USER MOD reduce.3.24.130724 H: found=0, std=0, add=607, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 610 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 Single : A 8 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 9 ASN : amide:sc= -0.0264 K(o=-0.026,f=-1.1) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 164:sc= 0.206 USER MOD Single : A 15 ASN : amide:sc= -0.0134 K(o=-0.013,f=-0.82) USER MOD Single : A 16 LYS NZ :NH3+ -119:sc= 0.719 (180deg=-0.0082) USER MOD Single : A 18 LYS NZ :NH3+ -152:sc= -0.0866 (180deg=-1.2) USER MOD Single : A 19 THR OG1 : rot 83:sc= 0.184 USER MOD Single : A 24 HIS : no HD1:sc= -0.0524 X(o=-0.052,f=-0.05) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 36 HIS :FLIP no HD1:sc= -0.575 F(o=-2.5!,f=-0.57) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=-0.0094) USER MOD Single : A 54 SER OG : rot 28:sc= 0.0351 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.472 X(o=-0.47,f=-0.4) USER MOD Single : A 69 GLN : amide:sc= 0.703 K(o=0.7,f=-5.8!) USER MOD Single : A 74 SER OG : rot 76:sc= 1.28 USER MOD Single : A 78 GLN : amide:sc= 0.387 X(o=0.39,f=0) USER MOD Single : B 201 ASN : amide:sc= 0.156 X(o=0.16,f=0) USER MOD Single : B 203 GLN : amide:sc= -0.3 X(o=-0.3,f=-0.46) USER MOD Single : B 204 MET CE :methyl 178:sc= -0.474 (180deg=-0.496) USER MOD Single : B 211 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 52 N VAL A 5 35.145 44.445 40.091 1.00 0.00 N ATOM 53 CA VAL A 5 35.740 43.365 40.816 1.00 0.00 C ATOM 54 C VAL A 5 35.467 42.084 40.104 1.00 0.00 C ATOM 55 O VAL A 5 36.333 41.242 39.878 1.00 0.00 O ATOM 56 CB VAL A 5 35.128 43.299 42.184 1.00 0.00 C ATOM 57 CG1 VAL A 5 35.596 42.053 42.954 1.00 0.00 C ATOM 58 CG2 VAL A 5 35.507 44.590 42.928 1.00 0.00 C ATOM 0 HA VAL A 5 36.816 43.523 40.893 1.00 0.00 H new ATOM 0 HB VAL A 5 34.044 43.216 42.102 1.00 0.00 H new ATOM 0 HG11 VAL A 5 35.132 42.039 43.940 1.00 0.00 H new ATOM 0 HG12 VAL A 5 35.308 41.157 42.405 1.00 0.00 H new ATOM 0 HG13 VAL A 5 36.680 42.079 43.063 1.00 0.00 H new ATOM 0 HG21 VAL A 5 35.076 44.573 43.929 1.00 0.00 H new ATOM 0 HG22 VAL A 5 36.592 44.662 43.001 1.00 0.00 H new ATOM 0 HG23 VAL A 5 35.122 45.451 42.382 1.00 0.00 H new ATOM 68 N GLU A 6 34.201 41.915 39.681 1.00 0.00 N ATOM 69 CA GLU A 6 33.742 40.750 38.990 1.00 0.00 C ATOM 70 C GLU A 6 34.337 40.596 37.632 1.00 0.00 C ATOM 71 O GLU A 6 34.526 39.483 37.144 1.00 0.00 O ATOM 72 CB GLU A 6 32.206 40.779 38.916 1.00 0.00 C ATOM 73 CG GLU A 6 31.684 41.869 37.977 1.00 0.00 C ATOM 74 CD GLU A 6 30.213 42.226 38.136 1.00 0.00 C ATOM 75 OE1 GLU A 6 29.511 41.706 39.044 1.00 0.00 O ATOM 76 OE2 GLU A 6 29.751 43.096 37.350 1.00 0.00 O ATOM 0 H GLU A 6 33.472 42.614 39.825 1.00 0.00 H new ATOM 0 HA GLU A 6 34.074 39.880 39.557 1.00 0.00 H new ATOM 0 HB2 GLU A 6 31.844 39.808 38.577 1.00 0.00 H new ATOM 0 HB3 GLU A 6 31.800 40.940 39.915 1.00 0.00 H new ATOM 0 HG2 GLU A 6 32.277 42.771 38.131 1.00 0.00 H new ATOM 0 HG3 GLU A 6 31.852 41.549 36.949 1.00 0.00 H new ATOM 83 N PHE A 7 34.754 41.718 37.020 1.00 0.00 N ATOM 84 CA PHE A 7 35.549 41.674 35.832 1.00 0.00 C ATOM 85 C PHE A 7 36.900 41.106 36.102 1.00 0.00 C ATOM 86 O PHE A 7 37.385 40.294 35.318 1.00 0.00 O ATOM 87 CB PHE A 7 35.719 43.039 35.144 1.00 0.00 C ATOM 88 CG PHE A 7 34.661 43.223 34.112 1.00 0.00 C ATOM 89 CD1 PHE A 7 33.409 43.696 34.427 1.00 0.00 C ATOM 90 CD2 PHE A 7 34.936 42.867 32.812 1.00 0.00 C ATOM 91 CE1 PHE A 7 32.452 43.843 33.451 1.00 0.00 C ATOM 92 CE2 PHE A 7 33.986 43.012 31.830 1.00 0.00 C ATOM 93 CZ PHE A 7 32.742 43.505 32.150 1.00 0.00 C ATOM 0 H PHE A 7 34.540 42.659 37.349 1.00 0.00 H new ATOM 0 HA PHE A 7 34.994 41.027 35.152 1.00 0.00 H new ATOM 0 HB2 PHE A 7 35.661 43.838 35.883 1.00 0.00 H new ATOM 0 HB3 PHE A 7 36.704 43.103 34.682 1.00 0.00 H new ATOM 0 HD1 PHE A 7 33.175 43.954 35.449 1.00 0.00 H new ATOM 0 HD2 PHE A 7 35.908 42.470 32.561 1.00 0.00 H new ATOM 0 HE1 PHE A 7 31.474 44.223 33.706 1.00 0.00 H new ATOM 0 HE2 PHE A 7 34.215 42.740 30.810 1.00 0.00 H new ATOM 0 HZ PHE A 7 31.994 43.626 31.380 1.00 0.00 H new ATOM 103 N ASN A 8 37.533 41.434 37.243 1.00 0.00 N ATOM 104 CA ASN A 8 38.872 41.041 37.556 1.00 0.00 C ATOM 105 C ASN A 8 38.905 39.605 37.952 1.00 0.00 C ATOM 106 O ASN A 8 39.861 38.892 37.648 1.00 0.00 O ATOM 107 CB ASN A 8 39.472 41.880 38.696 1.00 0.00 C ATOM 108 CG ASN A 8 39.660 43.339 38.306 1.00 0.00 C ATOM 109 OD1 ASN A 8 39.709 43.743 37.146 1.00 0.00 O ATOM 110 ND2 ASN A 8 39.806 44.194 39.356 1.00 0.00 N ATOM 0 H ASN A 8 37.096 41.994 37.975 1.00 0.00 H new ATOM 0 HA ASN A 8 39.468 41.204 36.658 1.00 0.00 H new ATOM 0 HB2 ASN A 8 38.821 41.821 39.568 1.00 0.00 H new ATOM 0 HB3 ASN A 8 40.434 41.458 38.987 1.00 0.00 H new ATOM 0 HD21 ASN A 8 39.959 45.188 39.187 1.00 0.00 H new ATOM 0 HD22 ASN A 8 39.762 43.840 40.312 1.00 0.00 H new ATOM 117 N ASN A 9 37.826 39.095 38.571 1.00 0.00 N ATOM 118 CA ASN A 9 37.602 37.696 38.766 1.00 0.00 C ATOM 119 C ASN A 9 37.475 36.937 37.490 1.00 0.00 C ATOM 120 O ASN A 9 37.915 35.792 37.404 1.00 0.00 O ATOM 121 CB ASN A 9 36.357 37.421 39.627 1.00 0.00 C ATOM 122 CG ASN A 9 36.601 37.830 41.071 1.00 0.00 C ATOM 123 OD1 ASN A 9 37.708 37.736 41.600 1.00 0.00 O ATOM 124 ND2 ASN A 9 35.520 38.255 41.777 1.00 0.00 N ATOM 0 H ASN A 9 37.081 39.679 38.950 1.00 0.00 H new ATOM 0 HA ASN A 9 38.492 37.346 39.288 1.00 0.00 H new ATOM 0 HB2 ASN A 9 35.504 37.970 39.228 1.00 0.00 H new ATOM 0 HB3 ASN A 9 36.104 36.362 39.582 1.00 0.00 H new ATOM 0 HD21 ASN A 9 35.619 38.502 42.762 1.00 0.00 H new ATOM 0 HD22 ASN A 9 34.610 38.327 41.322 1.00 0.00 H new ATOM 131 N ALA A 10 36.917 37.550 36.432 1.00 0.00 N ATOM 132 CA ALA A 10 36.969 37.012 35.108 1.00 0.00 C ATOM 133 C ALA A 10 38.347 37.033 34.541 1.00 0.00 C ATOM 134 O ALA A 10 38.828 36.018 34.039 1.00 0.00 O ATOM 135 CB ALA A 10 35.957 37.687 34.169 1.00 0.00 C ATOM 0 H ALA A 10 36.419 38.438 36.497 1.00 0.00 H new ATOM 0 HA ALA A 10 36.679 35.965 35.191 1.00 0.00 H new ATOM 0 HB1 ALA A 10 36.033 37.246 33.175 1.00 0.00 H new ATOM 0 HB2 ALA A 10 34.948 37.540 34.555 1.00 0.00 H new ATOM 0 HB3 ALA A 10 36.171 38.754 34.110 1.00 0.00 H new ATOM 141 N ILE A 11 39.076 38.159 34.643 1.00 0.00 N ATOM 142 CA ILE A 11 40.416 38.317 34.168 1.00 0.00 C ATOM 143 C ILE A 11 41.361 37.310 34.727 1.00 0.00 C ATOM 144 O ILE A 11 42.048 36.616 33.979 1.00 0.00 O ATOM 145 CB ILE A 11 41.015 39.660 34.464 1.00 0.00 C ATOM 146 CG1 ILE A 11 40.164 40.855 34.005 1.00 0.00 C ATOM 147 CG2 ILE A 11 42.370 39.814 33.753 1.00 0.00 C ATOM 148 CD1 ILE A 11 39.474 40.678 32.653 1.00 0.00 C ATOM 0 H ILE A 11 38.710 39.005 35.081 1.00 0.00 H new ATOM 0 HA ILE A 11 40.301 38.187 33.092 1.00 0.00 H new ATOM 0 HB ILE A 11 41.097 39.680 35.551 1.00 0.00 H new ATOM 0 HG12 ILE A 11 39.403 41.051 34.761 1.00 0.00 H new ATOM 0 HG13 ILE A 11 40.801 41.738 33.957 1.00 0.00 H new ATOM 0 HG21 ILE A 11 42.790 40.794 33.979 1.00 0.00 H new ATOM 0 HG22 ILE A 11 43.053 39.038 34.099 1.00 0.00 H new ATOM 0 HG23 ILE A 11 42.229 39.719 32.676 1.00 0.00 H new ATOM 0 HD11 ILE A 11 38.899 41.574 32.418 1.00 0.00 H new ATOM 0 HD12 ILE A 11 40.225 40.516 31.880 1.00 0.00 H new ATOM 0 HD13 ILE A 11 38.805 39.818 32.696 1.00 0.00 H new ATOM 160 N SER A 12 41.399 37.191 36.066 1.00 0.00 N ATOM 161 CA SER A 12 42.261 36.341 36.827 1.00 0.00 C ATOM 162 C SER A 12 42.188 34.902 36.449 1.00 0.00 C ATOM 163 O SER A 12 43.187 34.185 36.448 1.00 0.00 O ATOM 164 CB SER A 12 41.997 36.508 38.333 1.00 0.00 C ATOM 165 OG SER A 12 43.122 36.190 39.139 1.00 0.00 O ATOM 0 H SER A 12 40.776 37.734 36.663 1.00 0.00 H new ATOM 0 HA SER A 12 43.274 36.665 36.589 1.00 0.00 H new ATOM 0 HB2 SER A 12 41.697 37.537 38.530 1.00 0.00 H new ATOM 0 HB3 SER A 12 41.161 35.871 38.621 1.00 0.00 H new ATOM 0 HG SER A 12 42.894 36.317 40.084 1.00 0.00 H new ATOM 171 N TYR A 13 40.991 34.448 36.032 1.00 0.00 N ATOM 172 CA TYR A 13 40.726 33.159 35.472 1.00 0.00 C ATOM 173 C TYR A 13 41.339 32.982 34.125 1.00 0.00 C ATOM 174 O TYR A 13 42.100 32.042 33.899 1.00 0.00 O ATOM 175 CB TYR A 13 39.201 32.962 35.432 1.00 0.00 C ATOM 176 CG TYR A 13 38.717 31.647 34.930 1.00 0.00 C ATOM 177 CD1 TYR A 13 39.365 30.458 35.174 1.00 0.00 C ATOM 178 CD2 TYR A 13 37.586 31.645 34.148 1.00 0.00 C ATOM 179 CE1 TYR A 13 38.916 29.297 34.591 1.00 0.00 C ATOM 180 CE2 TYR A 13 37.141 30.489 33.549 1.00 0.00 C ATOM 181 CZ TYR A 13 37.820 29.313 33.761 1.00 0.00 C ATOM 182 OH TYR A 13 37.461 28.138 33.068 1.00 0.00 O ATOM 0 H TYR A 13 40.151 35.023 36.091 1.00 0.00 H new ATOM 0 HA TYR A 13 41.186 32.396 36.100 1.00 0.00 H new ATOM 0 HB2 TYR A 13 38.811 33.108 36.439 1.00 0.00 H new ATOM 0 HB3 TYR A 13 38.771 33.745 34.807 1.00 0.00 H new ATOM 0 HD1 TYR A 13 40.227 30.437 35.824 1.00 0.00 H new ATOM 0 HD2 TYR A 13 37.039 32.565 34.002 1.00 0.00 H new ATOM 0 HE1 TYR A 13 39.428 28.366 34.786 1.00 0.00 H new ATOM 0 HE2 TYR A 13 36.265 30.506 32.917 1.00 0.00 H new ATOM 0 HH TYR A 13 36.545 28.224 32.730 1.00 0.00 H new ATOM 192 N VAL A 14 41.076 33.889 33.168 1.00 0.00 N ATOM 193 CA VAL A 14 41.621 33.899 31.846 1.00 0.00 C ATOM 194 C VAL A 14 43.108 34.002 31.839 1.00 0.00 C ATOM 195 O VAL A 14 43.799 33.318 31.086 1.00 0.00 O ATOM 196 CB VAL A 14 41.046 35.028 31.043 1.00 0.00 C ATOM 197 CG1 VAL A 14 41.502 34.954 29.577 1.00 0.00 C ATOM 198 CG2 VAL A 14 39.513 34.910 31.018 1.00 0.00 C ATOM 0 H VAL A 14 40.439 34.669 33.330 1.00 0.00 H new ATOM 0 HA VAL A 14 41.348 32.945 31.396 1.00 0.00 H new ATOM 0 HB VAL A 14 41.382 35.957 31.503 1.00 0.00 H new ATOM 0 HG11 VAL A 14 41.070 35.785 29.019 1.00 0.00 H new ATOM 0 HG12 VAL A 14 42.589 35.013 29.531 1.00 0.00 H new ATOM 0 HG13 VAL A 14 41.171 34.012 29.140 1.00 0.00 H new ATOM 0 HG21 VAL A 14 39.094 35.730 30.435 1.00 0.00 H new ATOM 0 HG22 VAL A 14 39.229 33.960 30.565 1.00 0.00 H new ATOM 0 HG23 VAL A 14 39.128 34.956 32.037 1.00 0.00 H new ATOM 208 N ASN A 15 43.668 34.837 32.732 1.00 0.00 N ATOM 209 CA ASN A 15 45.058 34.912 33.057 1.00 0.00 C ATOM 210 C ASN A 15 45.696 33.599 33.354 1.00 0.00 C ATOM 211 O ASN A 15 46.720 33.256 32.765 1.00 0.00 O ATOM 212 CB ASN A 15 45.279 35.848 34.258 1.00 0.00 C ATOM 213 CG ASN A 15 46.232 36.995 33.951 1.00 0.00 C ATOM 214 OD1 ASN A 15 45.831 38.141 33.753 1.00 0.00 O ATOM 215 ND2 ASN A 15 47.556 36.687 33.944 1.00 0.00 N ATOM 0 H ASN A 15 43.110 35.505 33.263 1.00 0.00 H new ATOM 0 HA ASN A 15 45.536 35.301 32.158 1.00 0.00 H new ATOM 0 HB2 ASN A 15 44.319 36.256 34.575 1.00 0.00 H new ATOM 0 HB3 ASN A 15 45.672 35.270 35.094 1.00 0.00 H new ATOM 0 HD21 ASN A 15 48.248 37.416 33.771 1.00 0.00 H new ATOM 0 HD22 ASN A 15 47.857 35.727 34.112 1.00 0.00 H new ATOM 222 N LYS A 16 45.102 32.803 34.261 1.00 0.00 N ATOM 223 CA LYS A 16 45.504 31.478 34.618 1.00 0.00 C ATOM 224 C LYS A 16 45.501 30.524 33.474 1.00 0.00 C ATOM 225 O LYS A 16 46.462 29.791 33.247 1.00 0.00 O ATOM 226 CB LYS A 16 44.579 30.967 35.736 1.00 0.00 C ATOM 227 CG LYS A 16 45.258 29.915 36.614 1.00 0.00 C ATOM 228 CD LYS A 16 44.345 29.196 37.609 1.00 0.00 C ATOM 229 CE LYS A 16 43.618 30.108 38.599 1.00 0.00 C ATOM 230 NZ LYS A 16 42.882 29.300 39.597 1.00 0.00 N ATOM 0 H LYS A 16 44.281 33.109 34.782 1.00 0.00 H new ATOM 0 HA LYS A 16 46.538 31.532 34.958 1.00 0.00 H new ATOM 0 HB2 LYS A 16 44.264 31.806 36.356 1.00 0.00 H new ATOM 0 HB3 LYS A 16 43.678 30.542 35.294 1.00 0.00 H new ATOM 0 HG2 LYS A 16 45.718 29.169 35.966 1.00 0.00 H new ATOM 0 HG3 LYS A 16 46.063 30.396 37.169 1.00 0.00 H new ATOM 0 HD2 LYS A 16 43.602 28.627 37.051 1.00 0.00 H new ATOM 0 HD3 LYS A 16 44.941 28.477 38.171 1.00 0.00 H new ATOM 0 HE2 LYS A 16 44.336 30.755 39.103 1.00 0.00 H new ATOM 0 HE3 LYS A 16 42.925 30.757 38.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 41.865 29.510 39.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 43.040 28.289 39.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 43.223 29.532 40.552 1.00 0.00 H new ATOM 244 N ILE A 17 44.424 30.534 32.668 1.00 0.00 N ATOM 245 CA ILE A 17 44.259 29.792 31.457 1.00 0.00 C ATOM 246 C ILE A 17 45.311 30.088 30.445 1.00 0.00 C ATOM 247 O ILE A 17 45.915 29.171 29.890 1.00 0.00 O ATOM 248 CB ILE A 17 42.877 30.048 30.931 1.00 0.00 C ATOM 249 CG1 ILE A 17 41.882 29.328 31.856 1.00 0.00 C ATOM 250 CG2 ILE A 17 42.693 29.615 29.467 1.00 0.00 C ATOM 251 CD1 ILE A 17 40.422 29.462 31.430 1.00 0.00 C ATOM 0 H ILE A 17 43.606 31.106 32.881 1.00 0.00 H new ATOM 0 HA ILE A 17 44.378 28.731 31.676 1.00 0.00 H new ATOM 0 HB ILE A 17 42.697 31.123 30.931 1.00 0.00 H new ATOM 0 HG12 ILE A 17 42.141 28.270 31.897 1.00 0.00 H new ATOM 0 HG13 ILE A 17 41.992 29.722 32.866 1.00 0.00 H new ATOM 0 HG21 ILE A 17 41.672 29.828 29.150 1.00 0.00 H new ATOM 0 HG22 ILE A 17 43.391 30.164 28.835 1.00 0.00 H new ATOM 0 HG23 ILE A 17 42.885 28.546 29.377 1.00 0.00 H new ATOM 0 HD11 ILE A 17 39.787 28.926 32.135 1.00 0.00 H new ATOM 0 HD12 ILE A 17 40.142 30.515 31.417 1.00 0.00 H new ATOM 0 HD13 ILE A 17 40.294 29.041 30.433 1.00 0.00 H new ATOM 263 N LYS A 18 45.615 31.373 30.189 1.00 0.00 N ATOM 264 CA LYS A 18 46.670 31.781 29.315 1.00 0.00 C ATOM 265 C LYS A 18 47.989 31.221 29.720 1.00 0.00 C ATOM 266 O LYS A 18 48.691 30.627 28.902 1.00 0.00 O ATOM 267 CB LYS A 18 46.823 33.311 29.274 1.00 0.00 C ATOM 268 CG LYS A 18 45.762 34.030 28.437 1.00 0.00 C ATOM 269 CD LYS A 18 45.751 35.553 28.587 1.00 0.00 C ATOM 270 CE LYS A 18 46.784 36.338 27.777 1.00 0.00 C ATOM 271 NZ LYS A 18 48.162 36.082 28.253 1.00 0.00 N ATOM 0 H LYS A 18 45.109 32.155 30.605 1.00 0.00 H new ATOM 0 HA LYS A 18 46.387 31.399 28.334 1.00 0.00 H new ATOM 0 HB2 LYS A 18 46.786 33.695 30.293 1.00 0.00 H new ATOM 0 HB3 LYS A 18 47.808 33.555 28.877 1.00 0.00 H new ATOM 0 HG2 LYS A 18 45.919 33.783 27.387 1.00 0.00 H new ATOM 0 HG3 LYS A 18 44.780 33.645 28.712 1.00 0.00 H new ATOM 0 HD2 LYS A 18 44.760 35.913 28.312 1.00 0.00 H new ATOM 0 HD3 LYS A 18 45.895 35.791 29.641 1.00 0.00 H new ATOM 0 HE2 LYS A 18 46.706 36.064 26.725 1.00 0.00 H new ATOM 0 HE3 LYS A 18 46.567 37.404 27.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 48.757 36.911 28.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 48.148 35.902 29.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 48.550 35.252 27.761 1.00 0.00 H new ATOM 285 N THR A 19 48.353 31.377 31.006 1.00 0.00 N ATOM 286 CA THR A 19 49.596 30.945 31.565 1.00 0.00 C ATOM 287 C THR A 19 49.767 29.465 31.586 1.00 0.00 C ATOM 288 O THR A 19 50.853 28.975 31.278 1.00 0.00 O ATOM 289 CB THR A 19 49.774 31.521 32.938 1.00 0.00 C ATOM 290 OG1 THR A 19 49.803 32.939 32.868 1.00 0.00 O ATOM 291 CG2 THR A 19 51.105 31.109 33.591 1.00 0.00 C ATOM 0 H THR A 19 47.747 31.829 31.691 1.00 0.00 H new ATOM 0 HA THR A 19 50.376 31.322 30.904 1.00 0.00 H new ATOM 0 HB THR A 19 48.938 31.143 33.527 1.00 0.00 H new ATOM 0 HG1 THR A 19 48.886 33.284 32.839 1.00 0.00 H new ATOM 0 HG21 THR A 19 51.177 31.556 34.583 1.00 0.00 H new ATOM 0 HG22 THR A 19 51.147 30.023 33.678 1.00 0.00 H new ATOM 0 HG23 THR A 19 51.935 31.456 32.975 1.00 0.00 H new ATOM 299 N ARG A 20 48.747 28.649 31.908 1.00 0.00 N ATOM 300 CA ARG A 20 48.912 27.230 31.835 1.00 0.00 C ATOM 301 C ARG A 20 48.952 26.688 30.448 1.00 0.00 C ATOM 302 O ARG A 20 49.782 25.839 30.124 1.00 0.00 O ATOM 303 CB ARG A 20 47.791 26.501 32.592 1.00 0.00 C ATOM 304 CG ARG A 20 47.735 26.671 34.112 1.00 0.00 C ATOM 305 CD ARG A 20 46.619 25.782 34.664 1.00 0.00 C ATOM 306 NE ARG A 20 46.550 25.877 36.149 1.00 0.00 N ATOM 307 CZ ARG A 20 45.869 24.964 36.901 1.00 0.00 C ATOM 308 NH1 ARG A 20 45.223 23.908 36.325 1.00 0.00 N ATOM 309 NH2 ARG A 20 45.833 25.060 38.262 1.00 0.00 N ATOM 0 H ARG A 20 47.826 28.963 32.213 1.00 0.00 H new ATOM 0 HA ARG A 20 49.883 27.047 32.295 1.00 0.00 H new ATOM 0 HB2 ARG A 20 46.837 26.833 32.182 1.00 0.00 H new ATOM 0 HB3 ARG A 20 47.877 25.436 32.376 1.00 0.00 H new ATOM 0 HG2 ARG A 20 48.691 26.398 34.558 1.00 0.00 H new ATOM 0 HG3 ARG A 20 47.549 27.714 34.369 1.00 0.00 H new ATOM 0 HD2 ARG A 20 45.664 26.080 34.232 1.00 0.00 H new ATOM 0 HD3 ARG A 20 46.793 24.747 34.369 1.00 0.00 H new ATOM 0 HE ARG A 20 47.026 26.648 36.618 1.00 0.00 H new ATOM 0 HH11 ARG A 20 45.243 23.789 35.312 1.00 0.00 H new ATOM 0 HH12 ARG A 20 44.720 23.238 36.908 1.00 0.00 H new ATOM 0 HH21 ARG A 20 46.320 25.823 38.733 1.00 0.00 H new ATOM 0 HH22 ARG A 20 45.319 24.369 38.809 1.00 0.00 H new ATOM 323 N PHE A 21 48.074 27.148 29.539 1.00 0.00 N ATOM 324 CA PHE A 21 48.010 26.646 28.201 1.00 0.00 C ATOM 325 C PHE A 21 48.925 27.354 27.261 1.00 0.00 C ATOM 326 O PHE A 21 48.590 27.617 26.107 1.00 0.00 O ATOM 327 CB PHE A 21 46.575 26.681 27.649 1.00 0.00 C ATOM 328 CG PHE A 21 45.654 25.775 28.391 1.00 0.00 C ATOM 329 CD1 PHE A 21 45.853 24.415 28.436 1.00 0.00 C ATOM 330 CD2 PHE A 21 44.521 26.293 28.972 1.00 0.00 C ATOM 331 CE1 PHE A 21 44.927 23.583 29.018 1.00 0.00 C ATOM 332 CE2 PHE A 21 43.592 25.476 29.572 1.00 0.00 C ATOM 333 CZ PHE A 21 43.792 24.115 29.584 1.00 0.00 C ATOM 0 H PHE A 21 47.395 27.883 29.737 1.00 0.00 H new ATOM 0 HA PHE A 21 48.345 25.611 28.267 1.00 0.00 H new ATOM 0 HB2 PHE A 21 46.195 27.701 27.700 1.00 0.00 H new ATOM 0 HB3 PHE A 21 46.587 26.398 26.596 1.00 0.00 H new ATOM 0 HD1 PHE A 21 46.751 23.994 28.007 1.00 0.00 H new ATOM 0 HD2 PHE A 21 44.358 27.360 28.957 1.00 0.00 H new ATOM 0 HE1 PHE A 21 45.090 22.515 29.031 1.00 0.00 H new ATOM 0 HE2 PHE A 21 42.711 25.900 30.031 1.00 0.00 H new ATOM 0 HZ PHE A 21 43.058 23.465 30.037 1.00 0.00 H new ATOM 343 N LEU A 22 50.171 27.645 27.674 1.00 0.00 N ATOM 344 CA LEU A 22 51.216 28.138 26.831 1.00 0.00 C ATOM 345 C LEU A 22 51.774 27.045 25.987 1.00 0.00 C ATOM 346 O LEU A 22 52.083 27.214 24.809 1.00 0.00 O ATOM 347 CB LEU A 22 52.355 28.800 27.623 1.00 0.00 C ATOM 348 CG LEU A 22 51.883 30.059 28.371 1.00 0.00 C ATOM 349 CD1 LEU A 22 53.012 30.523 29.308 1.00 0.00 C ATOM 350 CD2 LEU A 22 51.453 31.226 27.465 1.00 0.00 C ATOM 0 H LEU A 22 50.464 27.531 28.644 1.00 0.00 H new ATOM 0 HA LEU A 22 50.763 28.901 26.198 1.00 0.00 H new ATOM 0 HB2 LEU A 22 52.762 28.085 28.338 1.00 0.00 H new ATOM 0 HB3 LEU A 22 53.164 29.065 26.942 1.00 0.00 H new ATOM 0 HG LEU A 22 50.986 29.774 28.920 1.00 0.00 H new ATOM 0 HD11 LEU A 22 52.694 31.416 29.847 1.00 0.00 H new ATOM 0 HD12 LEU A 22 53.241 29.731 30.021 1.00 0.00 H new ATOM 0 HD13 LEU A 22 53.901 30.751 28.721 1.00 0.00 H new ATOM 0 HD21 LEU A 22 51.137 32.068 28.081 1.00 0.00 H new ATOM 0 HD22 LEU A 22 52.292 31.529 26.839 1.00 0.00 H new ATOM 0 HD23 LEU A 22 50.625 30.909 26.832 1.00 0.00 H new ATOM 362 N ASP A 23 51.869 25.841 26.579 1.00 0.00 N ATOM 363 CA ASP A 23 52.244 24.647 25.886 1.00 0.00 C ATOM 364 C ASP A 23 51.098 24.018 25.170 1.00 0.00 C ATOM 365 O ASP A 23 51.220 22.941 24.588 1.00 0.00 O ATOM 366 CB ASP A 23 52.881 23.663 26.881 1.00 0.00 C ATOM 367 CG ASP A 23 54.397 23.716 26.756 1.00 0.00 C ATOM 368 OD1 ASP A 23 55.006 24.804 26.931 1.00 0.00 O ATOM 369 OD2 ASP A 23 55.005 22.658 26.441 1.00 0.00 O ATOM 0 H ASP A 23 51.679 25.693 27.570 1.00 0.00 H new ATOM 0 HA ASP A 23 52.971 24.915 25.119 1.00 0.00 H new ATOM 0 HB2 ASP A 23 52.581 23.915 27.898 1.00 0.00 H new ATOM 0 HB3 ASP A 23 52.525 22.651 26.685 1.00 0.00 H new ATOM 374 N HIS A 24 49.919 24.666 25.151 1.00 0.00 N ATOM 375 CA HIS A 24 48.829 24.247 24.326 1.00 0.00 C ATOM 376 C HIS A 24 48.126 25.404 23.702 1.00 0.00 C ATOM 377 O HIS A 24 46.993 25.661 24.106 1.00 0.00 O ATOM 378 CB HIS A 24 47.858 23.399 25.164 1.00 0.00 C ATOM 379 CG HIS A 24 48.425 22.067 25.557 1.00 0.00 C ATOM 380 ND1 HIS A 24 48.321 20.985 24.723 1.00 0.00 N ATOM 381 CD2 HIS A 24 49.151 21.661 26.633 1.00 0.00 C ATOM 382 CE1 HIS A 24 48.961 19.963 25.259 1.00 0.00 C ATOM 383 NE2 HIS A 24 49.475 20.348 26.413 1.00 0.00 N ATOM 0 H HIS A 24 49.720 25.492 25.716 1.00 0.00 H new ATOM 0 HA HIS A 24 49.225 23.645 23.508 1.00 0.00 H new ATOM 0 HB2 HIS A 24 47.587 23.951 26.064 1.00 0.00 H new ATOM 0 HB3 HIS A 24 46.940 23.243 24.597 1.00 0.00 H new ATOM 0 HD2 HIS A 24 49.420 22.257 27.493 1.00 0.00 H new ATOM 0 HE1 HIS A 24 49.050 18.977 24.827 1.00 0.00 H new ATOM 0 HE2 HIS A 24 50.025 19.762 27.040 1.00 0.00 H new ATOM 392 N PRO A 25 48.625 26.128 22.744 1.00 0.00 N ATOM 393 CA PRO A 25 48.028 27.357 22.313 1.00 0.00 C ATOM 394 C PRO A 25 46.732 27.222 21.592 1.00 0.00 C ATOM 395 O PRO A 25 45.973 28.188 21.517 1.00 0.00 O ATOM 396 CB PRO A 25 49.046 28.001 21.374 1.00 0.00 C ATOM 397 CG PRO A 25 50.388 27.406 21.828 1.00 0.00 C ATOM 398 CD PRO A 25 49.968 25.976 22.204 1.00 0.00 C ATOM 0 HA PRO A 25 47.791 27.943 23.201 1.00 0.00 H new ATOM 0 HB2 PRO A 25 48.835 27.764 20.331 1.00 0.00 H new ATOM 0 HB3 PRO A 25 49.040 29.087 21.461 1.00 0.00 H new ATOM 0 HG2 PRO A 25 51.134 27.420 21.034 1.00 0.00 H new ATOM 0 HG3 PRO A 25 50.813 27.946 22.674 1.00 0.00 H new ATOM 0 HD2 PRO A 25 49.976 25.317 21.335 1.00 0.00 H new ATOM 0 HD3 PRO A 25 50.646 25.542 22.939 1.00 0.00 H new ATOM 406 N GLU A 26 46.413 26.035 21.046 1.00 0.00 N ATOM 407 CA GLU A 26 45.185 25.788 20.356 1.00 0.00 C ATOM 408 C GLU A 26 44.023 25.751 21.289 1.00 0.00 C ATOM 409 O GLU A 26 42.882 25.982 20.893 1.00 0.00 O ATOM 410 CB GLU A 26 45.265 24.533 19.470 1.00 0.00 C ATOM 411 CG GLU A 26 45.470 23.223 20.234 1.00 0.00 C ATOM 412 CD GLU A 26 45.651 21.993 19.357 1.00 0.00 C ATOM 413 OE1 GLU A 26 45.682 22.084 18.101 1.00 0.00 O ATOM 414 OE2 GLU A 26 45.795 20.893 19.955 1.00 0.00 O ATOM 0 H GLU A 26 47.028 25.222 21.086 1.00 0.00 H new ATOM 0 HA GLU A 26 45.020 26.630 19.684 1.00 0.00 H new ATOM 0 HB2 GLU A 26 44.347 24.458 18.886 1.00 0.00 H new ATOM 0 HB3 GLU A 26 46.084 24.657 18.762 1.00 0.00 H new ATOM 0 HG2 GLU A 26 46.345 23.326 20.875 1.00 0.00 H new ATOM 0 HG3 GLU A 26 44.613 23.062 20.888 1.00 0.00 H new ATOM 421 N ILE A 27 44.265 25.522 22.591 1.00 0.00 N ATOM 422 CA ILE A 27 43.294 25.517 23.641 1.00 0.00 C ATOM 423 C ILE A 27 42.785 26.909 23.806 1.00 0.00 C ATOM 424 O ILE A 27 41.577 27.138 23.870 1.00 0.00 O ATOM 425 CB ILE A 27 43.846 25.027 24.947 1.00 0.00 C ATOM 426 CG1 ILE A 27 44.174 23.527 25.048 1.00 0.00 C ATOM 427 CG2 ILE A 27 42.790 25.202 26.051 1.00 0.00 C ATOM 428 CD1 ILE A 27 44.428 22.803 23.727 1.00 0.00 C ATOM 0 H ILE A 27 45.206 25.327 22.934 1.00 0.00 H new ATOM 0 HA ILE A 27 42.497 24.828 23.362 1.00 0.00 H new ATOM 0 HB ILE A 27 44.763 25.609 25.042 1.00 0.00 H new ATOM 0 HG12 ILE A 27 45.056 23.411 25.678 1.00 0.00 H new ATOM 0 HG13 ILE A 27 43.350 23.029 25.559 1.00 0.00 H new ATOM 0 HG21 ILE A 27 43.192 24.846 26.999 1.00 0.00 H new ATOM 0 HG22 ILE A 27 42.529 26.256 26.141 1.00 0.00 H new ATOM 0 HG23 ILE A 27 41.899 24.628 25.796 1.00 0.00 H new ATOM 0 HD11 ILE A 27 44.649 21.754 23.924 1.00 0.00 H new ATOM 0 HD12 ILE A 27 43.542 22.875 23.096 1.00 0.00 H new ATOM 0 HD13 ILE A 27 45.275 23.262 23.217 1.00 0.00 H new ATOM 440 N TYR A 28 43.690 27.902 23.816 1.00 0.00 N ATOM 441 CA TYR A 28 43.376 29.293 23.932 1.00 0.00 C ATOM 442 C TYR A 28 42.488 29.780 22.839 1.00 0.00 C ATOM 443 O TYR A 28 41.546 30.533 23.077 1.00 0.00 O ATOM 444 CB TYR A 28 44.674 30.113 24.020 1.00 0.00 C ATOM 445 CG TYR A 28 44.401 31.523 24.417 1.00 0.00 C ATOM 446 CD1 TYR A 28 43.942 31.798 25.683 1.00 0.00 C ATOM 447 CD2 TYR A 28 44.563 32.554 23.521 1.00 0.00 C ATOM 448 CE1 TYR A 28 43.642 33.088 26.050 1.00 0.00 C ATOM 449 CE2 TYR A 28 44.268 33.848 23.880 1.00 0.00 C ATOM 450 CZ TYR A 28 43.821 34.115 25.153 1.00 0.00 C ATOM 451 OH TYR A 28 43.584 35.441 25.571 1.00 0.00 O ATOM 0 H TYR A 28 44.692 27.727 23.739 1.00 0.00 H new ATOM 0 HA TYR A 28 42.808 29.429 24.852 1.00 0.00 H new ATOM 0 HB2 TYR A 28 45.348 29.654 24.743 1.00 0.00 H new ATOM 0 HB3 TYR A 28 45.182 30.097 23.056 1.00 0.00 H new ATOM 0 HD1 TYR A 28 43.816 30.995 26.394 1.00 0.00 H new ATOM 0 HD2 TYR A 28 44.926 32.345 22.525 1.00 0.00 H new ATOM 0 HE1 TYR A 28 43.266 33.295 27.041 1.00 0.00 H new ATOM 0 HE2 TYR A 28 44.387 34.650 23.167 1.00 0.00 H new ATOM 0 HH TYR A 28 43.754 36.054 24.826 1.00 0.00 H new ATOM 461 N ARG A 29 42.718 29.335 21.591 1.00 0.00 N ATOM 462 CA ARG A 29 41.841 29.582 20.490 1.00 0.00 C ATOM 463 C ARG A 29 40.535 28.869 20.575 1.00 0.00 C ATOM 464 O ARG A 29 39.491 29.507 20.452 1.00 0.00 O ATOM 465 CB ARG A 29 42.557 29.293 19.160 1.00 0.00 C ATOM 466 CG ARG A 29 43.236 30.529 18.569 1.00 0.00 C ATOM 467 CD ARG A 29 44.475 31.069 19.287 1.00 0.00 C ATOM 468 NE ARG A 29 44.742 32.431 18.747 1.00 0.00 N ATOM 469 CZ ARG A 29 44.105 33.563 19.168 1.00 0.00 C ATOM 470 NH1 ARG A 29 43.200 33.556 20.189 1.00 0.00 N ATOM 471 NH2 ARG A 29 44.326 34.746 18.525 1.00 0.00 N ATOM 0 H ARG A 29 43.540 28.786 21.341 1.00 0.00 H new ATOM 0 HA ARG A 29 41.585 30.640 20.537 1.00 0.00 H new ATOM 0 HB2 ARG A 29 43.304 28.515 19.317 1.00 0.00 H new ATOM 0 HB3 ARG A 29 41.836 28.903 18.442 1.00 0.00 H new ATOM 0 HG2 ARG A 29 43.517 30.299 17.541 1.00 0.00 H new ATOM 0 HG3 ARG A 29 42.497 31.329 18.526 1.00 0.00 H new ATOM 0 HD2 ARG A 29 44.309 31.108 20.363 1.00 0.00 H new ATOM 0 HD3 ARG A 29 45.331 30.415 19.121 1.00 0.00 H new ATOM 0 HE ARG A 29 45.446 32.524 18.015 1.00 0.00 H new ATOM 0 HH11 ARG A 29 42.978 32.683 20.668 1.00 0.00 H new ATOM 0 HH12 ARG A 29 42.746 34.424 20.474 1.00 0.00 H new ATOM 0 HH21 ARG A 29 44.966 34.783 17.732 1.00 0.00 H new ATOM 0 HH22 ARG A 29 43.851 35.593 18.838 1.00 0.00 H new ATOM 485 N SER A 30 40.527 27.542 20.799 1.00 0.00 N ATOM 486 CA SER A 30 39.370 26.703 20.775 1.00 0.00 C ATOM 487 C SER A 30 38.388 27.018 21.850 1.00 0.00 C ATOM 488 O SER A 30 37.182 27.062 21.610 1.00 0.00 O ATOM 489 CB SER A 30 39.775 25.219 20.817 1.00 0.00 C ATOM 490 OG SER A 30 38.679 24.330 20.662 1.00 0.00 O ATOM 0 H SER A 30 41.381 27.025 21.009 1.00 0.00 H new ATOM 0 HA SER A 30 38.861 26.907 19.833 1.00 0.00 H new ATOM 0 HB2 SER A 30 40.503 25.027 20.029 1.00 0.00 H new ATOM 0 HB3 SER A 30 40.270 25.012 21.766 1.00 0.00 H new ATOM 0 HG SER A 30 39.001 23.405 20.696 1.00 0.00 H new ATOM 496 N PHE A 31 38.864 27.319 23.071 1.00 0.00 N ATOM 497 CA PHE A 31 38.098 27.705 24.216 1.00 0.00 C ATOM 498 C PHE A 31 37.094 28.772 23.943 1.00 0.00 C ATOM 499 O PHE A 31 35.910 28.646 24.248 1.00 0.00 O ATOM 500 CB PHE A 31 39.094 28.129 25.310 1.00 0.00 C ATOM 501 CG PHE A 31 38.590 28.736 26.574 1.00 0.00 C ATOM 502 CD1 PHE A 31 37.362 28.461 27.125 1.00 0.00 C ATOM 503 CD2 PHE A 31 39.430 29.601 27.235 1.00 0.00 C ATOM 504 CE1 PHE A 31 36.962 29.061 28.296 1.00 0.00 C ATOM 505 CE2 PHE A 31 39.026 30.232 28.388 1.00 0.00 C ATOM 506 CZ PHE A 31 37.792 29.959 28.927 1.00 0.00 C ATOM 0 H PHE A 31 39.863 27.290 23.272 1.00 0.00 H new ATOM 0 HA PHE A 31 37.498 26.854 24.538 1.00 0.00 H new ATOM 0 HB2 PHE A 31 39.674 27.247 25.581 1.00 0.00 H new ATOM 0 HB3 PHE A 31 39.787 28.841 24.861 1.00 0.00 H new ATOM 0 HD1 PHE A 31 36.701 27.764 26.632 1.00 0.00 H new ATOM 0 HD2 PHE A 31 40.419 29.787 26.844 1.00 0.00 H new ATOM 0 HE1 PHE A 31 35.997 28.827 28.720 1.00 0.00 H new ATOM 0 HE2 PHE A 31 39.680 30.943 28.871 1.00 0.00 H new ATOM 0 HZ PHE A 31 37.476 30.445 29.838 1.00 0.00 H new ATOM 516 N LEU A 32 37.532 29.882 23.320 1.00 0.00 N ATOM 517 CA LEU A 32 36.701 31.025 23.112 1.00 0.00 C ATOM 518 C LEU A 32 35.751 30.838 21.979 1.00 0.00 C ATOM 519 O LEU A 32 34.638 31.361 22.007 1.00 0.00 O ATOM 520 CB LEU A 32 37.480 32.307 22.767 1.00 0.00 C ATOM 521 CG LEU A 32 38.901 32.395 23.349 1.00 0.00 C ATOM 522 CD1 LEU A 32 39.807 33.206 22.408 1.00 0.00 C ATOM 523 CD2 LEU A 32 38.885 32.966 24.778 1.00 0.00 C ATOM 0 H LEU A 32 38.479 29.986 22.955 1.00 0.00 H new ATOM 0 HA LEU A 32 36.188 31.131 24.068 1.00 0.00 H new ATOM 0 HB2 LEU A 32 37.545 32.391 21.682 1.00 0.00 H new ATOM 0 HB3 LEU A 32 36.908 33.165 23.120 1.00 0.00 H new ATOM 0 HG LEU A 32 39.314 31.389 23.423 1.00 0.00 H new ATOM 0 HD11 LEU A 32 40.811 33.263 22.829 1.00 0.00 H new ATOM 0 HD12 LEU A 32 39.849 32.719 21.434 1.00 0.00 H new ATOM 0 HD13 LEU A 32 39.404 34.212 22.293 1.00 0.00 H new ATOM 0 HD21 LEU A 32 39.904 33.016 25.161 1.00 0.00 H new ATOM 0 HD22 LEU A 32 38.453 33.967 24.765 1.00 0.00 H new ATOM 0 HD23 LEU A 32 38.286 32.321 25.421 1.00 0.00 H new ATOM 535 N GLU A 33 36.151 30.100 20.928 1.00 0.00 N ATOM 536 CA GLU A 33 35.278 29.673 19.879 1.00 0.00 C ATOM 537 C GLU A 33 33.991 29.085 20.346 1.00 0.00 C ATOM 538 O GLU A 33 32.915 29.436 19.869 1.00 0.00 O ATOM 539 CB GLU A 33 35.894 28.664 18.896 1.00 0.00 C ATOM 540 CG GLU A 33 37.055 29.197 18.055 1.00 0.00 C ATOM 541 CD GLU A 33 37.140 28.476 16.717 1.00 0.00 C ATOM 542 OE1 GLU A 33 36.202 28.648 15.893 1.00 0.00 O ATOM 543 OE2 GLU A 33 38.125 27.730 16.472 1.00 0.00 O ATOM 0 H GLU A 33 37.115 29.790 20.804 1.00 0.00 H new ATOM 0 HA GLU A 33 35.093 30.617 19.367 1.00 0.00 H new ATOM 0 HB2 GLU A 33 36.243 27.799 19.460 1.00 0.00 H new ATOM 0 HB3 GLU A 33 35.111 28.312 18.224 1.00 0.00 H new ATOM 0 HG2 GLU A 33 36.926 30.266 17.888 1.00 0.00 H new ATOM 0 HG3 GLU A 33 37.991 29.070 18.600 1.00 0.00 H new ATOM 550 N ILE A 34 34.060 28.201 21.360 1.00 0.00 N ATOM 551 CA ILE A 34 32.961 27.586 22.035 1.00 0.00 C ATOM 552 C ILE A 34 32.116 28.599 22.730 1.00 0.00 C ATOM 553 O ILE A 34 30.899 28.619 22.555 1.00 0.00 O ATOM 554 CB ILE A 34 33.498 26.515 22.937 1.00 0.00 C ATOM 555 CG1 ILE A 34 34.378 25.494 22.197 1.00 0.00 C ATOM 556 CG2 ILE A 34 32.330 25.775 23.611 1.00 0.00 C ATOM 557 CD1 ILE A 34 35.355 24.774 23.125 1.00 0.00 C ATOM 0 H ILE A 34 34.958 27.894 21.735 1.00 0.00 H new ATOM 0 HA ILE A 34 32.288 27.111 21.321 1.00 0.00 H new ATOM 0 HB ILE A 34 34.125 27.011 23.678 1.00 0.00 H new ATOM 0 HG12 ILE A 34 33.740 24.759 21.707 1.00 0.00 H new ATOM 0 HG13 ILE A 34 34.937 26.004 21.413 1.00 0.00 H new ATOM 0 HG21 ILE A 34 32.722 24.997 24.266 1.00 0.00 H new ATOM 0 HG22 ILE A 34 31.742 26.481 24.197 1.00 0.00 H new ATOM 0 HG23 ILE A 34 31.697 25.322 22.848 1.00 0.00 H new ATOM 0 HD11 ILE A 34 35.950 24.066 22.548 1.00 0.00 H new ATOM 0 HD12 ILE A 34 36.015 25.503 23.595 1.00 0.00 H new ATOM 0 HD13 ILE A 34 34.799 24.239 23.894 1.00 0.00 H new ATOM 569 N LEU A 35 32.672 29.522 23.535 1.00 0.00 N ATOM 570 CA LEU A 35 31.880 30.522 24.182 1.00 0.00 C ATOM 571 C LEU A 35 31.376 31.596 23.280 1.00 0.00 C ATOM 572 O LEU A 35 30.403 32.287 23.577 1.00 0.00 O ATOM 573 CB LEU A 35 32.655 31.223 25.310 1.00 0.00 C ATOM 574 CG LEU A 35 33.545 30.336 26.197 1.00 0.00 C ATOM 575 CD1 LEU A 35 33.656 31.064 27.547 1.00 0.00 C ATOM 576 CD2 LEU A 35 33.055 28.936 26.605 1.00 0.00 C ATOM 0 H LEU A 35 33.670 29.576 23.738 1.00 0.00 H new ATOM 0 HA LEU A 35 31.030 29.958 24.565 1.00 0.00 H new ATOM 0 HB2 LEU A 35 33.283 31.994 24.863 1.00 0.00 H new ATOM 0 HB3 LEU A 35 31.935 31.731 25.952 1.00 0.00 H new ATOM 0 HG LEU A 35 34.435 30.185 25.586 1.00 0.00 H new ATOM 0 HD11 LEU A 35 34.279 30.481 28.225 1.00 0.00 H new ATOM 0 HD12 LEU A 35 34.105 32.046 27.395 1.00 0.00 H new ATOM 0 HD13 LEU A 35 32.662 31.182 27.979 1.00 0.00 H new ATOM 0 HD21 LEU A 35 33.808 28.454 27.228 1.00 0.00 H new ATOM 0 HD22 LEU A 35 32.124 29.025 27.165 1.00 0.00 H new ATOM 0 HD23 LEU A 35 32.885 28.335 25.711 1.00 0.00 H new ATOM 588 N HIS A 36 31.992 31.811 22.104 1.00 0.00 N ATOM 589 CA HIS A 36 31.506 32.690 21.086 1.00 0.00 C ATOM 590 C HIS A 36 30.204 32.210 20.542 1.00 0.00 C ATOM 591 O HIS A 36 29.296 33.002 20.302 1.00 0.00 O ATOM 592 CB HIS A 36 32.458 32.885 19.894 1.00 0.00 C ATOM 593 CG HIS A 36 33.751 33.596 20.156 1.00 0.00 C ATOM 594 ND1 HIS A 36 35.011 33.249 19.781 1.00 0.00 N flip ATOM 595 CD2 HIS A 36 33.843 34.848 20.707 1.00 0.00 C flip ATOM 596 CE1 HIS A 36 35.832 34.285 20.142 1.00 0.00 C flip ATOM 597 NE2 HIS A 36 35.104 35.237 20.693 1.00 0.00 N flip ATOM 0 H HIS A 36 32.867 31.352 21.852 1.00 0.00 H new ATOM 0 HA HIS A 36 31.405 33.649 21.593 1.00 0.00 H new ATOM 0 HB2 HIS A 36 32.691 31.902 19.484 1.00 0.00 H new ATOM 0 HB3 HIS A 36 31.922 33.434 19.120 1.00 0.00 H new ATOM 0 HD2 HIS A 36 33.015 35.425 21.092 1.00 0.00 H new ATOM 0 HE1 HIS A 36 36.902 34.317 19.999 1.00 0.00 H new ATOM 0 HE2 HIS A 36 35.457 36.125 21.049 1.00 0.00 H new ATOM 606 N THR A 37 30.026 30.884 20.397 1.00 0.00 N ATOM 607 CA THR A 37 28.804 30.251 20.012 1.00 0.00 C ATOM 608 C THR A 37 27.696 30.505 20.975 1.00 0.00 C ATOM 609 O THR A 37 26.531 30.616 20.595 1.00 0.00 O ATOM 610 CB THR A 37 29.071 28.796 19.761 1.00 0.00 C ATOM 611 OG1 THR A 37 29.480 28.600 18.416 1.00 0.00 O ATOM 612 CG2 THR A 37 27.914 27.818 20.033 1.00 0.00 C ATOM 0 H THR A 37 30.780 30.216 20.558 1.00 0.00 H new ATOM 0 HA THR A 37 28.445 30.693 19.083 1.00 0.00 H new ATOM 0 HB THR A 37 29.846 28.559 20.490 1.00 0.00 H new ATOM 0 HG1 THR A 37 29.654 27.648 18.262 1.00 0.00 H new ATOM 0 HG21 THR A 37 28.238 26.801 19.812 1.00 0.00 H new ATOM 0 HG22 THR A 37 27.619 27.886 21.080 1.00 0.00 H new ATOM 0 HG23 THR A 37 27.065 28.074 19.399 1.00 0.00 H new ATOM 620 N TYR A 38 28.012 30.707 22.267 1.00 0.00 N ATOM 621 CA TYR A 38 27.116 31.191 23.271 1.00 0.00 C ATOM 622 C TYR A 38 26.765 32.628 23.095 1.00 0.00 C ATOM 623 O TYR A 38 25.599 33.005 22.992 1.00 0.00 O ATOM 624 CB TYR A 38 27.761 30.939 24.645 1.00 0.00 C ATOM 625 CG TYR A 38 26.909 31.131 25.851 1.00 0.00 C ATOM 626 CD1 TYR A 38 26.811 32.375 26.429 1.00 0.00 C ATOM 627 CD2 TYR A 38 26.345 30.051 26.490 1.00 0.00 C ATOM 628 CE1 TYR A 38 26.169 32.541 27.634 1.00 0.00 C ATOM 629 CE2 TYR A 38 25.690 30.209 27.689 1.00 0.00 C ATOM 630 CZ TYR A 38 25.599 31.457 28.258 1.00 0.00 C ATOM 631 OH TYR A 38 24.918 31.621 29.483 1.00 0.00 O ATOM 0 H TYR A 38 28.947 30.522 22.631 1.00 0.00 H new ATOM 0 HA TYR A 38 26.172 30.652 23.186 1.00 0.00 H new ATOM 0 HB2 TYR A 38 28.136 29.916 24.658 1.00 0.00 H new ATOM 0 HB3 TYR A 38 28.626 31.596 24.736 1.00 0.00 H new ATOM 0 HD1 TYR A 38 27.243 33.231 25.931 1.00 0.00 H new ATOM 0 HD2 TYR A 38 26.417 29.069 26.046 1.00 0.00 H new ATOM 0 HE1 TYR A 38 26.113 33.519 28.088 1.00 0.00 H new ATOM 0 HE2 TYR A 38 25.249 29.355 28.182 1.00 0.00 H new ATOM 0 HH TYR A 38 24.575 30.754 29.785 1.00 0.00 H new ATOM 641 N GLN A 39 27.787 33.502 23.072 1.00 0.00 N ATOM 642 CA GLN A 39 27.655 34.923 23.164 1.00 0.00 C ATOM 643 C GLN A 39 27.249 35.633 21.919 1.00 0.00 C ATOM 644 O GLN A 39 26.386 36.510 21.944 1.00 0.00 O ATOM 645 CB GLN A 39 28.994 35.440 23.715 1.00 0.00 C ATOM 646 CG GLN A 39 28.858 36.555 24.754 1.00 0.00 C ATOM 647 CD GLN A 39 28.811 37.939 24.122 1.00 0.00 C ATOM 648 OE1 GLN A 39 29.791 38.394 23.535 1.00 0.00 O ATOM 649 NE2 GLN A 39 27.658 38.647 24.248 1.00 0.00 N ATOM 0 H GLN A 39 28.758 33.201 22.984 1.00 0.00 H new ATOM 0 HA GLN A 39 26.815 35.143 23.823 1.00 0.00 H new ATOM 0 HB2 GLN A 39 29.536 34.607 24.162 1.00 0.00 H new ATOM 0 HB3 GLN A 39 29.599 35.805 22.885 1.00 0.00 H new ATOM 0 HG2 GLN A 39 27.951 36.395 25.337 1.00 0.00 H new ATOM 0 HG3 GLN A 39 29.697 36.505 25.448 1.00 0.00 H new ATOM 0 HE21 GLN A 39 26.862 38.242 24.741 1.00 0.00 H new ATOM 0 HE22 GLN A 39 27.588 39.583 23.850 1.00 0.00 H new ATOM 898 N SER A 54 22.850 25.692 25.202 1.00 0.00 N ATOM 899 CA SER A 54 23.122 24.781 26.269 1.00 0.00 C ATOM 900 C SER A 54 24.393 25.130 26.966 1.00 0.00 C ATOM 901 O SER A 54 25.490 24.999 26.427 1.00 0.00 O ATOM 902 CB SER A 54 23.269 23.339 25.754 1.00 0.00 C ATOM 903 OG SER A 54 22.084 22.897 25.109 1.00 0.00 O ATOM 0 HA SER A 54 22.277 24.854 26.954 1.00 0.00 H new ATOM 0 HB2 SER A 54 24.106 23.283 25.059 1.00 0.00 H new ATOM 0 HB3 SER A 54 23.501 22.675 26.587 1.00 0.00 H new ATOM 0 HG SER A 54 21.610 23.667 24.731 1.00 0.00 H new ATOM 909 N GLU A 55 24.309 25.565 28.237 1.00 0.00 N ATOM 910 CA GLU A 55 25.430 25.813 29.090 1.00 0.00 C ATOM 911 C GLU A 55 26.247 24.594 29.345 1.00 0.00 C ATOM 912 O GLU A 55 27.470 24.671 29.462 1.00 0.00 O ATOM 913 CB GLU A 55 25.037 26.520 30.399 1.00 0.00 C ATOM 914 CG GLU A 55 23.883 25.912 31.199 1.00 0.00 C ATOM 915 CD GLU A 55 22.523 26.355 30.680 1.00 0.00 C ATOM 916 OE1 GLU A 55 21.995 27.401 31.144 1.00 0.00 O ATOM 917 OE2 GLU A 55 21.956 25.663 29.792 1.00 0.00 O ATOM 0 H GLU A 55 23.415 25.753 28.691 1.00 0.00 H new ATOM 0 HA GLU A 55 26.067 26.504 28.538 1.00 0.00 H new ATOM 0 HB2 GLU A 55 25.916 26.552 31.043 1.00 0.00 H new ATOM 0 HB3 GLU A 55 24.778 27.552 30.162 1.00 0.00 H new ATOM 0 HG2 GLU A 55 23.948 24.825 31.158 1.00 0.00 H new ATOM 0 HG3 GLU A 55 23.980 26.197 32.246 1.00 0.00 H new ATOM 924 N GLU A 56 25.645 23.392 29.344 1.00 0.00 N ATOM 925 CA GLU A 56 26.390 22.172 29.365 1.00 0.00 C ATOM 926 C GLU A 56 27.153 21.892 28.117 1.00 0.00 C ATOM 927 O GLU A 56 28.117 21.128 28.179 1.00 0.00 O ATOM 928 CB GLU A 56 25.542 20.942 29.727 1.00 0.00 C ATOM 929 CG GLU A 56 25.076 20.944 31.185 1.00 0.00 C ATOM 930 CD GLU A 56 24.595 19.597 31.705 1.00 0.00 C ATOM 931 OE1 GLU A 56 24.622 18.563 30.986 1.00 0.00 O ATOM 932 OE2 GLU A 56 24.183 19.569 32.896 1.00 0.00 O ATOM 0 H GLU A 56 24.633 23.265 29.329 1.00 0.00 H new ATOM 0 HA GLU A 56 27.113 22.346 30.162 1.00 0.00 H new ATOM 0 HB2 GLU A 56 24.671 20.903 29.073 1.00 0.00 H new ATOM 0 HB3 GLU A 56 26.123 20.039 29.538 1.00 0.00 H new ATOM 0 HG2 GLU A 56 25.898 21.287 31.813 1.00 0.00 H new ATOM 0 HG3 GLU A 56 24.268 21.668 31.292 1.00 0.00 H new ATOM 939 N GLU A 57 26.807 22.427 26.932 1.00 0.00 N ATOM 940 CA GLU A 57 27.524 22.115 25.735 1.00 0.00 C ATOM 941 C GLU A 57 28.745 22.962 25.617 1.00 0.00 C ATOM 942 O GLU A 57 29.816 22.555 25.171 1.00 0.00 O ATOM 943 CB GLU A 57 26.701 22.128 24.435 1.00 0.00 C ATOM 944 CG GLU A 57 26.810 23.373 23.553 1.00 0.00 C ATOM 945 CD GLU A 57 25.902 23.204 22.343 1.00 0.00 C ATOM 946 OE1 GLU A 57 24.655 23.248 22.517 1.00 0.00 O ATOM 947 OE2 GLU A 57 26.428 22.977 21.221 1.00 0.00 O ATOM 0 H GLU A 57 26.031 23.076 26.803 1.00 0.00 H new ATOM 0 HA GLU A 57 27.810 21.069 25.849 1.00 0.00 H new ATOM 0 HB2 GLU A 57 26.997 21.265 23.839 1.00 0.00 H new ATOM 0 HB3 GLU A 57 25.652 21.990 24.697 1.00 0.00 H new ATOM 0 HG2 GLU A 57 26.524 24.260 24.117 1.00 0.00 H new ATOM 0 HG3 GLU A 57 27.842 23.518 23.232 1.00 0.00 H new ATOM 954 N VAL A 58 28.593 24.225 26.054 1.00 0.00 N ATOM 955 CA VAL A 58 29.633 25.206 26.069 1.00 0.00 C ATOM 956 C VAL A 58 30.719 24.823 27.016 1.00 0.00 C ATOM 957 O VAL A 58 31.912 24.938 26.741 1.00 0.00 O ATOM 958 CB VAL A 58 29.007 26.558 26.242 1.00 0.00 C ATOM 959 CG1 VAL A 58 29.075 27.119 27.672 1.00 0.00 C ATOM 960 CG2 VAL A 58 29.770 27.555 25.352 1.00 0.00 C ATOM 0 H VAL A 58 27.706 24.578 26.413 1.00 0.00 H new ATOM 0 HA VAL A 58 30.167 25.259 25.120 1.00 0.00 H new ATOM 0 HB VAL A 58 27.955 26.436 25.982 1.00 0.00 H new ATOM 0 HG11 VAL A 58 28.598 28.099 27.702 1.00 0.00 H new ATOM 0 HG12 VAL A 58 28.558 26.443 28.353 1.00 0.00 H new ATOM 0 HG13 VAL A 58 30.117 27.213 27.977 1.00 0.00 H new ATOM 0 HG21 VAL A 58 29.333 28.548 25.460 1.00 0.00 H new ATOM 0 HG22 VAL A 58 30.817 27.585 25.654 1.00 0.00 H new ATOM 0 HG23 VAL A 58 29.701 27.240 24.311 1.00 0.00 H new ATOM 970 N PHE A 59 30.293 24.219 28.140 1.00 0.00 N ATOM 971 CA PHE A 59 31.067 23.391 29.012 1.00 0.00 C ATOM 972 C PHE A 59 31.653 22.188 28.357 1.00 0.00 C ATOM 973 O PHE A 59 32.871 22.018 28.400 1.00 0.00 O ATOM 974 CB PHE A 59 30.200 23.032 30.232 1.00 0.00 C ATOM 975 CG PHE A 59 30.799 22.084 31.211 1.00 0.00 C ATOM 976 CD1 PHE A 59 31.664 22.525 32.184 1.00 0.00 C ATOM 977 CD2 PHE A 59 30.475 20.748 31.164 1.00 0.00 C ATOM 978 CE1 PHE A 59 32.204 21.646 33.093 1.00 0.00 C ATOM 979 CE2 PHE A 59 31.019 19.860 32.062 1.00 0.00 C ATOM 980 CZ PHE A 59 31.888 20.309 33.028 1.00 0.00 C ATOM 0 H PHE A 59 29.331 24.319 28.463 1.00 0.00 H new ATOM 0 HA PHE A 59 31.942 23.959 29.328 1.00 0.00 H new ATOM 0 HB2 PHE A 59 29.950 23.954 30.757 1.00 0.00 H new ATOM 0 HB3 PHE A 59 29.263 22.606 29.873 1.00 0.00 H new ATOM 0 HD1 PHE A 59 31.922 23.572 32.235 1.00 0.00 H new ATOM 0 HD2 PHE A 59 29.785 20.392 30.413 1.00 0.00 H new ATOM 0 HE1 PHE A 59 32.876 22.005 33.858 1.00 0.00 H new ATOM 0 HE2 PHE A 59 30.764 18.812 32.009 1.00 0.00 H new ATOM 0 HZ PHE A 59 32.321 19.615 33.733 1.00 0.00 H new ATOM 990 N THR A 60 30.863 21.294 27.736 1.00 0.00 N ATOM 991 CA THR A 60 31.265 20.049 27.158 1.00 0.00 C ATOM 992 C THR A 60 32.468 20.095 26.281 1.00 0.00 C ATOM 993 O THR A 60 33.348 19.238 26.349 1.00 0.00 O ATOM 994 CB THR A 60 30.183 19.262 26.478 1.00 0.00 C ATOM 995 OG1 THR A 60 30.229 17.896 26.858 1.00 0.00 O ATOM 996 CG2 THR A 60 30.201 19.272 24.941 1.00 0.00 C ATOM 0 H THR A 60 29.862 21.457 27.630 1.00 0.00 H new ATOM 0 HA THR A 60 31.542 19.513 28.066 1.00 0.00 H new ATOM 0 HB THR A 60 29.278 19.773 26.808 1.00 0.00 H new ATOM 0 HG1 THR A 60 29.513 17.406 26.403 1.00 0.00 H new ATOM 0 HG21 THR A 60 29.374 18.671 24.564 1.00 0.00 H new ATOM 0 HG22 THR A 60 30.098 20.296 24.583 1.00 0.00 H new ATOM 0 HG23 THR A 60 31.144 18.856 24.585 1.00 0.00 H new ATOM 1004 N GLU A 61 32.560 21.123 25.420 1.00 0.00 N ATOM 1005 CA GLU A 61 33.709 21.290 24.585 1.00 0.00 C ATOM 1006 C GLU A 61 34.890 21.712 25.392 1.00 0.00 C ATOM 1007 O GLU A 61 35.860 20.957 25.443 1.00 0.00 O ATOM 1008 CB GLU A 61 33.450 22.054 23.276 1.00 0.00 C ATOM 1009 CG GLU A 61 32.474 21.328 22.348 1.00 0.00 C ATOM 1010 CD GLU A 61 32.769 21.596 20.880 1.00 0.00 C ATOM 1011 OE1 GLU A 61 32.809 22.784 20.461 1.00 0.00 O ATOM 1012 OE2 GLU A 61 32.993 20.616 20.121 1.00 0.00 O ATOM 0 H GLU A 61 31.841 21.837 25.302 1.00 0.00 H new ATOM 0 HA GLU A 61 33.974 20.313 24.182 1.00 0.00 H new ATOM 0 HB2 GLU A 61 33.055 23.042 23.510 1.00 0.00 H new ATOM 0 HB3 GLU A 61 34.396 22.204 22.755 1.00 0.00 H new ATOM 0 HG2 GLU A 61 32.525 20.256 22.537 1.00 0.00 H new ATOM 0 HG3 GLU A 61 31.456 21.644 22.576 1.00 0.00 H new ATOM 1019 N VAL A 62 34.843 22.827 26.141 1.00 0.00 N ATOM 1020 CA VAL A 62 35.867 23.343 26.996 1.00 0.00 C ATOM 1021 C VAL A 62 36.456 22.354 27.942 1.00 0.00 C ATOM 1022 O VAL A 62 37.646 22.336 28.249 1.00 0.00 O ATOM 1023 CB VAL A 62 35.306 24.505 27.761 1.00 0.00 C ATOM 1024 CG1 VAL A 62 36.318 25.104 28.751 1.00 0.00 C ATOM 1025 CG2 VAL A 62 34.921 25.588 26.739 1.00 0.00 C ATOM 0 H VAL A 62 34.013 23.420 26.148 1.00 0.00 H new ATOM 0 HA VAL A 62 36.691 23.639 26.347 1.00 0.00 H new ATOM 0 HB VAL A 62 34.451 24.156 28.341 1.00 0.00 H new ATOM 0 HG11 VAL A 62 35.860 25.941 29.278 1.00 0.00 H new ATOM 0 HG12 VAL A 62 36.617 24.342 29.471 1.00 0.00 H new ATOM 0 HG13 VAL A 62 37.196 25.454 28.207 1.00 0.00 H new ATOM 0 HG21 VAL A 62 34.508 26.451 27.261 1.00 0.00 H new ATOM 0 HG22 VAL A 62 35.806 25.892 26.180 1.00 0.00 H new ATOM 0 HG23 VAL A 62 34.176 25.190 26.050 1.00 0.00 H new ATOM 1035 N ALA A 63 35.618 21.402 28.391 1.00 0.00 N ATOM 1036 CA ALA A 63 35.972 20.329 29.268 1.00 0.00 C ATOM 1037 C ALA A 63 36.909 19.354 28.643 1.00 0.00 C ATOM 1038 O ALA A 63 37.735 18.760 29.334 1.00 0.00 O ATOM 1039 CB ALA A 63 34.722 19.542 29.697 1.00 0.00 C ATOM 0 H ALA A 63 34.634 21.381 28.125 1.00 0.00 H new ATOM 0 HA ALA A 63 36.460 20.800 30.121 1.00 0.00 H new ATOM 0 HB1 ALA A 63 35.014 18.731 30.364 1.00 0.00 H new ATOM 0 HB2 ALA A 63 34.033 20.208 30.216 1.00 0.00 H new ATOM 0 HB3 ALA A 63 34.232 19.129 28.815 1.00 0.00 H new ATOM 1045 N ASN A 64 36.837 19.153 27.315 1.00 0.00 N ATOM 1046 CA ASN A 64 37.697 18.234 26.633 1.00 0.00 C ATOM 1047 C ASN A 64 39.039 18.831 26.381 1.00 0.00 C ATOM 1048 O ASN A 64 40.066 18.154 26.388 1.00 0.00 O ATOM 1049 CB ASN A 64 37.051 17.581 25.399 1.00 0.00 C ATOM 1050 CG ASN A 64 37.165 18.308 24.067 1.00 0.00 C ATOM 1051 OD1 ASN A 64 38.247 18.390 23.485 1.00 0.00 O ATOM 1052 ND2 ASN A 64 36.034 18.828 23.521 1.00 0.00 N ATOM 0 H ASN A 64 36.174 19.633 26.706 1.00 0.00 H new ATOM 0 HA ASN A 64 37.861 17.393 27.307 1.00 0.00 H new ATOM 0 HB2 ASN A 64 37.488 16.590 25.278 1.00 0.00 H new ATOM 0 HB3 ASN A 64 35.992 17.438 25.612 1.00 0.00 H new ATOM 0 HD21 ASN A 64 36.073 19.295 22.615 1.00 0.00 H new ATOM 0 HD22 ASN A 64 35.146 18.751 24.017 1.00 0.00 H new ATOM 1059 N LEU A 65 39.090 20.161 26.193 1.00 0.00 N ATOM 1060 CA LEU A 65 40.276 20.958 26.120 1.00 0.00 C ATOM 1061 C LEU A 65 41.061 20.915 27.385 1.00 0.00 C ATOM 1062 O LEU A 65 42.284 20.781 27.390 1.00 0.00 O ATOM 1063 CB LEU A 65 39.965 22.439 25.848 1.00 0.00 C ATOM 1064 CG LEU A 65 39.481 22.798 24.433 1.00 0.00 C ATOM 1065 CD1 LEU A 65 38.093 22.215 24.119 1.00 0.00 C ATOM 1066 CD2 LEU A 65 39.377 24.328 24.315 1.00 0.00 C ATOM 0 H LEU A 65 38.243 20.718 26.084 1.00 0.00 H new ATOM 0 HA LEU A 65 40.849 20.529 25.298 1.00 0.00 H new ATOM 0 HB2 LEU A 65 39.205 22.763 26.559 1.00 0.00 H new ATOM 0 HB3 LEU A 65 40.864 23.019 26.057 1.00 0.00 H new ATOM 0 HG LEU A 65 40.201 22.378 23.731 1.00 0.00 H new ATOM 0 HD11 LEU A 65 37.799 22.498 23.108 1.00 0.00 H new ATOM 0 HD12 LEU A 65 38.129 21.128 24.195 1.00 0.00 H new ATOM 0 HD13 LEU A 65 37.365 22.605 24.831 1.00 0.00 H new ATOM 0 HD21 LEU A 65 39.034 24.593 23.315 1.00 0.00 H new ATOM 0 HD22 LEU A 65 38.667 24.702 25.053 1.00 0.00 H new ATOM 0 HD23 LEU A 65 40.355 24.774 24.494 1.00 0.00 H new ATOM 1078 N PHE A 66 40.357 21.054 28.524 1.00 0.00 N ATOM 1079 CA PHE A 66 40.924 21.325 29.809 1.00 0.00 C ATOM 1080 C PHE A 66 40.958 20.087 30.637 1.00 0.00 C ATOM 1081 O PHE A 66 41.092 20.128 31.860 1.00 0.00 O ATOM 1082 CB PHE A 66 40.106 22.361 30.599 1.00 0.00 C ATOM 1083 CG PHE A 66 40.019 23.752 30.071 1.00 0.00 C ATOM 1084 CD1 PHE A 66 40.526 24.177 28.866 1.00 0.00 C ATOM 1085 CD2 PHE A 66 39.360 24.667 30.858 1.00 0.00 C ATOM 1086 CE1 PHE A 66 40.337 25.466 28.428 1.00 0.00 C ATOM 1087 CE2 PHE A 66 39.208 25.974 30.460 1.00 0.00 C ATOM 1088 CZ PHE A 66 39.691 26.370 29.236 1.00 0.00 C ATOM 0 H PHE A 66 39.341 20.973 28.549 1.00 0.00 H new ATOM 0 HA PHE A 66 41.926 21.709 29.620 1.00 0.00 H new ATOM 0 HB2 PHE A 66 39.090 21.978 30.694 1.00 0.00 H new ATOM 0 HB3 PHE A 66 40.522 22.414 31.605 1.00 0.00 H new ATOM 0 HD1 PHE A 66 41.083 23.485 28.252 1.00 0.00 H new ATOM 0 HD2 PHE A 66 38.954 24.352 31.808 1.00 0.00 H new ATOM 0 HE1 PHE A 66 40.694 25.767 27.454 1.00 0.00 H new ATOM 0 HE2 PHE A 66 38.712 26.685 31.105 1.00 0.00 H new ATOM 0 HZ PHE A 66 39.563 27.391 28.909 1.00 0.00 H new ATOM 1098 N ARG A 67 40.813 18.911 30.003 1.00 0.00 N ATOM 1099 CA ARG A 67 40.395 17.709 30.656 1.00 0.00 C ATOM 1100 C ARG A 67 41.286 17.195 31.735 1.00 0.00 C ATOM 1101 O ARG A 67 42.506 17.112 31.602 1.00 0.00 O ATOM 1102 CB ARG A 67 40.067 16.659 29.582 1.00 0.00 C ATOM 1103 CG ARG A 67 41.221 15.754 29.144 1.00 0.00 C ATOM 1104 CD ARG A 67 41.060 15.139 27.753 1.00 0.00 C ATOM 1105 NE ARG A 67 39.770 14.395 27.681 1.00 0.00 N ATOM 1106 CZ ARG A 67 39.146 14.134 26.496 1.00 0.00 C ATOM 1107 NH1 ARG A 67 39.705 14.483 25.302 1.00 0.00 N ATOM 1108 NH2 ARG A 67 37.938 13.497 26.498 1.00 0.00 N ATOM 0 H ARG A 67 40.992 18.792 29.006 1.00 0.00 H new ATOM 0 HA ARG A 67 39.500 17.957 31.227 1.00 0.00 H new ATOM 0 HB2 ARG A 67 39.260 16.028 29.955 1.00 0.00 H new ATOM 0 HB3 ARG A 67 39.686 17.177 28.702 1.00 0.00 H new ATOM 0 HG2 ARG A 67 42.145 16.331 29.166 1.00 0.00 H new ATOM 0 HG3 ARG A 67 41.330 14.950 29.871 1.00 0.00 H new ATOM 0 HD2 ARG A 67 41.083 15.921 26.994 1.00 0.00 H new ATOM 0 HD3 ARG A 67 41.892 14.466 27.543 1.00 0.00 H new ATOM 0 HE ARG A 67 39.339 14.070 28.547 1.00 0.00 H new ATOM 0 HH11 ARG A 67 40.611 14.951 25.280 1.00 0.00 H new ATOM 0 HH12 ARG A 67 39.217 14.276 24.431 1.00 0.00 H new ATOM 0 HH21 ARG A 67 37.509 13.220 27.381 1.00 0.00 H new ATOM 0 HH22 ARG A 67 37.465 13.298 25.617 1.00 0.00 H new ATOM 1122 N GLY A 68 40.702 16.884 32.907 1.00 0.00 N ATOM 1123 CA GLY A 68 41.436 16.545 34.086 1.00 0.00 C ATOM 1124 C GLY A 68 41.695 17.709 34.978 1.00 0.00 C ATOM 1125 O GLY A 68 41.846 17.544 36.188 1.00 0.00 O ATOM 0 H GLY A 68 39.691 16.868 33.037 1.00 0.00 H new ATOM 0 HA2 GLY A 68 40.885 15.786 34.642 1.00 0.00 H new ATOM 0 HA3 GLY A 68 42.388 16.100 33.797 1.00 0.00 H new ATOM 1129 N GLN A 69 41.779 18.940 34.442 1.00 0.00 N ATOM 1130 CA GLN A 69 42.077 20.107 35.211 1.00 0.00 C ATOM 1131 C GLN A 69 40.838 20.783 35.692 1.00 0.00 C ATOM 1132 O GLN A 69 40.375 21.801 35.179 1.00 0.00 O ATOM 1133 CB GLN A 69 42.930 21.126 34.436 1.00 0.00 C ATOM 1134 CG GLN A 69 44.257 20.550 33.939 1.00 0.00 C ATOM 1135 CD GLN A 69 45.054 21.622 33.211 1.00 0.00 C ATOM 1136 OE1 GLN A 69 45.371 22.668 33.776 1.00 0.00 O ATOM 1137 NE2 GLN A 69 45.378 21.388 31.910 1.00 0.00 N ATOM 0 H GLN A 69 41.636 19.128 33.450 1.00 0.00 H new ATOM 0 HA GLN A 69 42.653 19.752 36.065 1.00 0.00 H new ATOM 0 HB2 GLN A 69 42.359 21.493 33.583 1.00 0.00 H new ATOM 0 HB3 GLN A 69 43.132 21.984 35.078 1.00 0.00 H new ATOM 0 HG2 GLN A 69 44.834 20.166 34.781 1.00 0.00 H new ATOM 0 HG3 GLN A 69 44.070 19.709 33.271 1.00 0.00 H new ATOM 0 HE21 GLN A 69 45.103 20.512 31.466 1.00 0.00 H new ATOM 0 HE22 GLN A 69 45.896 22.089 31.379 1.00 0.00 H new ATOM 1146 N GLU A 70 40.281 20.233 36.785 1.00 0.00 N ATOM 1147 CA GLU A 70 39.052 20.644 37.391 1.00 0.00 C ATOM 1148 C GLU A 70 39.126 21.980 38.044 1.00 0.00 C ATOM 1149 O GLU A 70 38.095 22.618 38.253 1.00 0.00 O ATOM 1150 CB GLU A 70 38.466 19.576 38.330 1.00 0.00 C ATOM 1151 CG GLU A 70 38.125 18.284 37.583 1.00 0.00 C ATOM 1152 CD GLU A 70 37.186 17.381 38.371 1.00 0.00 C ATOM 1153 OE1 GLU A 70 36.027 17.797 38.631 1.00 0.00 O ATOM 1154 OE2 GLU A 70 37.588 16.237 38.715 1.00 0.00 O ATOM 0 H GLU A 70 40.716 19.452 37.276 1.00 0.00 H new ATOM 0 HA GLU A 70 38.353 20.756 36.562 1.00 0.00 H new ATOM 0 HB2 GLU A 70 39.181 19.359 39.124 1.00 0.00 H new ATOM 0 HB3 GLU A 70 37.568 19.967 38.808 1.00 0.00 H new ATOM 0 HG2 GLU A 70 37.666 18.533 36.626 1.00 0.00 H new ATOM 0 HG3 GLU A 70 39.045 17.742 37.364 1.00 0.00 H new ATOM 1161 N ASP A 71 40.333 22.492 38.347 1.00 0.00 N ATOM 1162 CA ASP A 71 40.616 23.815 38.810 1.00 0.00 C ATOM 1163 C ASP A 71 39.949 24.870 37.996 1.00 0.00 C ATOM 1164 O ASP A 71 39.283 25.771 38.503 1.00 0.00 O ATOM 1165 CB ASP A 71 42.123 24.115 38.742 1.00 0.00 C ATOM 1166 CG ASP A 71 42.966 23.243 39.661 1.00 0.00 C ATOM 1167 OD1 ASP A 71 42.410 22.537 40.544 1.00 0.00 O ATOM 1168 OD2 ASP A 71 44.213 23.245 39.477 1.00 0.00 O ATOM 0 H ASP A 71 41.181 21.931 38.260 1.00 0.00 H new ATOM 0 HA ASP A 71 40.242 23.840 39.833 1.00 0.00 H new ATOM 0 HB2 ASP A 71 42.464 23.981 37.716 1.00 0.00 H new ATOM 0 HB3 ASP A 71 42.287 25.162 38.998 1.00 0.00 H new ATOM 1173 N LEU A 72 40.088 24.778 36.661 1.00 0.00 N ATOM 1174 CA LEU A 72 39.559 25.735 35.740 1.00 0.00 C ATOM 1175 C LEU A 72 38.072 25.671 35.652 1.00 0.00 C ATOM 1176 O LEU A 72 37.388 26.683 35.795 1.00 0.00 O ATOM 1177 CB LEU A 72 40.255 25.578 34.377 1.00 0.00 C ATOM 1178 CG LEU A 72 41.789 25.676 34.437 1.00 0.00 C ATOM 1179 CD1 LEU A 72 42.372 25.520 33.023 1.00 0.00 C ATOM 1180 CD2 LEU A 72 42.325 26.972 35.070 1.00 0.00 C ATOM 0 H LEU A 72 40.585 24.011 36.208 1.00 0.00 H new ATOM 0 HA LEU A 72 39.774 26.737 36.110 1.00 0.00 H new ATOM 0 HB2 LEU A 72 39.980 24.613 33.950 1.00 0.00 H new ATOM 0 HB3 LEU A 72 39.879 26.345 33.699 1.00 0.00 H new ATOM 0 HG LEU A 72 42.111 24.866 35.092 1.00 0.00 H new ATOM 0 HD11 LEU A 72 43.459 25.590 33.068 1.00 0.00 H new ATOM 0 HD12 LEU A 72 42.087 24.549 32.617 1.00 0.00 H new ATOM 0 HD13 LEU A 72 41.984 26.310 32.380 1.00 0.00 H new ATOM 0 HD21 LEU A 72 43.415 26.953 35.070 1.00 0.00 H new ATOM 0 HD22 LEU A 72 41.977 27.829 34.494 1.00 0.00 H new ATOM 0 HD23 LEU A 72 41.964 27.053 36.095 1.00 0.00 H new ATOM 1192 N LEU A 73 37.475 24.474 35.513 1.00 0.00 N ATOM 1193 CA LEU A 73 36.060 24.283 35.449 1.00 0.00 C ATOM 1194 C LEU A 73 35.336 24.646 36.699 1.00 0.00 C ATOM 1195 O LEU A 73 34.153 24.984 36.711 1.00 0.00 O ATOM 1196 CB LEU A 73 35.667 22.838 35.097 1.00 0.00 C ATOM 1197 CG LEU A 73 35.950 22.400 33.651 1.00 0.00 C ATOM 1198 CD1 LEU A 73 35.381 23.364 32.597 1.00 0.00 C ATOM 1199 CD2 LEU A 73 37.447 22.129 33.424 1.00 0.00 C ATOM 0 H LEU A 73 38.001 23.603 35.442 1.00 0.00 H new ATOM 0 HA LEU A 73 35.759 24.965 34.654 1.00 0.00 H new ATOM 0 HB2 LEU A 73 36.196 22.164 35.771 1.00 0.00 H new ATOM 0 HB3 LEU A 73 34.602 22.714 35.292 1.00 0.00 H new ATOM 0 HG LEU A 73 35.415 21.460 33.514 1.00 0.00 H new ATOM 0 HD11 LEU A 73 35.618 22.993 31.600 1.00 0.00 H new ATOM 0 HD12 LEU A 73 34.299 23.431 32.712 1.00 0.00 H new ATOM 0 HD13 LEU A 73 35.822 24.352 32.731 1.00 0.00 H new ATOM 0 HD21 LEU A 73 37.609 21.822 32.391 1.00 0.00 H new ATOM 0 HD22 LEU A 73 38.016 23.037 33.626 1.00 0.00 H new ATOM 0 HD23 LEU A 73 37.779 21.336 34.094 1.00 0.00 H new ATOM 1211 N SER A 74 36.061 24.637 37.833 1.00 0.00 N ATOM 1212 CA SER A 74 35.599 25.065 39.116 1.00 0.00 C ATOM 1213 C SER A 74 35.313 26.527 39.139 1.00 0.00 C ATOM 1214 O SER A 74 34.240 26.965 39.554 1.00 0.00 O ATOM 1215 CB SER A 74 36.552 24.727 40.275 1.00 0.00 C ATOM 1216 OG SER A 74 36.667 23.322 40.443 1.00 0.00 O ATOM 0 H SER A 74 37.027 24.311 37.853 1.00 0.00 H new ATOM 0 HA SER A 74 34.680 24.500 39.273 1.00 0.00 H new ATOM 0 HB2 SER A 74 37.535 25.156 40.080 1.00 0.00 H new ATOM 0 HB3 SER A 74 36.185 25.179 41.197 1.00 0.00 H new ATOM 0 HG SER A 74 37.241 22.954 39.739 1.00 0.00 H new ATOM 1222 N GLU A 75 36.240 27.348 38.615 1.00 0.00 N ATOM 1223 CA GLU A 75 36.039 28.751 38.430 1.00 0.00 C ATOM 1224 C GLU A 75 35.142 29.078 37.287 1.00 0.00 C ATOM 1225 O GLU A 75 34.441 30.090 37.317 1.00 0.00 O ATOM 1226 CB GLU A 75 37.356 29.533 38.299 1.00 0.00 C ATOM 1227 CG GLU A 75 38.085 29.653 39.639 1.00 0.00 C ATOM 1228 CD GLU A 75 39.244 30.638 39.569 1.00 0.00 C ATOM 1229 OE1 GLU A 75 40.247 30.335 38.870 1.00 0.00 O ATOM 1230 OE2 GLU A 75 39.191 31.691 40.260 1.00 0.00 O ATOM 0 H GLU A 75 37.158 27.025 38.310 1.00 0.00 H new ATOM 0 HA GLU A 75 35.540 29.071 39.344 1.00 0.00 H new ATOM 0 HB2 GLU A 75 38.003 29.035 37.577 1.00 0.00 H new ATOM 0 HB3 GLU A 75 37.149 30.529 37.908 1.00 0.00 H new ATOM 0 HG2 GLU A 75 37.382 29.974 40.407 1.00 0.00 H new ATOM 0 HG3 GLU A 75 38.459 28.674 39.938 1.00 0.00 H new ATOM 1237 N PHE A 76 35.048 28.205 36.269 1.00 0.00 N ATOM 1238 CA PHE A 76 34.087 28.298 35.214 1.00 0.00 C ATOM 1239 C PHE A 76 32.690 28.249 35.727 1.00 0.00 C ATOM 1240 O PHE A 76 31.786 28.901 35.206 1.00 0.00 O ATOM 1241 CB PHE A 76 34.316 27.154 34.210 1.00 0.00 C ATOM 1242 CG PHE A 76 33.715 27.320 32.858 1.00 0.00 C ATOM 1243 CD1 PHE A 76 34.139 28.310 32.001 1.00 0.00 C ATOM 1244 CD2 PHE A 76 32.809 26.392 32.402 1.00 0.00 C ATOM 1245 CE1 PHE A 76 33.708 28.342 30.696 1.00 0.00 C ATOM 1246 CE2 PHE A 76 32.361 26.425 31.102 1.00 0.00 C ATOM 1247 CZ PHE A 76 32.831 27.388 30.239 1.00 0.00 C ATOM 0 H PHE A 76 35.668 27.400 36.177 1.00 0.00 H new ATOM 0 HA PHE A 76 34.221 29.261 34.722 1.00 0.00 H new ATOM 0 HB2 PHE A 76 35.391 27.017 34.090 1.00 0.00 H new ATOM 0 HB3 PHE A 76 33.924 26.235 34.646 1.00 0.00 H new ATOM 0 HD1 PHE A 76 34.818 29.070 32.358 1.00 0.00 H new ATOM 0 HD2 PHE A 76 32.445 25.628 33.073 1.00 0.00 H new ATOM 0 HE1 PHE A 76 34.059 29.117 30.030 1.00 0.00 H new ATOM 0 HE2 PHE A 76 31.641 25.696 30.759 1.00 0.00 H new ATOM 0 HZ PHE A 76 32.512 27.394 29.207 1.00 0.00 H new ATOM 1257 N GLY A 77 32.486 27.532 36.846 1.00 0.00 N ATOM 1258 CA GLY A 77 31.233 27.329 37.505 1.00 0.00 C ATOM 1259 C GLY A 77 30.574 28.553 38.042 1.00 0.00 C ATOM 1260 O GLY A 77 29.360 28.572 38.239 1.00 0.00 O ATOM 0 H GLY A 77 33.253 27.060 37.324 1.00 0.00 H new ATOM 0 HA2 GLY A 77 30.549 26.850 36.804 1.00 0.00 H new ATOM 0 HA3 GLY A 77 31.386 26.631 38.328 1.00 0.00 H new ATOM 1264 N GLN A 78 31.329 29.650 38.233 1.00 0.00 N ATOM 1265 CA GLN A 78 30.842 30.920 38.675 1.00 0.00 C ATOM 1266 C GLN A 78 30.080 31.615 37.600 1.00 0.00 C ATOM 1267 O GLN A 78 29.090 32.302 37.844 1.00 0.00 O ATOM 1268 CB GLN A 78 32.024 31.824 39.060 1.00 0.00 C ATOM 1269 CG GLN A 78 32.943 31.185 40.103 1.00 0.00 C ATOM 1270 CD GLN A 78 34.196 32.016 40.346 1.00 0.00 C ATOM 1271 OE1 GLN A 78 34.495 32.458 41.454 1.00 0.00 O ATOM 1272 NE2 GLN A 78 34.989 32.215 39.260 1.00 0.00 N ATOM 0 H GLN A 78 32.336 29.650 38.070 1.00 0.00 H new ATOM 0 HA GLN A 78 30.188 30.738 39.528 1.00 0.00 H new ATOM 0 HB2 GLN A 78 32.603 32.058 38.167 1.00 0.00 H new ATOM 0 HB3 GLN A 78 31.642 32.768 39.448 1.00 0.00 H new ATOM 0 HG2 GLN A 78 32.400 31.066 41.040 1.00 0.00 H new ATOM 0 HG3 GLN A 78 33.229 30.187 39.771 1.00 0.00 H new ATOM 0 HE21 GLN A 78 34.716 31.837 38.353 1.00 0.00 H new ATOM 0 HE22 GLN A 78 35.857 32.743 39.352 1.00 0.00 H new ATOM 1466 N ASN B 201 28.376 36.043 34.180 1.00 0.00 N ATOM 1467 CA ASN B 201 27.928 34.979 33.336 1.00 0.00 C ATOM 1468 C ASN B 201 28.998 34.744 32.325 1.00 0.00 C ATOM 1469 O ASN B 201 30.009 35.443 32.311 1.00 0.00 O ATOM 1470 CB ASN B 201 26.607 35.323 32.628 1.00 0.00 C ATOM 1471 CG ASN B 201 25.358 35.210 33.490 1.00 0.00 C ATOM 1472 OD1 ASN B 201 24.286 34.871 32.990 1.00 0.00 O ATOM 1473 ND2 ASN B 201 25.442 35.491 34.818 1.00 0.00 N ATOM 0 HA ASN B 201 27.739 34.090 33.938 1.00 0.00 H new ATOM 0 HB2 ASN B 201 26.673 36.342 32.246 1.00 0.00 H new ATOM 0 HB3 ASN B 201 26.494 34.666 31.766 1.00 0.00 H new ATOM 0 HD21 ASN B 201 24.612 35.421 35.407 1.00 0.00 H new ATOM 0 HD22 ASN B 201 26.335 35.771 35.225 1.00 0.00 H new ATOM 1480 N ILE B 202 28.850 33.785 31.393 1.00 0.00 N ATOM 1481 CA ILE B 202 29.809 33.497 30.372 1.00 0.00 C ATOM 1482 C ILE B 202 30.066 34.623 29.430 1.00 0.00 C ATOM 1483 O ILE B 202 31.140 34.733 28.841 1.00 0.00 O ATOM 1484 CB ILE B 202 29.576 32.159 29.735 1.00 0.00 C ATOM 1485 CG1 ILE B 202 30.347 31.114 30.559 1.00 0.00 C ATOM 1486 CG2 ILE B 202 29.937 32.105 28.242 1.00 0.00 C ATOM 1487 CD1 ILE B 202 30.329 29.682 30.021 1.00 0.00 C ATOM 0 H ILE B 202 28.026 33.185 31.349 1.00 0.00 H new ATOM 0 HA ILE B 202 30.771 33.401 30.876 1.00 0.00 H new ATOM 0 HB ILE B 202 28.507 31.946 29.748 1.00 0.00 H new ATOM 0 HG12 ILE B 202 31.385 31.437 30.637 1.00 0.00 H new ATOM 0 HG13 ILE B 202 29.939 31.105 31.570 1.00 0.00 H new ATOM 0 HG21 ILE B 202 29.740 31.105 27.856 1.00 0.00 H new ATOM 0 HG22 ILE B 202 29.334 32.830 27.695 1.00 0.00 H new ATOM 0 HG23 ILE B 202 30.993 32.342 28.114 1.00 0.00 H new ATOM 0 HD11 ILE B 202 30.905 29.037 30.685 1.00 0.00 H new ATOM 0 HD12 ILE B 202 29.300 29.325 29.971 1.00 0.00 H new ATOM 0 HD13 ILE B 202 30.769 29.662 29.024 1.00 0.00 H new ATOM 1499 N GLN B 203 29.131 35.586 29.346 1.00 0.00 N ATOM 1500 CA GLN B 203 29.243 36.892 28.774 1.00 0.00 C ATOM 1501 C GLN B 203 30.536 37.598 28.999 1.00 0.00 C ATOM 1502 O GLN B 203 31.062 38.262 28.108 1.00 0.00 O ATOM 1503 CB GLN B 203 28.082 37.720 29.347 1.00 0.00 C ATOM 1504 CG GLN B 203 27.938 39.176 28.898 1.00 0.00 C ATOM 1505 CD GLN B 203 28.735 40.163 29.740 1.00 0.00 C ATOM 1506 OE1 GLN B 203 28.659 40.186 30.967 1.00 0.00 O ATOM 1507 NE2 GLN B 203 29.517 41.051 29.068 1.00 0.00 N ATOM 0 H GLN B 203 28.195 35.429 29.721 1.00 0.00 H new ATOM 0 HA GLN B 203 29.203 36.776 27.691 1.00 0.00 H new ATOM 0 HB2 GLN B 203 27.154 37.204 29.103 1.00 0.00 H new ATOM 0 HB3 GLN B 203 28.174 37.715 30.433 1.00 0.00 H new ATOM 0 HG2 GLN B 203 28.257 39.259 27.859 1.00 0.00 H new ATOM 0 HG3 GLN B 203 26.884 39.454 28.931 1.00 0.00 H new ATOM 0 HE21 GLN B 203 29.568 41.017 28.050 1.00 0.00 H new ATOM 0 HE22 GLN B 203 30.052 41.750 29.582 1.00 0.00 H new ATOM 1516 N MET B 204 31.108 37.430 30.205 1.00 0.00 N ATOM 1517 CA MET B 204 32.336 38.000 30.666 1.00 0.00 C ATOM 1518 C MET B 204 33.562 37.517 29.969 1.00 0.00 C ATOM 1519 O MET B 204 34.531 38.256 29.803 1.00 0.00 O ATOM 1520 CB MET B 204 32.512 37.666 32.156 1.00 0.00 C ATOM 1521 CG MET B 204 31.387 38.244 33.017 1.00 0.00 C ATOM 1522 SD MET B 204 31.418 40.059 33.136 1.00 0.00 S ATOM 1523 CE MET B 204 32.490 40.044 34.602 1.00 0.00 C ATOM 0 H MET B 204 30.672 36.845 30.917 1.00 0.00 H new ATOM 0 HA MET B 204 32.247 39.067 30.462 1.00 0.00 H new ATOM 0 HB2 MET B 204 32.544 36.584 32.282 1.00 0.00 H new ATOM 0 HB3 MET B 204 33.469 38.056 32.503 1.00 0.00 H new ATOM 0 HG2 MET B 204 30.428 37.932 32.604 1.00 0.00 H new ATOM 0 HG3 MET B 204 31.455 37.822 34.020 1.00 0.00 H new ATOM 0 HE1 MET B 204 32.718 41.068 34.896 1.00 0.00 H new ATOM 0 HE2 MET B 204 31.980 39.536 35.421 1.00 0.00 H new ATOM 0 HE3 MET B 204 33.416 39.518 34.370 1.00 0.00 H new ATOM 1533 N LEU B 205 33.611 36.240 29.549 1.00 0.00 N ATOM 1534 CA LEU B 205 34.824 35.607 29.136 1.00 0.00 C ATOM 1535 C LEU B 205 35.394 36.095 27.849 1.00 0.00 C ATOM 1536 O LEU B 205 36.606 36.209 27.684 1.00 0.00 O ATOM 1537 CB LEU B 205 34.706 34.073 29.166 1.00 0.00 C ATOM 1538 CG LEU B 205 34.792 33.461 30.575 1.00 0.00 C ATOM 1539 CD1 LEU B 205 34.488 31.954 30.545 1.00 0.00 C ATOM 1540 CD2 LEU B 205 36.178 33.693 31.200 1.00 0.00 C ATOM 0 H LEU B 205 32.791 35.635 29.495 1.00 0.00 H new ATOM 0 HA LEU B 205 35.555 35.912 29.884 1.00 0.00 H new ATOM 0 HB2 LEU B 205 33.757 33.784 28.714 1.00 0.00 H new ATOM 0 HB3 LEU B 205 35.496 33.647 28.548 1.00 0.00 H new ATOM 0 HG LEU B 205 34.042 33.961 31.188 1.00 0.00 H new ATOM 0 HD11 LEU B 205 34.556 31.549 31.555 1.00 0.00 H new ATOM 0 HD12 LEU B 205 33.482 31.793 30.157 1.00 0.00 H new ATOM 0 HD13 LEU B 205 35.210 31.450 29.902 1.00 0.00 H new ATOM 0 HD21 LEU B 205 36.207 33.249 32.195 1.00 0.00 H new ATOM 0 HD22 LEU B 205 36.941 33.231 30.574 1.00 0.00 H new ATOM 0 HD23 LEU B 205 36.369 34.764 31.275 1.00 0.00 H new ATOM 1552 N LEU B 206 34.507 36.485 26.915 1.00 0.00 N ATOM 1553 CA LEU B 206 34.831 37.018 25.629 1.00 0.00 C ATOM 1554 C LEU B 206 35.254 38.443 25.725 1.00 0.00 C ATOM 1555 O LEU B 206 35.940 38.962 24.846 1.00 0.00 O ATOM 1556 CB LEU B 206 33.577 36.853 24.753 1.00 0.00 C ATOM 1557 CG LEU B 206 33.091 35.403 24.587 1.00 0.00 C ATOM 1558 CD1 LEU B 206 34.239 34.464 24.181 1.00 0.00 C ATOM 1559 CD2 LEU B 206 32.301 34.819 25.770 1.00 0.00 C ATOM 0 H LEU B 206 33.501 36.424 27.069 1.00 0.00 H new ATOM 0 HA LEU B 206 35.675 36.487 25.189 1.00 0.00 H new ATOM 0 HB2 LEU B 206 32.770 37.445 25.184 1.00 0.00 H new ATOM 0 HB3 LEU B 206 33.784 37.267 23.766 1.00 0.00 H new ATOM 0 HG LEU B 206 32.365 35.466 23.776 1.00 0.00 H new ATOM 0 HD11 LEU B 206 33.858 33.449 24.073 1.00 0.00 H new ATOM 0 HD12 LEU B 206 34.662 34.795 23.233 1.00 0.00 H new ATOM 0 HD13 LEU B 206 35.012 34.481 24.949 1.00 0.00 H new ATOM 0 HD21 LEU B 206 32.010 33.794 25.542 1.00 0.00 H new ATOM 0 HD22 LEU B 206 32.924 34.829 26.664 1.00 0.00 H new ATOM 0 HD23 LEU B 206 31.408 35.420 25.943 1.00 0.00 H new ATOM 1571 N GLU B 207 34.911 39.113 26.840 1.00 0.00 N ATOM 1572 CA GLU B 207 35.358 40.431 27.164 1.00 0.00 C ATOM 1573 C GLU B 207 36.708 40.386 27.793 1.00 0.00 C ATOM 1574 O GLU B 207 37.636 41.078 27.375 1.00 0.00 O ATOM 1575 CB GLU B 207 34.390 41.160 28.110 1.00 0.00 C ATOM 1576 CG GLU B 207 32.962 41.327 27.585 1.00 0.00 C ATOM 1577 CD GLU B 207 32.851 42.254 26.383 1.00 0.00 C ATOM 1578 OE1 GLU B 207 33.224 43.452 26.506 1.00 0.00 O ATOM 1579 OE2 GLU B 207 32.356 41.803 25.316 1.00 0.00 O ATOM 0 H GLU B 207 34.293 38.716 27.548 1.00 0.00 H new ATOM 0 HA GLU B 207 35.400 40.984 26.226 1.00 0.00 H new ATOM 0 HB2 GLU B 207 34.351 40.615 29.053 1.00 0.00 H new ATOM 0 HB3 GLU B 207 34.797 42.147 28.329 1.00 0.00 H new ATOM 0 HG2 GLU B 207 32.568 40.347 27.314 1.00 0.00 H new ATOM 0 HG3 GLU B 207 32.333 41.712 28.388 1.00 0.00 H new ATOM 1586 N ALA B 208 36.879 39.545 28.828 1.00 0.00 N ATOM 1587 CA ALA B 208 38.106 39.347 29.535 1.00 0.00 C ATOM 1588 C ALA B 208 39.222 38.856 28.677 1.00 0.00 C ATOM 1589 O ALA B 208 40.353 39.325 28.800 1.00 0.00 O ATOM 1590 CB ALA B 208 37.893 38.403 30.730 1.00 0.00 C ATOM 0 H ALA B 208 36.118 38.971 29.192 1.00 0.00 H new ATOM 0 HA ALA B 208 38.409 40.331 29.893 1.00 0.00 H new ATOM 0 HB1 ALA B 208 38.837 38.264 31.256 1.00 0.00 H new ATOM 0 HB2 ALA B 208 37.159 38.836 31.410 1.00 0.00 H new ATOM 0 HB3 ALA B 208 37.531 37.439 30.372 1.00 0.00 H new ATOM 1596 N ALA B 209 38.945 37.940 27.732 1.00 0.00 N ATOM 1597 CA ALA B 209 39.885 37.492 26.751 1.00 0.00 C ATOM 1598 C ALA B 209 40.377 38.561 25.838 1.00 0.00 C ATOM 1599 O ALA B 209 41.584 38.699 25.643 1.00 0.00 O ATOM 1600 CB ALA B 209 39.276 36.358 25.910 1.00 0.00 C ATOM 0 H ALA B 209 38.031 37.494 27.648 1.00 0.00 H new ATOM 0 HA ALA B 209 40.748 37.142 27.317 1.00 0.00 H new ATOM 0 HB1 ALA B 209 40.001 36.026 25.167 1.00 0.00 H new ATOM 0 HB2 ALA B 209 39.014 35.523 26.560 1.00 0.00 H new ATOM 0 HB3 ALA B 209 38.380 36.720 25.406 1.00 0.00 H new ATOM 1606 N ASP B 210 39.498 39.396 25.253 1.00 0.00 N ATOM 1607 CA ASP B 210 39.900 40.410 24.329 1.00 0.00 C ATOM 1608 C ASP B 210 40.612 41.541 24.987 1.00 0.00 C ATOM 1609 O ASP B 210 41.546 42.123 24.438 1.00 0.00 O ATOM 1610 CB ASP B 210 38.695 40.884 23.499 1.00 0.00 C ATOM 1611 CG ASP B 210 39.151 41.490 22.178 1.00 0.00 C ATOM 1612 OD1 ASP B 210 39.575 40.717 21.278 1.00 0.00 O ATOM 1613 OD2 ASP B 210 39.094 42.739 22.022 1.00 0.00 O ATOM 0 H ASP B 210 38.493 39.366 25.425 1.00 0.00 H new ATOM 0 HA ASP B 210 40.627 39.966 23.649 1.00 0.00 H new ATOM 0 HB2 ASP B 210 38.027 40.044 23.307 1.00 0.00 H new ATOM 0 HB3 ASP B 210 38.126 41.621 24.065 1.00 0.00 H new ATOM 1618 N TYR B 211 40.255 41.852 26.245 1.00 0.00 N ATOM 1619 CA TYR B 211 40.996 42.681 27.144 1.00 0.00 C ATOM 1620 C TYR B 211 42.390 42.196 27.349 1.00 0.00 C ATOM 1621 O TYR B 211 43.354 42.929 27.133 1.00 0.00 O ATOM 1622 CB TYR B 211 40.197 42.789 28.453 1.00 0.00 C ATOM 1623 CG TYR B 211 40.916 43.334 29.638 1.00 0.00 C ATOM 1624 CD1 TYR B 211 41.012 44.687 29.866 1.00 0.00 C ATOM 1625 CD2 TYR B 211 41.466 42.461 30.547 1.00 0.00 C ATOM 1626 CE1 TYR B 211 41.625 45.159 31.003 1.00 0.00 C ATOM 1627 CE2 TYR B 211 42.081 42.926 31.686 1.00 0.00 C ATOM 1628 CZ TYR B 211 42.145 44.279 31.923 1.00 0.00 C ATOM 1629 OH TYR B 211 42.722 44.767 33.115 1.00 0.00 O ATOM 0 H TYR B 211 39.392 41.501 26.661 1.00 0.00 H new ATOM 0 HA TYR B 211 41.118 43.676 26.715 1.00 0.00 H new ATOM 0 HB2 TYR B 211 39.325 43.416 28.267 1.00 0.00 H new ATOM 0 HB3 TYR B 211 39.827 41.796 28.708 1.00 0.00 H new ATOM 0 HD1 TYR B 211 40.604 45.383 29.148 1.00 0.00 H new ATOM 0 HD2 TYR B 211 41.414 41.398 30.364 1.00 0.00 H new ATOM 0 HE1 TYR B 211 41.698 46.223 31.174 1.00 0.00 H new ATOM 0 HE2 TYR B 211 42.512 42.231 32.392 1.00 0.00 H new ATOM 0 HH TYR B 211 43.040 44.015 33.656 1.00 0.00 H new ATOM 1639 N LEU B 212 42.581 40.926 27.750 1.00 0.00 N ATOM 1640 CA LEU B 212 43.867 40.351 27.998 1.00 0.00 C ATOM 1641 C LEU B 212 44.737 40.227 26.794 1.00 0.00 C ATOM 1642 O LEU B 212 45.954 40.396 26.863 1.00 0.00 O ATOM 1643 CB LEU B 212 43.712 39.007 28.729 1.00 0.00 C ATOM 1644 CG LEU B 212 44.086 39.100 30.218 1.00 0.00 C ATOM 1645 CD1 LEU B 212 43.522 37.869 30.948 1.00 0.00 C ATOM 1646 CD2 LEU B 212 45.602 39.244 30.437 1.00 0.00 C ATOM 0 H LEU B 212 41.811 40.276 27.907 1.00 0.00 H new ATOM 0 HA LEU B 212 44.395 41.056 28.640 1.00 0.00 H new ATOM 0 HB2 LEU B 212 42.681 38.664 28.637 1.00 0.00 H new ATOM 0 HB3 LEU B 212 44.341 38.259 28.246 1.00 0.00 H new ATOM 0 HG LEU B 212 43.643 40.005 30.633 1.00 0.00 H new ATOM 0 HD11 LEU B 212 43.781 37.923 32.006 1.00 0.00 H new ATOM 0 HD12 LEU B 212 42.438 37.847 30.840 1.00 0.00 H new ATOM 0 HD13 LEU B 212 43.948 36.963 30.516 1.00 0.00 H new ATOM 0 HD21 LEU B 212 45.811 39.305 31.505 1.00 0.00 H new ATOM 0 HD22 LEU B 212 46.114 38.379 30.016 1.00 0.00 H new ATOM 0 HD23 LEU B 212 45.956 40.150 29.945 1.00 0.00 H new ATOM 1658 N GLU B 213 44.140 39.985 25.615 1.00 0.00 N ATOM 1659 CA GLU B 213 44.762 40.021 24.327 1.00 0.00 C ATOM 1660 C GLU B 213 45.324 41.357 23.982 1.00 0.00 C ATOM 1661 O GLU B 213 46.427 41.473 23.452 1.00 0.00 O ATOM 1662 CB GLU B 213 43.655 39.605 23.344 1.00 0.00 C ATOM 1663 CG GLU B 213 44.053 39.563 21.868 1.00 0.00 C ATOM 1664 CD GLU B 213 44.364 38.162 21.360 1.00 0.00 C ATOM 1665 OE1 GLU B 213 45.437 37.611 21.727 1.00 0.00 O ATOM 1666 OE2 GLU B 213 43.545 37.634 20.561 1.00 0.00 O ATOM 0 H GLU B 213 43.150 39.747 25.558 1.00 0.00 H new ATOM 0 HA GLU B 213 45.624 39.355 24.294 1.00 0.00 H new ATOM 0 HB2 GLU B 213 43.293 38.618 23.631 1.00 0.00 H new ATOM 0 HB3 GLU B 213 42.819 40.295 23.455 1.00 0.00 H new ATOM 0 HG2 GLU B 213 43.246 39.986 21.270 1.00 0.00 H new ATOM 0 HG3 GLU B 213 44.927 40.197 21.718 1.00 0.00 H new ATOM 1673 N ARG B 214 44.597 42.439 24.315 1.00 0.00 N ATOM 1674 CA ARG B 214 45.010 43.803 24.204 1.00 0.00 C ATOM 1675 C ARG B 214 46.111 44.171 25.137 1.00 0.00 C ATOM 1676 O ARG B 214 46.983 44.972 24.800 1.00 0.00 O ATOM 1677 CB ARG B 214 43.760 44.682 24.374 1.00 0.00 C ATOM 1678 CG ARG B 214 43.982 46.127 23.923 1.00 0.00 C ATOM 1679 CD ARG B 214 42.713 46.976 23.832 1.00 0.00 C ATOM 1680 NE ARG B 214 43.135 48.326 23.363 1.00 0.00 N ATOM 1681 CZ ARG B 214 42.907 48.834 22.116 1.00 0.00 C ATOM 1682 NH1 ARG B 214 42.080 48.254 21.199 1.00 0.00 N ATOM 1683 NH2 ARG B 214 43.507 50.007 21.761 1.00 0.00 N ATOM 0 H ARG B 214 43.652 42.352 24.689 1.00 0.00 H new ATOM 0 HA ARG B 214 45.448 43.967 23.219 1.00 0.00 H new ATOM 0 HB2 ARG B 214 42.938 44.251 23.802 1.00 0.00 H new ATOM 0 HB3 ARG B 214 43.458 44.676 25.421 1.00 0.00 H new ATOM 0 HG2 ARG B 214 44.673 46.606 24.616 1.00 0.00 H new ATOM 0 HG3 ARG B 214 44.466 46.117 22.946 1.00 0.00 H new ATOM 0 HD2 ARG B 214 41.998 46.531 23.139 1.00 0.00 H new ATOM 0 HD3 ARG B 214 42.219 47.040 24.802 1.00 0.00 H new ATOM 0 HE ARG B 214 43.634 48.918 24.027 1.00 0.00 H new ATOM 0 HH11 ARG B 214 41.589 47.390 21.429 1.00 0.00 H new ATOM 0 HH12 ARG B 214 41.952 48.685 20.283 1.00 0.00 H new ATOM 0 HH21 ARG B 214 44.115 50.490 22.423 1.00 0.00 H new ATOM 0 HH22 ARG B 214 43.348 50.401 20.834 1.00 0.00 H new ATOM 1697 N ARG B 215 46.178 43.557 26.331 1.00 0.00 N ATOM 1698 CA ARG B 215 47.285 43.663 27.230 1.00 0.00 C ATOM 1699 C ARG B 215 48.546 43.090 26.682 1.00 0.00 C ATOM 1700 O ARG B 215 49.625 43.662 26.832 1.00 0.00 O ATOM 1701 CB ARG B 215 47.021 43.053 28.617 1.00 0.00 C ATOM 1702 CG ARG B 215 45.783 43.611 29.323 1.00 0.00 C ATOM 1703 CD ARG B 215 45.757 43.385 30.836 1.00 0.00 C ATOM 1704 NE ARG B 215 46.760 44.326 31.411 1.00 0.00 N ATOM 1705 CZ ARG B 215 47.728 43.980 32.307 1.00 0.00 C ATOM 1706 NH1 ARG B 215 47.745 42.770 32.941 1.00 0.00 N ATOM 1707 NH2 ARG B 215 48.723 44.872 32.586 1.00 0.00 N ATOM 0 H ARG B 215 45.429 42.962 26.685 1.00 0.00 H new ATOM 0 HA ARG B 215 47.410 44.739 27.349 1.00 0.00 H new ATOM 0 HB2 ARG B 215 46.910 41.974 28.512 1.00 0.00 H new ATOM 0 HB3 ARG B 215 47.893 43.223 29.248 1.00 0.00 H new ATOM 0 HG2 ARG B 215 45.721 44.682 29.128 1.00 0.00 H new ATOM 0 HG3 ARG B 215 44.895 43.155 28.885 1.00 0.00 H new ATOM 0 HD2 ARG B 215 44.764 43.578 31.242 1.00 0.00 H new ATOM 0 HD3 ARG B 215 46.006 42.352 31.080 1.00 0.00 H new ATOM 0 HE ARG B 215 46.719 45.300 31.112 1.00 0.00 H new ATOM 0 HH11 ARG B 215 47.014 42.084 32.751 1.00 0.00 H new ATOM 0 HH12 ARG B 215 48.488 42.552 33.604 1.00 0.00 H new ATOM 0 HH21 ARG B 215 48.735 45.783 32.127 1.00 0.00 H new ATOM 0 HH22 ARG B 215 49.454 44.628 33.254 1.00 0.00 H new