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 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 144 MET CE :methyl 180:sc= -0.93 (180deg=-0.93) USER MOD Set 2.1: A 107 HIS :FLIP no HD1:sc= -0.148 F(o=-1.3,f=-0.55) USER MOD Set 2.2: A 111 ASN : amide:sc= -0.404 K(o=-0.55,f=-1.3) USER MOD Set 3.1: A 51 MET CE :methyl 156:sc= -0.0199 (180deg=0) USER MOD Set 3.2: A 71 MET CE :methyl -144:sc= -0.148 (180deg=-0.659) USER MOD Set 4.1: A 60 ASN : amide:sc= 1.22 K(o=1.5,f=-5.1!) USER MOD Set 4.2: A 62 THR OG1 : rot 22:sc= 0.271 USER MOD Set 5.1: A 49 GLN : amide:sc= 0.00472 X(o=-0.56,f=-0.58) USER MOD Set 5.2: A 53 ASN : amide:sc= -0.568 K(o=-0.56,f=-1.8) USER MOD Set 6.1: A 5 THR OG1 : rot 180:sc= 0 USER MOD Set 6.2: A 8 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.2 USER MOD Single : A 29 THR OG1 : rot 170:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 150:sc= 1.23 (180deg=-0.198!) USER MOD Single : A 34 THR OG1 : rot 62:sc= 1.07 USER MOD Single : A 36 MET CE :methyl 163:sc= 0 (180deg=-0.122) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 42 ASN : amide:sc= -0.0603 K(o=-0.06,f=-0.97) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 82:sc= 0.519 USER MOD Single : A 72 MET CE :methyl -168:sc= -0.044 (180deg=-0.262) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0.0458 K(o=0.046,f=-2.5!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0.0742 USER MOD Single : A 110 THR OG1 : rot 104:sc= 1.26 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl -179:sc= 0 (180deg=-0.00164) USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 137 ASN : amide:sc= 0.256 K(o=0.26,f=-6.7!) USER MOD Single : A 138 TYR OH : rot 180:sc= -0.0516 USER MOD Single : A 143 GLN :FLIP amide:sc= -0.311 F(o=-1.1,f=-0.31) USER MOD Single : A 145 MET CE :methyl -149:sc= -0.737 (180deg=-1.47) USER MOD ----------------------------------------------------------------- ATOM 58 N THR A 5 -12.394 15.914 1.820 1.00 0.00 N ATOM 59 CA THR A 5 -13.042 17.053 1.248 1.00 0.00 C ATOM 60 C THR A 5 -14.314 16.601 0.618 1.00 0.00 C ATOM 61 O THR A 5 -14.589 15.404 0.545 1.00 0.00 O ATOM 62 CB THR A 5 -12.209 17.722 0.195 1.00 0.00 C ATOM 63 OG1 THR A 5 -11.724 16.802 -0.771 1.00 0.00 O ATOM 64 CG2 THR A 5 -10.908 18.198 0.864 1.00 0.00 C ATOM 0 HA THR A 5 -13.213 17.774 2.047 1.00 0.00 H new ATOM 0 HB THR A 5 -12.832 18.495 -0.255 1.00 0.00 H new ATOM 0 HG1 THR A 5 -11.188 17.280 -1.438 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.277 18.690 0.124 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.146 18.900 1.663 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.378 17.341 1.280 1.00 0.00 H new ATOM 72 N GLU A 6 -15.244 17.479 0.202 1.00 0.00 N ATOM 73 CA GLU A 6 -16.412 17.260 -0.593 1.00 0.00 C ATOM 74 C GLU A 6 -16.168 16.352 -1.749 1.00 0.00 C ATOM 75 O GLU A 6 -16.864 15.378 -2.033 1.00 0.00 O ATOM 76 CB GLU A 6 -17.003 18.544 -1.200 1.00 0.00 C ATOM 77 CG GLU A 6 -17.269 19.669 -0.198 1.00 0.00 C ATOM 78 CD GLU A 6 -18.349 19.302 0.809 1.00 0.00 C ATOM 79 OE1 GLU A 6 -19.144 18.343 0.619 1.00 0.00 O ATOM 80 OE2 GLU A 6 -18.386 19.958 1.884 1.00 0.00 O ATOM 0 H GLU A 6 -15.163 18.463 0.457 1.00 0.00 H new ATOM 0 HA GLU A 6 -17.106 16.819 0.122 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -16.321 18.913 -1.966 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -17.939 18.294 -1.700 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -16.347 19.906 0.332 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -17.568 20.569 -0.736 1.00 0.00 H new ATOM 87 N GLU A 7 -15.166 16.691 -2.579 1.00 0.00 N ATOM 88 CA GLU A 7 -14.880 16.080 -3.839 1.00 0.00 C ATOM 89 C GLU A 7 -14.383 14.678 -3.741 1.00 0.00 C ATOM 90 O GLU A 7 -14.500 13.784 -4.576 1.00 0.00 O ATOM 91 CB GLU A 7 -13.797 16.819 -4.643 1.00 0.00 C ATOM 92 CG GLU A 7 -14.061 18.271 -5.049 1.00 0.00 C ATOM 93 CD GLU A 7 -13.963 19.303 -3.935 1.00 0.00 C ATOM 94 OE1 GLU A 7 -13.720 18.980 -2.741 1.00 0.00 O ATOM 95 OE2 GLU A 7 -14.214 20.489 -4.279 1.00 0.00 O ATOM 0 H GLU A 7 -14.513 17.442 -2.354 1.00 0.00 H new ATOM 0 HA GLU A 7 -15.852 16.118 -4.332 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -12.877 16.799 -4.059 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -13.610 16.248 -5.552 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -13.354 18.543 -5.832 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -15.058 18.330 -5.485 1.00 0.00 H new ATOM 102 N GLN A 8 -13.626 14.472 -2.648 1.00 0.00 N ATOM 103 CA GLN A 8 -13.233 13.162 -2.230 1.00 0.00 C ATOM 104 C GLN A 8 -14.423 12.354 -1.843 1.00 0.00 C ATOM 105 O GLN A 8 -14.596 11.216 -2.276 1.00 0.00 O ATOM 106 CB GLN A 8 -12.262 13.353 -1.052 1.00 0.00 C ATOM 107 CG GLN A 8 -10.842 13.618 -1.558 1.00 0.00 C ATOM 108 CD GLN A 8 -9.878 14.112 -0.489 1.00 0.00 C ATOM 109 OE1 GLN A 8 -10.214 14.218 0.690 1.00 0.00 O ATOM 110 NE2 GLN A 8 -8.581 14.350 -0.818 1.00 0.00 N ATOM 0 H GLN A 8 -13.283 15.222 -2.048 1.00 0.00 H new ATOM 0 HA GLN A 8 -12.746 12.614 -3.037 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -12.594 14.186 -0.432 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -12.269 12.464 -0.421 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -10.446 12.700 -1.991 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -10.886 14.355 -2.360 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -8.278 14.269 -1.789 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -7.911 14.610 -0.094 1.00 0.00 H new ATOM 119 N ILE A 9 -15.385 12.832 -1.033 1.00 0.00 N ATOM 120 CA ILE A 9 -16.619 12.205 -0.673 1.00 0.00 C ATOM 121 C ILE A 9 -17.509 11.891 -1.826 1.00 0.00 C ATOM 122 O ILE A 9 -17.962 10.767 -2.037 1.00 0.00 O ATOM 123 CB ILE A 9 -17.362 12.973 0.380 1.00 0.00 C ATOM 124 CG1 ILE A 9 -16.522 13.079 1.663 1.00 0.00 C ATOM 125 CG2 ILE A 9 -18.703 12.285 0.690 1.00 0.00 C ATOM 126 CD1 ILE A 9 -16.996 14.224 2.558 1.00 0.00 C ATOM 0 H ILE A 9 -15.287 13.745 -0.589 1.00 0.00 H new ATOM 0 HA ILE A 9 -16.321 11.245 -0.253 1.00 0.00 H new ATOM 0 HB ILE A 9 -17.554 13.977 0.003 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -16.579 12.140 2.213 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.475 13.232 1.401 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -19.234 12.851 1.456 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -19.308 12.243 -0.215 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -18.518 11.273 1.050 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -16.377 14.265 3.454 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -16.914 15.167 2.017 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -18.035 14.058 2.842 1.00 0.00 H new ATOM 138 N ALA A 10 -17.704 12.892 -2.702 1.00 0.00 N ATOM 139 CA ALA A 10 -18.494 12.790 -3.890 1.00 0.00 C ATOM 140 C ALA A 10 -18.010 11.809 -4.901 1.00 0.00 C ATOM 141 O ALA A 10 -18.800 11.148 -5.573 1.00 0.00 O ATOM 142 CB ALA A 10 -18.644 14.155 -4.583 1.00 0.00 C ATOM 0 H ALA A 10 -17.291 13.816 -2.576 1.00 0.00 H new ATOM 0 HA ALA A 10 -19.452 12.421 -3.523 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -19.250 14.042 -5.482 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -19.129 14.856 -3.904 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -17.659 14.535 -4.854 1.00 0.00 H new ATOM 148 N GLU A 11 -16.696 11.564 -5.049 1.00 0.00 N ATOM 149 CA GLU A 11 -16.171 10.519 -5.873 1.00 0.00 C ATOM 150 C GLU A 11 -16.435 9.167 -5.306 1.00 0.00 C ATOM 151 O GLU A 11 -16.960 8.317 -6.023 1.00 0.00 O ATOM 152 CB GLU A 11 -14.680 10.671 -6.218 1.00 0.00 C ATOM 153 CG GLU A 11 -14.088 9.698 -7.240 1.00 0.00 C ATOM 154 CD GLU A 11 -12.621 10.022 -7.483 1.00 0.00 C ATOM 155 OE1 GLU A 11 -11.852 9.470 -6.652 1.00 0.00 O ATOM 156 OE2 GLU A 11 -12.279 10.577 -8.562 1.00 0.00 O ATOM 0 H GLU A 11 -15.974 12.111 -4.580 1.00 0.00 H new ATOM 0 HA GLU A 11 -16.716 10.619 -6.812 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -14.522 11.684 -6.588 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -14.110 10.576 -5.294 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -14.187 8.674 -6.879 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -14.642 9.761 -8.177 1.00 0.00 H new ATOM 163 N PHE A 12 -16.193 8.958 -4.000 1.00 0.00 N ATOM 164 CA PHE A 12 -16.537 7.800 -3.234 1.00 0.00 C ATOM 165 C PHE A 12 -17.969 7.430 -3.411 1.00 0.00 C ATOM 166 O PHE A 12 -18.269 6.266 -3.671 1.00 0.00 O ATOM 167 CB PHE A 12 -16.014 7.959 -1.796 1.00 0.00 C ATOM 168 CG PHE A 12 -14.584 8.353 -1.663 1.00 0.00 C ATOM 169 CD1 PHE A 12 -13.699 7.706 -2.493 1.00 0.00 C ATOM 170 CD2 PHE A 12 -14.082 9.065 -0.598 1.00 0.00 C ATOM 171 CE1 PHE A 12 -12.344 7.803 -2.279 1.00 0.00 C ATOM 172 CE2 PHE A 12 -12.736 9.324 -0.488 1.00 0.00 C ATOM 173 CZ PHE A 12 -11.863 8.624 -1.287 1.00 0.00 C ATOM 0 H PHE A 12 -15.716 9.659 -3.433 1.00 0.00 H new ATOM 0 HA PHE A 12 -16.028 6.912 -3.609 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -16.625 8.705 -1.288 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -16.161 7.016 -1.270 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -14.071 7.117 -3.319 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -14.756 9.426 0.164 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -11.658 7.235 -2.890 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -12.372 10.062 0.212 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.798 8.719 -1.135 1.00 0.00 H new ATOM 183 N LYS A 13 -18.846 8.448 -3.352 1.00 0.00 N ATOM 184 CA LYS A 13 -20.262 8.280 -3.244 1.00 0.00 C ATOM 185 C LYS A 13 -20.735 7.762 -4.559 1.00 0.00 C ATOM 186 O LYS A 13 -21.531 6.839 -4.722 1.00 0.00 O ATOM 187 CB LYS A 13 -20.926 9.655 -3.058 1.00 0.00 C ATOM 188 CG LYS A 13 -22.452 9.674 -2.946 1.00 0.00 C ATOM 189 CD LYS A 13 -22.915 10.893 -2.146 1.00 0.00 C ATOM 190 CE LYS A 13 -24.326 10.786 -1.563 1.00 0.00 C ATOM 191 NZ LYS A 13 -25.342 10.627 -2.628 1.00 0.00 N ATOM 0 H LYS A 13 -18.558 9.426 -3.381 1.00 0.00 H new ATOM 0 HA LYS A 13 -20.502 7.619 -2.411 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -20.514 10.113 -2.159 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -20.639 10.287 -3.898 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -22.895 9.695 -3.942 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -22.798 8.761 -2.462 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -22.213 11.061 -1.330 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -22.870 11.771 -2.791 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -24.376 9.937 -0.881 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -24.548 11.678 -0.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -26.287 10.557 -2.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -25.310 11.449 -3.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -25.144 9.762 -3.171 1.00 0.00 H new ATOM 205 N GLU A 14 -20.154 8.344 -5.623 1.00 0.00 N ATOM 206 CA GLU A 14 -20.566 8.091 -6.968 1.00 0.00 C ATOM 207 C GLU A 14 -20.174 6.712 -7.376 1.00 0.00 C ATOM 208 O GLU A 14 -21.004 5.923 -7.826 1.00 0.00 O ATOM 209 CB GLU A 14 -19.845 9.057 -7.923 1.00 0.00 C ATOM 210 CG GLU A 14 -20.421 8.864 -9.327 1.00 0.00 C ATOM 211 CD GLU A 14 -20.616 10.194 -10.041 1.00 0.00 C ATOM 212 OE1 GLU A 14 -19.600 10.927 -10.180 1.00 0.00 O ATOM 213 OE2 GLU A 14 -21.775 10.434 -10.473 1.00 0.00 O ATOM 0 H GLU A 14 -19.381 9.005 -5.547 1.00 0.00 H new ATOM 0 HA GLU A 14 -21.647 8.218 -7.017 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -19.981 10.087 -7.595 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -18.773 8.862 -7.922 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -19.753 8.231 -9.911 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -21.376 8.343 -9.261 1.00 0.00 H new ATOM 220 N ALA A 15 -18.961 6.272 -6.998 1.00 0.00 N ATOM 221 CA ALA A 15 -18.417 4.952 -7.068 1.00 0.00 C ATOM 222 C ALA A 15 -19.212 3.940 -6.317 1.00 0.00 C ATOM 223 O ALA A 15 -19.531 2.881 -6.856 1.00 0.00 O ATOM 224 CB ALA A 15 -16.970 5.005 -6.548 1.00 0.00 C ATOM 0 H ALA A 15 -18.285 6.921 -6.596 1.00 0.00 H new ATOM 0 HA ALA A 15 -18.448 4.627 -8.108 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.531 4.008 -6.591 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.386 5.686 -7.167 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -16.967 5.359 -5.517 1.00 0.00 H new ATOM 230 N PHE A 16 -19.619 4.237 -5.071 1.00 0.00 N ATOM 231 CA PHE A 16 -20.344 3.409 -4.158 1.00 0.00 C ATOM 232 C PHE A 16 -21.663 3.036 -4.743 1.00 0.00 C ATOM 233 O PHE A 16 -21.987 1.852 -4.827 1.00 0.00 O ATOM 234 CB PHE A 16 -20.574 4.237 -2.882 1.00 0.00 C ATOM 235 CG PHE A 16 -21.020 3.375 -1.752 1.00 0.00 C ATOM 236 CD1 PHE A 16 -20.253 2.405 -1.151 1.00 0.00 C ATOM 237 CD2 PHE A 16 -22.311 3.526 -1.302 1.00 0.00 C ATOM 238 CE1 PHE A 16 -20.802 1.591 -0.187 1.00 0.00 C ATOM 239 CE2 PHE A 16 -22.811 2.839 -0.221 1.00 0.00 C ATOM 240 CZ PHE A 16 -22.027 1.876 0.368 1.00 0.00 C ATOM 0 H PHE A 16 -19.419 5.150 -4.664 1.00 0.00 H new ATOM 0 HA PHE A 16 -19.788 2.496 -3.946 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -19.653 4.751 -2.608 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -21.323 5.005 -3.074 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -19.219 2.282 -1.436 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -22.961 4.215 -1.821 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -20.262 0.714 0.139 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -23.800 3.052 0.158 1.00 0.00 H new ATOM 0 HZ PHE A 16 -22.367 1.353 1.250 1.00 0.00 H new ATOM 250 N SER A 17 -22.428 4.034 -5.219 1.00 0.00 N ATOM 251 CA SER A 17 -23.692 3.863 -5.867 1.00 0.00 C ATOM 252 C SER A 17 -23.590 3.252 -7.222 1.00 0.00 C ATOM 253 O SER A 17 -24.518 2.575 -7.661 1.00 0.00 O ATOM 254 CB SER A 17 -24.433 5.200 -6.035 1.00 0.00 C ATOM 255 OG SER A 17 -25.738 5.064 -6.578 1.00 0.00 O ATOM 0 H SER A 17 -22.150 5.013 -5.148 1.00 0.00 H new ATOM 0 HA SER A 17 -24.239 3.189 -5.208 1.00 0.00 H new ATOM 0 HB2 SER A 17 -24.502 5.692 -5.065 1.00 0.00 H new ATOM 0 HB3 SER A 17 -23.846 5.852 -6.682 1.00 0.00 H new ATOM 0 HG SER A 17 -26.153 5.948 -6.657 1.00 0.00 H new ATOM 261 N LEU A 18 -22.443 3.374 -7.915 1.00 0.00 N ATOM 262 CA LEU A 18 -22.171 2.827 -9.208 1.00 0.00 C ATOM 263 C LEU A 18 -21.895 1.363 -9.194 1.00 0.00 C ATOM 264 O LEU A 18 -22.164 0.666 -10.171 1.00 0.00 O ATOM 265 CB LEU A 18 -21.099 3.522 -10.064 1.00 0.00 C ATOM 266 CG LEU A 18 -21.660 4.753 -10.796 1.00 0.00 C ATOM 267 CD1 LEU A 18 -20.504 5.639 -11.292 1.00 0.00 C ATOM 268 CD2 LEU A 18 -22.651 4.427 -11.926 1.00 0.00 C ATOM 0 H LEU A 18 -21.648 3.894 -7.543 1.00 0.00 H new ATOM 0 HA LEU A 18 -23.123 3.031 -9.699 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -20.267 3.825 -9.428 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -20.702 2.816 -10.793 1.00 0.00 H new ATOM 0 HG LEU A 18 -22.253 5.302 -10.065 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -20.908 6.509 -11.809 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -19.907 5.968 -10.441 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -19.877 5.069 -11.977 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -22.995 5.353 -12.386 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -22.157 3.810 -12.677 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -23.504 3.886 -11.517 1.00 0.00 H new ATOM 280 N PHE A 19 -21.498 0.910 -7.991 1.00 0.00 N ATOM 281 CA PHE A 19 -21.187 -0.428 -7.593 1.00 0.00 C ATOM 282 C PHE A 19 -22.258 -1.159 -6.858 1.00 0.00 C ATOM 283 O PHE A 19 -22.120 -2.365 -6.660 1.00 0.00 O ATOM 284 CB PHE A 19 -19.930 -0.455 -6.708 1.00 0.00 C ATOM 285 CG PHE A 19 -18.653 -0.179 -7.424 1.00 0.00 C ATOM 286 CD1 PHE A 19 -18.299 -0.773 -8.613 1.00 0.00 C ATOM 287 CD2 PHE A 19 -17.827 0.730 -6.805 1.00 0.00 C ATOM 288 CE1 PHE A 19 -17.124 -0.432 -9.239 1.00 0.00 C ATOM 289 CE2 PHE A 19 -16.702 1.107 -7.499 1.00 0.00 C ATOM 290 CZ PHE A 19 -16.320 0.540 -8.692 1.00 0.00 C ATOM 0 H PHE A 19 -21.383 1.558 -7.212 1.00 0.00 H new ATOM 0 HA PHE A 19 -21.045 -0.942 -8.544 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -20.049 0.279 -5.911 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -19.859 -1.433 -6.233 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -18.949 -1.512 -9.058 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -18.050 1.127 -5.826 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -16.834 -0.925 -10.155 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -16.085 1.891 -7.085 1.00 0.00 H new ATOM 0 HZ PHE A 19 -15.412 0.850 -9.187 1.00 0.00 H new ATOM 300 N ASP A 20 -23.388 -0.504 -6.538 1.00 0.00 N ATOM 301 CA ASP A 20 -24.516 -1.069 -5.865 1.00 0.00 C ATOM 302 C ASP A 20 -25.372 -1.844 -6.806 1.00 0.00 C ATOM 303 O ASP A 20 -25.687 -1.428 -7.920 1.00 0.00 O ATOM 304 CB ASP A 20 -25.331 -0.001 -5.115 1.00 0.00 C ATOM 305 CG ASP A 20 -26.052 -0.549 -3.892 1.00 0.00 C ATOM 306 OD1 ASP A 20 -27.008 -1.350 -4.066 1.00 0.00 O ATOM 307 OD2 ASP A 20 -25.498 -0.499 -2.762 1.00 0.00 O ATOM 0 H ASP A 20 -23.522 0.482 -6.764 1.00 0.00 H new ATOM 0 HA ASP A 20 -24.132 -1.762 -5.116 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -24.665 0.805 -4.806 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -26.063 0.434 -5.796 1.00 0.00 H new ATOM 312 N LYS A 21 -25.757 -3.036 -6.317 1.00 0.00 N ATOM 313 CA LYS A 21 -26.664 -3.925 -6.974 1.00 0.00 C ATOM 314 C LYS A 21 -28.050 -3.395 -6.839 1.00 0.00 C ATOM 315 O LYS A 21 -28.722 -3.143 -7.837 1.00 0.00 O ATOM 316 CB LYS A 21 -26.591 -5.343 -6.381 1.00 0.00 C ATOM 317 CG LYS A 21 -27.716 -6.283 -6.819 1.00 0.00 C ATOM 318 CD LYS A 21 -27.389 -7.700 -6.344 1.00 0.00 C ATOM 319 CE LYS A 21 -27.354 -7.871 -4.824 1.00 0.00 C ATOM 320 NZ LYS A 21 -26.742 -9.163 -4.441 1.00 0.00 N ATOM 0 H LYS A 21 -25.421 -3.396 -5.424 1.00 0.00 H new ATOM 0 HA LYS A 21 -26.385 -3.988 -8.026 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -25.636 -5.789 -6.659 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -26.603 -5.267 -5.294 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -28.667 -5.955 -6.399 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -27.823 -6.264 -7.904 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -28.128 -8.387 -6.757 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -26.421 -7.991 -6.751 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -26.790 -7.052 -4.377 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -28.367 -7.814 -4.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -26.733 -9.249 -3.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -27.295 -9.944 -4.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -25.767 -9.205 -4.800 1.00 0.00 H new ATOM 334 N ASP A 22 -28.506 -3.179 -5.592 1.00 0.00 N ATOM 335 CA ASP A 22 -29.891 -3.051 -5.261 1.00 0.00 C ATOM 336 C ASP A 22 -30.375 -1.670 -5.542 1.00 0.00 C ATOM 337 O ASP A 22 -31.530 -1.373 -5.844 1.00 0.00 O ATOM 338 CB ASP A 22 -30.127 -3.497 -3.808 1.00 0.00 C ATOM 339 CG ASP A 22 -29.202 -4.576 -3.262 1.00 0.00 C ATOM 340 OD1 ASP A 22 -27.975 -4.341 -3.098 1.00 0.00 O ATOM 341 OD2 ASP A 22 -29.625 -5.723 -2.957 1.00 0.00 O ATOM 0 H ASP A 22 -27.888 -3.090 -4.785 1.00 0.00 H new ATOM 0 HA ASP A 22 -30.483 -3.712 -5.894 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -30.043 -2.620 -3.166 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -31.153 -3.855 -3.725 1.00 0.00 H new ATOM 346 N GLY A 23 -29.456 -0.708 -5.346 1.00 0.00 N ATOM 347 CA GLY A 23 -29.705 0.698 -5.271 1.00 0.00 C ATOM 348 C GLY A 23 -29.982 1.146 -3.877 1.00 0.00 C ATOM 349 O GLY A 23 -30.783 2.065 -3.714 1.00 0.00 O ATOM 0 H GLY A 23 -28.467 -0.930 -5.232 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -28.843 1.239 -5.660 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -30.553 0.950 -5.907 1.00 0.00 H new ATOM 353 N ASP A 24 -29.358 0.510 -2.869 1.00 0.00 N ATOM 354 CA ASP A 24 -29.501 0.952 -1.517 1.00 0.00 C ATOM 355 C ASP A 24 -28.253 1.644 -1.087 1.00 0.00 C ATOM 356 O ASP A 24 -27.618 2.401 -1.819 1.00 0.00 O ATOM 357 CB ASP A 24 -29.983 -0.259 -0.702 1.00 0.00 C ATOM 358 CG ASP A 24 -29.071 -1.473 -0.589 1.00 0.00 C ATOM 359 OD1 ASP A 24 -27.876 -1.338 -0.964 1.00 0.00 O ATOM 360 OD2 ASP A 24 -29.550 -2.583 -0.234 1.00 0.00 O ATOM 0 H ASP A 24 -28.758 -0.306 -2.989 1.00 0.00 H new ATOM 0 HA ASP A 24 -30.259 1.720 -1.363 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -30.199 0.087 0.309 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -30.927 -0.593 -1.133 1.00 0.00 H new ATOM 365 N GLY A 25 -27.921 1.590 0.215 1.00 0.00 N ATOM 366 CA GLY A 25 -26.937 2.397 0.868 1.00 0.00 C ATOM 367 C GLY A 25 -25.859 1.595 1.513 1.00 0.00 C ATOM 368 O GLY A 25 -25.077 2.059 2.341 1.00 0.00 O ATOM 0 H GLY A 25 -28.372 0.937 0.855 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -26.491 3.076 0.141 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -27.424 3.014 1.623 1.00 0.00 H new ATOM 372 N THR A 26 -25.856 0.274 1.260 1.00 0.00 N ATOM 373 CA THR A 26 -24.943 -0.682 1.805 1.00 0.00 C ATOM 374 C THR A 26 -24.392 -1.585 0.756 1.00 0.00 C ATOM 375 O THR A 26 -25.006 -1.771 -0.294 1.00 0.00 O ATOM 376 CB THR A 26 -25.606 -1.647 2.742 1.00 0.00 C ATOM 377 OG1 THR A 26 -26.919 -2.017 2.347 1.00 0.00 O ATOM 378 CG2 THR A 26 -25.670 -1.107 4.181 1.00 0.00 C ATOM 0 H THR A 26 -26.537 -0.154 0.633 1.00 0.00 H new ATOM 0 HA THR A 26 -24.189 -0.065 2.294 1.00 0.00 H new ATOM 0 HB THR A 26 -24.973 -2.534 2.703 1.00 0.00 H new ATOM 0 HG1 THR A 26 -27.291 -2.647 2.999 1.00 0.00 H new ATOM 0 HG21 THR A 26 -26.158 -1.840 4.823 1.00 0.00 H new ATOM 0 HG22 THR A 26 -24.660 -0.921 4.545 1.00 0.00 H new ATOM 0 HG23 THR A 26 -26.238 -0.177 4.196 1.00 0.00 H new ATOM 386 N ILE A 27 -23.233 -2.246 0.925 1.00 0.00 N ATOM 387 CA ILE A 27 -22.822 -3.295 0.044 1.00 0.00 C ATOM 388 C ILE A 27 -22.525 -4.552 0.786 1.00 0.00 C ATOM 389 O ILE A 27 -22.044 -4.462 1.914 1.00 0.00 O ATOM 390 CB ILE A 27 -21.753 -2.886 -0.926 1.00 0.00 C ATOM 391 CG1 ILE A 27 -20.388 -2.526 -0.316 1.00 0.00 C ATOM 392 CG2 ILE A 27 -22.238 -1.893 -1.996 1.00 0.00 C ATOM 393 CD1 ILE A 27 -19.295 -2.247 -1.348 1.00 0.00 C ATOM 0 H ILE A 27 -22.575 -2.051 1.679 1.00 0.00 H new ATOM 0 HA ILE A 27 -23.676 -3.517 -0.596 1.00 0.00 H new ATOM 0 HB ILE A 27 -21.539 -3.813 -1.457 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -20.506 -1.647 0.318 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -20.064 -3.343 0.329 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -21.412 -1.643 -2.661 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -23.044 -2.345 -2.573 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -22.602 -0.986 -1.513 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -18.365 -2.001 -0.836 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -19.145 -3.131 -1.967 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -19.595 -1.409 -1.978 1.00 0.00 H new ATOM 405 N THR A 28 -22.718 -5.751 0.208 1.00 0.00 N ATOM 406 CA THR A 28 -22.475 -6.982 0.896 1.00 0.00 C ATOM 407 C THR A 28 -21.200 -7.607 0.444 1.00 0.00 C ATOM 408 O THR A 28 -20.482 -7.114 -0.425 1.00 0.00 O ATOM 409 CB THR A 28 -23.567 -7.962 0.587 1.00 0.00 C ATOM 410 OG1 THR A 28 -23.812 -8.157 -0.798 1.00 0.00 O ATOM 411 CG2 THR A 28 -24.853 -7.292 1.102 1.00 0.00 C ATOM 0 H THR A 28 -23.047 -5.868 -0.750 1.00 0.00 H new ATOM 0 HA THR A 28 -22.429 -6.753 1.961 1.00 0.00 H new ATOM 0 HB THR A 28 -23.285 -8.920 1.024 1.00 0.00 H new ATOM 0 HG1 THR A 28 -24.534 -8.809 -0.914 1.00 0.00 H new ATOM 0 HG21 THR A 28 -25.704 -7.946 0.914 1.00 0.00 H new ATOM 0 HG22 THR A 28 -24.765 -7.110 2.173 1.00 0.00 H new ATOM 0 HG23 THR A 28 -25.002 -6.345 0.584 1.00 0.00 H new ATOM 419 N THR A 29 -20.956 -8.766 1.082 1.00 0.00 N ATOM 420 CA THR A 29 -19.966 -9.666 0.578 1.00 0.00 C ATOM 421 C THR A 29 -20.058 -10.099 -0.845 1.00 0.00 C ATOM 422 O THR A 29 -19.048 -10.335 -1.508 1.00 0.00 O ATOM 423 CB THR A 29 -20.087 -10.953 1.339 1.00 0.00 C ATOM 424 OG1 THR A 29 -21.405 -11.440 1.548 1.00 0.00 O ATOM 425 CG2 THR A 29 -19.660 -10.890 2.815 1.00 0.00 C ATOM 0 H THR A 29 -21.433 -9.075 1.929 1.00 0.00 H new ATOM 0 HA THR A 29 -19.045 -9.093 0.683 1.00 0.00 H new ATOM 0 HB THR A 29 -19.464 -11.561 0.683 1.00 0.00 H new ATOM 0 HG1 THR A 29 -21.364 -12.351 1.906 1.00 0.00 H new ATOM 0 HG21 THR A 29 -19.786 -11.871 3.273 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.613 -10.592 2.879 1.00 0.00 H new ATOM 0 HG23 THR A 29 -20.277 -10.162 3.342 1.00 0.00 H new ATOM 433 N LYS A 30 -21.296 -10.109 -1.369 1.00 0.00 N ATOM 434 CA LYS A 30 -21.659 -10.388 -2.724 1.00 0.00 C ATOM 435 C LYS A 30 -21.325 -9.299 -3.684 1.00 0.00 C ATOM 436 O LYS A 30 -20.733 -9.470 -4.748 1.00 0.00 O ATOM 437 CB LYS A 30 -23.178 -10.608 -2.818 1.00 0.00 C ATOM 438 CG LYS A 30 -23.742 -11.585 -1.784 1.00 0.00 C ATOM 439 CD LYS A 30 -23.103 -12.975 -1.790 1.00 0.00 C ATOM 440 CE LYS A 30 -23.522 -13.857 -0.612 1.00 0.00 C ATOM 441 NZ LYS A 30 -23.096 -15.263 -0.790 1.00 0.00 N ATOM 0 H LYS A 30 -22.113 -9.904 -0.793 1.00 0.00 H new ATOM 0 HA LYS A 30 -21.083 -11.272 -2.997 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -23.680 -9.647 -2.703 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -23.418 -10.976 -3.816 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -23.620 -11.150 -0.792 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -24.813 -11.693 -1.955 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -23.365 -13.480 -2.720 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -22.019 -12.865 -1.781 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -23.091 -13.462 0.308 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -24.605 -13.819 -0.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -22.923 -15.694 0.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -23.843 -15.792 -1.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -22.222 -15.292 -1.353 1.00 0.00 H new ATOM 455 N GLU A 31 -21.594 -8.040 -3.293 1.00 0.00 N ATOM 456 CA GLU A 31 -21.335 -6.829 -4.008 1.00 0.00 C ATOM 457 C GLU A 31 -19.912 -6.400 -3.911 1.00 0.00 C ATOM 458 O GLU A 31 -19.444 -5.976 -4.967 1.00 0.00 O ATOM 459 CB GLU A 31 -22.166 -5.648 -3.478 1.00 0.00 C ATOM 460 CG GLU A 31 -23.626 -5.755 -3.921 1.00 0.00 C ATOM 461 CD GLU A 31 -24.414 -4.756 -3.086 1.00 0.00 C ATOM 462 OE1 GLU A 31 -24.754 -4.985 -1.895 1.00 0.00 O ATOM 463 OE2 GLU A 31 -24.777 -3.669 -3.610 1.00 0.00 O ATOM 0 H GLU A 31 -22.034 -7.855 -2.391 1.00 0.00 H new ATOM 0 HA GLU A 31 -21.600 -7.066 -5.038 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -22.115 -5.623 -2.389 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -21.742 -4.711 -3.838 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -23.725 -5.533 -4.984 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -24.002 -6.767 -3.770 1.00 0.00 H new ATOM 470 N LEU A 32 -19.232 -6.601 -2.768 1.00 0.00 N ATOM 471 CA LEU A 32 -17.823 -6.360 -2.760 1.00 0.00 C ATOM 472 C LEU A 32 -17.013 -7.448 -3.376 1.00 0.00 C ATOM 473 O LEU A 32 -15.962 -7.243 -3.981 1.00 0.00 O ATOM 474 CB LEU A 32 -17.442 -5.942 -1.330 1.00 0.00 C ATOM 475 CG LEU A 32 -15.982 -5.536 -1.069 1.00 0.00 C ATOM 476 CD1 LEU A 32 -15.451 -4.323 -1.852 1.00 0.00 C ATOM 477 CD2 LEU A 32 -15.759 -5.233 0.422 1.00 0.00 C ATOM 0 H LEU A 32 -19.635 -6.916 -1.886 1.00 0.00 H new ATOM 0 HA LEU A 32 -17.569 -5.538 -3.429 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -18.079 -5.105 -1.044 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -17.684 -6.769 -0.663 1.00 0.00 H new ATOM 0 HG LEU A 32 -15.428 -6.407 -1.420 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -14.412 -4.140 -1.579 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -15.515 -4.524 -2.921 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -16.049 -3.444 -1.611 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.719 -4.948 0.584 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.411 -4.415 0.729 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -15.988 -6.121 1.012 1.00 0.00 H new ATOM 489 N GLY A 33 -17.542 -8.683 -3.318 1.00 0.00 N ATOM 490 CA GLY A 33 -17.076 -9.796 -4.086 1.00 0.00 C ATOM 491 C GLY A 33 -17.073 -9.447 -5.535 1.00 0.00 C ATOM 492 O GLY A 33 -16.063 -9.559 -6.228 1.00 0.00 O ATOM 0 H GLY A 33 -18.327 -8.916 -2.710 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.071 -10.073 -3.768 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -17.715 -10.662 -3.913 1.00 0.00 H new ATOM 496 N THR A 34 -18.177 -8.942 -6.112 1.00 0.00 N ATOM 497 CA THR A 34 -18.329 -8.668 -7.507 1.00 0.00 C ATOM 498 C THR A 34 -17.472 -7.548 -7.988 1.00 0.00 C ATOM 499 O THR A 34 -16.852 -7.670 -9.043 1.00 0.00 O ATOM 500 CB THR A 34 -19.654 -8.024 -7.791 1.00 0.00 C ATOM 501 OG1 THR A 34 -20.748 -8.879 -7.491 1.00 0.00 O ATOM 502 CG2 THR A 34 -19.876 -7.519 -9.227 1.00 0.00 C ATOM 0 H THR A 34 -19.012 -8.712 -5.573 1.00 0.00 H new ATOM 0 HA THR A 34 -18.131 -9.639 -7.962 1.00 0.00 H new ATOM 0 HB THR A 34 -19.615 -7.156 -7.133 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.746 -9.090 -6.534 1.00 0.00 H new ATOM 0 HG21 THR A 34 -20.868 -7.075 -9.307 1.00 0.00 H new ATOM 0 HG22 THR A 34 -19.122 -6.770 -9.470 1.00 0.00 H new ATOM 0 HG23 THR A 34 -19.795 -8.354 -9.923 1.00 0.00 H new ATOM 510 N VAL A 35 -17.226 -6.418 -7.301 1.00 0.00 N ATOM 511 CA VAL A 35 -16.234 -5.423 -7.568 1.00 0.00 C ATOM 512 C VAL A 35 -14.847 -5.917 -7.797 1.00 0.00 C ATOM 513 O VAL A 35 -14.255 -5.647 -8.840 1.00 0.00 O ATOM 514 CB VAL A 35 -16.228 -4.329 -6.541 1.00 0.00 C ATOM 515 CG1 VAL A 35 -15.156 -3.260 -6.808 1.00 0.00 C ATOM 516 CG2 VAL A 35 -17.574 -3.600 -6.691 1.00 0.00 C ATOM 0 H VAL A 35 -17.778 -6.180 -6.477 1.00 0.00 H new ATOM 0 HA VAL A 35 -16.557 -5.023 -8.529 1.00 0.00 H new ATOM 0 HB VAL A 35 -16.042 -4.778 -5.565 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -15.202 -2.497 -6.031 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -14.170 -3.724 -6.802 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -15.335 -2.800 -7.780 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -17.631 -2.788 -5.966 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -17.657 -3.193 -7.699 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -18.389 -4.301 -6.514 1.00 0.00 H new ATOM 526 N MET A 36 -14.398 -6.697 -6.797 1.00 0.00 N ATOM 527 CA MET A 36 -13.117 -7.332 -6.835 1.00 0.00 C ATOM 528 C MET A 36 -13.014 -8.311 -7.953 1.00 0.00 C ATOM 529 O MET A 36 -11.957 -8.596 -8.515 1.00 0.00 O ATOM 530 CB MET A 36 -12.750 -8.055 -5.529 1.00 0.00 C ATOM 531 CG MET A 36 -12.552 -7.205 -4.273 1.00 0.00 C ATOM 532 SD MET A 36 -11.335 -5.867 -4.458 1.00 0.00 S ATOM 533 CE MET A 36 -11.629 -5.021 -2.879 1.00 0.00 C ATOM 0 H MET A 36 -14.932 -6.890 -5.950 1.00 0.00 H new ATOM 0 HA MET A 36 -12.413 -6.513 -6.985 1.00 0.00 H new ATOM 0 HB2 MET A 36 -13.532 -8.785 -5.319 1.00 0.00 H new ATOM 0 HB3 MET A 36 -11.831 -8.614 -5.703 1.00 0.00 H new ATOM 0 HG2 MET A 36 -13.510 -6.771 -3.987 1.00 0.00 H new ATOM 0 HG3 MET A 36 -12.239 -7.854 -3.455 1.00 0.00 H new ATOM 0 HE1 MET A 36 -10.791 -4.360 -2.659 1.00 0.00 H new ATOM 0 HE2 MET A 36 -12.546 -4.435 -2.945 1.00 0.00 H new ATOM 0 HE3 MET A 36 -11.727 -5.759 -2.083 1.00 0.00 H new ATOM 543 N ARG A 37 -14.074 -9.076 -8.269 1.00 0.00 N ATOM 544 CA ARG A 37 -14.181 -9.946 -9.399 1.00 0.00 C ATOM 545 C ARG A 37 -13.891 -9.220 -10.667 1.00 0.00 C ATOM 546 O ARG A 37 -13.171 -9.617 -11.583 1.00 0.00 O ATOM 547 CB ARG A 37 -15.530 -10.684 -9.409 1.00 0.00 C ATOM 548 CG ARG A 37 -15.417 -12.111 -9.950 1.00 0.00 C ATOM 549 CD ARG A 37 -14.853 -13.107 -8.934 1.00 0.00 C ATOM 550 NE ARG A 37 -14.688 -14.356 -9.728 1.00 0.00 N ATOM 551 CZ ARG A 37 -13.540 -14.867 -10.263 1.00 0.00 C ATOM 552 NH1 ARG A 37 -12.421 -14.092 -10.161 1.00 0.00 N ATOM 553 NH2 ARG A 37 -13.483 -16.067 -10.909 1.00 0.00 N ATOM 0 H ARG A 37 -14.916 -9.087 -7.693 1.00 0.00 H new ATOM 0 HA ARG A 37 -13.418 -10.719 -9.314 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -15.931 -10.714 -8.396 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -16.241 -10.125 -10.016 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -16.403 -12.449 -10.269 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -14.780 -12.106 -10.834 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -13.904 -12.765 -8.521 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -15.532 -13.252 -8.094 1.00 0.00 H new ATOM 0 HE ARG A 37 -15.537 -14.897 -9.893 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -12.471 -13.182 -9.703 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -11.535 -14.423 -10.543 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -14.326 -16.631 -11.012 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -12.597 -16.400 -11.289 1.00 0.00 H new ATOM 567 N SER A 38 -14.479 -8.018 -10.804 1.00 0.00 N ATOM 568 CA SER A 38 -14.284 -7.129 -11.907 1.00 0.00 C ATOM 569 C SER A 38 -12.922 -6.531 -11.985 1.00 0.00 C ATOM 570 O SER A 38 -12.522 -6.068 -13.052 1.00 0.00 O ATOM 571 CB SER A 38 -15.240 -5.942 -12.113 1.00 0.00 C ATOM 572 OG SER A 38 -16.569 -6.402 -12.305 1.00 0.00 O ATOM 0 H SER A 38 -15.125 -7.647 -10.107 1.00 0.00 H new ATOM 0 HA SER A 38 -14.492 -7.863 -12.685 1.00 0.00 H new ATOM 0 HB2 SER A 38 -15.199 -5.280 -11.248 1.00 0.00 H new ATOM 0 HB3 SER A 38 -14.923 -5.357 -12.977 1.00 0.00 H new ATOM 0 HG SER A 38 -17.165 -5.635 -12.433 1.00 0.00 H new ATOM 578 N LEU A 39 -12.143 -6.569 -10.889 1.00 0.00 N ATOM 579 CA LEU A 39 -10.790 -6.150 -10.696 1.00 0.00 C ATOM 580 C LEU A 39 -9.830 -7.274 -10.883 1.00 0.00 C ATOM 581 O LEU A 39 -8.641 -7.287 -10.569 1.00 0.00 O ATOM 582 CB LEU A 39 -10.558 -5.327 -9.418 1.00 0.00 C ATOM 583 CG LEU A 39 -11.453 -4.083 -9.288 1.00 0.00 C ATOM 584 CD1 LEU A 39 -10.986 -3.327 -8.032 1.00 0.00 C ATOM 585 CD2 LEU A 39 -11.497 -3.161 -10.518 1.00 0.00 C ATOM 0 H LEU A 39 -12.521 -6.948 -10.020 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.579 -5.436 -11.492 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -10.723 -5.969 -8.553 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -9.515 -5.013 -9.388 1.00 0.00 H new ATOM 0 HG LEU A 39 -12.485 -4.423 -9.206 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -11.595 -2.433 -7.898 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -11.091 -3.971 -7.159 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.941 -3.040 -8.147 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -12.157 -2.317 -10.317 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -10.494 -2.794 -10.733 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -11.872 -3.718 -11.377 1.00 0.00 H new ATOM 597 N GLY A 40 -10.352 -8.444 -11.293 1.00 0.00 N ATOM 598 CA GLY A 40 -9.685 -9.673 -11.595 1.00 0.00 C ATOM 599 C GLY A 40 -9.290 -10.554 -10.461 1.00 0.00 C ATOM 600 O GLY A 40 -8.415 -11.411 -10.576 1.00 0.00 O ATOM 0 H GLY A 40 -11.359 -8.535 -11.427 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -10.332 -10.250 -12.256 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.784 -9.433 -12.160 1.00 0.00 H new ATOM 604 N GLN A 41 -9.767 -10.278 -9.234 1.00 0.00 N ATOM 605 CA GLN A 41 -9.440 -11.068 -8.088 1.00 0.00 C ATOM 606 C GLN A 41 -10.509 -12.077 -7.843 1.00 0.00 C ATOM 607 O GLN A 41 -11.633 -12.016 -8.339 1.00 0.00 O ATOM 608 CB GLN A 41 -9.190 -10.171 -6.864 1.00 0.00 C ATOM 609 CG GLN A 41 -8.161 -9.075 -7.147 1.00 0.00 C ATOM 610 CD GLN A 41 -8.365 -8.029 -6.060 1.00 0.00 C ATOM 611 OE1 GLN A 41 -8.792 -8.298 -4.939 1.00 0.00 O ATOM 612 NE2 GLN A 41 -7.959 -6.772 -6.385 1.00 0.00 N ATOM 0 H GLN A 41 -10.389 -9.495 -9.034 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.513 -11.610 -8.276 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.129 -9.713 -6.554 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -8.845 -10.784 -6.032 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -7.147 -9.474 -7.121 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.309 -8.645 -8.137 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -7.609 -6.576 -7.323 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -8.005 -6.026 -5.691 1.00 0.00 H new ATOM 621 N ASN A 42 -10.238 -13.044 -6.948 1.00 0.00 N ATOM 622 CA ASN A 42 -11.147 -14.116 -6.685 1.00 0.00 C ATOM 623 C ASN A 42 -11.196 -14.232 -5.200 1.00 0.00 C ATOM 624 O ASN A 42 -10.708 -15.248 -4.709 1.00 0.00 O ATOM 625 CB ASN A 42 -10.566 -15.388 -7.326 1.00 0.00 C ATOM 626 CG ASN A 42 -11.502 -16.584 -7.227 1.00 0.00 C ATOM 627 OD1 ASN A 42 -12.660 -16.474 -6.827 1.00 0.00 O ATOM 628 ND2 ASN A 42 -10.894 -17.751 -7.570 1.00 0.00 N ATOM 0 H ASN A 42 -9.378 -13.082 -6.401 1.00 0.00 H new ATOM 0 HA ASN A 42 -12.147 -13.958 -7.089 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -10.346 -15.192 -8.375 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -9.620 -15.633 -6.842 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -11.406 -18.631 -7.505 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -9.926 -17.746 -7.893 1.00 0.00 H new ATOM 635 N PRO A 43 -11.769 -13.374 -4.409 1.00 0.00 N ATOM 636 CA PRO A 43 -11.693 -13.539 -2.987 1.00 0.00 C ATOM 637 C PRO A 43 -12.552 -14.631 -2.449 1.00 0.00 C ATOM 638 O PRO A 43 -13.473 -15.113 -3.107 1.00 0.00 O ATOM 639 CB PRO A 43 -12.217 -12.223 -2.416 1.00 0.00 C ATOM 640 CG PRO A 43 -12.599 -11.293 -3.578 1.00 0.00 C ATOM 641 CD PRO A 43 -12.521 -12.197 -4.819 1.00 0.00 C ATOM 0 HA PRO A 43 -10.669 -13.796 -2.716 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -13.083 -12.406 -1.780 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -11.457 -11.754 -1.792 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -13.599 -10.881 -3.447 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -11.914 -10.449 -3.655 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -13.517 -12.471 -5.166 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -12.026 -11.685 -5.644 1.00 0.00 H new ATOM 649 N THR A 44 -12.419 -15.032 -1.172 1.00 0.00 N ATOM 650 CA THR A 44 -13.463 -15.740 -0.499 1.00 0.00 C ATOM 651 C THR A 44 -14.353 -14.800 0.239 1.00 0.00 C ATOM 652 O THR A 44 -14.032 -13.646 0.516 1.00 0.00 O ATOM 653 CB THR A 44 -13.076 -16.822 0.464 1.00 0.00 C ATOM 654 OG1 THR A 44 -12.595 -16.248 1.670 1.00 0.00 O ATOM 655 CG2 THR A 44 -11.868 -17.625 -0.048 1.00 0.00 C ATOM 0 H THR A 44 -11.587 -14.866 -0.605 1.00 0.00 H new ATOM 0 HA THR A 44 -13.952 -16.245 -1.332 1.00 0.00 H new ATOM 0 HB THR A 44 -13.964 -17.441 0.593 1.00 0.00 H new ATOM 0 HG1 THR A 44 -12.346 -16.961 2.295 1.00 0.00 H new ATOM 0 HG21 THR A 44 -11.614 -18.401 0.674 1.00 0.00 H new ATOM 0 HG22 THR A 44 -12.116 -18.086 -1.004 1.00 0.00 H new ATOM 0 HG23 THR A 44 -11.016 -16.958 -0.178 1.00 0.00 H new ATOM 663 N GLU A 45 -15.474 -15.353 0.736 1.00 0.00 N ATOM 664 CA GLU A 45 -16.549 -14.669 1.385 1.00 0.00 C ATOM 665 C GLU A 45 -16.232 -14.472 2.828 1.00 0.00 C ATOM 666 O GLU A 45 -16.538 -13.430 3.406 1.00 0.00 O ATOM 667 CB GLU A 45 -17.940 -15.292 1.175 1.00 0.00 C ATOM 668 CG GLU A 45 -18.421 -15.390 -0.274 1.00 0.00 C ATOM 669 CD GLU A 45 -19.924 -15.622 -0.324 1.00 0.00 C ATOM 670 OE1 GLU A 45 -20.586 -15.712 0.744 1.00 0.00 O ATOM 671 OE2 GLU A 45 -20.499 -15.512 -1.440 1.00 0.00 O ATOM 0 H GLU A 45 -15.640 -16.358 0.679 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.627 -13.698 0.896 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -17.935 -16.294 1.604 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.667 -14.707 1.739 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -18.171 -14.474 -0.809 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -17.904 -16.206 -0.780 1.00 0.00 H new ATOM 678 N ALA A 46 -15.551 -15.405 3.516 1.00 0.00 N ATOM 679 CA ALA A 46 -15.297 -15.210 4.910 1.00 0.00 C ATOM 680 C ALA A 46 -14.238 -14.211 5.226 1.00 0.00 C ATOM 681 O ALA A 46 -14.365 -13.454 6.187 1.00 0.00 O ATOM 682 CB ALA A 46 -14.911 -16.563 5.531 1.00 0.00 C ATOM 0 H ALA A 46 -15.185 -16.272 3.122 1.00 0.00 H new ATOM 0 HA ALA A 46 -16.217 -14.805 5.331 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -14.714 -16.432 6.595 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -15.729 -17.271 5.398 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -14.016 -16.946 5.041 1.00 0.00 H new ATOM 688 N GLU A 47 -13.233 -14.174 4.332 1.00 0.00 N ATOM 689 CA GLU A 47 -12.246 -13.144 4.428 1.00 0.00 C ATOM 690 C GLU A 47 -12.634 -11.795 3.929 1.00 0.00 C ATOM 691 O GLU A 47 -12.140 -10.793 4.445 1.00 0.00 O ATOM 692 CB GLU A 47 -10.873 -13.469 3.816 1.00 0.00 C ATOM 693 CG GLU A 47 -10.100 -14.594 4.508 1.00 0.00 C ATOM 694 CD GLU A 47 -8.755 -15.001 3.923 1.00 0.00 C ATOM 695 OE1 GLU A 47 -8.382 -14.322 2.930 1.00 0.00 O ATOM 696 OE2 GLU A 47 -7.995 -15.824 4.500 1.00 0.00 O ATOM 0 H GLU A 47 -13.105 -14.835 3.566 1.00 0.00 H new ATOM 0 HA GLU A 47 -12.167 -13.108 5.515 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -11.014 -13.738 2.769 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.262 -12.566 3.834 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.938 -14.299 5.545 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.738 -15.477 4.524 1.00 0.00 H new ATOM 703 N LEU A 48 -13.610 -11.697 3.009 1.00 0.00 N ATOM 704 CA LEU A 48 -14.476 -10.578 2.801 1.00 0.00 C ATOM 705 C LEU A 48 -15.221 -10.130 4.011 1.00 0.00 C ATOM 706 O LEU A 48 -15.007 -8.979 4.385 1.00 0.00 O ATOM 707 CB LEU A 48 -15.420 -10.535 1.588 1.00 0.00 C ATOM 708 CG LEU A 48 -14.733 -10.223 0.248 1.00 0.00 C ATOM 709 CD1 LEU A 48 -15.691 -10.613 -0.891 1.00 0.00 C ATOM 710 CD2 LEU A 48 -14.183 -8.792 0.128 1.00 0.00 C ATOM 0 H LEU A 48 -13.808 -12.460 2.361 1.00 0.00 H new ATOM 0 HA LEU A 48 -13.687 -9.873 2.539 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -15.927 -11.496 1.505 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -16.189 -9.784 1.770 1.00 0.00 H new ATOM 0 HG LEU A 48 -13.828 -10.826 0.181 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -15.221 -10.399 -1.851 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -15.918 -11.677 -0.827 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -16.614 -10.039 -0.803 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -13.716 -8.662 -0.848 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -14.999 -8.078 0.238 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -13.443 -8.620 0.910 1.00 0.00 H new ATOM 722 N GLN A 49 -15.990 -10.996 4.695 1.00 0.00 N ATOM 723 CA GLN A 49 -16.608 -10.622 5.929 1.00 0.00 C ATOM 724 C GLN A 49 -15.785 -10.029 7.020 1.00 0.00 C ATOM 725 O GLN A 49 -16.128 -9.112 7.766 1.00 0.00 O ATOM 726 CB GLN A 49 -17.380 -11.864 6.406 1.00 0.00 C ATOM 727 CG GLN A 49 -18.450 -11.650 7.479 1.00 0.00 C ATOM 728 CD GLN A 49 -19.781 -11.098 6.988 1.00 0.00 C ATOM 729 OE1 GLN A 49 -20.442 -11.797 6.222 1.00 0.00 O ATOM 730 NE2 GLN A 49 -20.094 -9.864 7.467 1.00 0.00 N ATOM 0 H GLN A 49 -16.183 -11.952 4.395 1.00 0.00 H new ATOM 0 HA GLN A 49 -17.230 -9.757 5.698 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -17.857 -12.319 5.538 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -16.658 -12.585 6.788 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -18.635 -12.602 7.976 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -18.052 -10.970 8.232 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -19.454 -9.386 8.102 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -20.968 -9.417 7.192 1.00 0.00 H new ATOM 739 N ASP A 50 -14.571 -10.594 7.145 1.00 0.00 N ATOM 740 CA ASP A 50 -13.538 -10.068 7.982 1.00 0.00 C ATOM 741 C ASP A 50 -13.142 -8.654 7.728 1.00 0.00 C ATOM 742 O ASP A 50 -13.127 -7.845 8.654 1.00 0.00 O ATOM 743 CB ASP A 50 -12.212 -10.846 8.020 1.00 0.00 C ATOM 744 CG ASP A 50 -12.241 -12.215 8.684 1.00 0.00 C ATOM 745 OD1 ASP A 50 -13.313 -12.796 9.002 1.00 0.00 O ATOM 746 OD2 ASP A 50 -11.144 -12.732 9.029 1.00 0.00 O ATOM 0 H ASP A 50 -14.300 -11.443 6.649 1.00 0.00 H new ATOM 0 HA ASP A 50 -14.065 -10.165 8.931 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -11.862 -10.972 6.995 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -11.473 -10.233 8.536 1.00 0.00 H new ATOM 751 N MET A 51 -12.812 -8.395 6.450 1.00 0.00 N ATOM 752 CA MET A 51 -12.592 -7.133 5.814 1.00 0.00 C ATOM 753 C MET A 51 -13.652 -6.132 6.124 1.00 0.00 C ATOM 754 O MET A 51 -13.390 -5.055 6.658 1.00 0.00 O ATOM 755 CB MET A 51 -12.399 -7.174 4.289 1.00 0.00 C ATOM 756 CG MET A 51 -11.964 -5.905 3.554 1.00 0.00 C ATOM 757 SD MET A 51 -12.022 -6.105 1.748 1.00 0.00 S ATOM 758 CE MET A 51 -11.522 -4.398 1.382 1.00 0.00 C ATOM 0 H MET A 51 -12.686 -9.162 5.789 1.00 0.00 H new ATOM 0 HA MET A 51 -11.641 -6.828 6.250 1.00 0.00 H new ATOM 0 HB2 MET A 51 -11.661 -7.947 4.073 1.00 0.00 H new ATOM 0 HB3 MET A 51 -13.341 -7.501 3.848 1.00 0.00 H new ATOM 0 HG2 MET A 51 -12.610 -5.078 3.847 1.00 0.00 H new ATOM 0 HG3 MET A 51 -10.951 -5.641 3.856 1.00 0.00 H new ATOM 0 HE1 MET A 51 -11.074 -4.355 0.389 1.00 0.00 H new ATOM 0 HE2 MET A 51 -12.396 -3.748 1.414 1.00 0.00 H new ATOM 0 HE3 MET A 51 -10.795 -4.065 2.123 1.00 0.00 H new ATOM 768 N ILE A 52 -14.879 -6.590 5.820 1.00 0.00 N ATOM 769 CA ILE A 52 -16.054 -5.837 6.132 1.00 0.00 C ATOM 770 C ILE A 52 -16.150 -5.471 7.573 1.00 0.00 C ATOM 771 O ILE A 52 -16.366 -4.323 7.957 1.00 0.00 O ATOM 772 CB ILE A 52 -17.228 -6.631 5.641 1.00 0.00 C ATOM 773 CG1 ILE A 52 -17.221 -6.641 4.103 1.00 0.00 C ATOM 774 CG2 ILE A 52 -18.553 -6.049 6.161 1.00 0.00 C ATOM 775 CD1 ILE A 52 -18.286 -7.466 3.383 1.00 0.00 C ATOM 0 H ILE A 52 -15.058 -7.482 5.358 1.00 0.00 H new ATOM 0 HA ILE A 52 -16.024 -4.870 5.629 1.00 0.00 H new ATOM 0 HB ILE A 52 -17.144 -7.650 6.019 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -17.312 -5.610 3.763 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -16.245 -6.999 3.777 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -19.384 -6.647 5.787 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -18.555 -6.066 7.251 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -18.660 -5.021 5.814 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -18.151 -7.373 2.305 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -18.192 -8.513 3.672 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -19.276 -7.101 3.658 1.00 0.00 H new ATOM 787 N ASN A 53 -16.055 -6.452 8.489 1.00 0.00 N ATOM 788 CA ASN A 53 -16.254 -6.364 9.902 1.00 0.00 C ATOM 789 C ASN A 53 -15.238 -5.441 10.483 1.00 0.00 C ATOM 790 O ASN A 53 -15.572 -4.709 11.413 1.00 0.00 O ATOM 791 CB ASN A 53 -16.227 -7.763 10.540 1.00 0.00 C ATOM 792 CG ASN A 53 -17.535 -8.461 10.197 1.00 0.00 C ATOM 793 OD1 ASN A 53 -18.527 -7.936 9.692 1.00 0.00 O ATOM 794 ND2 ASN A 53 -17.656 -9.754 10.600 1.00 0.00 N ATOM 0 H ASN A 53 -15.814 -7.402 8.208 1.00 0.00 H new ATOM 0 HA ASN A 53 -17.239 -5.950 10.118 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -15.379 -8.337 10.165 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -16.108 -7.687 11.621 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -18.541 -10.246 10.478 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -16.861 -10.232 11.024 1.00 0.00 H new ATOM 801 N GLU A 54 -13.995 -5.338 9.980 1.00 0.00 N ATOM 802 CA GLU A 54 -12.996 -4.380 10.341 1.00 0.00 C ATOM 803 C GLU A 54 -13.419 -2.953 10.424 1.00 0.00 C ATOM 804 O GLU A 54 -12.925 -2.279 11.327 1.00 0.00 O ATOM 805 CB GLU A 54 -11.742 -4.578 9.473 1.00 0.00 C ATOM 806 CG GLU A 54 -10.693 -3.470 9.350 1.00 0.00 C ATOM 807 CD GLU A 54 -9.358 -3.841 8.720 1.00 0.00 C ATOM 808 OE1 GLU A 54 -9.356 -4.353 7.569 1.00 0.00 O ATOM 809 OE2 GLU A 54 -8.294 -3.635 9.363 1.00 0.00 O ATOM 0 H GLU A 54 -13.662 -5.980 9.260 1.00 0.00 H new ATOM 0 HA GLU A 54 -12.767 -4.598 11.384 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -11.230 -5.464 9.847 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -12.084 -4.809 8.464 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.127 -2.657 8.767 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.498 -3.078 10.348 1.00 0.00 H new ATOM 816 N VAL A 55 -14.270 -2.442 9.517 1.00 0.00 N ATOM 817 CA VAL A 55 -14.807 -1.117 9.529 1.00 0.00 C ATOM 818 C VAL A 55 -16.250 -1.057 9.894 1.00 0.00 C ATOM 819 O VAL A 55 -16.855 0.014 9.917 1.00 0.00 O ATOM 820 CB VAL A 55 -14.592 -0.422 8.217 1.00 0.00 C ATOM 821 CG1 VAL A 55 -13.092 -0.128 8.048 1.00 0.00 C ATOM 822 CG2 VAL A 55 -15.106 -1.396 7.144 1.00 0.00 C ATOM 0 H VAL A 55 -14.604 -2.990 8.724 1.00 0.00 H new ATOM 0 HA VAL A 55 -14.255 -0.597 10.312 1.00 0.00 H new ATOM 0 HB VAL A 55 -15.116 0.531 8.147 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -12.925 0.377 7.097 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.752 0.511 8.863 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -12.534 -1.064 8.064 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -14.979 -0.951 6.157 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -14.542 -2.327 7.197 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -16.163 -1.602 7.316 1.00 0.00 H new ATOM 832 N ASP A 56 -16.901 -2.167 10.283 1.00 0.00 N ATOM 833 CA ASP A 56 -18.311 -2.147 10.519 1.00 0.00 C ATOM 834 C ASP A 56 -18.523 -1.748 11.939 1.00 0.00 C ATOM 835 O ASP A 56 -18.297 -2.495 12.889 1.00 0.00 O ATOM 836 CB ASP A 56 -18.989 -3.485 10.179 1.00 0.00 C ATOM 837 CG ASP A 56 -20.471 -3.654 10.483 1.00 0.00 C ATOM 838 OD1 ASP A 56 -21.344 -2.987 9.866 1.00 0.00 O ATOM 839 OD2 ASP A 56 -20.811 -4.580 11.267 1.00 0.00 O ATOM 0 H ASP A 56 -16.456 -3.072 10.433 1.00 0.00 H new ATOM 0 HA ASP A 56 -18.784 -1.424 9.854 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -18.848 -3.665 9.113 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -18.452 -4.271 10.709 1.00 0.00 H new ATOM 844 N ALA A 57 -18.858 -0.465 12.163 1.00 0.00 N ATOM 845 CA ALA A 57 -19.206 0.161 13.400 1.00 0.00 C ATOM 846 C ALA A 57 -20.563 -0.107 13.953 1.00 0.00 C ATOM 847 O ALA A 57 -20.804 -0.003 15.155 1.00 0.00 O ATOM 848 CB ALA A 57 -18.976 1.670 13.210 1.00 0.00 C ATOM 0 H ALA A 57 -18.887 0.203 11.392 1.00 0.00 H new ATOM 0 HA ALA A 57 -18.567 -0.287 14.162 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -19.229 2.195 14.131 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -17.929 1.850 12.965 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -19.607 2.035 12.399 1.00 0.00 H new ATOM 854 N ASP A 58 -21.504 -0.462 13.060 1.00 0.00 N ATOM 855 CA ASP A 58 -22.870 -0.618 13.457 1.00 0.00 C ATOM 856 C ASP A 58 -23.316 -2.017 13.713 1.00 0.00 C ATOM 857 O ASP A 58 -24.332 -2.226 14.373 1.00 0.00 O ATOM 858 CB ASP A 58 -23.819 0.172 12.541 1.00 0.00 C ATOM 859 CG ASP A 58 -23.738 -0.285 11.091 1.00 0.00 C ATOM 860 OD1 ASP A 58 -23.854 -1.506 10.802 1.00 0.00 O ATOM 861 OD2 ASP A 58 -23.572 0.516 10.133 1.00 0.00 O ATOM 0 H ASP A 58 -21.323 -0.640 12.072 1.00 0.00 H new ATOM 0 HA ASP A 58 -22.924 -0.171 14.450 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -24.843 0.059 12.898 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -23.576 1.233 12.599 1.00 0.00 H new ATOM 866 N GLY A 59 -22.592 -3.039 13.221 1.00 0.00 N ATOM 867 CA GLY A 59 -22.944 -4.386 13.548 1.00 0.00 C ATOM 868 C GLY A 59 -23.861 -5.125 12.636 1.00 0.00 C ATOM 869 O GLY A 59 -24.307 -6.194 13.049 1.00 0.00 O ATOM 0 H GLY A 59 -21.781 -2.938 12.611 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -22.021 -4.960 13.625 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -23.398 -4.378 14.539 1.00 0.00 H new ATOM 873 N ASN A 60 -24.263 -4.542 11.492 1.00 0.00 N ATOM 874 CA ASN A 60 -24.974 -5.333 10.536 1.00 0.00 C ATOM 875 C ASN A 60 -24.194 -6.302 9.717 1.00 0.00 C ATOM 876 O ASN A 60 -24.701 -7.257 9.130 1.00 0.00 O ATOM 877 CB ASN A 60 -25.807 -4.475 9.568 1.00 0.00 C ATOM 878 CG ASN A 60 -25.166 -3.323 8.807 1.00 0.00 C ATOM 879 OD1 ASN A 60 -24.018 -3.325 8.365 1.00 0.00 O ATOM 880 ND2 ASN A 60 -25.973 -2.245 8.618 1.00 0.00 N ATOM 0 H ASN A 60 -24.106 -3.567 11.235 1.00 0.00 H new ATOM 0 HA ASN A 60 -25.598 -5.931 11.200 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -26.236 -5.150 8.827 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -26.637 -4.060 10.139 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -25.627 -1.432 8.107 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -26.924 -2.249 8.987 1.00 0.00 H new ATOM 887 N GLY A 61 -22.887 -6.025 9.559 1.00 0.00 N ATOM 888 CA GLY A 61 -22.005 -6.741 8.691 1.00 0.00 C ATOM 889 C GLY A 61 -22.065 -6.425 7.236 1.00 0.00 C ATOM 890 O GLY A 61 -21.670 -7.249 6.413 1.00 0.00 O ATOM 0 H GLY A 61 -22.424 -5.266 10.060 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -20.984 -6.567 9.031 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -22.205 -7.806 8.812 1.00 0.00 H new ATOM 894 N THR A 62 -22.658 -5.284 6.844 1.00 0.00 N ATOM 895 CA THR A 62 -22.515 -4.807 5.504 1.00 0.00 C ATOM 896 C THR A 62 -21.929 -3.438 5.477 1.00 0.00 C ATOM 897 O THR A 62 -22.137 -2.708 6.444 1.00 0.00 O ATOM 898 CB THR A 62 -23.858 -4.716 4.843 1.00 0.00 C ATOM 899 OG1 THR A 62 -24.787 -4.041 5.678 1.00 0.00 O ATOM 900 CG2 THR A 62 -24.479 -6.115 4.690 1.00 0.00 C ATOM 0 H THR A 62 -23.232 -4.696 7.449 1.00 0.00 H new ATOM 0 HA THR A 62 -21.862 -5.508 4.985 1.00 0.00 H new ATOM 0 HB THR A 62 -23.692 -4.210 3.892 1.00 0.00 H new ATOM 0 HG1 THR A 62 -24.303 -3.486 6.324 1.00 0.00 H new ATOM 0 HG21 THR A 62 -25.453 -6.030 4.209 1.00 0.00 H new ATOM 0 HG22 THR A 62 -23.826 -6.738 4.079 1.00 0.00 H new ATOM 0 HG23 THR A 62 -24.599 -6.569 5.673 1.00 0.00 H new ATOM 908 N ILE A 63 -21.210 -2.986 4.433 1.00 0.00 N ATOM 909 CA ILE A 63 -20.526 -1.735 4.547 1.00 0.00 C ATOM 910 C ILE A 63 -21.470 -0.648 4.163 1.00 0.00 C ATOM 911 O ILE A 63 -21.948 -0.622 3.031 1.00 0.00 O ATOM 912 CB ILE A 63 -19.315 -1.668 3.664 1.00 0.00 C ATOM 913 CG1 ILE A 63 -18.464 -2.909 3.985 1.00 0.00 C ATOM 914 CG2 ILE A 63 -18.536 -0.377 3.964 1.00 0.00 C ATOM 915 CD1 ILE A 63 -17.142 -2.883 3.220 1.00 0.00 C ATOM 0 H ILE A 63 -21.103 -3.467 3.540 1.00 0.00 H new ATOM 0 HA ILE A 63 -20.187 -1.623 5.577 1.00 0.00 H new ATOM 0 HB ILE A 63 -19.584 -1.656 2.608 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -18.267 -2.951 5.056 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -19.019 -3.811 3.727 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -17.656 -0.326 3.323 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -19.174 0.486 3.773 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -18.225 -0.374 5.009 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -16.561 -3.772 3.466 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -17.342 -2.866 2.149 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -16.578 -1.993 3.498 1.00 0.00 H new ATOM 927 N ASP A 64 -21.893 0.239 5.081 1.00 0.00 N ATOM 928 CA ASP A 64 -22.705 1.379 4.790 1.00 0.00 C ATOM 929 C ASP A 64 -21.736 2.461 4.457 1.00 0.00 C ATOM 930 O ASP A 64 -20.522 2.333 4.605 1.00 0.00 O ATOM 931 CB ASP A 64 -23.574 1.777 5.995 1.00 0.00 C ATOM 932 CG ASP A 64 -24.396 0.660 6.622 1.00 0.00 C ATOM 933 OD1 ASP A 64 -23.924 -0.368 7.176 1.00 0.00 O ATOM 934 OD2 ASP A 64 -25.635 0.887 6.621 1.00 0.00 O ATOM 0 H ASP A 64 -21.658 0.158 6.070 1.00 0.00 H new ATOM 0 HA ASP A 64 -23.402 1.179 3.976 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -22.925 2.198 6.763 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -24.254 2.570 5.682 1.00 0.00 H new ATOM 939 N PHE A 65 -22.168 3.575 3.838 1.00 0.00 N ATOM 940 CA PHE A 65 -21.292 4.577 3.315 1.00 0.00 C ATOM 941 C PHE A 65 -20.400 5.276 4.281 1.00 0.00 C ATOM 942 O PHE A 65 -19.203 5.369 4.011 1.00 0.00 O ATOM 943 CB PHE A 65 -22.163 5.576 2.535 1.00 0.00 C ATOM 944 CG PHE A 65 -21.446 6.643 1.782 1.00 0.00 C ATOM 945 CD1 PHE A 65 -20.280 6.408 1.091 1.00 0.00 C ATOM 946 CD2 PHE A 65 -21.994 7.901 1.694 1.00 0.00 C ATOM 947 CE1 PHE A 65 -19.621 7.401 0.406 1.00 0.00 C ATOM 948 CE2 PHE A 65 -21.343 8.918 1.037 1.00 0.00 C ATOM 949 CZ PHE A 65 -20.190 8.651 0.337 1.00 0.00 C ATOM 0 H PHE A 65 -23.156 3.785 3.697 1.00 0.00 H new ATOM 0 HA PHE A 65 -20.571 4.057 2.684 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -22.776 5.015 1.830 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -22.844 6.055 3.238 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -19.868 5.410 1.087 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -22.954 8.094 2.150 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -18.672 7.203 -0.070 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -21.736 9.923 1.071 1.00 0.00 H new ATOM 0 HZ PHE A 65 -19.732 9.421 -0.266 1.00 0.00 H new ATOM 959 N PRO A 66 -20.689 5.680 5.483 1.00 0.00 N ATOM 960 CA PRO A 66 -19.738 6.307 6.354 1.00 0.00 C ATOM 961 C PRO A 66 -18.703 5.365 6.865 1.00 0.00 C ATOM 962 O PRO A 66 -17.638 5.830 7.267 1.00 0.00 O ATOM 963 CB PRO A 66 -20.567 6.963 7.456 1.00 0.00 C ATOM 964 CG PRO A 66 -21.775 6.024 7.598 1.00 0.00 C ATOM 965 CD PRO A 66 -21.993 5.635 6.127 1.00 0.00 C ATOM 0 HA PRO A 66 -19.144 7.051 5.823 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -20.007 7.041 8.388 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -20.873 7.973 7.182 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -21.559 5.161 8.228 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -22.642 6.525 8.029 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.428 4.638 6.051 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -22.687 6.323 5.644 1.00 0.00 H new ATOM 973 N GLU A 67 -18.819 4.027 6.794 1.00 0.00 N ATOM 974 CA GLU A 67 -17.774 3.074 7.002 1.00 0.00 C ATOM 975 C GLU A 67 -16.942 2.816 5.794 1.00 0.00 C ATOM 976 O GLU A 67 -15.786 2.404 5.888 1.00 0.00 O ATOM 977 CB GLU A 67 -18.455 1.729 7.305 1.00 0.00 C ATOM 978 CG GLU A 67 -19.572 1.810 8.348 1.00 0.00 C ATOM 979 CD GLU A 67 -20.334 0.500 8.486 1.00 0.00 C ATOM 980 OE1 GLU A 67 -20.797 -0.173 7.527 1.00 0.00 O ATOM 981 OE2 GLU A 67 -20.697 0.234 9.663 1.00 0.00 O ATOM 0 H GLU A 67 -19.709 3.580 6.575 1.00 0.00 H new ATOM 0 HA GLU A 67 -17.135 3.470 7.791 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -18.867 1.327 6.379 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -17.700 1.023 7.652 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -19.145 2.082 9.313 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -20.266 2.604 8.072 1.00 0.00 H new ATOM 988 N PHE A 68 -17.444 3.110 4.581 1.00 0.00 N ATOM 989 CA PHE A 68 -16.731 3.105 3.341 1.00 0.00 C ATOM 990 C PHE A 68 -15.824 4.287 3.314 1.00 0.00 C ATOM 991 O PHE A 68 -14.750 4.339 2.718 1.00 0.00 O ATOM 992 CB PHE A 68 -17.568 3.074 2.051 1.00 0.00 C ATOM 993 CG PHE A 68 -16.866 2.585 0.831 1.00 0.00 C ATOM 994 CD1 PHE A 68 -16.336 1.323 0.708 1.00 0.00 C ATOM 995 CD2 PHE A 68 -16.660 3.484 -0.189 1.00 0.00 C ATOM 996 CE1 PHE A 68 -15.809 0.890 -0.486 1.00 0.00 C ATOM 997 CE2 PHE A 68 -16.135 3.081 -1.395 1.00 0.00 C ATOM 998 CZ PHE A 68 -15.683 1.789 -1.519 1.00 0.00 C ATOM 0 H PHE A 68 -18.423 3.371 4.459 1.00 0.00 H new ATOM 0 HA PHE A 68 -16.199 2.154 3.329 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -18.440 2.443 2.222 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -17.936 4.081 1.856 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -16.333 0.662 1.562 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -16.914 4.523 -0.041 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -15.500 -0.137 -0.610 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -16.079 3.766 -2.228 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.221 1.474 -2.443 1.00 0.00 H new ATOM 1008 N LEU A 69 -16.291 5.431 3.846 1.00 0.00 N ATOM 1009 CA LEU A 69 -15.613 6.687 3.925 1.00 0.00 C ATOM 1010 C LEU A 69 -14.546 6.553 4.956 1.00 0.00 C ATOM 1011 O LEU A 69 -13.424 7.011 4.750 1.00 0.00 O ATOM 1012 CB LEU A 69 -16.510 7.860 4.356 1.00 0.00 C ATOM 1013 CG LEU A 69 -17.533 8.305 3.297 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -18.384 9.451 3.870 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -16.865 8.625 1.949 1.00 0.00 C ATOM 0 H LEU A 69 -17.224 5.479 4.256 1.00 0.00 H new ATOM 0 HA LEU A 69 -15.241 6.912 2.925 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -17.045 7.578 5.263 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -15.877 8.710 4.611 1.00 0.00 H new ATOM 0 HG LEU A 69 -18.210 7.482 3.068 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -19.112 9.772 3.125 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -18.907 9.105 4.762 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -17.738 10.289 4.130 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -17.624 8.935 1.231 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -16.142 9.430 2.083 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -16.354 7.737 1.576 1.00 0.00 H new ATOM 1027 N THR A 70 -14.809 5.903 6.104 1.00 0.00 N ATOM 1028 CA THR A 70 -13.929 5.517 7.163 1.00 0.00 C ATOM 1029 C THR A 70 -12.853 4.625 6.646 1.00 0.00 C ATOM 1030 O THR A 70 -11.677 4.723 6.992 1.00 0.00 O ATOM 1031 CB THR A 70 -14.587 4.847 8.333 1.00 0.00 C ATOM 1032 OG1 THR A 70 -15.300 5.848 9.044 1.00 0.00 O ATOM 1033 CG2 THR A 70 -13.592 4.222 9.325 1.00 0.00 C ATOM 0 H THR A 70 -15.765 5.613 6.312 1.00 0.00 H new ATOM 0 HA THR A 70 -13.526 6.458 7.537 1.00 0.00 H new ATOM 0 HB THR A 70 -15.214 4.047 7.940 1.00 0.00 H new ATOM 0 HG1 THR A 70 -16.166 6.002 8.612 1.00 0.00 H new ATOM 0 HG21 THR A 70 -14.139 3.756 10.144 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.993 3.468 8.814 1.00 0.00 H new ATOM 0 HG23 THR A 70 -12.937 4.998 9.721 1.00 0.00 H new ATOM 1041 N MET A 71 -13.115 3.741 5.667 1.00 0.00 N ATOM 1042 CA MET A 71 -12.196 2.920 4.942 1.00 0.00 C ATOM 1043 C MET A 71 -11.399 3.812 4.053 1.00 0.00 C ATOM 1044 O MET A 71 -10.172 3.868 4.122 1.00 0.00 O ATOM 1045 CB MET A 71 -12.981 1.854 4.159 1.00 0.00 C ATOM 1046 CG MET A 71 -12.162 0.930 3.255 1.00 0.00 C ATOM 1047 SD MET A 71 -13.301 -0.155 2.343 1.00 0.00 S ATOM 1048 CE MET A 71 -13.498 -1.562 3.473 1.00 0.00 C ATOM 0 H MET A 71 -14.073 3.588 5.352 1.00 0.00 H new ATOM 0 HA MET A 71 -11.512 2.389 5.604 1.00 0.00 H new ATOM 0 HB2 MET A 71 -13.525 1.237 4.874 1.00 0.00 H new ATOM 0 HB3 MET A 71 -13.725 2.361 3.544 1.00 0.00 H new ATOM 0 HG2 MET A 71 -11.562 1.517 2.560 1.00 0.00 H new ATOM 0 HG3 MET A 71 -11.470 0.335 3.851 1.00 0.00 H new ATOM 0 HE1 MET A 71 -13.580 -2.483 2.896 1.00 0.00 H new ATOM 0 HE2 MET A 71 -12.632 -1.623 4.133 1.00 0.00 H new ATOM 0 HE3 MET A 71 -14.400 -1.426 4.070 1.00 0.00 H new ATOM 1058 N MET A 72 -12.074 4.584 3.182 1.00 0.00 N ATOM 1059 CA MET A 72 -11.439 5.381 2.179 1.00 0.00 C ATOM 1060 C MET A 72 -10.388 6.329 2.645 1.00 0.00 C ATOM 1061 O MET A 72 -9.316 6.381 2.044 1.00 0.00 O ATOM 1062 CB MET A 72 -12.460 5.982 1.199 1.00 0.00 C ATOM 1063 CG MET A 72 -12.979 4.990 0.156 1.00 0.00 C ATOM 1064 SD MET A 72 -11.664 4.619 -1.043 1.00 0.00 S ATOM 1065 CE MET A 72 -12.543 3.188 -1.734 1.00 0.00 C ATOM 0 H MET A 72 -13.091 4.656 3.176 1.00 0.00 H new ATOM 0 HA MET A 72 -10.833 4.674 1.612 1.00 0.00 H new ATOM 0 HB2 MET A 72 -13.305 6.374 1.765 1.00 0.00 H new ATOM 0 HB3 MET A 72 -12.002 6.827 0.685 1.00 0.00 H new ATOM 0 HG2 MET A 72 -13.309 4.073 0.644 1.00 0.00 H new ATOM 0 HG3 MET A 72 -13.846 5.407 -0.357 1.00 0.00 H new ATOM 0 HE1 MET A 72 -11.866 2.617 -2.370 1.00 0.00 H new ATOM 0 HE2 MET A 72 -12.900 2.554 -0.923 1.00 0.00 H new ATOM 0 HE3 MET A 72 -13.391 3.533 -2.325 1.00 0.00 H new ATOM 1075 N ALA A 73 -10.661 7.016 3.769 1.00 0.00 N ATOM 1076 CA ALA A 73 -9.771 7.885 4.474 1.00 0.00 C ATOM 1077 C ALA A 73 -8.495 7.287 4.960 1.00 0.00 C ATOM 1078 O ALA A 73 -7.498 7.991 5.113 1.00 0.00 O ATOM 1079 CB ALA A 73 -10.624 8.621 5.521 1.00 0.00 C ATOM 0 H ALA A 73 -11.575 6.958 4.218 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.336 8.603 3.779 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.992 9.302 6.092 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -11.407 9.188 5.018 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -11.078 7.895 6.196 1.00 0.00 H new ATOM 1234 N GLU A 83 3.657 5.509 2.147 1.00 0.00 N ATOM 1235 CA GLU A 83 3.586 4.997 3.480 1.00 0.00 C ATOM 1236 C GLU A 83 2.747 3.770 3.594 1.00 0.00 C ATOM 1237 O GLU A 83 3.088 2.810 4.284 1.00 0.00 O ATOM 1238 CB GLU A 83 2.930 6.059 4.379 1.00 0.00 C ATOM 1239 CG GLU A 83 2.811 5.594 5.831 1.00 0.00 C ATOM 1240 CD GLU A 83 2.393 6.713 6.775 1.00 0.00 C ATOM 1241 OE1 GLU A 83 1.321 7.322 6.516 1.00 0.00 O ATOM 1242 OE2 GLU A 83 3.108 7.010 7.769 1.00 0.00 O ATOM 0 HA GLU A 83 4.606 4.752 3.775 1.00 0.00 H new ATOM 0 HB2 GLU A 83 3.516 6.977 4.340 1.00 0.00 H new ATOM 0 HB3 GLU A 83 1.939 6.297 3.993 1.00 0.00 H new ATOM 0 HG2 GLU A 83 2.084 4.784 5.890 1.00 0.00 H new ATOM 0 HG3 GLU A 83 3.768 5.188 6.157 1.00 0.00 H new ATOM 1249 N GLU A 84 1.631 3.668 2.851 1.00 0.00 N ATOM 1250 CA GLU A 84 0.911 2.463 2.581 1.00 0.00 C ATOM 1251 C GLU A 84 1.684 1.276 2.119 1.00 0.00 C ATOM 1252 O GLU A 84 1.707 0.203 2.721 1.00 0.00 O ATOM 1253 CB GLU A 84 -0.183 2.727 1.533 1.00 0.00 C ATOM 1254 CG GLU A 84 -1.220 1.601 1.547 1.00 0.00 C ATOM 1255 CD GLU A 84 -2.320 1.811 0.517 1.00 0.00 C ATOM 1256 OE1 GLU A 84 -2.013 1.809 -0.705 1.00 0.00 O ATOM 1257 OE2 GLU A 84 -3.512 2.048 0.849 1.00 0.00 O ATOM 0 H GLU A 84 1.204 4.482 2.410 1.00 0.00 H new ATOM 0 HA GLU A 84 0.529 2.195 3.566 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -0.670 3.680 1.739 1.00 0.00 H new ATOM 0 HB3 GLU A 84 0.265 2.805 0.542 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -0.723 0.651 1.354 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -1.664 1.533 2.540 1.00 0.00 H new ATOM 1264 N ILE A 85 2.380 1.356 0.971 1.00 0.00 N ATOM 1265 CA ILE A 85 3.207 0.284 0.513 1.00 0.00 C ATOM 1266 C ILE A 85 4.392 0.033 1.381 1.00 0.00 C ATOM 1267 O ILE A 85 4.818 -1.113 1.516 1.00 0.00 O ATOM 1268 CB ILE A 85 3.405 0.211 -0.972 1.00 0.00 C ATOM 1269 CG1 ILE A 85 4.429 1.250 -1.457 1.00 0.00 C ATOM 1270 CG2 ILE A 85 2.056 0.276 -1.708 1.00 0.00 C ATOM 1271 CD1 ILE A 85 4.361 1.501 -2.963 1.00 0.00 C ATOM 0 H ILE A 85 2.369 2.170 0.356 1.00 0.00 H new ATOM 0 HA ILE A 85 2.616 -0.620 0.661 1.00 0.00 H new ATOM 0 HB ILE A 85 3.838 -0.758 -1.220 1.00 0.00 H new ATOM 0 HG12 ILE A 85 4.262 2.189 -0.930 1.00 0.00 H new ATOM 0 HG13 ILE A 85 5.432 0.912 -1.196 1.00 0.00 H new ATOM 0 HG21 ILE A 85 2.225 0.221 -2.783 1.00 0.00 H new ATOM 0 HG22 ILE A 85 1.431 -0.561 -1.396 1.00 0.00 H new ATOM 0 HG23 ILE A 85 1.555 1.213 -1.467 1.00 0.00 H new ATOM 0 HD11 ILE A 85 5.108 2.244 -3.242 1.00 0.00 H new ATOM 0 HD12 ILE A 85 4.557 0.571 -3.496 1.00 0.00 H new ATOM 0 HD13 ILE A 85 3.369 1.868 -3.226 1.00 0.00 H new ATOM 1283 N ARG A 86 5.009 1.014 2.063 1.00 0.00 N ATOM 1284 CA ARG A 86 6.149 0.787 2.896 1.00 0.00 C ATOM 1285 C ARG A 86 5.667 0.160 4.159 1.00 0.00 C ATOM 1286 O ARG A 86 6.390 -0.670 4.708 1.00 0.00 O ATOM 1287 CB ARG A 86 6.825 2.145 3.147 1.00 0.00 C ATOM 1288 CG ARG A 86 8.298 2.012 3.537 1.00 0.00 C ATOM 1289 CD ARG A 86 8.927 3.301 4.070 1.00 0.00 C ATOM 1290 NE ARG A 86 10.292 2.933 4.542 1.00 0.00 N ATOM 1291 CZ ARG A 86 11.205 3.857 4.961 1.00 0.00 C ATOM 1292 NH1 ARG A 86 11.056 5.212 4.892 1.00 0.00 N ATOM 1293 NH2 ARG A 86 12.388 3.428 5.490 1.00 0.00 N ATOM 0 H ARG A 86 4.709 1.988 2.035 1.00 0.00 H new ATOM 0 HA ARG A 86 6.879 0.121 2.437 1.00 0.00 H new ATOM 0 HB2 ARG A 86 6.746 2.756 2.248 1.00 0.00 H new ATOM 0 HB3 ARG A 86 6.291 2.671 3.938 1.00 0.00 H new ATOM 0 HG2 ARG A 86 8.392 1.235 4.296 1.00 0.00 H new ATOM 0 HG3 ARG A 86 8.863 1.678 2.667 1.00 0.00 H new ATOM 0 HD2 ARG A 86 8.976 4.061 3.291 1.00 0.00 H new ATOM 0 HD3 ARG A 86 8.333 3.717 4.884 1.00 0.00 H new ATOM 0 HE ARG A 86 10.555 1.948 4.552 1.00 0.00 H new ATOM 0 HH11 ARG A 86 10.203 5.612 4.500 1.00 0.00 H new ATOM 0 HH12 ARG A 86 11.797 5.825 5.232 1.00 0.00 H new ATOM 0 HH21 ARG A 86 12.580 2.429 5.568 1.00 0.00 H new ATOM 0 HH22 ARG A 86 13.080 4.106 5.808 1.00 0.00 H new ATOM 1307 N GLU A 87 4.462 0.473 4.668 1.00 0.00 N ATOM 1308 CA GLU A 87 3.866 -0.259 5.742 1.00 0.00 C ATOM 1309 C GLU A 87 3.421 -1.633 5.371 1.00 0.00 C ATOM 1310 O GLU A 87 3.782 -2.593 6.050 1.00 0.00 O ATOM 1311 CB GLU A 87 2.749 0.438 6.537 1.00 0.00 C ATOM 1312 CG GLU A 87 1.961 -0.364 7.575 1.00 0.00 C ATOM 1313 CD GLU A 87 2.696 -0.290 8.905 1.00 0.00 C ATOM 1314 OE1 GLU A 87 3.863 -0.735 9.074 1.00 0.00 O ATOM 1315 OE2 GLU A 87 2.056 0.316 9.805 1.00 0.00 O ATOM 0 H GLU A 87 3.892 1.247 4.328 1.00 0.00 H new ATOM 0 HA GLU A 87 4.718 -0.320 6.419 1.00 0.00 H new ATOM 0 HB2 GLU A 87 3.194 1.291 7.050 1.00 0.00 H new ATOM 0 HB3 GLU A 87 2.034 0.836 5.818 1.00 0.00 H new ATOM 0 HG2 GLU A 87 0.953 0.037 7.677 1.00 0.00 H new ATOM 0 HG3 GLU A 87 1.861 -1.401 7.255 1.00 0.00 H new ATOM 1322 N ALA A 88 2.880 -1.889 4.167 1.00 0.00 N ATOM 1323 CA ALA A 88 2.558 -3.196 3.683 1.00 0.00 C ATOM 1324 C ALA A 88 3.696 -4.079 3.302 1.00 0.00 C ATOM 1325 O ALA A 88 3.598 -5.259 3.634 1.00 0.00 O ATOM 1326 CB ALA A 88 1.529 -3.017 2.554 1.00 0.00 C ATOM 0 H ALA A 88 2.657 -1.151 3.500 1.00 0.00 H new ATOM 0 HA ALA A 88 2.147 -3.759 4.521 1.00 0.00 H new ATOM 0 HB1 ALA A 88 1.254 -3.993 2.154 1.00 0.00 H new ATOM 0 HB2 ALA A 88 0.641 -2.522 2.947 1.00 0.00 H new ATOM 0 HB3 ALA A 88 1.962 -2.409 1.760 1.00 0.00 H new ATOM 1332 N PHE A 89 4.782 -3.521 2.738 1.00 0.00 N ATOM 1333 CA PHE A 89 6.081 -4.104 2.866 1.00 0.00 C ATOM 1334 C PHE A 89 6.551 -4.762 4.118 1.00 0.00 C ATOM 1335 O PHE A 89 6.916 -5.932 4.214 1.00 0.00 O ATOM 1336 CB PHE A 89 7.114 -3.131 2.274 1.00 0.00 C ATOM 1337 CG PHE A 89 8.441 -3.786 2.101 1.00 0.00 C ATOM 1338 CD1 PHE A 89 8.594 -4.687 1.074 1.00 0.00 C ATOM 1339 CD2 PHE A 89 9.521 -3.406 2.862 1.00 0.00 C ATOM 1340 CE1 PHE A 89 9.828 -5.242 0.827 1.00 0.00 C ATOM 1341 CE2 PHE A 89 10.756 -3.952 2.603 1.00 0.00 C ATOM 1342 CZ PHE A 89 10.913 -4.857 1.580 1.00 0.00 C ATOM 0 H PHE A 89 4.759 -2.661 2.190 1.00 0.00 H new ATOM 0 HA PHE A 89 5.960 -5.029 2.302 1.00 0.00 H new ATOM 0 HB2 PHE A 89 6.760 -2.763 1.311 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.217 -2.265 2.928 1.00 0.00 H new ATOM 0 HD1 PHE A 89 7.747 -4.959 0.462 1.00 0.00 H new ATOM 0 HD2 PHE A 89 9.400 -2.685 3.657 1.00 0.00 H new ATOM 0 HE1 PHE A 89 9.945 -5.977 0.045 1.00 0.00 H new ATOM 0 HE2 PHE A 89 11.606 -3.669 3.206 1.00 0.00 H new ATOM 0 HZ PHE A 89 11.890 -5.266 1.367 1.00 0.00 H new ATOM 1352 N ARG A 90 6.495 -4.003 5.227 1.00 0.00 N ATOM 1353 CA ARG A 90 6.862 -4.434 6.540 1.00 0.00 C ATOM 1354 C ARG A 90 5.848 -5.334 7.157 1.00 0.00 C ATOM 1355 O ARG A 90 6.324 -6.155 7.940 1.00 0.00 O ATOM 1356 CB ARG A 90 7.102 -3.146 7.346 1.00 0.00 C ATOM 1357 CG ARG A 90 7.797 -3.181 8.708 1.00 0.00 C ATOM 1358 CD ARG A 90 7.647 -1.912 9.549 1.00 0.00 C ATOM 1359 NE ARG A 90 6.226 -1.904 9.994 1.00 0.00 N ATOM 1360 CZ ARG A 90 5.782 -2.162 11.259 1.00 0.00 C ATOM 1361 NH1 ARG A 90 6.606 -2.560 12.273 1.00 0.00 N ATOM 1362 NH2 ARG A 90 4.455 -1.987 11.527 1.00 0.00 N ATOM 0 H ARG A 90 6.176 -3.035 5.205 1.00 0.00 H new ATOM 0 HA ARG A 90 7.761 -5.049 6.517 1.00 0.00 H new ATOM 0 HB2 ARG A 90 7.681 -2.476 6.710 1.00 0.00 H new ATOM 0 HB3 ARG A 90 6.129 -2.679 7.497 1.00 0.00 H new ATOM 0 HG2 ARG A 90 7.404 -4.023 9.277 1.00 0.00 H new ATOM 0 HG3 ARG A 90 8.859 -3.370 8.551 1.00 0.00 H new ATOM 0 HD2 ARG A 90 8.326 -1.922 10.401 1.00 0.00 H new ATOM 0 HD3 ARG A 90 7.882 -1.022 8.965 1.00 0.00 H new ATOM 0 HE ARG A 90 5.521 -1.686 9.290 1.00 0.00 H new ATOM 0 HH11 ARG A 90 7.605 -2.677 12.102 1.00 0.00 H new ATOM 0 HH12 ARG A 90 6.223 -2.740 13.201 1.00 0.00 H new ATOM 0 HH21 ARG A 90 3.823 -1.671 10.791 1.00 0.00 H new ATOM 0 HH22 ARG A 90 4.095 -2.172 12.463 1.00 0.00 H new ATOM 1376 N VAL A 91 4.593 -5.341 6.674 1.00 0.00 N ATOM 1377 CA VAL A 91 3.627 -6.317 7.074 1.00 0.00 C ATOM 1378 C VAL A 91 3.794 -7.676 6.486 1.00 0.00 C ATOM 1379 O VAL A 91 3.690 -8.713 7.139 1.00 0.00 O ATOM 1380 CB VAL A 91 2.220 -5.874 6.806 1.00 0.00 C ATOM 1381 CG1 VAL A 91 1.079 -6.900 6.915 1.00 0.00 C ATOM 1382 CG2 VAL A 91 1.909 -4.788 7.851 1.00 0.00 C ATOM 0 H VAL A 91 4.244 -4.662 5.998 1.00 0.00 H new ATOM 0 HA VAL A 91 3.816 -6.400 8.144 1.00 0.00 H new ATOM 0 HB VAL A 91 2.226 -5.584 5.755 1.00 0.00 H new ATOM 0 HG11 VAL A 91 0.130 -6.414 6.690 1.00 0.00 H new ATOM 0 HG12 VAL A 91 1.249 -7.710 6.206 1.00 0.00 H new ATOM 0 HG13 VAL A 91 1.049 -7.304 7.927 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.892 -4.424 7.706 1.00 0.00 H new ATOM 0 HG22 VAL A 91 2.005 -5.208 8.852 1.00 0.00 H new ATOM 0 HG23 VAL A 91 2.610 -3.961 7.736 1.00 0.00 H new ATOM 1392 N PHE A 92 4.140 -7.700 5.186 1.00 0.00 N ATOM 1393 CA PHE A 92 4.562 -8.890 4.515 1.00 0.00 C ATOM 1394 C PHE A 92 5.803 -9.476 5.094 1.00 0.00 C ATOM 1395 O PHE A 92 6.078 -10.675 5.120 1.00 0.00 O ATOM 1396 CB PHE A 92 4.630 -8.579 3.010 1.00 0.00 C ATOM 1397 CG PHE A 92 3.327 -8.314 2.338 1.00 0.00 C ATOM 1398 CD1 PHE A 92 2.102 -8.676 2.846 1.00 0.00 C ATOM 1399 CD2 PHE A 92 3.363 -7.886 1.031 1.00 0.00 C ATOM 1400 CE1 PHE A 92 0.955 -8.565 2.095 1.00 0.00 C ATOM 1401 CE2 PHE A 92 2.249 -7.832 0.228 1.00 0.00 C ATOM 1402 CZ PHE A 92 1.030 -8.119 0.797 1.00 0.00 C ATOM 0 H PHE A 92 4.126 -6.874 4.588 1.00 0.00 H new ATOM 0 HA PHE A 92 3.836 -9.689 4.665 1.00 0.00 H new ATOM 0 HB2 PHE A 92 5.273 -7.710 2.867 1.00 0.00 H new ATOM 0 HB3 PHE A 92 5.111 -9.418 2.507 1.00 0.00 H new ATOM 0 HD1 PHE A 92 2.039 -9.055 3.855 1.00 0.00 H new ATOM 0 HD2 PHE A 92 4.311 -7.578 0.616 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -0.001 -8.827 2.524 1.00 0.00 H new ATOM 0 HE2 PHE A 92 2.328 -7.572 -0.817 1.00 0.00 H new ATOM 0 HZ PHE A 92 0.126 -7.993 0.220 1.00 0.00 H new ATOM 1412 N ASP A 93 6.783 -8.643 5.488 1.00 0.00 N ATOM 1413 CA ASP A 93 8.006 -9.038 6.115 1.00 0.00 C ATOM 1414 C ASP A 93 7.783 -9.352 7.554 1.00 0.00 C ATOM 1415 O ASP A 93 7.803 -8.489 8.429 1.00 0.00 O ATOM 1416 CB ASP A 93 9.114 -8.008 5.836 1.00 0.00 C ATOM 1417 CG ASP A 93 10.455 -8.488 6.373 1.00 0.00 C ATOM 1418 OD1 ASP A 93 10.760 -9.708 6.293 1.00 0.00 O ATOM 1419 OD2 ASP A 93 11.174 -7.649 6.979 1.00 0.00 O ATOM 0 H ASP A 93 6.717 -7.633 5.361 1.00 0.00 H new ATOM 0 HA ASP A 93 8.366 -9.969 5.677 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.190 -7.833 4.763 1.00 0.00 H new ATOM 0 HB3 ASP A 93 8.854 -7.055 6.297 1.00 0.00 H new ATOM 1424 N LYS A 94 7.452 -10.625 7.836 1.00 0.00 N ATOM 1425 CA LYS A 94 6.927 -11.087 9.083 1.00 0.00 C ATOM 1426 C LYS A 94 7.996 -11.194 10.116 1.00 0.00 C ATOM 1427 O LYS A 94 7.846 -10.702 11.233 1.00 0.00 O ATOM 1428 CB LYS A 94 6.158 -12.380 8.764 1.00 0.00 C ATOM 1429 CG LYS A 94 5.313 -12.828 9.958 1.00 0.00 C ATOM 1430 CD LYS A 94 4.144 -11.932 10.375 1.00 0.00 C ATOM 1431 CE LYS A 94 3.008 -12.715 11.036 1.00 0.00 C ATOM 1432 NZ LYS A 94 1.754 -11.929 11.043 1.00 0.00 N ATOM 0 H LYS A 94 7.557 -11.375 7.153 1.00 0.00 H new ATOM 0 HA LYS A 94 6.231 -10.385 9.543 1.00 0.00 H new ATOM 0 HB2 LYS A 94 5.514 -12.220 7.899 1.00 0.00 H new ATOM 0 HB3 LYS A 94 6.861 -13.168 8.496 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.915 -13.818 9.735 1.00 0.00 H new ATOM 0 HG3 LYS A 94 5.976 -12.937 10.817 1.00 0.00 H new ATOM 0 HD2 LYS A 94 4.504 -11.169 11.065 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.759 -11.412 9.498 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.850 -13.653 10.503 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.286 -12.972 12.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.000 -12.483 11.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 1.901 -11.046 11.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 1.479 -11.705 10.065 1.00 0.00 H new ATOM 1446 N ASP A 95 9.117 -11.796 9.679 1.00 0.00 N ATOM 1447 CA ASP A 95 10.321 -12.005 10.421 1.00 0.00 C ATOM 1448 C ASP A 95 11.006 -10.746 10.825 1.00 0.00 C ATOM 1449 O ASP A 95 11.614 -10.582 11.882 1.00 0.00 O ATOM 1450 CB ASP A 95 11.213 -13.012 9.674 1.00 0.00 C ATOM 1451 CG ASP A 95 11.580 -12.483 8.294 1.00 0.00 C ATOM 1452 OD1 ASP A 95 10.693 -12.484 7.400 1.00 0.00 O ATOM 1453 OD2 ASP A 95 12.775 -12.241 7.975 1.00 0.00 O ATOM 0 H ASP A 95 9.185 -12.165 8.731 1.00 0.00 H new ATOM 0 HA ASP A 95 10.062 -12.447 11.383 1.00 0.00 H new ATOM 0 HB2 ASP A 95 12.119 -13.200 10.250 1.00 0.00 H new ATOM 0 HB3 ASP A 95 10.693 -13.965 9.577 1.00 0.00 H new ATOM 1458 N GLY A 96 10.939 -9.753 9.920 1.00 0.00 N ATOM 1459 CA GLY A 96 11.329 -8.412 10.227 1.00 0.00 C ATOM 1460 C GLY A 96 12.741 -8.023 9.957 1.00 0.00 C ATOM 1461 O GLY A 96 13.353 -7.324 10.763 1.00 0.00 O ATOM 0 H GLY A 96 10.610 -9.882 8.963 1.00 0.00 H new ATOM 0 HA2 GLY A 96 10.682 -7.738 9.666 1.00 0.00 H new ATOM 0 HA3 GLY A 96 11.130 -8.238 11.284 1.00 0.00 H new ATOM 1465 N ASN A 97 13.312 -8.331 8.778 1.00 0.00 N ATOM 1466 CA ASN A 97 14.692 -8.136 8.460 1.00 0.00 C ATOM 1467 C ASN A 97 14.896 -7.028 7.484 1.00 0.00 C ATOM 1468 O ASN A 97 15.900 -6.319 7.447 1.00 0.00 O ATOM 1469 CB ASN A 97 15.468 -9.387 8.016 1.00 0.00 C ATOM 1470 CG ASN A 97 15.124 -9.963 6.650 1.00 0.00 C ATOM 1471 OD1 ASN A 97 13.955 -9.915 6.269 1.00 0.00 O ATOM 1472 ND2 ASN A 97 16.224 -10.372 5.961 1.00 0.00 N ATOM 0 H ASN A 97 12.782 -8.737 8.007 1.00 0.00 H new ATOM 0 HA ASN A 97 15.124 -7.860 9.422 1.00 0.00 H new ATOM 0 HB2 ASN A 97 16.531 -9.147 8.025 1.00 0.00 H new ATOM 0 HB3 ASN A 97 15.311 -10.166 8.762 1.00 0.00 H new ATOM 0 HD21 ASN A 97 16.132 -10.693 4.997 1.00 0.00 H new ATOM 0 HD22 ASN A 97 17.140 -10.358 6.409 1.00 0.00 H new ATOM 1479 N GLY A 98 13.839 -6.738 6.704 1.00 0.00 N ATOM 1480 CA GLY A 98 13.803 -5.642 5.787 1.00 0.00 C ATOM 1481 C GLY A 98 13.671 -6.109 4.378 1.00 0.00 C ATOM 1482 O GLY A 98 13.642 -5.285 3.466 1.00 0.00 O ATOM 0 H GLY A 98 12.979 -7.286 6.712 1.00 0.00 H new ATOM 0 HA2 GLY A 98 12.967 -4.988 6.034 1.00 0.00 H new ATOM 0 HA3 GLY A 98 14.712 -5.050 5.891 1.00 0.00 H new ATOM 1486 N TYR A 99 13.619 -7.433 4.147 1.00 0.00 N ATOM 1487 CA TYR A 99 13.580 -7.978 2.825 1.00 0.00 C ATOM 1488 C TYR A 99 12.535 -9.038 2.778 1.00 0.00 C ATOM 1489 O TYR A 99 12.114 -9.567 3.806 1.00 0.00 O ATOM 1490 CB TYR A 99 14.902 -8.658 2.431 1.00 0.00 C ATOM 1491 CG TYR A 99 16.003 -7.655 2.425 1.00 0.00 C ATOM 1492 CD1 TYR A 99 16.036 -6.775 1.369 1.00 0.00 C ATOM 1493 CD2 TYR A 99 16.711 -7.381 3.572 1.00 0.00 C ATOM 1494 CE1 TYR A 99 16.873 -5.687 1.443 1.00 0.00 C ATOM 1495 CE2 TYR A 99 17.496 -6.252 3.584 1.00 0.00 C ATOM 1496 CZ TYR A 99 17.674 -5.397 2.522 1.00 0.00 C ATOM 1497 OH TYR A 99 18.506 -4.258 2.541 1.00 0.00 O ATOM 0 H TYR A 99 13.604 -8.135 4.887 1.00 0.00 H new ATOM 0 HA TYR A 99 13.382 -7.151 2.144 1.00 0.00 H new ATOM 0 HB2 TYR A 99 15.132 -9.460 3.132 1.00 0.00 H new ATOM 0 HB3 TYR A 99 14.808 -9.114 1.445 1.00 0.00 H new ATOM 0 HD1 TYR A 99 15.417 -6.935 0.499 1.00 0.00 H new ATOM 0 HD2 TYR A 99 16.652 -8.030 4.433 1.00 0.00 H new ATOM 0 HE1 TYR A 99 16.903 -5.016 0.598 1.00 0.00 H new ATOM 0 HE2 TYR A 99 18.015 -6.018 4.502 1.00 0.00 H new ATOM 0 HH TYR A 99 18.995 -4.224 3.390 1.00 0.00 H new ATOM 1507 N ILE A 100 12.118 -9.477 1.577 1.00 0.00 N ATOM 1508 CA ILE A 100 11.192 -10.559 1.443 1.00 0.00 C ATOM 1509 C ILE A 100 11.802 -11.527 0.489 1.00 0.00 C ATOM 1510 O ILE A 100 12.120 -11.173 -0.645 1.00 0.00 O ATOM 1511 CB ILE A 100 9.831 -10.211 0.917 1.00 0.00 C ATOM 1512 CG1 ILE A 100 9.378 -8.837 1.438 1.00 0.00 C ATOM 1513 CG2 ILE A 100 8.883 -11.406 1.119 1.00 0.00 C ATOM 1514 CD1 ILE A 100 8.089 -8.358 0.771 1.00 0.00 C ATOM 0 H ILE A 100 12.426 -9.078 0.690 1.00 0.00 H new ATOM 0 HA ILE A 100 11.024 -10.939 2.451 1.00 0.00 H new ATOM 0 HB ILE A 100 9.835 -10.060 -0.162 1.00 0.00 H new ATOM 0 HG12 ILE A 100 9.228 -8.892 2.516 1.00 0.00 H new ATOM 0 HG13 ILE A 100 10.168 -8.106 1.263 1.00 0.00 H new ATOM 0 HG21 ILE A 100 7.894 -11.154 0.737 1.00 0.00 H new ATOM 0 HG22 ILE A 100 9.270 -12.272 0.582 1.00 0.00 H new ATOM 0 HG23 ILE A 100 8.813 -11.640 2.181 1.00 0.00 H new ATOM 0 HD11 ILE A 100 7.811 -7.384 1.173 1.00 0.00 H new ATOM 0 HD12 ILE A 100 8.245 -8.275 -0.305 1.00 0.00 H new ATOM 0 HD13 ILE A 100 7.290 -9.073 0.968 1.00 0.00 H new ATOM 1526 N SER A 101 11.964 -12.812 0.851 1.00 0.00 N ATOM 1527 CA SER A 101 12.389 -13.827 -0.062 1.00 0.00 C ATOM 1528 C SER A 101 11.287 -14.189 -0.998 1.00 0.00 C ATOM 1529 O SER A 101 10.118 -14.101 -0.623 1.00 0.00 O ATOM 1530 CB SER A 101 13.084 -15.020 0.616 1.00 0.00 C ATOM 1531 OG SER A 101 12.262 -15.797 1.475 1.00 0.00 O ATOM 0 H SER A 101 11.796 -13.153 1.798 1.00 0.00 H new ATOM 0 HA SER A 101 13.185 -13.407 -0.677 1.00 0.00 H new ATOM 0 HB2 SER A 101 13.488 -15.671 -0.159 1.00 0.00 H new ATOM 0 HB3 SER A 101 13.931 -14.646 1.192 1.00 0.00 H new ATOM 0 HG SER A 101 12.789 -16.530 1.857 1.00 0.00 H new ATOM 1537 N ALA A 102 11.627 -14.711 -2.190 1.00 0.00 N ATOM 1538 CA ALA A 102 10.668 -15.325 -3.054 1.00 0.00 C ATOM 1539 C ALA A 102 9.828 -16.403 -2.460 1.00 0.00 C ATOM 1540 O ALA A 102 8.607 -16.432 -2.609 1.00 0.00 O ATOM 1541 CB ALA A 102 11.271 -15.913 -4.341 1.00 0.00 C ATOM 0 H ALA A 102 12.578 -14.707 -2.558 1.00 0.00 H new ATOM 0 HA ALA A 102 10.033 -14.465 -3.266 1.00 0.00 H new ATOM 0 HB1 ALA A 102 10.480 -16.360 -4.942 1.00 0.00 H new ATOM 0 HB2 ALA A 102 11.756 -15.120 -4.911 1.00 0.00 H new ATOM 0 HB3 ALA A 102 12.006 -16.676 -4.083 1.00 0.00 H new ATOM 1547 N ALA A 103 10.382 -17.254 -1.578 1.00 0.00 N ATOM 1548 CA ALA A 103 9.691 -18.114 -0.669 1.00 0.00 C ATOM 1549 C ALA A 103 8.751 -17.482 0.299 1.00 0.00 C ATOM 1550 O ALA A 103 7.623 -17.952 0.439 1.00 0.00 O ATOM 1551 CB ALA A 103 10.770 -18.775 0.206 1.00 0.00 C ATOM 0 H ALA A 103 11.394 -17.347 -1.496 1.00 0.00 H new ATOM 0 HA ALA A 103 9.088 -18.763 -1.303 1.00 0.00 H new ATOM 0 HB1 ALA A 103 10.297 -19.446 0.923 1.00 0.00 H new ATOM 0 HB2 ALA A 103 11.453 -19.342 -0.426 1.00 0.00 H new ATOM 0 HB3 ALA A 103 11.326 -18.005 0.742 1.00 0.00 H new ATOM 1557 N GLU A 104 9.125 -16.410 1.021 1.00 0.00 N ATOM 1558 CA GLU A 104 8.194 -15.576 1.715 1.00 0.00 C ATOM 1559 C GLU A 104 7.120 -14.974 0.876 1.00 0.00 C ATOM 1560 O GLU A 104 5.959 -14.884 1.271 1.00 0.00 O ATOM 1561 CB GLU A 104 8.877 -14.429 2.479 1.00 0.00 C ATOM 1562 CG GLU A 104 9.673 -14.815 3.727 1.00 0.00 C ATOM 1563 CD GLU A 104 10.449 -13.648 4.319 1.00 0.00 C ATOM 1564 OE1 GLU A 104 9.839 -12.643 4.774 1.00 0.00 O ATOM 1565 OE2 GLU A 104 11.709 -13.658 4.349 1.00 0.00 O ATOM 0 H GLU A 104 10.096 -16.117 1.125 1.00 0.00 H new ATOM 0 HA GLU A 104 7.728 -16.282 2.402 1.00 0.00 H new ATOM 0 HB2 GLU A 104 9.549 -13.915 1.792 1.00 0.00 H new ATOM 0 HB3 GLU A 104 8.111 -13.711 2.772 1.00 0.00 H new ATOM 0 HG2 GLU A 104 8.990 -15.210 4.479 1.00 0.00 H new ATOM 0 HG3 GLU A 104 10.368 -15.616 3.475 1.00 0.00 H new ATOM 1572 N LEU A 105 7.455 -14.366 -0.276 1.00 0.00 N ATOM 1573 CA LEU A 105 6.525 -13.749 -1.169 1.00 0.00 C ATOM 1574 C LEU A 105 5.517 -14.652 -1.792 1.00 0.00 C ATOM 1575 O LEU A 105 4.353 -14.287 -1.954 1.00 0.00 O ATOM 1576 CB LEU A 105 7.267 -12.904 -2.218 1.00 0.00 C ATOM 1577 CG LEU A 105 6.435 -11.927 -3.066 1.00 0.00 C ATOM 1578 CD1 LEU A 105 7.158 -10.583 -3.259 1.00 0.00 C ATOM 1579 CD2 LEU A 105 6.070 -12.532 -4.432 1.00 0.00 C ATOM 0 H LEU A 105 8.420 -14.302 -0.600 1.00 0.00 H new ATOM 0 HA LEU A 105 5.918 -13.100 -0.537 1.00 0.00 H new ATOM 0 HB2 LEU A 105 8.037 -12.330 -1.703 1.00 0.00 H new ATOM 0 HB3 LEU A 105 7.779 -13.586 -2.897 1.00 0.00 H new ATOM 0 HG LEU A 105 5.513 -11.742 -2.515 1.00 0.00 H new ATOM 0 HD11 LEU A 105 6.539 -9.920 -3.863 1.00 0.00 H new ATOM 0 HD12 LEU A 105 7.339 -10.124 -2.287 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.109 -10.751 -3.764 1.00 0.00 H new ATOM 0 HD21 LEU A 105 5.482 -11.813 -5.003 1.00 0.00 H new ATOM 0 HD22 LEU A 105 6.982 -12.772 -4.979 1.00 0.00 H new ATOM 0 HD23 LEU A 105 5.487 -13.441 -4.283 1.00 0.00 H new ATOM 1591 N ARG A 106 5.824 -15.911 -2.151 1.00 0.00 N ATOM 1592 CA ARG A 106 4.850 -16.853 -2.607 1.00 0.00 C ATOM 1593 C ARG A 106 3.946 -17.415 -1.564 1.00 0.00 C ATOM 1594 O ARG A 106 2.774 -17.643 -1.858 1.00 0.00 O ATOM 1595 CB ARG A 106 5.478 -18.029 -3.374 1.00 0.00 C ATOM 1596 CG ARG A 106 6.305 -19.027 -2.561 1.00 0.00 C ATOM 1597 CD ARG A 106 7.103 -20.010 -3.421 1.00 0.00 C ATOM 1598 NE ARG A 106 6.250 -20.665 -4.452 1.00 0.00 N ATOM 1599 CZ ARG A 106 6.626 -20.799 -5.757 1.00 0.00 C ATOM 1600 NH1 ARG A 106 7.843 -20.331 -6.160 1.00 0.00 N ATOM 1601 NH2 ARG A 106 5.872 -21.364 -6.746 1.00 0.00 N ATOM 0 H ARG A 106 6.773 -16.284 -2.124 1.00 0.00 H new ATOM 0 HA ARG A 106 4.237 -16.240 -3.267 1.00 0.00 H new ATOM 0 HB2 ARG A 106 4.676 -18.577 -3.869 1.00 0.00 H new ATOM 0 HB3 ARG A 106 6.116 -17.620 -4.158 1.00 0.00 H new ATOM 0 HG2 ARG A 106 6.994 -18.477 -1.920 1.00 0.00 H new ATOM 0 HG3 ARG A 106 5.639 -19.589 -1.906 1.00 0.00 H new ATOM 0 HD2 ARG A 106 7.923 -19.483 -3.909 1.00 0.00 H new ATOM 0 HD3 ARG A 106 7.550 -20.772 -2.782 1.00 0.00 H new ATOM 0 HE ARG A 106 5.341 -21.031 -4.169 1.00 0.00 H new ATOM 0 HH11 ARG A 106 8.466 -19.884 -5.487 1.00 0.00 H new ATOM 0 HH12 ARG A 106 8.130 -20.428 -7.134 1.00 0.00 H new ATOM 0 HH21 ARG A 106 4.944 -21.729 -6.534 1.00 0.00 H new ATOM 0 HH22 ARG A 106 6.237 -21.421 -7.697 1.00 0.00 H new ATOM 1615 N HIS A 107 4.337 -17.516 -0.281 1.00 0.00 N ATOM 1616 CA HIS A 107 3.452 -17.968 0.747 1.00 0.00 C ATOM 1617 C HIS A 107 2.561 -16.849 1.165 1.00 0.00 C ATOM 1618 O HIS A 107 1.421 -17.190 1.477 1.00 0.00 O ATOM 1619 CB HIS A 107 4.236 -18.492 1.962 1.00 0.00 C ATOM 1620 CG HIS A 107 3.459 -19.105 3.089 1.00 0.00 C ATOM 1621 ND1 HIS A 107 3.774 -19.185 4.409 1.00 0.00 N flip ATOM 1622 CD2 HIS A 107 2.355 -19.924 2.968 1.00 0.00 C flip ATOM 1623 CE1 HIS A 107 2.926 -20.033 5.093 1.00 0.00 C flip ATOM 1624 NE2 HIS A 107 2.057 -20.444 4.189 1.00 0.00 N flip ATOM 0 H HIS A 107 5.274 -17.282 0.046 1.00 0.00 H new ATOM 0 HA HIS A 107 2.853 -18.788 0.350 1.00 0.00 H new ATOM 0 HB2 HIS A 107 4.949 -19.235 1.605 1.00 0.00 H new ATOM 0 HB3 HIS A 107 4.816 -17.663 2.368 1.00 0.00 H new ATOM 0 HD2 HIS A 107 1.816 -20.120 2.053 1.00 0.00 H new ATOM 0 HE1 HIS A 107 2.965 -20.301 6.138 1.00 0.00 H new ATOM 0 HE2 HIS A 107 1.271 -21.065 4.379 1.00 0.00 H new ATOM 1632 N VAL A 108 3.074 -15.606 1.162 1.00 0.00 N ATOM 1633 CA VAL A 108 2.315 -14.441 1.495 1.00 0.00 C ATOM 1634 C VAL A 108 1.289 -14.197 0.442 1.00 0.00 C ATOM 1635 O VAL A 108 0.139 -13.916 0.774 1.00 0.00 O ATOM 1636 CB VAL A 108 3.147 -13.211 1.712 1.00 0.00 C ATOM 1637 CG1 VAL A 108 2.462 -11.839 1.607 1.00 0.00 C ATOM 1638 CG2 VAL A 108 3.936 -13.233 3.032 1.00 0.00 C ATOM 0 H VAL A 108 4.045 -15.405 0.921 1.00 0.00 H new ATOM 0 HA VAL A 108 1.837 -14.644 2.453 1.00 0.00 H new ATOM 0 HB VAL A 108 3.802 -13.290 0.844 1.00 0.00 H new ATOM 0 HG11 VAL A 108 3.194 -11.052 1.789 1.00 0.00 H new ATOM 0 HG12 VAL A 108 2.040 -11.718 0.609 1.00 0.00 H new ATOM 0 HG13 VAL A 108 1.666 -11.772 2.348 1.00 0.00 H new ATOM 0 HG21 VAL A 108 4.515 -12.314 3.125 1.00 0.00 H new ATOM 0 HG22 VAL A 108 3.242 -13.311 3.869 1.00 0.00 H new ATOM 0 HG23 VAL A 108 4.610 -14.089 3.039 1.00 0.00 H new ATOM 1648 N MET A 109 1.594 -14.354 -0.859 1.00 0.00 N ATOM 1649 CA MET A 109 0.651 -14.081 -1.898 1.00 0.00 C ATOM 1650 C MET A 109 -0.343 -15.168 -2.121 1.00 0.00 C ATOM 1651 O MET A 109 -1.397 -14.905 -2.699 1.00 0.00 O ATOM 1652 CB MET A 109 1.289 -13.642 -3.227 1.00 0.00 C ATOM 1653 CG MET A 109 1.301 -12.115 -3.325 1.00 0.00 C ATOM 1654 SD MET A 109 2.637 -11.311 -2.390 1.00 0.00 S ATOM 1655 CE MET A 109 2.393 -9.594 -2.928 1.00 0.00 C ATOM 0 H MET A 109 2.503 -14.673 -1.193 1.00 0.00 H new ATOM 0 HA MET A 109 0.101 -13.223 -1.511 1.00 0.00 H new ATOM 0 HB2 MET A 109 2.307 -14.027 -3.295 1.00 0.00 H new ATOM 0 HB3 MET A 109 0.732 -14.064 -4.064 1.00 0.00 H new ATOM 0 HG2 MET A 109 1.387 -11.831 -4.374 1.00 0.00 H new ATOM 0 HG3 MET A 109 0.344 -11.733 -2.969 1.00 0.00 H new ATOM 0 HE1 MET A 109 3.133 -8.954 -2.448 1.00 0.00 H new ATOM 0 HE2 MET A 109 2.507 -9.532 -4.010 1.00 0.00 H new ATOM 0 HE3 MET A 109 1.392 -9.264 -2.649 1.00 0.00 H new ATOM 1665 N THR A 110 -0.123 -16.341 -1.501 1.00 0.00 N ATOM 1666 CA THR A 110 -1.036 -17.436 -1.388 1.00 0.00 C ATOM 1667 C THR A 110 -1.906 -17.275 -0.189 1.00 0.00 C ATOM 1668 O THR A 110 -3.056 -17.707 -0.120 1.00 0.00 O ATOM 1669 CB THR A 110 -0.296 -18.740 -1.347 1.00 0.00 C ATOM 1670 OG1 THR A 110 0.594 -18.821 -2.451 1.00 0.00 O ATOM 1671 CG2 THR A 110 -1.326 -19.875 -1.471 1.00 0.00 C ATOM 0 H THR A 110 0.766 -16.538 -1.042 1.00 0.00 H new ATOM 0 HA THR A 110 -1.677 -17.441 -2.269 1.00 0.00 H new ATOM 0 HB THR A 110 0.268 -18.818 -0.417 1.00 0.00 H new ATOM 0 HG1 THR A 110 1.510 -18.651 -2.146 1.00 0.00 H new ATOM 0 HG21 THR A 110 -0.813 -20.836 -1.444 1.00 0.00 H new ATOM 0 HG22 THR A 110 -2.033 -19.817 -0.643 1.00 0.00 H new ATOM 0 HG23 THR A 110 -1.864 -19.777 -2.414 1.00 0.00 H new ATOM 1679 N ASN A 111 -1.415 -16.617 0.876 1.00 0.00 N ATOM 1680 CA ASN A 111 -2.139 -16.460 2.099 1.00 0.00 C ATOM 1681 C ASN A 111 -3.010 -15.253 2.017 1.00 0.00 C ATOM 1682 O ASN A 111 -4.009 -15.093 2.716 1.00 0.00 O ATOM 1683 CB ASN A 111 -1.171 -16.343 3.289 1.00 0.00 C ATOM 1684 CG ASN A 111 -0.500 -17.659 3.656 1.00 0.00 C ATOM 1685 OD1 ASN A 111 -0.867 -18.729 3.174 1.00 0.00 O ATOM 1686 ND2 ASN A 111 0.502 -17.579 4.572 1.00 0.00 N ATOM 0 H ASN A 111 -0.492 -16.183 0.887 1.00 0.00 H new ATOM 0 HA ASN A 111 -2.764 -17.340 2.254 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -0.403 -15.606 3.052 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -1.716 -15.968 4.155 1.00 0.00 H new ATOM 0 HD21 ASN A 111 0.978 -18.426 4.882 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.778 -16.672 4.948 1.00 0.00 H new ATOM 1693 N LEU A 112 -2.804 -14.428 0.975 1.00 0.00 N ATOM 1694 CA LEU A 112 -3.353 -13.110 0.911 1.00 0.00 C ATOM 1695 C LEU A 112 -4.820 -12.977 0.683 1.00 0.00 C ATOM 1696 O LEU A 112 -5.547 -12.400 1.490 1.00 0.00 O ATOM 1697 CB LEU A 112 -2.512 -12.227 -0.026 1.00 0.00 C ATOM 1698 CG LEU A 112 -2.747 -10.717 0.148 1.00 0.00 C ATOM 1699 CD1 LEU A 112 -2.142 -10.131 1.435 1.00 0.00 C ATOM 1700 CD2 LEU A 112 -2.167 -10.017 -1.093 1.00 0.00 C ATOM 0 H LEU A 112 -2.245 -14.682 0.161 1.00 0.00 H new ATOM 0 HA LEU A 112 -3.277 -12.741 1.934 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -1.457 -12.440 0.143 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -2.731 -12.501 -1.058 1.00 0.00 H new ATOM 0 HG LEU A 112 -3.819 -10.548 0.245 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -2.352 -9.062 1.482 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -2.581 -10.625 2.301 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -1.064 -10.289 1.435 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -2.315 -8.941 -1.006 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -1.101 -10.232 -1.167 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -2.673 -10.382 -1.987 1.00 0.00 H new ATOM 1712 N GLY A 113 -5.365 -13.481 -0.438 1.00 0.00 N ATOM 1713 CA GLY A 113 -6.782 -13.571 -0.611 1.00 0.00 C ATOM 1714 C GLY A 113 -7.215 -14.729 -1.441 1.00 0.00 C ATOM 1715 O GLY A 113 -8.230 -15.363 -1.152 1.00 0.00 O ATOM 0 H GLY A 113 -4.822 -13.828 -1.228 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -7.254 -13.642 0.369 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -7.141 -12.651 -1.072 1.00 0.00 H new ATOM 1719 N GLU A 114 -6.420 -15.094 -2.462 1.00 0.00 N ATOM 1720 CA GLU A 114 -6.669 -16.141 -3.404 1.00 0.00 C ATOM 1721 C GLU A 114 -5.518 -17.084 -3.468 1.00 0.00 C ATOM 1722 O GLU A 114 -4.343 -16.742 -3.338 1.00 0.00 O ATOM 1723 CB GLU A 114 -6.939 -15.510 -4.781 1.00 0.00 C ATOM 1724 CG GLU A 114 -5.876 -14.688 -5.513 1.00 0.00 C ATOM 1725 CD GLU A 114 -6.463 -14.074 -6.775 1.00 0.00 C ATOM 1726 OE1 GLU A 114 -7.055 -12.974 -6.606 1.00 0.00 O ATOM 1727 OE2 GLU A 114 -6.427 -14.660 -7.890 1.00 0.00 O ATOM 0 H GLU A 114 -5.535 -14.620 -2.642 1.00 0.00 H new ATOM 0 HA GLU A 114 -7.540 -16.716 -3.089 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -7.225 -16.322 -5.449 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -7.812 -14.867 -4.668 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -5.500 -13.902 -4.859 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -5.028 -15.323 -5.769 1.00 0.00 H new ATOM 1734 N LYS A 115 -5.800 -18.388 -3.636 1.00 0.00 N ATOM 1735 CA LYS A 115 -4.699 -19.301 -3.650 1.00 0.00 C ATOM 1736 C LYS A 115 -4.059 -19.420 -4.990 1.00 0.00 C ATOM 1737 O LYS A 115 -4.650 -20.025 -5.883 1.00 0.00 O ATOM 1738 CB LYS A 115 -5.134 -20.631 -3.012 1.00 0.00 C ATOM 1739 CG LYS A 115 -5.353 -20.490 -1.504 1.00 0.00 C ATOM 1740 CD LYS A 115 -5.776 -21.848 -0.940 1.00 0.00 C ATOM 1741 CE LYS A 115 -6.208 -21.811 0.527 1.00 0.00 C ATOM 1742 NZ LYS A 115 -6.590 -23.104 1.137 1.00 0.00 N ATOM 0 H LYS A 115 -6.728 -18.793 -3.755 1.00 0.00 H new ATOM 0 HA LYS A 115 -3.892 -18.904 -3.035 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -6.054 -20.977 -3.483 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -4.375 -21.390 -3.200 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -4.438 -20.148 -1.020 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.119 -19.742 -1.302 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -6.599 -22.237 -1.540 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -4.946 -22.547 -1.045 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -5.392 -21.386 1.112 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -7.054 -21.129 0.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -6.863 -22.953 2.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -7.393 -23.510 0.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -5.783 -23.759 1.096 1.00 0.00 H new ATOM 1756 N LEU A 116 -2.853 -18.871 -5.217 1.00 0.00 N ATOM 1757 CA LEU A 116 -2.170 -18.860 -6.473 1.00 0.00 C ATOM 1758 C LEU A 116 -1.605 -20.195 -6.815 1.00 0.00 C ATOM 1759 O LEU A 116 -1.145 -21.048 -6.057 1.00 0.00 O ATOM 1760 CB LEU A 116 -1.075 -17.781 -6.525 1.00 0.00 C ATOM 1761 CG LEU A 116 -1.626 -16.373 -6.245 1.00 0.00 C ATOM 1762 CD1 LEU A 116 -0.494 -15.393 -6.596 1.00 0.00 C ATOM 1763 CD2 LEU A 116 -2.816 -16.084 -7.175 1.00 0.00 C ATOM 0 H LEU A 116 -2.323 -18.407 -4.479 1.00 0.00 H new ATOM 0 HA LEU A 116 -2.920 -18.613 -7.225 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -0.301 -18.017 -5.795 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -0.602 -17.794 -7.507 1.00 0.00 H new ATOM 0 HG LEU A 116 -1.953 -16.281 -5.209 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -0.829 -14.371 -6.416 1.00 0.00 H new ATOM 0 HD12 LEU A 116 0.376 -15.605 -5.974 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -0.226 -15.508 -7.646 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -3.202 -15.085 -6.972 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -2.489 -16.143 -8.213 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -3.601 -16.819 -7.000 1.00 0.00 H new ATOM 1775 N THR A 117 -1.598 -20.484 -8.129 1.00 0.00 N ATOM 1776 CA THR A 117 -0.843 -21.534 -8.738 1.00 0.00 C ATOM 1777 C THR A 117 0.607 -21.191 -8.717 1.00 0.00 C ATOM 1778 O THR A 117 1.025 -20.056 -8.493 1.00 0.00 O ATOM 1779 CB THR A 117 -1.309 -22.049 -10.068 1.00 0.00 C ATOM 1780 OG1 THR A 117 -1.563 -21.004 -10.994 1.00 0.00 O ATOM 1781 CG2 THR A 117 -2.640 -22.774 -9.804 1.00 0.00 C ATOM 0 H THR A 117 -2.151 -19.955 -8.803 1.00 0.00 H new ATOM 0 HA THR A 117 -1.031 -22.406 -8.112 1.00 0.00 H new ATOM 0 HB THR A 117 -0.537 -22.689 -10.495 1.00 0.00 H new ATOM 0 HG1 THR A 117 -1.862 -21.387 -11.845 1.00 0.00 H new ATOM 0 HG21 THR A 117 -3.029 -23.172 -10.741 1.00 0.00 H new ATOM 0 HG22 THR A 117 -2.476 -23.592 -9.102 1.00 0.00 H new ATOM 0 HG23 THR A 117 -3.359 -22.072 -9.381 1.00 0.00 H new ATOM 1789 N ASP A 118 1.486 -22.209 -8.721 1.00 0.00 N ATOM 1790 CA ASP A 118 2.897 -22.052 -8.550 1.00 0.00 C ATOM 1791 C ASP A 118 3.342 -21.277 -9.743 1.00 0.00 C ATOM 1792 O ASP A 118 4.003 -20.249 -9.607 1.00 0.00 O ATOM 1793 CB ASP A 118 3.545 -23.440 -8.409 1.00 0.00 C ATOM 1794 CG ASP A 118 3.480 -23.900 -6.960 1.00 0.00 C ATOM 1795 OD1 ASP A 118 4.048 -23.263 -6.033 1.00 0.00 O ATOM 1796 OD2 ASP A 118 2.789 -24.930 -6.739 1.00 0.00 O ATOM 0 H ASP A 118 1.202 -23.180 -8.848 1.00 0.00 H new ATOM 0 HA ASP A 118 3.188 -21.515 -7.647 1.00 0.00 H new ATOM 0 HB2 ASP A 118 3.032 -24.157 -9.050 1.00 0.00 H new ATOM 0 HB3 ASP A 118 4.583 -23.401 -8.741 1.00 0.00 H new ATOM 1801 N GLU A 119 3.088 -21.708 -10.991 1.00 0.00 N ATOM 1802 CA GLU A 119 3.306 -21.090 -12.263 1.00 0.00 C ATOM 1803 C GLU A 119 3.018 -19.628 -12.304 1.00 0.00 C ATOM 1804 O GLU A 119 3.862 -18.846 -12.739 1.00 0.00 O ATOM 1805 CB GLU A 119 2.667 -21.695 -13.524 1.00 0.00 C ATOM 1806 CG GLU A 119 2.794 -23.184 -13.851 1.00 0.00 C ATOM 1807 CD GLU A 119 2.051 -24.082 -12.871 1.00 0.00 C ATOM 1808 OE1 GLU A 119 0.827 -24.317 -13.055 1.00 0.00 O ATOM 1809 OE2 GLU A 119 2.631 -24.631 -11.897 1.00 0.00 O ATOM 0 H GLU A 119 2.667 -22.628 -11.120 1.00 0.00 H new ATOM 0 HA GLU A 119 4.372 -21.308 -12.321 1.00 0.00 H new ATOM 0 HB2 GLU A 119 1.601 -21.471 -13.477 1.00 0.00 H new ATOM 0 HB3 GLU A 119 3.070 -21.148 -14.376 1.00 0.00 H new ATOM 0 HG2 GLU A 119 2.413 -23.362 -14.857 1.00 0.00 H new ATOM 0 HG3 GLU A 119 3.849 -23.459 -13.857 1.00 0.00 H new ATOM 1816 N GLU A 120 1.846 -19.221 -11.786 1.00 0.00 N ATOM 1817 CA GLU A 120 1.305 -17.919 -11.543 1.00 0.00 C ATOM 1818 C GLU A 120 2.162 -17.055 -10.683 1.00 0.00 C ATOM 1819 O GLU A 120 2.588 -15.945 -10.997 1.00 0.00 O ATOM 1820 CB GLU A 120 -0.160 -17.902 -11.075 1.00 0.00 C ATOM 1821 CG GLU A 120 -0.916 -16.574 -11.143 1.00 0.00 C ATOM 1822 CD GLU A 120 -1.119 -16.062 -12.562 1.00 0.00 C ATOM 1823 OE1 GLU A 120 -1.642 -16.792 -13.446 1.00 0.00 O ATOM 1824 OE2 GLU A 120 -0.879 -14.872 -12.899 1.00 0.00 O ATOM 0 H GLU A 120 1.172 -19.928 -11.492 1.00 0.00 H new ATOM 0 HA GLU A 120 1.304 -17.473 -12.538 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -0.710 -18.631 -11.670 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -0.185 -18.249 -10.042 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -1.889 -16.694 -10.666 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -0.370 -15.825 -10.570 1.00 0.00 H new ATOM 1831 N VAL A 121 2.468 -17.469 -9.441 1.00 0.00 N ATOM 1832 CA VAL A 121 3.306 -16.768 -8.518 1.00 0.00 C ATOM 1833 C VAL A 121 4.741 -16.633 -8.897 1.00 0.00 C ATOM 1834 O VAL A 121 5.494 -15.755 -8.479 1.00 0.00 O ATOM 1835 CB VAL A 121 3.105 -17.315 -7.136 1.00 0.00 C ATOM 1836 CG1 VAL A 121 4.105 -18.427 -6.777 1.00 0.00 C ATOM 1837 CG2 VAL A 121 3.037 -16.148 -6.136 1.00 0.00 C ATOM 0 H VAL A 121 2.109 -18.344 -9.059 1.00 0.00 H new ATOM 0 HA VAL A 121 2.976 -15.730 -8.548 1.00 0.00 H new ATOM 0 HB VAL A 121 2.147 -17.833 -7.087 1.00 0.00 H new ATOM 0 HG11 VAL A 121 3.908 -18.781 -5.765 1.00 0.00 H new ATOM 0 HG12 VAL A 121 3.997 -19.254 -7.479 1.00 0.00 H new ATOM 0 HG13 VAL A 121 5.121 -18.035 -6.832 1.00 0.00 H new ATOM 0 HG21 VAL A 121 2.891 -16.540 -5.129 1.00 0.00 H new ATOM 0 HG22 VAL A 121 3.968 -15.582 -6.174 1.00 0.00 H new ATOM 0 HG23 VAL A 121 2.204 -15.495 -6.396 1.00 0.00 H new ATOM 1847 N ASP A 122 5.200 -17.631 -9.674 1.00 0.00 N ATOM 1848 CA ASP A 122 6.554 -17.725 -10.125 1.00 0.00 C ATOM 1849 C ASP A 122 6.745 -16.786 -11.266 1.00 0.00 C ATOM 1850 O ASP A 122 7.778 -16.131 -11.398 1.00 0.00 O ATOM 1851 CB ASP A 122 6.957 -19.129 -10.606 1.00 0.00 C ATOM 1852 CG ASP A 122 7.320 -20.025 -9.430 1.00 0.00 C ATOM 1853 OD1 ASP A 122 8.244 -19.730 -8.626 1.00 0.00 O ATOM 1854 OD2 ASP A 122 6.699 -21.102 -9.223 1.00 0.00 O ATOM 0 H ASP A 122 4.610 -18.397 -9.999 1.00 0.00 H new ATOM 0 HA ASP A 122 7.180 -17.481 -9.267 1.00 0.00 H new ATOM 0 HB2 ASP A 122 6.136 -19.575 -11.167 1.00 0.00 H new ATOM 0 HB3 ASP A 122 7.805 -19.055 -11.287 1.00 0.00 H new ATOM 1859 N GLU A 123 5.699 -16.576 -12.085 1.00 0.00 N ATOM 1860 CA GLU A 123 5.652 -15.595 -13.124 1.00 0.00 C ATOM 1861 C GLU A 123 5.523 -14.203 -12.610 1.00 0.00 C ATOM 1862 O GLU A 123 6.152 -13.243 -13.052 1.00 0.00 O ATOM 1863 CB GLU A 123 4.549 -15.989 -14.121 1.00 0.00 C ATOM 1864 CG GLU A 123 4.843 -15.345 -15.477 1.00 0.00 C ATOM 1865 CD GLU A 123 5.941 -16.184 -16.114 1.00 0.00 C ATOM 1866 OE1 GLU A 123 5.746 -17.421 -16.255 1.00 0.00 O ATOM 1867 OE2 GLU A 123 7.091 -15.688 -16.252 1.00 0.00 O ATOM 0 H GLU A 123 4.839 -17.121 -12.018 1.00 0.00 H new ATOM 0 HA GLU A 123 6.607 -15.585 -13.649 1.00 0.00 H new ATOM 0 HB2 GLU A 123 4.504 -17.073 -14.222 1.00 0.00 H new ATOM 0 HB3 GLU A 123 3.576 -15.663 -13.753 1.00 0.00 H new ATOM 0 HG2 GLU A 123 3.951 -15.331 -16.103 1.00 0.00 H new ATOM 0 HG3 GLU A 123 5.164 -14.310 -15.356 1.00 0.00 H new ATOM 1874 N MET A 124 4.809 -13.965 -11.495 1.00 0.00 N ATOM 1875 CA MET A 124 5.036 -12.850 -10.629 1.00 0.00 C ATOM 1876 C MET A 124 6.424 -12.626 -10.136 1.00 0.00 C ATOM 1877 O MET A 124 7.116 -11.676 -10.496 1.00 0.00 O ATOM 1878 CB MET A 124 3.989 -12.934 -9.506 1.00 0.00 C ATOM 1879 CG MET A 124 3.914 -11.811 -8.469 1.00 0.00 C ATOM 1880 SD MET A 124 3.062 -12.271 -6.930 1.00 0.00 S ATOM 1881 CE MET A 124 1.318 -12.372 -7.427 1.00 0.00 C ATOM 0 H MET A 124 4.048 -14.569 -11.186 1.00 0.00 H new ATOM 0 HA MET A 124 4.915 -11.948 -11.229 1.00 0.00 H new ATOM 0 HB2 MET A 124 3.009 -13.012 -9.977 1.00 0.00 H new ATOM 0 HB3 MET A 124 4.159 -13.866 -8.968 1.00 0.00 H new ATOM 0 HG2 MET A 124 4.926 -11.487 -8.227 1.00 0.00 H new ATOM 0 HG3 MET A 124 3.403 -10.956 -8.912 1.00 0.00 H new ATOM 0 HE1 MET A 124 0.707 -12.628 -6.561 1.00 0.00 H new ATOM 0 HE2 MET A 124 0.997 -11.410 -7.825 1.00 0.00 H new ATOM 0 HE3 MET A 124 1.202 -13.139 -8.193 1.00 0.00 H new ATOM 1891 N ILE A 125 7.027 -13.561 -9.380 1.00 0.00 N ATOM 1892 CA ILE A 125 8.370 -13.507 -8.891 1.00 0.00 C ATOM 1893 C ILE A 125 9.341 -13.118 -9.951 1.00 0.00 C ATOM 1894 O ILE A 125 10.286 -12.355 -9.757 1.00 0.00 O ATOM 1895 CB ILE A 125 8.751 -14.816 -8.265 1.00 0.00 C ATOM 1896 CG1 ILE A 125 8.060 -15.008 -6.904 1.00 0.00 C ATOM 1897 CG2 ILE A 125 10.266 -14.925 -8.026 1.00 0.00 C ATOM 1898 CD1 ILE A 125 7.814 -16.492 -6.639 1.00 0.00 C ATOM 0 H ILE A 125 6.543 -14.411 -9.092 1.00 0.00 H new ATOM 0 HA ILE A 125 8.410 -12.729 -8.128 1.00 0.00 H new ATOM 0 HB ILE A 125 8.431 -15.583 -8.971 1.00 0.00 H new ATOM 0 HG12 ILE A 125 8.679 -14.588 -6.112 1.00 0.00 H new ATOM 0 HG13 ILE A 125 7.114 -14.467 -6.889 1.00 0.00 H new ATOM 0 HG21 ILE A 125 10.494 -15.889 -7.572 1.00 0.00 H new ATOM 0 HG22 ILE A 125 10.792 -14.839 -8.977 1.00 0.00 H new ATOM 0 HG23 ILE A 125 10.588 -14.125 -7.360 1.00 0.00 H new ATOM 0 HD11 ILE A 125 7.325 -16.613 -5.673 1.00 0.00 H new ATOM 0 HD12 ILE A 125 7.176 -16.901 -7.423 1.00 0.00 H new ATOM 0 HD13 ILE A 125 8.766 -17.023 -6.633 1.00 0.00 H new ATOM 1910 N ARG A 126 9.151 -13.698 -11.149 1.00 0.00 N ATOM 1911 CA ARG A 126 10.068 -13.446 -12.217 1.00 0.00 C ATOM 1912 C ARG A 126 10.119 -12.049 -12.733 1.00 0.00 C ATOM 1913 O ARG A 126 11.152 -11.541 -13.166 1.00 0.00 O ATOM 1914 CB ARG A 126 9.743 -14.390 -13.387 1.00 0.00 C ATOM 1915 CG ARG A 126 10.550 -15.674 -13.185 1.00 0.00 C ATOM 1916 CD ARG A 126 10.662 -16.387 -14.534 1.00 0.00 C ATOM 1917 NE ARG A 126 9.322 -16.945 -14.869 1.00 0.00 N ATOM 1918 CZ ARG A 126 8.934 -18.201 -14.502 1.00 0.00 C ATOM 1919 NH1 ARG A 126 9.658 -19.036 -13.700 1.00 0.00 N ATOM 1920 NH2 ARG A 126 7.684 -18.663 -14.799 1.00 0.00 N ATOM 0 H ARG A 126 8.381 -14.327 -11.376 1.00 0.00 H new ATOM 0 HA ARG A 126 11.052 -13.623 -11.784 1.00 0.00 H new ATOM 0 HB2 ARG A 126 8.676 -14.609 -13.417 1.00 0.00 H new ATOM 0 HB3 ARG A 126 9.999 -13.923 -14.338 1.00 0.00 H new ATOM 0 HG2 ARG A 126 11.541 -15.442 -12.794 1.00 0.00 H new ATOM 0 HG3 ARG A 126 10.062 -16.319 -12.454 1.00 0.00 H new ATOM 0 HD2 ARG A 126 10.990 -15.692 -15.307 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.405 -17.183 -14.485 1.00 0.00 H new ATOM 0 HE ARG A 126 8.668 -16.365 -15.394 1.00 0.00 H new ATOM 0 HH11 ARG A 126 10.559 -18.733 -13.330 1.00 0.00 H new ATOM 0 HH12 ARG A 126 9.298 -19.963 -13.471 1.00 0.00 H new ATOM 0 HH21 ARG A 126 7.026 -18.067 -15.302 1.00 0.00 H new ATOM 0 HH22 ARG A 126 7.408 -19.604 -14.518 1.00 0.00 H new ATOM 1934 N GLU A 127 8.976 -11.343 -12.669 1.00 0.00 N ATOM 1935 CA GLU A 127 8.835 -9.933 -12.862 1.00 0.00 C ATOM 1936 C GLU A 127 9.105 -9.011 -11.724 1.00 0.00 C ATOM 1937 O GLU A 127 9.427 -7.843 -11.936 1.00 0.00 O ATOM 1938 CB GLU A 127 7.502 -9.442 -13.452 1.00 0.00 C ATOM 1939 CG GLU A 127 6.256 -9.720 -12.610 1.00 0.00 C ATOM 1940 CD GLU A 127 4.995 -9.080 -13.173 1.00 0.00 C ATOM 1941 OE1 GLU A 127 4.652 -9.402 -14.343 1.00 0.00 O ATOM 1942 OE2 GLU A 127 4.354 -8.203 -12.535 1.00 0.00 O ATOM 0 H GLU A 127 8.083 -11.793 -12.467 1.00 0.00 H new ATOM 0 HA GLU A 127 9.652 -9.867 -13.580 1.00 0.00 H new ATOM 0 HB2 GLU A 127 7.574 -8.367 -13.616 1.00 0.00 H new ATOM 0 HB3 GLU A 127 7.367 -9.905 -14.429 1.00 0.00 H new ATOM 0 HG2 GLU A 127 6.107 -10.797 -12.538 1.00 0.00 H new ATOM 0 HG3 GLU A 127 6.421 -9.352 -11.597 1.00 0.00 H new ATOM 1949 N ALA A 128 8.944 -9.525 -10.491 1.00 0.00 N ATOM 1950 CA ALA A 128 9.224 -8.849 -9.263 1.00 0.00 C ATOM 1951 C ALA A 128 10.603 -8.798 -8.699 1.00 0.00 C ATOM 1952 O ALA A 128 11.012 -7.750 -8.201 1.00 0.00 O ATOM 1953 CB ALA A 128 8.229 -9.614 -8.374 1.00 0.00 C ATOM 0 H ALA A 128 8.596 -10.473 -10.344 1.00 0.00 H new ATOM 0 HA ALA A 128 9.129 -7.769 -9.375 1.00 0.00 H new ATOM 0 HB1 ALA A 128 8.287 -9.235 -7.354 1.00 0.00 H new ATOM 0 HB2 ALA A 128 7.218 -9.474 -8.756 1.00 0.00 H new ATOM 0 HB3 ALA A 128 8.476 -10.676 -8.381 1.00 0.00 H new ATOM 1959 N ASP A 129 11.442 -9.843 -8.803 1.00 0.00 N ATOM 1960 CA ASP A 129 12.827 -9.771 -8.455 1.00 0.00 C ATOM 1961 C ASP A 129 13.526 -9.585 -9.757 1.00 0.00 C ATOM 1962 O ASP A 129 13.503 -10.482 -10.599 1.00 0.00 O ATOM 1963 CB ASP A 129 13.387 -11.048 -7.806 1.00 0.00 C ATOM 1964 CG ASP A 129 14.900 -10.987 -7.662 1.00 0.00 C ATOM 1965 OD1 ASP A 129 15.533 -9.915 -7.470 1.00 0.00 O ATOM 1966 OD2 ASP A 129 15.575 -12.027 -7.890 1.00 0.00 O ATOM 0 H ASP A 129 11.151 -10.762 -9.137 1.00 0.00 H new ATOM 0 HA ASP A 129 12.969 -8.976 -7.723 1.00 0.00 H new ATOM 0 HB2 ASP A 129 12.933 -11.187 -6.825 1.00 0.00 H new ATOM 0 HB3 ASP A 129 13.113 -11.913 -8.409 1.00 0.00 H new ATOM 1971 N ILE A 130 14.150 -8.410 -9.956 1.00 0.00 N ATOM 1972 CA ILE A 130 14.894 -8.053 -11.124 1.00 0.00 C ATOM 1973 C ILE A 130 16.275 -8.610 -11.155 1.00 0.00 C ATOM 1974 O ILE A 130 16.820 -8.970 -12.198 1.00 0.00 O ATOM 1975 CB ILE A 130 14.903 -6.579 -11.403 1.00 0.00 C ATOM 1976 CG1 ILE A 130 13.561 -5.945 -10.997 1.00 0.00 C ATOM 1977 CG2 ILE A 130 15.183 -6.268 -12.883 1.00 0.00 C ATOM 1978 CD1 ILE A 130 12.341 -6.296 -11.847 1.00 0.00 C ATOM 0 H ILE A 130 14.134 -7.665 -9.259 1.00 0.00 H new ATOM 0 HA ILE A 130 14.345 -8.530 -11.935 1.00 0.00 H new ATOM 0 HB ILE A 130 15.711 -6.152 -10.809 1.00 0.00 H new ATOM 0 HG12 ILE A 130 13.349 -6.231 -9.967 1.00 0.00 H new ATOM 0 HG13 ILE A 130 13.681 -4.862 -11.009 1.00 0.00 H new ATOM 0 HG21 ILE A 130 15.179 -5.189 -13.035 1.00 0.00 H new ATOM 0 HG22 ILE A 130 16.157 -6.670 -13.161 1.00 0.00 H new ATOM 0 HG23 ILE A 130 14.411 -6.724 -13.503 1.00 0.00 H new ATOM 0 HD11 ILE A 130 11.463 -5.784 -11.453 1.00 0.00 H new ATOM 0 HD12 ILE A 130 12.512 -5.982 -12.877 1.00 0.00 H new ATOM 0 HD13 ILE A 130 12.175 -7.373 -11.819 1.00 0.00 H new ATOM 1990 N ASP A 131 16.903 -8.808 -9.982 1.00 0.00 N ATOM 1991 CA ASP A 131 18.316 -9.005 -9.888 1.00 0.00 C ATOM 1992 C ASP A 131 18.609 -10.400 -10.320 1.00 0.00 C ATOM 1993 O ASP A 131 19.497 -10.696 -11.118 1.00 0.00 O ATOM 1994 CB ASP A 131 18.920 -8.586 -8.537 1.00 0.00 C ATOM 1995 CG ASP A 131 18.429 -7.212 -8.105 1.00 0.00 C ATOM 1996 OD1 ASP A 131 18.700 -6.227 -8.842 1.00 0.00 O ATOM 1997 OD2 ASP A 131 17.873 -7.064 -6.984 1.00 0.00 O ATOM 0 H ASP A 131 16.421 -8.832 -9.083 1.00 0.00 H new ATOM 0 HA ASP A 131 18.832 -8.324 -10.564 1.00 0.00 H new ATOM 0 HB2 ASP A 131 18.658 -9.322 -7.777 1.00 0.00 H new ATOM 0 HB3 ASP A 131 20.007 -8.578 -8.611 1.00 0.00 H new ATOM 2002 N GLY A 132 17.877 -11.333 -9.685 1.00 0.00 N ATOM 2003 CA GLY A 132 18.126 -12.733 -9.840 1.00 0.00 C ATOM 2004 C GLY A 132 18.541 -13.355 -8.552 1.00 0.00 C ATOM 2005 O GLY A 132 18.874 -14.530 -8.404 1.00 0.00 O ATOM 0 H GLY A 132 17.104 -11.114 -9.057 1.00 0.00 H new ATOM 0 HA2 GLY A 132 17.227 -13.225 -10.211 1.00 0.00 H new ATOM 0 HA3 GLY A 132 18.905 -12.885 -10.587 1.00 0.00 H new ATOM 2009 N ASP A 133 18.509 -12.545 -7.478 1.00 0.00 N ATOM 2010 CA ASP A 133 18.964 -12.829 -6.153 1.00 0.00 C ATOM 2011 C ASP A 133 18.020 -13.649 -5.342 1.00 0.00 C ATOM 2012 O ASP A 133 18.398 -14.488 -4.526 1.00 0.00 O ATOM 2013 CB ASP A 133 19.485 -11.561 -5.456 1.00 0.00 C ATOM 2014 CG ASP A 133 18.534 -10.383 -5.296 1.00 0.00 C ATOM 2015 OD1 ASP A 133 17.301 -10.636 -5.233 1.00 0.00 O ATOM 2016 OD2 ASP A 133 18.957 -9.227 -5.027 1.00 0.00 O ATOM 0 H ASP A 133 18.127 -11.602 -7.547 1.00 0.00 H new ATOM 0 HA ASP A 133 19.823 -13.492 -6.252 1.00 0.00 H new ATOM 0 HB2 ASP A 133 19.831 -11.846 -4.463 1.00 0.00 H new ATOM 0 HB3 ASP A 133 20.357 -11.212 -6.009 1.00 0.00 H new ATOM 2021 N GLY A 134 16.710 -13.418 -5.546 1.00 0.00 N ATOM 2022 CA GLY A 134 15.704 -14.285 -5.017 1.00 0.00 C ATOM 2023 C GLY A 134 14.972 -13.598 -3.916 1.00 0.00 C ATOM 2024 O GLY A 134 14.179 -14.294 -3.284 1.00 0.00 O ATOM 0 H GLY A 134 16.347 -12.628 -6.079 1.00 0.00 H new ATOM 0 HA2 GLY A 134 15.008 -14.572 -5.805 1.00 0.00 H new ATOM 0 HA3 GLY A 134 16.161 -15.202 -4.645 1.00 0.00 H new ATOM 2028 N GLN A 135 15.245 -12.289 -3.780 1.00 0.00 N ATOM 2029 CA GLN A 135 14.538 -11.557 -2.775 1.00 0.00 C ATOM 2030 C GLN A 135 14.142 -10.247 -3.364 1.00 0.00 C ATOM 2031 O GLN A 135 14.507 -9.755 -4.431 1.00 0.00 O ATOM 2032 CB GLN A 135 15.491 -11.388 -1.579 1.00 0.00 C ATOM 2033 CG GLN A 135 16.570 -10.309 -1.468 1.00 0.00 C ATOM 2034 CD GLN A 135 17.331 -10.368 -0.151 1.00 0.00 C ATOM 2035 OE1 GLN A 135 17.164 -11.187 0.752 1.00 0.00 O ATOM 2036 NE2 GLN A 135 18.457 -9.609 -0.208 1.00 0.00 N ATOM 0 H GLN A 135 15.918 -11.759 -4.333 1.00 0.00 H new ATOM 0 HA GLN A 135 13.636 -12.065 -2.434 1.00 0.00 H new ATOM 0 HB2 GLN A 135 14.854 -11.268 -0.702 1.00 0.00 H new ATOM 0 HB3 GLN A 135 16.007 -12.342 -1.469 1.00 0.00 H new ATOM 0 HG2 GLN A 135 17.273 -10.419 -2.294 1.00 0.00 H new ATOM 0 HG3 GLN A 135 16.108 -9.327 -1.571 1.00 0.00 H new ATOM 0 HE21 GLN A 135 18.580 -8.935 -0.963 1.00 0.00 H new ATOM 0 HE22 GLN A 135 19.179 -9.714 0.505 1.00 0.00 H new ATOM 2045 N VAL A 136 13.169 -9.643 -2.658 1.00 0.00 N ATOM 2046 CA VAL A 136 12.532 -8.457 -3.140 1.00 0.00 C ATOM 2047 C VAL A 136 12.737 -7.465 -2.048 1.00 0.00 C ATOM 2048 O VAL A 136 12.620 -7.735 -0.854 1.00 0.00 O ATOM 2049 CB VAL A 136 11.075 -8.710 -3.389 1.00 0.00 C ATOM 2050 CG1 VAL A 136 10.114 -7.555 -3.057 1.00 0.00 C ATOM 2051 CG2 VAL A 136 10.957 -9.021 -4.890 1.00 0.00 C ATOM 0 H VAL A 136 12.825 -9.974 -1.757 1.00 0.00 H new ATOM 0 HA VAL A 136 12.940 -8.108 -4.089 1.00 0.00 H new ATOM 0 HB VAL A 136 10.771 -9.516 -2.721 1.00 0.00 H new ATOM 0 HG11 VAL A 136 9.091 -7.858 -3.279 1.00 0.00 H new ATOM 0 HG12 VAL A 136 10.197 -7.305 -1.999 1.00 0.00 H new ATOM 0 HG13 VAL A 136 10.372 -6.683 -3.657 1.00 0.00 H new ATOM 0 HG21 VAL A 136 9.914 -9.216 -5.140 1.00 0.00 H new ATOM 0 HG22 VAL A 136 11.315 -8.169 -5.467 1.00 0.00 H new ATOM 0 HG23 VAL A 136 11.558 -9.899 -5.128 1.00 0.00 H new ATOM 2061 N ASN A 137 13.314 -6.320 -2.453 1.00 0.00 N ATOM 2062 CA ASN A 137 13.549 -5.256 -1.527 1.00 0.00 C ATOM 2063 C ASN A 137 12.413 -4.299 -1.648 1.00 0.00 C ATOM 2064 O ASN A 137 11.392 -4.424 -2.321 1.00 0.00 O ATOM 2065 CB ASN A 137 14.941 -4.625 -1.698 1.00 0.00 C ATOM 2066 CG ASN A 137 15.195 -4.053 -3.085 1.00 0.00 C ATOM 2067 OD1 ASN A 137 14.403 -3.315 -3.669 1.00 0.00 O ATOM 2068 ND2 ASN A 137 16.369 -4.351 -3.703 1.00 0.00 N ATOM 0 H ASN A 137 13.615 -6.132 -3.409 1.00 0.00 H new ATOM 0 HA ASN A 137 13.575 -5.632 -0.504 1.00 0.00 H new ATOM 0 HB2 ASN A 137 15.062 -3.831 -0.961 1.00 0.00 H new ATOM 0 HB3 ASN A 137 15.699 -5.378 -1.482 1.00 0.00 H new ATOM 0 HD21 ASN A 137 16.572 -3.965 -4.625 1.00 0.00 H new ATOM 0 HD22 ASN A 137 17.046 -4.960 -3.244 1.00 0.00 H new ATOM 2075 N TYR A 138 12.528 -3.108 -1.033 1.00 0.00 N ATOM 2076 CA TYR A 138 11.494 -2.120 -1.019 1.00 0.00 C ATOM 2077 C TYR A 138 11.234 -1.466 -2.332 1.00 0.00 C ATOM 2078 O TYR A 138 10.098 -1.331 -2.784 1.00 0.00 O ATOM 2079 CB TYR A 138 11.732 -1.151 0.151 1.00 0.00 C ATOM 2080 CG TYR A 138 10.675 -0.108 0.266 1.00 0.00 C ATOM 2081 CD1 TYR A 138 9.371 -0.538 0.339 1.00 0.00 C ATOM 2082 CD2 TYR A 138 10.948 1.238 0.197 1.00 0.00 C ATOM 2083 CE1 TYR A 138 8.310 0.299 0.087 1.00 0.00 C ATOM 2084 CE2 TYR A 138 9.897 2.115 0.065 1.00 0.00 C ATOM 2085 CZ TYR A 138 8.617 1.631 -0.068 1.00 0.00 C ATOM 2086 OH TYR A 138 7.576 2.476 -0.506 1.00 0.00 O ATOM 0 H TYR A 138 13.368 -2.823 -0.529 1.00 0.00 H new ATOM 0 HA TYR A 138 10.547 -2.630 -0.843 1.00 0.00 H new ATOM 0 HB2 TYR A 138 11.779 -1.717 1.081 1.00 0.00 H new ATOM 0 HB3 TYR A 138 12.700 -0.667 0.024 1.00 0.00 H new ATOM 0 HD1 TYR A 138 9.174 -1.567 0.603 1.00 0.00 H new ATOM 0 HD2 TYR A 138 11.965 1.598 0.245 1.00 0.00 H new ATOM 0 HE1 TYR A 138 7.296 -0.067 0.015 1.00 0.00 H new ATOM 0 HE2 TYR A 138 10.076 3.180 0.066 1.00 0.00 H new ATOM 0 HH TYR A 138 7.909 3.395 -0.579 1.00 0.00 H new ATOM 2096 N GLU A 139 12.363 -1.231 -3.023 1.00 0.00 N ATOM 2097 CA GLU A 139 12.275 -0.565 -4.285 1.00 0.00 C ATOM 2098 C GLU A 139 11.837 -1.503 -5.357 1.00 0.00 C ATOM 2099 O GLU A 139 11.158 -1.128 -6.312 1.00 0.00 O ATOM 2100 CB GLU A 139 13.672 -0.071 -4.698 1.00 0.00 C ATOM 2101 CG GLU A 139 13.635 0.930 -5.854 1.00 0.00 C ATOM 2102 CD GLU A 139 13.253 2.319 -5.361 1.00 0.00 C ATOM 2103 OE1 GLU A 139 14.140 3.064 -4.867 1.00 0.00 O ATOM 2104 OE2 GLU A 139 12.074 2.733 -5.529 1.00 0.00 O ATOM 0 H GLU A 139 13.303 -1.490 -2.724 1.00 0.00 H new ATOM 0 HA GLU A 139 11.562 0.252 -4.174 1.00 0.00 H new ATOM 0 HB2 GLU A 139 14.156 0.393 -3.839 1.00 0.00 H new ATOM 0 HB3 GLU A 139 14.284 -0.926 -4.985 1.00 0.00 H new ATOM 0 HG2 GLU A 139 14.611 0.968 -6.338 1.00 0.00 H new ATOM 0 HG3 GLU A 139 12.919 0.597 -6.605 1.00 0.00 H new ATOM 2111 N GLU A 140 11.986 -2.829 -5.192 1.00 0.00 N ATOM 2112 CA GLU A 140 11.456 -3.880 -6.005 1.00 0.00 C ATOM 2113 C GLU A 140 10.028 -4.160 -5.687 1.00 0.00 C ATOM 2114 O GLU A 140 9.229 -4.436 -6.581 1.00 0.00 O ATOM 2115 CB GLU A 140 12.370 -5.110 -5.875 1.00 0.00 C ATOM 2116 CG GLU A 140 13.782 -5.033 -6.460 1.00 0.00 C ATOM 2117 CD GLU A 140 14.474 -6.384 -6.342 1.00 0.00 C ATOM 2118 OE1 GLU A 140 14.608 -6.864 -5.185 1.00 0.00 O ATOM 2119 OE2 GLU A 140 14.994 -6.925 -7.354 1.00 0.00 O ATOM 0 H GLU A 140 12.531 -3.199 -4.413 1.00 0.00 H new ATOM 0 HA GLU A 140 11.449 -3.574 -7.051 1.00 0.00 H new ATOM 0 HB2 GLU A 140 12.462 -5.344 -4.814 1.00 0.00 H new ATOM 0 HB3 GLU A 140 11.862 -5.952 -6.344 1.00 0.00 H new ATOM 0 HG2 GLU A 140 13.734 -4.731 -7.506 1.00 0.00 H new ATOM 0 HG3 GLU A 140 14.360 -4.273 -5.935 1.00 0.00 H new ATOM 2126 N PHE A 141 9.620 -3.983 -4.418 1.00 0.00 N ATOM 2127 CA PHE A 141 8.254 -3.984 -3.993 1.00 0.00 C ATOM 2128 C PHE A 141 7.420 -2.847 -4.473 1.00 0.00 C ATOM 2129 O PHE A 141 6.275 -3.002 -4.896 1.00 0.00 O ATOM 2130 CB PHE A 141 8.166 -4.059 -2.460 1.00 0.00 C ATOM 2131 CG PHE A 141 6.782 -4.374 -2.006 1.00 0.00 C ATOM 2132 CD1 PHE A 141 6.229 -5.621 -2.185 1.00 0.00 C ATOM 2133 CD2 PHE A 141 5.947 -3.361 -1.597 1.00 0.00 C ATOM 2134 CE1 PHE A 141 4.939 -5.886 -1.791 1.00 0.00 C ATOM 2135 CE2 PHE A 141 4.701 -3.656 -1.096 1.00 0.00 C ATOM 2136 CZ PHE A 141 4.176 -4.925 -1.170 1.00 0.00 C ATOM 0 H PHE A 141 10.275 -3.832 -3.651 1.00 0.00 H new ATOM 0 HA PHE A 141 7.834 -4.873 -4.463 1.00 0.00 H new ATOM 0 HB2 PHE A 141 8.853 -4.821 -2.092 1.00 0.00 H new ATOM 0 HB3 PHE A 141 8.484 -3.109 -2.030 1.00 0.00 H new ATOM 0 HD1 PHE A 141 6.817 -6.403 -2.642 1.00 0.00 H new ATOM 0 HD2 PHE A 141 6.270 -2.333 -1.669 1.00 0.00 H new ATOM 0 HE1 PHE A 141 4.518 -6.864 -1.972 1.00 0.00 H new ATOM 0 HE2 PHE A 141 4.120 -2.872 -0.633 1.00 0.00 H new ATOM 0 HZ PHE A 141 3.205 -5.157 -0.758 1.00 0.00 H new ATOM 2146 N VAL A 142 7.977 -1.624 -4.432 1.00 0.00 N ATOM 2147 CA VAL A 142 7.340 -0.408 -4.835 1.00 0.00 C ATOM 2148 C VAL A 142 6.900 -0.609 -6.245 1.00 0.00 C ATOM 2149 O VAL A 142 5.764 -0.309 -6.609 1.00 0.00 O ATOM 2150 CB VAL A 142 8.243 0.779 -4.676 1.00 0.00 C ATOM 2151 CG1 VAL A 142 7.689 1.978 -5.464 1.00 0.00 C ATOM 2152 CG2 VAL A 142 8.161 1.245 -3.212 1.00 0.00 C ATOM 0 H VAL A 142 8.929 -1.475 -4.097 1.00 0.00 H new ATOM 0 HA VAL A 142 6.483 -0.188 -4.199 1.00 0.00 H new ATOM 0 HB VAL A 142 9.242 0.493 -5.004 1.00 0.00 H new ATOM 0 HG11 VAL A 142 8.354 2.833 -5.340 1.00 0.00 H new ATOM 0 HG12 VAL A 142 7.623 1.720 -6.521 1.00 0.00 H new ATOM 0 HG13 VAL A 142 6.697 2.232 -5.090 1.00 0.00 H new ATOM 0 HG21 VAL A 142 8.810 2.109 -3.068 1.00 0.00 H new ATOM 0 HG22 VAL A 142 7.133 1.519 -2.975 1.00 0.00 H new ATOM 0 HG23 VAL A 142 8.482 0.437 -2.554 1.00 0.00 H new ATOM 2162 N GLN A 143 7.808 -1.021 -7.148 1.00 0.00 N ATOM 2163 CA GLN A 143 7.600 -1.339 -8.526 1.00 0.00 C ATOM 2164 C GLN A 143 6.597 -2.419 -8.746 1.00 0.00 C ATOM 2165 O GLN A 143 5.913 -2.490 -9.766 1.00 0.00 O ATOM 2166 CB GLN A 143 8.987 -1.775 -9.027 1.00 0.00 C ATOM 2167 CG GLN A 143 9.057 -1.962 -10.544 1.00 0.00 C ATOM 2168 CD GLN A 143 10.412 -2.276 -11.162 1.00 0.00 C ATOM 2169 OE1 GLN A 143 10.591 -3.566 -11.554 1.00 0.00 O flip ATOM 2170 NE2 GLN A 143 11.284 -1.432 -11.362 1.00 0.00 N flip ATOM 0 H GLN A 143 8.785 -1.143 -6.883 1.00 0.00 H new ATOM 0 HA GLN A 143 7.192 -0.482 -9.061 1.00 0.00 H new ATOM 0 HB2 GLN A 143 9.724 -1.030 -8.726 1.00 0.00 H new ATOM 0 HB3 GLN A 143 9.263 -2.711 -8.540 1.00 0.00 H new ATOM 0 HG2 GLN A 143 8.372 -2.766 -10.814 1.00 0.00 H new ATOM 0 HG3 GLN A 143 8.680 -1.052 -11.011 1.00 0.00 H new ATOM 0 HE21 GLN A 143 11.138 -0.468 -11.064 1.00 0.00 H new ATOM 0 HE22 GLN A 143 12.153 -1.696 -11.826 1.00 0.00 H new ATOM 2179 N MET A 144 6.362 -3.328 -7.784 1.00 0.00 N ATOM 2180 CA MET A 144 5.303 -4.286 -7.857 1.00 0.00 C ATOM 2181 C MET A 144 3.979 -3.616 -7.724 1.00 0.00 C ATOM 2182 O MET A 144 3.016 -3.816 -8.463 1.00 0.00 O ATOM 2183 CB MET A 144 5.284 -5.397 -6.794 1.00 0.00 C ATOM 2184 CG MET A 144 6.417 -6.423 -6.873 1.00 0.00 C ATOM 2185 SD MET A 144 6.651 -7.497 -5.425 1.00 0.00 S ATOM 2186 CE MET A 144 4.960 -8.133 -5.243 1.00 0.00 C ATOM 0 H MET A 144 6.922 -3.399 -6.934 1.00 0.00 H new ATOM 0 HA MET A 144 5.490 -4.749 -8.826 1.00 0.00 H new ATOM 0 HB2 MET A 144 5.312 -4.930 -5.809 1.00 0.00 H new ATOM 0 HB3 MET A 144 4.335 -5.927 -6.869 1.00 0.00 H new ATOM 0 HG2 MET A 144 6.241 -7.057 -7.742 1.00 0.00 H new ATOM 0 HG3 MET A 144 7.349 -5.887 -7.053 1.00 0.00 H new ATOM 0 HE1 MET A 144 4.917 -8.815 -4.394 1.00 0.00 H new ATOM 0 HE2 MET A 144 4.275 -7.302 -5.076 1.00 0.00 H new ATOM 0 HE3 MET A 144 4.671 -8.664 -6.150 1.00 0.00 H new ATOM 2196 N MET A 145 3.759 -2.724 -6.742 1.00 0.00 N ATOM 2197 CA MET A 145 2.476 -2.139 -6.505 1.00 0.00 C ATOM 2198 C MET A 145 2.145 -0.971 -7.368 1.00 0.00 C ATOM 2199 O MET A 145 0.981 -0.594 -7.494 1.00 0.00 O ATOM 2200 CB MET A 145 2.454 -1.646 -5.048 1.00 0.00 C ATOM 2201 CG MET A 145 2.413 -2.722 -3.961 1.00 0.00 C ATOM 2202 SD MET A 145 0.881 -3.695 -4.068 1.00 0.00 S ATOM 2203 CE MET A 145 1.925 -5.179 -3.996 1.00 0.00 C ATOM 0 H MET A 145 4.485 -2.403 -6.101 1.00 0.00 H new ATOM 0 HA MET A 145 1.741 -2.912 -6.730 1.00 0.00 H new ATOM 0 HB2 MET A 145 3.338 -1.029 -4.884 1.00 0.00 H new ATOM 0 HB3 MET A 145 1.586 -0.999 -4.920 1.00 0.00 H new ATOM 0 HG2 MET A 145 3.275 -3.381 -4.064 1.00 0.00 H new ATOM 0 HG3 MET A 145 2.484 -2.255 -2.979 1.00 0.00 H new ATOM 0 HE1 MET A 145 1.453 -5.984 -4.560 1.00 0.00 H new ATOM 0 HE2 MET A 145 2.901 -4.958 -4.427 1.00 0.00 H new ATOM 0 HE3 MET A 145 2.048 -5.487 -2.958 1.00 0.00 H new