USER MOD reduce.3.24.130724 H: found=0, std=0, add=607, rem=0, adj=14 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 X(o=0,f=0) USER MOD Single : A 9 ASN : amide:sc= 0.575 K(o=0.58,f=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 103:sc= 1.18 USER MOD Single : A 15 ASN : amide:sc= -0.1 K(o=-0.1,f=-2.3) USER MOD Single : A 16 LYS NZ :NH3+ 152:sc= 1.48 (180deg=0.319) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot 72:sc= 1.24 USER MOD Single : A 24 HIS : no HD1:sc= -0.369 X(o=-0.37,f=-0.37) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot -71:sc= 1.26 USER MOD Single : A 36 HIS :FLIP no HD1:sc= -0.954 F(o=-1.9,f=-0.95) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 TYR OH : rot 85:sc= 1.24 USER MOD Single : A 39 GLN : amide:sc= -0.0215 X(o=-0.022,f=-0.048) USER MOD Single : A 54 SER OG : rot -178:sc= 0.673 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.381 X(o=-0.38,f=-0.012) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 201 ASN : amide:sc= -0.0559 X(o=-0.056,f=-0.076) USER MOD Single : B 203 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 204 MET CE :methyl -174:sc= -0.155 (180deg=-0.204) USER MOD Single : B 211 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 52 N VAL A 5 35.032 43.637 40.505 1.00 0.00 N ATOM 53 CA VAL A 5 35.689 42.493 41.057 1.00 0.00 C ATOM 54 C VAL A 5 35.395 41.262 40.269 1.00 0.00 C ATOM 55 O VAL A 5 36.270 40.481 39.904 1.00 0.00 O ATOM 56 CB VAL A 5 35.259 42.308 42.482 1.00 0.00 C ATOM 57 CG1 VAL A 5 35.858 41.025 43.080 1.00 0.00 C ATOM 58 CG2 VAL A 5 35.698 43.554 43.271 1.00 0.00 C ATOM 0 HA VAL A 5 36.765 42.663 41.016 1.00 0.00 H new ATOM 0 HB VAL A 5 34.176 42.197 42.536 1.00 0.00 H new ATOM 0 HG11 VAL A 5 35.529 40.917 44.114 1.00 0.00 H new ATOM 0 HG12 VAL A 5 35.524 40.164 42.501 1.00 0.00 H new ATOM 0 HG13 VAL A 5 36.946 41.083 43.050 1.00 0.00 H new ATOM 0 HG21 VAL A 5 35.398 43.449 44.314 1.00 0.00 H new ATOM 0 HG22 VAL A 5 36.782 43.658 43.214 1.00 0.00 H new ATOM 0 HG23 VAL A 5 35.225 44.439 42.845 1.00 0.00 H new ATOM 68 N GLU A 6 34.112 41.082 39.906 1.00 0.00 N ATOM 69 CA GLU A 6 33.630 40.002 39.103 1.00 0.00 C ATOM 70 C GLU A 6 34.140 40.001 37.702 1.00 0.00 C ATOM 71 O GLU A 6 34.327 38.953 37.087 1.00 0.00 O ATOM 72 CB GLU A 6 32.093 40.035 39.107 1.00 0.00 C ATOM 73 CG GLU A 6 31.515 41.258 38.391 1.00 0.00 C ATOM 74 CD GLU A 6 30.114 41.625 38.859 1.00 0.00 C ATOM 75 OE1 GLU A 6 29.116 40.996 38.418 1.00 0.00 O ATOM 76 OE2 GLU A 6 30.008 42.568 39.689 1.00 0.00 O ATOM 0 H GLU A 6 33.372 41.725 40.188 1.00 0.00 H new ATOM 0 HA GLU A 6 34.010 39.082 39.548 1.00 0.00 H new ATOM 0 HB2 GLU A 6 31.715 39.131 38.630 1.00 0.00 H new ATOM 0 HB3 GLU A 6 31.738 40.024 40.138 1.00 0.00 H new ATOM 0 HG2 GLU A 6 32.178 42.109 38.549 1.00 0.00 H new ATOM 0 HG3 GLU A 6 31.493 41.065 37.318 1.00 0.00 H new ATOM 83 N PHE A 7 34.491 41.192 37.184 1.00 0.00 N ATOM 84 CA PHE A 7 35.118 41.354 35.910 1.00 0.00 C ATOM 85 C PHE A 7 36.521 40.854 35.968 1.00 0.00 C ATOM 86 O PHE A 7 37.011 40.228 35.029 1.00 0.00 O ATOM 87 CB PHE A 7 35.067 42.832 35.489 1.00 0.00 C ATOM 88 CG PHE A 7 35.167 43.034 34.016 1.00 0.00 C ATOM 89 CD1 PHE A 7 36.391 43.070 33.392 1.00 0.00 C ATOM 90 CD2 PHE A 7 34.031 43.244 33.270 1.00 0.00 C ATOM 91 CE1 PHE A 7 36.485 43.341 32.047 1.00 0.00 C ATOM 92 CE2 PHE A 7 34.116 43.509 31.922 1.00 0.00 C ATOM 93 CZ PHE A 7 35.345 43.567 31.311 1.00 0.00 C ATOM 0 H PHE A 7 34.332 42.074 37.671 1.00 0.00 H new ATOM 0 HA PHE A 7 34.583 40.770 35.161 1.00 0.00 H new ATOM 0 HB2 PHE A 7 34.135 43.271 35.846 1.00 0.00 H new ATOM 0 HB3 PHE A 7 35.880 43.369 35.977 1.00 0.00 H new ATOM 0 HD1 PHE A 7 37.288 42.884 33.964 1.00 0.00 H new ATOM 0 HD2 PHE A 7 33.063 43.201 33.746 1.00 0.00 H new ATOM 0 HE1 PHE A 7 37.453 43.376 31.569 1.00 0.00 H new ATOM 0 HE2 PHE A 7 33.217 43.671 31.345 1.00 0.00 H new ATOM 0 HZ PHE A 7 35.416 43.789 30.257 1.00 0.00 H new ATOM 103 N ASN A 8 37.206 41.022 37.112 1.00 0.00 N ATOM 104 CA ASN A 8 38.562 40.623 37.329 1.00 0.00 C ATOM 105 C ASN A 8 38.654 39.167 37.630 1.00 0.00 C ATOM 106 O ASN A 8 39.662 38.528 37.331 1.00 0.00 O ATOM 107 CB ASN A 8 39.218 41.446 38.451 1.00 0.00 C ATOM 108 CG ASN A 8 39.674 42.783 37.887 1.00 0.00 C ATOM 109 OD1 ASN A 8 40.736 42.858 37.270 1.00 0.00 O ATOM 110 ND2 ASN A 8 38.877 43.868 38.082 1.00 0.00 N ATOM 0 H ASN A 8 36.790 41.462 37.933 1.00 0.00 H new ATOM 0 HA ASN A 8 39.107 40.817 36.405 1.00 0.00 H new ATOM 0 HB2 ASN A 8 38.510 41.603 39.265 1.00 0.00 H new ATOM 0 HB3 ASN A 8 40.067 40.904 38.867 1.00 0.00 H new ATOM 0 HD21 ASN A 8 39.154 44.777 37.712 1.00 0.00 H new ATOM 0 HD22 ASN A 8 38.002 43.772 38.598 1.00 0.00 H new ATOM 117 N ASN A 9 37.578 38.553 38.152 1.00 0.00 N ATOM 118 CA ASN A 9 37.423 37.132 38.195 1.00 0.00 C ATOM 119 C ASN A 9 37.251 36.571 36.825 1.00 0.00 C ATOM 120 O ASN A 9 37.763 35.497 36.511 1.00 0.00 O ATOM 121 CB ASN A 9 36.229 36.697 39.062 1.00 0.00 C ATOM 122 CG ASN A 9 36.516 36.715 40.557 1.00 0.00 C ATOM 123 OD1 ASN A 9 36.403 35.682 41.216 1.00 0.00 O ATOM 124 ND2 ASN A 9 36.837 37.894 41.152 1.00 0.00 N ATOM 0 H ASN A 9 36.791 39.061 38.557 1.00 0.00 H new ATOM 0 HA ASN A 9 38.336 36.742 38.645 1.00 0.00 H new ATOM 0 HB2 ASN A 9 35.384 37.354 38.856 1.00 0.00 H new ATOM 0 HB3 ASN A 9 35.929 35.690 38.771 1.00 0.00 H new ATOM 0 HD21 ASN A 9 36.988 37.932 42.160 1.00 0.00 H new ATOM 0 HD22 ASN A 9 36.927 38.741 40.591 1.00 0.00 H new ATOM 131 N ALA A 10 36.567 37.295 35.921 1.00 0.00 N ATOM 132 CA ALA A 10 36.468 36.944 34.538 1.00 0.00 C ATOM 133 C ALA A 10 37.790 37.019 33.858 1.00 0.00 C ATOM 134 O ALA A 10 38.178 36.087 33.154 1.00 0.00 O ATOM 135 CB ALA A 10 35.375 37.768 33.837 1.00 0.00 C ATOM 0 H ALA A 10 36.067 38.151 36.160 1.00 0.00 H new ATOM 0 HA ALA A 10 36.159 35.901 34.470 1.00 0.00 H new ATOM 0 HB1 ALA A 10 35.321 37.481 32.787 1.00 0.00 H new ATOM 0 HB2 ALA A 10 34.414 37.579 34.315 1.00 0.00 H new ATOM 0 HB3 ALA A 10 35.615 38.829 33.912 1.00 0.00 H new ATOM 141 N ILE A 11 38.590 38.071 34.108 1.00 0.00 N ATOM 142 CA ILE A 11 39.940 38.210 33.661 1.00 0.00 C ATOM 143 C ILE A 11 40.825 37.094 34.097 1.00 0.00 C ATOM 144 O ILE A 11 41.480 36.437 33.288 1.00 0.00 O ATOM 145 CB ILE A 11 40.602 39.470 34.135 1.00 0.00 C ATOM 146 CG1 ILE A 11 39.845 40.759 33.777 1.00 0.00 C ATOM 147 CG2 ILE A 11 42.005 39.637 33.527 1.00 0.00 C ATOM 148 CD1 ILE A 11 39.211 40.759 32.387 1.00 0.00 C ATOM 0 H ILE A 11 38.274 38.872 34.655 1.00 0.00 H new ATOM 0 HA ILE A 11 39.833 38.218 32.576 1.00 0.00 H new ATOM 0 HB ILE A 11 40.627 39.347 35.218 1.00 0.00 H new ATOM 0 HG12 ILE A 11 39.063 40.923 34.519 1.00 0.00 H new ATOM 0 HG13 ILE A 11 40.534 41.601 33.848 1.00 0.00 H new ATOM 0 HG21 ILE A 11 42.453 40.561 33.894 1.00 0.00 H new ATOM 0 HG22 ILE A 11 42.630 38.792 33.815 1.00 0.00 H new ATOM 0 HG23 ILE A 11 41.928 39.677 32.440 1.00 0.00 H new ATOM 0 HD11 ILE A 11 38.699 41.707 32.221 1.00 0.00 H new ATOM 0 HD12 ILE A 11 39.987 40.629 31.633 1.00 0.00 H new ATOM 0 HD13 ILE A 11 38.494 39.941 32.314 1.00 0.00 H new ATOM 160 N SER A 12 40.881 36.857 35.420 1.00 0.00 N ATOM 161 CA SER A 12 41.781 35.943 36.050 1.00 0.00 C ATOM 162 C SER A 12 41.645 34.532 35.593 1.00 0.00 C ATOM 163 O SER A 12 42.633 33.805 35.493 1.00 0.00 O ATOM 164 CB SER A 12 41.689 35.976 37.585 1.00 0.00 C ATOM 165 OG SER A 12 42.862 35.433 38.174 1.00 0.00 O ATOM 0 H SER A 12 40.266 37.328 36.084 1.00 0.00 H new ATOM 0 HA SER A 12 42.761 36.302 35.736 1.00 0.00 H new ATOM 0 HB2 SER A 12 41.549 37.003 37.923 1.00 0.00 H new ATOM 0 HB3 SER A 12 40.817 35.411 37.913 1.00 0.00 H new ATOM 0 HG SER A 12 42.783 35.465 39.150 1.00 0.00 H new ATOM 171 N TYR A 13 40.419 34.117 35.231 1.00 0.00 N ATOM 172 CA TYR A 13 40.112 32.874 34.593 1.00 0.00 C ATOM 173 C TYR A 13 40.804 32.729 33.281 1.00 0.00 C ATOM 174 O TYR A 13 41.600 31.810 33.093 1.00 0.00 O ATOM 175 CB TYR A 13 38.582 32.755 34.485 1.00 0.00 C ATOM 176 CG TYR A 13 38.088 31.644 33.626 1.00 0.00 C ATOM 177 CD1 TYR A 13 38.154 30.322 33.998 1.00 0.00 C ATOM 178 CD2 TYR A 13 37.602 31.965 32.380 1.00 0.00 C ATOM 179 CE1 TYR A 13 37.725 29.339 33.137 1.00 0.00 C ATOM 180 CE2 TYR A 13 37.178 30.987 31.511 1.00 0.00 C ATOM 181 CZ TYR A 13 37.236 29.668 31.895 1.00 0.00 C ATOM 182 OH TYR A 13 36.884 28.674 30.957 1.00 0.00 O ATOM 0 H TYR A 13 39.589 34.686 35.394 1.00 0.00 H new ATOM 0 HA TYR A 13 40.488 32.046 35.194 1.00 0.00 H new ATOM 0 HB2 TYR A 13 38.173 32.627 35.487 1.00 0.00 H new ATOM 0 HB3 TYR A 13 38.188 33.694 34.098 1.00 0.00 H new ATOM 0 HD1 TYR A 13 38.544 30.055 34.969 1.00 0.00 H new ATOM 0 HD2 TYR A 13 37.553 33.001 32.079 1.00 0.00 H new ATOM 0 HE1 TYR A 13 37.773 28.303 33.438 1.00 0.00 H new ATOM 0 HE2 TYR A 13 36.802 31.253 30.534 1.00 0.00 H new ATOM 0 HH TYR A 13 35.909 28.574 30.937 1.00 0.00 H new ATOM 192 N VAL A 14 40.565 33.648 32.330 1.00 0.00 N ATOM 193 CA VAL A 14 41.148 33.659 31.024 1.00 0.00 C ATOM 194 C VAL A 14 42.633 33.777 31.077 1.00 0.00 C ATOM 195 O VAL A 14 43.360 33.092 30.361 1.00 0.00 O ATOM 196 CB VAL A 14 40.597 34.781 30.196 1.00 0.00 C ATOM 197 CG1 VAL A 14 40.975 34.584 28.718 1.00 0.00 C ATOM 198 CG2 VAL A 14 39.059 34.777 30.239 1.00 0.00 C ATOM 0 H VAL A 14 39.927 34.429 32.481 1.00 0.00 H new ATOM 0 HA VAL A 14 40.891 32.705 30.563 1.00 0.00 H new ATOM 0 HB VAL A 14 41.005 35.709 30.598 1.00 0.00 H new ATOM 0 HG11 VAL A 14 40.570 35.405 28.126 1.00 0.00 H new ATOM 0 HG12 VAL A 14 42.060 34.567 28.619 1.00 0.00 H new ATOM 0 HG13 VAL A 14 40.563 33.640 28.360 1.00 0.00 H new ATOM 0 HG21 VAL A 14 38.676 35.598 29.633 1.00 0.00 H new ATOM 0 HG22 VAL A 14 38.686 33.831 29.846 1.00 0.00 H new ATOM 0 HG23 VAL A 14 38.723 34.899 31.269 1.00 0.00 H new ATOM 208 N ASN A 15 43.148 34.618 31.992 1.00 0.00 N ATOM 209 CA ASN A 15 44.539 34.685 32.317 1.00 0.00 C ATOM 210 C ASN A 15 45.149 33.399 32.757 1.00 0.00 C ATOM 211 O ASN A 15 46.205 33.009 32.262 1.00 0.00 O ATOM 212 CB ASN A 15 44.770 35.735 33.416 1.00 0.00 C ATOM 213 CG ASN A 15 46.207 36.234 33.476 1.00 0.00 C ATOM 214 OD1 ASN A 15 46.995 36.058 32.547 1.00 0.00 O ATOM 215 ND2 ASN A 15 46.572 36.877 34.617 1.00 0.00 N ATOM 0 H ASN A 15 42.576 35.274 32.524 1.00 0.00 H new ATOM 0 HA ASN A 15 45.032 34.956 31.383 1.00 0.00 H new ATOM 0 HB2 ASN A 15 44.105 36.582 33.246 1.00 0.00 H new ATOM 0 HB3 ASN A 15 44.500 35.307 34.381 1.00 0.00 H new ATOM 0 HD21 ASN A 15 47.523 37.230 34.722 1.00 0.00 H new ATOM 0 HD22 ASN A 15 45.895 37.007 35.368 1.00 0.00 H new ATOM 222 N LYS A 16 44.540 32.648 33.694 1.00 0.00 N ATOM 223 CA LYS A 16 45.012 31.371 34.129 1.00 0.00 C ATOM 224 C LYS A 16 45.099 30.366 33.032 1.00 0.00 C ATOM 225 O LYS A 16 46.067 29.615 32.930 1.00 0.00 O ATOM 226 CB LYS A 16 44.133 30.834 35.270 1.00 0.00 C ATOM 227 CG LYS A 16 44.921 29.936 36.227 1.00 0.00 C ATOM 228 CD LYS A 16 44.055 28.996 37.067 1.00 0.00 C ATOM 229 CE LYS A 16 43.248 29.628 38.203 1.00 0.00 C ATOM 230 NZ LYS A 16 42.180 28.691 38.614 1.00 0.00 N ATOM 0 H LYS A 16 43.685 32.943 34.166 1.00 0.00 H new ATOM 0 HA LYS A 16 46.029 31.528 34.488 1.00 0.00 H new ATOM 0 HB2 LYS A 16 43.708 31.671 35.825 1.00 0.00 H new ATOM 0 HB3 LYS A 16 43.298 30.273 34.851 1.00 0.00 H new ATOM 0 HG2 LYS A 16 45.627 29.340 35.649 1.00 0.00 H new ATOM 0 HG3 LYS A 16 45.508 30.565 36.896 1.00 0.00 H new ATOM 0 HD2 LYS A 16 43.360 28.488 36.399 1.00 0.00 H new ATOM 0 HD3 LYS A 16 44.702 28.231 37.496 1.00 0.00 H new ATOM 0 HE2 LYS A 16 43.899 29.851 39.048 1.00 0.00 H new ATOM 0 HE3 LYS A 16 42.814 30.573 37.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 41.946 28.848 39.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 41.334 28.852 38.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 42.508 27.713 38.485 1.00 0.00 H new ATOM 244 N ILE A 17 44.116 30.365 32.115 1.00 0.00 N ATOM 245 CA ILE A 17 44.076 29.583 30.918 1.00 0.00 C ATOM 246 C ILE A 17 45.186 29.940 29.991 1.00 0.00 C ATOM 247 O ILE A 17 45.943 29.073 29.556 1.00 0.00 O ATOM 248 CB ILE A 17 42.744 29.762 30.253 1.00 0.00 C ATOM 249 CG1 ILE A 17 41.659 29.157 31.159 1.00 0.00 C ATOM 250 CG2 ILE A 17 42.675 29.095 28.869 1.00 0.00 C ATOM 251 CD1 ILE A 17 40.238 29.441 30.676 1.00 0.00 C ATOM 0 H ILE A 17 43.289 30.954 32.218 1.00 0.00 H new ATOM 0 HA ILE A 17 44.209 28.534 31.183 1.00 0.00 H new ATOM 0 HB ILE A 17 42.589 30.830 30.103 1.00 0.00 H new ATOM 0 HG12 ILE A 17 41.806 28.079 31.219 1.00 0.00 H new ATOM 0 HG13 ILE A 17 41.777 29.551 32.168 1.00 0.00 H new ATOM 0 HG21 ILE A 17 41.688 29.257 28.436 1.00 0.00 H new ATOM 0 HG22 ILE A 17 43.433 29.529 28.218 1.00 0.00 H new ATOM 0 HG23 ILE A 17 42.855 28.025 28.972 1.00 0.00 H new ATOM 0 HD11 ILE A 17 39.523 28.986 31.361 1.00 0.00 H new ATOM 0 HD12 ILE A 17 40.073 30.518 30.643 1.00 0.00 H new ATOM 0 HD13 ILE A 17 40.102 29.022 29.679 1.00 0.00 H new ATOM 263 N LYS A 18 45.360 31.236 29.674 1.00 0.00 N ATOM 264 CA LYS A 18 46.393 31.722 28.813 1.00 0.00 C ATOM 265 C LYS A 18 47.760 31.398 29.311 1.00 0.00 C ATOM 266 O LYS A 18 48.645 31.023 28.545 1.00 0.00 O ATOM 267 CB LYS A 18 46.201 33.211 28.480 1.00 0.00 C ATOM 268 CG LYS A 18 47.094 34.273 29.123 1.00 0.00 C ATOM 269 CD LYS A 18 46.819 35.627 28.467 1.00 0.00 C ATOM 270 CE LYS A 18 47.243 36.864 29.260 1.00 0.00 C ATOM 271 NZ LYS A 18 48.708 36.931 29.455 1.00 0.00 N ATOM 0 H LYS A 18 44.756 31.975 30.033 1.00 0.00 H new ATOM 0 HA LYS A 18 46.301 31.183 27.870 1.00 0.00 H new ATOM 0 HB2 LYS A 18 46.305 33.315 27.400 1.00 0.00 H new ATOM 0 HB3 LYS A 18 45.170 33.465 28.727 1.00 0.00 H new ATOM 0 HG2 LYS A 18 46.900 34.328 30.194 1.00 0.00 H new ATOM 0 HG3 LYS A 18 48.143 34.004 29.003 1.00 0.00 H new ATOM 0 HD2 LYS A 18 47.326 35.649 27.502 1.00 0.00 H new ATOM 0 HD3 LYS A 18 45.750 35.699 28.267 1.00 0.00 H new ATOM 0 HE2 LYS A 18 46.907 37.760 28.738 1.00 0.00 H new ATOM 0 HE3 LYS A 18 46.749 36.857 30.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 48.947 37.786 29.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 49.028 36.090 29.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 49.180 36.965 28.529 1.00 0.00 H new ATOM 285 N THR A 19 47.965 31.466 30.639 1.00 0.00 N ATOM 286 CA THR A 19 49.205 31.159 31.280 1.00 0.00 C ATOM 287 C THR A 19 49.488 29.699 31.372 1.00 0.00 C ATOM 288 O THR A 19 50.637 29.285 31.222 1.00 0.00 O ATOM 289 CB THR A 19 49.283 31.764 32.651 1.00 0.00 C ATOM 290 OG1 THR A 19 48.828 33.109 32.670 1.00 0.00 O ATOM 291 CG2 THR A 19 50.757 31.849 33.083 1.00 0.00 C ATOM 0 H THR A 19 47.235 31.747 31.293 1.00 0.00 H new ATOM 0 HA THR A 19 49.967 31.600 30.638 1.00 0.00 H new ATOM 0 HB THR A 19 48.670 31.137 33.299 1.00 0.00 H new ATOM 0 HG1 THR A 19 47.853 33.126 32.569 1.00 0.00 H new ATOM 0 HG21 THR A 19 50.820 32.288 34.079 1.00 0.00 H new ATOM 0 HG22 THR A 19 51.190 30.849 33.100 1.00 0.00 H new ATOM 0 HG23 THR A 19 51.308 32.471 32.377 1.00 0.00 H new ATOM 299 N ARG A 20 48.510 28.808 31.612 1.00 0.00 N ATOM 300 CA ARG A 20 48.775 27.403 31.588 1.00 0.00 C ATOM 301 C ARG A 20 48.940 26.839 30.219 1.00 0.00 C ATOM 302 O ARG A 20 49.831 26.028 29.972 1.00 0.00 O ATOM 303 CB ARG A 20 47.687 26.604 32.322 1.00 0.00 C ATOM 304 CG ARG A 20 47.618 26.797 33.839 1.00 0.00 C ATOM 305 CD ARG A 20 48.903 26.436 34.587 1.00 0.00 C ATOM 306 NE ARG A 20 48.526 25.917 35.931 1.00 0.00 N ATOM 307 CZ ARG A 20 48.846 26.484 37.131 1.00 0.00 C ATOM 308 NH1 ARG A 20 49.348 27.749 37.242 1.00 0.00 N ATOM 309 NH2 ARG A 20 48.661 25.766 38.277 1.00 0.00 N ATOM 0 H ARG A 20 47.543 29.057 31.821 1.00 0.00 H new ATOM 0 HA ARG A 20 49.729 27.301 32.105 1.00 0.00 H new ATOM 0 HB2 ARG A 20 46.719 26.872 31.898 1.00 0.00 H new ATOM 0 HB3 ARG A 20 47.842 25.545 32.118 1.00 0.00 H new ATOM 0 HG2 ARG A 20 47.372 27.838 34.049 1.00 0.00 H new ATOM 0 HG3 ARG A 20 46.802 26.191 34.232 1.00 0.00 H new ATOM 0 HD2 ARG A 20 49.467 25.685 34.034 1.00 0.00 H new ATOM 0 HD3 ARG A 20 49.546 27.311 34.683 1.00 0.00 H new ATOM 0 HE ARG A 20 47.977 25.058 35.957 1.00 0.00 H new ATOM 0 HH11 ARG A 20 49.499 28.313 36.406 1.00 0.00 H new ATOM 0 HH12 ARG A 20 49.572 28.130 38.161 1.00 0.00 H new ATOM 0 HH21 ARG A 20 48.288 24.818 38.230 1.00 0.00 H new ATOM 0 HH22 ARG A 20 48.896 26.178 39.180 1.00 0.00 H new ATOM 323 N PHE A 21 48.102 27.237 29.246 1.00 0.00 N ATOM 324 CA PHE A 21 48.104 26.663 27.936 1.00 0.00 C ATOM 325 C PHE A 21 49.020 27.346 26.980 1.00 0.00 C ATOM 326 O PHE A 21 48.722 27.523 25.800 1.00 0.00 O ATOM 327 CB PHE A 21 46.684 26.536 27.360 1.00 0.00 C ATOM 328 CG PHE A 21 45.862 25.628 28.210 1.00 0.00 C ATOM 329 CD1 PHE A 21 46.171 24.295 28.359 1.00 0.00 C ATOM 330 CD2 PHE A 21 44.746 26.120 28.843 1.00 0.00 C ATOM 331 CE1 PHE A 21 45.378 23.470 29.120 1.00 0.00 C ATOM 332 CE2 PHE A 21 43.935 25.305 29.598 1.00 0.00 C ATOM 333 CZ PHE A 21 44.258 23.976 29.735 1.00 0.00 C ATOM 0 H PHE A 21 47.408 27.974 29.372 1.00 0.00 H new ATOM 0 HA PHE A 21 48.505 25.658 28.066 1.00 0.00 H new ATOM 0 HB2 PHE A 21 46.216 27.519 27.307 1.00 0.00 H new ATOM 0 HB3 PHE A 21 46.730 26.150 26.342 1.00 0.00 H new ATOM 0 HD1 PHE A 21 47.047 23.893 27.872 1.00 0.00 H new ATOM 0 HD2 PHE A 21 44.501 27.167 28.746 1.00 0.00 H new ATOM 0 HE1 PHE A 21 45.634 22.427 29.234 1.00 0.00 H new ATOM 0 HE2 PHE A 21 43.054 25.705 30.078 1.00 0.00 H new ATOM 0 HZ PHE A 21 43.630 23.328 30.328 1.00 0.00 H new ATOM 343 N LEU A 22 50.243 27.658 27.442 1.00 0.00 N ATOM 344 CA LEU A 22 51.336 28.121 26.644 1.00 0.00 C ATOM 345 C LEU A 22 51.965 26.983 25.915 1.00 0.00 C ATOM 346 O LEU A 22 52.455 27.108 24.794 1.00 0.00 O ATOM 347 CB LEU A 22 52.414 28.839 27.473 1.00 0.00 C ATOM 348 CG LEU A 22 51.860 30.081 28.192 1.00 0.00 C ATOM 349 CD1 LEU A 22 52.923 30.569 29.191 1.00 0.00 C ATOM 350 CD2 LEU A 22 51.448 31.236 27.264 1.00 0.00 C ATOM 0 H LEU A 22 50.483 27.583 28.430 1.00 0.00 H new ATOM 0 HA LEU A 22 50.920 28.840 25.939 1.00 0.00 H new ATOM 0 HB2 LEU A 22 52.825 28.148 28.209 1.00 0.00 H new ATOM 0 HB3 LEU A 22 53.235 29.135 26.820 1.00 0.00 H new ATOM 0 HG LEU A 22 50.939 29.774 28.688 1.00 0.00 H new ATOM 0 HD11 LEU A 22 52.553 31.451 29.714 1.00 0.00 H new ATOM 0 HD12 LEU A 22 53.133 29.780 29.913 1.00 0.00 H new ATOM 0 HD13 LEU A 22 53.837 30.823 28.654 1.00 0.00 H new ATOM 0 HD21 LEU A 22 51.070 32.066 27.861 1.00 0.00 H new ATOM 0 HD22 LEU A 22 52.313 31.567 26.689 1.00 0.00 H new ATOM 0 HD23 LEU A 22 50.668 30.895 26.583 1.00 0.00 H new ATOM 362 N ASP A 23 51.931 25.793 26.540 1.00 0.00 N ATOM 363 CA ASP A 23 52.334 24.570 25.917 1.00 0.00 C ATOM 364 C ASP A 23 51.270 23.990 25.049 1.00 0.00 C ATOM 365 O ASP A 23 51.504 22.996 24.363 1.00 0.00 O ATOM 366 CB ASP A 23 52.792 23.540 26.962 1.00 0.00 C ATOM 367 CG ASP A 23 54.174 23.900 27.489 1.00 0.00 C ATOM 368 OD1 ASP A 23 55.146 23.822 26.693 1.00 0.00 O ATOM 369 OD2 ASP A 23 54.304 24.228 28.699 1.00 0.00 O ATOM 0 H ASP A 23 51.615 25.678 27.503 1.00 0.00 H new ATOM 0 HA ASP A 23 53.178 24.817 25.272 1.00 0.00 H new ATOM 0 HB2 ASP A 23 52.079 23.506 27.786 1.00 0.00 H new ATOM 0 HB3 ASP A 23 52.813 22.545 26.517 1.00 0.00 H new ATOM 374 N HIS A 24 50.065 24.584 24.991 1.00 0.00 N ATOM 375 CA HIS A 24 49.055 24.161 24.071 1.00 0.00 C ATOM 376 C HIS A 24 48.275 25.306 23.524 1.00 0.00 C ATOM 377 O HIS A 24 47.112 25.438 23.903 1.00 0.00 O ATOM 378 CB HIS A 24 48.129 23.127 24.734 1.00 0.00 C ATOM 379 CG HIS A 24 48.839 21.851 25.074 1.00 0.00 C ATOM 380 ND1 HIS A 24 49.190 20.931 24.121 1.00 0.00 N ATOM 381 CD2 HIS A 24 49.342 21.402 26.254 1.00 0.00 C ATOM 382 CE1 HIS A 24 49.885 19.965 24.692 1.00 0.00 C ATOM 383 NE2 HIS A 24 49.990 20.225 25.982 1.00 0.00 N ATOM 0 H HIS A 24 49.788 25.364 25.587 1.00 0.00 H new ATOM 0 HA HIS A 24 49.557 23.692 23.225 1.00 0.00 H new ATOM 0 HB2 HIS A 24 47.704 23.555 25.642 1.00 0.00 H new ATOM 0 HB3 HIS A 24 47.297 22.908 24.065 1.00 0.00 H new ATOM 0 HD2 HIS A 24 49.249 21.879 27.218 1.00 0.00 H new ATOM 0 HE1 HIS A 24 50.299 19.105 24.187 1.00 0.00 H new ATOM 0 HE2 HIS A 24 50.475 19.644 26.666 1.00 0.00 H new ATOM 392 N PRO A 25 48.749 26.137 22.643 1.00 0.00 N ATOM 393 CA PRO A 25 48.044 27.316 22.232 1.00 0.00 C ATOM 394 C PRO A 25 46.805 27.086 21.435 1.00 0.00 C ATOM 395 O PRO A 25 46.023 28.016 21.242 1.00 0.00 O ATOM 396 CB PRO A 25 49.044 28.109 21.395 1.00 0.00 C ATOM 397 CG PRO A 25 50.410 27.674 21.947 1.00 0.00 C ATOM 398 CD PRO A 25 50.143 26.187 22.231 1.00 0.00 C ATOM 0 HA PRO A 25 47.689 27.829 23.126 1.00 0.00 H new ATOM 0 HB2 PRO A 25 48.949 27.878 20.334 1.00 0.00 H new ATOM 0 HB3 PRO A 25 48.893 29.183 21.502 1.00 0.00 H new ATOM 0 HG2 PRO A 25 51.213 27.819 21.225 1.00 0.00 H new ATOM 0 HG3 PRO A 25 50.687 28.224 22.847 1.00 0.00 H new ATOM 0 HD2 PRO A 25 50.317 25.577 21.345 1.00 0.00 H new ATOM 0 HD3 PRO A 25 50.801 25.808 23.013 1.00 0.00 H new ATOM 406 N GLU A 26 46.551 25.860 20.944 1.00 0.00 N ATOM 407 CA GLU A 26 45.314 25.491 20.328 1.00 0.00 C ATOM 408 C GLU A 26 44.172 25.459 21.285 1.00 0.00 C ATOM 409 O GLU A 26 43.013 25.589 20.895 1.00 0.00 O ATOM 410 CB GLU A 26 45.464 24.176 19.544 1.00 0.00 C ATOM 411 CG GLU A 26 45.704 22.922 20.387 1.00 0.00 C ATOM 412 CD GLU A 26 46.170 21.737 19.552 1.00 0.00 C ATOM 413 OE1 GLU A 26 47.365 21.739 19.151 1.00 0.00 O ATOM 414 OE2 GLU A 26 45.373 20.787 19.337 1.00 0.00 O ATOM 0 H GLU A 26 47.230 25.099 20.977 1.00 0.00 H new ATOM 0 HA GLU A 26 45.065 26.276 19.613 1.00 0.00 H new ATOM 0 HB2 GLU A 26 44.563 24.024 18.950 1.00 0.00 H new ATOM 0 HB3 GLU A 26 46.293 24.285 18.844 1.00 0.00 H new ATOM 0 HG2 GLU A 26 46.450 23.139 21.151 1.00 0.00 H new ATOM 0 HG3 GLU A 26 44.784 22.656 20.907 1.00 0.00 H new ATOM 421 N ILE A 27 44.446 25.365 22.598 1.00 0.00 N ATOM 422 CA ILE A 27 43.490 25.328 23.662 1.00 0.00 C ATOM 423 C ILE A 27 42.939 26.699 23.846 1.00 0.00 C ATOM 424 O ILE A 27 41.727 26.892 23.931 1.00 0.00 O ATOM 425 CB ILE A 27 44.088 24.813 24.937 1.00 0.00 C ATOM 426 CG1 ILE A 27 44.463 23.322 24.993 1.00 0.00 C ATOM 427 CG2 ILE A 27 43.059 24.927 26.074 1.00 0.00 C ATOM 428 CD1 ILE A 27 44.631 22.625 23.644 1.00 0.00 C ATOM 0 H ILE A 27 45.405 25.311 22.940 1.00 0.00 H new ATOM 0 HA ILE A 27 42.690 24.636 23.398 1.00 0.00 H new ATOM 0 HB ILE A 27 44.991 25.418 25.019 1.00 0.00 H new ATOM 0 HG12 ILE A 27 45.395 23.222 25.550 1.00 0.00 H new ATOM 0 HG13 ILE A 27 43.695 22.795 25.559 1.00 0.00 H new ATOM 0 HG21 ILE A 27 43.496 24.552 26.999 1.00 0.00 H new ATOM 0 HG22 ILE A 27 42.775 25.971 26.204 1.00 0.00 H new ATOM 0 HG23 ILE A 27 42.176 24.339 25.826 1.00 0.00 H new ATOM 0 HD11 ILE A 27 44.895 21.580 23.805 1.00 0.00 H new ATOM 0 HD12 ILE A 27 43.696 22.682 23.086 1.00 0.00 H new ATOM 0 HD13 ILE A 27 45.422 23.116 23.077 1.00 0.00 H new ATOM 440 N TYR A 28 43.807 27.727 23.851 1.00 0.00 N ATOM 441 CA TYR A 28 43.431 29.104 23.945 1.00 0.00 C ATOM 442 C TYR A 28 42.541 29.518 22.824 1.00 0.00 C ATOM 443 O TYR A 28 41.449 30.042 23.044 1.00 0.00 O ATOM 444 CB TYR A 28 44.675 30.003 24.054 1.00 0.00 C ATOM 445 CG TYR A 28 44.335 31.378 24.518 1.00 0.00 C ATOM 446 CD1 TYR A 28 43.922 31.587 25.813 1.00 0.00 C ATOM 447 CD2 TYR A 28 44.445 32.455 23.670 1.00 0.00 C ATOM 448 CE1 TYR A 28 43.623 32.854 26.259 1.00 0.00 C ATOM 449 CE2 TYR A 28 44.149 33.726 24.106 1.00 0.00 C ATOM 450 CZ TYR A 28 43.743 33.924 25.404 1.00 0.00 C ATOM 451 OH TYR A 28 43.461 35.224 25.876 1.00 0.00 O ATOM 0 H TYR A 28 44.816 27.592 23.787 1.00 0.00 H new ATOM 0 HA TYR A 28 42.851 29.227 24.860 1.00 0.00 H new ATOM 0 HB2 TYR A 28 45.387 29.553 24.746 1.00 0.00 H new ATOM 0 HB3 TYR A 28 45.167 30.060 23.083 1.00 0.00 H new ATOM 0 HD1 TYR A 28 43.831 30.748 26.487 1.00 0.00 H new ATOM 0 HD2 TYR A 28 44.767 32.302 22.651 1.00 0.00 H new ATOM 0 HE1 TYR A 28 43.295 33.007 27.277 1.00 0.00 H new ATOM 0 HE2 TYR A 28 44.235 34.565 23.431 1.00 0.00 H new ATOM 0 HH TYR A 28 43.593 35.871 25.152 1.00 0.00 H new ATOM 461 N ARG A 29 42.933 29.224 21.573 1.00 0.00 N ATOM 462 CA ARG A 29 42.153 29.457 20.396 1.00 0.00 C ATOM 463 C ARG A 29 40.809 28.814 20.406 1.00 0.00 C ATOM 464 O ARG A 29 39.801 29.451 20.105 1.00 0.00 O ATOM 465 CB ARG A 29 42.985 29.009 19.183 1.00 0.00 C ATOM 466 CG ARG A 29 42.753 29.788 17.887 1.00 0.00 C ATOM 467 CD ARG A 29 41.476 29.462 17.112 1.00 0.00 C ATOM 468 NE ARG A 29 41.502 30.239 15.841 1.00 0.00 N ATOM 469 CZ ARG A 29 40.408 30.858 15.307 1.00 0.00 C ATOM 470 NH1 ARG A 29 39.144 30.646 15.776 1.00 0.00 N ATOM 471 NH2 ARG A 29 40.533 31.687 14.230 1.00 0.00 N ATOM 0 H ARG A 29 43.840 28.802 21.371 1.00 0.00 H new ATOM 0 HA ARG A 29 41.931 30.523 20.348 1.00 0.00 H new ATOM 0 HB2 ARG A 29 44.041 29.083 19.444 1.00 0.00 H new ATOM 0 HB3 ARG A 29 42.777 27.956 18.993 1.00 0.00 H new ATOM 0 HG2 ARG A 29 42.745 30.852 18.126 1.00 0.00 H new ATOM 0 HG3 ARG A 29 43.605 29.616 17.229 1.00 0.00 H new ATOM 0 HD2 ARG A 29 41.417 28.393 16.905 1.00 0.00 H new ATOM 0 HD3 ARG A 29 40.596 29.722 17.700 1.00 0.00 H new ATOM 0 HE ARG A 29 42.388 30.313 15.341 1.00 0.00 H new ATOM 0 HH11 ARG A 29 38.990 30.005 16.554 1.00 0.00 H new ATOM 0 HH12 ARG A 29 38.354 31.129 15.348 1.00 0.00 H new ATOM 0 HH21 ARG A 29 41.451 31.850 13.815 1.00 0.00 H new ATOM 0 HH22 ARG A 29 39.709 32.144 13.840 1.00 0.00 H new ATOM 485 N SER A 30 40.727 27.512 20.733 1.00 0.00 N ATOM 486 CA SER A 30 39.523 26.748 20.633 1.00 0.00 C ATOM 487 C SER A 30 38.556 26.925 21.752 1.00 0.00 C ATOM 488 O SER A 30 37.350 26.834 21.529 1.00 0.00 O ATOM 489 CB SER A 30 39.747 25.258 20.327 1.00 0.00 C ATOM 490 OG SER A 30 40.530 24.606 21.315 1.00 0.00 O ATOM 0 H SER A 30 41.523 26.975 21.077 1.00 0.00 H new ATOM 0 HA SER A 30 39.047 27.192 19.759 1.00 0.00 H new ATOM 0 HB2 SER A 30 38.781 24.759 20.247 1.00 0.00 H new ATOM 0 HB3 SER A 30 40.237 25.160 19.358 1.00 0.00 H new ATOM 0 HG SER A 30 41.459 24.913 21.252 1.00 0.00 H new ATOM 496 N PHE A 31 38.992 27.223 22.988 1.00 0.00 N ATOM 497 CA PHE A 31 38.069 27.440 24.059 1.00 0.00 C ATOM 498 C PHE A 31 37.190 28.629 23.876 1.00 0.00 C ATOM 499 O PHE A 31 35.991 28.589 24.151 1.00 0.00 O ATOM 500 CB PHE A 31 38.726 27.325 25.445 1.00 0.00 C ATOM 501 CG PHE A 31 38.825 28.568 26.261 1.00 0.00 C ATOM 502 CD1 PHE A 31 39.916 29.398 26.152 1.00 0.00 C ATOM 503 CD2 PHE A 31 37.814 28.894 27.134 1.00 0.00 C ATOM 504 CE1 PHE A 31 39.988 30.552 26.896 1.00 0.00 C ATOM 505 CE2 PHE A 31 37.886 30.045 27.883 1.00 0.00 C ATOM 506 CZ PHE A 31 38.975 30.876 27.768 1.00 0.00 C ATOM 0 H PHE A 31 39.975 27.313 23.246 1.00 0.00 H new ATOM 0 HA PHE A 31 37.366 26.608 24.016 1.00 0.00 H new ATOM 0 HB2 PHE A 31 38.169 26.587 26.022 1.00 0.00 H new ATOM 0 HB3 PHE A 31 39.733 26.930 25.309 1.00 0.00 H new ATOM 0 HD1 PHE A 31 40.721 29.142 25.478 1.00 0.00 H new ATOM 0 HD2 PHE A 31 36.958 28.242 27.232 1.00 0.00 H new ATOM 0 HE1 PHE A 31 40.842 31.205 26.795 1.00 0.00 H new ATOM 0 HE2 PHE A 31 37.085 30.297 28.563 1.00 0.00 H new ATOM 0 HZ PHE A 31 39.035 31.778 28.359 1.00 0.00 H new ATOM 516 N LEU A 32 37.734 29.738 23.345 1.00 0.00 N ATOM 517 CA LEU A 32 36.988 30.922 23.052 1.00 0.00 C ATOM 518 C LEU A 32 36.075 30.724 21.892 1.00 0.00 C ATOM 519 O LEU A 32 34.969 31.261 21.842 1.00 0.00 O ATOM 520 CB LEU A 32 37.854 32.115 22.614 1.00 0.00 C ATOM 521 CG LEU A 32 39.143 32.288 23.434 1.00 0.00 C ATOM 522 CD1 LEU A 32 40.169 33.066 22.593 1.00 0.00 C ATOM 523 CD2 LEU A 32 38.844 32.911 24.807 1.00 0.00 C ATOM 0 H LEU A 32 38.724 29.813 23.112 1.00 0.00 H new ATOM 0 HA LEU A 32 36.472 31.125 23.991 1.00 0.00 H new ATOM 0 HB2 LEU A 32 38.118 31.993 21.564 1.00 0.00 H new ATOM 0 HB3 LEU A 32 37.262 33.027 22.690 1.00 0.00 H new ATOM 0 HG LEU A 32 39.587 31.319 23.661 1.00 0.00 H new ATOM 0 HD11 LEU A 32 41.087 33.194 23.166 1.00 0.00 H new ATOM 0 HD12 LEU A 32 40.386 32.512 21.680 1.00 0.00 H new ATOM 0 HD13 LEU A 32 39.762 34.044 22.336 1.00 0.00 H new ATOM 0 HD21 LEU A 32 39.773 33.022 25.366 1.00 0.00 H new ATOM 0 HD22 LEU A 32 38.384 33.889 24.670 1.00 0.00 H new ATOM 0 HD23 LEU A 32 38.163 32.264 25.360 1.00 0.00 H new ATOM 535 N GLU A 33 36.530 29.950 20.892 1.00 0.00 N ATOM 536 CA GLU A 33 35.724 29.437 19.827 1.00 0.00 C ATOM 537 C GLU A 33 34.438 28.813 20.245 1.00 0.00 C ATOM 538 O GLU A 33 33.380 29.101 19.685 1.00 0.00 O ATOM 539 CB GLU A 33 36.562 28.508 18.934 1.00 0.00 C ATOM 540 CG GLU A 33 36.283 28.695 17.441 1.00 0.00 C ATOM 541 CD GLU A 33 37.164 27.819 16.561 1.00 0.00 C ATOM 542 OE1 GLU A 33 38.366 28.145 16.370 1.00 0.00 O ATOM 543 OE2 GLU A 33 36.658 26.797 16.025 1.00 0.00 O ATOM 0 H GLU A 33 37.508 29.668 20.822 1.00 0.00 H new ATOM 0 HA GLU A 33 35.405 30.304 19.248 1.00 0.00 H new ATOM 0 HB2 GLU A 33 37.620 28.688 19.125 1.00 0.00 H new ATOM 0 HB3 GLU A 33 36.361 27.472 19.208 1.00 0.00 H new ATOM 0 HG2 GLU A 33 35.236 28.467 17.240 1.00 0.00 H new ATOM 0 HG3 GLU A 33 36.438 29.741 17.175 1.00 0.00 H new ATOM 550 N ILE A 34 34.444 27.998 21.315 1.00 0.00 N ATOM 551 CA ILE A 34 33.310 27.446 21.988 1.00 0.00 C ATOM 552 C ILE A 34 32.534 28.471 22.742 1.00 0.00 C ATOM 553 O ILE A 34 31.307 28.498 22.658 1.00 0.00 O ATOM 554 CB ILE A 34 33.738 26.290 22.843 1.00 0.00 C ATOM 555 CG1 ILE A 34 34.421 25.187 22.016 1.00 0.00 C ATOM 556 CG2 ILE A 34 32.541 25.693 23.601 1.00 0.00 C ATOM 557 CD1 ILE A 34 35.244 24.212 22.856 1.00 0.00 C ATOM 0 H ILE A 34 35.320 27.701 21.745 1.00 0.00 H new ATOM 0 HA ILE A 34 32.617 27.069 21.236 1.00 0.00 H new ATOM 0 HB ILE A 34 34.461 26.680 23.559 1.00 0.00 H new ATOM 0 HG12 ILE A 34 33.660 24.630 21.470 1.00 0.00 H new ATOM 0 HG13 ILE A 34 35.070 25.651 21.273 1.00 0.00 H new ATOM 0 HG21 ILE A 34 32.878 24.857 24.213 1.00 0.00 H new ATOM 0 HG22 ILE A 34 32.098 26.456 24.241 1.00 0.00 H new ATOM 0 HG23 ILE A 34 31.796 25.342 22.887 1.00 0.00 H new ATOM 0 HD11 ILE A 34 35.696 23.463 22.206 1.00 0.00 H new ATOM 0 HD12 ILE A 34 36.028 24.757 23.381 1.00 0.00 H new ATOM 0 HD13 ILE A 34 34.596 23.720 23.581 1.00 0.00 H new ATOM 569 N LEU A 35 33.127 29.429 23.475 1.00 0.00 N ATOM 570 CA LEU A 35 32.398 30.509 24.065 1.00 0.00 C ATOM 571 C LEU A 35 31.719 31.394 23.077 1.00 0.00 C ATOM 572 O LEU A 35 30.652 31.954 23.322 1.00 0.00 O ATOM 573 CB LEU A 35 33.388 31.396 24.839 1.00 0.00 C ATOM 574 CG LEU A 35 34.106 30.743 26.032 1.00 0.00 C ATOM 575 CD1 LEU A 35 33.890 31.666 27.244 1.00 0.00 C ATOM 576 CD2 LEU A 35 33.579 29.400 26.565 1.00 0.00 C ATOM 0 H LEU A 35 34.129 29.455 23.662 1.00 0.00 H new ATOM 0 HA LEU A 35 31.633 30.053 24.693 1.00 0.00 H new ATOM 0 HB2 LEU A 35 34.144 31.754 24.140 1.00 0.00 H new ATOM 0 HB3 LEU A 35 32.850 32.271 25.202 1.00 0.00 H new ATOM 0 HG LEU A 35 35.115 30.582 25.651 1.00 0.00 H new ATOM 0 HD11 LEU A 35 34.384 31.241 28.118 1.00 0.00 H new ATOM 0 HD12 LEU A 35 34.310 32.649 27.032 1.00 0.00 H new ATOM 0 HD13 LEU A 35 32.823 31.763 27.442 1.00 0.00 H new ATOM 0 HD21 LEU A 35 34.193 29.075 27.405 1.00 0.00 H new ATOM 0 HD22 LEU A 35 32.547 29.519 26.895 1.00 0.00 H new ATOM 0 HD23 LEU A 35 33.622 28.652 25.773 1.00 0.00 H new ATOM 588 N HIS A 36 32.303 31.551 21.875 1.00 0.00 N ATOM 589 CA HIS A 36 31.728 32.233 20.759 1.00 0.00 C ATOM 590 C HIS A 36 30.514 31.543 20.239 1.00 0.00 C ATOM 591 O HIS A 36 29.537 32.231 19.945 1.00 0.00 O ATOM 592 CB HIS A 36 32.708 32.493 19.602 1.00 0.00 C ATOM 593 CG HIS A 36 33.767 33.503 19.931 1.00 0.00 C ATOM 594 ND1 HIS A 36 35.122 33.392 19.989 1.00 0.00 N flip ATOM 595 CD2 HIS A 36 33.469 34.806 20.230 1.00 0.00 C flip ATOM 596 CE1 HIS A 36 35.602 34.629 20.329 1.00 0.00 C flip ATOM 597 NE2 HIS A 36 34.590 35.466 20.458 1.00 0.00 N flip ATOM 0 H HIS A 36 33.231 31.179 21.672 1.00 0.00 H new ATOM 0 HA HIS A 36 31.445 33.205 21.162 1.00 0.00 H new ATOM 0 HB2 HIS A 36 33.186 31.554 19.324 1.00 0.00 H new ATOM 0 HB3 HIS A 36 32.148 32.836 18.732 1.00 0.00 H new ATOM 0 HD2 HIS A 36 32.475 35.227 20.273 1.00 0.00 H new ATOM 0 HE1 HIS A 36 36.643 34.879 20.469 1.00 0.00 H new ATOM 0 HE2 HIS A 36 34.661 36.456 20.694 1.00 0.00 H new ATOM 606 N THR A 37 30.450 30.201 20.172 1.00 0.00 N ATOM 607 CA THR A 37 29.278 29.443 19.858 1.00 0.00 C ATOM 608 C THR A 37 28.077 29.858 20.637 1.00 0.00 C ATOM 609 O THR A 37 26.991 30.031 20.086 1.00 0.00 O ATOM 610 CB THR A 37 29.531 27.973 20.014 1.00 0.00 C ATOM 611 OG1 THR A 37 30.331 27.510 18.937 1.00 0.00 O ATOM 612 CG2 THR A 37 28.268 27.097 20.058 1.00 0.00 C ATOM 0 H THR A 37 31.264 29.611 20.347 1.00 0.00 H new ATOM 0 HA THR A 37 29.053 29.655 18.813 1.00 0.00 H new ATOM 0 HB THR A 37 30.025 27.875 20.981 1.00 0.00 H new ATOM 0 HG1 THR A 37 30.497 26.550 19.042 1.00 0.00 H new ATOM 0 HG21 THR A 37 28.554 26.051 20.173 1.00 0.00 H new ATOM 0 HG22 THR A 37 27.646 27.397 20.901 1.00 0.00 H new ATOM 0 HG23 THR A 37 27.707 27.220 19.131 1.00 0.00 H new ATOM 620 N TYR A 38 28.253 30.131 21.942 1.00 0.00 N ATOM 621 CA TYR A 38 27.262 30.749 22.768 1.00 0.00 C ATOM 622 C TYR A 38 27.004 32.170 22.399 1.00 0.00 C ATOM 623 O TYR A 38 25.906 32.557 22.004 1.00 0.00 O ATOM 624 CB TYR A 38 27.766 30.671 24.218 1.00 0.00 C ATOM 625 CG TYR A 38 26.878 31.166 25.308 1.00 0.00 C ATOM 626 CD1 TYR A 38 25.562 31.530 25.146 1.00 0.00 C ATOM 627 CD2 TYR A 38 27.470 31.312 26.540 1.00 0.00 C ATOM 628 CE1 TYR A 38 24.866 32.101 26.185 1.00 0.00 C ATOM 629 CE2 TYR A 38 26.785 31.902 27.576 1.00 0.00 C ATOM 630 CZ TYR A 38 25.487 32.316 27.393 1.00 0.00 C ATOM 631 OH TYR A 38 24.825 33.021 28.421 1.00 0.00 O ATOM 0 H TYR A 38 29.116 29.914 22.440 1.00 0.00 H new ATOM 0 HA TYR A 38 26.316 30.224 22.636 1.00 0.00 H new ATOM 0 HB2 TYR A 38 28.002 29.628 24.431 1.00 0.00 H new ATOM 0 HB3 TYR A 38 28.701 31.228 24.274 1.00 0.00 H new ATOM 0 HD1 TYR A 38 25.072 31.366 24.197 1.00 0.00 H new ATOM 0 HD2 TYR A 38 28.480 30.961 26.695 1.00 0.00 H new ATOM 0 HE1 TYR A 38 23.831 32.381 26.052 1.00 0.00 H new ATOM 0 HE2 TYR A 38 27.266 32.040 28.533 1.00 0.00 H new ATOM 0 HH TYR A 38 24.265 32.402 28.934 1.00 0.00 H new ATOM 641 N GLN A 39 28.030 33.029 22.536 1.00 0.00 N ATOM 642 CA GLN A 39 27.814 34.438 22.657 1.00 0.00 C ATOM 643 C GLN A 39 27.545 35.142 21.371 1.00 0.00 C ATOM 644 O GLN A 39 26.935 36.209 21.362 1.00 0.00 O ATOM 645 CB GLN A 39 28.993 35.051 23.432 1.00 0.00 C ATOM 646 CG GLN A 39 28.629 35.883 24.664 1.00 0.00 C ATOM 647 CD GLN A 39 27.557 36.951 24.497 1.00 0.00 C ATOM 648 OE1 GLN A 39 26.380 36.698 24.752 1.00 0.00 O ATOM 649 NE2 GLN A 39 27.959 38.207 24.165 1.00 0.00 N ATOM 0 H GLN A 39 29.010 32.748 22.563 1.00 0.00 H new ATOM 0 HA GLN A 39 26.888 34.581 23.214 1.00 0.00 H new ATOM 0 HB2 GLN A 39 29.654 34.243 23.747 1.00 0.00 H new ATOM 0 HB3 GLN A 39 29.562 35.681 22.749 1.00 0.00 H new ATOM 0 HG2 GLN A 39 28.304 35.199 25.448 1.00 0.00 H new ATOM 0 HG3 GLN A 39 29.536 36.370 25.022 1.00 0.00 H new ATOM 0 HE21 GLN A 39 28.941 38.390 23.958 1.00 0.00 H new ATOM 0 HE22 GLN A 39 27.279 38.966 24.123 1.00 0.00 H new ATOM 898 N SER A 54 22.361 25.602 25.685 1.00 0.00 N ATOM 899 CA SER A 54 22.574 25.330 27.074 1.00 0.00 C ATOM 900 C SER A 54 23.950 25.745 27.465 1.00 0.00 C ATOM 901 O SER A 54 24.951 25.467 26.805 1.00 0.00 O ATOM 902 CB SER A 54 22.327 23.873 27.502 1.00 0.00 C ATOM 903 OG SER A 54 22.280 23.754 28.916 1.00 0.00 O ATOM 0 HA SER A 54 21.821 25.916 27.601 1.00 0.00 H new ATOM 0 HB2 SER A 54 21.389 23.519 27.073 1.00 0.00 H new ATOM 0 HB3 SER A 54 23.118 23.236 27.107 1.00 0.00 H new ATOM 0 HG SER A 54 22.152 22.814 29.161 1.00 0.00 H new ATOM 909 N GLU A 55 24.046 26.412 28.630 1.00 0.00 N ATOM 910 CA GLU A 55 25.233 26.912 29.252 1.00 0.00 C ATOM 911 C GLU A 55 26.112 25.816 29.750 1.00 0.00 C ATOM 912 O GLU A 55 27.315 25.971 29.947 1.00 0.00 O ATOM 913 CB GLU A 55 24.843 27.988 30.280 1.00 0.00 C ATOM 914 CG GLU A 55 24.299 29.222 29.558 1.00 0.00 C ATOM 915 CD GLU A 55 23.696 30.304 30.441 1.00 0.00 C ATOM 916 OE1 GLU A 55 23.478 30.096 31.665 1.00 0.00 O ATOM 917 OE2 GLU A 55 23.380 31.388 29.880 1.00 0.00 O ATOM 0 H GLU A 55 23.216 26.619 29.185 1.00 0.00 H new ATOM 0 HA GLU A 55 25.870 27.409 28.520 1.00 0.00 H new ATOM 0 HB2 GLU A 55 24.091 27.595 30.964 1.00 0.00 H new ATOM 0 HB3 GLU A 55 25.710 28.260 30.882 1.00 0.00 H new ATOM 0 HG2 GLU A 55 25.109 29.665 28.978 1.00 0.00 H new ATOM 0 HG3 GLU A 55 23.539 28.896 28.848 1.00 0.00 H new ATOM 924 N GLU A 56 25.552 24.602 29.905 1.00 0.00 N ATOM 925 CA GLU A 56 26.306 23.414 30.155 1.00 0.00 C ATOM 926 C GLU A 56 26.988 22.842 28.959 1.00 0.00 C ATOM 927 O GLU A 56 27.906 22.038 29.116 1.00 0.00 O ATOM 928 CB GLU A 56 25.443 22.362 30.871 1.00 0.00 C ATOM 929 CG GLU A 56 24.527 21.521 29.978 1.00 0.00 C ATOM 930 CD GLU A 56 23.330 20.993 30.757 1.00 0.00 C ATOM 931 OE1 GLU A 56 23.536 20.309 31.794 1.00 0.00 O ATOM 932 OE2 GLU A 56 22.176 21.282 30.343 1.00 0.00 O ATOM 0 H GLU A 56 24.546 24.443 29.855 1.00 0.00 H new ATOM 0 HA GLU A 56 27.119 23.719 30.814 1.00 0.00 H new ATOM 0 HB2 GLU A 56 26.105 21.688 31.415 1.00 0.00 H new ATOM 0 HB3 GLU A 56 24.827 22.871 31.612 1.00 0.00 H new ATOM 0 HG2 GLU A 56 24.180 22.124 29.138 1.00 0.00 H new ATOM 0 HG3 GLU A 56 25.089 20.686 29.560 1.00 0.00 H new ATOM 939 N GLU A 57 26.635 23.190 27.708 1.00 0.00 N ATOM 940 CA GLU A 57 27.228 22.563 26.568 1.00 0.00 C ATOM 941 C GLU A 57 28.537 23.219 26.291 1.00 0.00 C ATOM 942 O GLU A 57 29.530 22.601 25.909 1.00 0.00 O ATOM 943 CB GLU A 57 26.367 22.534 25.294 1.00 0.00 C ATOM 944 CG GLU A 57 26.747 23.497 24.167 1.00 0.00 C ATOM 945 CD GLU A 57 26.044 23.114 22.872 1.00 0.00 C ATOM 946 OE1 GLU A 57 24.788 23.152 22.773 1.00 0.00 O ATOM 947 OE2 GLU A 57 26.770 22.728 21.917 1.00 0.00 O ATOM 0 H GLU A 57 25.941 23.904 27.487 1.00 0.00 H new ATOM 0 HA GLU A 57 27.345 21.512 26.833 1.00 0.00 H new ATOM 0 HB2 GLU A 57 26.391 21.520 24.894 1.00 0.00 H new ATOM 0 HB3 GLU A 57 25.335 22.740 25.580 1.00 0.00 H new ATOM 0 HG2 GLU A 57 26.477 24.516 24.446 1.00 0.00 H new ATOM 0 HG3 GLU A 57 27.827 23.483 24.018 1.00 0.00 H new ATOM 954 N VAL A 58 28.571 24.546 26.511 1.00 0.00 N ATOM 955 CA VAL A 58 29.728 25.362 26.312 1.00 0.00 C ATOM 956 C VAL A 58 30.817 24.923 27.229 1.00 0.00 C ATOM 957 O VAL A 58 31.975 24.740 26.856 1.00 0.00 O ATOM 958 CB VAL A 58 29.305 26.801 26.335 1.00 0.00 C ATOM 959 CG1 VAL A 58 29.317 27.492 27.708 1.00 0.00 C ATOM 960 CG2 VAL A 58 30.208 27.618 25.396 1.00 0.00 C ATOM 0 H VAL A 58 27.761 25.070 26.840 1.00 0.00 H new ATOM 0 HA VAL A 58 30.187 25.242 25.331 1.00 0.00 H new ATOM 0 HB VAL A 58 28.263 26.775 26.017 1.00 0.00 H new ATOM 0 HG11 VAL A 58 28.993 28.527 27.597 1.00 0.00 H new ATOM 0 HG12 VAL A 58 28.640 26.970 28.384 1.00 0.00 H new ATOM 0 HG13 VAL A 58 30.327 27.470 28.118 1.00 0.00 H new ATOM 0 HG21 VAL A 58 29.900 28.663 25.413 1.00 0.00 H new ATOM 0 HG22 VAL A 58 31.243 27.539 25.727 1.00 0.00 H new ATOM 0 HG23 VAL A 58 30.122 27.231 24.381 1.00 0.00 H new ATOM 970 N PHE A 59 30.419 24.620 28.477 1.00 0.00 N ATOM 971 CA PHE A 59 31.153 23.919 29.485 1.00 0.00 C ATOM 972 C PHE A 59 31.642 22.587 29.029 1.00 0.00 C ATOM 973 O PHE A 59 32.840 22.313 29.080 1.00 0.00 O ATOM 974 CB PHE A 59 30.272 23.827 30.742 1.00 0.00 C ATOM 975 CG PHE A 59 30.798 23.090 31.924 1.00 0.00 C ATOM 976 CD1 PHE A 59 30.804 21.716 31.972 1.00 0.00 C ATOM 977 CD2 PHE A 59 31.180 23.777 33.052 1.00 0.00 C ATOM 978 CE1 PHE A 59 31.238 21.039 33.088 1.00 0.00 C ATOM 979 CE2 PHE A 59 31.607 23.119 34.182 1.00 0.00 C ATOM 980 CZ PHE A 59 31.650 21.746 34.193 1.00 0.00 C ATOM 0 H PHE A 59 29.494 24.893 28.810 1.00 0.00 H new ATOM 0 HA PHE A 59 32.062 24.475 29.717 1.00 0.00 H new ATOM 0 HB2 PHE A 59 30.041 24.844 31.061 1.00 0.00 H new ATOM 0 HB3 PHE A 59 29.330 23.362 30.453 1.00 0.00 H new ATOM 0 HD1 PHE A 59 30.460 21.156 31.115 1.00 0.00 H new ATOM 0 HD2 PHE A 59 31.144 24.856 33.051 1.00 0.00 H new ATOM 0 HE1 PHE A 59 31.255 19.959 33.096 1.00 0.00 H new ATOM 0 HE2 PHE A 59 31.907 23.679 35.056 1.00 0.00 H new ATOM 0 HZ PHE A 59 32.007 21.223 35.068 1.00 0.00 H new ATOM 990 N THR A 60 30.750 21.708 28.541 1.00 0.00 N ATOM 991 CA THR A 60 31.036 20.383 28.086 1.00 0.00 C ATOM 992 C THR A 60 32.102 20.296 27.048 1.00 0.00 C ATOM 993 O THR A 60 32.936 19.391 27.059 1.00 0.00 O ATOM 994 CB THR A 60 29.811 19.610 27.698 1.00 0.00 C ATOM 995 OG1 THR A 60 29.778 18.341 28.335 1.00 0.00 O ATOM 996 CG2 THR A 60 29.654 19.334 26.193 1.00 0.00 C ATOM 0 H THR A 60 29.760 21.940 28.459 1.00 0.00 H new ATOM 0 HA THR A 60 31.453 19.895 28.967 1.00 0.00 H new ATOM 0 HB THR A 60 28.999 20.264 28.016 1.00 0.00 H new ATOM 0 HG1 THR A 60 28.968 17.860 28.065 1.00 0.00 H new ATOM 0 HG21 THR A 60 28.737 18.770 26.020 1.00 0.00 H new ATOM 0 HG22 THR A 60 29.605 20.279 25.653 1.00 0.00 H new ATOM 0 HG23 THR A 60 30.508 18.757 25.838 1.00 0.00 H new ATOM 1004 N GLU A 61 32.143 21.256 26.106 1.00 0.00 N ATOM 1005 CA GLU A 61 33.165 21.267 25.106 1.00 0.00 C ATOM 1006 C GLU A 61 34.493 21.732 25.595 1.00 0.00 C ATOM 1007 O GLU A 61 35.484 21.055 25.330 1.00 0.00 O ATOM 1008 CB GLU A 61 32.669 21.846 23.770 1.00 0.00 C ATOM 1009 CG GLU A 61 31.589 20.931 23.191 1.00 0.00 C ATOM 1010 CD GLU A 61 31.442 21.030 21.679 1.00 0.00 C ATOM 1011 OE1 GLU A 61 32.469 20.973 20.952 1.00 0.00 O ATOM 1012 OE2 GLU A 61 30.275 21.055 21.203 1.00 0.00 O ATOM 0 H GLU A 61 31.472 22.021 26.037 1.00 0.00 H new ATOM 0 HA GLU A 61 33.387 20.228 24.863 1.00 0.00 H new ATOM 0 HB2 GLU A 61 32.269 22.849 23.921 1.00 0.00 H new ATOM 0 HB3 GLU A 61 33.499 21.936 23.069 1.00 0.00 H new ATOM 0 HG2 GLU A 61 31.820 19.899 23.457 1.00 0.00 H new ATOM 0 HG3 GLU A 61 30.633 21.174 23.656 1.00 0.00 H new ATOM 1019 N VAL A 62 34.587 22.802 26.407 1.00 0.00 N ATOM 1020 CA VAL A 62 35.787 23.251 27.041 1.00 0.00 C ATOM 1021 C VAL A 62 36.429 22.240 27.928 1.00 0.00 C ATOM 1022 O VAL A 62 37.645 22.172 28.096 1.00 0.00 O ATOM 1023 CB VAL A 62 35.474 24.489 27.827 1.00 0.00 C ATOM 1024 CG1 VAL A 62 36.640 24.961 28.711 1.00 0.00 C ATOM 1025 CG2 VAL A 62 35.155 25.601 26.813 1.00 0.00 C ATOM 0 H VAL A 62 33.781 23.384 26.632 1.00 0.00 H new ATOM 0 HA VAL A 62 36.510 23.446 26.249 1.00 0.00 H new ATOM 0 HB VAL A 62 34.641 24.265 28.494 1.00 0.00 H new ATOM 0 HG11 VAL A 62 36.346 25.861 29.252 1.00 0.00 H new ATOM 0 HG12 VAL A 62 36.897 24.177 29.423 1.00 0.00 H new ATOM 0 HG13 VAL A 62 37.505 25.180 28.085 1.00 0.00 H new ATOM 0 HG21 VAL A 62 34.921 26.523 27.346 1.00 0.00 H new ATOM 0 HG22 VAL A 62 36.018 25.764 26.168 1.00 0.00 H new ATOM 0 HG23 VAL A 62 34.299 25.305 26.206 1.00 0.00 H new ATOM 1035 N ALA A 63 35.609 21.335 28.494 1.00 0.00 N ATOM 1036 CA ALA A 63 35.991 20.307 29.411 1.00 0.00 C ATOM 1037 C ALA A 63 36.961 19.335 28.832 1.00 0.00 C ATOM 1038 O ALA A 63 37.802 18.788 29.542 1.00 0.00 O ATOM 1039 CB ALA A 63 34.765 19.486 29.849 1.00 0.00 C ATOM 0 H ALA A 63 34.609 21.323 28.295 1.00 0.00 H new ATOM 0 HA ALA A 63 36.454 20.830 30.247 1.00 0.00 H new ATOM 0 HB1 ALA A 63 35.078 18.709 30.547 1.00 0.00 H new ATOM 0 HB2 ALA A 63 34.043 20.142 30.336 1.00 0.00 H new ATOM 0 HB3 ALA A 63 34.305 19.025 28.975 1.00 0.00 H new ATOM 1045 N ASN A 64 36.868 19.107 27.510 1.00 0.00 N ATOM 1046 CA ASN A 64 37.750 18.200 26.845 1.00 0.00 C ATOM 1047 C ASN A 64 39.106 18.785 26.650 1.00 0.00 C ATOM 1048 O ASN A 64 40.128 18.107 26.749 1.00 0.00 O ATOM 1049 CB ASN A 64 37.304 17.735 25.448 1.00 0.00 C ATOM 1050 CG ASN A 64 35.811 17.447 25.385 1.00 0.00 C ATOM 1051 OD1 ASN A 64 35.251 16.496 25.927 1.00 0.00 O ATOM 1052 ND2 ASN A 64 35.114 18.366 24.663 1.00 0.00 N ATOM 0 H ASN A 64 36.181 19.552 26.901 1.00 0.00 H new ATOM 0 HA ASN A 64 37.746 17.345 27.521 1.00 0.00 H new ATOM 0 HB2 ASN A 64 37.555 18.502 24.715 1.00 0.00 H new ATOM 0 HB3 ASN A 64 37.857 16.837 25.173 1.00 0.00 H new ATOM 0 HD21 ASN A 64 34.103 18.275 24.562 1.00 0.00 H new ATOM 0 HD22 ASN A 64 35.602 19.146 24.223 1.00 0.00 H new ATOM 1059 N LEU A 65 39.171 20.099 26.370 1.00 0.00 N ATOM 1060 CA LEU A 65 40.361 20.845 26.098 1.00 0.00 C ATOM 1061 C LEU A 65 41.285 20.862 27.266 1.00 0.00 C ATOM 1062 O LEU A 65 42.505 20.767 27.145 1.00 0.00 O ATOM 1063 CB LEU A 65 40.060 22.319 25.777 1.00 0.00 C ATOM 1064 CG LEU A 65 39.412 22.603 24.411 1.00 0.00 C ATOM 1065 CD1 LEU A 65 38.021 21.958 24.292 1.00 0.00 C ATOM 1066 CD2 LEU A 65 39.288 24.125 24.224 1.00 0.00 C ATOM 0 H LEU A 65 38.333 20.680 26.331 1.00 0.00 H new ATOM 0 HA LEU A 65 40.816 20.345 25.243 1.00 0.00 H new ATOM 0 HB2 LEU A 65 39.404 22.711 26.554 1.00 0.00 H new ATOM 0 HB3 LEU A 65 40.993 22.879 25.835 1.00 0.00 H new ATOM 0 HG LEU A 65 40.046 22.170 23.637 1.00 0.00 H new ATOM 0 HD11 LEU A 65 37.598 22.183 23.313 1.00 0.00 H new ATOM 0 HD12 LEU A 65 38.109 20.878 24.410 1.00 0.00 H new ATOM 0 HD13 LEU A 65 37.368 22.356 25.069 1.00 0.00 H new ATOM 0 HD21 LEU A 65 38.830 24.337 23.258 1.00 0.00 H new ATOM 0 HD22 LEU A 65 38.668 24.540 25.019 1.00 0.00 H new ATOM 0 HD23 LEU A 65 40.279 24.578 24.263 1.00 0.00 H new ATOM 1078 N PHE A 66 40.675 21.005 28.457 1.00 0.00 N ATOM 1079 CA PHE A 66 41.328 21.332 29.687 1.00 0.00 C ATOM 1080 C PHE A 66 41.409 20.101 30.521 1.00 0.00 C ATOM 1081 O PHE A 66 41.455 20.146 31.750 1.00 0.00 O ATOM 1082 CB PHE A 66 40.538 22.370 30.502 1.00 0.00 C ATOM 1083 CG PHE A 66 40.355 23.727 29.915 1.00 0.00 C ATOM 1084 CD1 PHE A 66 40.840 24.145 28.698 1.00 0.00 C ATOM 1085 CD2 PHE A 66 39.632 24.621 30.669 1.00 0.00 C ATOM 1086 CE1 PHE A 66 40.563 25.405 28.221 1.00 0.00 C ATOM 1087 CE2 PHE A 66 39.393 25.901 30.232 1.00 0.00 C ATOM 1088 CZ PHE A 66 39.851 26.290 28.994 1.00 0.00 C ATOM 0 H PHE A 66 39.668 20.885 28.567 1.00 0.00 H new ATOM 0 HA PHE A 66 42.309 21.739 29.441 1.00 0.00 H new ATOM 0 HB2 PHE A 66 39.550 21.956 30.701 1.00 0.00 H new ATOM 0 HB3 PHE A 66 41.035 22.487 31.465 1.00 0.00 H new ATOM 0 HD1 PHE A 66 41.447 23.474 28.108 1.00 0.00 H new ATOM 0 HD2 PHE A 66 39.243 24.310 31.627 1.00 0.00 H new ATOM 0 HE1 PHE A 66 40.905 25.698 27.240 1.00 0.00 H new ATOM 0 HE2 PHE A 66 38.850 26.596 30.855 1.00 0.00 H new ATOM 0 HZ PHE A 66 39.651 27.288 28.631 1.00 0.00 H new ATOM 1098 N ARG A 67 41.386 18.910 29.896 1.00 0.00 N ATOM 1099 CA ARG A 67 41.152 17.689 30.603 1.00 0.00 C ATOM 1100 C ARG A 67 42.240 17.273 31.531 1.00 0.00 C ATOM 1101 O ARG A 67 43.426 17.245 31.204 1.00 0.00 O ATOM 1102 CB ARG A 67 40.723 16.611 29.592 1.00 0.00 C ATOM 1103 CG ARG A 67 41.832 16.082 28.682 1.00 0.00 C ATOM 1104 CD ARG A 67 41.343 15.122 27.596 1.00 0.00 C ATOM 1105 NE ARG A 67 42.559 14.623 26.895 1.00 0.00 N ATOM 1106 CZ ARG A 67 42.591 13.514 26.100 1.00 0.00 C ATOM 1107 NH1 ARG A 67 41.463 12.842 25.727 1.00 0.00 N ATOM 1108 NH2 ARG A 67 43.800 13.051 25.667 1.00 0.00 N ATOM 0 H ARG A 67 41.531 18.793 28.893 1.00 0.00 H new ATOM 0 HA ARG A 67 40.335 17.856 31.304 1.00 0.00 H new ATOM 0 HB2 ARG A 67 40.297 15.772 30.142 1.00 0.00 H new ATOM 0 HB3 ARG A 67 39.929 17.019 28.967 1.00 0.00 H new ATOM 0 HG2 ARG A 67 42.332 16.926 28.207 1.00 0.00 H new ATOM 0 HG3 ARG A 67 42.577 15.573 29.293 1.00 0.00 H new ATOM 0 HD2 ARG A 67 40.780 14.297 28.032 1.00 0.00 H new ATOM 0 HD3 ARG A 67 40.675 15.630 26.901 1.00 0.00 H new ATOM 0 HE ARG A 67 43.426 15.145 27.017 1.00 0.00 H new ATOM 0 HH11 ARG A 67 40.549 13.165 26.044 1.00 0.00 H new ATOM 0 HH12 ARG A 67 41.534 12.017 25.131 1.00 0.00 H new ATOM 0 HH21 ARG A 67 44.657 13.532 25.938 1.00 0.00 H new ATOM 0 HH22 ARG A 67 43.846 12.224 25.072 1.00 0.00 H new ATOM 1122 N GLY A 68 41.870 17.013 32.798 1.00 0.00 N ATOM 1123 CA GLY A 68 42.784 16.719 33.859 1.00 0.00 C ATOM 1124 C GLY A 68 42.848 17.820 34.861 1.00 0.00 C ATOM 1125 O GLY A 68 42.936 17.578 36.064 1.00 0.00 O ATOM 0 H GLY A 68 40.894 17.007 33.096 1.00 0.00 H new ATOM 0 HA2 GLY A 68 42.481 15.796 34.353 1.00 0.00 H new ATOM 0 HA3 GLY A 68 43.778 16.547 33.445 1.00 0.00 H new ATOM 1129 N GLN A 69 42.821 19.086 34.408 1.00 0.00 N ATOM 1130 CA GLN A 69 42.942 20.232 35.254 1.00 0.00 C ATOM 1131 C GLN A 69 41.610 20.855 35.500 1.00 0.00 C ATOM 1132 O GLN A 69 41.035 21.604 34.713 1.00 0.00 O ATOM 1133 CB GLN A 69 44.016 21.208 34.744 1.00 0.00 C ATOM 1134 CG GLN A 69 43.810 21.717 33.317 1.00 0.00 C ATOM 1135 CD GLN A 69 45.097 22.226 32.683 1.00 0.00 C ATOM 1136 OE1 GLN A 69 45.798 21.461 32.023 1.00 0.00 O ATOM 1137 NE2 GLN A 69 45.394 23.544 32.839 1.00 0.00 N ATOM 0 H GLN A 69 42.711 19.319 33.421 1.00 0.00 H new ATOM 0 HA GLN A 69 43.302 19.909 36.231 1.00 0.00 H new ATOM 0 HB2 GLN A 69 44.053 22.065 35.416 1.00 0.00 H new ATOM 0 HB3 GLN A 69 44.987 20.716 34.800 1.00 0.00 H new ATOM 0 HG2 GLN A 69 43.401 20.913 32.704 1.00 0.00 H new ATOM 0 HG3 GLN A 69 43.072 22.519 33.325 1.00 0.00 H new ATOM 0 HE21 GLN A 69 44.783 24.142 33.396 1.00 0.00 H new ATOM 0 HE22 GLN A 69 46.227 23.935 32.399 1.00 0.00 H new ATOM 1146 N GLU A 70 41.010 20.473 36.641 1.00 0.00 N ATOM 1147 CA GLU A 70 39.647 20.747 36.973 1.00 0.00 C ATOM 1148 C GLU A 70 39.350 22.108 37.504 1.00 0.00 C ATOM 1149 O GLU A 70 38.194 22.526 37.487 1.00 0.00 O ATOM 1150 CB GLU A 70 39.073 19.659 37.893 1.00 0.00 C ATOM 1151 CG GLU A 70 39.236 18.266 37.281 1.00 0.00 C ATOM 1152 CD GLU A 70 38.258 17.251 37.853 1.00 0.00 C ATOM 1153 OE1 GLU A 70 38.241 17.035 39.095 1.00 0.00 O ATOM 1154 OE2 GLU A 70 37.494 16.641 37.057 1.00 0.00 O ATOM 0 H GLU A 70 41.499 19.948 37.366 1.00 0.00 H new ATOM 0 HA GLU A 70 39.139 20.730 36.009 1.00 0.00 H new ATOM 0 HB2 GLU A 70 39.577 19.695 38.859 1.00 0.00 H new ATOM 0 HB3 GLU A 70 38.017 19.856 38.077 1.00 0.00 H new ATOM 0 HG2 GLU A 70 39.096 18.330 36.202 1.00 0.00 H new ATOM 0 HG3 GLU A 70 40.255 17.917 37.450 1.00 0.00 H new ATOM 1161 N ASP A 71 40.350 22.872 37.980 1.00 0.00 N ATOM 1162 CA ASP A 71 40.174 24.119 38.660 1.00 0.00 C ATOM 1163 C ASP A 71 39.507 25.160 37.828 1.00 0.00 C ATOM 1164 O ASP A 71 38.648 25.910 38.291 1.00 0.00 O ATOM 1165 CB ASP A 71 41.513 24.597 39.244 1.00 0.00 C ATOM 1166 CG ASP A 71 42.541 24.979 38.190 1.00 0.00 C ATOM 1167 OD1 ASP A 71 42.947 24.110 37.372 1.00 0.00 O ATOM 1168 OD2 ASP A 71 42.964 26.167 38.192 1.00 0.00 O ATOM 0 H ASP A 71 41.330 22.607 37.886 1.00 0.00 H new ATOM 0 HA ASP A 71 39.484 23.944 39.485 1.00 0.00 H new ATOM 0 HB2 ASP A 71 41.331 25.457 39.889 1.00 0.00 H new ATOM 0 HB3 ASP A 71 41.927 23.809 39.873 1.00 0.00 H new ATOM 1173 N LEU A 72 39.825 25.178 36.521 1.00 0.00 N ATOM 1174 CA LEU A 72 39.222 26.000 35.518 1.00 0.00 C ATOM 1175 C LEU A 72 37.753 25.796 35.377 1.00 0.00 C ATOM 1176 O LEU A 72 36.997 26.752 35.211 1.00 0.00 O ATOM 1177 CB LEU A 72 39.930 25.753 34.176 1.00 0.00 C ATOM 1178 CG LEU A 72 41.445 26.019 34.183 1.00 0.00 C ATOM 1179 CD1 LEU A 72 42.096 25.644 32.841 1.00 0.00 C ATOM 1180 CD2 LEU A 72 41.780 27.485 34.504 1.00 0.00 C ATOM 0 H LEU A 72 40.555 24.576 36.140 1.00 0.00 H new ATOM 0 HA LEU A 72 39.345 27.036 35.834 1.00 0.00 H new ATOM 0 HB2 LEU A 72 39.759 24.719 33.877 1.00 0.00 H new ATOM 0 HB3 LEU A 72 39.469 26.385 33.417 1.00 0.00 H new ATOM 0 HG LEU A 72 41.851 25.386 34.972 1.00 0.00 H new ATOM 0 HD11 LEU A 72 43.166 25.847 32.886 1.00 0.00 H new ATOM 0 HD12 LEU A 72 41.935 24.584 32.642 1.00 0.00 H new ATOM 0 HD13 LEU A 72 41.648 26.235 32.042 1.00 0.00 H new ATOM 0 HD21 LEU A 72 42.861 27.621 34.497 1.00 0.00 H new ATOM 0 HD22 LEU A 72 41.328 28.134 33.754 1.00 0.00 H new ATOM 0 HD23 LEU A 72 41.389 27.740 35.489 1.00 0.00 H new ATOM 1192 N LEU A 73 37.253 24.550 35.451 1.00 0.00 N ATOM 1193 CA LEU A 73 35.869 24.204 35.365 1.00 0.00 C ATOM 1194 C LEU A 73 35.166 24.398 36.665 1.00 0.00 C ATOM 1195 O LEU A 73 33.958 24.620 36.730 1.00 0.00 O ATOM 1196 CB LEU A 73 35.637 22.751 34.919 1.00 0.00 C ATOM 1197 CG LEU A 73 35.893 22.456 33.432 1.00 0.00 C ATOM 1198 CD1 LEU A 73 34.959 23.239 32.494 1.00 0.00 C ATOM 1199 CD2 LEU A 73 37.369 22.669 33.054 1.00 0.00 C ATOM 0 H LEU A 73 37.853 23.735 35.579 1.00 0.00 H new ATOM 0 HA LEU A 73 35.463 24.877 34.610 1.00 0.00 H new ATOM 0 HB2 LEU A 73 36.279 22.102 35.514 1.00 0.00 H new ATOM 0 HB3 LEU A 73 34.607 22.480 35.151 1.00 0.00 H new ATOM 0 HG LEU A 73 35.660 21.401 33.292 1.00 0.00 H new ATOM 0 HD11 LEU A 73 35.189 22.988 31.459 1.00 0.00 H new ATOM 0 HD12 LEU A 73 33.923 22.976 32.710 1.00 0.00 H new ATOM 0 HD13 LEU A 73 35.102 24.309 32.648 1.00 0.00 H new ATOM 0 HD21 LEU A 73 37.509 22.450 31.995 1.00 0.00 H new ATOM 0 HD22 LEU A 73 37.649 23.704 33.251 1.00 0.00 H new ATOM 0 HD23 LEU A 73 37.996 22.004 33.648 1.00 0.00 H new ATOM 1211 N SER A 74 35.926 24.327 37.773 1.00 0.00 N ATOM 1212 CA SER A 74 35.470 24.530 39.113 1.00 0.00 C ATOM 1213 C SER A 74 35.066 25.946 39.340 1.00 0.00 C ATOM 1214 O SER A 74 33.940 26.258 39.721 1.00 0.00 O ATOM 1215 CB SER A 74 36.509 24.124 40.171 1.00 0.00 C ATOM 1216 OG SER A 74 35.971 24.158 41.484 1.00 0.00 O ATOM 0 H SER A 74 36.923 24.114 37.729 1.00 0.00 H new ATOM 0 HA SER A 74 34.604 23.878 39.229 1.00 0.00 H new ATOM 0 HB2 SER A 74 36.874 23.120 39.954 1.00 0.00 H new ATOM 0 HB3 SER A 74 37.367 24.794 40.113 1.00 0.00 H new ATOM 0 HG SER A 74 36.661 23.892 42.127 1.00 0.00 H new ATOM 1222 N GLU A 75 35.984 26.885 39.047 1.00 0.00 N ATOM 1223 CA GLU A 75 35.793 28.300 39.134 1.00 0.00 C ATOM 1224 C GLU A 75 34.856 28.833 38.106 1.00 0.00 C ATOM 1225 O GLU A 75 34.284 29.911 38.260 1.00 0.00 O ATOM 1226 CB GLU A 75 37.159 29.005 39.097 1.00 0.00 C ATOM 1227 CG GLU A 75 38.058 28.608 40.270 1.00 0.00 C ATOM 1228 CD GLU A 75 39.449 29.225 40.210 1.00 0.00 C ATOM 1229 OE1 GLU A 75 39.668 30.199 39.441 1.00 0.00 O ATOM 1230 OE2 GLU A 75 40.353 28.710 40.920 1.00 0.00 O ATOM 0 H GLU A 75 36.921 26.638 38.728 1.00 0.00 H new ATOM 0 HA GLU A 75 35.310 28.513 40.088 1.00 0.00 H new ATOM 0 HB2 GLU A 75 37.662 28.765 38.161 1.00 0.00 H new ATOM 0 HB3 GLU A 75 37.007 30.084 39.109 1.00 0.00 H new ATOM 0 HG2 GLU A 75 37.578 28.906 41.202 1.00 0.00 H new ATOM 0 HG3 GLU A 75 38.152 27.522 40.293 1.00 0.00 H new ATOM 1237 N PHE A 76 34.606 28.067 37.029 1.00 0.00 N ATOM 1238 CA PHE A 76 33.573 28.323 36.074 1.00 0.00 C ATOM 1239 C PHE A 76 32.202 28.250 36.654 1.00 0.00 C ATOM 1240 O PHE A 76 31.280 28.945 36.231 1.00 0.00 O ATOM 1241 CB PHE A 76 33.694 27.262 34.967 1.00 0.00 C ATOM 1242 CG PHE A 76 33.576 27.715 33.554 1.00 0.00 C ATOM 1243 CD1 PHE A 76 33.934 28.968 33.114 1.00 0.00 C ATOM 1244 CD2 PHE A 76 33.248 26.757 32.624 1.00 0.00 C ATOM 1245 CE1 PHE A 76 33.924 29.267 31.772 1.00 0.00 C ATOM 1246 CE2 PHE A 76 33.238 27.041 31.279 1.00 0.00 C ATOM 1247 CZ PHE A 76 33.575 28.304 30.853 1.00 0.00 C ATOM 0 H PHE A 76 35.149 27.231 36.814 1.00 0.00 H new ATOM 0 HA PHE A 76 33.704 29.339 35.701 1.00 0.00 H new ATOM 0 HB2 PHE A 76 34.659 26.768 35.081 1.00 0.00 H new ATOM 0 HB3 PHE A 76 32.927 26.507 35.142 1.00 0.00 H new ATOM 0 HD1 PHE A 76 34.225 29.723 33.829 1.00 0.00 H new ATOM 0 HD2 PHE A 76 32.993 25.762 32.957 1.00 0.00 H new ATOM 0 HE1 PHE A 76 34.190 30.259 31.439 1.00 0.00 H new ATOM 0 HE2 PHE A 76 32.968 26.279 30.563 1.00 0.00 H new ATOM 0 HZ PHE A 76 33.566 28.540 29.799 1.00 0.00 H new ATOM 1257 N GLY A 77 32.045 27.412 37.693 1.00 0.00 N ATOM 1258 CA GLY A 77 30.845 27.103 38.408 1.00 0.00 C ATOM 1259 C GLY A 77 30.197 28.249 39.106 1.00 0.00 C ATOM 1260 O GLY A 77 29.022 28.186 39.468 1.00 0.00 O ATOM 0 H GLY A 77 32.842 26.899 38.070 1.00 0.00 H new ATOM 0 HA2 GLY A 77 30.127 26.674 37.709 1.00 0.00 H new ATOM 0 HA3 GLY A 77 31.071 26.333 39.145 1.00 0.00 H new ATOM 1264 N GLN A 78 30.928 29.353 39.342 1.00 0.00 N ATOM 1265 CA GLN A 78 30.411 30.524 39.977 1.00 0.00 C ATOM 1266 C GLN A 78 29.379 31.266 39.200 1.00 0.00 C ATOM 1267 O GLN A 78 28.603 32.042 39.755 1.00 0.00 O ATOM 1268 CB GLN A 78 31.577 31.439 40.390 1.00 0.00 C ATOM 1269 CG GLN A 78 32.632 30.620 41.133 1.00 0.00 C ATOM 1270 CD GLN A 78 33.622 31.498 41.884 1.00 0.00 C ATOM 1271 OE1 GLN A 78 33.383 31.861 43.035 1.00 0.00 O ATOM 1272 NE2 GLN A 78 34.758 31.879 41.240 1.00 0.00 N ATOM 0 H GLN A 78 31.911 29.433 39.082 1.00 0.00 H new ATOM 0 HA GLN A 78 29.871 30.179 40.859 1.00 0.00 H new ATOM 0 HB2 GLN A 78 32.018 31.904 39.508 1.00 0.00 H new ATOM 0 HB3 GLN A 78 31.212 32.245 41.027 1.00 0.00 H new ATOM 0 HG2 GLN A 78 32.139 29.949 41.836 1.00 0.00 H new ATOM 0 HG3 GLN A 78 33.171 29.995 40.421 1.00 0.00 H new ATOM 0 HE21 GLN A 78 34.933 31.565 40.286 1.00 0.00 H new ATOM 0 HE22 GLN A 78 35.435 32.479 41.712 1.00 0.00 H new ATOM 1466 N ASN B 201 28.135 36.517 34.095 1.00 0.00 N ATOM 1467 CA ASN B 201 27.653 35.818 32.944 1.00 0.00 C ATOM 1468 C ASN B 201 28.730 35.657 31.927 1.00 0.00 C ATOM 1469 O ASN B 201 29.601 36.514 31.783 1.00 0.00 O ATOM 1470 CB ASN B 201 26.430 36.507 32.316 1.00 0.00 C ATOM 1471 CG ASN B 201 25.289 36.666 33.310 1.00 0.00 C ATOM 1472 OD1 ASN B 201 25.411 37.327 34.339 1.00 0.00 O ATOM 1473 ND2 ASN B 201 24.098 36.083 33.005 1.00 0.00 N ATOM 0 HA ASN B 201 27.338 34.832 33.285 1.00 0.00 H new ATOM 0 HB2 ASN B 201 26.721 37.487 31.939 1.00 0.00 H new ATOM 0 HB3 ASN B 201 26.086 35.925 31.460 1.00 0.00 H new ATOM 0 HD21 ASN B 201 23.301 36.193 33.632 1.00 0.00 H new ATOM 0 HD22 ASN B 201 24.002 35.536 32.150 1.00 0.00 H new ATOM 1480 N ILE B 202 28.756 34.538 31.182 1.00 0.00 N ATOM 1481 CA ILE B 202 29.835 34.165 30.320 1.00 0.00 C ATOM 1482 C ILE B 202 30.105 35.108 29.199 1.00 0.00 C ATOM 1483 O ILE B 202 31.214 35.190 28.675 1.00 0.00 O ATOM 1484 CB ILE B 202 29.823 32.701 29.994 1.00 0.00 C ATOM 1485 CG1 ILE B 202 30.512 32.009 31.183 1.00 0.00 C ATOM 1486 CG2 ILE B 202 30.411 32.383 28.609 1.00 0.00 C ATOM 1487 CD1 ILE B 202 30.448 30.486 31.271 1.00 0.00 C ATOM 0 H ILE B 202 27.991 33.863 31.180 1.00 0.00 H new ATOM 0 HA ILE B 202 30.750 34.294 30.898 1.00 0.00 H new ATOM 0 HB ILE B 202 28.810 32.315 29.886 1.00 0.00 H new ATOM 0 HG12 ILE B 202 31.563 32.297 31.172 1.00 0.00 H new ATOM 0 HG13 ILE B 202 30.080 32.413 32.099 1.00 0.00 H new ATOM 0 HG21 ILE B 202 30.373 31.308 28.436 1.00 0.00 H new ATOM 0 HG22 ILE B 202 29.831 32.895 27.841 1.00 0.00 H new ATOM 0 HG23 ILE B 202 31.447 32.720 28.567 1.00 0.00 H new ATOM 0 HD11 ILE B 202 30.979 30.150 32.162 1.00 0.00 H new ATOM 0 HD12 ILE B 202 29.407 30.168 31.327 1.00 0.00 H new ATOM 0 HD13 ILE B 202 30.913 30.051 30.386 1.00 0.00 H new ATOM 1499 N GLN B 203 29.127 35.965 28.851 1.00 0.00 N ATOM 1500 CA GLN B 203 29.315 37.116 28.024 1.00 0.00 C ATOM 1501 C GLN B 203 30.507 37.973 28.281 1.00 0.00 C ATOM 1502 O GLN B 203 31.125 38.473 27.343 1.00 0.00 O ATOM 1503 CB GLN B 203 28.057 37.997 27.936 1.00 0.00 C ATOM 1504 CG GLN B 203 27.650 38.734 29.214 1.00 0.00 C ATOM 1505 CD GLN B 203 26.482 39.667 28.932 1.00 0.00 C ATOM 1506 OE1 GLN B 203 25.346 39.249 28.710 1.00 0.00 O ATOM 1507 NE2 GLN B 203 26.759 40.998 28.912 1.00 0.00 N ATOM 0 H GLN B 203 28.162 35.849 29.161 1.00 0.00 H new ATOM 0 HA GLN B 203 29.522 36.642 27.064 1.00 0.00 H new ATOM 0 HB2 GLN B 203 28.212 38.736 27.150 1.00 0.00 H new ATOM 0 HB3 GLN B 203 27.222 37.370 27.623 1.00 0.00 H new ATOM 0 HG2 GLN B 203 27.373 38.015 29.985 1.00 0.00 H new ATOM 0 HG3 GLN B 203 28.496 39.304 29.599 1.00 0.00 H new ATOM 0 HE21 GLN B 203 27.707 41.324 29.099 1.00 0.00 H new ATOM 0 HE22 GLN B 203 26.019 41.670 28.710 1.00 0.00 H new ATOM 1516 N MET B 204 30.921 38.126 29.552 1.00 0.00 N ATOM 1517 CA MET B 204 32.114 38.805 29.949 1.00 0.00 C ATOM 1518 C MET B 204 33.396 38.238 29.444 1.00 0.00 C ATOM 1519 O MET B 204 34.383 38.959 29.312 1.00 0.00 O ATOM 1520 CB MET B 204 32.131 38.868 31.486 1.00 0.00 C ATOM 1521 CG MET B 204 31.370 40.084 32.019 1.00 0.00 C ATOM 1522 SD MET B 204 30.422 39.817 33.546 1.00 0.00 S ATOM 1523 CE MET B 204 31.877 39.681 34.624 1.00 0.00 C ATOM 0 H MET B 204 30.395 37.756 30.343 1.00 0.00 H new ATOM 0 HA MET B 204 32.070 39.791 29.486 1.00 0.00 H new ATOM 0 HB2 MET B 204 31.689 37.958 31.891 1.00 0.00 H new ATOM 0 HB3 MET B 204 33.163 38.904 31.836 1.00 0.00 H new ATOM 0 HG2 MET B 204 32.085 40.888 32.193 1.00 0.00 H new ATOM 0 HG3 MET B 204 30.685 40.429 31.244 1.00 0.00 H new ATOM 0 HE1 MET B 204 31.560 39.404 35.629 1.00 0.00 H new ATOM 0 HE2 MET B 204 32.550 38.918 34.232 1.00 0.00 H new ATOM 0 HE3 MET B 204 32.395 40.639 34.658 1.00 0.00 H new ATOM 1533 N LEU B 205 33.461 36.935 29.116 1.00 0.00 N ATOM 1534 CA LEU B 205 34.675 36.250 28.799 1.00 0.00 C ATOM 1535 C LEU B 205 35.326 36.590 27.502 1.00 0.00 C ATOM 1536 O LEU B 205 36.546 36.702 27.401 1.00 0.00 O ATOM 1537 CB LEU B 205 34.515 34.725 28.916 1.00 0.00 C ATOM 1538 CG LEU B 205 34.359 34.232 30.365 1.00 0.00 C ATOM 1539 CD1 LEU B 205 34.149 32.709 30.384 1.00 0.00 C ATOM 1540 CD2 LEU B 205 35.597 34.593 31.201 1.00 0.00 C ATOM 0 H LEU B 205 32.637 36.336 29.070 1.00 0.00 H new ATOM 0 HA LEU B 205 35.360 36.627 29.558 1.00 0.00 H new ATOM 0 HB2 LEU B 205 33.644 34.414 28.339 1.00 0.00 H new ATOM 0 HB3 LEU B 205 35.383 34.241 28.468 1.00 0.00 H new ATOM 0 HG LEU B 205 33.489 34.724 30.800 1.00 0.00 H new ATOM 0 HD11 LEU B 205 34.040 32.370 31.414 1.00 0.00 H new ATOM 0 HD12 LEU B 205 33.249 32.459 29.822 1.00 0.00 H new ATOM 0 HD13 LEU B 205 35.009 32.217 29.929 1.00 0.00 H new ATOM 0 HD21 LEU B 205 35.464 34.234 32.222 1.00 0.00 H new ATOM 0 HD22 LEU B 205 36.480 34.126 30.764 1.00 0.00 H new ATOM 0 HD23 LEU B 205 35.727 35.675 31.211 1.00 0.00 H new ATOM 1552 N LEU B 206 34.514 36.833 26.458 1.00 0.00 N ATOM 1553 CA LEU B 206 34.960 37.190 25.148 1.00 0.00 C ATOM 1554 C LEU B 206 35.474 38.588 25.134 1.00 0.00 C ATOM 1555 O LEU B 206 36.225 38.999 24.250 1.00 0.00 O ATOM 1556 CB LEU B 206 33.776 36.986 24.187 1.00 0.00 C ATOM 1557 CG LEU B 206 33.225 35.550 24.128 1.00 0.00 C ATOM 1558 CD1 LEU B 206 34.338 34.531 23.834 1.00 0.00 C ATOM 1559 CD2 LEU B 206 32.375 35.096 25.327 1.00 0.00 C ATOM 0 H LEU B 206 33.498 36.778 26.531 1.00 0.00 H new ATOM 0 HA LEU B 206 35.792 36.562 24.829 1.00 0.00 H new ATOM 0 HB2 LEU B 206 32.969 37.657 24.482 1.00 0.00 H new ATOM 0 HB3 LEU B 206 34.086 37.281 23.185 1.00 0.00 H new ATOM 0 HG LEU B 206 32.522 35.583 23.296 1.00 0.00 H new ATOM 0 HD11 LEU B 206 33.913 33.528 23.800 1.00 0.00 H new ATOM 0 HD12 LEU B 206 34.799 34.763 22.874 1.00 0.00 H new ATOM 0 HD13 LEU B 206 35.092 34.579 24.620 1.00 0.00 H new ATOM 0 HD21 LEU B 206 32.044 34.069 25.171 1.00 0.00 H new ATOM 0 HD22 LEU B 206 32.972 35.150 26.237 1.00 0.00 H new ATOM 0 HD23 LEU B 206 31.506 35.746 25.424 1.00 0.00 H new ATOM 1571 N GLU B 207 35.058 39.386 26.132 1.00 0.00 N ATOM 1572 CA GLU B 207 35.561 40.700 26.387 1.00 0.00 C ATOM 1573 C GLU B 207 36.847 40.650 27.138 1.00 0.00 C ATOM 1574 O GLU B 207 37.830 41.286 26.761 1.00 0.00 O ATOM 1575 CB GLU B 207 34.512 41.567 27.104 1.00 0.00 C ATOM 1576 CG GLU B 207 33.094 41.467 26.543 1.00 0.00 C ATOM 1577 CD GLU B 207 32.871 41.908 25.103 1.00 0.00 C ATOM 1578 OE1 GLU B 207 33.802 42.387 24.402 1.00 0.00 O ATOM 1579 OE2 GLU B 207 31.705 41.784 24.641 1.00 0.00 O ATOM 0 H GLU B 207 34.336 39.101 26.794 1.00 0.00 H new ATOM 0 HA GLU B 207 35.768 41.172 25.426 1.00 0.00 H new ATOM 0 HB2 GLU B 207 34.490 41.286 28.157 1.00 0.00 H new ATOM 0 HB3 GLU B 207 34.831 42.608 27.058 1.00 0.00 H new ATOM 0 HG2 GLU B 207 32.771 40.430 26.630 1.00 0.00 H new ATOM 0 HG3 GLU B 207 32.438 42.060 27.181 1.00 0.00 H new ATOM 1586 N ALA B 208 36.911 39.851 28.218 1.00 0.00 N ATOM 1587 CA ALA B 208 38.064 39.621 29.032 1.00 0.00 C ATOM 1588 C ALA B 208 39.252 39.103 28.297 1.00 0.00 C ATOM 1589 O ALA B 208 40.377 39.544 28.526 1.00 0.00 O ATOM 1590 CB ALA B 208 37.735 38.640 30.170 1.00 0.00 C ATOM 0 H ALA B 208 36.098 39.329 28.545 1.00 0.00 H new ATOM 0 HA ALA B 208 38.330 40.605 29.417 1.00 0.00 H new ATOM 0 HB1 ALA B 208 38.624 38.477 30.779 1.00 0.00 H new ATOM 0 HB2 ALA B 208 36.942 39.056 30.791 1.00 0.00 H new ATOM 0 HB3 ALA B 208 37.405 37.691 29.748 1.00 0.00 H new ATOM 1596 N ALA B 209 39.045 38.170 27.350 1.00 0.00 N ATOM 1597 CA ALA B 209 40.050 37.675 26.462 1.00 0.00 C ATOM 1598 C ALA B 209 40.680 38.732 25.621 1.00 0.00 C ATOM 1599 O ALA B 209 41.903 38.841 25.544 1.00 0.00 O ATOM 1600 CB ALA B 209 39.447 36.580 25.567 1.00 0.00 C ATOM 0 H ALA B 209 38.133 37.741 27.197 1.00 0.00 H new ATOM 0 HA ALA B 209 40.847 37.268 27.084 1.00 0.00 H new ATOM 0 HB1 ALA B 209 40.212 36.202 24.889 1.00 0.00 H new ATOM 0 HB2 ALA B 209 39.077 35.764 26.189 1.00 0.00 H new ATOM 0 HB3 ALA B 209 38.623 36.996 24.988 1.00 0.00 H new ATOM 1606 N ASP B 210 39.865 39.597 24.991 1.00 0.00 N ATOM 1607 CA ASP B 210 40.307 40.653 24.134 1.00 0.00 C ATOM 1608 C ASP B 210 41.006 41.748 24.867 1.00 0.00 C ATOM 1609 O ASP B 210 41.991 42.309 24.390 1.00 0.00 O ATOM 1610 CB ASP B 210 39.089 41.157 23.344 1.00 0.00 C ATOM 1611 CG ASP B 210 39.516 41.972 22.132 1.00 0.00 C ATOM 1612 OD1 ASP B 210 40.316 41.459 21.303 1.00 0.00 O ATOM 1613 OD2 ASP B 210 39.062 43.139 21.998 1.00 0.00 O ATOM 0 H ASP B 210 38.850 39.558 25.084 1.00 0.00 H new ATOM 0 HA ASP B 210 41.061 40.268 23.447 1.00 0.00 H new ATOM 0 HB2 ASP B 210 38.486 40.309 23.021 1.00 0.00 H new ATOM 0 HB3 ASP B 210 38.459 41.767 23.992 1.00 0.00 H new ATOM 1618 N TYR B 211 40.545 42.071 26.089 1.00 0.00 N ATOM 1619 CA TYR B 211 41.194 42.904 27.053 1.00 0.00 C ATOM 1620 C TYR B 211 42.560 42.413 27.391 1.00 0.00 C ATOM 1621 O TYR B 211 43.536 43.159 27.353 1.00 0.00 O ATOM 1622 CB TYR B 211 40.262 42.998 28.273 1.00 0.00 C ATOM 1623 CG TYR B 211 40.854 43.537 29.529 1.00 0.00 C ATOM 1624 CD1 TYR B 211 40.878 44.887 29.790 1.00 0.00 C ATOM 1625 CD2 TYR B 211 41.354 42.662 30.466 1.00 0.00 C ATOM 1626 CE1 TYR B 211 41.379 45.357 30.981 1.00 0.00 C ATOM 1627 CE2 TYR B 211 41.850 43.130 31.659 1.00 0.00 C ATOM 1628 CZ TYR B 211 41.864 44.479 31.921 1.00 0.00 C ATOM 1629 OH TYR B 211 42.376 44.940 33.153 1.00 0.00 O ATOM 0 H TYR B 211 39.649 41.722 26.427 1.00 0.00 H new ATOM 0 HA TYR B 211 41.362 43.902 26.648 1.00 0.00 H new ATOM 0 HB2 TYR B 211 39.411 43.623 28.003 1.00 0.00 H new ATOM 0 HB3 TYR B 211 39.873 42.001 28.481 1.00 0.00 H new ATOM 0 HD1 TYR B 211 40.501 45.582 29.055 1.00 0.00 H new ATOM 0 HD2 TYR B 211 41.357 41.601 30.263 1.00 0.00 H new ATOM 0 HE1 TYR B 211 41.392 46.419 31.179 1.00 0.00 H new ATOM 0 HE2 TYR B 211 42.230 42.435 32.393 1.00 0.00 H new ATOM 0 HH TYR B 211 42.672 44.176 33.691 1.00 0.00 H new ATOM 1639 N LEU B 212 42.702 41.115 27.715 1.00 0.00 N ATOM 1640 CA LEU B 212 43.958 40.530 28.067 1.00 0.00 C ATOM 1641 C LEU B 212 44.943 40.426 26.953 1.00 0.00 C ATOM 1642 O LEU B 212 46.130 40.660 27.172 1.00 0.00 O ATOM 1643 CB LEU B 212 43.752 39.161 28.738 1.00 0.00 C ATOM 1644 CG LEU B 212 43.702 39.222 30.274 1.00 0.00 C ATOM 1645 CD1 LEU B 212 43.299 37.824 30.771 1.00 0.00 C ATOM 1646 CD2 LEU B 212 45.018 39.689 30.921 1.00 0.00 C ATOM 0 H LEU B 212 41.924 40.456 27.733 1.00 0.00 H new ATOM 0 HA LEU B 212 44.404 41.229 28.775 1.00 0.00 H new ATOM 0 HB2 LEU B 212 42.824 38.723 28.371 1.00 0.00 H new ATOM 0 HB3 LEU B 212 44.560 38.494 28.437 1.00 0.00 H new ATOM 0 HG LEU B 212 42.972 39.975 30.572 1.00 0.00 H new ATOM 0 HD11 LEU B 212 43.252 37.825 31.860 1.00 0.00 H new ATOM 0 HD12 LEU B 212 42.322 37.561 30.366 1.00 0.00 H new ATOM 0 HD13 LEU B 212 44.037 37.093 30.440 1.00 0.00 H new ATOM 0 HD21 LEU B 212 44.904 39.706 32.005 1.00 0.00 H new ATOM 0 HD22 LEU B 212 45.820 39.002 30.651 1.00 0.00 H new ATOM 0 HD23 LEU B 212 45.263 40.690 30.566 1.00 0.00 H new ATOM 1658 N GLU B 213 44.517 40.132 25.711 1.00 0.00 N ATOM 1659 CA GLU B 213 45.366 40.209 24.564 1.00 0.00 C ATOM 1660 C GLU B 213 45.882 41.585 24.316 1.00 0.00 C ATOM 1661 O GLU B 213 47.056 41.786 24.007 1.00 0.00 O ATOM 1662 CB GLU B 213 44.694 39.690 23.281 1.00 0.00 C ATOM 1663 CG GLU B 213 44.422 38.184 23.299 1.00 0.00 C ATOM 1664 CD GLU B 213 44.048 37.668 21.917 1.00 0.00 C ATOM 1665 OE1 GLU B 213 43.014 38.113 21.351 1.00 0.00 O ATOM 1666 OE2 GLU B 213 44.803 36.812 21.382 1.00 0.00 O ATOM 0 H GLU B 213 43.564 39.835 25.500 1.00 0.00 H new ATOM 0 HA GLU B 213 46.205 39.557 24.806 1.00 0.00 H new ATOM 0 HB2 GLU B 213 43.752 40.219 23.134 1.00 0.00 H new ATOM 0 HB3 GLU B 213 45.329 39.926 22.427 1.00 0.00 H new ATOM 0 HG2 GLU B 213 45.307 37.658 23.658 1.00 0.00 H new ATOM 0 HG3 GLU B 213 43.616 37.967 24.000 1.00 0.00 H new ATOM 1673 N ARG B 214 45.042 42.615 24.523 1.00 0.00 N ATOM 1674 CA ARG B 214 45.445 43.987 24.492 1.00 0.00 C ATOM 1675 C ARG B 214 46.476 44.323 25.514 1.00 0.00 C ATOM 1676 O ARG B 214 47.427 45.051 25.229 1.00 0.00 O ATOM 1677 CB ARG B 214 44.249 44.945 24.623 1.00 0.00 C ATOM 1678 CG ARG B 214 43.996 45.840 23.409 1.00 0.00 C ATOM 1679 CD ARG B 214 45.195 46.679 22.962 1.00 0.00 C ATOM 1680 NE ARG B 214 44.688 47.720 22.025 1.00 0.00 N ATOM 1681 CZ ARG B 214 44.668 49.061 22.274 1.00 0.00 C ATOM 1682 NH1 ARG B 214 44.972 49.594 23.493 1.00 0.00 N ATOM 1683 NH2 ARG B 214 44.300 49.899 21.260 1.00 0.00 N ATOM 0 H ARG B 214 44.049 42.489 24.719 1.00 0.00 H new ATOM 0 HA ARG B 214 45.900 44.124 23.511 1.00 0.00 H new ATOM 0 HB2 ARG B 214 43.352 44.356 24.814 1.00 0.00 H new ATOM 0 HB3 ARG B 214 44.406 45.579 25.496 1.00 0.00 H new ATOM 0 HG2 ARG B 214 43.679 45.214 22.575 1.00 0.00 H new ATOM 0 HG3 ARG B 214 43.168 46.511 23.637 1.00 0.00 H new ATOM 0 HD2 ARG B 214 45.682 47.141 23.821 1.00 0.00 H new ATOM 0 HD3 ARG B 214 45.940 46.052 22.472 1.00 0.00 H new ATOM 0 HE ARG B 214 44.327 47.405 21.125 1.00 0.00 H new ATOM 0 HH11 ARG B 214 45.229 48.982 24.268 1.00 0.00 H new ATOM 0 HH12 ARG B 214 44.943 50.604 23.629 1.00 0.00 H new ATOM 0 HH21 ARG B 214 44.050 49.517 20.348 1.00 0.00 H new ATOM 0 HH22 ARG B 214 44.275 50.907 21.415 1.00 0.00 H new ATOM 1697 N ARG B 215 46.372 43.775 26.737 1.00 0.00 N ATOM 1698 CA ARG B 215 47.346 43.916 27.774 1.00 0.00 C ATOM 1699 C ARG B 215 48.678 43.310 27.491 1.00 0.00 C ATOM 1700 O ARG B 215 49.688 43.748 28.041 1.00 0.00 O ATOM 1701 CB ARG B 215 46.838 43.391 29.127 1.00 0.00 C ATOM 1702 CG ARG B 215 45.856 44.347 29.808 1.00 0.00 C ATOM 1703 CD ARG B 215 45.630 44.022 31.286 1.00 0.00 C ATOM 1704 NE ARG B 215 46.092 45.153 32.140 1.00 0.00 N ATOM 1705 CZ ARG B 215 47.384 45.391 32.513 1.00 0.00 C ATOM 1706 NH1 ARG B 215 48.439 44.802 31.879 1.00 0.00 N ATOM 1707 NH2 ARG B 215 47.644 46.248 33.543 1.00 0.00 N ATOM 0 H ARG B 215 45.572 43.207 27.016 1.00 0.00 H new ATOM 0 HA ARG B 215 47.496 44.995 27.819 1.00 0.00 H new ATOM 0 HB2 ARG B 215 46.353 42.426 28.977 1.00 0.00 H new ATOM 0 HB3 ARG B 215 47.688 43.221 29.787 1.00 0.00 H new ATOM 0 HG2 ARG B 215 46.230 45.367 29.719 1.00 0.00 H new ATOM 0 HG3 ARG B 215 44.901 44.311 29.284 1.00 0.00 H new ATOM 0 HD2 ARG B 215 44.572 43.830 31.466 1.00 0.00 H new ATOM 0 HD3 ARG B 215 46.169 43.113 31.552 1.00 0.00 H new ATOM 0 HE ARG B 215 45.382 45.805 32.474 1.00 0.00 H new ATOM 0 HH11 ARG B 215 48.274 44.163 31.102 1.00 0.00 H new ATOM 0 HH12 ARG B 215 49.392 45.001 32.182 1.00 0.00 H new ATOM 0 HH21 ARG B 215 46.875 46.708 34.031 1.00 0.00 H new ATOM 0 HH22 ARG B 215 48.607 46.429 33.825 1.00 0.00 H new