.00 C ATOM 187 C MET A 138 -7.082 10.185 7.228 1.00 0.00 C ATOM 188 O MET A 138 -7.440 11.362 7.234 1.00 0.00 O ATOM 189 CB MET A 138 -6.955 10.140 9.822 1.00 0.00 C ATOM 190 CG MET A 138 -5.943 11.262 10.063 1.00 0.00 C ATOM 191 SD MET A 138 -6.217 12.159 11.608 1.00 0.00 S ATOM 192 CE MET A 138 -4.773 13.241 11.512 1.00 0.00 C ATOM 0 H MET A 138 -4.715 9.661 8.162 1.00 0.00 H new ATOM 0 HA MET A 138 -7.467 8.579 8.569 1.00 0.00 H new ATOM 0 HB2 MET A 138 -7.961 10.560 9.841 1.00 0.00 H new ATOM 0 HB3 MET A 138 -6.893 9.425 10.642 1.00 0.00 H new ATOM 0 HG2 MET A 138 -4.938 10.839 10.071 1.00 0.00 H new ATOM 0 HG3 MET A 138 -5.987 11.965 9.231 1.00 0.00 H new ATOM 0 HE1 MET A 138 -4.748 13.892 12.386 1.00 0.00 H new ATOM 0 HE2 MET A 138 -3.867 12.636 11.483 1.00 0.00 H new ATOM 0 HE3 MET A 138 -4.833 13.848 10.609 1.00 0.00 H new ATOM 202 N MET A 139 -6.890 9.480 6.113 1.00 0.00 N ATOM 203 CA MET A 139 -6.892 9.933 4.731 1.00 0.00 C ATOM 204 C MET A 139 -8.288 9.969 4.102 1.00 0.00 C ATOM 205 O MET A 139 -8.382 10.042 2.877 1.00 0.00 O ATOM 206 CB MET A 139 -5.954 9.012 3.938 1.00 0.00 C ATOM 207 CG MET A 139 -6.416 7.544 3.901 1.00 0.00 C ATOM 208 SD MET A 139 -6.652 6.848 2.251 1.00 0.00 S ATOM 209 CE MET A 139 -5.032 7.183 1.529 1.00 0.00 C ATOM 0 H MET A 139 -6.712 8.477 6.166 1.00 0.00 H new ATOM 0 HA MET A 139 -6.544 10.966 4.704 1.00 0.00 H new ATOM 0 HB2 MET A 139 -5.872 9.384 2.917 1.00 0.00 H new ATOM 0 HB3 MET A 139 -4.957 9.059 4.376 1.00 0.00 H new ATOM 0 HG2 MET A 139 -5.683 6.937 4.432 1.00 0.00 H new ATOM 0 HG3 MET A 139 -7.355 7.462 4.449 1.00 0.00 H new ATOM 0 HE1 MET A 139 -4.895 6.567 0.640 1.00 0.00 H new ATOM 0 HE2 MET A 139 -4.967 8.236 1.254 1.00 0.00 H new ATOM 0 HE3 MET A 139 -4.254 6.949 2.256 1.00 0.00 H new ATOM 219 N HIS A 140 -9.331 9.931 4.942 1.00 0.00 N ATOM 220 CA HIS A 140 -10.742 9.724 4.620 1.00 0.00 C ATOM 221 C HIS A 140 -11.143 10.048 3.179 1.00 0.00 C ATOM 222 O HIS A 140 -11.005 11.183 2.703 1.00 0.00 O ATOM 223 CB HIS A 140 -11.490 10.671 5.554 1.00 0.00 C ATOM 224 CG HIS A 140 -11.371 10.295 7.011 1.00 0.00 C ATOM 225 ND1 HIS A 140 -12.018 9.236 7.614 1.00 0.00 N ATOM 226 CD2 HIS A 140 -10.677 10.979 7.969 1.00 0.00 C ATOM 227 CE1 HIS A 140 -11.741 9.288 8.931 1.00 0.00 C ATOM 228 NE2 HIS A 140 -10.928 10.338 9.168 1.00 0.00 N ATOM 0 H HIS A 140 -9.194 10.055 5.945 1.00 0.00 H new ATOM 0 HA HIS A 140 -10.973 8.665 4.739 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -11.108 11.683 5.415 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -12.544 10.687 5.275 1.00 0.00 H new ATOM 0 HD1 HIS A 140 -12.600 8.540 7.147 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -10.055 11.849 7.819 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -12.110 8.600 9.677 1.00 0.00 H new ATOM 237 N PHE A 141 -11.605 9.014 2.482 1.00 0.00 N ATOM 238 CA PHE A 141 -11.915 9.056 1.059 1.00 0.00 C ATOM 239 C PHE A 141 -13.063 10.017 0.769 1.00 0.00 C ATOM 240 O PHE A 141 -13.061 10.704 -0.259 1.00 0.00 O ATOM 241 CB PHE A 141 -12.268 7.651 0.554 1.00 0.00 C ATOM 242 CG PHE A 141 -11.513 6.523 1.214 1.00 0.00 C ATOM 243 CD1 PHE A 141 -10.225 6.164 0.778 1.00 0.00 C ATOM 244 CD2 PHE A 141 -12.106 5.852 2.295 1.00 0.00 C ATOM 245 CE1 PHE A 141 -9.524 5.139 1.432 1.00 0.00 C ATOM 246 CE2 PHE A 141 -11.390 4.844 2.961 1.00 0.00 C ATOM 247 CZ PHE A 141 -10.099 4.491 2.535 1.00 0.00 C ATOM 0 H PHE A 141 -11.778 8.101 2.903 1.00 0.00 H new ATOM 0 HA PHE A 141 -11.031 9.417 0.534 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -13.336 7.487 0.701 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -12.084 7.611 -0.520 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -9.776 6.677 -0.060 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -13.106 6.109 2.612 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -8.543 4.849 1.086 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -11.834 4.338 3.805 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.550 3.721 3.056 1.00 0.00 H new ATOM 257 N GLY A 142 -14.039 10.038 1.680 1.00 0.00 N ATOM 258 CA GLY A 142 -15.304 10.748 1.479 1.00 0.00 C ATOM 259 C GLY A 142 -16.277 9.948 0.609 1.00 0.00 C ATOM 260 O GLY A 142 -17.252 10.491 0.083 1.00 0.00 O ATOM 0 H GLY A 142 -13.974 9.562 2.580 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -15.764 10.950 2.446 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -15.108 11.713 1.011 1.00 0.00 H new ATOM 264 N ASN A 143 -15.996 8.651 0.493 1.00 0.00 N ATOM 265 CA ASN A 143 -16.855 7.619 -0.063 1.00 0.00 C ATOM 266 C ASN A 143 -17.183 6.772 1.176 1.00 0.00 C ATOM 267 O ASN A 143 -16.306 6.163 1.779 1.00 0.00 O ATOM 268 CB ASN A 143 -16.097 6.846 -1.152 1.00 0.00 C ATOM 269 CG ASN A 143 -15.302 7.708 -2.112 1.00 0.00 C ATOM 270 OD1 ASN A 143 -15.803 8.588 -2.810 1.00 0.00 O ATOM 271 ND2 ASN A 143 -14.011 7.480 -2.173 1.00 0.00 N ATOM 0 H ASN A 143 -15.102 8.273 0.807 1.00 0.00 H new ATOM 0 HA ASN A 143 -17.757 7.976 -0.560 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -15.418 6.142 -0.671 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -16.814 6.257 -1.724 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -13.425 8.032 -2.799 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -13.594 6.751 -1.595 1.00 0.00 H new ATOM 278 N ASP A 144 -18.432 6.830 1.628 1.00 0.00 N ATOM 279 CA ASP A 144 -18.870 6.381 2.951 1.00 0.00 C ATOM 280 C ASP A 144 -18.765 4.876 3.187 1.00 0.00 C ATOM 281 O ASP A 144 -18.472 4.456 4.311 1.00 0.00 O ATOM 282 CB ASP A 144 -20.307 6.854 3.203 1.00 0.00 C ATOM 283 CG ASP A 144 -20.427 7.471 4.590 1.00 0.00 C ATOM 284 OD1 ASP A 144 -20.049 8.663 4.741 1.00 0.00 O ATOM 285 OD2 ASP A 144 -20.870 6.757 5.529 1.00 0.00 O ATOM 0 H ASP A 144 -19.196 7.204 1.065 1.00 0.00 H new ATOM 0 HA ASP A 144 -18.178 6.832 3.662 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -20.594 7.585 2.447 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -20.995 6.013 3.111 1.00 0.00 H new ATOM 290 N TRP A 145 -18.987 4.088 2.126 1.00 0.00 N ATOM 291 CA TRP A 145 -18.776 2.642 2.115 1.00 0.00 C ATOM 292 C TRP A 145 -17.289 2.318 2.293 1.00 0.00 C ATOM 293 O TRP A 145 -16.932 1.352 2.957 1.00 0.00 O ATOM 294 CB TRP A 145 -19.312 2.037 0.802 1.00 0.00 C ATOM 295 CG TRP A 145 -18.354 2.034 -0.359 1.00 0.00 C ATOM 296 CD1 TRP A 145 -18.305 2.963 -1.341 1.00 0.00 C ATOM 297 CD2 TRP A 145 -17.211 1.144 -0.595 1.00 0.00 C ATOM 298 NE1 TRP A 145 -17.217 2.715 -2.153 1.00 0.00 N ATOM 299 CE2 TRP A 145 -16.497 1.619 -1.732 1.00 0.00 C ATOM 300 CE3 TRP A 145 -16.651 0.040 0.090 1.00 0.00 C ATOM 301 CZ2 TRP A 145 -15.301 1.033 -2.174 1.00 0.00 C ATOM 302 CZ3 TRP A 145 -15.423 -0.522 -0.309 1.00 0.00 C ATOM 303 CH2 TRP A 145 -14.749 -0.034 -1.442 1.00 0.00 C ATOM 0 H TRP A 145 -19.325 4.450 1.235 1.00 0.00 H new ATOM 0 HA TRP A 145 -19.323 2.201 2.948 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -19.620 1.010 0.997 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -20.206 2.588 0.509 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -19.008 3.773 -1.470 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -16.975 3.277 -2.969 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -17.176 -0.380 0.935 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -14.811 1.397 -3.065 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -14.996 -1.334 0.260 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -13.812 -0.476 -1.749 1.00 0.00 H new ATOM 314 N GLU A 146 -16.440 3.153 1.694 1.00 0.00 N ATOM 315 CA GLU A 146 -14.986 3.085 1.659 1.00 0.00 C ATOM 316 C GLU A 146 -14.456 3.409 3.057 1.00 0.00 C ATOM 317 O GLU A 146 -13.769 2.608 3.692 1.00 0.00 O ATOM 318 CB GLU A 146 -14.506 4.041 0.548 1.00 0.00 C ATOM 319 CG GLU A 146 -13.471 3.499 -0.446 1.00 0.00 C ATOM 320 CD GLU A 146 -13.501 4.305 -1.757 1.00 0.00 C ATOM 321 OE1 GLU A 146 -14.501 4.244 -2.511 1.00 0.00 O ATOM 322 OE2 GLU A 146 -12.536 5.069 -2.028 1.00 0.00 O ATOM 0 H GLU A 146 -16.785 3.962 1.178 1.00 0.00 H new ATOM 0 HA GLU A 146 -14.602 2.095 1.414 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.379 4.367 -0.018 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -14.086 4.927 1.024 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -12.475 3.549 -0.005 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -13.675 2.449 -0.654 1.00 0.00 H new ATOM 329 N ASP A 147 -14.887 4.558 3.585 1.00 0.00 N ATOM 330 CA ASP A 147 -14.566 5.078 4.903 1.00 0.00 C ATOM 331 C ASP A 147 -14.907 4.069 6.010 1.00 0.00 C ATOM 332 O ASP A 147 -14.088 3.850 6.908 1.00 0.00 O ATOM 333 CB ASP A 147 -15.289 6.424 5.065 1.00 0.00 C ATOM 334 CG ASP A 147 -14.308 7.598 5.159 1.00 0.00 C ATOM 335 OD1 ASP A 147 -13.810 8.071 4.110 1.00 0.00 O ATOM 336 OD2 ASP A 147 -14.046 8.031 6.318 1.00 0.00 O ATOM 0 H ASP A 147 -15.506 5.182 3.067 1.00 0.00 H new ATOM 0 HA ASP A 147 -13.492 5.241 4.998 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -15.959 6.579 4.219 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -15.908 6.397 5.962 1.00 0.00 H new ATOM 341 N ARG A 148 -16.067 3.393 5.925 1.00 0.00 N ATOM 342 CA ARG A 148 -16.389 2.324 6.882 1.00 0.00 C ATOM 343 C ARG A 148 -15.589 1.049 6.666 1.00 0.00 C ATOM 344 O ARG A 148 -15.218 0.413 7.647 1.00 0.00 O ATOM 345 CB ARG A 148 -17.897 2.059 7.017 1.00 0.00 C ATOM 346 CG ARG A 148 -18.581 1.576 5.737 1.00 0.00 C ATOM 347 CD ARG A 148 -18.641 0.052 5.555 1.00 0.00 C ATOM 348 NE ARG A 148 -19.492 -0.553 6.587 1.00 0.00 N ATOM 349 CZ ARG A 148 -19.280 -1.647 7.302 1.00 0.00 C ATOM 350 NH1 ARG A 148 -18.361 -2.534 7.005 1.00 0.00 N ATOM 351 NH2 ARG A 148 -19.988 -1.885 8.376 1.00 0.00 N ATOM 0 H ARG A 148 -16.782 3.564 5.218 1.00 0.00 H new ATOM 0 HA ARG A 148 -16.066 2.713 7.848 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -18.052 1.315 7.798 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -18.384 2.976 7.349 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -19.598 1.967 5.719 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -18.059 2.006 4.882 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -19.032 -0.188 4.566 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -17.636 -0.367 5.611 1.00 0.00 H new ATOM 0 HE ARG A 148 -20.366 -0.064 6.779 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -17.766 -2.398 6.188 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -18.241 -3.360 7.592 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -20.709 -1.226 8.668 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -19.819 -2.730 8.922 1.00 0.00 H new ATOM 365 N TYR A 149 -15.274 0.678 5.424 1.00 0.00 N ATOM 366 CA TYR A 149 -14.536 -0.548 5.147 1.00 0.00 C ATOM 367 C TYR A 149 -13.131 -0.479 5.735 1.00 0.00 C ATOM 368 O TYR A 149 -12.703 -1.410 6.421 1.00 0.00 O ATOM 369 CB TYR A 149 -14.473 -0.771 3.634 1.00 0.00 C ATOM 370 CG TYR A 149 -15.037 -2.099 3.205 1.00 0.00 C ATOM 371 CD1 TYR A 149 -16.425 -2.324 3.262 1.00 0.00 C ATOM 372 CD2 TYR A 149 -14.166 -3.115 2.787 1.00 0.00 C ATOM 373 CE1 TYR A 149 -16.945 -3.599 2.966 1.00 0.00 C ATOM 374 CE2 TYR A 149 -14.682 -4.380 2.466 1.00 0.00 C ATOM 375 CZ TYR A 149 -16.065 -4.639 2.593 1.00 0.00 C ATOM 376 OH TYR A 149 -16.532 -5.905 2.406 1.00 0.00 O ATOM 0 H TYR A 149 -15.521 1.214 4.592 1.00 0.00 H new ATOM 0 HA TYR A 149 -15.053 -1.386 5.614 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -15.020 0.027 3.133 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -13.436 -0.701 3.306 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -17.092 -1.519 3.533 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -13.105 -2.925 2.713 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -18.008 -3.780 3.024 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -14.019 -5.159 2.120 1.00 0.00 H new ATOM 0 HH TYR A 149 -15.790 -6.493 2.152 1.00 0.00 H new ATOM 386 N TYR A 150 -12.469 0.661 5.515 1.00 0.00 N ATOM 387 CA TYR A 150 -11.196 1.048 6.116 1.00 0.00 C ATOM 388 C TYR A 150 -11.259 0.820 7.619 1.00 0.00 C ATOM 389 O TYR A 150 -10.614 -0.100 8.127 1.00 0.00 O ATOM 390 CB TYR A 150 -10.886 2.503 5.711 1.00 0.00 C ATOM 391 CG TYR A 150 -10.134 3.404 6.683 1.00 0.00 C ATOM 392 CD1 TYR A 150 -8.779 3.178 7.002 1.00 0.00 C ATOM 393 CD2 TYR A 150 -10.795 4.525 7.227 1.00 0.00 C ATOM 394 CE1 TYR A 150 -8.091 4.071 7.852 1.00 0.00 C ATOM 395 CE2 TYR A 150 -10.121 5.404 8.091 1.00 0.00 C ATOM 396 CZ TYR A 150 -8.764 5.187 8.400 1.00 0.00 C ATOM 397 OH TYR A 150 -8.133 6.078 9.213 1.00 0.00 O ATOM 0 H TYR A 150 -12.828 1.373 4.879 1.00 0.00 H new ATOM 0 HA TYR A 150 -10.371 0.435 5.753 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -10.313 2.470 4.785 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -11.835 2.988 5.482 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -8.266 2.319 6.595 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -11.829 4.709 6.977 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -7.050 3.901 8.084 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -10.644 6.247 8.519 1.00 0.00 H new ATOM 0 HH TYR A 150 -7.248 6.286 8.846 1.00 0.00 H new ATOM 407 N ARG A 151 -12.091 1.593 8.325 1.00 0.00 N ATOM 408 CA ARG A 151 -12.074 1.564 9.789 1.00 0.00 C ATOM 409 C ARG A 151 -12.576 0.242 10.387 1.00 0.00 C ATOM 410 O ARG A 151 -12.300 -0.024 11.559 1.00 0.00 O ATOM 411 CB ARG A 151 -12.765 2.799 10.355 1.00 0.00 C ATOM 412 CG ARG A 151 -14.267 2.732 10.131 1.00 0.00 C ATOM 413 CD ARG A 151 -14.856 4.123 10.231 1.00 0.00 C ATOM 414 NE ARG A 151 -16.309 4.022 10.398 1.00 0.00 N ATOM 415 CZ ARG A 151 -17.291 4.398 9.600 1.00 0.00 C ATOM 416 NH1 ARG A 151 -17.162 5.214 8.582 1.00 0.00 N ATOM 417 NH2 ARG A 151 -18.456 3.879 9.858 1.00 0.00 N ATOM 0 H ARG A 151 -12.771 2.234 7.916 1.00 0.00 H new ATOM 0 HA ARG A 151 -11.031 1.605 10.104 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -12.556 2.881 11.422 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -12.362 3.695 9.882 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -14.480 2.305 9.151 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -14.727 2.077 10.871 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -14.418 4.656 11.074 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -14.620 4.696 9.334 1.00 0.00 H new ATOM 0 HE ARG A 151 -16.610 3.591 11.272 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -16.249 5.609 8.358 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -17.975 5.454 8.014 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -18.563 3.227 10.635 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -19.262 4.124 9.283 1.00 0.00 H new ATOM 431 N GLU A 152 -13.281 -0.603 9.622 1.00 0.00 N ATOM 432 CA GLU A 152 -13.760 -1.912 10.056 1.00 0.00 C ATOM 433 C GLU A 152 -12.740 -3.030 9.826 1.00 0.00 C ATOM 434 O GLU A 152 -12.775 -3.996 10.597 1.00 0.00 O ATOM 435 CB GLU A 152 -15.061 -2.267 9.321 1.00 0.00 C ATOM 436 CG GLU A 152 -16.265 -1.498 9.887 1.00 0.00 C ATOM 437 CD GLU A 152 -16.903 -2.190 11.098 1.00 0.00 C ATOM 438 OE1 GLU A 152 -17.184 -3.415 11.027 1.00 0.00 O ATOM 439 OE2 GLU A 152 -17.150 -1.504 12.122 1.00 0.00 O ATOM 0 H GLU A 152 -13.538 -0.384 8.659 1.00 0.00 H new ATOM 0 HA GLU A 152 -13.931 -1.837 11.130 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -14.952 -2.042 8.260 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -15.243 -3.339 9.402 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -15.947 -0.496 10.174 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -17.015 -1.382 9.105 1.00 0.00 H new ATOM 446 N ASN A 153 -11.848 -2.918 8.824 1.00 0.00 N ATOM 447 CA ASN A 153 -11.000 -4.028 8.384 1.00 0.00 C ATOM 448 C ASN A 153 -9.512 -3.768 8.620 1.00 0.00 C ATOM 449 O ASN A 153 -8.724 -4.711 8.616 1.00 0.00 O ATOM 450 CB ASN A 153 -11.223 -4.345 6.893 1.00 0.00 C ATOM 451 CG ASN A 153 -12.612 -4.880 6.573 1.00 0.00 C ATOM 452 OD1 ASN A 153 -12.789 -6.068 6.304 1.00 0.00 O ATOM 453 ND2 ASN A 153 -13.612 -4.030 6.571 1.00 0.00 N ATOM 0 H ASN A 153 -11.699 -2.055 8.301 1.00 0.00 H new ATOM 0 HA ASN A 153 -11.295 -4.883 8.992 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -11.051 -3.440 6.310 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -10.481 -5.076 6.573 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -14.553 -4.351 6.344 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -13.448 -3.049 6.796 1.00 0.00 H new ATOM 460 N MET A 154 -9.121 -2.504 8.829 1.00 0.00 N ATOM 461 CA MET A 154 -7.742 -2.043 8.896 1.00 0.00 C ATOM 462 C MET A 154 -6.869 -2.774 9.915 1.00 0.00 C ATOM 463 O MET A 154 -5.649 -2.808 9.752 1.00 0.00 O ATOM 464 CB MET A 154 -7.699 -0.533 9.154 1.00 0.00 C ATOM 465 CG MET A 154 -8.322 -0.169 10.505 1.00 0.00 C ATOM 466 SD MET A 154 -8.391 1.608 10.838 1.00 0.00 S ATOM 467 CE MET A 154 -9.111 1.564 12.500 1.00 0.00 C ATOM 0 H MET A 154 -9.792 -1.747 8.961 1.00 0.00 H new ATOM 0 HA MET A 154 -7.313 -2.278 7.922 1.00 0.00 H new ATOM 0 HB2 MET A 154 -6.665 -0.189 9.126 1.00 0.00 H new ATOM 0 HB3 MET A 154 -8.230 -0.013 8.357 1.00 0.00 H new ATOM 0 HG2 MET A 154 -9.333 -0.574 10.547 1.00 0.00 H new ATOM 0 HG3 MET A 154 -7.751 -0.653 11.297 1.00 0.00 H new ATOM 0 HE1 MET A 154 -9.229 2.582 12.872 1.00 0.00 H new ATOM 0 HE2 MET A 154 -10.085 1.076 12.462 1.00 0.00 H new ATOM 0 HE3 MET A 154 -8.453 1.008 13.167 1.00 0.00 H new ATOM 477 N ASN A 155 -7.479 -3.416 10.921 1.00 0.00 N ATOM 478 CA ASN A 155 -6.799 -4.270 11.873 1.00 0.00 C ATOM 479 C ASN A 155 -6.038 -5.362 11.102 1.00 0.00 C ATOM 480 O ASN A 155 -4.855 -5.595 11.349 1.00 0.00 O ATOM 481 CB ASN A 155 -7.785 -4.880 12.905 1.00 0.00 C ATOM 482 CG ASN A 155 -9.197 -4.293 13.011 1.00 0.00 C ATOM 483 OD1 ASN A 155 -9.442 -3.098 12.865 1.00 0.00 O ATOM 484 ND2 ASN A 155 -10.181 -5.141 13.243 1.00 0.00 N ATOM 0 H ASN A 155 -8.483 -3.347 11.089 1.00 0.00 H new ATOM 0 HA ASN A 155 -6.090 -3.673 12.447 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -7.885 -5.942 12.679 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -7.322 -4.806 13.889 1.00 0.00 H new ATOM 0 HD21 ASN A 155 -11.142 -4.804 13.301 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -9.981 -6.134 13.365 1.00 0.00 H new ATOM 491 N ARG A 156 -6.731 -5.984 10.133 1.00 0.00 N ATOM 492 CA ARG A 156 -6.236 -7.047 9.266 1.00 0.00 C ATOM 493 C ARG A 156 -5.554 -6.531 8.010 1.00 0.00 C ATOM 494 O ARG A 156 -4.873 -7.313 7.344 1.00 0.00 O ATOM 495 CB ARG A 156 -7.403 -7.910 8.774 1.00 0.00 C ATOM 496 CG ARG A 156 -8.021 -8.778 9.867 1.00 0.00 C ATOM 497 CD ARG A 156 -9.201 -8.100 10.553 1.00 0.00 C ATOM 498 NE ARG A 156 -10.324 -7.931 9.631 1.00 0.00 N ATOM 499 CZ ARG A 156 -11.580 -7.631 9.898 1.00 0.00 C ATOM 500 NH1 ARG A 156 -12.028 -7.438 11.115 1.00 0.00 N ATOM 501 NH2 ARG A 156 -12.383 -7.521 8.870 1.00 0.00 N ATOM 0 H ARG A 156 -7.700 -5.740 9.929 1.00 0.00 H new ATOM 0 HA ARG A 156 -5.520 -7.602 9.873 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -8.173 -7.262 8.357 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -7.054 -8.552 7.965 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -8.350 -9.722 9.434 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -7.261 -9.016 10.611 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -9.517 -8.695 11.410 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -8.892 -7.127 10.936 1.00 0.00 H new ATOM 0 HE ARG A 156 -10.105 -8.064 8.644 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -11.394 -7.518 11.910 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -13.010 -7.208 11.266 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -12.025 -7.666 7.926 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -13.366 -7.291 9.013 1.00 0.00 H new ATOM 515 N TYR A 157 -5.819 -5.287 7.598 1.00 0.00 N ATOM 516 CA TYR A 157 -5.344 -4.807 6.300 1.00 0.00 C ATOM 517 C TYR A 157 -3.808 -4.607 6.334 1.00 0.00 C ATOM 518 O TYR A 157 -3.233 -4.515 7.433 1.00 0.00 O ATOM 519 CB TYR A 157 -6.274 -3.658 5.820 1.00 0.00 C ATOM 520 CG TYR A 157 -5.949 -2.175 5.940 1.00 0.00 C ATOM 521 CD1 TYR A 157 -4.966 -1.658 6.806 1.00 0.00 C ATOM 522 CD2 TYR A 157 -6.795 -1.278 5.253 1.00 0.00 C ATOM 523 CE1 TYR A 157 -4.797 -0.267 6.945 1.00 0.00 C ATOM 524 CE2 TYR A 157 -6.659 0.114 5.410 1.00 0.00 C ATOM 525 CZ TYR A 157 -5.646 0.621 6.252 1.00 0.00 C ATOM 526 OH TYR A 157 -5.508 1.963 6.422 1.00 0.00 O ATOM 0 H TYR A 157 -6.352 -4.604 8.137 1.00 0.00 H new ATOM 0 HA TYR A 157 -5.436 -5.534 5.493 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -6.458 -3.841 4.761 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -7.222 -3.802 6.338 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -4.337 -2.333 7.367 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -7.559 -1.666 4.596 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -4.016 0.120 7.583 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -7.324 0.788 4.891 1.00 0.00 H new ATOM 0 HH TYR A 157 -6.385 2.362 6.603 1.00 0.00 H new ATOM 536 N PRO A 158 -3.097 -4.574 5.189 1.00 0.00 N ATOM 537 CA PRO A 158 -1.690 -4.213 5.166 1.00 0.00 C ATOM 538 C PRO A 158 -1.499 -2.792 5.652 1.00 0.00 C ATOM 539 O PRO A 158 -2.286 -1.883 5.402 1.00 0.00 O ATOM 540 CB PRO A 158 -1.203 -4.322 3.724 1.00 0.00 C ATOM 541 CG PRO A 158 -2.490 -4.164 2.943 1.00 0.00 C ATOM 542 CD PRO A 158 -3.542 -4.832 3.840 1.00 0.00 C ATOM 0 HA PRO A 158 -1.127 -4.879 5.820 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -0.479 -3.545 3.478 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -0.722 -5.280 3.527 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.724 -3.115 2.764 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -2.429 -4.648 1.968 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -4.534 -4.415 3.664 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -3.607 -5.902 3.643 1.00 0.00 H new ATOM 550 N ASN A 159 -0.364 -2.626 6.298 1.00 0.00 N ATOM 551 CA ASN A 159 0.102 -1.395 6.876 1.00 0.00 C ATOM 552 C ASN A 159 1.581 -1.178 6.536 1.00 0.00 C ATOM 553 O ASN A 159 2.190 -0.276 7.112 1.00 0.00 O ATOM 554 CB ASN A 159 -0.181 -1.430 8.380 1.00 0.00 C ATOM 555 CG ASN A 159 0.719 -2.382 9.123 1.00 0.00 C ATOM 556 OD1 ASN A 159 0.385 -3.531 9.389 1.00 0.00 O ATOM 557 ND2 ASN A 159 1.914 -1.936 9.431 1.00 0.00 N ATOM 0 H ASN A 159 0.292 -3.395 6.439 1.00 0.00 H new ATOM 0 HA ASN A 159 -0.427 -0.538 6.459 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -0.060 -0.428 8.791 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -1.220 -1.718 8.543 1.00 0.00 H new ATOM 0 HD21 ASN A 159 2.582 -2.548 9.899 1.00 0.00 H new ATOM 0 HD22 ASN A 159 2.175 -0.977 9.202 1.00 0.00 H new ATOM 564 N GLN A 160 2.171 -2.011 5.666 1.00 0.00 N ATOM 565 CA GLN A 160 3.497 -1.806 5.119 1.00 0.00 C ATOM 566 C GLN A 160 3.527 -2.203 3.645 1.00 0.00 C ATOM 567 O GLN A 160 2.750 -3.065 3.243 1.00 0.00 O ATOM 568 CB GLN A 160 4.535 -2.675 5.809 1.00 0.00 C ATOM 569 CG GLN A 160 4.621 -2.624 7.332 1.00 0.00 C ATOM 570 CD GLN A 160 5.963 -3.113 7.867 1.00 0.00 C ATOM 571 OE1 GLN A 160 6.040 -3.882 8.823 1.00 0.00 O ATOM 572 NE2 GLN A 160 7.045 -2.659 7.263 1.00 0.00 N ATOM 0 H GLN A 160 1.721 -2.860 5.324 1.00 0.00 H new ATOM 0 HA GLN A 160 3.727 -0.751 5.264 1.00 0.00 H new ATOM 0 HB2 GLN A 160 4.348 -3.709 5.521 1.00 0.00 H new ATOM 0 HB3 GLN A 160 5.513 -2.405 5.411 1.00 0.00 H new ATOM 0 HG2 GLN A 160 4.454 -1.600 7.666 1.00 0.00 H new ATOM 0 HG3 GLN A 160 3.823 -3.233 7.757 1.00 0.00 H new ATOM 0 HE21 GLN A 160 6.958 -2.022 6.471 1.00 0.00 H new ATOM 0 HE22 GLN A 160 7.969 -2.946 7.588 1.00 0.00 H new ATOM 581 N VAL A 161 4.458 -1.622 2.877 1.00 0.00 N ATOM 582 CA VAL A 161 4.431 -1.714 1.418 1.00 0.00 C ATOM 583 C VAL A 161 5.758 -2.302 0.887 1.00 0.00 C ATOM 584 O VAL A 161 6.840 -1.823 1.237 1.00 0.00 O ATOM 585 CB VAL A 161 3.989 -0.341 0.831 1.00 0.00 C ATOM 586 CG1 VAL A 161 3.165 0.533 1.797 1.00 0.00 C ATOM 587 CG2 VAL A 161 5.130 0.541 0.353 1.00 0.00 C ATOM 0 H VAL A 161 5.240 -1.082 3.247 1.00 0.00 H new ATOM 0 HA VAL A 161 3.683 -2.425 1.068 1.00 0.00 H new ATOM 0 HB VAL A 161 3.378 -0.666 -0.011 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.901 1.469 1.305 1.00 0.00 H new ATOM 0 HG12 VAL A 161 2.256 0.003 2.081 1.00 0.00 H new ATOM 0 HG13 VAL A 161 3.755 0.746 2.689 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.728 1.475 -0.039 1.00 0.00 H new ATOM 0 HG22 VAL A 161 5.798 0.755 1.187 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.684 0.026 -0.432 1.00 0.00 H new ATOM 597 N TYR A 162 5.688 -3.382 0.101 1.00 0.00 N ATOM 598 CA TYR A 162 6.827 -3.980 -0.617 1.00 0.00 C ATOM 599 C TYR A 162 7.100 -3.155 -1.884 1.00 0.00 C ATOM 600 O TYR A 162 6.152 -2.855 -2.605 1.00 0.00 O ATOM 601 CB TYR A 162 6.482 -5.417 -1.044 1.00 0.00 C ATOM 602 CG TYR A 162 6.490 -6.461 0.050 1.00 0.00 C ATOM 603 CD1 TYR A 162 7.684 -6.841 0.697 1.00 0.00 C ATOM 604 CD2 TYR A 162 5.276 -7.057 0.425 1.00 0.00 C ATOM 605 CE1 TYR A 162 7.636 -7.759 1.768 1.00 0.00 C ATOM 606 CE2 TYR A 162 5.210 -7.887 1.548 1.00 0.00 C ATOM 607 CZ TYR A 162 6.389 -8.240 2.221 1.00 0.00 C ATOM 608 OH TYR A 162 6.285 -9.035 3.310 1.00 0.00 O ATOM 0 H TYR A 162 4.813 -3.881 -0.060 1.00 0.00 H new ATOM 0 HA TYR A 162 7.699 -3.989 0.037 1.00 0.00 H new ATOM 0 HB2 TYR A 162 5.493 -5.410 -1.503 1.00 0.00 H new ATOM 0 HB3 TYR A 162 7.189 -5.724 -1.815 1.00 0.00 H new ATOM 0 HD1 TYR A 162 8.630 -6.432 0.375 1.00 0.00 H new ATOM 0 HD2 TYR A 162 4.386 -6.873 -0.158 1.00 0.00 H new ATOM 0 HE1 TYR A 162 8.549 -8.092 2.239 1.00 0.00 H new ATOM 0 HE2 TYR A 162 4.256 -8.255 1.896 1.00 0.00 H new ATOM 0 HH TYR A 162 5.343 -9.260 3.462 1.00 0.00 H new ATOM 618 N TYR A 163 8.355 -2.822 -2.219 1.00 0.00 N ATOM 619 CA TYR A 163 8.635 -2.136 -3.491 1.00 0.00 C ATOM 620 C TYR A 163 10.001 -2.387 -4.108 1.00 0.00 C ATOM 621 O TYR A 163 10.948 -2.790 -3.436 1.00 0.00 O ATOM 622 CB TYR A 163 8.496 -0.619 -3.312 1.00 0.00 C ATOM 623 CG TYR A 163 9.212 0.007 -2.130 1.00 0.00 C ATOM 624 CD1 TYR A 163 10.519 0.524 -2.228 1.00 0.00 C ATOM 625 CD2 TYR A 163 8.504 0.144 -0.931 1.00 0.00 C ATOM 626 CE1 TYR A 163 11.093 1.204 -1.135 1.00 0.00 C ATOM 627 CE2 TYR A 163 9.039 0.866 0.141 1.00 0.00 C ATOM 628 CZ TYR A 163 10.342 1.397 0.047 1.00 0.00 C ATOM 629 OH TYR A 163 10.849 2.082 1.104 1.00 0.00 O ATOM 0 H TYR A 163 9.176 -3.010 -1.643 1.00 0.00 H new ATOM 0 HA TYR A 163 7.900 -2.561 -4.174 1.00 0.00 H new ATOM 0 HB2 TYR A 163 8.858 -0.137 -4.220 1.00 0.00 H new ATOM 0 HB3 TYR A 163 7.435 -0.384 -3.227 1.00 0.00 H new ATOM 0 HD1 TYR A 163 11.082 0.399 -3.141 1.00 0.00 H new ATOM 0 HD2 TYR A 163 7.531 -0.314 -0.832 1.00 0.00 H new ATOM 0 HE1 TYR A 163 12.104 1.577 -1.200 1.00 0.00 H new ATOM 0 HE2 TYR A 163 8.456 1.016 1.038 1.00 0.00 H new ATOM 0 HH TYR A 163 11.386 2.835 0.779 1.00 0.00 H new ATOM 639 N ARG A 164 10.072 -2.085 -5.412 1.00 0.00 N ATOM 640 CA ARG A 164 11.312 -1.912 -6.164 1.00 0.00 C ATOM 641 C ARG A 164 11.875 -0.549 -5.726 1.00 0.00 C ATOM 642 O ARG A 164 11.081 0.392 -5.595 1.00 0.00 O ATOM 643 CB ARG A 164 11.027 -1.851 -7.681 1.00 0.00 C ATOM 644 CG ARG A 164 10.159 -2.980 -8.259 1.00 0.00 C ATOM 645 CD ARG A 164 10.679 -4.377 -7.927 1.00 0.00 C ATOM 646 NE ARG A 164 12.044 -4.597 -8.405 1.00 0.00 N ATOM 647 CZ ARG A 164 12.414 -5.061 -9.584 1.00 0.00 C ATOM 648 NH1 ARG A 164 11.542 -5.395 -10.508 1.00 0.00 N ATOM 649 NH2 ARG A 164 13.690 -5.196 -9.818 1.00 0.00 N ATOM 0 H ARG A 164 9.239 -1.951 -5.986 1.00 0.00 H new ATOM 0 HA ARG A 164 11.996 -2.739 -5.977 1.00 0.00 H new ATOM 0 HB2 ARG A 164 10.541 -0.900 -7.899 1.00 0.00 H new ATOM 0 HB3 ARG A 164 11.981 -1.849 -8.208 1.00 0.00 H new ATOM 0 HG2 ARG A 164 9.143 -2.879 -7.877 1.00 0.00 H new ATOM 0 HG3 ARG A 164 10.105 -2.869 -9.342 1.00 0.00 H new ATOM 0 HD2 ARG A 164 10.648 -4.525 -6.848 1.00 0.00 H new ATOM 0 HD3 ARG A 164 10.018 -5.122 -8.371 1.00 0.00 H new ATOM 0 HE ARG A 164 12.794 -4.366 -7.754 1.00 0.00 H new ATOM 0 HH11 ARG A 164 10.543 -5.299 -10.325 1.00 0.00 H new ATOM 0 HH12 ARG A 164 11.864 -5.750 -11.408 1.00 0.00 H new ATOM 0 HH21 ARG A 164 14.370 -4.946 -9.100 1.00 0.00 H new ATOM 0 HH22 ARG A 164 14.008 -5.552 -10.719 1.00 0.00 H new ATOM 663 N PRO A 165 13.185 -0.379 -5.503 1.00 0.00 N ATOM 664 CA PRO A 165 13.724 0.922 -5.115 1.00 0.00 C ATOM 665 C PRO A 165 13.620 1.939 -6.265 1.00 0.00 C ATOM 666 O PRO A 165 13.462 1.575 -7.427 1.00 0.00 O ATOM 667 CB PRO A 165 15.171 0.636 -4.709 1.00 0.00 C ATOM 668 CG PRO A 165 15.545 -0.585 -5.546 1.00 0.00 C ATOM 669 CD PRO A 165 14.238 -1.374 -5.630 1.00 0.00 C ATOM 0 HA PRO A 165 13.167 1.378 -4.297 1.00 0.00 H new ATOM 0 HB2 PRO A 165 15.822 1.483 -4.923 1.00 0.00 H new ATOM 0 HB3 PRO A 165 15.255 0.431 -3.642 1.00 0.00 H new ATOM 0 HG2 PRO A 165 15.905 -0.299 -6.534 1.00 0.00 H new ATOM 0 HG3 PRO A 165 16.336 -1.168 -5.074 1.00 0.00 H new ATOM 0 HD2 PRO A 165 14.161 -1.910 -6.576 1.00 0.00 H new ATOM 0 HD3 PRO A 165 14.175 -2.118 -4.836 1.00 0.00 H new ATOM 677 N VAL A 166 13.793 3.227 -5.951 1.00 0.00 N ATOM 678 CA VAL A 166 13.948 4.336 -6.919 1.00 0.00 C ATOM 679 C VAL A 166 15.299 4.321 -7.671 1.00 0.00 C ATOM 680 O VAL A 166 15.630 5.194 -8.477 1.00 0.00 O ATOM 681 CB VAL A 166 13.747 5.690 -6.220 1.00 0.00 C ATOM 682 CG1 VAL A 166 12.260 5.941 -5.902 1.00 0.00 C ATOM 683 CG2 VAL A 166 14.641 5.842 -4.988 1.00 0.00 C ATOM 0 H VAL A 166 13.831 3.545 -4.983 1.00 0.00 H new ATOM 0 HA VAL A 166 13.175 4.188 -7.673 1.00 0.00 H new ATOM 0 HB VAL A 166 14.060 6.466 -6.918 1.00 0.00 H new ATOM 0 HG11 VAL A 166 12.152 6.907 -5.408 1.00 0.00 H new ATOM 0 HG12 VAL A 166 11.685 5.940 -6.828 1.00 0.00 H new ATOM 0 HG13 VAL A 166 11.891 5.154 -5.245 1.00 0.00 H new ATOM 0 HG21 VAL A 166 14.464 6.814 -4.528 1.00 0.00 H new ATOM 0 HG22 VAL A 166 14.410 5.054 -4.272 1.00 0.00 H new ATOM 0 HG23 VAL A 166 15.687 5.767 -5.286 1.00 0.00 H new ATOM 693 N ASP A 167 16.106 3.299 -7.422 1.00 0.00 N ATOM 694 CA ASP A 167 17.426 3.101 -8.015 1.00 0.00 C ATOM 695 C ASP A 167 17.472 3.043 -9.541 1.00 0.00 C ATOM 696 O ASP A 167 18.541 3.239 -10.123 1.00 0.00 O ATOM 697 CB ASP A 167 18.039 1.817 -7.462 1.00 0.00 C ATOM 698 CG ASP A 167 19.562 1.892 -7.413 1.00 0.00 C ATOM 699 OD1 ASP A 167 20.058 2.549 -6.460 1.00 0.00 O ATOM 700 OD2 ASP A 167 20.253 1.305 -8.296 1.00 0.00 O ATOM 0 H ASP A 167 15.850 2.553 -6.775 1.00 0.00 H new ATOM 0 HA ASP A 167 17.991 3.991 -7.739 1.00 0.00 H new ATOM 0 HB2 ASP A 167 17.652 1.631 -6.460 1.00 0.00 H new ATOM 0 HB3 ASP A 167 17.736 0.973 -8.082 1.00 0.00 H new ATOM 705 N GLN A 168 16.336 2.780 -10.181 1.00 0.00 N ATOM 706 CA GLN A 168 16.180 2.579 -11.608 1.00 0.00 C ATOM 707 C GLN A 168 14.814 3.073 -12.092 1.00 0.00 C ATOM 708 O GLN A 168 14.303 2.618 -13.121 1.00 0.00 O ATOM 709 CB GLN A 168 16.525 1.129 -11.939 1.00 0.00 C ATOM 710 CG GLN A 168 15.452 0.077 -11.647 1.00 0.00 C ATOM 711 CD GLN A 168 14.980 0.094 -10.202 1.00 0.00 C ATOM 712 OE1 GLN A 168 15.653 -0.384 -9.295 1.00 0.00 O ATOM 713 NE2 GLN A 168 13.837 0.702 -9.954 1.00 0.00 N ATOM 0 H GLN A 168 15.450 2.698 -9.682 1.00 0.00 H new ATOM 0 HA GLN A 168 16.881 3.192 -12.175 1.00 0.00 H new ATOM 0 HB2 GLN A 168 16.775 1.073 -12.998 1.00 0.00 H new ATOM 0 HB3 GLN A 168 17.424 0.859 -11.385 1.00 0.00 H new ATOM 0 HG2 GLN A 168 14.599 0.245 -12.304 1.00 0.00 H new ATOM 0 HG3 GLN A 168 15.847 -0.911 -11.883 1.00 0.00 H new ATOM 0 HE21 GLN A 168 13.291 1.094 -10.721 1.00 0.00 H new ATOM 0 HE22 GLN A 168 13.499 0.781 -8.995 1.00 0.00 H new ATOM 722 N TYR A 169 14.242 4.033 -11.355 1.00 0.00 N ATOM 723 CA TYR A 169 12.982 4.698 -11.686 1.00 0.00 C ATOM 724 C TYR A 169 13.183 6.124 -12.200 1.00 0.00 C ATOM 725 O TYR A 169 14.168 6.808 -11.903 1.00 0.00 O ATOM 726 CB TYR A 169 11.994 4.692 -10.495 1.00 0.00 C ATOM 727 CG TYR A 169 11.837 5.998 -9.711 1.00 0.00 C ATOM 728 CD1 TYR A 169 12.969 6.720 -9.298 1.00 0.00 C ATOM 729 CD2 TYR A 169 10.561 6.542 -9.460 1.00 0.00 C ATOM 730 CE1 TYR A 169 12.856 7.985 -8.696 1.00 0.00 C ATOM 731 CE2 TYR A 169 10.433 7.808 -8.850 1.00 0.00 C ATOM 732 CZ TYR A 169 11.582 8.539 -8.473 1.00 0.00 C ATOM 733 OH TYR A 169 11.463 9.777 -7.913 1.00 0.00 O ATOM 0 H TYR A 169 14.657 4.376 -10.489 1.00 0.00 H new ATOM 0 HA TYR A 169 12.546 4.115 -12.497 1.00 0.00 H new ATOM 0 HB2 TYR A 169 11.013 4.404 -10.871 1.00 0.00 H new ATOM 0 HB3 TYR A 169 12.309 3.915 -9.798 1.00 0.00 H new ATOM 0 HD1 TYR A 169 13.950 6.293 -9.447 1.00 0.00 H new ATOM 0 HD2 TYR A 169 9.677 5.987 -9.736 1.00 0.00 H new ATOM 0 HE1 TYR A 169 13.743 8.529 -8.406 1.00 0.00 H new ATOM 0 HE2 TYR A 169 9.451 8.221 -8.670 1.00 0.00 H new ATOM 0 HH TYR A 169 10.514 10.009 -7.830 1.00 0.00 H new ATOM 743 N ASN A 170 12.144 6.581 -12.888 1.00 0.00 N ATOM 744 CA ASN A 170 12.001 7.932 -13.398 1.00 0.00 C ATOM 745 C ASN A 170 10.663 8.548 -12.965 1.00 0.00 C ATOM 746 O ASN A 170 10.523 9.772 -12.905 1.00 0.00 O ATOM 747 CB ASN A 170 12.146 7.848 -14.922 1.00 0.00 C ATOM 748 CG ASN A 170 12.363 9.224 -15.525 1.00 0.00 C ATOM 749 OD1 ASN A 170 11.456 9.822 -16.100 1.00 0.00 O ATOM 750 ND2 ASN A 170 13.555 9.765 -15.385 1.00 0.00 N ATOM 0 H ASN A 170 11.344 5.990 -13.114 1.00 0.00 H new ATOM 0 HA ASN A 170 12.767 8.592 -12.991 1.00 0.00 H new ATOM 0 HB2 ASN A 170 12.985 7.200 -15.176 1.00 0.00 H new ATOM 0 HB3 ASN A 170 11.252 7.396 -15.351 1.00 0.00 H new ATOM 0 HD21 ASN A 170 13.739 10.697 -15.757 1.00 0.00 H new ATOM 0 HD22 ASN A 170 14.294 9.252 -14.905 1.00 0.00 H new ATOM 757 N ASN A 171 9.676 7.691 -12.658 1.00 0.00 N ATOM 758 CA ASN A 171 8.301 8.068 -12.401 1.00 0.00 C ATOM 759 C ASN A 171 7.720 7.226 -11.263 1.00 0.00 C ATOM 760 O ASN A 171 7.685 5.997 -11.350 1.00 0.00 O ATOM 761 CB ASN A 171 7.458 7.891 -13.670 1.00 0.00 C ATOM 762 CG ASN A 171 7.947 8.722 -14.845 1.00 0.00 C ATOM 763 OD1 ASN A 171 7.998 9.949 -14.803 1.00 0.00 O ATOM 764 ND2 ASN A 171 8.303 8.073 -15.930 1.00 0.00 N ATOM 0 H ASN A 171 9.832 6.686 -12.583 1.00 0.00 H new ATOM 0 HA ASN A 171 8.279 9.117 -12.105 1.00 0.00 H new ATOM 0 HB2 ASN A 171 7.460 6.839 -13.954 1.00 0.00 H new ATOM 0 HB3 ASN A 171 6.425 8.160 -13.450 1.00 0.00 H new ATOM 0 HD21 ASN A 171 8.626 8.588 -16.749 1.00 0.00 H new ATOM 0 HD22 ASN A 171 8.257 7.054 -15.953 1.00 0.00 H new ATOM 771 N GLN A 172 7.253 7.895 -10.205 1.00 0.00 N ATOM 772 CA GLN A 172 6.678 7.307 -9.007 1.00 0.00 C ATOM 773 C GLN A 172 5.580 6.312 -9.364 1.00 0.00 C ATOM 774 O GLN A 172 5.716 5.131 -9.083 1.00 0.00 O ATOM 775 CB GLN A 172 6.170 8.453 -8.107 1.00 0.00 C ATOM 776 CG GLN A 172 6.904 8.500 -6.765 1.00 0.00 C ATOM 777 CD GLN A 172 6.778 9.855 -6.090 1.00 0.00 C ATOM 778 OE1 GLN A 172 7.755 10.583 -5.918 1.00 0.00 O ATOM 779 NE2 GLN A 172 5.580 10.280 -5.764 1.00 0.00 N ATOM 0 H GLN A 172 7.270 8.914 -10.166 1.00 0.00 H new ATOM 0 HA GLN A 172 7.430 6.738 -8.460 1.00 0.00 H new ATOM 0 HB2 GLN A 172 6.299 9.404 -8.624 1.00 0.00 H new ATOM 0 HB3 GLN A 172 5.101 8.329 -7.931 1.00 0.00 H new ATOM 0 HG2 GLN A 172 6.504 7.729 -6.106 1.00 0.00 H new ATOM 0 HG3 GLN A 172 7.958 8.270 -6.921 1.00 0.00 H new ATOM 0 HE21 GLN A 172 4.769 9.678 -5.906 1.00 0.00 H new ATOM 0 HE22 GLN A 172 5.460 11.213 -5.369 1.00 0.00 H new ATOM 788 N ASN A 173 4.535 6.787 -10.042 1.00 0.00 N ATOM 789 CA ASN A 173 3.282 6.106 -10.334 1.00 0.00 C ATOM 790 C ASN A 173 3.462 4.691 -10.902 1.00 0.00 C ATOM 791 O ASN A 173 2.799 3.754 -10.462 1.00 0.00 O ATOM 792 CB ASN A 173 2.494 7.017 -11.287 1.00 0.00 C ATOM 793 CG ASN A 173 3.352 7.598 -12.407 1.00 0.00 C ATOM 794 OD1 ASN A 173 3.990 8.630 -12.241 1.00 0.00 O ATOM 795 ND2 ASN A 173 3.479 6.924 -13.527 1.00 0.00 N ATOM 0 H ASN A 173 4.548 7.731 -10.429 1.00 0.00 H new ATOM 0 HA ASN A 173 2.735 5.942 -9.405 1.00 0.00 H new ATOM 0 HB2 ASN A 173 1.672 6.451 -11.724 1.00 0.00 H new ATOM 0 HB3 ASN A 173 2.051 7.833 -10.716 1.00 0.00 H new ATOM 0 HD21 ASN A 173 4.108 7.260 -14.256 1.00 0.00 H new ATOM 0 HD22 ASN A 173 2.949 6.064 -13.668 1.00 0.00 H new ATOM 802 N ASN A 174 4.395 4.541 -11.844 1.00 0.00 N ATOM 803 CA ASN A 174 4.717 3.296 -12.520 1.00 0.00 C ATOM 804 C ASN A 174 5.187 2.224 -11.530 1.00 0.00 C ATOM 805 O ASN A 174 4.526 1.198 -11.337 1.00 0.00 O ATOM 806 CB ASN A 174 5.761 3.635 -13.603 1.00 0.00 C ATOM 807 CG ASN A 174 6.646 2.477 -14.033 1.00 0.00 C ATOM 808 OD1 ASN A 174 6.233 1.321 -14.129 1.00 0.00 O ATOM 809 ND2 ASN A 174 7.906 2.765 -14.265 1.00 0.00 N ATOM 0 H ASN A 174 4.968 5.321 -12.166 1.00 0.00 H new ATOM 0 HA ASN A 174 3.837 2.860 -12.992 1.00 0.00 H new ATOM 0 HB2 ASN A 174 5.240 4.018 -14.480 1.00 0.00 H new ATOM 0 HB3 ASN A 174 6.397 4.439 -13.233 1.00 0.00 H new ATOM 0 HD21 ASN A 174 8.558 2.026 -14.529 1.00 0.00 H new ATOM 0 HD22 ASN A 174 8.233 3.728 -14.181 1.00 0.00 H new ATOM 816 N PHE A 175 6.334 2.469 -10.900 1.00 0.00 N ATOM 817 CA PHE A 175 6.905 1.550 -9.919 1.00 0.00 C ATOM 818 C PHE A 175 6.122 1.550 -8.592 1.00 0.00 C ATOM 819 O PHE A 175 6.207 0.610 -7.809 1.00 0.00 O ATOM 820 CB PHE A 175 8.377 1.889 -9.744 1.00 0.00 C ATOM 821 CG PHE A 175 9.284 1.342 -10.829 1.00 0.00 C ATOM 822 CD1 PHE A 175 9.647 -0.017 -10.809 1.00 0.00 C ATOM 823 CD2 PHE A 175 9.791 2.182 -11.839 1.00 0.00 C ATOM 824 CE1 PHE A 175 10.520 -0.535 -11.782 1.00 0.00 C ATOM 825 CE2 PHE A 175 10.673 1.668 -12.808 1.00 0.00 C ATOM 826 CZ PHE A 175 11.036 0.310 -12.779 1.00 0.00 C ATOM 0 H PHE A 175 6.892 3.308 -11.055 1.00 0.00 H new ATOM 0 HA PHE A 175 6.822 0.527 -10.285 1.00 0.00 H new ATOM 0 HB2 PHE A 175 8.485 2.973 -9.711 1.00 0.00 H new ATOM 0 HB3 PHE A 175 8.713 1.505 -8.781 1.00 0.00 H new ATOM 0 HD1 PHE A 175 9.253 -0.667 -10.042 1.00 0.00 H new ATOM 0 HD2 PHE A 175 9.503 3.222 -11.870 1.00 0.00 H new ATOM 0 HE1 PHE A 175 10.793 -1.580 -11.763 1.00 0.00 H new ATOM 0 HE2 PHE A 175 11.071 2.317 -13.574 1.00 0.00 H new ATOM 0 HZ PHE A 175 11.712 -0.084 -13.524 1.00 0.00 H new ATOM 836 N VAL A 176 5.269 2.546 -8.356 1.00 0.00 N ATOM 837 CA VAL A 176 4.272 2.508 -7.283 1.00 0.00 C ATOM 838 C VAL A 176 3.146 1.534 -7.630 1.00 0.00 C ATOM 839 O VAL A 176 2.586 0.907 -6.732 1.00 0.00 O ATOM 840 CB VAL A 176 3.754 3.915 -6.964 1.00 0.00 C ATOM 841 CG1 VAL A 176 2.383 3.959 -6.289 1.00 0.00 C ATOM 842 CG2 VAL A 176 4.832 4.585 -6.113 1.00 0.00 C ATOM 0 H VAL A 176 5.249 3.406 -8.905 1.00 0.00 H new ATOM 0 HA VAL A 176 4.748 2.137 -6.375 1.00 0.00 H new ATOM 0 HB VAL A 176 3.581 4.448 -7.899 1.00 0.00 H new ATOM 0 HG11 VAL A 176 2.102 4.996 -6.103 1.00 0.00 H new ATOM 0 HG12 VAL A 176 1.642 3.493 -6.939 1.00 0.00 H new ATOM 0 HG13 VAL A 176 2.426 3.420 -5.343 1.00 0.00 H new ATOM 0 HG21 VAL A 176 4.516 5.596 -5.855 1.00 0.00 H new ATOM 0 HG22 VAL A 176 4.986 4.008 -5.201 1.00 0.00 H new ATOM 0 HG23 VAL A 176 5.764 4.630 -6.676 1.00 0.00 H new ATOM 852 N HIS A 177 2.861 1.323 -8.920 1.00 0.00 N ATOM 853 CA HIS A 177 1.936 0.264 -9.324 1.00 0.00 C ATOM 854 C HIS A 177 2.536 -1.123 -9.087 1.00 0.00 C ATOM 855 O HIS A 177 1.808 -2.019 -8.659 1.00 0.00 O ATOM 856 CB HIS A 177 1.394 0.496 -10.737 1.00 0.00 C ATOM 857 CG HIS A 177 -0.072 0.848 -10.661 1.00 0.00 C ATOM 858 ND1 HIS A 177 -1.101 -0.069 -10.551 1.00 0.00 N ATOM 859 CD2 HIS A 177 -0.578 2.090 -10.396 1.00 0.00 C ATOM 860 CE1 HIS A 177 -2.221 0.607 -10.242 1.00 0.00 C ATOM 861 NE2 HIS A 177 -1.929 1.917 -10.139 1.00 0.00 N ATOM 0 H HIS A 177 3.252 1.864 -9.691 1.00 0.00 H new ATOM 0 HA HIS A 177 1.058 0.305 -8.680 1.00 0.00 H new ATOM 0 HB2 HIS A 177 1.947 1.299 -11.223 1.00 0.00 H new ATOM 0 HB3 HIS A 177 1.533 -0.399 -11.343 1.00 0.00 H new ATOM 0 HD2 HIS A 177 -0.033 3.022 -10.388 1.00 0.00 H new ATOM 0 HE1 HIS A 177 -3.198 0.169 -10.099 1.00 0.00 H new ATOM 0 HE2 HIS A 177 -2.591 2.658 -9.910 1.00 0.00 H new ATOM 870 N ASP A 178 3.852 -1.276 -9.274 1.00 0.00 N ATOM 871 CA ASP A 178 4.598 -2.461 -8.834 1.00 0.00 C ATOM 872 C ASP A 178 4.528 -2.603 -7.308 1.00 0.00 C ATOM 873 O ASP A 178 4.324 -3.704 -6.793 1.00 0.00 O ATOM 874 CB ASP A 178 6.090 -2.379 -9.191 1.00 0.00 C ATOM 875 CG ASP A 178 6.411 -2.561 -10.672 1.00 0.00 C ATOM 876 OD1 ASP A 178 6.155 -1.624 -11.466 1.00 0.00 O ATOM 877 OD2 ASP A 178 6.886 -3.660 -11.075 1.00 0.00 O ATOM 0 H ASP A 178 4.433 -0.577 -9.737 1.00 0.00 H new ATOM 0 HA ASP A 178 4.138 -3.308 -9.344 1.00 0.00 H new ATOM 0 HB2 ASP A 178 6.472 -1.411 -8.868 1.00 0.00 H new ATOM 0 HB3 ASP A 178 6.626 -3.139 -8.623 1.00 0.00 H new ATOM 882 N CYS A 179 4.714 -1.479 -6.607 1.00 0.00 N ATOM 883 CA CYS A 179 4.744 -1.389 -5.158 1.00 0.00 C ATOM 884 C CYS A 179 3.446 -1.916 -4.521 1.00 0.00 C ATOM 885 O CYS A 179 3.457 -2.843 -3.699 1.00 0.00 O ATOM 886 CB CYS A 179 5.013 0.054 -4.739 1.00 0.00 C ATOM 887 SG CYS A 179 4.976 0.351 -2.969 1.00 0.00 S ATOM 0 H CYS A 179 4.852 -0.576 -7.060 1.00 0.00 H new ATOM 0 HA CYS A 179 5.552 -2.024 -4.795 1.00 0.00 H new ATOM 0 HB2 CYS A 179 5.989 0.351 -5.122 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.274 0.698 -5.216 1.00 0.00 H new ATOM 892 N VAL A 180 2.302 -1.326 -4.902 1.00 0.00 N ATOM 893 CA VAL A 180 1.007 -1.728 -4.344 1.00 0.00 C ATOM 894 C VAL A 180 0.663 -3.168 -4.691 1.00 0.00 C ATOM 895 O VAL A 180 0.108 -3.884 -3.860 1.00 0.00 O ATOM 896 CB VAL A 180 -0.161 -0.834 -4.793 1.00 0.00 C ATOM 897 CG1 VAL A 180 0.054 0.577 -4.282 1.00 0.00 C ATOM 898 CG2 VAL A 180 -0.476 -0.717 -6.285 1.00 0.00 C ATOM 0 H VAL A 180 2.250 -0.574 -5.590 1.00 0.00 H new ATOM 0 HA VAL A 180 1.130 -1.619 -3.266 1.00 0.00 H new ATOM 0 HB VAL A 180 -1.016 -1.358 -4.367 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -0.774 1.210 -4.601 1.00 0.00 H new ATOM 0 HG12 VAL A 180 0.104 0.566 -3.193 1.00 0.00 H new ATOM 0 HG13 VAL A 180 0.987 0.971 -4.684 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -1.326 -0.050 -6.426 1.00 0.00 H new ATOM 0 HG22 VAL A 180 0.391 -0.316 -6.810 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -0.718 -1.702 -6.684 1.00 0.00 H new ATOM 908 N ASN A 181 1.030 -3.590 -5.903 1.00 0.00 N ATOM 909 CA ASN A 181 0.921 -4.949 -6.399 1.00 0.00 C ATOM 910 C ASN A 181 1.546 -5.939 -5.425 1.00 0.00 C ATOM 911 O ASN A 181 0.828 -6.763 -4.858 1.00 0.00 O ATOM 912 CB ASN A 181 1.514 -4.982 -7.807 1.00 0.00 C ATOM 913 CG ASN A 181 1.960 -6.348 -8.263 1.00 0.00 C ATOM 914 OD1 ASN A 181 1.157 -7.166 -8.688 1.00 0.00 O ATOM 915 ND2 ASN A 181 3.244 -6.622 -8.185 1.00 0.00 N ATOM 0 H ASN A 181 1.430 -2.955 -6.594 1.00 0.00 H new ATOM 0 HA ASN A 181 -0.120 -5.265 -6.471 1.00 0.00 H new ATOM 0 HB2 ASN A 181 0.772 -4.602 -8.509 1.00 0.00 H new ATOM 0 HB3 ASN A 181 2.366 -4.303 -7.845 1.00 0.00 H new ATOM 0 HD21 ASN A 181 3.590 -7.534 -8.483 1.00 0.00 H new ATOM 0 HD22 ASN A 181 3.894 -5.922 -7.827 1.00 0.00 H new ATOM 922 N ILE A 182 2.865 -5.871 -5.219 1.00 0.00 N ATOM 923 CA ILE A 182 3.532 -6.885 -4.417 1.00 0.00 C ATOM 924 C ILE A 182 3.146 -6.775 -2.934 1.00 0.00 C ATOM 925 O ILE A 182 2.942 -7.808 -2.298 1.00 0.00 O ATOM 926 CB ILE A 182 5.048 -6.890 -4.694 1.00 0.00 C ATOM 927 CG1 ILE A 182 5.766 -8.049 -3.976 1.00 0.00 C ATOM 928 CG2 ILE A 182 5.693 -5.533 -4.369 1.00 0.00 C ATOM 929 CD1 ILE A 182 5.414 -9.429 -4.544 1.00 0.00 C ATOM 0 H ILE A 182 3.474 -5.141 -5.589 1.00 0.00 H new ATOM 0 HA ILE A 182 3.179 -7.871 -4.719 1.00 0.00 H new ATOM 0 HB ILE A 182 5.171 -7.057 -5.764 1.00 0.00 H new ATOM 0 HG12 ILE A 182 6.843 -7.899 -4.047 1.00 0.00 H new ATOM 0 HG13 ILE A 182 5.510 -8.024 -2.917 1.00 0.00 H new ATOM 0 HG21 ILE A 182 6.762 -5.579 -4.578 1.00 0.00 H new ATOM 0 HG22 ILE A 182 5.236 -4.757 -4.983 1.00 0.00 H new ATOM 0 HG23 ILE A 182 5.539 -5.300 -3.315 1.00 0.00 H new ATOM 0 HD11 ILE A 182 5.954 -10.198 -3.992 1.00 0.00 H new ATOM 0 HD12 ILE A 182 4.342 -9.599 -4.448 1.00 0.00 H new ATOM 0 HD13 ILE A 182 5.695 -9.472 -5.596 1.00 0.00 H new ATOM 941 N THR A 183 2.933 -5.552 -2.415 1.00 0.00 N ATOM 942 CA THR A 183 2.364 -5.276 -1.095 1.00 0.00 C ATOM 943 C THR A 183 1.135 -6.135 -0.857 1.00 0.00 C ATOM 944 O THR A 183 1.098 -6.992 0.026 1.00 0.00 O ATOM 945 CB THR A 183 2.031 -3.789 -0.935 1.00 0.00 C ATOM 946 OG1 THR A 183 3.197 -3.031 -1.130 1.00 0.00 O ATOM 947 CG2 THR A 183 1.435 -3.581 0.455 1.00 0.00 C ATOM 0 H THR A 183 3.163 -4.701 -2.928 1.00 0.00 H new ATOM 0 HA THR A 183 3.112 -5.529 -0.344 1.00 0.00 H new ATOM 0 HB THR A 183 1.301 -3.462 -1.676 1.00 0.00 H new ATOM 0 HG1 THR A 183 3.164 -2.600 -2.009 1.00 0.00 H new ATOM 0 HG21 THR A 183 1.190 -2.528 0.592 1.00 0.00 H new ATOM 0 HG22 THR A 183 0.530 -4.180 0.556 1.00 0.00 H new ATOM 0 HG23 THR A 183 2.159 -3.886 1.211 1.00 0.00 H new ATOM 955 N ILE A 184 0.134 -5.888 -1.692 1.00 0.00 N ATOM 956 CA ILE A 184 -1.160 -6.544 -1.628 1.00 0.00 C ATOM 957 C ILE A 184 -1.007 -8.045 -1.861 1.00 0.00 C ATOM 958 O ILE A 184 -1.470 -8.812 -1.014 1.00 0.00 O ATOM 959 CB ILE A 184 -2.128 -5.828 -2.594 1.00 0.00 C ATOM 960 CG1 ILE A 184 -2.434 -4.442 -1.968 1.00 0.00 C ATOM 961 CG2 ILE A 184 -3.402 -6.640 -2.869 1.00 0.00 C ATOM 962 CD1 ILE A 184 -3.314 -3.511 -2.796 1.00 0.00 C ATOM 0 H ILE A 184 0.204 -5.209 -2.450 1.00 0.00 H new ATOM 0 HA ILE A 184 -1.600 -6.462 -0.634 1.00 0.00 H new ATOM 0 HB ILE A 184 -1.667 -5.714 -3.575 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -2.915 -4.600 -1.003 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -1.488 -3.937 -1.774 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -4.045 -6.087 -3.554 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -3.134 -7.598 -3.315 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -3.933 -6.812 -1.933 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -3.459 -2.574 -2.258 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -2.832 -3.310 -3.753 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.281 -3.983 -2.970 1.00 0.00 H new ATOM 974 N LYS A 185 -0.329 -8.492 -2.929 1.00 0.00 N ATOM 975 CA LYS A 185 -0.160 -9.923 -3.232 1.00 0.00 C ATOM 976 C LYS A 185 0.369 -10.712 -2.049 1.00 0.00 C ATOM 977 O LYS A 185 -0.232 -11.711 -1.671 1.00 0.00 O ATOM 978 CB LYS A 185 0.748 -10.135 -4.446 1.00 0.00 C ATOM 979 CG LYS A 185 -0.043 -9.827 -5.713 1.00 0.00 C ATOM 980 CD LYS A 185 0.806 -10.041 -6.967 1.00 0.00 C ATOM 981 CE LYS A 185 -0.063 -10.150 -8.226 1.00 0.00 C ATOM 982 NZ LYS A 185 -0.886 -8.939 -8.428 1.00 0.00 N ATOM 0 H LYS A 185 0.117 -7.874 -3.606 1.00 0.00 H new ATOM 0 HA LYS A 185 -1.156 -10.300 -3.464 1.00 0.00 H new ATOM 0 HB2 LYS A 185 1.622 -9.488 -4.381 1.00 0.00 H new ATOM 0 HB3 LYS A 185 1.113 -11.162 -4.469 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -0.926 -10.465 -5.756 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -0.396 -8.796 -5.682 1.00 0.00 H new ATOM 0 HD2 LYS A 185 1.506 -9.213 -7.078 1.00 0.00 H new ATOM 0 HD3 LYS A 185 1.400 -10.948 -6.855 1.00 0.00 H new ATOM 0 HE2 LYS A 185 0.575 -10.306 -9.096 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -0.712 -11.022 -8.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 -1.316 -8.965 -9.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -1.636 -8.905 -7.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 -0.286 -8.094 -8.343 1.00 0.00 H new ATOM 996 N GLN A 186 1.440 -10.251 -1.404 1.00 0.00 N ATOM 997 CA GLN A 186 1.974 -10.982 -0.260 1.00 0.00 C ATOM 998 C GLN A 186 1.008 -11.022 0.917 1.00 0.00 C ATOM 999 O GLN A 186 0.900 -12.045 1.597 1.00 0.00 O ATOM 1000 CB GLN A 186 3.250 -10.299 0.220 1.00 0.00 C ATOM 1001 CG GLN A 186 4.397 -10.387 -0.785 1.00 0.00 C ATOM 1002 CD GLN A 186 4.660 -11.810 -1.237 1.00 0.00 C ATOM 1003 OE1 GLN A 186 5.089 -12.667 -0.474 1.00 0.00 O ATOM 1004 NE2 GLN A 186 4.378 -12.070 -2.498 1.00 0.00 N ATOM 0 H GLN A 186 1.943 -9.397 -1.647 1.00 0.00 H new ATOM 0 HA GLN A 186 2.155 -12.003 -0.596 1.00 0.00 H new ATOM 0 HB2 GLN A 186 3.037 -9.250 0.427 1.00 0.00 H new ATOM 0 HB3 GLN A 186 3.565 -10.752 1.160 1.00 0.00 H new ATOM 0 HG2 GLN A 186 4.164 -9.770 -1.653 1.00 0.00 H new ATOM 0 HG3 GLN A 186 5.302 -9.978 -0.336 1.00 0.00 H new ATOM 0 HE21 GLN A 186 4.022 -11.331 -3.104 1.00 0.00 H new ATOM 0 HE22 GLN A 186 4.515 -13.011 -2.868 1.00 0.00 H new ATOM 1013 N HIS A 187 0.309 -9.911 1.158 1.00 0.00 N ATOM 1014 CA HIS A 187 -0.486 -9.707 2.356 1.00 0.00 C ATOM 1015 C HIS A 187 -1.731 -10.576 2.271 1.00 0.00 C ATOM 1016 O HIS A 187 -2.036 -11.299 3.222 1.00 0.00 O ATOM 1017 CB HIS A 187 -0.822 -8.214 2.540 1.00 0.00 C ATOM 1018 CG HIS A 187 -1.041 -7.917 4.001 1.00 0.00 C ATOM 1019 ND1 HIS A 187 -2.220 -8.121 4.685 1.00 0.00 N ATOM 1020 CD2 HIS A 187 -0.086 -7.539 4.904 1.00 0.00 C ATOM 1021 CE1 HIS A 187 -1.983 -7.891 5.990 1.00 0.00 C ATOM 1022 NE2 HIS A 187 -0.695 -7.522 6.147 1.00 0.00 N ATOM 0 H HIS A 187 0.283 -9.121 0.513 1.00 0.00 H new ATOM 0 HA HIS A 187 0.081 -10.004 3.238 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -0.010 -7.599 2.152 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -1.715 -7.960 1.970 1.00 0.00 H new ATOM 0 HD2 HIS A 187 0.945 -7.300 4.689 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -2.708 -7.987 6.784 1.00 0.00 H new ATOM 0 HE2 HIS A 187 -0.247 -7.273 7.029 1.00 0.00 H new ATOM 1031 N THR A 188 -2.354 -10.513 1.087 1.00 0.00 N ATOM 1032 CA THR A 188 -3.527 -11.249 0.617 1.00 0.00 C ATOM 1033 C THR A 188 -3.244 -12.741 0.542 1.00 0.00 C ATOM 1034 O THR A 188 -3.853 -13.482 1.298 1.00 0.00 O ATOM 1035 CB THR A 188 -4.035 -10.734 -0.736 1.00 0.00 C ATOM 1036 OG1 THR A 188 -3.022 -10.703 -1.705 1.00 0.00 O ATOM 1037 CG2 THR A 188 -4.630 -9.335 -0.615 1.00 0.00 C ATOM 0 H THR A 188 -2.011 -9.880 0.364 1.00 0.00 H new ATOM 0 HA THR A 188 -4.316 -11.078 1.349 1.00 0.00 H new ATOM 0 HB THR A 188 -4.807 -11.436 -1.050 1.00 0.00 H new ATOM 0 HG1 THR A 188 -2.461 -9.912 -1.566 1.00 0.00 H new ATOM 0 HG21 THR A 188 -4.979 -9.002 -1.592 1.00 0.00 H new ATOM 0 HG22 THR A 188 -5.468 -9.355 0.082 1.00 0.00 H new ATOM 0 HG23 THR A 188 -3.869 -8.646 -0.248 1.00 0.00 H new ATOM 1045 N VAL A 189 -2.291 -13.194 -0.283 1.00 0.00 N ATOM 1046 CA VAL A 189 -1.946 -14.624 -0.407 1.00 0.00 C ATOM 1047 C VAL A 189 -1.657 -15.252 0.952 1.00 0.00 C ATOM 1048 O VAL A 189 -2.170 -16.329 1.251 1.00 0.00 O ATOM 1049 CB VAL A 189 -0.767 -14.842 -1.366 1.00 0.00 C ATOM 1050 CG1 VAL A 189 -0.272 -16.295 -1.412 1.00 0.00 C ATOM 1051 CG2 VAL A 189 -1.127 -14.441 -2.805 1.00 0.00 C ATOM 0 H VAL A 189 -1.736 -12.584 -0.884 1.00 0.00 H new ATOM 0 HA VAL A 189 -2.818 -15.124 -0.829 1.00 0.00 H new ATOM 0 HB VAL A 189 0.026 -14.209 -0.967 1.00 0.00 H new ATOM 0 HG11 VAL A 189 0.562 -16.373 -2.110 1.00 0.00 H new ATOM 0 HG12 VAL A 189 0.057 -16.599 -0.418 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -1.083 -16.945 -1.741 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -0.268 -14.609 -3.455 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -1.967 -15.043 -3.151 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -1.401 -13.386 -2.831 1.00 0.00 H new ATOM 1061 N THR A 190 -0.892 -14.550 1.794 1.00 0.00 N ATOM 1062 CA THR A 190 -0.592 -15.013 3.158 1.00 0.00 C ATOM 1063 C THR A 190 -1.888 -15.234 3.943 1.00 0.00 C ATOM 1064 O THR A 190 -2.139 -16.346 4.412 1.00 0.00 O ATOM 1065 CB THR A 190 0.361 -14.058 3.898 1.00 0.00 C ATOM 1066 OG1 THR A 190 1.546 -13.905 3.149 1.00 0.00 O ATOM 1067 CG2 THR A 190 0.768 -14.567 5.279 1.00 0.00 C ATOM 0 H THR A 190 -0.466 -13.654 1.556 1.00 0.00 H new ATOM 0 HA THR A 190 -0.072 -15.968 3.078 1.00 0.00 H new ATOM 0 HB THR A 190 -0.180 -13.119 4.018 1.00 0.00 H new ATOM 0 HG1 THR A 190 1.547 -13.027 2.714 1.00 0.00 H new ATOM 0 HG21 THR A 190 1.440 -13.848 5.748 1.00 0.00 H new ATOM 0 HG22 THR A 190 -0.121 -14.690 5.898 1.00 0.00 H new ATOM 0 HG23 THR A 190 1.276 -15.526 5.178 1.00 0.00 H new ATOM 1075 N THR A 191 -2.740 -14.207 4.056 1.00 0.00 N ATOM 1076 CA THR A 191 -4.003 -14.298 4.787 1.00 0.00 C ATOM 1077 C THR A 191 -5.056 -15.176 4.126 1.00 0.00 C ATOM 1078 O THR A 191 -5.950 -15.618 4.837 1.00 0.00 O ATOM 1079 CB THR A 191 -4.609 -12.929 5.100 1.00 0.00 C ATOM 1080 OG1 THR A 191 -5.695 -13.084 5.993 1.00 0.00 O ATOM 1081 CG2 THR A 191 -5.103 -12.155 3.888 1.00 0.00 C ATOM 0 H THR A 191 -2.570 -13.291 3.642 1.00 0.00 H new ATOM 0 HA THR A 191 -3.716 -14.784 5.719 1.00 0.00 H new ATOM 0 HB THR A 191 -3.794 -12.349 5.533 1.00 0.00 H new ATOM 0 HG1 THR A 191 -6.117 -13.956 5.847 1.00 0.00 H new ATOM 0 HG21 THR A 191 -5.515 -11.199 4.210 1.00 0.00 H new ATOM 0 HG22 THR A 191 -4.272 -11.980 3.204 1.00 0.00 H new ATOM 0 HG23 THR A 191 -5.876 -12.730 3.379 1.00 0.00 H new ATOM 1089 N THR A 192 -4.970 -15.448 2.823 1.00 0.00 N ATOM 1090 CA THR A 192 -5.844 -16.386 2.106 1.00 0.00 C ATOM 1091 C THR A 192 -5.658 -17.810 2.619 1.00 0.00 C ATOM 1092 O THR A 192 -6.643 -18.536 2.759 1.00 0.00 O ATOM 1093 CB THR A 192 -5.630 -16.298 0.582 1.00 0.00 C ATOM 1094 OG1 THR A 192 -5.994 -15.016 0.098 1.00 0.00 O ATOM 1095 CG2 THR A 192 -6.484 -17.293 -0.205 1.00 0.00 C ATOM 0 H THR A 192 -4.273 -15.012 2.219 1.00 0.00 H new ATOM 0 HA THR A 192 -6.877 -16.099 2.304 1.00 0.00 H new ATOM 0 HB THR A 192 -4.572 -16.516 0.435 1.00 0.00 H new ATOM 0 HG1 THR A 192 -6.298 -14.459 0.845 1.00 0.00 H new ATOM 0 HG21 THR A 192 -6.286 -17.179 -1.271 1.00 0.00 H new ATOM 0 HG22 THR A 192 -6.237 -18.309 0.104 1.00 0.00 H new ATOM 0 HG23 THR A 192 -7.539 -17.101 -0.010 1.00 0.00 H new ATOM 1103 N THR A 193 -4.424 -18.181 2.990 1.00 0.00 N ATOM 1104 CA THR A 193 -4.160 -19.443 3.700 1.00 0.00 C ATOM 1105 C THR A 193 -4.870 -19.503 5.056 1.00 0.00 C ATOM 1106 O THR A 193 -5.461 -20.525 5.416 1.00 0.00 O ATOM 1107 CB THR A 193 -2.657 -19.715 3.890 1.00 0.00 C ATOM 1108 OG1 THR A 193 -2.058 -18.867 4.850 1.00 0.00 O ATOM 1109 CG2 THR A 193 -1.864 -19.618 2.590 1.00 0.00 C ATOM 0 H THR A 193 -3.589 -17.623 2.810 1.00 0.00 H new ATOM 0 HA THR A 193 -4.567 -20.225 3.059 1.00 0.00 H new ATOM 0 HB THR A 193 -2.616 -20.742 4.253 1.00 0.00 H new ATOM 0 HG1 THR A 193 -2.472 -17.980 4.806 1.00 0.00 H new ATOM 0 HG21 THR A 193 -0.812 -19.820 2.790 1.00 0.00 H new ATOM 0 HG22 THR A 193 -2.245 -20.349 1.876 1.00 0.00 H new ATOM 0 HG23 THR A 193 -1.969 -18.616 2.174 1.00 0.00 H new ATOM 1117 N LYS A 194 -4.868 -18.382 5.790 1.00 0.00 N ATOM 1118 CA LYS A 194 -5.545 -18.220 7.075 1.00 0.00 C ATOM 1119 C LYS A 194 -7.061 -18.205 6.896 1.00 0.00 C ATOM 1120 O LYS A 194 -7.754 -18.847 7.691 1.00 0.00 O ATOM 1121 CB LYS A 194 -5.055 -16.956 7.804 1.00 0.00 C ATOM 1122 CG LYS A 194 -3.523 -16.876 7.846 1.00 0.00 C ATOM 1123 CD LYS A 194 -3.023 -15.660 8.628 1.00 0.00 C ATOM 1124 CE LYS A 194 -1.498 -15.608 8.499 1.00 0.00 C ATOM 1125 NZ LYS A 194 -0.949 -14.409 9.160 1.00 0.00 N ATOM 0 H LYS A 194 -4.378 -17.538 5.492 1.00 0.00 H new ATOM 0 HA LYS A 194 -5.293 -19.078 7.698 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -5.451 -16.072 7.304 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -5.447 -16.949 8.821 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -3.127 -17.784 8.300 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -3.136 -16.834 6.828 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -3.470 -14.746 8.237 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -3.314 -15.735 9.676 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -1.062 -16.503 8.942 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -1.219 -15.606 7.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 0.086 -14.399 9.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -1.349 -13.556 8.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -1.196 -14.425 10.170 1.00 0.00 H new ATOM 1139 N GLY A 195 -7.556 -17.571 5.830 1.00 0.00 N ATOM 1140 CA GLY A 195 -8.960 -17.548 5.437 1.00 0.00 C ATOM 1141 C GLY A 195 -9.386 -16.508 4.399 1.00 0.00 C ATOM 1142 O GLY A 195 -10.324 -16.754 3.643 1.00 0.00 O ATOM 0 H GLY A 195 -6.962 -17.039 5.194 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -9.217 -18.534 5.050 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -9.558 -17.392 6.335 1.00 0.00 H new ATOM 1146 N GLU A 196 -8.741 -15.343 4.339 1.00 0.00 N ATOM 1147 CA GLU A 196 -9.226 -14.216 3.544 1.00 0.00 C ATOM 1148 C GLU A 196 -8.666 -14.122 2.130 1.00 0.00 C ATOM 1149 O GLU A 196 -7.477 -13.938 1.876 1.00 0.00 O ATOM 1150 CB GLU A 196 -9.020 -12.887 4.257 1.00 0.00 C ATOM 1151 CG GLU A 196 -10.150 -12.696 5.253 1.00 0.00 C ATOM 1152 CD GLU A 196 -9.873 -11.552 6.230 1.00 0.00 C ATOM 1153 OE1 GLU A 196 -9.039 -11.748 7.162 1.00 0.00 O ATOM 1154 OE2 GLU A 196 -10.495 -10.470 6.039 1.00 0.00 O ATOM 0 H GLU A 196 -7.871 -15.155 4.838 1.00 0.00 H new ATOM 0 HA GLU A 196 -10.290 -14.425 3.437 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -8.058 -12.877 4.769 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -9.007 -12.069 3.537 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -11.076 -12.495 4.715 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -10.300 -13.620 5.811 1.00 0.00 H new ATOM 1161 N ASN A 197 -9.603 -14.120 1.201 1.00 0.00 N ATOM 1162 CA ASN A 197 -9.420 -13.930 -0.215 1.00 0.00 C ATOM 1163 C ASN A 197 -10.044 -12.593 -0.577 1.00 0.00 C ATOM 1164 O ASN A 197 -11.254 -12.478 -0.808 1.00 0.00 O ATOM 1165 CB ASN A 197 -9.959 -15.110 -1.001 1.00 0.00 C ATOM 1166 CG ASN A 197 -9.578 -14.936 -2.459 1.00 0.00 C ATOM 1167 OD1 ASN A 197 -8.406 -14.994 -2.812 1.00 0.00 O ATOM 1168 ND2 ASN A 197 -10.528 -14.600 -3.301 1.00 0.00 N ATOM 0 H ASN A 197 -10.584 -14.262 1.441 1.00 0.00 H new ATOM 0 HA ASN A 197 -8.364 -13.895 -0.483 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -9.550 -16.042 -0.612 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -11.042 -15.170 -0.898 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -10.297 -14.381 -4.270 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -11.497 -14.558 -2.986 1.00 0.00 H new ATOM 1175 N PHE A 198 -9.210 -11.573 -0.451 1.00 0.00 N ATOM 1176 CA PHE A 198 -9.566 -10.165 -0.520 1.00 0.00 C ATOM 1177 C PHE A 198 -10.317 -9.853 -1.810 1.00 0.00 C ATOM 1178 O PHE A 198 -9.991 -10.352 -2.889 1.00 0.00 O ATOM 1179 CB PHE A 198 -8.287 -9.350 -0.381 1.00 0.00 C ATOM 1180 CG PHE A 198 -7.924 -9.068 1.067 1.00 0.00 C ATOM 1181 CD1 PHE A 198 -7.742 -10.097 2.012 1.00 0.00 C ATOM 1182 CD2 PHE A 198 -7.895 -7.737 1.498 1.00 0.00 C ATOM 1183 CE1 PHE A 198 -7.633 -9.780 3.378 1.00 0.00 C ATOM 1184 CE2 PHE A 198 -7.828 -7.427 2.864 1.00 0.00 C ATOM 1185 CZ PHE A 198 -7.710 -8.449 3.812 1.00 0.00 C ATOM 0 H PHE A 198 -8.213 -11.713 -0.289 1.00 0.00 H new ATOM 0 HA PHE A 198 -10.245 -9.903 0.291 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -7.467 -9.885 -0.859 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -8.404 -8.405 -0.912 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -7.686 -11.126 1.689 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -7.925 -6.939 0.770 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -7.488 -10.570 4.100 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -7.868 -6.397 3.185 1.00 0.00 H new ATOM 0 HZ PHE A 198 -7.679 -8.215 4.866 1.00 0.00 H new ATOM 1195 N THR A 199 -11.339 -9.024 -1.647 1.00 0.00 N ATOM 1196 CA THR A 199 -12.275 -8.608 -2.695 1.00 0.00 C ATOM 1197 C THR A 199 -11.827 -7.292 -3.292 1.00 0.00 C ATOM 1198 O THR A 199 -11.085 -6.565 -2.650 1.00 0.00 O ATOM 1199 CB THR A 199 -13.680 -8.389 -2.117 1.00 0.00 C ATOM 1200 OG1 THR A 199 -13.666 -7.404 -1.095 1.00 0.00 O ATOM 1201 CG2 THR A 199 -14.269 -9.701 -1.611 1.00 0.00 C ATOM 0 H THR A 199 -11.552 -8.602 -0.743 1.00 0.00 H new ATOM 0 HA THR A 199 -12.296 -9.395 -3.448 1.00 0.00 H new ATOM 0 HB THR A 199 -14.320 -8.022 -2.919 1.00 0.00 H new ATOM 0 HG1 THR A 199 -13.534 -7.836 -0.226 1.00 0.00 H new ATOM 0 HG21 THR A 199 -15.265 -9.521 -1.206 1.00 0.00 H new ATOM 0 HG22 THR A 199 -14.336 -10.412 -2.435 1.00 0.00 H new ATOM 0 HG23 THR A 199 -13.628 -10.110 -0.830 1.00 0.00 H new ATOM 1209 N GLU A 200 -12.367 -6.905 -4.445 1.00 0.00 N ATOM 1210 CA GLU A 200 -12.181 -5.583 -5.034 1.00 0.00 C ATOM 1211 C GLU A 200 -12.518 -4.456 -4.045 1.00 0.00 C ATOM 1212 O GLU A 200 -11.858 -3.427 -4.072 1.00 0.00 O ATOM 1213 CB GLU A 200 -13.013 -5.453 -6.306 1.00 0.00 C ATOM 1214 CG GLU A 200 -12.472 -4.323 -7.183 1.00 0.00 C ATOM 1215 CD GLU A 200 -13.344 -4.019 -8.398 1.00 0.00 C ATOM 1216 OE1 GLU A 200 -14.355 -4.734 -8.649 1.00 0.00 O ATOM 1217 OE2 GLU A 200 -13.037 -2.994 -9.072 1.00 0.00 O ATOM 0 H GLU A 200 -12.959 -7.516 -5.008 1.00 0.00 H new ATOM 0 HA GLU A 200 -11.126 -5.480 -5.286 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -12.993 -6.392 -6.859 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -14.054 -5.256 -6.049 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -12.377 -3.420 -6.580 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -11.470 -4.586 -7.522 1.00 0.00 H new ATOM 1224 N THR A 201 -13.476 -4.652 -3.130 1.00 0.00 N ATOM 1225 CA THR A 201 -13.715 -3.730 -2.022 1.00 0.00 C ATOM 1226 C THR A 201 -12.568 -3.663 -1.021 1.00 0.00 C ATOM 1227 O THR A 201 -12.080 -2.572 -0.743 1.00 0.00 O ATOM 1228 CB THR A 201 -15.039 -3.999 -1.286 1.00 0.00 C ATOM 1229 OG1 THR A 201 -15.319 -5.372 -1.041 1.00 0.00 O ATOM 1230 CG2 THR A 201 -16.198 -3.466 -2.121 1.00 0.00 C ATOM 0 H THR A 201 -14.105 -5.455 -3.141 1.00 0.00 H new ATOM 0 HA THR A 201 -13.786 -2.755 -2.504 1.00 0.00 H new ATOM 0 HB THR A 201 -14.930 -3.502 -0.322 1.00 0.00 H new ATOM 0 HG1 THR A 201 -14.482 -5.882 -1.042 1.00 0.00 H new ATOM 0 HG21 THR A 201 -17.138 -3.655 -1.602 1.00 0.00 H new ATOM 0 HG22 THR A 201 -16.076 -2.393 -2.270 1.00 0.00 H new ATOM 0 HG23 THR A 201 -16.210 -3.968 -3.088 1.00 0.00 H new ATOM 1238 N ASP A 202 -12.122 -4.812 -0.503 1.00 0.00 N ATOM 1239 CA ASP A 202 -10.980 -4.895 0.415 1.00 0.00 C ATOM 1240 C ASP A 202 -9.712 -4.299 -0.231 1.00 0.00 C ATOM 1241 O ASP A 202 -8.993 -3.497 0.365 1.00 0.00 O ATOM 1242 CB ASP A 202 -10.720 -6.355 0.816 1.00 0.00 C ATOM 1243 CG ASP A 202 -11.879 -7.133 1.431 1.00 0.00 C ATOM 1244 OD1 ASP A 202 -12.319 -6.824 2.565 1.00 0.00 O ATOM 1245 OD2 ASP A 202 -12.315 -8.130 0.804 1.00 0.00 O ATOM 0 H ASP A 202 -12.545 -5.717 -0.710 1.00 0.00 H new ATOM 0 HA ASP A 202 -11.222 -4.317 1.307 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -10.387 -6.893 -0.071 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -9.893 -6.367 1.526 1.00 0.00 H new ATOM 1250 N ILE A 203 -9.498 -4.673 -1.493 1.00 0.00 N ATOM 1251 CA ILE A 203 -8.493 -4.197 -2.434 1.00 0.00 C ATOM 1252 C ILE A 203 -8.559 -2.694 -2.564 1.00 0.00 C ATOM 1253 O ILE A 203 -7.566 -2.039 -2.279 1.00 0.00 O ATOM 1254 CB ILE A 203 -8.716 -4.896 -3.795 1.00 0.00 C ATOM 1255 CG1 ILE A 203 -8.255 -6.358 -3.719 1.00 0.00 C ATOM 1256 CG2 ILE A 203 -8.143 -4.212 -5.049 1.00 0.00 C ATOM 1257 CD1 ILE A 203 -6.739 -6.471 -3.758 1.00 0.00 C ATOM 0 H ILE A 203 -10.085 -5.389 -1.921 1.00 0.00 H new ATOM 0 HA ILE A 203 -7.495 -4.443 -2.070 1.00 0.00 H new ATOM 0 HB ILE A 203 -9.793 -4.822 -3.947 1.00 0.00 H new ATOM 0 HG12 ILE A 203 -8.630 -6.811 -2.801 1.00 0.00 H new ATOM 0 HG13 ILE A 203 -8.683 -6.919 -4.550 1.00 0.00 H new ATOM 0 HG21 ILE A 203 -8.374 -4.813 -5.929 1.00 0.00 H new ATOM 0 HG22 ILE A 203 -8.586 -3.222 -5.158 1.00 0.00 H new ATOM 0 HG23 ILE A 203 -7.062 -4.116 -4.949 1.00 0.00 H new ATOM 0 HD11 ILE A 203 -6.451 -7.521 -3.702 1.00 0.00 H new ATOM 0 HD12 ILE A 203 -6.366 -6.041 -4.688 1.00 0.00 H new ATOM 0 HD13 ILE A 203 -6.312 -5.932 -2.912 1.00 0.00 H new ATOM 1269 N LYS A 204 -9.698 -2.139 -2.991 1.00 0.00 N ATOM 1270 CA LYS A 204 -9.779 -0.721 -3.325 1.00 0.00 C ATOM 1271 C LYS A 204 -9.387 0.167 -2.156 1.00 0.00 C ATOM 1272 O LYS A 204 -8.725 1.176 -2.395 1.00 0.00 O ATOM 1273 CB LYS A 204 -11.155 -0.319 -3.861 1.00 0.00 C ATOM 1274 CG LYS A 204 -11.090 -0.366 -5.390 1.00 0.00 C ATOM 1275 CD LYS A 204 -12.370 0.139 -6.044 1.00 0.00 C ATOM 1276 CE LYS A 204 -12.751 1.596 -5.728 1.00 0.00 C ATOM 1277 NZ LYS A 204 -11.645 2.561 -5.948 1.00 0.00 N ATOM 0 H LYS A 204 -10.572 -2.652 -3.112 1.00 0.00 H new ATOM 0 HA LYS A 204 -9.056 -0.567 -4.126 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -11.923 -0.997 -3.490 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -11.421 0.681 -3.520 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -10.249 0.236 -5.733 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -10.901 -1.390 -5.711 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -12.270 0.035 -7.124 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -13.192 -0.507 -5.737 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -13.601 1.883 -6.347 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -13.077 1.660 -4.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -11.971 3.521 -5.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -10.840 2.312 -5.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -11.348 2.527 -6.944 1.00 0.00 H new ATOM 1291 N ILE A 205 -9.749 -0.226 -0.929 1.00 0.00 N ATOM 1292 CA ILE A 205 -9.241 0.407 0.290 1.00 0.00 C ATOM 1293 C ILE A 205 -7.723 0.384 0.283 1.00 0.00 C ATOM 1294 O ILE A 205 -7.081 1.429 0.217 1.00 0.00 O ATOM 1295 CB ILE A 205 -9.755 -0.301 1.558 1.00 0.00 C ATOM 1296 CG1 ILE A 205 -11.273 -0.291 1.654 1.00 0.00 C ATOM 1297 CG2 ILE A 205 -9.143 0.324 2.821 1.00 0.00 C ATOM 1298 CD1 ILE A 205 -11.865 1.102 1.783 1.00 0.00 C ATOM 0 H ILE A 205 -10.401 -0.991 -0.755 1.00 0.00 H new ATOM 0 HA ILE A 205 -9.603 1.435 0.306 1.00 0.00 H new ATOM 0 HB ILE A 205 -9.438 -1.341 1.484 1.00 0.00 H new ATOM 0 HG12 ILE A 205 -11.688 -0.772 0.768 1.00 0.00 H new ATOM 0 HG13 ILE A 205 -11.578 -0.888 2.514 1.00 0.00 H new ATOM 0 HG21 ILE A 205 -9.521 -0.193 3.703 1.00 0.00 H new ATOM 0 HG22 ILE A 205 -8.058 0.231 2.784 1.00 0.00 H new ATOM 0 HG23 ILE A 205 -9.415 1.378 2.874 1.00 0.00 H new ATOM 0 HD11 ILE A 205 -12.951 1.031 1.847 1.00 0.00 H new ATOM 0 HD12 ILE A 205 -11.479 1.579 2.684 1.00 0.00 H new ATOM 0 HD13 ILE A 205 -11.590 1.696 0.911 1.00 0.00 H new ATOM 1310 N MET A 206 -7.166 -0.828 0.359 1.00 0.00 N ATOM 1311 CA MET A 206 -5.741 -1.082 0.451 1.00 0.00 C ATOM 1312 C MET A 206 -4.995 -0.339 -0.623 1.00 0.00 C ATOM 1313 O MET A 206 -4.257 0.558 -0.255 1.00 0.00 O ATOM 1314 CB MET A 206 -5.487 -2.576 0.362 1.00 0.00 C ATOM 1315 CG MET A 206 -5.851 -3.211 1.690 1.00 0.00 C ATOM 1316 SD MET A 206 -6.169 -4.982 1.598 1.00 0.00 S ATOM 1317 CE MET A 206 -4.988 -5.553 0.359 1.00 0.00 C ATOM 0 H MET A 206 -7.721 -1.683 0.357 1.00 0.00 H new ATOM 0 HA MET A 206 -5.374 -0.720 1.412 1.00 0.00 H new ATOM 0 HB2 MET A 206 -6.080 -3.013 -0.441 1.00 0.00 H new ATOM 0 HB3 MET A 206 -4.440 -2.768 0.126 1.00 0.00 H new ATOM 0 HG2 MET A 206 -5.042 -3.035 2.398 1.00 0.00 H new ATOM 0 HG3 MET A 206 -6.736 -2.714 2.087 1.00 0.00 H new ATOM 0 HE1 MET A 206 -4.957 -6.643 0.361 1.00 0.00 H new ATOM 0 HE2 MET A 206 -5.295 -5.201 -0.626 1.00 0.00 H new ATOM 0 HE3 MET A 206 -3.998 -5.161 0.592 1.00 0.00 H new ATOM 1327 N GLU A 207 -5.233 -0.646 -1.901 1.00 0.00 N ATOM 1328 CA GLU A 207 -4.780 0.085 -3.088 1.00 0.00 C ATOM 1329 C GLU A 207 -4.673 1.583 -2.863 1.00 0.00 C ATOM 1330 O GLU A 207 -3.664 2.163 -3.246 1.00 0.00 O ATOM 1331 CB GLU A 207 -5.723 -0.139 -4.269 1.00 0.00 C ATOM 1332 CG GLU A 207 -5.803 -1.600 -4.688 1.00 0.00 C ATOM 1333 CD GLU A 207 -4.958 -1.960 -5.913 1.00 0.00 C ATOM 1334 OE1 GLU A 207 -5.042 -1.279 -6.973 1.00 0.00 O ATOM 1335 OE2 GLU A 207 -4.336 -3.050 -5.909 1.00 0.00 O ATOM 0 H GLU A 207 -5.784 -1.467 -2.151 1.00 0.00 H new ATOM 0 HA GLU A 207 -3.787 -0.311 -3.303 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -6.720 0.214 -4.005 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -5.387 0.460 -5.116 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -5.488 -2.222 -3.850 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -6.844 -1.848 -4.896 1.00 0.00 H new ATOM 1342 N ARG A 208 -5.652 2.211 -2.211 1.00 0.00 N ATOM 1343 CA ARG A 208 -5.648 3.655 -2.069 1.00 0.00 C ATOM 1344 C ARG A 208 -4.699 4.113 -0.975 1.00 0.00 C ATOM 1345 O ARG A 208 -3.945 5.058 -1.192 1.00 0.00 O ATOM 1346 CB ARG A 208 -7.087 4.059 -1.818 1.00 0.00 C ATOM 1347 CG ARG A 208 -7.403 5.446 -2.345 1.00 0.00 C ATOM 1348 CD ARG A 208 -7.014 6.496 -1.327 1.00 0.00 C ATOM 1349 NE ARG A 208 -7.780 7.701 -1.596 1.00 0.00 N ATOM 1350 CZ ARG A 208 -7.406 8.956 -1.517 1.00 0.00 C ATOM 1351 NH1 ARG A 208 -6.157 9.319 -1.357 1.00 0.00 N ATOM 1352 NH2 ARG A 208 -8.352 9.842 -1.633 1.00 0.00 N ATOM 0 H ARG A 208 -6.448 1.742 -1.779 1.00 0.00 H new ATOM 0 HA ARG A 208 -5.274 4.143 -2.969 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -7.751 3.335 -2.289 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -7.288 4.026 -0.747 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -6.867 5.619 -3.278 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -8.467 5.524 -2.569 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -7.213 6.137 -0.317 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -5.946 6.704 -1.386 1.00 0.00 H new ATOM 0 HE ARG A 208 -8.746 7.550 -1.888 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -5.425 8.612 -1.288 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -5.917 10.309 -1.301 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -9.316 9.543 -1.776 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -8.129 10.836 -1.581 1.00 0.00 H new ATOM 1366 N VAL A 209 -4.694 3.433 0.175 1.00 0.00 N ATOM 1367 CA VAL A 209 -3.797 3.761 1.289 1.00 0.00 C ATOM 1368 C VAL A 209 -2.375 3.390 0.903 1.00 0.00 C ATOM 1369 O VAL A 209 -1.425 4.122 1.186 1.00 0.00 O ATOM 1370 CB VAL A 209 -4.191 2.998 2.574 1.00 0.00 C ATOM 1371 CG1 VAL A 209 -3.426 3.553 3.778 1.00 0.00 C ATOM 1372 CG2 VAL A 209 -5.683 3.107 2.891 1.00 0.00 C ATOM 0 H VAL A 209 -5.310 2.641 0.361 1.00 0.00 H new ATOM 0 HA VAL A 209 -3.874 4.829 1.491 1.00 0.00 H new ATOM 0 HB VAL A 209 -3.942 1.953 2.391 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -3.714 3.006 4.676 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -2.355 3.440 3.612 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -3.664 4.609 3.905 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -5.903 2.552 3.803 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -5.950 4.155 3.030 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -6.262 2.692 2.066 1.00 0.00 H new ATOM 1382 N VAL A 210 -2.242 2.246 0.232 1.00 0.00 N ATOM 1383 CA VAL A 210 -0.954 1.677 -0.110 1.00 0.00 C ATOM 1384 C VAL A 210 -0.318 2.424 -1.272 1.00 0.00 C ATOM 1385 O VAL A 210 0.876 2.651 -1.207 1.00 0.00 O ATOM 1386 CB VAL A 210 -1.057 0.159 -0.292 1.00 0.00 C ATOM 1387 CG1 VAL A 210 -1.831 -0.344 -1.497 1.00 0.00 C ATOM 1388 CG2 VAL A 210 0.312 -0.477 -0.424 1.00 0.00 C ATOM 0 H VAL A 210 -3.035 1.690 -0.088 1.00 0.00 H new ATOM 0 HA VAL A 210 -0.263 1.814 0.721 1.00 0.00 H new ATOM 0 HB VAL A 210 -1.602 -0.124 0.609 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -1.825 -1.434 -1.504 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -2.860 0.013 -1.444 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -1.365 0.027 -2.410 1.00 0.00 H new ATOM 0 HG21 VAL A 210 0.202 -1.554 -0.552 1.00 0.00 H new ATOM 0 HG22 VAL A 210 0.825 -0.059 -1.290 1.00 0.00 H new ATOM 0 HG23 VAL A 210 0.895 -0.276 0.475 1.00 0.00 H new ATOM 1398 N GLU A 211 -1.064 2.898 -2.278 1.00 0.00 N ATOM 1399 CA GLU A 211 -0.518 3.737 -3.350 1.00 0.00 C ATOM 1400 C GLU A 211 -0.025 5.084 -2.815 1.00 0.00 C ATOM 1401 O GLU A 211 1.089 5.498 -3.144 1.00 0.00 O ATOM 1402 CB GLU A 211 -1.579 3.867 -4.437 1.00 0.00 C ATOM 1403 CG GLU A 211 -1.209 4.786 -5.596 1.00 0.00 C ATOM 1404 CD GLU A 211 -2.386 5.028 -6.538 1.00 0.00 C ATOM 1405 OE1 GLU A 211 -3.388 4.267 -6.553 1.00 0.00 O ATOM 1406 OE2 GLU A 211 -2.326 6.026 -7.310 1.00 0.00 O ATOM 0 H GLU A 211 -2.062 2.710 -2.371 1.00 0.00 H new ATOM 0 HA GLU A 211 0.366 3.271 -3.785 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -1.793 2.875 -4.834 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -2.499 4.234 -3.983 1.00 0.00 H new ATOM 0 HG2 GLU A 211 -0.858 5.740 -5.203 1.00 0.00 H new ATOM 0 HG3 GLU A 211 -0.382 4.348 -6.155 1.00 0.00 H new ATOM 1413 N GLN A 212 -0.809 5.728 -1.942 1.00 0.00 N ATOM 1414 CA GLN A 212 -0.408 6.884 -1.162 1.00 0.00 C ATOM 1415 C GLN A 212 0.882 6.639 -0.370 1.00 0.00 C ATOM 1416 O GLN A 212 1.797 7.461 -0.424 1.00 0.00 O ATOM 1417 CB GLN A 212 -1.586 7.203 -0.239 1.00 0.00 C ATOM 1418 CG GLN A 212 -2.459 8.348 -0.746 1.00 0.00 C ATOM 1419 CD GLN A 212 -2.969 8.224 -2.181 1.00 0.00 C ATOM 1420 OE1 GLN A 212 -4.075 7.747 -2.414 1.00 0.00 O ATOM 1421 NE2 GLN A 212 -2.241 8.705 -3.172 1.00 0.00 N ATOM 0 H GLN A 212 -1.771 5.442 -1.760 1.00 0.00 H new ATOM 0 HA GLN A 212 -0.178 7.725 -1.816 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -2.201 6.310 -0.124 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -1.205 7.457 0.750 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -3.320 8.442 -0.084 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -1.891 9.274 -0.663 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -1.321 9.102 -2.983 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -2.599 8.679 -4.127 1.00 0.00 H new ATOM 1430 N MET A 213 0.982 5.520 0.349 1.00 0.00 N ATOM 1431 CA MET A 213 2.209 5.121 1.049 1.00 0.00 C ATOM 1432 C MET A 213 3.389 4.796 0.146 1.00 0.00 C ATOM 1433 O MET A 213 4.486 5.246 0.421 1.00 0.00 O ATOM 1434 CB MET A 213 1.932 3.914 1.922 1.00 0.00 C ATOM 1435 CG MET A 213 1.236 4.370 3.185 1.00 0.00 C ATOM 1436 SD MET A 213 2.204 5.445 4.298 1.00 0.00 S ATOM 1437 CE MET A 213 3.780 4.546 4.437 1.00 0.00 C ATOM 0 H MET A 213 0.212 4.861 0.464 1.00 0.00 H new ATOM 0 HA MET A 213 2.496 5.995 1.634 1.00 0.00 H new ATOM 0 HB2 MET A 213 1.309 3.197 1.387 1.00 0.00 H new ATOM 0 HB3 MET A 213 2.864 3.405 2.168 1.00 0.00 H new ATOM 0 HG2 MET A 213 0.327 4.900 2.902 1.00 0.00 H new ATOM 0 HG3 MET A 213 0.929 3.486 3.744 1.00 0.00 H new ATOM 0 HE1 MET A 213 4.374 4.975 5.244 1.00 0.00 H new ATOM 0 HE2 MET A 213 3.582 3.496 4.651 1.00 0.00 H new ATOM 0 HE3 MET A 213 4.330 4.628 3.499 1.00 0.00 H new ATOM 1447 N CYS A 214 3.178 4.022 -0.906 1.00 0.00 N ATOM 1448 CA CYS A 214 4.144 3.683 -1.949 1.00 0.00 C ATOM 1449 C CYS A 214 4.760 4.939 -2.572 1.00 0.00 C ATOM 1450 O CYS A 214 5.965 5.169 -2.463 1.00 0.00 O ATOM 1451 CB CYS A 214 3.410 2.861 -3.007 1.00 0.00 C ATOM 1452 SG CYS A 214 3.142 1.124 -2.614 1.00 0.00 S ATOM 0 H CYS A 214 2.271 3.584 -1.068 1.00 0.00 H new ATOM 0 HA CYS A 214 4.967 3.111 -1.520 1.00 0.00 H new ATOM 0 HB2 CYS A 214 2.441 3.325 -3.191 1.00 0.00 H new ATOM 0 HB3 CYS A 214 3.973 2.919 -3.939 1.00 0.00 H new ATOM 1457 N THR A 215 3.932 5.776 -3.209 1.00 0.00 N ATOM 1458 CA THR A 215 4.352 7.080 -3.724 1.00 0.00 C ATOM 1459 C THR A 215 5.004 7.929 -2.629 1.00 0.00 C ATOM 1460 O THR A 215 6.036 8.539 -2.888 1.00 0.00 O ATOM 1461 CB THR A 215 3.167 7.743 -4.457 1.00 0.00 C ATOM 1462 OG1 THR A 215 3.547 8.350 -5.673 1.00 0.00 O ATOM 1463 CG2 THR A 215 2.425 8.752 -3.604 1.00 0.00 C ATOM 0 H THR A 215 2.949 5.565 -3.381 1.00 0.00 H new ATOM 0 HA THR A 215 5.141 6.963 -4.467 1.00 0.00 H new ATOM 0 HB THR A 215 2.489 6.918 -4.675 1.00 0.00 H new ATOM 0 HG1 THR A 215 3.003 9.151 -5.823 1.00 0.00 H new ATOM 0 HG21 THR A 215 1.604 9.181 -4.179 1.00 0.00 H new ATOM 0 HG22 THR A 215 2.028 8.257 -2.718 1.00 0.00 H new ATOM 0 HG23 THR A 215 3.109 9.545 -3.301 1.00 0.00 H new ATOM 1471 N THR A 216 4.486 7.910 -1.391 1.00 0.00 N ATOM 1472 CA THR A 216 5.120 8.598 -0.259 1.00 0.00 C ATOM 1473 C THR A 216 6.508 8.058 0.041 1.00 0.00 C ATOM 1474 O THR A 216 7.440 8.844 0.168 1.00 0.00 O ATOM 1475 CB THR A 216 4.263 8.577 1.015 1.00 0.00 C ATOM 1476 OG1 THR A 216 3.077 9.293 0.763 1.00 0.00 O ATOM 1477 CG2 THR A 216 4.960 9.222 2.215 1.00 0.00 C ATOM 0 H THR A 216 3.624 7.422 -1.149 1.00 0.00 H new ATOM 0 HA THR A 216 5.214 9.636 -0.577 1.00 0.00 H new ATOM 0 HB THR A 216 4.073 7.533 1.263 1.00 0.00 H new ATOM 0 HG1 THR A 216 2.346 8.664 0.590 1.00 0.00 H new ATOM 0 HG21 THR A 216 4.304 9.176 3.084 1.00 0.00 H new ATOM 0 HG22 THR A 216 5.885 8.687 2.430 1.00 0.00 H new ATOM 0 HG23 THR A 216 5.188 10.263 1.987 1.00 0.00 H new ATOM 1485 N GLN A 217 6.678 6.740 0.118 1.00 0.00 N ATOM 1486 CA GLN A 217 7.962 6.103 0.346 1.00 0.00 C ATOM 1487 C GLN A 217 8.964 6.580 -0.701 1.00 0.00 C ATOM 1488 O GLN A 217 10.087 6.919 -0.347 1.00 0.00 O ATOM 1489 CB GLN A 217 7.826 4.570 0.349 1.00 0.00 C ATOM 1490 CG GLN A 217 7.264 4.006 1.666 1.00 0.00 C ATOM 1491 CD GLN A 217 8.308 3.785 2.761 1.00 0.00 C ATOM 1492 OE1 GLN A 217 8.109 3.004 3.685 1.00 0.00 O ATOM 1493 NE2 GLN A 217 9.445 4.454 2.728 1.00 0.00 N ATOM 0 H GLN A 217 5.909 6.077 0.021 1.00 0.00 H new ATOM 0 HA GLN A 217 8.332 6.389 1.331 1.00 0.00 H new ATOM 0 HB2 GLN A 217 7.176 4.269 -0.473 1.00 0.00 H new ATOM 0 HB3 GLN A 217 8.804 4.126 0.161 1.00 0.00 H new ATOM 0 HG2 GLN A 217 6.501 4.688 2.042 1.00 0.00 H new ATOM 0 HG3 GLN A 217 6.769 3.058 1.458 1.00 0.00 H new ATOM 0 HE21 GLN A 217 9.630 5.108 1.968 1.00 0.00 H new ATOM 0 HE22 GLN A 217 10.139 4.317 3.463 1.00 0.00 H new ATOM 1502 N TYR A 218 8.538 6.712 -1.959 1.00 0.00 N ATOM 1503 CA TYR A 218 9.370 7.218 -3.033 1.00 0.00 C ATOM 1504 C TYR A 218 9.720 8.694 -2.850 1.00 0.00 C ATOM 1505 O TYR A 218 10.839 9.056 -3.175 1.00 0.00 O ATOM 1506 CB TYR A 218 8.670 6.988 -4.367 1.00 0.00 C ATOM 1507 CG TYR A 218 8.752 5.581 -4.921 1.00 0.00 C ATOM 1508 CD1 TYR A 218 8.692 4.451 -4.082 1.00 0.00 C ATOM 1509 CD2 TYR A 218 8.902 5.412 -6.307 1.00 0.00 C ATOM 1510 CE1 TYR A 218 8.837 3.162 -4.618 1.00 0.00 C ATOM 1511 CE2 TYR A 218 9.015 4.129 -6.859 1.00 0.00 C ATOM 1512 CZ TYR A 218 9.009 2.998 -6.007 1.00 0.00 C ATOM 1513 OH TYR A 218 9.173 1.752 -6.512 1.00 0.00 O ATOM 0 H TYR A 218 7.594 6.466 -2.256 1.00 0.00 H new ATOM 0 HA TYR A 218 10.313 6.672 -3.016 1.00 0.00 H new ATOM 0 HB2 TYR A 218 7.619 7.253 -4.255 1.00 0.00 H new ATOM 0 HB3 TYR A 218 9.095 7.673 -5.101 1.00 0.00 H new ATOM 0 HD1 TYR A 218 8.534 4.577 -3.021 1.00 0.00 H new ATOM 0 HD2 TYR A 218 8.930 6.277 -6.952 1.00 0.00 H new ATOM 0 HE1 TYR A 218 8.817 2.299 -3.969 1.00 0.00 H new ATOM 0 HE2 TYR A 218 9.106 4.004 -7.928 1.00 0.00 H new ATOM 0 HH TYR A 218 9.598 1.180 -5.840 1.00 0.00 H new ATOM 1523 N GLN A 219 8.853 9.530 -2.265 1.00 0.00 N ATOM 1524 CA GLN A 219 9.211 10.897 -1.856 1.00 0.00 C ATOM 1525 C GLN A 219 10.429 10.861 -0.915 1.00 0.00 C ATOM 1526 O GLN A 219 11.348 11.674 -1.046 1.00 0.00 O ATOM 1527 CB GLN A 219 8.039 11.621 -1.161 1.00 0.00 C ATOM 1528 CG GLN A 219 6.730 11.709 -1.964 1.00 0.00 C ATOM 1529 CD GLN A 219 5.466 12.008 -1.145 1.00 0.00 C ATOM 1530 OE1 GLN A 219 5.455 12.183 0.075 1.00 0.00 O ATOM 1531 NE2 GLN A 219 4.314 11.963 -1.791 1.00 0.00 N ATOM 0 H GLN A 219 7.885 9.280 -2.062 1.00 0.00 H new ATOM 0 HA GLN A 219 9.455 11.455 -2.760 1.00 0.00 H new ATOM 0 HB2 GLN A 219 7.831 11.113 -0.219 1.00 0.00 H new ATOM 0 HB3 GLN A 219 8.359 12.633 -0.913 1.00 0.00 H new ATOM 0 HG2 GLN A 219 6.842 12.484 -2.722 1.00 0.00 H new ATOM 0 HG3 GLN A 219 6.585 10.766 -2.491 1.00 0.00 H new ATOM 0 HE21 GLN A 219 4.301 11.819 -2.801 1.00 0.00 H new ATOM 0 HE22 GLN A 219 3.438 12.072 -1.280 1.00 0.00 H new ATOM 1540 N LYS A 220 10.449 9.903 0.027 1.00 0.00 N ATOM 1541 CA LYS A 220 11.533 9.741 1.018 1.00 0.00 C ATOM 1542 C LYS A 220 12.790 9.155 0.384 1.00 0.00 C ATOM 1543 O LYS A 220 13.898 9.633 0.632 1.00 0.00 O ATOM 1544 CB LYS A 220 11.137 8.863 2.230 1.00 0.00 C ATOM 1545 CG LYS A 220 9.655 8.787 2.603 1.00 0.00 C ATOM 1546 CD LYS A 220 8.913 10.121 2.705 1.00 0.00 C ATOM 1547 CE LYS A 220 8.855 10.644 4.138 1.00 0.00 C ATOM 1548 NZ LYS A 220 8.207 11.975 4.174 1.00 0.00 N ATOM 0 H LYS A 220 9.706 9.211 0.125 1.00 0.00 H new ATOM 0 HA LYS A 220 11.731 10.749 1.382 1.00 0.00 H new ATOM 0 HB2 LYS A 220 11.486 7.849 2.037 1.00 0.00 H new ATOM 0 HB3 LYS A 220 11.683 9.228 3.100 1.00 0.00 H new ATOM 0 HG2 LYS A 220 9.147 8.169 1.863 1.00 0.00 H new ATOM 0 HG3 LYS A 220 9.569 8.273 3.561 1.00 0.00 H new ATOM 0 HD2 LYS A 220 9.406 10.858 2.071 1.00 0.00 H new ATOM 0 HD3 LYS A 220 7.899 10.000 2.323 1.00 0.00 H new ATOM 0 HE2 LYS A 220 8.301 9.945 4.765 1.00 0.00 H new ATOM 0 HE3 LYS A 220 9.862 10.711 4.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 8.174 12.319 5.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 8.752 12.642 3.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 7.239 11.900 3.801 1.00 0.00 H new ATOM 1562 N GLU A 221 12.627 8.104 -0.416 1.00 0.00 N ATOM 1563 CA GLU A 221 13.724 7.423 -1.093 1.00 0.00 C ATOM 1564 C GLU A 221 14.341 8.316 -2.172 1.00 0.00 C ATOM 1565 O GLU A 221 15.541 8.221 -2.411 1.00 0.00 O ATOM 1566 CB GLU A 221 13.248 6.116 -1.740 1.00 0.00 C ATOM 1567 CG GLU A 221 12.544 5.128 -0.799 1.00 0.00 C ATOM 1568 CD GLU A 221 13.391 3.966 -0.254 1.00 0.00 C ATOM 1569 OE1 GLU A 221 14.583 3.749 -0.632 1.00 0.00 O ATOM 1570 OE2 GLU A 221 12.885 3.297 0.685 1.00 0.00 O ATOM 0 H GLU A 221 11.713 7.696 -0.614 1.00 0.00 H new ATOM 0 HA GLU A 221 14.476 7.196 -0.337 1.00 0.00 H new ATOM 0 HB2 GLU A 221 12.567 6.362 -2.555 1.00 0.00 H new ATOM 0 HB3 GLU A 221 14.109 5.617 -2.184 1.00 0.00 H new ATOM 0 HG2 GLU A 221 12.150 5.688 0.049 1.00 0.00 H new ATOM 0 HG3 GLU A 221 11.689 4.706 -1.327 1.00 0.00 H new ATOM 1577 N SER A 222 13.539 9.184 -2.799 1.00 0.00 N ATOM 1578 CA SER A 222 13.977 10.136 -3.838 1.00 0.00 C ATOM 1579 C SER A 222 14.840 11.247 -3.245 1.00 0.00 C ATOM 1580 O SER A 222 15.894 11.599 -3.782 1.00 0.00 O ATOM 1581 CB SER A 222 12.768 10.763 -4.532 1.00 0.00 C ATOM 1582 OG SER A 222 13.165 11.614 -5.584 1.00 0.00 O ATOM 0 H SER A 222 12.542 9.249 -2.596 1.00 0.00 H new ATOM 0 HA SER A 222 14.570 9.577 -4.562 1.00 0.00 H new ATOM 0 HB2 SER A 222 12.122 9.977 -4.922 1.00 0.00 H new ATOM 0 HB3 SER A 222 12.182 11.327 -3.807 1.00 0.00 H new ATOM 0 HG SER A 222 12.371 11.999 -6.010 1.00 0.00 H new ATOM 1588 N GLN A 223 14.409 11.767 -2.094 1.00 0.00 N ATOM 1589 CA GLN A 223 15.220 12.654 -1.268 1.00 0.00 C ATOM 1590 C GLN A 223 16.488 11.973 -0.778 1.00 0.00 C ATOM 1591 O GLN A 223 17.539 12.591 -0.790 1.00 0.00 O ATOM 1592 CB GLN A 223 14.441 13.069 -0.037 1.00 0.00 C ATOM 1593 CG GLN A 223 13.453 14.180 -0.378 1.00 0.00 C ATOM 1594 CD GLN A 223 12.549 14.418 0.811 1.00 0.00 C ATOM 1595 OE1 GLN A 223 12.888 15.182 1.714 1.00 0.00 O ATOM 1596 NE2 GLN A 223 11.436 13.719 0.860 1.00 0.00 N ATOM 0 H GLN A 223 13.483 11.582 -1.710 1.00 0.00 H new ATOM 0 HA GLN A 223 15.479 13.510 -1.891 1.00 0.00 H new ATOM 0 HB2 GLN A 223 13.906 12.210 0.368 1.00 0.00 H new ATOM 0 HB3 GLN A 223 15.128 13.411 0.737 1.00 0.00 H new ATOM 0 HG2 GLN A 223 13.988 15.095 -0.633 1.00 0.00 H new ATOM 0 HG3 GLN A 223 12.862 13.903 -1.251 1.00 0.00 H new ATOM 0 HE21 GLN A 223 11.191 13.096 0.090 1.00 0.00 H new ATOM 0 HE22 GLN A 223 10.818 13.800 1.668 1.00 0.00 H new ATOM 1605 N ALA A 224 16.415 10.706 -0.369 1.00 0.00 N ATOM 1606 CA ALA A 224 17.582 9.954 0.045 1.00 0.00 C ATOM 1607 C ALA A 224 18.566 9.821 -1.115 1.00 0.00 C ATOM 1608 O ALA A 224 19.761 10.065 -0.962 1.00 0.00 O ATOM 1609 CB ALA A 224 17.151 8.579 0.557 1.00 0.00 C ATOM 0 H ALA A 224 15.543 10.180 -0.318 1.00 0.00 H new ATOM 0 HA ALA A 224 18.086 10.485 0.853 1.00 0.00 H new ATOM 0 HB1 ALA A 224 18.030 8.015 0.868 1.00 0.00 H new ATOM 0 HB2 ALA A 224 16.479 8.701 1.406 1.00 0.00 H new ATOM 0 HB3 ALA A 224 16.636 8.040 -0.238 1.00 0.00 H new ATOM 1615 N TYR A 225 18.036 9.503 -2.298 1.00 0.00 N ATOM 1616 CA TYR A 225 18.754 9.416 -3.559 1.00 0.00 C ATOM 1617 C TYR A 225 19.503 10.711 -3.874 1.00 0.00 C ATOM 1618 O TYR A 225 20.674 10.669 -4.268 1.00 0.00 O ATOM 1619 CB TYR A 225 17.741 9.071 -4.647 1.00 0.00 C ATOM 1620 CG TYR A 225 18.332 8.460 -5.869 1.00 0.00 C ATOM 1621 CD1 TYR A 225 18.585 7.083 -5.870 1.00 0.00 C ATOM 1622 CD2 TYR A 225 18.560 9.243 -7.006 1.00 0.00 C ATOM 1623 CE1 TYR A 225 19.063 6.467 -7.036 1.00 0.00 C ATOM 1624 CE2 TYR A 225 19.000 8.624 -8.181 1.00 0.00 C ATOM 1625 CZ TYR A 225 19.221 7.236 -8.210 1.00 0.00 C ATOM 1626 OH TYR A 225 19.479 6.644 -9.401 1.00 0.00 O ATOM 0 H TYR A 225 17.044 9.290 -2.401 1.00 0.00 H new ATOM 0 HA TYR A 225 19.516 8.639 -3.500 1.00 0.00 H new ATOM 0 HB2 TYR A 225 17.002 8.384 -4.234 1.00 0.00 H new ATOM 0 HB3 TYR A 225 17.208 9.979 -4.931 1.00 0.00 H new ATOM 0 HD1 TYR A 225 18.413 6.499 -4.978 1.00 0.00 H new ATOM 0 HD2 TYR A 225 18.399 10.310 -6.977 1.00 0.00 H new ATOM 0 HE1 TYR A 225 19.308 5.415 -7.036 1.00 0.00 H new ATOM 0 HE2 TYR A 225 19.170 9.215 -9.069 1.00 0.00 H new ATOM 0 HH TYR A 225 19.555 7.329 -10.097 1.00 0.00 H new ATOM 1636 N TYR A 226 18.826 11.839 -3.650 1.00 0.00 N ATOM 1637 CA TYR A 226 19.304 13.209 -3.784 1.00 0.00 C ATOM 1638 C TYR A 226 20.344 13.606 -2.721 1.00 0.00 C ATOM 1639 O TYR A 226 21.404 14.122 -3.094 1.00 0.00 O ATOM 1640 CB TYR A 226 18.074 14.116 -3.740 1.00 0.00 C ATOM 1641 CG TYR A 226 18.357 15.591 -3.754 1.00 0.00 C ATOM 1642 CD1 TYR A 226 18.661 16.227 -4.969 1.00 0.00 C ATOM 1643 CD2 TYR A 226 18.275 16.327 -2.559 1.00 0.00 C ATOM 1644 CE1 TYR A 226 18.891 17.612 -4.990 1.00 0.00 C ATOM 1645 CE2 TYR A 226 18.468 17.717 -2.585 1.00 0.00 C ATOM 1646 CZ TYR A 226 18.760 18.363 -3.804 1.00 0.00 C ATOM 1647 OH TYR A 226 18.852 19.716 -3.848 1.00 0.00 O ATOM 0 H TYR A 226 17.853 11.811 -3.346 1.00 0.00 H new ATOM 0 HA TYR A 226 19.836 13.313 -4.729 1.00 0.00 H new ATOM 0 HB2 TYR A 226 17.438 13.878 -4.592 1.00 0.00 H new ATOM 0 HB3 TYR A 226 17.503 13.882 -2.841 1.00 0.00 H new ATOM 0 HD1 TYR A 226 18.718 15.654 -5.882 1.00 0.00 H new ATOM 0 HD2 TYR A 226 18.065 15.826 -1.626 1.00 0.00 H new ATOM 0 HE1 TYR A 226 19.168 18.101 -5.912 1.00 0.00 H new ATOM 0 HE2 TYR A 226 18.393 18.291 -1.673 1.00 0.00 H new ATOM 0 HH TYR A 226 18.738 20.081 -2.946 1.00 0.00 H new ATOM 1657 N ASP A 227 20.053 13.342 -1.440 1.00 0.00 N ATOM 1658 CA ASP A 227 20.837 13.664 -0.245 1.00 0.00 C ATOM 1659 C ASP A 227 22.197 12.956 -0.228 1.00 0.00 C ATOM 1660 O ASP A 227 23.189 13.570 0.169 1.00 0.00 O ATOM 1661 CB ASP A 227 19.996 13.318 1.003 1.00 0.00 C ATOM 1662 CG ASP A 227 20.697 13.529 2.351 1.00 0.00 C ATOM 1663 OD1 ASP A 227 20.580 14.654 2.913 1.00 0.00 O ATOM 1664 OD2 ASP A 227 21.329 12.562 2.869 1.00 0.00 O ATOM 0 H ASP A 227 19.190 12.857 -1.195 1.00 0.00 H new ATOM 0 HA ASP A 227 21.064 14.730 -0.249 1.00 0.00 H new ATOM 0 HB2 ASP A 227 19.088 13.922 0.987 1.00 0.00 H new ATOM 0 HB3 ASP A 227 19.687 12.275 0.933 1.00 0.00 H new ATOM 1669 N GLY A 228 22.253 11.703 -0.689 1.00 0.00 N ATOM 1670 CA GLY A 228 23.505 10.971 -0.883 1.00 0.00 C ATOM 1671 C GLY A 228 23.374 9.504 -1.305 1.00 0.00 C ATOM 1672 O GLY A 228 24.383 8.791 -1.342 1.00 0.00 O ATOM 0 H GLY A 228 21.423 11.165 -0.940 1.00 0.00 H new ATOM 0 HA2 GLY A 228 24.093 11.493 -1.638 1.00 0.00 H new ATOM 0 HA3 GLY A 228 24.072 11.010 0.047 1.00 0.00 H new TER 1676 GLY A 228