USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 967 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 107 HIS :FLIP no HD1:sc= 0 X(o=-0.019,f=0) USER MOD Set 1.2: A 111 ASN :FLIP amide:sc= 0 F(o=-3!,f=0) USER MOD Set 2.1: A 109 MET CE :methyl -142:sc= -0.0152 (180deg=-0.188) USER MOD Set 2.2: A 144 MET CE :methyl 148:sc= -0.165 (180deg=-0.825) USER MOD Set 3.1: A 26 THR OG1 : rot -141:sc= 1.3 USER MOD Set 3.2: A 62 THR OG1 : rot -150:sc= 0.99 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-2.3!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot -22:sc= 0.384 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot -64:sc= 0.523 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 73:sc= 0.104 USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 74:sc= 0.945 USER MOD Single : A 41 GLN : amide:sc= -0.0787 X(o=-0.079,f=-0.37) USER MOD Single : A 42 ASN : amide:sc=-0.00382 K(o=-0.0038,f=-0.86) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.00167 USER MOD Single : A 49 GLN :FLIP amide:sc= 0 F(o=-0.52,f=0) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.0634 K(o=-0.063,f=-1.6!) USER MOD Single : A 60 ASN : amide:sc= -0.207 K(o=-0.21,f=-3.6) USER MOD Single : A 70 THR OG1 : rot 76:sc= 0.151 USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl 179:sc= 0 (180deg=-0.00375) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 1.18 K(o=1.2,f=-0.057) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -63:sc= 1.3 USER MOD Single : A 110 THR OG1 : rot 105:sc= 1.18 USER MOD Single : A 115 LYS NZ :NH3+ -159:sc= 1.27 (180deg=1.11) USER MOD Single : A 117 THR OG1 : rot 180:sc=3.17e-05 USER MOD Single : A 124 MET CE :methyl 138:sc= -0.224 (180deg=-1.33!) USER MOD Single : A 135 GLN : amide:sc= 1.5 K(o=1.5,f=0) USER MOD Single : A 137 ASN : amide:sc= 0.205 K(o=0.21,f=-6.1!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN :FLIP amide:sc= -0.0219 F(o=-0.84,f=-0.022) USER MOD Single : A 145 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 58 N THR A 5 -11.854 15.648 0.957 1.00 0.00 N ATOM 59 CA THR A 5 -12.399 16.867 0.444 1.00 0.00 C ATOM 60 C THR A 5 -13.734 16.519 -0.118 1.00 0.00 C ATOM 61 O THR A 5 -14.006 15.338 -0.332 1.00 0.00 O ATOM 62 CB THR A 5 -11.477 17.477 -0.570 1.00 0.00 C ATOM 63 OG1 THR A 5 -11.230 16.718 -1.744 1.00 0.00 O ATOM 64 CG2 THR A 5 -10.134 17.705 0.144 1.00 0.00 C ATOM 0 HA THR A 5 -12.510 17.625 1.219 1.00 0.00 H new ATOM 0 HB THR A 5 -11.970 18.381 -0.927 1.00 0.00 H new ATOM 0 HG1 THR A 5 -10.620 17.212 -2.330 1.00 0.00 H new ATOM 0 HG21 THR A 5 -9.423 18.150 -0.552 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.281 18.376 0.990 1.00 0.00 H new ATOM 0 HG23 THR A 5 -9.745 16.751 0.500 1.00 0.00 H new ATOM 72 N GLU A 6 -14.586 17.496 -0.474 1.00 0.00 N ATOM 73 CA GLU A 6 -15.908 17.253 -0.962 1.00 0.00 C ATOM 74 C GLU A 6 -15.972 16.570 -2.284 1.00 0.00 C ATOM 75 O GLU A 6 -16.868 15.800 -2.627 1.00 0.00 O ATOM 76 CB GLU A 6 -16.597 18.621 -1.100 1.00 0.00 C ATOM 77 CG GLU A 6 -17.184 19.121 0.222 1.00 0.00 C ATOM 78 CD GLU A 6 -18.351 18.282 0.724 1.00 0.00 C ATOM 79 OE1 GLU A 6 -19.319 18.093 -0.060 1.00 0.00 O ATOM 80 OE2 GLU A 6 -18.227 17.880 1.912 1.00 0.00 O ATOM 0 H GLU A 6 -14.348 18.486 -0.421 1.00 0.00 H new ATOM 0 HA GLU A 6 -16.392 16.582 -0.252 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -15.877 19.350 -1.472 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -17.392 18.550 -1.842 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -16.400 19.128 0.979 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -17.515 20.152 0.097 1.00 0.00 H new ATOM 87 N GLU A 7 -14.939 16.860 -3.095 1.00 0.00 N ATOM 88 CA GLU A 7 -14.866 16.282 -4.401 1.00 0.00 C ATOM 89 C GLU A 7 -14.569 14.824 -4.462 1.00 0.00 C ATOM 90 O GLU A 7 -15.031 14.057 -5.306 1.00 0.00 O ATOM 91 CB GLU A 7 -13.663 17.055 -4.970 1.00 0.00 C ATOM 92 CG GLU A 7 -13.868 18.571 -5.010 1.00 0.00 C ATOM 93 CD GLU A 7 -13.109 19.353 -6.072 1.00 0.00 C ATOM 94 OE1 GLU A 7 -13.365 19.033 -7.263 1.00 0.00 O ATOM 95 OE2 GLU A 7 -12.270 20.257 -5.813 1.00 0.00 O ATOM 0 H GLU A 7 -14.168 17.482 -2.853 1.00 0.00 H new ATOM 0 HA GLU A 7 -15.823 16.357 -4.918 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -12.782 16.832 -4.368 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -13.458 16.698 -5.979 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -14.932 18.763 -5.146 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -13.594 18.974 -4.035 1.00 0.00 H new ATOM 102 N GLN A 8 -13.873 14.289 -3.443 1.00 0.00 N ATOM 103 CA GLN A 8 -13.692 12.884 -3.249 1.00 0.00 C ATOM 104 C GLN A 8 -14.922 12.218 -2.735 1.00 0.00 C ATOM 105 O GLN A 8 -15.254 11.134 -3.212 1.00 0.00 O ATOM 106 CB GLN A 8 -12.436 12.692 -2.382 1.00 0.00 C ATOM 107 CG GLN A 8 -11.194 13.185 -3.127 1.00 0.00 C ATOM 108 CD GLN A 8 -10.036 12.972 -2.163 1.00 0.00 C ATOM 109 OE1 GLN A 8 -10.236 12.475 -1.056 1.00 0.00 O ATOM 110 NE2 GLN A 8 -8.789 13.389 -2.511 1.00 0.00 N ATOM 0 H GLN A 8 -13.419 14.857 -2.727 1.00 0.00 H new ATOM 0 HA GLN A 8 -13.525 12.378 -4.200 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -12.546 13.238 -1.445 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -12.320 11.639 -2.126 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -11.043 12.628 -4.052 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -11.290 14.236 -3.400 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -8.627 13.801 -3.430 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -8.016 13.290 -1.853 1.00 0.00 H new ATOM 119 N ILE A 9 -15.706 12.824 -1.826 1.00 0.00 N ATOM 120 CA ILE A 9 -16.936 12.324 -1.294 1.00 0.00 C ATOM 121 C ILE A 9 -18.007 12.156 -2.317 1.00 0.00 C ATOM 122 O ILE A 9 -18.677 11.127 -2.384 1.00 0.00 O ATOM 123 CB ILE A 9 -17.441 13.171 -0.164 1.00 0.00 C ATOM 124 CG1 ILE A 9 -16.435 13.222 0.999 1.00 0.00 C ATOM 125 CG2 ILE A 9 -18.749 12.540 0.342 1.00 0.00 C ATOM 126 CD1 ILE A 9 -16.871 14.100 2.171 1.00 0.00 C ATOM 0 H ILE A 9 -15.460 13.733 -1.434 1.00 0.00 H new ATOM 0 HA ILE A 9 -16.694 11.331 -0.916 1.00 0.00 H new ATOM 0 HB ILE A 9 -17.592 14.189 -0.522 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -16.267 12.208 1.363 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.480 13.588 0.622 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -19.144 13.133 1.167 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -19.478 12.514 -0.468 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -18.554 11.525 0.687 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -16.105 14.079 2.946 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -17.011 15.124 1.826 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -17.809 13.723 2.578 1.00 0.00 H new ATOM 138 N ALA A 10 -18.118 13.092 -3.277 1.00 0.00 N ATOM 139 CA ALA A 10 -18.891 13.022 -4.477 1.00 0.00 C ATOM 140 C ALA A 10 -18.507 11.905 -5.386 1.00 0.00 C ATOM 141 O ALA A 10 -19.418 11.137 -5.692 1.00 0.00 O ATOM 142 CB ALA A 10 -19.299 14.421 -4.970 1.00 0.00 C ATOM 0 H ALA A 10 -17.619 13.979 -3.203 1.00 0.00 H new ATOM 0 HA ALA A 10 -19.893 12.629 -4.307 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -19.885 14.328 -5.884 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -19.896 14.917 -4.205 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -18.405 15.011 -5.171 1.00 0.00 H new ATOM 148 N GLU A 11 -17.257 11.768 -5.864 1.00 0.00 N ATOM 149 CA GLU A 11 -16.783 10.685 -6.669 1.00 0.00 C ATOM 150 C GLU A 11 -16.904 9.326 -6.071 1.00 0.00 C ATOM 151 O GLU A 11 -17.237 8.354 -6.748 1.00 0.00 O ATOM 152 CB GLU A 11 -15.331 11.042 -7.030 1.00 0.00 C ATOM 153 CG GLU A 11 -14.695 10.162 -8.109 1.00 0.00 C ATOM 154 CD GLU A 11 -13.443 10.832 -8.657 1.00 0.00 C ATOM 155 OE1 GLU A 11 -12.591 11.379 -7.908 1.00 0.00 O ATOM 156 OE2 GLU A 11 -13.264 10.790 -9.903 1.00 0.00 O ATOM 0 H GLU A 11 -16.531 12.459 -5.675 1.00 0.00 H new ATOM 0 HA GLU A 11 -17.422 10.592 -7.547 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -15.301 12.079 -7.364 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -14.723 10.980 -6.128 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -14.443 9.187 -7.692 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -15.408 9.989 -8.916 1.00 0.00 H new ATOM 163 N PHE A 12 -16.789 9.204 -4.737 1.00 0.00 N ATOM 164 CA PHE A 12 -16.975 7.974 -4.030 1.00 0.00 C ATOM 165 C PHE A 12 -18.391 7.531 -3.885 1.00 0.00 C ATOM 166 O PHE A 12 -18.710 6.352 -3.740 1.00 0.00 O ATOM 167 CB PHE A 12 -16.421 7.974 -2.596 1.00 0.00 C ATOM 168 CG PHE A 12 -14.954 8.232 -2.598 1.00 0.00 C ATOM 169 CD1 PHE A 12 -14.048 7.922 -3.585 1.00 0.00 C ATOM 170 CD2 PHE A 12 -14.453 8.783 -1.442 1.00 0.00 C ATOM 171 CE1 PHE A 12 -12.698 8.141 -3.444 1.00 0.00 C ATOM 172 CE2 PHE A 12 -13.121 9.083 -1.278 1.00 0.00 C ATOM 173 CZ PHE A 12 -12.264 8.791 -2.312 1.00 0.00 C ATOM 0 H PHE A 12 -16.558 9.989 -4.128 1.00 0.00 H new ATOM 0 HA PHE A 12 -16.420 7.295 -4.677 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -16.928 8.736 -2.005 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -16.626 7.014 -2.122 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -14.411 7.490 -4.506 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -15.134 8.989 -0.629 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -11.999 7.813 -4.199 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -12.760 9.534 -0.365 1.00 0.00 H new ATOM 0 HZ PHE A 12 -11.226 9.078 -2.234 1.00 0.00 H new ATOM 183 N LYS A 13 -19.348 8.474 -3.823 1.00 0.00 N ATOM 184 CA LYS A 13 -20.735 8.128 -3.788 1.00 0.00 C ATOM 185 C LYS A 13 -21.184 7.539 -5.081 1.00 0.00 C ATOM 186 O LYS A 13 -21.993 6.615 -5.154 1.00 0.00 O ATOM 187 CB LYS A 13 -21.594 9.334 -3.373 1.00 0.00 C ATOM 188 CG LYS A 13 -23.028 9.076 -2.907 1.00 0.00 C ATOM 189 CD LYS A 13 -23.692 10.226 -2.148 1.00 0.00 C ATOM 190 CE LYS A 13 -23.654 11.651 -2.706 1.00 0.00 C ATOM 191 NZ LYS A 13 -24.237 12.646 -1.778 1.00 0.00 N ATOM 0 H LYS A 13 -19.161 9.476 -3.797 1.00 0.00 H new ATOM 0 HA LYS A 13 -20.869 7.358 -3.028 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -21.072 9.854 -2.570 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -21.638 10.019 -4.220 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -23.638 8.840 -3.779 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -23.030 8.193 -2.268 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -24.741 9.961 -2.015 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -23.243 10.257 -1.155 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -22.621 11.924 -2.922 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -24.196 11.681 -3.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -24.185 13.592 -2.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -25.231 12.405 -1.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -23.705 12.641 -0.884 1.00 0.00 H new ATOM 205 N GLU A 14 -20.623 7.987 -6.218 1.00 0.00 N ATOM 206 CA GLU A 14 -20.937 7.459 -7.509 1.00 0.00 C ATOM 207 C GLU A 14 -20.431 6.075 -7.728 1.00 0.00 C ATOM 208 O GLU A 14 -21.063 5.228 -8.357 1.00 0.00 O ATOM 209 CB GLU A 14 -20.385 8.442 -8.556 1.00 0.00 C ATOM 210 CG GLU A 14 -20.945 9.865 -8.578 1.00 0.00 C ATOM 211 CD GLU A 14 -22.465 9.916 -8.646 1.00 0.00 C ATOM 212 OE1 GLU A 14 -23.047 9.699 -9.741 1.00 0.00 O ATOM 213 OE2 GLU A 14 -23.123 10.157 -7.599 1.00 0.00 O ATOM 0 H GLU A 14 -19.932 8.737 -6.240 1.00 0.00 H new ATOM 0 HA GLU A 14 -22.019 7.366 -7.598 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -19.307 8.511 -8.412 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -20.548 8.005 -9.541 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -20.611 10.393 -7.685 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -20.532 10.397 -9.435 1.00 0.00 H new ATOM 220 N ALA A 15 -19.235 5.803 -7.176 1.00 0.00 N ATOM 221 CA ALA A 15 -18.543 4.558 -7.056 1.00 0.00 C ATOM 222 C ALA A 15 -19.302 3.566 -6.243 1.00 0.00 C ATOM 223 O ALA A 15 -19.555 2.512 -6.824 1.00 0.00 O ATOM 224 CB ALA A 15 -17.038 4.701 -6.771 1.00 0.00 C ATOM 0 H ALA A 15 -18.687 6.557 -6.762 1.00 0.00 H new ATOM 0 HA ALA A 15 -18.520 4.102 -8.046 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.587 3.712 -6.694 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.565 5.254 -7.583 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -16.895 5.239 -5.834 1.00 0.00 H new ATOM 230 N PHE A 16 -19.814 3.969 -5.066 1.00 0.00 N ATOM 231 CA PHE A 16 -20.770 3.307 -4.234 1.00 0.00 C ATOM 232 C PHE A 16 -21.938 2.746 -4.969 1.00 0.00 C ATOM 233 O PHE A 16 -22.291 1.568 -4.937 1.00 0.00 O ATOM 234 CB PHE A 16 -21.186 4.297 -3.133 1.00 0.00 C ATOM 235 CG PHE A 16 -21.869 3.695 -1.953 1.00 0.00 C ATOM 236 CD1 PHE A 16 -21.088 3.135 -0.969 1.00 0.00 C ATOM 237 CD2 PHE A 16 -23.229 3.541 -1.823 1.00 0.00 C ATOM 238 CE1 PHE A 16 -21.633 2.568 0.159 1.00 0.00 C ATOM 239 CE2 PHE A 16 -23.811 2.980 -0.711 1.00 0.00 C ATOM 240 CZ PHE A 16 -23.000 2.544 0.310 1.00 0.00 C ATOM 0 H PHE A 16 -19.524 4.857 -4.656 1.00 0.00 H new ATOM 0 HA PHE A 16 -20.303 2.423 -3.799 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -20.296 4.823 -2.787 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -21.847 5.044 -3.572 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -20.014 3.141 -1.086 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -23.867 3.875 -2.628 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -20.993 2.145 0.920 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -24.884 2.884 -0.641 1.00 0.00 H new ATOM 0 HZ PHE A 16 -23.436 2.183 1.230 1.00 0.00 H new ATOM 250 N SER A 17 -22.625 3.692 -5.634 1.00 0.00 N ATOM 251 CA SER A 17 -23.909 3.455 -6.218 1.00 0.00 C ATOM 252 C SER A 17 -23.865 2.631 -7.459 1.00 0.00 C ATOM 253 O SER A 17 -24.828 1.947 -7.803 1.00 0.00 O ATOM 254 CB SER A 17 -24.593 4.771 -6.626 1.00 0.00 C ATOM 255 OG SER A 17 -23.972 5.515 -7.663 1.00 0.00 O ATOM 0 H SER A 17 -22.281 4.643 -5.769 1.00 0.00 H new ATOM 0 HA SER A 17 -24.455 2.925 -5.438 1.00 0.00 H new ATOM 0 HB2 SER A 17 -25.613 4.543 -6.934 1.00 0.00 H new ATOM 0 HB3 SER A 17 -24.661 5.407 -5.744 1.00 0.00 H new ATOM 0 HG SER A 17 -23.029 5.258 -7.730 1.00 0.00 H new ATOM 261 N LEU A 18 -22.731 2.679 -8.180 1.00 0.00 N ATOM 262 CA LEU A 18 -22.377 1.664 -9.123 1.00 0.00 C ATOM 263 C LEU A 18 -22.156 0.283 -8.609 1.00 0.00 C ATOM 264 O LEU A 18 -22.391 -0.697 -9.314 1.00 0.00 O ATOM 265 CB LEU A 18 -21.044 2.056 -9.782 1.00 0.00 C ATOM 266 CG LEU A 18 -20.837 1.666 -11.256 1.00 0.00 C ATOM 267 CD1 LEU A 18 -21.938 2.251 -12.155 1.00 0.00 C ATOM 268 CD2 LEU A 18 -19.480 2.145 -11.798 1.00 0.00 C ATOM 0 H LEU A 18 -22.049 3.434 -8.107 1.00 0.00 H new ATOM 0 HA LEU A 18 -23.248 1.621 -9.777 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -20.935 3.138 -9.702 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -20.237 1.610 -9.200 1.00 0.00 H new ATOM 0 HG LEU A 18 -20.873 0.577 -11.280 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -21.759 1.955 -13.189 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -22.909 1.875 -11.833 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -21.928 3.339 -12.082 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -19.379 1.847 -12.842 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -19.421 3.231 -11.724 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -18.676 1.697 -11.213 1.00 0.00 H new ATOM 280 N PHE A 19 -21.769 0.129 -7.330 1.00 0.00 N ATOM 281 CA PHE A 19 -21.582 -1.117 -6.653 1.00 0.00 C ATOM 282 C PHE A 19 -22.832 -1.603 -6.005 1.00 0.00 C ATOM 283 O PHE A 19 -23.137 -2.795 -6.032 1.00 0.00 O ATOM 284 CB PHE A 19 -20.417 -1.086 -5.649 1.00 0.00 C ATOM 285 CG PHE A 19 -19.117 -0.701 -6.268 1.00 0.00 C ATOM 286 CD1 PHE A 19 -18.722 -1.004 -7.549 1.00 0.00 C ATOM 287 CD2 PHE A 19 -18.233 0.017 -5.498 1.00 0.00 C ATOM 288 CE1 PHE A 19 -17.510 -0.584 -8.045 1.00 0.00 C ATOM 289 CE2 PHE A 19 -17.036 0.457 -6.013 1.00 0.00 C ATOM 290 CZ PHE A 19 -16.587 0.049 -7.247 1.00 0.00 C ATOM 0 H PHE A 19 -21.574 0.930 -6.729 1.00 0.00 H new ATOM 0 HA PHE A 19 -21.313 -1.832 -7.431 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -20.653 -0.383 -4.850 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -20.316 -2.069 -5.189 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -19.378 -1.585 -8.180 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -18.483 0.239 -4.471 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -17.278 -0.756 -9.086 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -16.433 1.140 -5.433 1.00 0.00 H new ATOM 0 HZ PHE A 19 -15.570 0.216 -7.570 1.00 0.00 H new ATOM 300 N ASP A 20 -23.685 -0.702 -5.486 1.00 0.00 N ATOM 301 CA ASP A 20 -24.915 -0.979 -4.810 1.00 0.00 C ATOM 302 C ASP A 20 -25.936 -1.304 -5.845 1.00 0.00 C ATOM 303 O ASP A 20 -26.410 -0.370 -6.489 1.00 0.00 O ATOM 304 CB ASP A 20 -25.402 0.193 -3.941 1.00 0.00 C ATOM 305 CG ASP A 20 -26.541 -0.225 -3.022 1.00 0.00 C ATOM 306 OD1 ASP A 20 -26.866 -1.438 -2.926 1.00 0.00 O ATOM 307 OD2 ASP A 20 -27.145 0.709 -2.429 1.00 0.00 O ATOM 0 H ASP A 20 -23.499 0.299 -5.544 1.00 0.00 H new ATOM 0 HA ASP A 20 -24.754 -1.814 -4.128 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -24.573 0.573 -3.344 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -25.733 1.009 -4.583 1.00 0.00 H new ATOM 312 N LYS A 21 -26.273 -2.601 -5.963 1.00 0.00 N ATOM 313 CA LYS A 21 -26.909 -3.184 -7.104 1.00 0.00 C ATOM 314 C LYS A 21 -28.383 -3.004 -6.982 1.00 0.00 C ATOM 315 O LYS A 21 -29.032 -2.546 -7.922 1.00 0.00 O ATOM 316 CB LYS A 21 -26.561 -4.658 -7.373 1.00 0.00 C ATOM 317 CG LYS A 21 -27.242 -5.478 -8.471 1.00 0.00 C ATOM 318 CD LYS A 21 -26.523 -5.467 -9.821 1.00 0.00 C ATOM 319 CE LYS A 21 -27.260 -6.330 -10.846 1.00 0.00 C ATOM 320 NZ LYS A 21 -26.424 -6.481 -12.058 1.00 0.00 N ATOM 0 H LYS A 21 -26.092 -3.279 -5.223 1.00 0.00 H new ATOM 0 HA LYS A 21 -26.517 -2.654 -7.972 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -25.491 -4.693 -7.576 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -26.726 -5.193 -6.437 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -27.331 -6.510 -8.131 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -28.255 -5.100 -8.612 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -26.450 -4.444 -10.189 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -25.505 -5.835 -9.697 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -27.482 -7.309 -10.420 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -28.214 -5.871 -11.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -26.926 -7.068 -12.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -26.234 -5.544 -12.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -25.524 -6.937 -11.805 1.00 0.00 H new ATOM 334 N ASP A 22 -28.898 -3.279 -5.770 1.00 0.00 N ATOM 335 CA ASP A 22 -30.299 -3.133 -5.526 1.00 0.00 C ATOM 336 C ASP A 22 -30.616 -1.720 -5.173 1.00 0.00 C ATOM 337 O ASP A 22 -31.635 -1.172 -5.589 1.00 0.00 O ATOM 338 CB ASP A 22 -30.759 -4.191 -4.510 1.00 0.00 C ATOM 339 CG ASP A 22 -29.812 -4.383 -3.335 1.00 0.00 C ATOM 340 OD1 ASP A 22 -28.882 -3.575 -3.067 1.00 0.00 O ATOM 341 OD2 ASP A 22 -29.943 -5.393 -2.593 1.00 0.00 O ATOM 0 H ASP A 22 -28.353 -3.598 -4.969 1.00 0.00 H new ATOM 0 HA ASP A 22 -30.880 -3.328 -6.428 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -31.740 -3.909 -4.128 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -30.879 -5.144 -5.025 1.00 0.00 H new ATOM 346 N GLY A 23 -29.789 -1.038 -4.360 1.00 0.00 N ATOM 347 CA GLY A 23 -29.816 0.368 -4.100 1.00 0.00 C ATOM 348 C GLY A 23 -30.305 0.756 -2.747 1.00 0.00 C ATOM 349 O GLY A 23 -30.758 1.864 -2.464 1.00 0.00 O ATOM 0 H GLY A 23 -29.044 -1.508 -3.845 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -28.809 0.765 -4.232 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -30.448 0.847 -4.848 1.00 0.00 H new ATOM 353 N ASP A 24 -30.060 -0.123 -1.759 1.00 0.00 N ATOM 354 CA ASP A 24 -30.514 -0.025 -0.407 1.00 0.00 C ATOM 355 C ASP A 24 -29.720 0.951 0.393 1.00 0.00 C ATOM 356 O ASP A 24 -30.045 1.218 1.549 1.00 0.00 O ATOM 357 CB ASP A 24 -30.632 -1.387 0.298 1.00 0.00 C ATOM 358 CG ASP A 24 -29.424 -2.310 0.228 1.00 0.00 C ATOM 359 OD1 ASP A 24 -28.394 -2.071 -0.457 1.00 0.00 O ATOM 360 OD2 ASP A 24 -29.490 -3.327 0.969 1.00 0.00 O ATOM 0 H ASP A 24 -29.504 -0.963 -1.918 1.00 0.00 H new ATOM 0 HA ASP A 24 -31.529 0.368 -0.471 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -30.859 -1.206 1.349 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -31.486 -1.915 -0.126 1.00 0.00 H new ATOM 365 N GLY A 25 -28.576 1.445 -0.112 1.00 0.00 N ATOM 366 CA GLY A 25 -27.627 2.314 0.511 1.00 0.00 C ATOM 367 C GLY A 25 -26.511 1.665 1.256 1.00 0.00 C ATOM 368 O GLY A 25 -25.736 2.284 1.983 1.00 0.00 O ATOM 0 H GLY A 25 -28.287 1.207 -1.061 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -27.195 2.954 -0.259 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -28.164 2.964 1.202 1.00 0.00 H new ATOM 372 N THR A 26 -26.341 0.354 1.010 1.00 0.00 N ATOM 373 CA THR A 26 -25.285 -0.369 1.649 1.00 0.00 C ATOM 374 C THR A 26 -24.702 -1.468 0.829 1.00 0.00 C ATOM 375 O THR A 26 -25.414 -1.892 -0.079 1.00 0.00 O ATOM 376 CB THR A 26 -25.594 -0.778 3.059 1.00 0.00 C ATOM 377 OG1 THR A 26 -24.479 -1.104 3.875 1.00 0.00 O ATOM 378 CG2 THR A 26 -26.600 -1.940 3.111 1.00 0.00 C ATOM 0 H THR A 26 -26.923 -0.198 0.380 1.00 0.00 H new ATOM 0 HA THR A 26 -24.482 0.364 1.732 1.00 0.00 H new ATOM 0 HB THR A 26 -26.024 0.130 3.481 1.00 0.00 H new ATOM 0 HG1 THR A 26 -24.704 -1.867 4.447 1.00 0.00 H new ATOM 0 HG21 THR A 26 -26.796 -2.205 4.150 1.00 0.00 H new ATOM 0 HG22 THR A 26 -27.531 -1.637 2.632 1.00 0.00 H new ATOM 0 HG23 THR A 26 -26.187 -2.803 2.588 1.00 0.00 H new ATOM 386 N ILE A 27 -23.435 -1.863 1.050 1.00 0.00 N ATOM 387 CA ILE A 27 -22.700 -2.779 0.234 1.00 0.00 C ATOM 388 C ILE A 27 -22.511 -4.084 0.930 1.00 0.00 C ATOM 389 O ILE A 27 -21.710 -4.129 1.862 1.00 0.00 O ATOM 390 CB ILE A 27 -21.377 -2.236 -0.217 1.00 0.00 C ATOM 391 CG1 ILE A 27 -21.283 -0.750 -0.603 1.00 0.00 C ATOM 392 CG2 ILE A 27 -21.069 -3.024 -1.502 1.00 0.00 C ATOM 393 CD1 ILE A 27 -19.797 -0.400 -0.677 1.00 0.00 C ATOM 0 H ILE A 27 -22.893 -1.523 1.844 1.00 0.00 H new ATOM 0 HA ILE A 27 -23.302 -2.934 -0.661 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.704 -2.335 0.634 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -21.770 -0.569 -1.561 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -21.789 -0.127 0.134 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -20.113 -2.695 -1.910 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -21.019 -4.088 -1.273 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -21.856 -2.847 -2.235 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -19.683 0.649 -0.949 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -19.333 -0.575 0.294 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -19.313 -1.024 -1.428 1.00 0.00 H new ATOM 405 N THR A 28 -22.965 -5.212 0.356 1.00 0.00 N ATOM 406 CA THR A 28 -22.835 -6.519 0.923 1.00 0.00 C ATOM 407 C THR A 28 -21.593 -7.243 0.531 1.00 0.00 C ATOM 408 O THR A 28 -20.989 -6.805 -0.447 1.00 0.00 O ATOM 409 CB THR A 28 -24.007 -7.400 0.605 1.00 0.00 C ATOM 410 OG1 THR A 28 -24.329 -7.349 -0.777 1.00 0.00 O ATOM 411 CG2 THR A 28 -25.235 -7.047 1.461 1.00 0.00 C ATOM 0 H THR A 28 -23.445 -5.213 -0.544 1.00 0.00 H new ATOM 0 HA THR A 28 -22.788 -6.323 1.994 1.00 0.00 H new ATOM 0 HB THR A 28 -23.715 -8.421 0.850 1.00 0.00 H new ATOM 0 HG1 THR A 28 -24.619 -6.443 -1.012 1.00 0.00 H new ATOM 0 HG21 THR A 28 -26.062 -7.707 1.201 1.00 0.00 H new ATOM 0 HG22 THR A 28 -24.991 -7.170 2.516 1.00 0.00 H new ATOM 0 HG23 THR A 28 -25.524 -6.013 1.274 1.00 0.00 H new ATOM 419 N THR A 29 -21.278 -8.394 1.151 1.00 0.00 N ATOM 420 CA THR A 29 -20.304 -9.375 0.784 1.00 0.00 C ATOM 421 C THR A 29 -20.439 -9.831 -0.628 1.00 0.00 C ATOM 422 O THR A 29 -19.413 -10.039 -1.273 1.00 0.00 O ATOM 423 CB THR A 29 -20.033 -10.536 1.694 1.00 0.00 C ATOM 424 OG1 THR A 29 -20.002 -10.157 3.062 1.00 0.00 O ATOM 425 CG2 THR A 29 -18.606 -11.073 1.493 1.00 0.00 C ATOM 0 H THR A 29 -21.763 -8.665 2.006 1.00 0.00 H new ATOM 0 HA THR A 29 -19.404 -8.774 0.913 1.00 0.00 H new ATOM 0 HB THR A 29 -20.825 -11.248 1.461 1.00 0.00 H new ATOM 0 HG1 THR A 29 -19.824 -10.946 3.616 1.00 0.00 H new ATOM 0 HG21 THR A 29 -18.436 -11.914 2.165 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.483 -11.402 0.461 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.886 -10.284 1.710 1.00 0.00 H new ATOM 433 N LYS A 30 -21.671 -10.109 -1.090 1.00 0.00 N ATOM 434 CA LYS A 30 -22.039 -10.654 -2.360 1.00 0.00 C ATOM 435 C LYS A 30 -21.853 -9.574 -3.368 1.00 0.00 C ATOM 436 O LYS A 30 -21.450 -9.827 -4.503 1.00 0.00 O ATOM 437 CB LYS A 30 -23.466 -11.224 -2.294 1.00 0.00 C ATOM 438 CG LYS A 30 -23.508 -12.559 -1.547 1.00 0.00 C ATOM 439 CD LYS A 30 -24.895 -13.196 -1.657 1.00 0.00 C ATOM 440 CE LYS A 30 -26.014 -12.398 -0.985 1.00 0.00 C ATOM 441 NZ LYS A 30 -27.286 -13.009 -1.430 1.00 0.00 N ATOM 0 H LYS A 30 -22.493 -9.933 -0.512 1.00 0.00 H new ATOM 0 HA LYS A 30 -21.413 -11.498 -2.651 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -24.121 -10.508 -1.797 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -23.851 -11.360 -3.305 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -22.758 -13.235 -1.958 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -23.256 -12.403 -0.498 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -25.140 -13.324 -2.711 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -24.860 -14.192 -1.215 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -25.922 -12.438 0.100 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -25.967 -11.347 -1.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -28.085 -12.501 -0.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -27.356 -12.949 -2.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -27.313 -14.007 -1.138 1.00 0.00 H new ATOM 455 N GLU A 31 -22.075 -8.296 -3.010 1.00 0.00 N ATOM 456 CA GLU A 31 -21.827 -7.229 -3.928 1.00 0.00 C ATOM 457 C GLU A 31 -20.393 -6.830 -3.990 1.00 0.00 C ATOM 458 O GLU A 31 -19.899 -6.406 -5.034 1.00 0.00 O ATOM 459 CB GLU A 31 -22.665 -5.997 -3.547 1.00 0.00 C ATOM 460 CG GLU A 31 -24.157 -6.124 -3.863 1.00 0.00 C ATOM 461 CD GLU A 31 -24.988 -5.024 -3.219 1.00 0.00 C ATOM 462 OE1 GLU A 31 -24.841 -4.855 -1.979 1.00 0.00 O ATOM 463 OE2 GLU A 31 -25.937 -4.466 -3.832 1.00 0.00 O ATOM 0 H GLU A 31 -22.422 -8.004 -2.096 1.00 0.00 H new ATOM 0 HA GLU A 31 -22.110 -7.603 -4.912 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -22.547 -5.808 -2.480 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -22.268 -5.127 -4.070 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -24.299 -6.096 -4.943 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -24.516 -7.094 -3.519 1.00 0.00 H new ATOM 470 N LEU A 32 -19.626 -6.867 -2.885 1.00 0.00 N ATOM 471 CA LEU A 32 -18.219 -6.615 -2.835 1.00 0.00 C ATOM 472 C LEU A 32 -17.487 -7.712 -3.530 1.00 0.00 C ATOM 473 O LEU A 32 -16.470 -7.465 -4.176 1.00 0.00 O ATOM 474 CB LEU A 32 -17.796 -6.549 -1.358 1.00 0.00 C ATOM 475 CG LEU A 32 -16.640 -5.558 -1.144 1.00 0.00 C ATOM 476 CD1 LEU A 32 -17.033 -4.102 -1.445 1.00 0.00 C ATOM 477 CD2 LEU A 32 -16.026 -5.715 0.257 1.00 0.00 C ATOM 0 H LEU A 32 -20.015 -7.087 -1.968 1.00 0.00 H new ATOM 0 HA LEU A 32 -17.983 -5.674 -3.332 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -18.649 -6.251 -0.748 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -17.493 -7.540 -1.021 1.00 0.00 H new ATOM 0 HG LEU A 32 -15.870 -5.811 -1.873 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -16.175 -3.451 -1.275 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -17.352 -4.019 -2.484 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -17.851 -3.803 -0.789 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -15.211 -5.001 0.379 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.789 -5.527 1.012 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -15.642 -6.728 0.374 1.00 0.00 H new ATOM 489 N GLY A 33 -18.031 -8.942 -3.527 1.00 0.00 N ATOM 490 CA GLY A 33 -17.722 -9.993 -4.446 1.00 0.00 C ATOM 491 C GLY A 33 -17.793 -9.646 -5.894 1.00 0.00 C ATOM 492 O GLY A 33 -16.875 -9.972 -6.644 1.00 0.00 O ATOM 0 H GLY A 33 -18.731 -9.219 -2.839 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.716 -10.352 -4.229 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -18.404 -10.823 -4.259 1.00 0.00 H new ATOM 496 N THR A 34 -18.841 -8.899 -6.284 1.00 0.00 N ATOM 497 CA THR A 34 -18.960 -8.400 -7.619 1.00 0.00 C ATOM 498 C THR A 34 -17.906 -7.393 -7.929 1.00 0.00 C ATOM 499 O THR A 34 -17.414 -7.348 -9.055 1.00 0.00 O ATOM 500 CB THR A 34 -20.363 -7.944 -7.893 1.00 0.00 C ATOM 501 OG1 THR A 34 -21.279 -8.978 -7.562 1.00 0.00 O ATOM 502 CG2 THR A 34 -20.606 -7.643 -9.381 1.00 0.00 C ATOM 0 H THR A 34 -19.612 -8.639 -5.669 1.00 0.00 H new ATOM 0 HA THR A 34 -18.773 -9.214 -8.320 1.00 0.00 H new ATOM 0 HB THR A 34 -20.506 -7.042 -7.297 1.00 0.00 H new ATOM 0 HG1 THR A 34 -21.336 -9.065 -6.588 1.00 0.00 H new ATOM 0 HG21 THR A 34 -21.636 -7.317 -9.523 1.00 0.00 H new ATOM 0 HG22 THR A 34 -19.928 -6.855 -9.708 1.00 0.00 H new ATOM 0 HG23 THR A 34 -20.426 -8.543 -9.968 1.00 0.00 H new ATOM 510 N VAL A 35 -17.513 -6.583 -6.930 1.00 0.00 N ATOM 511 CA VAL A 35 -16.500 -5.589 -7.104 1.00 0.00 C ATOM 512 C VAL A 35 -15.190 -6.161 -7.525 1.00 0.00 C ATOM 513 O VAL A 35 -14.546 -5.652 -8.441 1.00 0.00 O ATOM 514 CB VAL A 35 -16.247 -4.786 -5.863 1.00 0.00 C ATOM 515 CG1 VAL A 35 -15.079 -3.802 -6.044 1.00 0.00 C ATOM 516 CG2 VAL A 35 -17.556 -4.021 -5.601 1.00 0.00 C ATOM 0 H VAL A 35 -17.904 -6.618 -5.988 1.00 0.00 H new ATOM 0 HA VAL A 35 -16.900 -4.948 -7.890 1.00 0.00 H new ATOM 0 HB VAL A 35 -15.968 -5.432 -5.031 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -14.930 -3.241 -5.122 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -14.171 -4.355 -6.283 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -15.307 -3.112 -6.856 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -17.447 -3.409 -4.705 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -17.779 -3.380 -6.453 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -18.370 -4.731 -5.458 1.00 0.00 H new ATOM 526 N MET A 36 -14.821 -7.292 -6.897 1.00 0.00 N ATOM 527 CA MET A 36 -13.717 -8.169 -7.132 1.00 0.00 C ATOM 528 C MET A 36 -13.849 -8.843 -8.455 1.00 0.00 C ATOM 529 O MET A 36 -12.952 -8.845 -9.296 1.00 0.00 O ATOM 530 CB MET A 36 -13.530 -9.154 -5.965 1.00 0.00 C ATOM 531 CG MET A 36 -13.304 -8.464 -4.618 1.00 0.00 C ATOM 532 SD MET A 36 -11.604 -7.846 -4.433 1.00 0.00 S ATOM 533 CE MET A 36 -12.041 -6.085 -4.491 1.00 0.00 C ATOM 0 H MET A 36 -15.380 -7.634 -6.115 1.00 0.00 H new ATOM 0 HA MET A 36 -12.803 -7.577 -7.176 1.00 0.00 H new ATOM 0 HB2 MET A 36 -14.410 -9.793 -5.894 1.00 0.00 H new ATOM 0 HB3 MET A 36 -12.681 -9.803 -6.179 1.00 0.00 H new ATOM 0 HG2 MET A 36 -14.003 -7.634 -4.516 1.00 0.00 H new ATOM 0 HG3 MET A 36 -13.523 -9.165 -3.812 1.00 0.00 H new ATOM 0 HE1 MET A 36 -11.138 -5.483 -4.394 1.00 0.00 H new ATOM 0 HE2 MET A 36 -12.526 -5.862 -5.441 1.00 0.00 H new ATOM 0 HE3 MET A 36 -12.722 -5.852 -3.672 1.00 0.00 H new ATOM 543 N ARG A 37 -14.983 -9.472 -8.809 1.00 0.00 N ATOM 544 CA ARG A 37 -15.194 -10.053 -10.098 1.00 0.00 C ATOM 545 C ARG A 37 -15.147 -9.096 -11.239 1.00 0.00 C ATOM 546 O ARG A 37 -14.494 -9.333 -12.254 1.00 0.00 O ATOM 547 CB ARG A 37 -16.563 -10.719 -10.316 1.00 0.00 C ATOM 548 CG ARG A 37 -16.631 -12.012 -9.499 1.00 0.00 C ATOM 549 CD ARG A 37 -18.058 -12.411 -9.116 1.00 0.00 C ATOM 550 NE ARG A 37 -17.847 -13.537 -8.164 1.00 0.00 N ATOM 551 CZ ARG A 37 -18.859 -14.235 -7.570 1.00 0.00 C ATOM 552 NH1 ARG A 37 -20.162 -14.021 -7.917 1.00 0.00 N ATOM 553 NH2 ARG A 37 -18.740 -15.244 -6.658 1.00 0.00 N ATOM 0 H ARG A 37 -15.778 -9.580 -8.179 1.00 0.00 H new ATOM 0 HA ARG A 37 -14.370 -10.767 -10.091 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -17.362 -10.042 -10.014 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -16.711 -10.935 -11.374 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -16.176 -12.820 -10.072 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -16.039 -11.892 -8.592 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -18.597 -11.585 -8.651 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -18.638 -12.721 -9.986 1.00 0.00 H new ATOM 0 HE ARG A 37 -16.888 -13.803 -7.942 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -20.393 -13.330 -8.631 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -20.905 -14.552 -7.462 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -17.816 -15.549 -6.352 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -19.575 -15.693 -6.282 1.00 0.00 H new ATOM 567 N SER A 38 -15.762 -7.907 -11.098 1.00 0.00 N ATOM 568 CA SER A 38 -15.596 -6.821 -12.013 1.00 0.00 C ATOM 569 C SER A 38 -14.197 -6.349 -12.219 1.00 0.00 C ATOM 570 O SER A 38 -13.827 -5.820 -13.266 1.00 0.00 O ATOM 571 CB SER A 38 -16.344 -5.523 -11.667 1.00 0.00 C ATOM 572 OG SER A 38 -17.699 -5.882 -11.436 1.00 0.00 O ATOM 0 H SER A 38 -16.393 -7.696 -10.325 1.00 0.00 H new ATOM 0 HA SER A 38 -16.005 -7.309 -12.898 1.00 0.00 H new ATOM 0 HB2 SER A 38 -15.913 -5.051 -10.784 1.00 0.00 H new ATOM 0 HB3 SER A 38 -16.268 -4.803 -12.482 1.00 0.00 H new ATOM 0 HG SER A 38 -17.775 -6.331 -10.568 1.00 0.00 H new ATOM 578 N LEU A 39 -13.317 -6.383 -11.203 1.00 0.00 N ATOM 579 CA LEU A 39 -11.959 -5.985 -11.409 1.00 0.00 C ATOM 580 C LEU A 39 -11.149 -7.047 -12.069 1.00 0.00 C ATOM 581 O LEU A 39 -10.099 -6.773 -12.648 1.00 0.00 O ATOM 582 CB LEU A 39 -11.246 -5.591 -10.104 1.00 0.00 C ATOM 583 CG LEU A 39 -11.850 -4.285 -9.562 1.00 0.00 C ATOM 584 CD1 LEU A 39 -11.496 -4.119 -8.074 1.00 0.00 C ATOM 585 CD2 LEU A 39 -11.312 -3.013 -10.239 1.00 0.00 C ATOM 0 H LEU A 39 -13.540 -6.681 -10.253 1.00 0.00 H new ATOM 0 HA LEU A 39 -12.027 -5.114 -12.060 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -11.351 -6.386 -9.366 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -10.179 -5.463 -10.285 1.00 0.00 H new ATOM 0 HG LEU A 39 -12.919 -4.379 -9.754 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -11.928 -3.191 -7.699 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -11.896 -4.961 -7.509 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -10.413 -4.087 -7.959 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -11.789 -2.137 -9.799 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -10.234 -2.951 -10.093 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -11.532 -3.048 -11.306 1.00 0.00 H new ATOM 597 N GLY A 40 -11.560 -8.326 -11.993 1.00 0.00 N ATOM 598 CA GLY A 40 -10.723 -9.435 -12.330 1.00 0.00 C ATOM 599 C GLY A 40 -10.343 -10.415 -11.274 1.00 0.00 C ATOM 600 O GLY A 40 -9.793 -11.507 -11.408 1.00 0.00 O ATOM 0 H GLY A 40 -12.496 -8.595 -11.690 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -11.220 -9.989 -13.126 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.801 -9.033 -12.749 1.00 0.00 H new ATOM 604 N GLN A 41 -10.653 -10.084 -10.007 1.00 0.00 N ATOM 605 CA GLN A 41 -10.152 -10.787 -8.868 1.00 0.00 C ATOM 606 C GLN A 41 -10.946 -11.974 -8.443 1.00 0.00 C ATOM 607 O GLN A 41 -12.096 -12.141 -8.847 1.00 0.00 O ATOM 608 CB GLN A 41 -10.056 -9.802 -7.690 1.00 0.00 C ATOM 609 CG GLN A 41 -9.234 -8.556 -8.027 1.00 0.00 C ATOM 610 CD GLN A 41 -7.826 -9.045 -8.333 1.00 0.00 C ATOM 611 OE1 GLN A 41 -7.508 -9.173 -9.515 1.00 0.00 O ATOM 612 NE2 GLN A 41 -6.948 -9.160 -7.301 1.00 0.00 N ATOM 0 H GLN A 41 -11.269 -9.306 -9.769 1.00 0.00 H new ATOM 0 HA GLN A 41 -9.182 -11.183 -9.168 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -11.060 -9.500 -7.392 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.608 -10.308 -6.835 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.658 -8.030 -8.883 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.230 -7.855 -7.192 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -7.272 -9.043 -6.341 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -5.966 -9.363 -7.487 1.00 0.00 H new ATOM 621 N ASN A 42 -10.401 -12.690 -7.443 1.00 0.00 N ATOM 622 CA ASN A 42 -10.967 -13.817 -6.769 1.00 0.00 C ATOM 623 C ASN A 42 -10.446 -14.130 -5.408 1.00 0.00 C ATOM 624 O ASN A 42 -9.819 -15.174 -5.233 1.00 0.00 O ATOM 625 CB ASN A 42 -10.913 -15.042 -7.697 1.00 0.00 C ATOM 626 CG ASN A 42 -11.855 -16.169 -7.298 1.00 0.00 C ATOM 627 OD1 ASN A 42 -12.989 -15.852 -6.941 1.00 0.00 O ATOM 628 ND2 ASN A 42 -11.468 -17.455 -7.507 1.00 0.00 N ATOM 0 H ASN A 42 -9.479 -12.456 -7.074 1.00 0.00 H new ATOM 0 HA ASN A 42 -11.996 -13.529 -6.556 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -11.153 -14.726 -8.712 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -9.893 -15.425 -7.715 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -12.132 -18.216 -7.368 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -10.513 -17.659 -7.803 1.00 0.00 H new ATOM 635 N PRO A 43 -10.562 -13.263 -4.447 1.00 0.00 N ATOM 636 CA PRO A 43 -10.164 -13.588 -3.109 1.00 0.00 C ATOM 637 C PRO A 43 -11.157 -14.407 -2.358 1.00 0.00 C ATOM 638 O PRO A 43 -12.227 -14.699 -2.890 1.00 0.00 O ATOM 639 CB PRO A 43 -10.062 -12.234 -2.411 1.00 0.00 C ATOM 640 CG PRO A 43 -11.008 -11.319 -3.206 1.00 0.00 C ATOM 641 CD PRO A 43 -10.866 -11.853 -4.640 1.00 0.00 C ATOM 0 HA PRO A 43 -9.247 -14.177 -3.138 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -10.362 -12.303 -1.365 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -9.040 -11.856 -2.425 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -12.035 -11.389 -2.848 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -10.715 -10.272 -3.133 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -11.783 -11.715 -5.213 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -10.071 -11.341 -5.182 1.00 0.00 H new ATOM 649 N THR A 44 -10.786 -14.876 -1.153 1.00 0.00 N ATOM 650 CA THR A 44 -11.679 -15.741 -0.446 1.00 0.00 C ATOM 651 C THR A 44 -12.677 -15.006 0.380 1.00 0.00 C ATOM 652 O THR A 44 -12.509 -13.869 0.819 1.00 0.00 O ATOM 653 CB THR A 44 -10.955 -16.643 0.509 1.00 0.00 C ATOM 654 OG1 THR A 44 -9.830 -16.108 1.191 1.00 0.00 O ATOM 655 CG2 THR A 44 -10.274 -17.704 -0.372 1.00 0.00 C ATOM 0 H THR A 44 -9.905 -14.668 -0.683 1.00 0.00 H new ATOM 0 HA THR A 44 -12.175 -16.305 -1.236 1.00 0.00 H new ATOM 0 HB THR A 44 -11.710 -16.932 1.241 1.00 0.00 H new ATOM 0 HG1 THR A 44 -9.450 -16.792 1.781 1.00 0.00 H new ATOM 0 HG21 THR A 44 -9.723 -18.402 0.259 1.00 0.00 H new ATOM 0 HG22 THR A 44 -11.031 -18.247 -0.939 1.00 0.00 H new ATOM 0 HG23 THR A 44 -9.585 -17.217 -1.062 1.00 0.00 H new ATOM 663 N GLU A 45 -13.820 -15.654 0.668 1.00 0.00 N ATOM 664 CA GLU A 45 -14.911 -15.080 1.392 1.00 0.00 C ATOM 665 C GLU A 45 -14.671 -14.701 2.813 1.00 0.00 C ATOM 666 O GLU A 45 -15.066 -13.619 3.243 1.00 0.00 O ATOM 667 CB GLU A 45 -16.169 -15.933 1.153 1.00 0.00 C ATOM 668 CG GLU A 45 -17.464 -15.330 1.698 1.00 0.00 C ATOM 669 CD GLU A 45 -18.603 -16.249 1.279 1.00 0.00 C ATOM 670 OE1 GLU A 45 -18.851 -16.326 0.046 1.00 0.00 O ATOM 671 OE2 GLU A 45 -19.180 -16.982 2.125 1.00 0.00 O ATOM 0 H GLU A 45 -13.991 -16.619 0.384 1.00 0.00 H new ATOM 0 HA GLU A 45 -15.062 -14.083 0.977 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -16.283 -16.095 0.081 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -16.020 -16.912 1.609 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -17.420 -15.243 2.784 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -17.616 -14.325 1.303 1.00 0.00 H new ATOM 678 N ALA A 46 -13.895 -15.508 3.558 1.00 0.00 N ATOM 679 CA ALA A 46 -13.425 -15.228 4.879 1.00 0.00 C ATOM 680 C ALA A 46 -12.578 -14.001 4.863 1.00 0.00 C ATOM 681 O ALA A 46 -12.688 -13.124 5.718 1.00 0.00 O ATOM 682 CB ALA A 46 -12.634 -16.358 5.559 1.00 0.00 C ATOM 0 H ALA A 46 -13.576 -16.414 3.215 1.00 0.00 H new ATOM 0 HA ALA A 46 -14.331 -15.099 5.471 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -12.326 -16.039 6.555 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -13.263 -17.244 5.640 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -11.751 -16.593 4.964 1.00 0.00 H new ATOM 688 N GLU A 47 -11.631 -13.900 3.914 1.00 0.00 N ATOM 689 CA GLU A 47 -10.847 -12.705 3.885 1.00 0.00 C ATOM 690 C GLU A 47 -11.590 -11.455 3.558 1.00 0.00 C ATOM 691 O GLU A 47 -11.215 -10.358 3.971 1.00 0.00 O ATOM 692 CB GLU A 47 -9.670 -12.986 2.936 1.00 0.00 C ATOM 693 CG GLU A 47 -8.564 -13.802 3.608 1.00 0.00 C ATOM 694 CD GLU A 47 -7.412 -14.148 2.676 1.00 0.00 C ATOM 695 OE1 GLU A 47 -6.678 -13.190 2.314 1.00 0.00 O ATOM 696 OE2 GLU A 47 -7.326 -15.330 2.246 1.00 0.00 O ATOM 0 H GLU A 47 -11.415 -14.601 3.205 1.00 0.00 H new ATOM 0 HA GLU A 47 -10.499 -12.483 4.894 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -10.033 -13.523 2.060 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -9.258 -12.041 2.583 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -8.176 -13.242 4.459 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -8.992 -14.724 4.001 1.00 0.00 H new ATOM 703 N LEU A 48 -12.535 -11.527 2.604 1.00 0.00 N ATOM 704 CA LEU A 48 -13.377 -10.439 2.213 1.00 0.00 C ATOM 705 C LEU A 48 -14.234 -9.936 3.323 1.00 0.00 C ATOM 706 O LEU A 48 -14.346 -8.733 3.555 1.00 0.00 O ATOM 707 CB LEU A 48 -14.269 -10.798 1.013 1.00 0.00 C ATOM 708 CG LEU A 48 -14.807 -9.620 0.184 1.00 0.00 C ATOM 709 CD1 LEU A 48 -13.712 -8.673 -0.335 1.00 0.00 C ATOM 710 CD2 LEU A 48 -15.641 -10.060 -1.031 1.00 0.00 C ATOM 0 H LEU A 48 -12.721 -12.383 2.081 1.00 0.00 H new ATOM 0 HA LEU A 48 -12.690 -9.643 1.924 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -13.703 -11.452 0.350 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -15.119 -11.374 1.379 1.00 0.00 H new ATOM 0 HG LEU A 48 -15.438 -9.090 0.898 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -14.170 -7.868 -0.910 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -13.166 -8.251 0.509 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -13.023 -9.228 -0.972 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -15.989 -9.180 -1.571 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -15.027 -10.672 -1.692 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -16.499 -10.641 -0.692 1.00 0.00 H new ATOM 722 N GLN A 49 -14.921 -10.807 4.084 1.00 0.00 N ATOM 723 CA GLN A 49 -15.553 -10.469 5.321 1.00 0.00 C ATOM 724 C GLN A 49 -14.683 -9.690 6.247 1.00 0.00 C ATOM 725 O GLN A 49 -15.135 -8.736 6.878 1.00 0.00 O ATOM 726 CB GLN A 49 -16.131 -11.666 6.094 1.00 0.00 C ATOM 727 CG GLN A 49 -17.308 -12.291 5.342 1.00 0.00 C ATOM 728 CD GLN A 49 -17.815 -13.658 5.781 1.00 0.00 C ATOM 729 OE1 GLN A 49 -16.986 -14.704 5.521 1.00 0.00 O flip ATOM 730 NE2 GLN A 49 -18.878 -13.892 6.353 1.00 0.00 N flip ATOM 0 H GLN A 49 -15.041 -11.787 3.826 1.00 0.00 H new ATOM 0 HA GLN A 49 -16.381 -9.842 4.991 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -15.353 -12.415 6.246 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -16.458 -11.341 7.082 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -18.144 -11.594 5.400 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -17.027 -12.365 4.291 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -19.523 -13.130 6.563 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -19.115 -14.848 6.618 1.00 0.00 H new ATOM 739 N ASP A 50 -13.384 -9.998 6.409 1.00 0.00 N ATOM 740 CA ASP A 50 -12.470 -9.316 7.271 1.00 0.00 C ATOM 741 C ASP A 50 -12.201 -7.904 6.877 1.00 0.00 C ATOM 742 O ASP A 50 -12.014 -7.003 7.693 1.00 0.00 O ATOM 743 CB ASP A 50 -11.099 -10.013 7.308 1.00 0.00 C ATOM 744 CG ASP A 50 -10.265 -9.644 8.527 1.00 0.00 C ATOM 745 OD1 ASP A 50 -10.546 -10.025 9.695 1.00 0.00 O ATOM 746 OD2 ASP A 50 -9.260 -8.924 8.288 1.00 0.00 O ATOM 0 H ASP A 50 -12.946 -10.770 5.907 1.00 0.00 H new ATOM 0 HA ASP A 50 -12.967 -9.336 8.241 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -11.248 -11.093 7.293 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -10.544 -9.755 6.406 1.00 0.00 H new ATOM 751 N MET A 51 -12.255 -7.604 5.567 1.00 0.00 N ATOM 752 CA MET A 51 -12.111 -6.312 4.972 1.00 0.00 C ATOM 753 C MET A 51 -13.269 -5.481 5.405 1.00 0.00 C ATOM 754 O MET A 51 -12.959 -4.320 5.668 1.00 0.00 O ATOM 755 CB MET A 51 -12.120 -6.175 3.440 1.00 0.00 C ATOM 756 CG MET A 51 -10.679 -6.392 2.974 1.00 0.00 C ATOM 757 SD MET A 51 -10.566 -6.807 1.207 1.00 0.00 S ATOM 758 CE MET A 51 -11.172 -5.290 0.415 1.00 0.00 C ATOM 0 H MET A 51 -12.413 -8.328 4.866 1.00 0.00 H new ATOM 0 HA MET A 51 -11.112 -6.022 5.299 1.00 0.00 H new ATOM 0 HB2 MET A 51 -12.788 -6.909 2.989 1.00 0.00 H new ATOM 0 HB3 MET A 51 -12.480 -5.191 3.141 1.00 0.00 H new ATOM 0 HG2 MET A 51 -10.099 -5.490 3.169 1.00 0.00 H new ATOM 0 HG3 MET A 51 -10.229 -7.193 3.560 1.00 0.00 H new ATOM 0 HE1 MET A 51 -11.154 -5.413 -0.668 1.00 0.00 H new ATOM 0 HE2 MET A 51 -12.193 -5.093 0.741 1.00 0.00 H new ATOM 0 HE3 MET A 51 -10.533 -4.453 0.696 1.00 0.00 H new ATOM 768 N ILE A 52 -14.523 -5.966 5.361 1.00 0.00 N ATOM 769 CA ILE A 52 -15.758 -5.415 5.825 1.00 0.00 C ATOM 770 C ILE A 52 -15.718 -5.175 7.295 1.00 0.00 C ATOM 771 O ILE A 52 -15.777 -4.061 7.812 1.00 0.00 O ATOM 772 CB ILE A 52 -16.880 -6.311 5.392 1.00 0.00 C ATOM 773 CG1 ILE A 52 -16.910 -6.406 3.857 1.00 0.00 C ATOM 774 CG2 ILE A 52 -18.167 -5.632 5.888 1.00 0.00 C ATOM 775 CD1 ILE A 52 -17.942 -7.453 3.441 1.00 0.00 C ATOM 0 H ILE A 52 -14.687 -6.879 4.936 1.00 0.00 H new ATOM 0 HA ILE A 52 -15.928 -4.435 5.380 1.00 0.00 H new ATOM 0 HB ILE A 52 -16.768 -7.319 5.791 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -17.162 -5.437 3.425 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -15.925 -6.678 3.478 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -19.029 -6.236 5.605 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -18.132 -5.535 6.973 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -18.253 -4.643 5.438 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -17.969 -7.526 2.354 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -17.669 -8.420 3.863 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -18.925 -7.161 3.809 1.00 0.00 H new ATOM 787 N ASN A 53 -15.576 -6.284 8.044 1.00 0.00 N ATOM 788 CA ASN A 53 -15.721 -6.360 9.465 1.00 0.00 C ATOM 789 C ASN A 53 -14.703 -5.553 10.194 1.00 0.00 C ATOM 790 O ASN A 53 -14.964 -5.300 11.369 1.00 0.00 O ATOM 791 CB ASN A 53 -15.675 -7.812 9.968 1.00 0.00 C ATOM 792 CG ASN A 53 -16.892 -8.602 9.507 1.00 0.00 C ATOM 793 OD1 ASN A 53 -17.937 -8.009 9.242 1.00 0.00 O ATOM 794 ND2 ASN A 53 -16.759 -9.942 9.321 1.00 0.00 N ATOM 0 H ASN A 53 -15.345 -7.186 7.628 1.00 0.00 H new ATOM 0 HA ASN A 53 -16.703 -5.938 9.678 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -14.768 -8.295 9.605 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -15.626 -7.819 11.057 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -17.539 -10.486 8.952 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -15.879 -10.404 9.551 1.00 0.00 H new ATOM 801 N GLU A 54 -13.580 -5.151 9.571 1.00 0.00 N ATOM 802 CA GLU A 54 -12.773 -4.051 10.000 1.00 0.00 C ATOM 803 C GLU A 54 -13.456 -2.748 10.239 1.00 0.00 C ATOM 804 O GLU A 54 -13.202 -2.114 11.262 1.00 0.00 O ATOM 805 CB GLU A 54 -11.472 -3.991 9.183 1.00 0.00 C ATOM 806 CG GLU A 54 -10.559 -2.893 9.733 1.00 0.00 C ATOM 807 CD GLU A 54 -9.325 -2.826 8.844 1.00 0.00 C ATOM 808 OE1 GLU A 54 -9.453 -2.442 7.650 1.00 0.00 O ATOM 809 OE2 GLU A 54 -8.209 -3.173 9.312 1.00 0.00 O ATOM 0 H GLU A 54 -13.220 -5.611 8.735 1.00 0.00 H new ATOM 0 HA GLU A 54 -12.502 -4.273 11.032 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -10.962 -4.954 9.224 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -11.700 -3.795 8.135 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.077 -1.934 9.741 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.277 -3.111 10.763 1.00 0.00 H new ATOM 816 N VAL A 55 -14.127 -2.178 9.223 1.00 0.00 N ATOM 817 CA VAL A 55 -14.538 -0.814 9.101 1.00 0.00 C ATOM 818 C VAL A 55 -15.995 -0.625 9.348 1.00 0.00 C ATOM 819 O VAL A 55 -16.686 0.303 8.931 1.00 0.00 O ATOM 820 CB VAL A 55 -14.166 -0.402 7.707 1.00 0.00 C ATOM 821 CG1 VAL A 55 -15.019 -0.848 6.507 1.00 0.00 C ATOM 822 CG2 VAL A 55 -13.736 1.073 7.643 1.00 0.00 C ATOM 0 H VAL A 55 -14.408 -2.727 8.410 1.00 0.00 H new ATOM 0 HA VAL A 55 -14.046 -0.200 9.855 1.00 0.00 H new ATOM 0 HB VAL A 55 -13.308 -1.050 7.531 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -14.589 -0.450 5.587 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -15.037 -1.937 6.458 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -16.036 -0.473 6.624 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -13.475 1.332 6.617 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -14.557 1.706 7.979 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -12.871 1.228 8.288 1.00 0.00 H new ATOM 832 N ASP A 56 -16.594 -1.596 10.061 1.00 0.00 N ATOM 833 CA ASP A 56 -17.992 -1.671 10.350 1.00 0.00 C ATOM 834 C ASP A 56 -18.301 -0.885 11.577 1.00 0.00 C ATOM 835 O ASP A 56 -17.915 -1.312 12.664 1.00 0.00 O ATOM 836 CB ASP A 56 -18.387 -3.158 10.342 1.00 0.00 C ATOM 837 CG ASP A 56 -19.850 -3.351 9.969 1.00 0.00 C ATOM 838 OD1 ASP A 56 -20.554 -2.331 9.739 1.00 0.00 O ATOM 839 OD2 ASP A 56 -20.369 -4.498 10.031 1.00 0.00 O ATOM 0 H ASP A 56 -16.070 -2.375 10.459 1.00 0.00 H new ATOM 0 HA ASP A 56 -18.621 -1.198 9.596 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -17.757 -3.698 9.635 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -18.203 -3.589 11.326 1.00 0.00 H new ATOM 844 N ALA A 57 -19.049 0.232 11.560 1.00 0.00 N ATOM 845 CA ALA A 57 -19.308 1.072 12.688 1.00 0.00 C ATOM 846 C ALA A 57 -20.501 0.497 13.370 1.00 0.00 C ATOM 847 O ALA A 57 -20.461 0.494 14.599 1.00 0.00 O ATOM 848 CB ALA A 57 -19.606 2.522 12.268 1.00 0.00 C ATOM 0 H ALA A 57 -19.499 0.568 10.709 1.00 0.00 H new ATOM 0 HA ALA A 57 -18.433 1.105 13.337 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -19.797 3.126 13.155 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -18.750 2.928 11.730 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -20.483 2.540 11.621 1.00 0.00 H new ATOM 854 N ASP A 58 -21.525 0.016 12.642 1.00 0.00 N ATOM 855 CA ASP A 58 -22.727 -0.581 13.135 1.00 0.00 C ATOM 856 C ASP A 58 -22.741 -2.065 13.272 1.00 0.00 C ATOM 857 O ASP A 58 -23.530 -2.557 14.078 1.00 0.00 O ATOM 858 CB ASP A 58 -23.916 0.187 12.534 1.00 0.00 C ATOM 859 CG ASP A 58 -24.114 -0.005 11.037 1.00 0.00 C ATOM 860 OD1 ASP A 58 -23.382 -0.803 10.394 1.00 0.00 O ATOM 861 OD2 ASP A 58 -24.957 0.714 10.437 1.00 0.00 O ATOM 0 H ASP A 58 -21.508 0.049 11.623 1.00 0.00 H new ATOM 0 HA ASP A 58 -22.824 -0.449 14.213 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -24.826 -0.122 13.048 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -23.781 1.250 12.734 1.00 0.00 H new ATOM 866 N GLY A 59 -21.924 -2.795 12.493 1.00 0.00 N ATOM 867 CA GLY A 59 -21.644 -4.155 12.834 1.00 0.00 C ATOM 868 C GLY A 59 -22.508 -5.074 12.041 1.00 0.00 C ATOM 869 O GLY A 59 -22.402 -6.285 12.228 1.00 0.00 O ATOM 0 H GLY A 59 -21.467 -2.455 11.647 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -20.594 -4.376 12.643 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -21.814 -4.313 13.899 1.00 0.00 H new ATOM 873 N ASN A 60 -23.353 -4.600 11.108 1.00 0.00 N ATOM 874 CA ASN A 60 -24.280 -5.301 10.274 1.00 0.00 C ATOM 875 C ASN A 60 -23.715 -6.092 9.145 1.00 0.00 C ATOM 876 O ASN A 60 -24.502 -6.704 8.425 1.00 0.00 O ATOM 877 CB ASN A 60 -25.409 -4.388 9.766 1.00 0.00 C ATOM 878 CG ASN A 60 -24.820 -3.178 9.056 1.00 0.00 C ATOM 879 OD1 ASN A 60 -23.632 -3.059 8.761 1.00 0.00 O ATOM 880 ND2 ASN A 60 -25.682 -2.159 8.796 1.00 0.00 N ATOM 0 H ASN A 60 -23.387 -3.598 10.918 1.00 0.00 H new ATOM 0 HA ASN A 60 -24.678 -6.050 10.959 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -26.056 -4.941 9.085 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -26.029 -4.063 10.602 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -25.342 -1.302 8.359 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -26.669 -2.251 9.038 1.00 0.00 H new ATOM 887 N GLY A 61 -22.389 -5.975 8.953 1.00 0.00 N ATOM 888 CA GLY A 61 -21.520 -6.650 8.039 1.00 0.00 C ATOM 889 C GLY A 61 -21.779 -6.239 6.630 1.00 0.00 C ATOM 890 O GLY A 61 -21.618 -7.074 5.742 1.00 0.00 O ATOM 0 H GLY A 61 -21.858 -5.314 9.520 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -20.483 -6.435 8.296 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -21.656 -7.727 8.135 1.00 0.00 H new ATOM 894 N THR A 62 -22.203 -4.973 6.466 1.00 0.00 N ATOM 895 CA THR A 62 -22.261 -4.386 5.164 1.00 0.00 C ATOM 896 C THR A 62 -21.688 -3.013 5.251 1.00 0.00 C ATOM 897 O THR A 62 -21.786 -2.306 6.252 1.00 0.00 O ATOM 898 CB THR A 62 -23.629 -4.209 4.574 1.00 0.00 C ATOM 899 OG1 THR A 62 -24.533 -3.381 5.290 1.00 0.00 O ATOM 900 CG2 THR A 62 -24.289 -5.585 4.386 1.00 0.00 C ATOM 0 H THR A 62 -22.503 -4.362 7.226 1.00 0.00 H new ATOM 0 HA THR A 62 -21.721 -5.084 4.524 1.00 0.00 H new ATOM 0 HB THR A 62 -23.442 -3.689 3.635 1.00 0.00 H new ATOM 0 HG1 THR A 62 -25.451 -3.687 5.133 1.00 0.00 H new ATOM 0 HG21 THR A 62 -25.283 -5.456 3.957 1.00 0.00 H new ATOM 0 HG22 THR A 62 -23.680 -6.192 3.716 1.00 0.00 H new ATOM 0 HG23 THR A 62 -24.372 -6.084 5.352 1.00 0.00 H new ATOM 908 N ILE A 63 -20.973 -2.555 4.208 1.00 0.00 N ATOM 909 CA ILE A 63 -20.386 -1.252 4.156 1.00 0.00 C ATOM 910 C ILE A 63 -21.408 -0.214 3.842 1.00 0.00 C ATOM 911 O ILE A 63 -21.864 -0.030 2.715 1.00 0.00 O ATOM 912 CB ILE A 63 -19.142 -1.202 3.320 1.00 0.00 C ATOM 913 CG1 ILE A 63 -18.312 -2.490 3.448 1.00 0.00 C ATOM 914 CG2 ILE A 63 -18.282 -0.025 3.811 1.00 0.00 C ATOM 915 CD1 ILE A 63 -17.244 -2.443 2.356 1.00 0.00 C ATOM 0 H ILE A 63 -20.797 -3.111 3.371 1.00 0.00 H new ATOM 0 HA ILE A 63 -20.022 -1.005 5.153 1.00 0.00 H new ATOM 0 HB ILE A 63 -19.435 -1.087 2.276 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -17.853 -2.556 4.434 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -18.945 -3.370 3.331 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -17.370 0.032 3.217 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -18.842 0.904 3.705 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -18.024 -0.176 4.859 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -16.629 -3.341 2.410 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -17.725 -2.390 1.379 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -16.616 -1.564 2.499 1.00 0.00 H new ATOM 927 N ASP A 64 -21.840 0.639 4.788 1.00 0.00 N ATOM 928 CA ASP A 64 -22.702 1.760 4.576 1.00 0.00 C ATOM 929 C ASP A 64 -21.863 2.939 4.223 1.00 0.00 C ATOM 930 O ASP A 64 -20.642 2.811 4.290 1.00 0.00 O ATOM 931 CB ASP A 64 -23.570 2.099 5.800 1.00 0.00 C ATOM 932 CG ASP A 64 -24.261 0.880 6.394 1.00 0.00 C ATOM 933 OD1 ASP A 64 -23.628 0.186 7.234 1.00 0.00 O ATOM 934 OD2 ASP A 64 -25.446 0.581 6.086 1.00 0.00 O ATOM 0 H ASP A 64 -21.568 0.538 5.766 1.00 0.00 H new ATOM 0 HA ASP A 64 -23.388 1.500 3.770 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -22.946 2.564 6.563 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -24.323 2.833 5.513 1.00 0.00 H new ATOM 939 N PHE A 65 -22.347 4.020 3.585 1.00 0.00 N ATOM 940 CA PHE A 65 -21.632 5.085 2.952 1.00 0.00 C ATOM 941 C PHE A 65 -20.823 5.924 3.880 1.00 0.00 C ATOM 942 O PHE A 65 -19.724 6.200 3.403 1.00 0.00 O ATOM 943 CB PHE A 65 -22.454 5.859 1.908 1.00 0.00 C ATOM 944 CG PHE A 65 -21.672 6.818 1.079 1.00 0.00 C ATOM 945 CD1 PHE A 65 -20.766 6.434 0.118 1.00 0.00 C ATOM 946 CD2 PHE A 65 -22.015 8.147 1.166 1.00 0.00 C ATOM 947 CE1 PHE A 65 -19.943 7.370 -0.462 1.00 0.00 C ATOM 948 CE2 PHE A 65 -21.322 9.084 0.436 1.00 0.00 C ATOM 949 CZ PHE A 65 -20.279 8.701 -0.373 1.00 0.00 C ATOM 0 H PHE A 65 -23.354 4.160 3.506 1.00 0.00 H new ATOM 0 HA PHE A 65 -20.870 4.586 2.353 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -22.941 5.142 1.246 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -23.244 6.406 2.422 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.701 5.398 -0.181 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -22.828 8.455 1.807 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -19.046 7.065 -0.980 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -21.599 10.126 0.499 1.00 0.00 H new ATOM 0 HZ PHE A 65 -19.727 9.440 -0.935 1.00 0.00 H new ATOM 959 N PRO A 66 -21.162 6.332 5.067 1.00 0.00 N ATOM 960 CA PRO A 66 -20.238 6.994 5.941 1.00 0.00 C ATOM 961 C PRO A 66 -19.065 6.147 6.297 1.00 0.00 C ATOM 962 O PRO A 66 -17.929 6.611 6.380 1.00 0.00 O ATOM 963 CB PRO A 66 -21.101 7.421 7.126 1.00 0.00 C ATOM 964 CG PRO A 66 -22.521 7.567 6.557 1.00 0.00 C ATOM 965 CD PRO A 66 -22.544 6.442 5.510 1.00 0.00 C ATOM 0 HA PRO A 66 -19.754 7.853 5.477 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -21.071 6.678 7.923 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -20.749 8.361 7.552 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -23.286 7.432 7.322 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -22.686 8.548 6.110 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.899 5.506 5.940 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -23.209 6.684 4.681 1.00 0.00 H new ATOM 973 N GLU A 67 -19.287 4.827 6.434 1.00 0.00 N ATOM 974 CA GLU A 67 -18.198 3.916 6.609 1.00 0.00 C ATOM 975 C GLU A 67 -17.282 3.662 5.462 1.00 0.00 C ATOM 976 O GLU A 67 -16.109 3.324 5.610 1.00 0.00 O ATOM 977 CB GLU A 67 -18.647 2.517 7.063 1.00 0.00 C ATOM 978 CG GLU A 67 -19.810 2.539 8.057 1.00 0.00 C ATOM 979 CD GLU A 67 -20.561 1.244 8.331 1.00 0.00 C ATOM 980 OE1 GLU A 67 -20.607 0.397 7.399 1.00 0.00 O ATOM 981 OE2 GLU A 67 -21.067 0.978 9.453 1.00 0.00 O ATOM 0 H GLU A 67 -20.210 4.394 6.424 1.00 0.00 H new ATOM 0 HA GLU A 67 -17.645 4.476 7.363 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -18.939 1.937 6.188 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -17.801 2.003 7.518 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -19.425 2.905 9.009 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -20.534 3.273 7.702 1.00 0.00 H new ATOM 988 N PHE A 68 -17.769 3.880 4.227 1.00 0.00 N ATOM 989 CA PHE A 68 -17.152 3.669 2.955 1.00 0.00 C ATOM 990 C PHE A 68 -16.220 4.789 2.641 1.00 0.00 C ATOM 991 O PHE A 68 -15.173 4.576 2.031 1.00 0.00 O ATOM 992 CB PHE A 68 -18.211 3.548 1.846 1.00 0.00 C ATOM 993 CG PHE A 68 -17.638 3.110 0.543 1.00 0.00 C ATOM 994 CD1 PHE A 68 -17.318 1.812 0.219 1.00 0.00 C ATOM 995 CD2 PHE A 68 -17.326 4.065 -0.396 1.00 0.00 C ATOM 996 CE1 PHE A 68 -16.872 1.500 -1.044 1.00 0.00 C ATOM 997 CE2 PHE A 68 -16.893 3.755 -1.663 1.00 0.00 C ATOM 998 CZ PHE A 68 -16.719 2.442 -2.033 1.00 0.00 C ATOM 0 H PHE A 68 -18.712 4.250 4.112 1.00 0.00 H new ATOM 0 HA PHE A 68 -16.590 2.737 3.002 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -18.977 2.838 2.158 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -18.704 4.511 1.715 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -17.418 1.033 0.961 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -17.426 5.106 -0.126 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.632 0.471 -1.268 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -16.689 4.545 -2.370 1.00 0.00 H new ATOM 0 HZ PHE A 68 -16.475 2.165 -3.048 1.00 0.00 H new ATOM 1008 N LEU A 69 -16.659 5.952 3.152 1.00 0.00 N ATOM 1009 CA LEU A 69 -15.769 7.070 3.204 1.00 0.00 C ATOM 1010 C LEU A 69 -14.654 6.877 4.174 1.00 0.00 C ATOM 1011 O LEU A 69 -13.483 7.127 3.893 1.00 0.00 O ATOM 1012 CB LEU A 69 -16.550 8.345 3.563 1.00 0.00 C ATOM 1013 CG LEU A 69 -17.670 8.680 2.564 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -18.445 9.906 3.075 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -17.124 9.041 1.172 1.00 0.00 C ATOM 0 H LEU A 69 -17.597 6.118 3.518 1.00 0.00 H new ATOM 0 HA LEU A 69 -15.323 7.166 2.214 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -16.983 8.229 4.557 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -15.856 9.184 3.614 1.00 0.00 H new ATOM 0 HG LEU A 69 -18.300 7.795 2.480 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -19.242 10.151 2.373 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -18.877 9.683 4.050 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -17.766 10.754 3.164 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -17.954 9.269 0.504 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -16.472 9.911 1.251 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -16.558 8.199 0.773 1.00 0.00 H new ATOM 1027 N THR A 70 -14.945 6.332 5.369 1.00 0.00 N ATOM 1028 CA THR A 70 -13.975 5.858 6.306 1.00 0.00 C ATOM 1029 C THR A 70 -13.007 4.858 5.774 1.00 0.00 C ATOM 1030 O THR A 70 -11.813 4.940 6.059 1.00 0.00 O ATOM 1031 CB THR A 70 -14.601 5.399 7.589 1.00 0.00 C ATOM 1032 OG1 THR A 70 -15.318 6.486 8.156 1.00 0.00 O ATOM 1033 CG2 THR A 70 -13.600 4.981 8.679 1.00 0.00 C ATOM 0 H THR A 70 -15.904 6.217 5.697 1.00 0.00 H new ATOM 0 HA THR A 70 -13.367 6.737 6.520 1.00 0.00 H new ATOM 0 HB THR A 70 -15.209 4.536 7.317 1.00 0.00 H new ATOM 0 HG1 THR A 70 -16.159 6.613 7.669 1.00 0.00 H new ATOM 0 HG21 THR A 70 -14.143 4.664 9.570 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.989 4.156 8.314 1.00 0.00 H new ATOM 0 HG23 THR A 70 -12.958 5.826 8.927 1.00 0.00 H new ATOM 1041 N MET A 71 -13.465 3.920 4.926 1.00 0.00 N ATOM 1042 CA MET A 71 -12.641 3.006 4.197 1.00 0.00 C ATOM 1043 C MET A 71 -11.699 3.687 3.265 1.00 0.00 C ATOM 1044 O MET A 71 -10.498 3.423 3.257 1.00 0.00 O ATOM 1045 CB MET A 71 -13.394 1.927 3.400 1.00 0.00 C ATOM 1046 CG MET A 71 -12.614 0.799 2.722 1.00 0.00 C ATOM 1047 SD MET A 71 -13.692 -0.257 1.709 1.00 0.00 S ATOM 1048 CE MET A 71 -13.336 -1.759 2.667 1.00 0.00 C ATOM 0 H MET A 71 -14.460 3.793 4.740 1.00 0.00 H new ATOM 0 HA MET A 71 -12.094 2.508 4.997 1.00 0.00 H new ATOM 0 HB2 MET A 71 -14.112 1.464 4.077 1.00 0.00 H new ATOM 0 HB3 MET A 71 -13.968 2.436 2.626 1.00 0.00 H new ATOM 0 HG2 MET A 71 -11.831 1.225 2.095 1.00 0.00 H new ATOM 0 HG3 MET A 71 -12.120 0.192 3.481 1.00 0.00 H new ATOM 0 HE1 MET A 71 -13.890 -2.598 2.247 1.00 0.00 H new ATOM 0 HE2 MET A 71 -12.268 -1.972 2.626 1.00 0.00 H new ATOM 0 HE3 MET A 71 -13.637 -1.609 3.704 1.00 0.00 H new ATOM 1058 N MET A 72 -12.088 4.683 2.450 1.00 0.00 N ATOM 1059 CA MET A 72 -11.231 5.432 1.585 1.00 0.00 C ATOM 1060 C MET A 72 -10.213 6.176 2.380 1.00 0.00 C ATOM 1061 O MET A 72 -9.009 6.214 2.134 1.00 0.00 O ATOM 1062 CB MET A 72 -12.140 6.252 0.654 1.00 0.00 C ATOM 1063 CG MET A 72 -12.871 5.405 -0.390 1.00 0.00 C ATOM 1064 SD MET A 72 -11.741 4.525 -1.509 1.00 0.00 S ATOM 1065 CE MET A 72 -12.668 2.972 -1.345 1.00 0.00 C ATOM 0 H MET A 72 -13.061 4.983 2.392 1.00 0.00 H new ATOM 0 HA MET A 72 -10.613 4.813 0.935 1.00 0.00 H new ATOM 0 HB2 MET A 72 -12.875 6.786 1.256 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.539 7.004 0.143 1.00 0.00 H new ATOM 0 HG2 MET A 72 -13.507 4.680 0.119 1.00 0.00 H new ATOM 0 HG3 MET A 72 -13.527 6.048 -0.977 1.00 0.00 H new ATOM 0 HE1 MET A 72 -12.203 2.204 -1.963 1.00 0.00 H new ATOM 0 HE2 MET A 72 -12.661 2.653 -0.303 1.00 0.00 H new ATOM 0 HE3 MET A 72 -13.697 3.126 -1.671 1.00 0.00 H new ATOM 1075 N ALA A 73 -10.630 6.849 3.467 1.00 0.00 N ATOM 1076 CA ALA A 73 -9.845 7.708 4.299 1.00 0.00 C ATOM 1077 C ALA A 73 -8.753 7.005 5.029 1.00 0.00 C ATOM 1078 O ALA A 73 -7.697 7.599 5.243 1.00 0.00 O ATOM 1079 CB ALA A 73 -10.780 8.376 5.321 1.00 0.00 C ATOM 0 H ALA A 73 -11.596 6.786 3.789 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.362 8.435 3.646 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -10.201 9.036 5.967 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -11.539 8.956 4.795 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -11.264 7.610 5.926 1.00 0.00 H new ATOM 1234 N GLU A 83 2.413 13.712 -5.616 1.00 0.00 N ATOM 1235 CA GLU A 83 3.757 14.086 -5.930 1.00 0.00 C ATOM 1236 C GLU A 83 4.835 13.241 -5.344 1.00 0.00 C ATOM 1237 O GLU A 83 5.908 13.056 -5.916 1.00 0.00 O ATOM 1238 CB GLU A 83 3.965 15.598 -5.733 1.00 0.00 C ATOM 1239 CG GLU A 83 3.279 16.418 -6.828 1.00 0.00 C ATOM 1240 CD GLU A 83 3.877 16.249 -8.217 1.00 0.00 C ATOM 1241 OE1 GLU A 83 5.060 16.654 -8.368 1.00 0.00 O ATOM 1242 OE2 GLU A 83 3.271 15.623 -9.127 1.00 0.00 O ATOM 0 HA GLU A 83 3.873 13.866 -6.991 1.00 0.00 H new ATOM 0 HB2 GLU A 83 3.574 15.894 -4.760 1.00 0.00 H new ATOM 0 HB3 GLU A 83 5.032 15.820 -5.729 1.00 0.00 H new ATOM 0 HG2 GLU A 83 2.225 16.141 -6.865 1.00 0.00 H new ATOM 0 HG3 GLU A 83 3.322 17.472 -6.554 1.00 0.00 H new ATOM 1249 N GLU A 84 4.441 12.656 -4.199 1.00 0.00 N ATOM 1250 CA GLU A 84 5.335 11.801 -3.481 1.00 0.00 C ATOM 1251 C GLU A 84 5.318 10.474 -4.159 1.00 0.00 C ATOM 1252 O GLU A 84 6.355 9.825 -4.290 1.00 0.00 O ATOM 1253 CB GLU A 84 4.987 11.809 -1.983 1.00 0.00 C ATOM 1254 CG GLU A 84 6.051 11.156 -1.099 1.00 0.00 C ATOM 1255 CD GLU A 84 7.446 11.764 -1.121 1.00 0.00 C ATOM 1256 OE1 GLU A 84 7.652 12.916 -0.656 1.00 0.00 O ATOM 1257 OE2 GLU A 84 8.404 11.109 -1.613 1.00 0.00 O ATOM 0 H GLU A 84 3.520 12.771 -3.776 1.00 0.00 H new ATOM 0 HA GLU A 84 6.369 12.146 -3.502 1.00 0.00 H new ATOM 0 HB2 GLU A 84 4.841 12.839 -1.659 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.039 11.291 -1.837 1.00 0.00 H new ATOM 0 HG2 GLU A 84 5.692 11.173 -0.070 1.00 0.00 H new ATOM 0 HG3 GLU A 84 6.135 10.109 -1.390 1.00 0.00 H new ATOM 1264 N ILE A 85 4.209 10.083 -4.811 1.00 0.00 N ATOM 1265 CA ILE A 85 4.100 8.842 -5.513 1.00 0.00 C ATOM 1266 C ILE A 85 4.789 9.015 -6.823 1.00 0.00 C ATOM 1267 O ILE A 85 5.603 8.206 -7.267 1.00 0.00 O ATOM 1268 CB ILE A 85 2.683 8.359 -5.612 1.00 0.00 C ATOM 1269 CG1 ILE A 85 2.234 7.722 -4.286 1.00 0.00 C ATOM 1270 CG2 ILE A 85 2.497 7.434 -6.826 1.00 0.00 C ATOM 1271 CD1 ILE A 85 0.787 7.943 -3.847 1.00 0.00 C ATOM 0 H ILE A 85 3.361 10.648 -4.851 1.00 0.00 H new ATOM 0 HA ILE A 85 4.592 8.040 -4.963 1.00 0.00 H new ATOM 0 HB ILE A 85 2.028 9.214 -5.783 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.403 6.647 -4.356 1.00 0.00 H new ATOM 0 HG13 ILE A 85 2.885 8.097 -3.496 1.00 0.00 H new ATOM 0 HG21 ILE A 85 1.461 7.099 -6.873 1.00 0.00 H new ATOM 0 HG22 ILE A 85 2.745 7.977 -7.738 1.00 0.00 H new ATOM 0 HG23 ILE A 85 3.154 6.569 -6.729 1.00 0.00 H new ATOM 0 HD11 ILE A 85 0.614 7.437 -2.897 1.00 0.00 H new ATOM 0 HD12 ILE A 85 0.602 9.011 -3.729 1.00 0.00 H new ATOM 0 HD13 ILE A 85 0.112 7.539 -4.602 1.00 0.00 H new ATOM 1283 N ARG A 86 4.539 10.087 -7.595 1.00 0.00 N ATOM 1284 CA ARG A 86 5.259 10.380 -8.796 1.00 0.00 C ATOM 1285 C ARG A 86 6.724 10.625 -8.672 1.00 0.00 C ATOM 1286 O ARG A 86 7.444 10.485 -9.660 1.00 0.00 O ATOM 1287 CB ARG A 86 4.614 11.603 -9.469 1.00 0.00 C ATOM 1288 CG ARG A 86 4.785 11.668 -10.988 1.00 0.00 C ATOM 1289 CD ARG A 86 3.981 12.829 -11.577 1.00 0.00 C ATOM 1290 NE ARG A 86 4.394 14.111 -10.942 1.00 0.00 N ATOM 1291 CZ ARG A 86 5.495 14.811 -11.344 1.00 0.00 C ATOM 1292 NH1 ARG A 86 6.376 14.356 -12.283 1.00 0.00 N ATOM 1293 NH2 ARG A 86 5.591 16.097 -10.897 1.00 0.00 N ATOM 0 H ARG A 86 3.814 10.771 -7.378 1.00 0.00 H new ATOM 0 HA ARG A 86 5.186 9.465 -9.384 1.00 0.00 H new ATOM 0 HB2 ARG A 86 3.549 11.607 -9.238 1.00 0.00 H new ATOM 0 HB3 ARG A 86 5.039 12.506 -9.031 1.00 0.00 H new ATOM 0 HG2 ARG A 86 5.840 11.788 -11.235 1.00 0.00 H new ATOM 0 HG3 ARG A 86 4.458 10.729 -11.436 1.00 0.00 H new ATOM 0 HD2 ARG A 86 4.138 12.881 -12.654 1.00 0.00 H new ATOM 0 HD3 ARG A 86 2.916 12.662 -11.418 1.00 0.00 H new ATOM 0 HE ARG A 86 3.832 14.481 -10.176 1.00 0.00 H new ATOM 0 HH11 ARG A 86 6.228 13.448 -12.724 1.00 0.00 H new ATOM 0 HH12 ARG A 86 7.182 14.924 -12.544 1.00 0.00 H new ATOM 0 HH21 ARG A 86 4.863 16.484 -10.297 1.00 0.00 H new ATOM 0 HH22 ARG A 86 6.391 16.671 -11.163 1.00 0.00 H new ATOM 1307 N GLU A 87 7.263 10.932 -7.479 1.00 0.00 N ATOM 1308 CA GLU A 87 8.689 11.013 -7.400 1.00 0.00 C ATOM 1309 C GLU A 87 9.260 9.663 -7.132 1.00 0.00 C ATOM 1310 O GLU A 87 10.224 9.299 -7.804 1.00 0.00 O ATOM 1311 CB GLU A 87 9.150 11.976 -6.293 1.00 0.00 C ATOM 1312 CG GLU A 87 10.656 12.238 -6.228 1.00 0.00 C ATOM 1313 CD GLU A 87 11.114 12.944 -7.496 1.00 0.00 C ATOM 1314 OE1 GLU A 87 10.627 14.097 -7.642 1.00 0.00 O ATOM 1315 OE2 GLU A 87 11.954 12.470 -8.306 1.00 0.00 O ATOM 0 H GLU A 87 6.750 11.115 -6.617 1.00 0.00 H new ATOM 0 HA GLU A 87 9.045 11.394 -8.357 1.00 0.00 H new ATOM 0 HB2 GLU A 87 8.639 12.929 -6.430 1.00 0.00 H new ATOM 0 HB3 GLU A 87 8.827 11.577 -5.332 1.00 0.00 H new ATOM 0 HG2 GLU A 87 10.890 12.849 -5.356 1.00 0.00 H new ATOM 0 HG3 GLU A 87 11.193 11.297 -6.111 1.00 0.00 H new ATOM 1322 N ALA A 88 8.625 8.783 -6.339 1.00 0.00 N ATOM 1323 CA ALA A 88 8.917 7.411 -6.059 1.00 0.00 C ATOM 1324 C ALA A 88 8.698 6.551 -7.256 1.00 0.00 C ATOM 1325 O ALA A 88 9.419 5.566 -7.411 1.00 0.00 O ATOM 1326 CB ALA A 88 8.073 6.956 -4.857 1.00 0.00 C ATOM 0 H ALA A 88 7.794 9.079 -5.827 1.00 0.00 H new ATOM 0 HA ALA A 88 9.972 7.310 -5.804 1.00 0.00 H new ATOM 0 HB1 ALA A 88 8.289 5.911 -4.636 1.00 0.00 H new ATOM 0 HB2 ALA A 88 8.316 7.568 -3.989 1.00 0.00 H new ATOM 0 HB3 ALA A 88 7.015 7.066 -5.093 1.00 0.00 H new ATOM 1332 N PHE A 89 7.722 6.876 -8.122 1.00 0.00 N ATOM 1333 CA PHE A 89 7.457 6.293 -9.401 1.00 0.00 C ATOM 1334 C PHE A 89 8.653 6.166 -10.280 1.00 0.00 C ATOM 1335 O PHE A 89 8.956 5.048 -10.694 1.00 0.00 O ATOM 1336 CB PHE A 89 6.338 7.010 -10.176 1.00 0.00 C ATOM 1337 CG PHE A 89 5.957 6.380 -11.471 1.00 0.00 C ATOM 1338 CD1 PHE A 89 5.753 5.040 -11.700 1.00 0.00 C ATOM 1339 CD2 PHE A 89 5.947 7.203 -12.573 1.00 0.00 C ATOM 1340 CE1 PHE A 89 5.395 4.542 -12.931 1.00 0.00 C ATOM 1341 CE2 PHE A 89 5.579 6.755 -13.819 1.00 0.00 C ATOM 1342 CZ PHE A 89 5.323 5.415 -13.991 1.00 0.00 C ATOM 0 H PHE A 89 7.056 7.618 -7.904 1.00 0.00 H new ATOM 0 HA PHE A 89 7.124 5.287 -9.146 1.00 0.00 H new ATOM 0 HB2 PHE A 89 5.453 7.060 -9.541 1.00 0.00 H new ATOM 0 HB3 PHE A 89 6.651 8.036 -10.368 1.00 0.00 H new ATOM 0 HD1 PHE A 89 5.879 4.350 -10.879 1.00 0.00 H new ATOM 0 HD2 PHE A 89 6.238 8.236 -12.455 1.00 0.00 H new ATOM 0 HE1 PHE A 89 5.176 3.493 -13.062 1.00 0.00 H new ATOM 0 HE2 PHE A 89 5.493 7.442 -14.647 1.00 0.00 H new ATOM 0 HZ PHE A 89 5.062 5.043 -14.971 1.00 0.00 H new ATOM 1352 N ARG A 90 9.334 7.311 -10.458 1.00 0.00 N ATOM 1353 CA ARG A 90 10.466 7.549 -11.300 1.00 0.00 C ATOM 1354 C ARG A 90 11.723 7.089 -10.645 1.00 0.00 C ATOM 1355 O ARG A 90 12.706 6.865 -11.350 1.00 0.00 O ATOM 1356 CB ARG A 90 10.488 9.039 -11.678 1.00 0.00 C ATOM 1357 CG ARG A 90 11.459 9.398 -12.804 1.00 0.00 C ATOM 1358 CD ARG A 90 11.521 10.863 -13.239 1.00 0.00 C ATOM 1359 NE ARG A 90 11.877 11.631 -12.013 1.00 0.00 N ATOM 1360 CZ ARG A 90 11.874 12.995 -11.953 1.00 0.00 C ATOM 1361 NH1 ARG A 90 11.376 13.822 -12.917 1.00 0.00 N ATOM 1362 NH2 ARG A 90 12.194 13.588 -10.765 1.00 0.00 N ATOM 0 H ARG A 90 9.061 8.158 -9.959 1.00 0.00 H new ATOM 0 HA ARG A 90 10.388 6.968 -12.219 1.00 0.00 H new ATOM 0 HB2 ARG A 90 9.483 9.340 -11.974 1.00 0.00 H new ATOM 0 HB3 ARG A 90 10.748 9.621 -10.793 1.00 0.00 H new ATOM 0 HG2 ARG A 90 12.460 9.096 -12.495 1.00 0.00 H new ATOM 0 HG3 ARG A 90 11.200 8.798 -13.676 1.00 0.00 H new ATOM 0 HD2 ARG A 90 12.265 11.008 -14.022 1.00 0.00 H new ATOM 0 HD3 ARG A 90 10.564 11.192 -13.644 1.00 0.00 H new ATOM 0 HE ARG A 90 12.136 11.111 -11.175 1.00 0.00 H new ATOM 0 HH11 ARG A 90 10.965 13.429 -13.764 1.00 0.00 H new ATOM 0 HH12 ARG A 90 11.414 14.833 -12.791 1.00 0.00 H new ATOM 0 HH21 ARG A 90 12.426 13.014 -9.955 1.00 0.00 H new ATOM 0 HH22 ARG A 90 12.201 14.605 -10.688 1.00 0.00 H new ATOM 1376 N VAL A 91 11.691 6.776 -9.338 1.00 0.00 N ATOM 1377 CA VAL A 91 12.740 6.125 -8.617 1.00 0.00 C ATOM 1378 C VAL A 91 12.693 4.670 -8.937 1.00 0.00 C ATOM 1379 O VAL A 91 13.706 4.048 -9.253 1.00 0.00 O ATOM 1380 CB VAL A 91 12.809 6.396 -7.143 1.00 0.00 C ATOM 1381 CG1 VAL A 91 13.745 5.417 -6.415 1.00 0.00 C ATOM 1382 CG2 VAL A 91 13.244 7.865 -7.003 1.00 0.00 C ATOM 0 H VAL A 91 10.885 6.990 -8.750 1.00 0.00 H new ATOM 0 HA VAL A 91 13.675 6.567 -8.960 1.00 0.00 H new ATOM 0 HB VAL A 91 11.842 6.239 -6.665 1.00 0.00 H new ATOM 0 HG11 VAL A 91 13.762 5.653 -5.351 1.00 0.00 H new ATOM 0 HG12 VAL A 91 13.385 4.398 -6.555 1.00 0.00 H new ATOM 0 HG13 VAL A 91 14.752 5.505 -6.822 1.00 0.00 H new ATOM 0 HG21 VAL A 91 13.313 8.125 -5.947 1.00 0.00 H new ATOM 0 HG22 VAL A 91 14.217 8.003 -7.475 1.00 0.00 H new ATOM 0 HG23 VAL A 91 12.511 8.509 -7.488 1.00 0.00 H new ATOM 1392 N PHE A 92 11.472 4.109 -9.005 1.00 0.00 N ATOM 1393 CA PHE A 92 11.162 2.736 -9.253 1.00 0.00 C ATOM 1394 C PHE A 92 11.366 2.383 -10.686 1.00 0.00 C ATOM 1395 O PHE A 92 11.802 1.276 -10.998 1.00 0.00 O ATOM 1396 CB PHE A 92 9.731 2.439 -8.774 1.00 0.00 C ATOM 1397 CG PHE A 92 9.495 2.234 -7.317 1.00 0.00 C ATOM 1398 CD1 PHE A 92 10.375 2.621 -6.334 1.00 0.00 C ATOM 1399 CD2 PHE A 92 8.337 1.591 -6.948 1.00 0.00 C ATOM 1400 CE1 PHE A 92 10.037 2.433 -5.014 1.00 0.00 C ATOM 1401 CE2 PHE A 92 8.025 1.319 -5.637 1.00 0.00 C ATOM 1402 CZ PHE A 92 8.849 1.835 -4.665 1.00 0.00 C ATOM 0 H PHE A 92 10.629 4.668 -8.874 1.00 0.00 H new ATOM 0 HA PHE A 92 11.847 2.105 -8.686 1.00 0.00 H new ATOM 0 HB2 PHE A 92 9.095 3.262 -9.100 1.00 0.00 H new ATOM 0 HB3 PHE A 92 9.387 1.545 -9.294 1.00 0.00 H new ATOM 0 HD1 PHE A 92 11.323 3.068 -6.596 1.00 0.00 H new ATOM 0 HD2 PHE A 92 7.645 1.287 -7.719 1.00 0.00 H new ATOM 0 HE1 PHE A 92 10.715 2.760 -4.240 1.00 0.00 H new ATOM 0 HE2 PHE A 92 7.163 0.721 -5.380 1.00 0.00 H new ATOM 0 HZ PHE A 92 8.563 1.771 -3.626 1.00 0.00 H new ATOM 1412 N ASP A 93 11.108 3.311 -11.625 1.00 0.00 N ATOM 1413 CA ASP A 93 11.517 3.134 -12.984 1.00 0.00 C ATOM 1414 C ASP A 93 13.000 3.279 -13.027 1.00 0.00 C ATOM 1415 O ASP A 93 13.446 4.391 -12.750 1.00 0.00 O ATOM 1416 CB ASP A 93 10.809 4.164 -13.880 1.00 0.00 C ATOM 1417 CG ASP A 93 10.923 3.810 -15.356 1.00 0.00 C ATOM 1418 OD1 ASP A 93 11.647 2.866 -15.770 1.00 0.00 O ATOM 1419 OD2 ASP A 93 10.327 4.598 -16.138 1.00 0.00 O ATOM 0 H ASP A 93 10.615 4.185 -11.443 1.00 0.00 H new ATOM 0 HA ASP A 93 11.242 2.148 -13.359 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.757 4.224 -13.602 1.00 0.00 H new ATOM 0 HB3 ASP A 93 11.241 5.150 -13.709 1.00 0.00 H new ATOM 1424 N LYS A 94 13.723 2.249 -13.503 1.00 0.00 N ATOM 1425 CA LYS A 94 15.148 2.258 -13.623 1.00 0.00 C ATOM 1426 C LYS A 94 15.777 3.333 -14.442 1.00 0.00 C ATOM 1427 O LYS A 94 16.439 4.262 -13.982 1.00 0.00 O ATOM 1428 CB LYS A 94 15.638 0.833 -13.928 1.00 0.00 C ATOM 1429 CG LYS A 94 17.115 0.565 -13.630 1.00 0.00 C ATOM 1430 CD LYS A 94 17.486 0.593 -12.146 1.00 0.00 C ATOM 1431 CE LYS A 94 19.008 0.520 -12.008 1.00 0.00 C ATOM 1432 NZ LYS A 94 19.416 0.314 -10.601 1.00 0.00 N ATOM 0 H LYS A 94 13.298 1.376 -13.816 1.00 0.00 H new ATOM 0 HA LYS A 94 15.524 2.569 -12.648 1.00 0.00 H new ATOM 0 HB2 LYS A 94 15.036 0.130 -13.352 1.00 0.00 H new ATOM 0 HB3 LYS A 94 15.454 0.622 -14.981 1.00 0.00 H new ATOM 0 HG2 LYS A 94 17.382 -0.410 -14.038 1.00 0.00 H new ATOM 0 HG3 LYS A 94 17.717 1.307 -14.155 1.00 0.00 H new ATOM 0 HD2 LYS A 94 17.110 1.505 -11.682 1.00 0.00 H new ATOM 0 HD3 LYS A 94 17.021 -0.245 -11.626 1.00 0.00 H new ATOM 0 HE2 LYS A 94 19.391 -0.295 -12.622 1.00 0.00 H new ATOM 0 HE3 LYS A 94 19.453 1.440 -12.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 20.453 0.269 -10.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 19.071 1.105 -10.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 19.011 -0.577 -10.249 1.00 0.00 H new ATOM 1446 N ASP A 95 15.544 3.256 -15.764 1.00 0.00 N ATOM 1447 CA ASP A 95 15.918 4.253 -16.719 1.00 0.00 C ATOM 1448 C ASP A 95 15.153 5.529 -16.633 1.00 0.00 C ATOM 1449 O ASP A 95 15.860 6.527 -16.763 1.00 0.00 O ATOM 1450 CB ASP A 95 15.786 3.593 -18.102 1.00 0.00 C ATOM 1451 CG ASP A 95 14.354 3.106 -18.267 1.00 0.00 C ATOM 1452 OD1 ASP A 95 13.968 1.979 -17.856 1.00 0.00 O ATOM 1453 OD2 ASP A 95 13.514 3.904 -18.762 1.00 0.00 O ATOM 0 H ASP A 95 15.071 2.458 -16.188 1.00 0.00 H new ATOM 0 HA ASP A 95 16.939 4.573 -16.513 1.00 0.00 H new ATOM 0 HB2 ASP A 95 16.037 4.305 -18.888 1.00 0.00 H new ATOM 0 HB3 ASP A 95 16.483 2.760 -18.193 1.00 0.00 H new ATOM 1458 N GLY A 96 13.853 5.582 -16.294 1.00 0.00 N ATOM 1459 CA GLY A 96 13.170 6.813 -16.041 1.00 0.00 C ATOM 1460 C GLY A 96 12.687 7.532 -17.254 1.00 0.00 C ATOM 1461 O GLY A 96 12.608 8.756 -17.164 1.00 0.00 O ATOM 0 H GLY A 96 13.265 4.755 -16.194 1.00 0.00 H new ATOM 0 HA2 GLY A 96 12.316 6.610 -15.395 1.00 0.00 H new ATOM 0 HA3 GLY A 96 13.838 7.474 -15.489 1.00 0.00 H new ATOM 1465 N ASN A 97 12.223 6.849 -18.316 1.00 0.00 N ATOM 1466 CA ASN A 97 11.570 7.327 -19.495 1.00 0.00 C ATOM 1467 C ASN A 97 10.117 7.450 -19.190 1.00 0.00 C ATOM 1468 O ASN A 97 9.542 8.522 -19.373 1.00 0.00 O ATOM 1469 CB ASN A 97 11.855 6.354 -20.652 1.00 0.00 C ATOM 1470 CG ASN A 97 13.312 6.633 -20.992 1.00 0.00 C ATOM 1471 OD1 ASN A 97 13.551 7.451 -21.879 1.00 0.00 O ATOM 1472 ND2 ASN A 97 14.306 5.995 -20.319 1.00 0.00 N ATOM 0 H ASN A 97 12.320 5.834 -18.347 1.00 0.00 H new ATOM 0 HA ASN A 97 11.939 8.306 -19.802 1.00 0.00 H new ATOM 0 HB2 ASN A 97 11.703 5.317 -20.352 1.00 0.00 H new ATOM 0 HB3 ASN A 97 11.200 6.539 -21.504 1.00 0.00 H new ATOM 0 HD21 ASN A 97 15.281 6.190 -20.545 1.00 0.00 H new ATOM 0 HD22 ASN A 97 14.076 5.322 -19.588 1.00 0.00 H new ATOM 1479 N GLY A 98 9.428 6.412 -18.684 1.00 0.00 N ATOM 1480 CA GLY A 98 8.039 6.559 -18.375 1.00 0.00 C ATOM 1481 C GLY A 98 7.555 5.377 -17.608 1.00 0.00 C ATOM 1482 O GLY A 98 6.943 5.600 -16.565 1.00 0.00 O ATOM 0 H GLY A 98 9.821 5.490 -18.492 1.00 0.00 H new ATOM 0 HA2 GLY A 98 7.882 7.468 -17.794 1.00 0.00 H new ATOM 0 HA3 GLY A 98 7.464 6.666 -19.295 1.00 0.00 H new ATOM 1486 N TYR A 99 7.679 4.125 -18.086 1.00 0.00 N ATOM 1487 CA TYR A 99 7.006 3.013 -17.491 1.00 0.00 C ATOM 1488 C TYR A 99 7.838 2.133 -16.624 1.00 0.00 C ATOM 1489 O TYR A 99 9.050 2.009 -16.792 1.00 0.00 O ATOM 1490 CB TYR A 99 6.526 2.040 -18.581 1.00 0.00 C ATOM 1491 CG TYR A 99 5.509 2.617 -19.505 1.00 0.00 C ATOM 1492 CD1 TYR A 99 5.771 3.410 -20.598 1.00 0.00 C ATOM 1493 CD2 TYR A 99 4.208 2.271 -19.226 1.00 0.00 C ATOM 1494 CE1 TYR A 99 4.765 3.761 -21.467 1.00 0.00 C ATOM 1495 CE2 TYR A 99 3.229 2.551 -20.150 1.00 0.00 C ATOM 1496 CZ TYR A 99 3.473 3.350 -21.242 1.00 0.00 C ATOM 1497 OH TYR A 99 2.448 3.714 -22.141 1.00 0.00 O ATOM 0 H TYR A 99 8.252 3.882 -18.894 1.00 0.00 H new ATOM 0 HA TYR A 99 6.227 3.497 -16.902 1.00 0.00 H new ATOM 0 HB2 TYR A 99 7.386 1.711 -19.164 1.00 0.00 H new ATOM 0 HB3 TYR A 99 6.107 1.154 -18.104 1.00 0.00 H new ATOM 0 HD1 TYR A 99 6.777 3.760 -20.775 1.00 0.00 H new ATOM 0 HD2 TYR A 99 3.958 1.786 -18.294 1.00 0.00 H new ATOM 0 HE1 TYR A 99 4.992 4.365 -22.333 1.00 0.00 H new ATOM 0 HE2 TYR A 99 2.243 2.132 -20.014 1.00 0.00 H new ATOM 0 HH TYR A 99 1.596 3.340 -21.834 1.00 0.00 H new ATOM 1507 N ILE A 100 7.163 1.483 -15.659 1.00 0.00 N ATOM 1508 CA ILE A 100 7.797 0.412 -14.953 1.00 0.00 C ATOM 1509 C ILE A 100 7.597 -0.911 -15.608 1.00 0.00 C ATOM 1510 O ILE A 100 6.446 -1.326 -15.481 1.00 0.00 O ATOM 1511 CB ILE A 100 7.661 0.395 -13.459 1.00 0.00 C ATOM 1512 CG1 ILE A 100 7.727 1.794 -12.823 1.00 0.00 C ATOM 1513 CG2 ILE A 100 8.961 -0.298 -13.019 1.00 0.00 C ATOM 1514 CD1 ILE A 100 7.194 1.582 -11.407 1.00 0.00 C ATOM 0 H ILE A 100 6.206 1.690 -15.373 1.00 0.00 H new ATOM 0 HA ILE A 100 8.856 0.651 -15.052 1.00 0.00 H new ATOM 0 HB ILE A 100 6.713 -0.060 -13.172 1.00 0.00 H new ATOM 0 HG12 ILE A 100 8.746 2.180 -12.812 1.00 0.00 H new ATOM 0 HG13 ILE A 100 7.120 2.512 -13.375 1.00 0.00 H new ATOM 0 HG21 ILE A 100 8.984 -0.373 -11.932 1.00 0.00 H new ATOM 0 HG22 ILE A 100 9.005 -1.297 -13.452 1.00 0.00 H new ATOM 0 HG23 ILE A 100 9.817 0.284 -13.360 1.00 0.00 H new ATOM 0 HD11 ILE A 100 7.202 2.530 -10.869 1.00 0.00 H new ATOM 0 HD12 ILE A 100 6.174 1.201 -11.455 1.00 0.00 H new ATOM 0 HD13 ILE A 100 7.825 0.863 -10.884 1.00 0.00 H new ATOM 1526 N SER A 101 8.541 -1.572 -16.301 1.00 0.00 N ATOM 1527 CA SER A 101 8.186 -2.824 -16.894 1.00 0.00 C ATOM 1528 C SER A 101 8.141 -3.815 -15.782 1.00 0.00 C ATOM 1529 O SER A 101 8.643 -3.555 -14.690 1.00 0.00 O ATOM 1530 CB SER A 101 9.220 -3.275 -17.939 1.00 0.00 C ATOM 1531 OG SER A 101 10.501 -3.427 -17.344 1.00 0.00 O ATOM 0 H SER A 101 9.502 -1.262 -16.447 1.00 0.00 H new ATOM 0 HA SER A 101 7.230 -2.735 -17.411 1.00 0.00 H new ATOM 0 HB2 SER A 101 8.906 -4.219 -18.385 1.00 0.00 H new ATOM 0 HB3 SER A 101 9.272 -2.544 -18.745 1.00 0.00 H new ATOM 0 HG SER A 101 10.807 -2.562 -17.000 1.00 0.00 H new ATOM 1537 N ALA A 102 7.445 -4.938 -16.033 1.00 0.00 N ATOM 1538 CA ALA A 102 7.351 -6.035 -15.121 1.00 0.00 C ATOM 1539 C ALA A 102 8.682 -6.591 -14.747 1.00 0.00 C ATOM 1540 O ALA A 102 8.793 -7.036 -13.605 1.00 0.00 O ATOM 1541 CB ALA A 102 6.324 -7.083 -15.582 1.00 0.00 C ATOM 0 H ALA A 102 6.930 -5.087 -16.901 1.00 0.00 H new ATOM 0 HA ALA A 102 6.954 -5.643 -14.185 1.00 0.00 H new ATOM 0 HB1 ALA A 102 6.286 -7.898 -14.859 1.00 0.00 H new ATOM 0 HB2 ALA A 102 5.340 -6.620 -15.658 1.00 0.00 H new ATOM 0 HB3 ALA A 102 6.617 -7.475 -16.556 1.00 0.00 H new ATOM 1547 N ALA A 103 9.679 -6.612 -15.649 1.00 0.00 N ATOM 1548 CA ALA A 103 11.032 -6.889 -15.276 1.00 0.00 C ATOM 1549 C ALA A 103 11.663 -6.096 -14.184 1.00 0.00 C ATOM 1550 O ALA A 103 12.244 -6.635 -13.243 1.00 0.00 O ATOM 1551 CB ALA A 103 11.936 -6.780 -16.515 1.00 0.00 C ATOM 0 H ALA A 103 9.547 -6.436 -16.645 1.00 0.00 H new ATOM 0 HA ALA A 103 10.949 -7.892 -14.856 1.00 0.00 H new ATOM 0 HB1 ALA A 103 12.967 -6.991 -16.233 1.00 0.00 H new ATOM 0 HB2 ALA A 103 11.611 -7.499 -17.267 1.00 0.00 H new ATOM 0 HB3 ALA A 103 11.871 -5.772 -16.925 1.00 0.00 H new ATOM 1557 N GLU A 104 11.488 -4.764 -14.241 1.00 0.00 N ATOM 1558 CA GLU A 104 11.913 -3.847 -13.230 1.00 0.00 C ATOM 1559 C GLU A 104 11.073 -3.974 -12.006 1.00 0.00 C ATOM 1560 O GLU A 104 11.591 -3.954 -10.890 1.00 0.00 O ATOM 1561 CB GLU A 104 11.719 -2.410 -13.744 1.00 0.00 C ATOM 1562 CG GLU A 104 12.631 -2.070 -14.924 1.00 0.00 C ATOM 1563 CD GLU A 104 12.068 -0.853 -15.645 1.00 0.00 C ATOM 1564 OE1 GLU A 104 11.130 -0.965 -16.479 1.00 0.00 O ATOM 1565 OE2 GLU A 104 12.612 0.264 -15.435 1.00 0.00 O ATOM 0 H GLU A 104 11.029 -4.305 -15.028 1.00 0.00 H new ATOM 0 HA GLU A 104 12.955 -4.066 -12.998 1.00 0.00 H new ATOM 0 HB2 GLU A 104 10.680 -2.274 -14.044 1.00 0.00 H new ATOM 0 HB3 GLU A 104 11.910 -1.710 -12.931 1.00 0.00 H new ATOM 0 HG2 GLU A 104 13.642 -1.866 -14.573 1.00 0.00 H new ATOM 0 HG3 GLU A 104 12.696 -2.917 -15.607 1.00 0.00 H new ATOM 1572 N LEU A 105 9.736 -4.065 -12.111 1.00 0.00 N ATOM 1573 CA LEU A 105 8.778 -4.006 -11.051 1.00 0.00 C ATOM 1574 C LEU A 105 8.897 -5.187 -10.149 1.00 0.00 C ATOM 1575 O LEU A 105 8.684 -5.048 -8.946 1.00 0.00 O ATOM 1576 CB LEU A 105 7.353 -3.902 -11.621 1.00 0.00 C ATOM 1577 CG LEU A 105 6.337 -3.358 -10.603 1.00 0.00 C ATOM 1578 CD1 LEU A 105 6.478 -1.830 -10.496 1.00 0.00 C ATOM 1579 CD2 LEU A 105 4.919 -3.746 -11.053 1.00 0.00 C ATOM 0 H LEU A 105 9.287 -4.191 -13.018 1.00 0.00 H new ATOM 0 HA LEU A 105 8.984 -3.113 -10.460 1.00 0.00 H new ATOM 0 HB2 LEU A 105 7.364 -3.253 -12.497 1.00 0.00 H new ATOM 0 HB3 LEU A 105 7.030 -4.887 -11.958 1.00 0.00 H new ATOM 0 HG LEU A 105 6.526 -3.788 -9.619 1.00 0.00 H new ATOM 0 HD11 LEU A 105 5.757 -1.448 -9.774 1.00 0.00 H new ATOM 0 HD12 LEU A 105 7.487 -1.580 -10.168 1.00 0.00 H new ATOM 0 HD13 LEU A 105 6.290 -1.378 -11.470 1.00 0.00 H new ATOM 0 HD21 LEU A 105 4.192 -3.364 -10.336 1.00 0.00 H new ATOM 0 HD22 LEU A 105 4.719 -3.318 -12.035 1.00 0.00 H new ATOM 0 HD23 LEU A 105 4.839 -4.832 -11.107 1.00 0.00 H new ATOM 1591 N ARG A 106 9.175 -6.392 -10.676 1.00 0.00 N ATOM 1592 CA ARG A 106 9.259 -7.561 -9.856 1.00 0.00 C ATOM 1593 C ARG A 106 10.557 -7.568 -9.124 1.00 0.00 C ATOM 1594 O ARG A 106 10.698 -7.970 -7.971 1.00 0.00 O ATOM 1595 CB ARG A 106 9.133 -8.826 -10.721 1.00 0.00 C ATOM 1596 CG ARG A 106 10.260 -9.190 -11.690 1.00 0.00 C ATOM 1597 CD ARG A 106 9.842 -10.147 -12.808 1.00 0.00 C ATOM 1598 NE ARG A 106 10.991 -10.392 -13.724 1.00 0.00 N ATOM 1599 CZ ARG A 106 10.902 -11.356 -14.686 1.00 0.00 C ATOM 1600 NH1 ARG A 106 9.794 -11.988 -15.173 1.00 0.00 N ATOM 1601 NH2 ARG A 106 12.080 -11.860 -15.157 1.00 0.00 N ATOM 0 H ARG A 106 9.342 -6.558 -11.669 1.00 0.00 H new ATOM 0 HA ARG A 106 8.442 -7.550 -9.135 1.00 0.00 H new ATOM 0 HB2 ARG A 106 8.996 -9.671 -10.046 1.00 0.00 H new ATOM 0 HB3 ARG A 106 8.217 -8.733 -11.305 1.00 0.00 H new ATOM 0 HG2 ARG A 106 10.649 -8.275 -12.137 1.00 0.00 H new ATOM 0 HG3 ARG A 106 11.076 -9.642 -11.127 1.00 0.00 H new ATOM 0 HD2 ARG A 106 9.498 -11.090 -12.382 1.00 0.00 H new ATOM 0 HD3 ARG A 106 9.005 -9.725 -13.365 1.00 0.00 H new ATOM 0 HE ARG A 106 11.844 -9.840 -13.632 1.00 0.00 H new ATOM 0 HH11 ARG A 106 8.871 -11.752 -14.809 1.00 0.00 H new ATOM 0 HH12 ARG A 106 9.889 -12.696 -15.901 1.00 0.00 H new ATOM 0 HH21 ARG A 106 12.966 -11.514 -14.789 1.00 0.00 H new ATOM 0 HH22 ARG A 106 12.074 -12.583 -15.877 1.00 0.00 H new ATOM 1615 N HIS A 107 11.590 -6.967 -9.743 1.00 0.00 N ATOM 1616 CA HIS A 107 12.790 -6.713 -9.008 1.00 0.00 C ATOM 1617 C HIS A 107 12.710 -5.683 -7.935 1.00 0.00 C ATOM 1618 O HIS A 107 13.133 -5.980 -6.819 1.00 0.00 O ATOM 1619 CB HIS A 107 13.926 -6.433 -10.007 1.00 0.00 C ATOM 1620 CG HIS A 107 15.274 -5.961 -9.548 1.00 0.00 C ATOM 1621 ND1 HIS A 107 15.851 -4.730 -9.565 1.00 0.00 N flip ATOM 1622 CD2 HIS A 107 16.089 -6.732 -8.745 1.00 0.00 C flip ATOM 1623 CE1 HIS A 107 17.022 -4.715 -8.835 1.00 0.00 C flip ATOM 1624 NE2 HIS A 107 17.137 -5.948 -8.377 1.00 0.00 N flip ATOM 0 H HIS A 107 11.598 -6.666 -10.718 1.00 0.00 H new ATOM 0 HA HIS A 107 12.991 -7.617 -8.433 1.00 0.00 H new ATOM 0 HB2 HIS A 107 14.087 -7.352 -10.570 1.00 0.00 H new ATOM 0 HB3 HIS A 107 13.553 -5.689 -10.711 1.00 0.00 H new ATOM 0 HD2 HIS A 107 15.926 -7.762 -8.463 1.00 0.00 H new ATOM 0 HE1 HIS A 107 17.692 -3.883 -8.675 1.00 0.00 H new ATOM 0 HE2 HIS A 107 17.921 -6.275 -7.812 1.00 0.00 H new ATOM 1632 N VAL A 108 12.119 -4.508 -8.211 1.00 0.00 N ATOM 1633 CA VAL A 108 12.036 -3.522 -7.178 1.00 0.00 C ATOM 1634 C VAL A 108 11.254 -3.929 -5.977 1.00 0.00 C ATOM 1635 O VAL A 108 11.783 -3.825 -4.871 1.00 0.00 O ATOM 1636 CB VAL A 108 11.598 -2.208 -7.753 1.00 0.00 C ATOM 1637 CG1 VAL A 108 11.441 -1.104 -6.694 1.00 0.00 C ATOM 1638 CG2 VAL A 108 12.605 -1.636 -8.765 1.00 0.00 C ATOM 0 H VAL A 108 11.714 -4.246 -9.110 1.00 0.00 H new ATOM 0 HA VAL A 108 13.044 -3.407 -6.780 1.00 0.00 H new ATOM 0 HB VAL A 108 10.644 -2.449 -8.221 1.00 0.00 H new ATOM 0 HG11 VAL A 108 11.122 -0.180 -7.176 1.00 0.00 H new ATOM 0 HG12 VAL A 108 10.694 -1.407 -5.961 1.00 0.00 H new ATOM 0 HG13 VAL A 108 12.396 -0.942 -6.193 1.00 0.00 H new ATOM 0 HG21 VAL A 108 12.235 -0.685 -9.148 1.00 0.00 H new ATOM 0 HG22 VAL A 108 13.566 -1.481 -8.274 1.00 0.00 H new ATOM 0 HG23 VAL A 108 12.728 -2.336 -9.591 1.00 0.00 H new ATOM 1648 N MET A 109 10.028 -4.442 -6.182 1.00 0.00 N ATOM 1649 CA MET A 109 9.215 -4.956 -5.124 1.00 0.00 C ATOM 1650 C MET A 109 9.785 -6.130 -4.406 1.00 0.00 C ATOM 1651 O MET A 109 9.658 -6.132 -3.183 1.00 0.00 O ATOM 1652 CB MET A 109 7.815 -5.323 -5.644 1.00 0.00 C ATOM 1653 CG MET A 109 7.040 -4.152 -6.252 1.00 0.00 C ATOM 1654 SD MET A 109 6.927 -2.528 -5.445 1.00 0.00 S ATOM 1655 CE MET A 109 5.778 -1.919 -6.713 1.00 0.00 C ATOM 0 H MET A 109 9.592 -4.501 -7.102 1.00 0.00 H new ATOM 0 HA MET A 109 9.165 -4.144 -4.399 1.00 0.00 H new ATOM 0 HB2 MET A 109 7.914 -6.107 -6.395 1.00 0.00 H new ATOM 0 HB3 MET A 109 7.233 -5.740 -4.822 1.00 0.00 H new ATOM 0 HG2 MET A 109 7.463 -3.979 -7.242 1.00 0.00 H new ATOM 0 HG3 MET A 109 6.017 -4.498 -6.399 1.00 0.00 H new ATOM 0 HE1 MET A 109 6.001 -0.876 -6.936 1.00 0.00 H new ATOM 0 HE2 MET A 109 5.887 -2.515 -7.619 1.00 0.00 H new ATOM 0 HE3 MET A 109 4.755 -2.001 -6.346 1.00 0.00 H new ATOM 1665 N THR A 110 10.529 -7.070 -5.017 1.00 0.00 N ATOM 1666 CA THR A 110 11.354 -8.028 -4.350 1.00 0.00 C ATOM 1667 C THR A 110 12.363 -7.511 -3.383 1.00 0.00 C ATOM 1668 O THR A 110 12.573 -7.978 -2.265 1.00 0.00 O ATOM 1669 CB THR A 110 12.177 -8.887 -5.264 1.00 0.00 C ATOM 1670 OG1 THR A 110 11.415 -9.587 -6.237 1.00 0.00 O ATOM 1671 CG2 THR A 110 12.753 -10.028 -4.408 1.00 0.00 C ATOM 0 H THR A 110 10.555 -7.166 -6.032 1.00 0.00 H new ATOM 0 HA THR A 110 10.564 -8.570 -3.830 1.00 0.00 H new ATOM 0 HB THR A 110 12.892 -8.221 -5.747 1.00 0.00 H new ATOM 0 HG1 THR A 110 11.534 -9.163 -7.113 1.00 0.00 H new ATOM 0 HG21 THR A 110 13.361 -10.681 -5.034 1.00 0.00 H new ATOM 0 HG22 THR A 110 13.370 -9.610 -3.612 1.00 0.00 H new ATOM 0 HG23 THR A 110 11.937 -10.602 -3.970 1.00 0.00 H new ATOM 1679 N ASN A 111 13.006 -6.424 -3.845 1.00 0.00 N ATOM 1680 CA ASN A 111 13.927 -5.715 -3.012 1.00 0.00 C ATOM 1681 C ASN A 111 13.266 -4.934 -1.929 1.00 0.00 C ATOM 1682 O ASN A 111 13.738 -4.940 -0.793 1.00 0.00 O ATOM 1683 CB ASN A 111 14.930 -4.811 -3.748 1.00 0.00 C ATOM 1684 CG ASN A 111 15.608 -5.404 -4.974 1.00 0.00 C ATOM 1685 OD1 ASN A 111 15.636 -4.496 -5.986 1.00 0.00 O flip ATOM 1686 ND2 ASN A 111 16.168 -6.498 -5.037 1.00 0.00 N flip ATOM 0 H ASN A 111 12.891 -6.040 -4.783 1.00 0.00 H new ATOM 0 HA ASN A 111 14.502 -6.529 -2.571 1.00 0.00 H new ATOM 0 HB2 ASN A 111 14.410 -3.902 -4.052 1.00 0.00 H new ATOM 0 HB3 ASN A 111 15.704 -4.514 -3.040 1.00 0.00 H new ATOM 0 HD21 ASN A 111 16.116 -7.144 -4.249 1.00 0.00 H new ATOM 0 HD22 ASN A 111 16.684 -6.759 -5.877 1.00 0.00 H new ATOM 1693 N LEU A 112 12.083 -4.348 -2.185 1.00 0.00 N ATOM 1694 CA LEU A 112 11.352 -3.572 -1.232 1.00 0.00 C ATOM 1695 C LEU A 112 11.162 -4.151 0.128 1.00 0.00 C ATOM 1696 O LEU A 112 11.475 -3.517 1.134 1.00 0.00 O ATOM 1697 CB LEU A 112 10.060 -3.035 -1.871 1.00 0.00 C ATOM 1698 CG LEU A 112 9.271 -1.991 -1.063 1.00 0.00 C ATOM 1699 CD1 LEU A 112 10.064 -0.679 -0.936 1.00 0.00 C ATOM 1700 CD2 LEU A 112 7.888 -1.761 -1.695 1.00 0.00 C ATOM 0 H LEU A 112 11.618 -4.417 -3.090 1.00 0.00 H new ATOM 0 HA LEU A 112 12.007 -2.736 -0.989 1.00 0.00 H new ATOM 0 HB2 LEU A 112 10.315 -2.597 -2.836 1.00 0.00 H new ATOM 0 HB3 LEU A 112 9.401 -3.881 -2.069 1.00 0.00 H new ATOM 0 HG LEU A 112 9.118 -2.374 -0.054 1.00 0.00 H new ATOM 0 HD11 LEU A 112 9.484 0.042 -0.360 1.00 0.00 H new ATOM 0 HD12 LEU A 112 11.009 -0.873 -0.428 1.00 0.00 H new ATOM 0 HD13 LEU A 112 10.262 -0.276 -1.929 1.00 0.00 H new ATOM 0 HD21 LEU A 112 7.341 -1.020 -1.113 1.00 0.00 H new ATOM 0 HD22 LEU A 112 8.010 -1.402 -2.717 1.00 0.00 H new ATOM 0 HD23 LEU A 112 7.332 -2.698 -1.704 1.00 0.00 H new ATOM 1712 N GLY A 113 10.637 -5.378 0.290 1.00 0.00 N ATOM 1713 CA GLY A 113 10.530 -6.005 1.571 1.00 0.00 C ATOM 1714 C GLY A 113 10.165 -7.448 1.503 1.00 0.00 C ATOM 1715 O GLY A 113 10.775 -8.277 2.177 1.00 0.00 O ATOM 0 H GLY A 113 10.281 -5.944 -0.480 1.00 0.00 H new ATOM 0 HA2 GLY A 113 11.480 -5.904 2.096 1.00 0.00 H new ATOM 0 HA3 GLY A 113 9.782 -5.478 2.162 1.00 0.00 H new ATOM 1719 N GLU A 114 9.179 -7.822 0.669 1.00 0.00 N ATOM 1720 CA GLU A 114 8.674 -9.158 0.592 1.00 0.00 C ATOM 1721 C GLU A 114 9.230 -10.069 -0.448 1.00 0.00 C ATOM 1722 O GLU A 114 9.235 -9.713 -1.625 1.00 0.00 O ATOM 1723 CB GLU A 114 7.163 -9.105 0.313 1.00 0.00 C ATOM 1724 CG GLU A 114 6.355 -8.168 1.214 1.00 0.00 C ATOM 1725 CD GLU A 114 4.848 -8.318 1.062 1.00 0.00 C ATOM 1726 OE1 GLU A 114 4.216 -7.627 0.219 1.00 0.00 O ATOM 1727 OE2 GLU A 114 4.255 -8.998 1.941 1.00 0.00 O ATOM 0 H GLU A 114 8.719 -7.175 0.028 1.00 0.00 H new ATOM 0 HA GLU A 114 8.973 -9.574 1.554 1.00 0.00 H new ATOM 0 HB2 GLU A 114 7.014 -8.801 -0.723 1.00 0.00 H new ATOM 0 HB3 GLU A 114 6.758 -10.112 0.411 1.00 0.00 H new ATOM 0 HG2 GLU A 114 6.626 -8.355 2.253 1.00 0.00 H new ATOM 0 HG3 GLU A 114 6.632 -7.137 0.992 1.00 0.00 H new ATOM 1734 N LYS A 115 9.726 -11.259 -0.066 1.00 0.00 N ATOM 1735 CA LYS A 115 10.247 -12.201 -1.008 1.00 0.00 C ATOM 1736 C LYS A 115 9.077 -13.051 -1.368 1.00 0.00 C ATOM 1737 O LYS A 115 8.710 -13.848 -0.506 1.00 0.00 O ATOM 1738 CB LYS A 115 11.419 -13.039 -0.471 1.00 0.00 C ATOM 1739 CG LYS A 115 12.563 -12.134 -0.008 1.00 0.00 C ATOM 1740 CD LYS A 115 13.214 -11.532 -1.254 1.00 0.00 C ATOM 1741 CE LYS A 115 14.490 -10.744 -0.949 1.00 0.00 C ATOM 1742 NZ LYS A 115 14.194 -9.355 -0.531 1.00 0.00 N ATOM 0 H LYS A 115 9.766 -11.571 0.904 1.00 0.00 H new ATOM 0 HA LYS A 115 10.681 -11.689 -1.867 1.00 0.00 H new ATOM 0 HB2 LYS A 115 11.080 -13.658 0.359 1.00 0.00 H new ATOM 0 HB3 LYS A 115 11.775 -13.715 -1.248 1.00 0.00 H new ATOM 0 HG2 LYS A 115 12.187 -11.347 0.645 1.00 0.00 H new ATOM 0 HG3 LYS A 115 13.293 -12.704 0.567 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.448 -12.332 -1.956 1.00 0.00 H new ATOM 0 HD3 LYS A 115 12.498 -10.875 -1.748 1.00 0.00 H new ATOM 0 HE2 LYS A 115 15.049 -11.249 -0.161 1.00 0.00 H new ATOM 0 HE3 LYS A 115 15.128 -10.729 -1.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 15.036 -8.762 -0.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 13.406 -8.982 -1.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 13.931 -9.344 0.475 1.00 0.00 H new ATOM 1756 N LEU A 116 8.551 -12.950 -2.602 1.00 0.00 N ATOM 1757 CA LEU A 116 7.532 -13.758 -3.198 1.00 0.00 C ATOM 1758 C LEU A 116 8.153 -14.775 -4.093 1.00 0.00 C ATOM 1759 O LEU A 116 9.341 -14.645 -4.382 1.00 0.00 O ATOM 1760 CB LEU A 116 6.656 -12.841 -4.068 1.00 0.00 C ATOM 1761 CG LEU A 116 5.927 -11.696 -3.345 1.00 0.00 C ATOM 1762 CD1 LEU A 116 4.891 -11.059 -4.285 1.00 0.00 C ATOM 1763 CD2 LEU A 116 5.324 -12.029 -1.969 1.00 0.00 C ATOM 0 H LEU A 116 8.874 -12.228 -3.246 1.00 0.00 H new ATOM 0 HA LEU A 116 6.952 -14.255 -2.420 1.00 0.00 H new ATOM 0 HB2 LEU A 116 7.285 -12.407 -4.846 1.00 0.00 H new ATOM 0 HB3 LEU A 116 5.910 -13.458 -4.569 1.00 0.00 H new ATOM 0 HG LEU A 116 6.707 -10.976 -3.098 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.379 -10.249 -3.766 1.00 0.00 H new ATOM 0 HD12 LEU A 116 5.395 -10.664 -5.167 1.00 0.00 H new ATOM 0 HD13 LEU A 116 4.164 -11.812 -4.589 1.00 0.00 H new ATOM 0 HD21 LEU A 116 4.838 -11.143 -1.561 1.00 0.00 H new ATOM 0 HD22 LEU A 116 4.591 -12.828 -2.077 1.00 0.00 H new ATOM 0 HD23 LEU A 116 6.116 -12.352 -1.293 1.00 0.00 H new ATOM 1775 N THR A 117 7.374 -15.738 -4.619 1.00 0.00 N ATOM 1776 CA THR A 117 7.763 -16.692 -5.611 1.00 0.00 C ATOM 1777 C THR A 117 7.309 -16.104 -6.902 1.00 0.00 C ATOM 1778 O THR A 117 6.519 -15.162 -6.942 1.00 0.00 O ATOM 1779 CB THR A 117 7.063 -18.009 -5.457 1.00 0.00 C ATOM 1780 OG1 THR A 117 5.685 -17.997 -5.112 1.00 0.00 O ATOM 1781 CG2 THR A 117 7.763 -18.659 -4.252 1.00 0.00 C ATOM 0 H THR A 117 6.403 -15.857 -4.329 1.00 0.00 H new ATOM 0 HA THR A 117 8.834 -16.880 -5.539 1.00 0.00 H new ATOM 0 HB THR A 117 7.113 -18.498 -6.430 1.00 0.00 H new ATOM 0 HG1 THR A 117 5.356 -18.918 -5.046 1.00 0.00 H new ATOM 0 HG21 THR A 117 7.319 -19.635 -4.057 1.00 0.00 H new ATOM 0 HG22 THR A 117 8.824 -18.780 -4.469 1.00 0.00 H new ATOM 0 HG23 THR A 117 7.642 -18.023 -3.375 1.00 0.00 H new ATOM 1789 N ASP A 118 7.644 -16.719 -8.050 1.00 0.00 N ATOM 1790 CA ASP A 118 7.394 -16.175 -9.349 1.00 0.00 C ATOM 1791 C ASP A 118 5.960 -16.086 -9.745 1.00 0.00 C ATOM 1792 O ASP A 118 5.590 -15.018 -10.230 1.00 0.00 O ATOM 1793 CB ASP A 118 8.038 -17.102 -10.393 1.00 0.00 C ATOM 1794 CG ASP A 118 9.555 -17.092 -10.267 1.00 0.00 C ATOM 1795 OD1 ASP A 118 10.058 -15.952 -10.081 1.00 0.00 O ATOM 1796 OD2 ASP A 118 10.260 -18.129 -10.394 1.00 0.00 O ATOM 0 H ASP A 118 8.106 -17.628 -8.075 1.00 0.00 H new ATOM 0 HA ASP A 118 7.798 -15.163 -9.309 1.00 0.00 H new ATOM 0 HB2 ASP A 118 7.665 -18.118 -10.262 1.00 0.00 H new ATOM 0 HB3 ASP A 118 7.750 -16.783 -11.395 1.00 0.00 H new ATOM 1801 N GLU A 119 5.153 -17.133 -9.498 1.00 0.00 N ATOM 1802 CA GLU A 119 3.766 -17.115 -9.845 1.00 0.00 C ATOM 1803 C GLU A 119 2.955 -16.301 -8.896 1.00 0.00 C ATOM 1804 O GLU A 119 2.041 -15.610 -9.344 1.00 0.00 O ATOM 1805 CB GLU A 119 3.233 -18.552 -9.980 1.00 0.00 C ATOM 1806 CG GLU A 119 4.066 -19.344 -10.989 1.00 0.00 C ATOM 1807 CD GLU A 119 3.501 -20.745 -11.177 1.00 0.00 C ATOM 1808 OE1 GLU A 119 3.430 -21.576 -10.232 1.00 0.00 O ATOM 1809 OE2 GLU A 119 3.010 -20.944 -12.320 1.00 0.00 O ATOM 0 H GLU A 119 5.464 -17.998 -9.055 1.00 0.00 H new ATOM 0 HA GLU A 119 3.669 -16.625 -10.814 1.00 0.00 H new ATOM 0 HB2 GLU A 119 3.260 -19.048 -9.010 1.00 0.00 H new ATOM 0 HB3 GLU A 119 2.191 -18.530 -10.298 1.00 0.00 H new ATOM 0 HG2 GLU A 119 4.080 -18.821 -11.945 1.00 0.00 H new ATOM 0 HG3 GLU A 119 5.098 -19.407 -10.645 1.00 0.00 H new ATOM 1816 N GLU A 120 3.391 -16.161 -7.632 1.00 0.00 N ATOM 1817 CA GLU A 120 2.949 -15.133 -6.741 1.00 0.00 C ATOM 1818 C GLU A 120 3.141 -13.746 -7.251 1.00 0.00 C ATOM 1819 O GLU A 120 2.244 -12.908 -7.188 1.00 0.00 O ATOM 1820 CB GLU A 120 3.531 -15.319 -5.330 1.00 0.00 C ATOM 1821 CG GLU A 120 2.933 -14.350 -4.307 1.00 0.00 C ATOM 1822 CD GLU A 120 1.481 -14.700 -4.017 1.00 0.00 C ATOM 1823 OE1 GLU A 120 0.980 -15.843 -4.192 1.00 0.00 O ATOM 1824 OE2 GLU A 120 0.808 -13.741 -3.553 1.00 0.00 O ATOM 0 H GLU A 120 4.078 -16.788 -7.214 1.00 0.00 H new ATOM 0 HA GLU A 120 1.868 -15.254 -6.678 1.00 0.00 H new ATOM 0 HB2 GLU A 120 3.353 -16.343 -5.001 1.00 0.00 H new ATOM 0 HB3 GLU A 120 4.611 -15.180 -5.367 1.00 0.00 H new ATOM 0 HG2 GLU A 120 3.512 -14.385 -3.384 1.00 0.00 H new ATOM 0 HG3 GLU A 120 2.998 -13.330 -4.685 1.00 0.00 H new ATOM 1831 N VAL A 121 4.328 -13.476 -7.824 1.00 0.00 N ATOM 1832 CA VAL A 121 4.564 -12.180 -8.381 1.00 0.00 C ATOM 1833 C VAL A 121 3.755 -11.902 -9.601 1.00 0.00 C ATOM 1834 O VAL A 121 3.042 -10.912 -9.762 1.00 0.00 O ATOM 1835 CB VAL A 121 5.985 -12.116 -8.857 1.00 0.00 C ATOM 1836 CG1 VAL A 121 6.312 -10.896 -9.736 1.00 0.00 C ATOM 1837 CG2 VAL A 121 6.831 -12.018 -7.577 1.00 0.00 C ATOM 0 H VAL A 121 5.104 -14.133 -7.901 1.00 0.00 H new ATOM 0 HA VAL A 121 4.312 -11.468 -7.595 1.00 0.00 H new ATOM 0 HB VAL A 121 6.183 -12.990 -9.478 1.00 0.00 H new ATOM 0 HG11 VAL A 121 7.360 -10.932 -10.034 1.00 0.00 H new ATOM 0 HG12 VAL A 121 5.682 -10.909 -10.625 1.00 0.00 H new ATOM 0 HG13 VAL A 121 6.126 -9.981 -9.173 1.00 0.00 H new ATOM 0 HG21 VAL A 121 7.887 -11.967 -7.842 1.00 0.00 H new ATOM 0 HG22 VAL A 121 6.552 -11.121 -7.024 1.00 0.00 H new ATOM 0 HG23 VAL A 121 6.655 -12.896 -6.956 1.00 0.00 H new ATOM 1847 N ASP A 122 3.689 -12.837 -10.565 1.00 0.00 N ATOM 1848 CA ASP A 122 2.812 -12.764 -11.692 1.00 0.00 C ATOM 1849 C ASP A 122 1.354 -12.520 -11.509 1.00 0.00 C ATOM 1850 O ASP A 122 0.769 -11.649 -12.152 1.00 0.00 O ATOM 1851 CB ASP A 122 2.897 -14.071 -12.499 1.00 0.00 C ATOM 1852 CG ASP A 122 4.194 -14.309 -13.259 1.00 0.00 C ATOM 1853 OD1 ASP A 122 4.981 -13.361 -13.523 1.00 0.00 O ATOM 1854 OD2 ASP A 122 4.404 -15.397 -13.857 1.00 0.00 O ATOM 0 H ASP A 122 4.269 -13.676 -10.559 1.00 0.00 H new ATOM 0 HA ASP A 122 3.193 -11.860 -12.166 1.00 0.00 H new ATOM 0 HB2 ASP A 122 2.742 -14.906 -11.816 1.00 0.00 H new ATOM 0 HB3 ASP A 122 2.074 -14.087 -13.213 1.00 0.00 H new ATOM 1859 N GLU A 123 0.795 -13.187 -10.484 1.00 0.00 N ATOM 1860 CA GLU A 123 -0.468 -12.763 -9.964 1.00 0.00 C ATOM 1861 C GLU A 123 -0.545 -11.394 -9.383 1.00 0.00 C ATOM 1862 O GLU A 123 -1.544 -10.733 -9.663 1.00 0.00 O ATOM 1863 CB GLU A 123 -1.016 -13.755 -8.924 1.00 0.00 C ATOM 1864 CG GLU A 123 -1.350 -15.131 -9.504 1.00 0.00 C ATOM 1865 CD GLU A 123 -1.772 -16.185 -8.491 1.00 0.00 C ATOM 1866 OE1 GLU A 123 -1.419 -16.166 -7.282 1.00 0.00 O ATOM 1867 OE2 GLU A 123 -2.505 -17.138 -8.869 1.00 0.00 O ATOM 0 H GLU A 123 1.205 -14.000 -10.024 1.00 0.00 H new ATOM 0 HA GLU A 123 -1.078 -12.735 -10.867 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -0.282 -13.875 -8.127 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -1.913 -13.334 -8.471 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -2.150 -15.013 -10.234 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -0.478 -15.500 -10.044 1.00 0.00 H new ATOM 1874 N MET A 124 0.440 -10.926 -8.596 1.00 0.00 N ATOM 1875 CA MET A 124 0.373 -9.559 -8.181 1.00 0.00 C ATOM 1876 C MET A 124 0.463 -8.574 -9.295 1.00 0.00 C ATOM 1877 O MET A 124 -0.184 -7.530 -9.366 1.00 0.00 O ATOM 1878 CB MET A 124 1.554 -9.445 -7.203 1.00 0.00 C ATOM 1879 CG MET A 124 1.669 -8.109 -6.467 1.00 0.00 C ATOM 1880 SD MET A 124 3.258 -8.057 -5.585 1.00 0.00 S ATOM 1881 CE MET A 124 4.333 -7.891 -7.040 1.00 0.00 C ATOM 0 H MET A 124 1.242 -11.459 -8.261 1.00 0.00 H new ATOM 0 HA MET A 124 -0.593 -9.316 -7.738 1.00 0.00 H new ATOM 0 HB2 MET A 124 1.470 -10.242 -6.464 1.00 0.00 H new ATOM 0 HB3 MET A 124 2.478 -9.618 -7.754 1.00 0.00 H new ATOM 0 HG2 MET A 124 1.603 -7.282 -7.174 1.00 0.00 H new ATOM 0 HG3 MET A 124 0.844 -7.994 -5.764 1.00 0.00 H new ATOM 0 HE1 MET A 124 5.115 -7.160 -6.833 1.00 0.00 H new ATOM 0 HE2 MET A 124 4.788 -8.855 -7.268 1.00 0.00 H new ATOM 0 HE3 MET A 124 3.742 -7.558 -7.893 1.00 0.00 H new ATOM 1891 N ILE A 125 1.199 -8.946 -10.357 1.00 0.00 N ATOM 1892 CA ILE A 125 1.357 -8.061 -11.470 1.00 0.00 C ATOM 1893 C ILE A 125 0.123 -7.943 -12.296 1.00 0.00 C ATOM 1894 O ILE A 125 -0.235 -6.901 -12.843 1.00 0.00 O ATOM 1895 CB ILE A 125 2.590 -8.382 -12.262 1.00 0.00 C ATOM 1896 CG1 ILE A 125 3.797 -8.253 -11.318 1.00 0.00 C ATOM 1897 CG2 ILE A 125 2.710 -7.227 -13.270 1.00 0.00 C ATOM 1898 CD1 ILE A 125 5.097 -8.779 -11.926 1.00 0.00 C ATOM 0 H ILE A 125 1.677 -9.843 -10.446 1.00 0.00 H new ATOM 0 HA ILE A 125 1.512 -7.061 -11.066 1.00 0.00 H new ATOM 0 HB ILE A 125 2.551 -9.370 -12.720 1.00 0.00 H new ATOM 0 HG12 ILE A 125 3.928 -7.205 -11.048 1.00 0.00 H new ATOM 0 HG13 ILE A 125 3.589 -8.796 -10.396 1.00 0.00 H new ATOM 0 HG21 ILE A 125 3.590 -7.380 -13.895 1.00 0.00 H new ATOM 0 HG22 ILE A 125 1.819 -7.198 -13.898 1.00 0.00 H new ATOM 0 HG23 ILE A 125 2.806 -6.284 -12.733 1.00 0.00 H new ATOM 0 HD11 ILE A 125 5.909 -8.659 -11.209 1.00 0.00 H new ATOM 0 HD12 ILE A 125 4.983 -9.835 -12.171 1.00 0.00 H new ATOM 0 HD13 ILE A 125 5.327 -8.219 -12.832 1.00 0.00 H new ATOM 1910 N ARG A 126 -0.540 -9.112 -12.350 1.00 0.00 N ATOM 1911 CA ARG A 126 -1.731 -9.298 -13.119 1.00 0.00 C ATOM 1912 C ARG A 126 -2.811 -8.434 -12.564 1.00 0.00 C ATOM 1913 O ARG A 126 -3.552 -7.799 -13.313 1.00 0.00 O ATOM 1914 CB ARG A 126 -2.208 -10.760 -13.083 1.00 0.00 C ATOM 1915 CG ARG A 126 -3.511 -11.055 -13.829 1.00 0.00 C ATOM 1916 CD ARG A 126 -4.072 -12.479 -13.837 1.00 0.00 C ATOM 1917 NE ARG A 126 -2.939 -13.427 -14.032 1.00 0.00 N ATOM 1918 CZ ARG A 126 -2.775 -14.669 -13.491 1.00 0.00 C ATOM 1919 NH1 ARG A 126 -3.559 -15.240 -12.530 1.00 0.00 N ATOM 1920 NH2 ARG A 126 -1.878 -15.527 -14.058 1.00 0.00 N ATOM 0 H ARG A 126 -0.241 -9.948 -11.847 1.00 0.00 H new ATOM 0 HA ARG A 126 -1.508 -9.032 -14.152 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -1.422 -11.389 -13.501 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -2.333 -11.056 -12.041 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -4.280 -10.404 -13.413 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -3.367 -10.755 -14.867 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -4.586 -12.690 -12.899 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -4.805 -12.594 -14.636 1.00 0.00 H new ATOM 0 HE ARG A 126 -2.191 -13.107 -14.648 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -4.355 -14.727 -12.150 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -3.349 -16.179 -12.192 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -1.341 -15.237 -14.875 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -1.745 -16.459 -13.665 1.00 0.00 H new ATOM 1934 N GLU A 127 -2.879 -8.301 -11.227 1.00 0.00 N ATOM 1935 CA GLU A 127 -3.826 -7.391 -10.663 1.00 0.00 C ATOM 1936 C GLU A 127 -3.438 -5.954 -10.725 1.00 0.00 C ATOM 1937 O GLU A 127 -4.331 -5.108 -10.758 1.00 0.00 O ATOM 1938 CB GLU A 127 -4.375 -7.887 -9.314 1.00 0.00 C ATOM 1939 CG GLU A 127 -3.363 -7.675 -8.186 1.00 0.00 C ATOM 1940 CD GLU A 127 -3.802 -7.870 -6.741 1.00 0.00 C ATOM 1941 OE1 GLU A 127 -3.734 -8.973 -6.137 1.00 0.00 O ATOM 1942 OE2 GLU A 127 -4.057 -6.792 -6.140 1.00 0.00 O ATOM 0 H GLU A 127 -2.299 -8.805 -10.556 1.00 0.00 H new ATOM 0 HA GLU A 127 -4.686 -7.399 -11.332 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -5.299 -7.359 -9.079 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -4.623 -8.946 -9.388 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -2.526 -8.349 -8.367 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -2.980 -6.659 -8.277 1.00 0.00 H new ATOM 1949 N ALA A 128 -2.127 -5.653 -10.707 1.00 0.00 N ATOM 1950 CA ALA A 128 -1.595 -4.329 -10.803 1.00 0.00 C ATOM 1951 C ALA A 128 -1.600 -3.672 -12.140 1.00 0.00 C ATOM 1952 O ALA A 128 -1.748 -2.456 -12.242 1.00 0.00 O ATOM 1953 CB ALA A 128 -0.150 -4.367 -10.278 1.00 0.00 C ATOM 0 H ALA A 128 -1.404 -6.367 -10.621 1.00 0.00 H new ATOM 0 HA ALA A 128 -2.275 -3.715 -10.213 1.00 0.00 H new ATOM 0 HB1 ALA A 128 0.285 -3.369 -10.338 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.148 -4.702 -9.241 1.00 0.00 H new ATOM 0 HB3 ALA A 128 0.439 -5.057 -10.883 1.00 0.00 H new ATOM 1959 N ASP A 129 -1.412 -4.404 -13.253 1.00 0.00 N ATOM 1960 CA ASP A 129 -1.527 -3.912 -14.591 1.00 0.00 C ATOM 1961 C ASP A 129 -2.958 -3.798 -14.990 1.00 0.00 C ATOM 1962 O ASP A 129 -3.641 -4.821 -15.022 1.00 0.00 O ATOM 1963 CB ASP A 129 -0.766 -4.761 -15.622 1.00 0.00 C ATOM 1964 CG ASP A 129 -0.463 -3.906 -16.844 1.00 0.00 C ATOM 1965 OD1 ASP A 129 -1.399 -3.633 -17.642 1.00 0.00 O ATOM 1966 OD2 ASP A 129 0.522 -3.122 -16.781 1.00 0.00 O ATOM 0 H ASP A 129 -1.166 -5.393 -13.217 1.00 0.00 H new ATOM 0 HA ASP A 129 -1.064 -2.925 -14.587 1.00 0.00 H new ATOM 0 HB2 ASP A 129 0.160 -5.139 -15.188 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -1.361 -5.628 -15.908 1.00 0.00 H new ATOM 1971 N ILE A 130 -3.456 -2.669 -15.525 1.00 0.00 N ATOM 1972 CA ILE A 130 -4.799 -2.526 -15.994 1.00 0.00 C ATOM 1973 C ILE A 130 -5.096 -3.118 -17.329 1.00 0.00 C ATOM 1974 O ILE A 130 -6.093 -3.809 -17.530 1.00 0.00 O ATOM 1975 CB ILE A 130 -5.484 -1.208 -15.784 1.00 0.00 C ATOM 1976 CG1 ILE A 130 -6.991 -1.450 -15.592 1.00 0.00 C ATOM 1977 CG2 ILE A 130 -5.231 -0.164 -16.885 1.00 0.00 C ATOM 1978 CD1 ILE A 130 -7.637 -0.112 -15.238 1.00 0.00 C ATOM 0 H ILE A 130 -2.900 -1.821 -15.635 1.00 0.00 H new ATOM 0 HA ILE A 130 -5.282 -3.176 -15.265 1.00 0.00 H new ATOM 0 HB ILE A 130 -5.044 -0.770 -14.888 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -7.431 -1.858 -16.502 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -7.163 -2.179 -14.800 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -5.767 0.754 -16.646 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -4.163 0.045 -16.950 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -5.583 -0.551 -17.841 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -8.709 -0.252 -15.095 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -7.196 0.273 -14.319 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -7.468 0.599 -16.047 1.00 0.00 H new ATOM 1990 N ASP A 131 -4.156 -2.907 -18.268 1.00 0.00 N ATOM 1991 CA ASP A 131 -4.008 -3.503 -19.560 1.00 0.00 C ATOM 1992 C ASP A 131 -3.803 -4.979 -19.586 1.00 0.00 C ATOM 1993 O ASP A 131 -4.534 -5.736 -20.222 1.00 0.00 O ATOM 1994 CB ASP A 131 -2.906 -2.796 -20.366 1.00 0.00 C ATOM 1995 CG ASP A 131 -2.939 -1.281 -20.220 1.00 0.00 C ATOM 1996 OD1 ASP A 131 -3.755 -0.540 -20.831 1.00 0.00 O ATOM 1997 OD2 ASP A 131 -2.108 -0.773 -19.421 1.00 0.00 O ATOM 0 H ASP A 131 -3.409 -2.234 -18.096 1.00 0.00 H new ATOM 0 HA ASP A 131 -4.981 -3.355 -20.028 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -1.933 -3.165 -20.042 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -3.011 -3.056 -21.419 1.00 0.00 H new ATOM 2002 N GLY A 132 -2.816 -5.447 -18.801 1.00 0.00 N ATOM 2003 CA GLY A 132 -2.147 -6.699 -18.975 1.00 0.00 C ATOM 2004 C GLY A 132 -0.989 -6.685 -19.912 1.00 0.00 C ATOM 2005 O GLY A 132 -0.675 -7.780 -20.376 1.00 0.00 O ATOM 0 H GLY A 132 -2.466 -4.922 -18.000 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -1.799 -7.043 -18.001 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -2.871 -7.431 -19.332 1.00 0.00 H new ATOM 2009 N ASP A 133 -0.454 -5.494 -20.232 1.00 0.00 N ATOM 2010 CA ASP A 133 0.657 -5.343 -21.120 1.00 0.00 C ATOM 2011 C ASP A 133 1.983 -5.657 -20.518 1.00 0.00 C ATOM 2012 O ASP A 133 2.897 -5.982 -21.274 1.00 0.00 O ATOM 2013 CB ASP A 133 0.682 -4.010 -21.886 1.00 0.00 C ATOM 2014 CG ASP A 133 0.692 -2.668 -21.168 1.00 0.00 C ATOM 2015 OD1 ASP A 133 0.802 -2.699 -19.913 1.00 0.00 O ATOM 2016 OD2 ASP A 133 0.688 -1.607 -21.848 1.00 0.00 O ATOM 0 H ASP A 133 -0.804 -4.610 -19.863 1.00 0.00 H new ATOM 0 HA ASP A 133 0.474 -6.119 -21.863 1.00 0.00 H new ATOM 0 HB2 ASP A 133 1.565 -4.031 -22.525 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -0.188 -4.009 -22.543 1.00 0.00 H new ATOM 2021 N GLY A 134 2.096 -5.497 -19.187 1.00 0.00 N ATOM 2022 CA GLY A 134 3.274 -5.915 -18.492 1.00 0.00 C ATOM 2023 C GLY A 134 4.200 -4.790 -18.180 1.00 0.00 C ATOM 2024 O GLY A 134 5.340 -4.959 -17.750 1.00 0.00 O ATOM 0 H GLY A 134 1.377 -5.081 -18.595 1.00 0.00 H new ATOM 0 HA2 GLY A 134 2.985 -6.408 -17.564 1.00 0.00 H new ATOM 0 HA3 GLY A 134 3.801 -6.655 -19.095 1.00 0.00 H new ATOM 2028 N GLN A 135 3.696 -3.548 -18.294 1.00 0.00 N ATOM 2029 CA GLN A 135 4.423 -2.365 -17.955 1.00 0.00 C ATOM 2030 C GLN A 135 3.426 -1.496 -17.270 1.00 0.00 C ATOM 2031 O GLN A 135 2.319 -1.313 -17.775 1.00 0.00 O ATOM 2032 CB GLN A 135 5.008 -1.738 -19.232 1.00 0.00 C ATOM 2033 CG GLN A 135 4.087 -1.457 -20.421 1.00 0.00 C ATOM 2034 CD GLN A 135 4.868 -0.991 -21.642 1.00 0.00 C ATOM 2035 OE1 GLN A 135 5.290 -1.782 -22.485 1.00 0.00 O ATOM 2036 NE2 GLN A 135 4.963 0.359 -21.777 1.00 0.00 N ATOM 0 H GLN A 135 2.752 -3.362 -18.633 1.00 0.00 H new ATOM 0 HA GLN A 135 5.279 -2.540 -17.303 1.00 0.00 H new ATOM 0 HB2 GLN A 135 5.474 -0.794 -18.949 1.00 0.00 H new ATOM 0 HB3 GLN A 135 5.805 -2.394 -19.583 1.00 0.00 H new ATOM 0 HG2 GLN A 135 3.528 -2.359 -20.669 1.00 0.00 H new ATOM 0 HG3 GLN A 135 3.357 -0.696 -20.144 1.00 0.00 H new ATOM 0 HE21 GLN A 135 4.597 0.971 -21.048 1.00 0.00 H new ATOM 0 HE22 GLN A 135 5.400 0.759 -22.607 1.00 0.00 H new ATOM 2045 N VAL A 136 3.834 -1.011 -16.083 1.00 0.00 N ATOM 2046 CA VAL A 136 3.040 -0.202 -15.212 1.00 0.00 C ATOM 2047 C VAL A 136 3.362 1.234 -15.448 1.00 0.00 C ATOM 2048 O VAL A 136 4.491 1.720 -15.423 1.00 0.00 O ATOM 2049 CB VAL A 136 3.322 -0.650 -13.808 1.00 0.00 C ATOM 2050 CG1 VAL A 136 3.142 0.548 -12.860 1.00 0.00 C ATOM 2051 CG2 VAL A 136 2.288 -1.733 -13.459 1.00 0.00 C ATOM 0 H VAL A 136 4.767 -1.193 -15.713 1.00 0.00 H new ATOM 0 HA VAL A 136 1.972 -0.312 -15.399 1.00 0.00 H new ATOM 0 HB VAL A 136 4.336 -1.037 -13.712 1.00 0.00 H new ATOM 0 HG11 VAL A 136 3.344 0.235 -11.836 1.00 0.00 H new ATOM 0 HG12 VAL A 136 3.835 1.341 -13.141 1.00 0.00 H new ATOM 0 HG13 VAL A 136 2.119 0.918 -12.931 1.00 0.00 H new ATOM 0 HG21 VAL A 136 2.460 -2.086 -12.442 1.00 0.00 H new ATOM 0 HG22 VAL A 136 1.284 -1.315 -13.533 1.00 0.00 H new ATOM 0 HG23 VAL A 136 2.386 -2.567 -14.154 1.00 0.00 H new ATOM 2061 N ASN A 137 2.325 2.066 -15.651 1.00 0.00 N ATOM 2062 CA ASN A 137 2.334 3.473 -15.907 1.00 0.00 C ATOM 2063 C ASN A 137 2.080 4.237 -14.653 1.00 0.00 C ATOM 2064 O ASN A 137 1.897 3.551 -13.649 1.00 0.00 O ATOM 2065 CB ASN A 137 1.203 3.770 -16.907 1.00 0.00 C ATOM 2066 CG ASN A 137 1.550 4.890 -17.878 1.00 0.00 C ATOM 2067 OD1 ASN A 137 2.160 5.870 -17.453 1.00 0.00 O ATOM 2068 ND2 ASN A 137 1.085 4.834 -19.155 1.00 0.00 N ATOM 0 H ASN A 137 1.371 1.707 -15.633 1.00 0.00 H new ATOM 0 HA ASN A 137 3.306 3.769 -16.302 1.00 0.00 H new ATOM 0 HB2 ASN A 137 0.976 2.865 -17.470 1.00 0.00 H new ATOM 0 HB3 ASN A 137 0.301 4.039 -16.358 1.00 0.00 H new ATOM 0 HD21 ASN A 137 1.239 5.618 -19.789 1.00 0.00 H new ATOM 0 HD22 ASN A 137 0.582 4.008 -19.479 1.00 0.00 H new ATOM 2075 N TYR A 138 2.217 5.575 -14.666 1.00 0.00 N ATOM 2076 CA TYR A 138 1.807 6.420 -13.588 1.00 0.00 C ATOM 2077 C TYR A 138 0.534 6.123 -12.873 1.00 0.00 C ATOM 2078 O TYR A 138 0.538 5.540 -11.790 1.00 0.00 O ATOM 2079 CB TYR A 138 1.878 7.921 -13.918 1.00 0.00 C ATOM 2080 CG TYR A 138 1.579 8.809 -12.760 1.00 0.00 C ATOM 2081 CD1 TYR A 138 2.338 8.814 -11.614 1.00 0.00 C ATOM 2082 CD2 TYR A 138 0.401 9.518 -12.738 1.00 0.00 C ATOM 2083 CE1 TYR A 138 1.912 9.446 -10.470 1.00 0.00 C ATOM 2084 CE2 TYR A 138 -0.001 10.274 -11.662 1.00 0.00 C ATOM 2085 CZ TYR A 138 0.826 10.285 -10.564 1.00 0.00 C ATOM 2086 OH TYR A 138 0.417 10.978 -9.405 1.00 0.00 O ATOM 0 H TYR A 138 2.625 6.084 -15.450 1.00 0.00 H new ATOM 0 HA TYR A 138 2.577 6.146 -12.867 1.00 0.00 H new ATOM 0 HB2 TYR A 138 2.874 8.154 -14.294 1.00 0.00 H new ATOM 0 HB3 TYR A 138 1.175 8.140 -14.722 1.00 0.00 H new ATOM 0 HD1 TYR A 138 3.293 8.309 -11.612 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -0.239 9.479 -13.607 1.00 0.00 H new ATOM 0 HE1 TYR A 138 2.414 9.289 -9.527 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -0.925 10.834 -11.679 1.00 0.00 H new ATOM 0 HH TYR A 138 -0.361 11.535 -9.615 1.00 0.00 H new ATOM 2096 N GLU A 139 -0.622 6.168 -13.559 1.00 0.00 N ATOM 2097 CA GLU A 139 -1.871 5.906 -12.913 1.00 0.00 C ATOM 2098 C GLU A 139 -2.020 4.530 -12.362 1.00 0.00 C ATOM 2099 O GLU A 139 -2.610 4.273 -11.313 1.00 0.00 O ATOM 2100 CB GLU A 139 -2.923 6.257 -13.979 1.00 0.00 C ATOM 2101 CG GLU A 139 -4.308 6.507 -13.378 1.00 0.00 C ATOM 2102 CD GLU A 139 -5.351 6.783 -14.451 1.00 0.00 C ATOM 2103 OE1 GLU A 139 -5.609 5.842 -15.248 1.00 0.00 O ATOM 2104 OE2 GLU A 139 -5.994 7.866 -14.402 1.00 0.00 O ATOM 0 H GLU A 139 -0.693 6.384 -14.553 1.00 0.00 H new ATOM 0 HA GLU A 139 -1.975 6.504 -12.008 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -2.601 7.145 -14.523 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -2.986 5.445 -14.703 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -4.611 5.640 -12.792 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -4.259 7.353 -12.693 1.00 0.00 H new ATOM 2111 N GLU A 140 -1.379 3.581 -13.067 1.00 0.00 N ATOM 2112 CA GLU A 140 -1.347 2.233 -12.589 1.00 0.00 C ATOM 2113 C GLU A 140 -0.539 2.094 -11.344 1.00 0.00 C ATOM 2114 O GLU A 140 -0.984 1.316 -10.501 1.00 0.00 O ATOM 2115 CB GLU A 140 -0.847 1.277 -13.685 1.00 0.00 C ATOM 2116 CG GLU A 140 -1.810 1.306 -14.873 1.00 0.00 C ATOM 2117 CD GLU A 140 -1.174 0.370 -15.890 1.00 0.00 C ATOM 2118 OE1 GLU A 140 -0.054 0.752 -16.324 1.00 0.00 O ATOM 2119 OE2 GLU A 140 -1.677 -0.762 -16.123 1.00 0.00 O ATOM 0 H GLU A 140 -0.892 3.740 -13.949 1.00 0.00 H new ATOM 0 HA GLU A 140 -2.370 1.958 -12.333 1.00 0.00 H new ATOM 0 HB2 GLU A 140 0.152 1.569 -14.007 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -0.771 0.264 -13.290 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -2.806 0.967 -14.587 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -1.919 2.314 -15.273 1.00 0.00 H new ATOM 2126 N PHE A 141 0.630 2.740 -11.190 1.00 0.00 N ATOM 2127 CA PHE A 141 1.375 2.719 -9.969 1.00 0.00 C ATOM 2128 C PHE A 141 0.632 3.323 -8.827 1.00 0.00 C ATOM 2129 O PHE A 141 0.772 2.728 -7.760 1.00 0.00 O ATOM 2130 CB PHE A 141 2.717 3.430 -10.213 1.00 0.00 C ATOM 2131 CG PHE A 141 3.721 3.518 -9.115 1.00 0.00 C ATOM 2132 CD1 PHE A 141 4.180 2.347 -8.560 1.00 0.00 C ATOM 2133 CD2 PHE A 141 4.214 4.694 -8.602 1.00 0.00 C ATOM 2134 CE1 PHE A 141 5.031 2.375 -7.481 1.00 0.00 C ATOM 2135 CE2 PHE A 141 5.192 4.653 -7.637 1.00 0.00 C ATOM 2136 CZ PHE A 141 5.728 3.501 -7.111 1.00 0.00 C ATOM 0 H PHE A 141 1.068 3.289 -11.930 1.00 0.00 H new ATOM 0 HA PHE A 141 1.548 1.682 -9.680 1.00 0.00 H new ATOM 0 HB2 PHE A 141 3.199 2.933 -11.055 1.00 0.00 H new ATOM 0 HB3 PHE A 141 2.492 4.448 -10.530 1.00 0.00 H new ATOM 0 HD1 PHE A 141 3.870 1.399 -8.974 1.00 0.00 H new ATOM 0 HD2 PHE A 141 3.836 5.642 -8.954 1.00 0.00 H new ATOM 0 HE1 PHE A 141 5.158 1.474 -6.899 1.00 0.00 H new ATOM 0 HE2 PHE A 141 5.567 5.595 -7.264 1.00 0.00 H new ATOM 0 HZ PHE A 141 6.602 3.483 -6.476 1.00 0.00 H new ATOM 2146 N VAL A 142 0.005 4.494 -9.039 1.00 0.00 N ATOM 2147 CA VAL A 142 -0.825 5.131 -8.065 1.00 0.00 C ATOM 2148 C VAL A 142 -1.983 4.308 -7.616 1.00 0.00 C ATOM 2149 O VAL A 142 -2.140 4.086 -6.416 1.00 0.00 O ATOM 2150 CB VAL A 142 -1.295 6.474 -8.538 1.00 0.00 C ATOM 2151 CG1 VAL A 142 -1.628 7.321 -7.298 1.00 0.00 C ATOM 2152 CG2 VAL A 142 -0.236 7.191 -9.392 1.00 0.00 C ATOM 0 H VAL A 142 0.078 5.013 -9.914 1.00 0.00 H new ATOM 0 HA VAL A 142 -0.185 5.259 -7.192 1.00 0.00 H new ATOM 0 HB VAL A 142 -2.172 6.339 -9.170 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -1.973 8.306 -7.612 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -2.411 6.829 -6.721 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -0.736 7.429 -6.681 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -0.621 8.159 -9.712 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.669 7.337 -8.802 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -0.004 6.585 -10.268 1.00 0.00 H new ATOM 2162 N GLN A 143 -2.783 3.681 -8.496 1.00 0.00 N ATOM 2163 CA GLN A 143 -3.789 2.748 -8.093 1.00 0.00 C ATOM 2164 C GLN A 143 -3.254 1.613 -7.290 1.00 0.00 C ATOM 2165 O GLN A 143 -3.873 1.320 -6.268 1.00 0.00 O ATOM 2166 CB GLN A 143 -4.501 2.139 -9.313 1.00 0.00 C ATOM 2167 CG GLN A 143 -5.468 3.034 -10.091 1.00 0.00 C ATOM 2168 CD GLN A 143 -5.777 2.611 -11.520 1.00 0.00 C ATOM 2169 OE1 GLN A 143 -5.214 1.471 -12.003 1.00 0.00 O flip ATOM 2170 NE2 GLN A 143 -6.544 3.292 -12.198 1.00 0.00 N flip ATOM 0 H GLN A 143 -2.731 3.824 -9.505 1.00 0.00 H new ATOM 0 HA GLN A 143 -4.477 3.328 -7.478 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -3.737 1.788 -10.007 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -5.053 1.262 -8.976 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -6.406 3.085 -9.539 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -5.057 4.043 -10.114 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -6.951 4.142 -11.808 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -6.773 3.007 -13.150 1.00 0.00 H new ATOM 2179 N MET A 144 -2.075 1.122 -7.713 1.00 0.00 N ATOM 2180 CA MET A 144 -1.413 0.105 -6.957 1.00 0.00 C ATOM 2181 C MET A 144 -0.975 0.458 -5.577 1.00 0.00 C ATOM 2182 O MET A 144 -1.257 -0.279 -4.634 1.00 0.00 O ATOM 2183 CB MET A 144 -0.209 -0.492 -7.705 1.00 0.00 C ATOM 2184 CG MET A 144 0.585 -1.574 -6.970 1.00 0.00 C ATOM 2185 SD MET A 144 1.669 -2.579 -8.027 1.00 0.00 S ATOM 2186 CE MET A 144 2.835 -1.308 -8.594 1.00 0.00 C ATOM 0 H MET A 144 -1.589 1.421 -8.559 1.00 0.00 H new ATOM 0 HA MET A 144 -2.214 -0.626 -6.841 1.00 0.00 H new ATOM 0 HB2 MET A 144 -0.566 -0.911 -8.646 1.00 0.00 H new ATOM 0 HB3 MET A 144 0.473 0.320 -7.956 1.00 0.00 H new ATOM 0 HG2 MET A 144 1.192 -1.098 -6.200 1.00 0.00 H new ATOM 0 HG3 MET A 144 -0.116 -2.235 -6.460 1.00 0.00 H new ATOM 0 HE1 MET A 144 3.817 -1.757 -8.746 1.00 0.00 H new ATOM 0 HE2 MET A 144 2.481 -0.883 -9.533 1.00 0.00 H new ATOM 0 HE3 MET A 144 2.908 -0.521 -7.844 1.00 0.00 H new ATOM 2196 N MET A 145 -0.319 1.616 -5.383 1.00 0.00 N ATOM 2197 CA MET A 145 0.189 2.086 -4.132 1.00 0.00 C ATOM 2198 C MET A 145 -0.846 2.592 -3.187 1.00 0.00 C ATOM 2199 O MET A 145 -0.634 2.559 -1.976 1.00 0.00 O ATOM 2200 CB MET A 145 1.272 3.149 -4.384 1.00 0.00 C ATOM 2201 CG MET A 145 2.492 2.688 -5.185 1.00 0.00 C ATOM 2202 SD MET A 145 3.536 1.441 -4.372 1.00 0.00 S ATOM 2203 CE MET A 145 4.603 2.525 -3.380 1.00 0.00 C ATOM 0 H MET A 145 -0.132 2.264 -6.148 1.00 0.00 H new ATOM 0 HA MET A 145 0.617 1.218 -3.631 1.00 0.00 H new ATOM 0 HB2 MET A 145 0.814 3.988 -4.908 1.00 0.00 H new ATOM 0 HB3 MET A 145 1.616 3.524 -3.420 1.00 0.00 H new ATOM 0 HG2 MET A 145 2.148 2.284 -6.137 1.00 0.00 H new ATOM 0 HG3 MET A 145 3.107 3.559 -5.412 1.00 0.00 H new ATOM 0 HE1 MET A 145 5.310 1.920 -2.813 1.00 0.00 H new ATOM 0 HE2 MET A 145 5.150 3.200 -4.039 1.00 0.00 H new ATOM 0 HE3 MET A 145 3.991 3.107 -2.692 1.00 0.00 H new