USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=21 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 60 ASN : amide:sc= 0.972 K(o=1.6,f=-3!) USER MOD Set 1.2: A 62 THR OG1 : rot -6:sc= 0.64 USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.527 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=0.78) 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 -71:sc= 1.28 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -162:sc= -0.0601 (180deg=-0.428) USER MOD Single : A 34 THR OG1 : rot 60:sc= 0.0355 USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 90:sc= 1.27 USER MOD Single : A 41 GLN : amide:sc= -0.209 X(o=-0.21,f=-0.21) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.053 USER MOD Single : A 49 GLN : amide:sc= -0.226 X(o=-0.23,f=-0.022) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.0292 K(o=-0.029,f=-0.99) USER MOD Single : A 70 THR OG1 : rot 79:sc= 0.0322 USER MOD Single : A 71 MET CE :methyl -160:sc= -0.242 (180deg=-1.21) USER MOD Single : A 72 MET CE :methyl 174:sc= 0 (180deg=-0.0171) USER MOD Single : A 94 LYS NZ :NH3+ -128:sc= 0 (180deg=-0.0901) USER MOD Single : A 97 ASN : amide:sc= -0.195 K(o=-0.19,f=-1.8!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -71:sc= 1.31 USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 109 MET CE :methyl 180:sc= -0.0602 (180deg=-0.0602) USER MOD Single : A 110 THR OG1 : rot 76:sc= 1.46 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.467 USER MOD Single : A 124 MET CE :methyl 171:sc= -0.333 (180deg=-0.41) USER MOD Single : A 135 GLN : amide:sc= -0.0199 K(o=-0.02,f=-0.89) USER MOD Single : A 137 ASN : amide:sc= -0.349 K(o=-0.35,f=-2.9!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.483 X(o=-0.48,f=-0.018) USER MOD Single : A 144 MET CE :methyl 143:sc= -0.0576 (180deg=-0.327) USER MOD Single : A 145 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 58 N THR A 5 -11.974 15.487 1.114 1.00 0.00 N ATOM 59 CA THR A 5 -12.601 16.692 0.666 1.00 0.00 C ATOM 60 C THR A 5 -13.998 16.359 0.269 1.00 0.00 C ATOM 61 O THR A 5 -14.284 15.184 0.049 1.00 0.00 O ATOM 62 CB THR A 5 -11.945 17.311 -0.532 1.00 0.00 C ATOM 63 OG1 THR A 5 -11.921 16.393 -1.615 1.00 0.00 O ATOM 64 CG2 THR A 5 -10.503 17.707 -0.169 1.00 0.00 C ATOM 0 HA THR A 5 -12.534 17.405 1.487 1.00 0.00 H new ATOM 0 HB THR A 5 -12.513 18.192 -0.831 1.00 0.00 H new ATOM 0 HG1 THR A 5 -11.491 16.812 -2.390 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.020 18.158 -1.036 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.518 18.424 0.652 1.00 0.00 H new ATOM 0 HG23 THR A 5 -9.948 16.820 0.135 1.00 0.00 H new ATOM 72 N GLU A 6 -14.820 17.405 0.068 1.00 0.00 N ATOM 73 CA GLU A 6 -16.136 17.262 -0.473 1.00 0.00 C ATOM 74 C GLU A 6 -16.186 16.718 -1.859 1.00 0.00 C ATOM 75 O GLU A 6 -17.069 15.942 -2.221 1.00 0.00 O ATOM 76 CB GLU A 6 -16.930 18.579 -0.425 1.00 0.00 C ATOM 77 CG GLU A 6 -18.429 18.395 -0.177 1.00 0.00 C ATOM 78 CD GLU A 6 -19.287 19.575 -0.606 1.00 0.00 C ATOM 79 OE1 GLU A 6 -19.036 20.709 -0.117 1.00 0.00 O ATOM 80 OE2 GLU A 6 -20.165 19.320 -1.473 1.00 0.00 O ATOM 0 H GLU A 6 -14.565 18.368 0.285 1.00 0.00 H new ATOM 0 HA GLU A 6 -16.600 16.522 0.179 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -16.517 19.211 0.361 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -16.791 19.110 -1.367 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -18.766 17.505 -0.708 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -18.589 18.212 0.886 1.00 0.00 H new ATOM 87 N GLU A 7 -15.180 17.036 -2.692 1.00 0.00 N ATOM 88 CA GLU A 7 -15.059 16.525 -4.022 1.00 0.00 C ATOM 89 C GLU A 7 -14.868 15.047 -4.049 1.00 0.00 C ATOM 90 O GLU A 7 -15.537 14.288 -4.748 1.00 0.00 O ATOM 91 CB GLU A 7 -13.920 17.226 -4.781 1.00 0.00 C ATOM 92 CG GLU A 7 -13.810 17.063 -6.299 1.00 0.00 C ATOM 93 CD GLU A 7 -12.528 17.635 -6.885 1.00 0.00 C ATOM 94 OE1 GLU A 7 -11.484 16.963 -6.673 1.00 0.00 O ATOM 95 OE2 GLU A 7 -12.474 18.763 -7.446 1.00 0.00 O ATOM 0 H GLU A 7 -14.425 17.670 -2.431 1.00 0.00 H new ATOM 0 HA GLU A 7 -16.002 16.739 -4.525 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -13.998 18.293 -4.572 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -12.980 16.884 -4.347 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -13.871 16.003 -6.547 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -14.663 17.550 -6.770 1.00 0.00 H new ATOM 102 N GLN A 8 -14.010 14.570 -3.129 1.00 0.00 N ATOM 103 CA GLN A 8 -13.728 13.205 -2.810 1.00 0.00 C ATOM 104 C GLN A 8 -14.899 12.430 -2.313 1.00 0.00 C ATOM 105 O GLN A 8 -15.321 11.432 -2.894 1.00 0.00 O ATOM 106 CB GLN A 8 -12.517 13.033 -1.877 1.00 0.00 C ATOM 107 CG GLN A 8 -11.160 13.470 -2.432 1.00 0.00 C ATOM 108 CD GLN A 8 -9.986 13.310 -1.476 1.00 0.00 C ATOM 109 OE1 GLN A 8 -9.933 13.684 -0.306 1.00 0.00 O ATOM 110 NE2 GLN A 8 -8.888 12.686 -1.981 1.00 0.00 N ATOM 0 H GLN A 8 -13.460 15.207 -2.552 1.00 0.00 H new ATOM 0 HA GLN A 8 -13.464 12.771 -3.774 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -12.708 13.595 -0.963 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -12.449 11.982 -1.597 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -10.953 12.896 -3.335 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -11.227 14.517 -2.728 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -8.887 12.359 -2.947 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -8.066 12.545 -1.394 1.00 0.00 H new ATOM 119 N ILE A 9 -15.582 12.907 -1.257 1.00 0.00 N ATOM 120 CA ILE A 9 -16.850 12.414 -0.815 1.00 0.00 C ATOM 121 C ILE A 9 -17.898 12.266 -1.865 1.00 0.00 C ATOM 122 O ILE A 9 -18.558 11.231 -1.937 1.00 0.00 O ATOM 123 CB ILE A 9 -17.298 13.044 0.470 1.00 0.00 C ATOM 124 CG1 ILE A 9 -16.293 13.051 1.634 1.00 0.00 C ATOM 125 CG2 ILE A 9 -18.586 12.365 0.966 1.00 0.00 C ATOM 126 CD1 ILE A 9 -16.706 14.053 2.711 1.00 0.00 C ATOM 0 H ILE A 9 -15.233 13.674 -0.683 1.00 0.00 H new ATOM 0 HA ILE A 9 -16.669 11.368 -0.569 1.00 0.00 H new ATOM 0 HB ILE A 9 -17.438 14.090 0.198 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -16.227 12.053 2.067 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.301 13.303 1.260 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -18.905 12.828 1.900 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -19.370 12.480 0.217 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -18.397 11.305 1.133 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -15.978 14.037 3.522 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -16.747 15.054 2.280 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -17.688 13.785 3.100 1.00 0.00 H new ATOM 138 N ALA A 10 -18.061 13.280 -2.733 1.00 0.00 N ATOM 139 CA ALA A 10 -18.979 13.274 -3.829 1.00 0.00 C ATOM 140 C ALA A 10 -18.655 12.365 -4.964 1.00 0.00 C ATOM 141 O ALA A 10 -19.536 11.852 -5.652 1.00 0.00 O ATOM 142 CB ALA A 10 -19.278 14.716 -4.273 1.00 0.00 C ATOM 0 H ALA A 10 -17.526 14.146 -2.667 1.00 0.00 H new ATOM 0 HA ALA A 10 -19.890 12.820 -3.440 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -19.978 14.702 -5.108 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -19.716 15.269 -3.442 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -18.352 15.200 -4.584 1.00 0.00 H new ATOM 148 N GLU A 11 -17.349 12.132 -5.182 1.00 0.00 N ATOM 149 CA GLU A 11 -17.042 11.179 -6.203 1.00 0.00 C ATOM 150 C GLU A 11 -17.245 9.806 -5.661 1.00 0.00 C ATOM 151 O GLU A 11 -17.761 8.936 -6.361 1.00 0.00 O ATOM 152 CB GLU A 11 -15.595 11.409 -6.671 1.00 0.00 C ATOM 153 CG GLU A 11 -15.135 10.616 -7.896 1.00 0.00 C ATOM 154 CD GLU A 11 -13.736 11.100 -8.250 1.00 0.00 C ATOM 155 OE1 GLU A 11 -12.758 10.592 -7.640 1.00 0.00 O ATOM 156 OE2 GLU A 11 -13.633 11.916 -9.206 1.00 0.00 O ATOM 0 H GLU A 11 -16.562 12.563 -4.697 1.00 0.00 H new ATOM 0 HA GLU A 11 -17.699 11.297 -7.065 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -15.472 12.470 -6.887 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -14.928 11.173 -5.842 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -15.129 9.547 -7.682 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -15.818 10.770 -8.732 1.00 0.00 H new ATOM 163 N PHE A 12 -16.921 9.549 -4.382 1.00 0.00 N ATOM 164 CA PHE A 12 -17.192 8.294 -3.753 1.00 0.00 C ATOM 165 C PHE A 12 -18.636 7.941 -3.659 1.00 0.00 C ATOM 166 O PHE A 12 -19.009 6.805 -3.947 1.00 0.00 O ATOM 167 CB PHE A 12 -16.489 8.270 -2.385 1.00 0.00 C ATOM 168 CG PHE A 12 -15.005 8.342 -2.272 1.00 0.00 C ATOM 169 CD1 PHE A 12 -14.209 8.031 -3.350 1.00 0.00 C ATOM 170 CD2 PHE A 12 -14.430 8.677 -1.069 1.00 0.00 C ATOM 171 CE1 PHE A 12 -12.844 8.050 -3.190 1.00 0.00 C ATOM 172 CE2 PHE A 12 -13.062 8.747 -0.950 1.00 0.00 C ATOM 173 CZ PHE A 12 -12.253 8.329 -1.980 1.00 0.00 C ATOM 0 H PHE A 12 -16.462 10.226 -3.773 1.00 0.00 H new ATOM 0 HA PHE A 12 -16.788 7.511 -4.395 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -16.892 9.102 -1.807 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -16.801 7.353 -1.884 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -14.648 7.777 -4.303 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -15.056 8.886 -0.214 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -12.215 7.839 -4.042 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -12.621 9.132 -0.043 1.00 0.00 H new ATOM 0 HZ PHE A 12 -11.187 8.223 -1.843 1.00 0.00 H new ATOM 183 N LYS A 13 -19.553 8.879 -3.362 1.00 0.00 N ATOM 184 CA LYS A 13 -20.968 8.741 -3.521 1.00 0.00 C ATOM 185 C LYS A 13 -21.359 8.293 -4.887 1.00 0.00 C ATOM 186 O LYS A 13 -22.218 7.433 -5.077 1.00 0.00 O ATOM 187 CB LYS A 13 -21.577 10.144 -3.356 1.00 0.00 C ATOM 188 CG LYS A 13 -23.082 10.116 -3.079 1.00 0.00 C ATOM 189 CD LYS A 13 -23.386 9.971 -1.586 1.00 0.00 C ATOM 190 CE LYS A 13 -24.802 10.252 -1.079 1.00 0.00 C ATOM 191 NZ LYS A 13 -25.692 9.199 -1.617 1.00 0.00 N ATOM 0 H LYS A 13 -19.289 9.790 -2.988 1.00 0.00 H new ATOM 0 HA LYS A 13 -21.312 8.005 -2.794 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -21.073 10.659 -2.538 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -21.391 10.723 -4.260 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -23.537 11.032 -3.455 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -23.536 9.288 -3.624 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -23.131 8.951 -1.297 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -22.708 10.633 -1.048 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -24.825 10.251 0.011 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -25.136 11.237 -1.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -26.664 9.365 -1.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -25.670 9.223 -2.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -25.368 8.268 -1.285 1.00 0.00 H new ATOM 205 N GLU A 14 -20.793 8.794 -5.999 1.00 0.00 N ATOM 206 CA GLU A 14 -21.119 8.366 -7.324 1.00 0.00 C ATOM 207 C GLU A 14 -20.726 6.950 -7.566 1.00 0.00 C ATOM 208 O GLU A 14 -21.380 6.178 -8.266 1.00 0.00 O ATOM 209 CB GLU A 14 -20.326 9.275 -8.278 1.00 0.00 C ATOM 210 CG GLU A 14 -21.141 10.469 -8.778 1.00 0.00 C ATOM 211 CD GLU A 14 -22.250 10.088 -9.749 1.00 0.00 C ATOM 212 OE1 GLU A 14 -21.889 9.480 -10.792 1.00 0.00 O ATOM 213 OE2 GLU A 14 -23.458 10.220 -9.418 1.00 0.00 O ATOM 0 H GLU A 14 -20.082 9.525 -5.975 1.00 0.00 H new ATOM 0 HA GLU A 14 -22.196 8.431 -7.478 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -19.434 9.639 -7.768 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -19.988 8.689 -9.133 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -21.580 10.982 -7.922 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -20.471 11.177 -9.265 1.00 0.00 H new ATOM 220 N ALA A 15 -19.570 6.551 -7.006 1.00 0.00 N ATOM 221 CA ALA A 15 -19.029 5.230 -7.102 1.00 0.00 C ATOM 222 C ALA A 15 -19.864 4.206 -6.414 1.00 0.00 C ATOM 223 O ALA A 15 -20.104 3.139 -6.977 1.00 0.00 O ATOM 224 CB ALA A 15 -17.589 5.080 -6.581 1.00 0.00 C ATOM 0 H ALA A 15 -18.983 7.181 -6.459 1.00 0.00 H new ATOM 0 HA ALA A 15 -19.026 5.058 -8.178 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -17.267 4.045 -6.695 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.926 5.732 -7.151 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -17.553 5.357 -5.527 1.00 0.00 H new ATOM 230 N PHE A 16 -20.277 4.526 -5.175 1.00 0.00 N ATOM 231 CA PHE A 16 -21.052 3.694 -4.308 1.00 0.00 C ATOM 232 C PHE A 16 -22.294 3.111 -4.887 1.00 0.00 C ATOM 233 O PHE A 16 -22.609 1.944 -4.659 1.00 0.00 O ATOM 234 CB PHE A 16 -21.391 4.537 -3.067 1.00 0.00 C ATOM 235 CG PHE A 16 -21.917 3.766 -1.906 1.00 0.00 C ATOM 236 CD1 PHE A 16 -21.053 3.124 -1.050 1.00 0.00 C ATOM 237 CD2 PHE A 16 -23.274 3.710 -1.696 1.00 0.00 C ATOM 238 CE1 PHE A 16 -21.523 2.484 0.073 1.00 0.00 C ATOM 239 CE2 PHE A 16 -23.748 3.106 -0.555 1.00 0.00 C ATOM 240 CZ PHE A 16 -22.881 2.448 0.285 1.00 0.00 C ATOM 0 H PHE A 16 -20.054 5.427 -4.751 1.00 0.00 H new ATOM 0 HA PHE A 16 -20.444 2.817 -4.085 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -20.494 5.071 -2.753 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -22.128 5.290 -3.348 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -19.994 3.122 -1.262 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -23.958 4.134 -2.416 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -20.842 2.021 0.771 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -24.801 3.149 -0.319 1.00 0.00 H new ATOM 0 HZ PHE A 16 -23.273 1.894 1.125 1.00 0.00 H new ATOM 250 N SER A 17 -23.058 3.947 -5.612 1.00 0.00 N ATOM 251 CA SER A 17 -24.289 3.619 -6.262 1.00 0.00 C ATOM 252 C SER A 17 -24.136 2.935 -7.577 1.00 0.00 C ATOM 253 O SER A 17 -25.186 2.473 -8.023 1.00 0.00 O ATOM 254 CB SER A 17 -25.305 4.769 -6.373 1.00 0.00 C ATOM 255 OG SER A 17 -25.674 5.248 -5.089 1.00 0.00 O ATOM 0 H SER A 17 -22.796 4.922 -5.754 1.00 0.00 H new ATOM 0 HA SER A 17 -24.712 2.896 -5.564 1.00 0.00 H new ATOM 0 HB2 SER A 17 -24.877 5.582 -6.959 1.00 0.00 H new ATOM 0 HB3 SER A 17 -26.192 4.425 -6.905 1.00 0.00 H new ATOM 0 HG SER A 17 -26.319 5.979 -5.186 1.00 0.00 H new ATOM 261 N LEU A 18 -22.971 2.786 -8.232 1.00 0.00 N ATOM 262 CA LEU A 18 -22.631 1.775 -9.184 1.00 0.00 C ATOM 263 C LEU A 18 -22.525 0.458 -8.496 1.00 0.00 C ATOM 264 O LEU A 18 -22.924 -0.548 -9.079 1.00 0.00 O ATOM 265 CB LEU A 18 -21.312 2.146 -9.882 1.00 0.00 C ATOM 266 CG LEU A 18 -21.324 3.364 -10.821 1.00 0.00 C ATOM 267 CD1 LEU A 18 -19.871 3.770 -11.118 1.00 0.00 C ATOM 268 CD2 LEU A 18 -22.149 3.099 -12.091 1.00 0.00 C ATOM 0 H LEU A 18 -22.198 3.434 -8.080 1.00 0.00 H new ATOM 0 HA LEU A 18 -23.410 1.703 -9.943 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -20.562 2.323 -9.111 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -20.981 1.281 -10.457 1.00 0.00 H new ATOM 0 HG LEU A 18 -21.822 4.202 -10.332 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -19.863 4.633 -11.783 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -19.367 4.026 -10.186 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -19.351 2.939 -11.595 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -22.132 3.984 -12.727 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -21.722 2.255 -12.632 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -23.178 2.870 -11.815 1.00 0.00 H new ATOM 280 N PHE A 19 -21.958 0.424 -7.276 1.00 0.00 N ATOM 281 CA PHE A 19 -21.669 -0.757 -6.523 1.00 0.00 C ATOM 282 C PHE A 19 -22.779 -1.360 -5.735 1.00 0.00 C ATOM 283 O PHE A 19 -22.789 -2.575 -5.542 1.00 0.00 O ATOM 284 CB PHE A 19 -20.576 -0.480 -5.477 1.00 0.00 C ATOM 285 CG PHE A 19 -19.349 -0.116 -6.239 1.00 0.00 C ATOM 286 CD1 PHE A 19 -18.871 -0.489 -7.474 1.00 0.00 C ATOM 287 CD2 PHE A 19 -18.492 0.688 -5.526 1.00 0.00 C ATOM 288 CE1 PHE A 19 -17.630 -0.153 -7.963 1.00 0.00 C ATOM 289 CE2 PHE A 19 -17.280 1.080 -6.043 1.00 0.00 C ATOM 290 CZ PHE A 19 -16.773 0.648 -7.246 1.00 0.00 C ATOM 0 H PHE A 19 -21.685 1.276 -6.786 1.00 0.00 H new ATOM 0 HA PHE A 19 -21.394 -1.454 -7.315 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -20.873 0.329 -4.809 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -20.401 -1.358 -4.856 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -19.514 -1.087 -8.103 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -18.777 1.019 -4.538 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -17.323 -0.526 -8.929 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -16.686 1.774 -5.466 1.00 0.00 H new ATOM 0 HZ PHE A 19 -15.787 0.915 -7.597 1.00 0.00 H new ATOM 300 N ASP A 20 -23.736 -0.517 -5.308 1.00 0.00 N ATOM 301 CA ASP A 20 -25.005 -0.905 -4.775 1.00 0.00 C ATOM 302 C ASP A 20 -25.984 -1.297 -5.828 1.00 0.00 C ATOM 303 O ASP A 20 -26.526 -0.502 -6.594 1.00 0.00 O ATOM 304 CB ASP A 20 -25.666 0.109 -3.826 1.00 0.00 C ATOM 305 CG ASP A 20 -27.041 -0.145 -3.224 1.00 0.00 C ATOM 306 OD1 ASP A 20 -27.168 -1.281 -2.695 1.00 0.00 O ATOM 307 OD2 ASP A 20 -28.001 0.670 -3.247 1.00 0.00 O ATOM 0 H ASP A 20 -23.616 0.496 -5.337 1.00 0.00 H new ATOM 0 HA ASP A 20 -24.745 -1.775 -4.172 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -24.978 0.259 -2.994 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -25.726 1.055 -4.364 1.00 0.00 H new ATOM 312 N LYS A 21 -26.176 -2.623 -5.950 1.00 0.00 N ATOM 313 CA LYS A 21 -26.839 -3.271 -7.039 1.00 0.00 C ATOM 314 C LYS A 21 -28.314 -3.218 -6.837 1.00 0.00 C ATOM 315 O LYS A 21 -29.056 -2.755 -7.702 1.00 0.00 O ATOM 316 CB LYS A 21 -26.352 -4.719 -7.215 1.00 0.00 C ATOM 317 CG LYS A 21 -26.931 -5.373 -8.471 1.00 0.00 C ATOM 318 CD LYS A 21 -26.270 -6.659 -8.970 1.00 0.00 C ATOM 319 CE LYS A 21 -26.774 -7.274 -10.278 1.00 0.00 C ATOM 320 NZ LYS A 21 -25.978 -8.503 -10.491 1.00 0.00 N ATOM 0 H LYS A 21 -25.848 -3.282 -5.244 1.00 0.00 H new ATOM 0 HA LYS A 21 -26.593 -2.739 -7.958 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -25.263 -4.731 -7.270 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -26.633 -5.304 -6.340 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -27.983 -5.587 -8.283 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -26.894 -4.641 -9.278 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -25.204 -6.462 -9.084 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -26.373 -7.411 -8.188 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -27.837 -7.505 -10.215 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -26.647 -6.580 -11.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -26.281 -8.964 -11.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -24.970 -8.256 -10.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -26.123 -9.153 -9.692 1.00 0.00 H new ATOM 334 N ASP A 22 -28.817 -3.673 -5.676 1.00 0.00 N ATOM 335 CA ASP A 22 -30.202 -3.940 -5.441 1.00 0.00 C ATOM 336 C ASP A 22 -31.009 -2.755 -5.035 1.00 0.00 C ATOM 337 O ASP A 22 -32.226 -2.610 -5.140 1.00 0.00 O ATOM 338 CB ASP A 22 -30.448 -5.102 -4.463 1.00 0.00 C ATOM 339 CG ASP A 22 -29.751 -5.022 -3.113 1.00 0.00 C ATOM 340 OD1 ASP A 22 -29.021 -4.044 -2.798 1.00 0.00 O ATOM 341 OD2 ASP A 22 -29.827 -6.064 -2.408 1.00 0.00 O ATOM 0 H ASP A 22 -28.231 -3.864 -4.863 1.00 0.00 H new ATOM 0 HA ASP A 22 -30.556 -4.241 -6.427 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -31.521 -5.177 -4.287 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -30.140 -6.027 -4.950 1.00 0.00 H new ATOM 346 N GLY A 23 -30.250 -1.784 -4.497 1.00 0.00 N ATOM 347 CA GLY A 23 -30.809 -0.511 -4.162 1.00 0.00 C ATOM 348 C GLY A 23 -31.157 -0.298 -2.729 1.00 0.00 C ATOM 349 O GLY A 23 -31.951 0.610 -2.487 1.00 0.00 O ATOM 0 H GLY A 23 -29.255 -1.879 -4.295 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -30.101 0.262 -4.461 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -31.710 -0.366 -4.758 1.00 0.00 H new ATOM 353 N ASP A 24 -30.629 -1.050 -1.748 1.00 0.00 N ATOM 354 CA ASP A 24 -30.829 -0.939 -0.336 1.00 0.00 C ATOM 355 C ASP A 24 -30.017 0.167 0.246 1.00 0.00 C ATOM 356 O ASP A 24 -30.105 0.559 1.409 1.00 0.00 O ATOM 357 CB ASP A 24 -30.775 -2.283 0.410 1.00 0.00 C ATOM 358 CG ASP A 24 -29.376 -2.883 0.437 1.00 0.00 C ATOM 359 OD1 ASP A 24 -28.442 -2.381 -0.243 1.00 0.00 O ATOM 360 OD2 ASP A 24 -29.087 -3.839 1.206 1.00 0.00 O ATOM 0 H ASP A 24 -29.995 -1.817 -1.970 1.00 0.00 H new ATOM 0 HA ASP A 24 -31.864 -0.638 -0.175 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -31.125 -2.141 1.432 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -31.459 -2.986 -0.066 1.00 0.00 H new ATOM 365 N GLY A 25 -29.024 0.735 -0.460 1.00 0.00 N ATOM 366 CA GLY A 25 -28.080 1.710 -0.009 1.00 0.00 C ATOM 367 C GLY A 25 -26.905 1.181 0.739 1.00 0.00 C ATOM 368 O GLY A 25 -26.233 1.837 1.534 1.00 0.00 O ATOM 0 H GLY A 25 -28.869 0.487 -1.437 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -27.716 2.263 -0.875 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -28.601 2.424 0.629 1.00 0.00 H new ATOM 372 N THR A 26 -26.565 -0.112 0.596 1.00 0.00 N ATOM 373 CA THR A 26 -25.474 -0.627 1.364 1.00 0.00 C ATOM 374 C THR A 26 -24.652 -1.438 0.422 1.00 0.00 C ATOM 375 O THR A 26 -25.160 -1.776 -0.646 1.00 0.00 O ATOM 376 CB THR A 26 -25.872 -1.463 2.544 1.00 0.00 C ATOM 377 OG1 THR A 26 -26.436 -2.717 2.187 1.00 0.00 O ATOM 378 CG2 THR A 26 -26.972 -0.682 3.282 1.00 0.00 C ATOM 0 H THR A 26 -27.024 -0.779 -0.025 1.00 0.00 H new ATOM 0 HA THR A 26 -24.933 0.214 1.798 1.00 0.00 H new ATOM 0 HB THR A 26 -24.976 -1.656 3.134 1.00 0.00 H new ATOM 0 HG1 THR A 26 -26.672 -3.213 2.999 1.00 0.00 H new ATOM 0 HG21 THR A 26 -27.299 -1.249 4.154 1.00 0.00 H new ATOM 0 HG22 THR A 26 -26.580 0.283 3.603 1.00 0.00 H new ATOM 0 HG23 THR A 26 -27.818 -0.525 2.613 1.00 0.00 H new ATOM 386 N ILE A 27 -23.381 -1.770 0.714 1.00 0.00 N ATOM 387 CA ILE A 27 -22.635 -2.725 -0.044 1.00 0.00 C ATOM 388 C ILE A 27 -22.459 -3.963 0.766 1.00 0.00 C ATOM 389 O ILE A 27 -21.892 -4.025 1.856 1.00 0.00 O ATOM 390 CB ILE A 27 -21.275 -2.279 -0.496 1.00 0.00 C ATOM 391 CG1 ILE A 27 -21.146 -0.908 -1.180 1.00 0.00 C ATOM 392 CG2 ILE A 27 -20.654 -3.297 -1.467 1.00 0.00 C ATOM 393 CD1 ILE A 27 -19.702 -0.493 -1.458 1.00 0.00 C ATOM 0 H ILE A 27 -22.861 -1.366 1.493 1.00 0.00 H new ATOM 0 HA ILE A 27 -23.223 -2.882 -0.948 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.759 -2.196 0.460 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -21.696 -0.928 -2.121 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -21.617 -0.152 -0.551 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -19.669 -2.949 -1.779 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -20.557 -4.262 -0.970 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -21.295 -3.403 -2.342 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -19.691 0.484 -1.941 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -19.152 -0.439 -0.519 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -19.232 -1.227 -2.113 1.00 0.00 H new ATOM 405 N THR A 28 -23.205 -5.021 0.402 1.00 0.00 N ATOM 406 CA THR A 28 -23.146 -6.292 1.054 1.00 0.00 C ATOM 407 C THR A 28 -22.021 -7.185 0.657 1.00 0.00 C ATOM 408 O THR A 28 -21.228 -6.661 -0.124 1.00 0.00 O ATOM 409 CB THR A 28 -24.319 -7.186 0.777 1.00 0.00 C ATOM 410 OG1 THR A 28 -24.580 -7.517 -0.579 1.00 0.00 O ATOM 411 CG2 THR A 28 -25.620 -6.465 1.168 1.00 0.00 C ATOM 0 H THR A 28 -23.870 -4.991 -0.371 1.00 0.00 H new ATOM 0 HA THR A 28 -23.069 -5.944 2.084 1.00 0.00 H new ATOM 0 HB THR A 28 -24.051 -8.084 1.334 1.00 0.00 H new ATOM 0 HG1 THR A 28 -24.915 -6.726 -1.050 1.00 0.00 H new ATOM 0 HG21 THR A 28 -26.471 -7.115 0.966 1.00 0.00 H new ATOM 0 HG22 THR A 28 -25.595 -6.219 2.230 1.00 0.00 H new ATOM 0 HG23 THR A 28 -25.717 -5.549 0.586 1.00 0.00 H new ATOM 419 N THR A 29 -21.878 -8.413 1.185 1.00 0.00 N ATOM 420 CA THR A 29 -20.799 -9.302 0.883 1.00 0.00 C ATOM 421 C THR A 29 -20.731 -9.750 -0.536 1.00 0.00 C ATOM 422 O THR A 29 -19.740 -9.932 -1.242 1.00 0.00 O ATOM 423 CB THR A 29 -20.618 -10.472 1.805 1.00 0.00 C ATOM 424 OG1 THR A 29 -20.789 -10.040 3.146 1.00 0.00 O ATOM 425 CG2 THR A 29 -19.225 -11.122 1.778 1.00 0.00 C ATOM 0 H THR A 29 -22.544 -8.804 1.852 1.00 0.00 H new ATOM 0 HA THR A 29 -19.952 -8.641 1.066 1.00 0.00 H new ATOM 0 HB THR A 29 -21.351 -11.201 1.460 1.00 0.00 H new ATOM 0 HG1 THR A 29 -20.673 -10.801 3.752 1.00 0.00 H new ATOM 0 HG21 THR A 29 -19.199 -11.956 2.479 1.00 0.00 H new ATOM 0 HG22 THR A 29 -19.013 -11.486 0.773 1.00 0.00 H new ATOM 0 HG23 THR A 29 -18.474 -10.385 2.063 1.00 0.00 H new ATOM 433 N LYS A 30 -21.896 -9.950 -1.178 1.00 0.00 N ATOM 434 CA LYS A 30 -21.980 -10.176 -2.587 1.00 0.00 C ATOM 435 C LYS A 30 -21.412 -9.141 -3.496 1.00 0.00 C ATOM 436 O LYS A 30 -20.555 -9.298 -4.364 1.00 0.00 O ATOM 437 CB LYS A 30 -23.431 -10.549 -2.934 1.00 0.00 C ATOM 438 CG LYS A 30 -23.719 -11.991 -2.511 1.00 0.00 C ATOM 439 CD LYS A 30 -25.196 -12.241 -2.824 1.00 0.00 C ATOM 440 CE LYS A 30 -25.603 -13.715 -2.860 1.00 0.00 C ATOM 441 NZ LYS A 30 -24.796 -14.456 -3.855 1.00 0.00 N ATOM 0 H LYS A 30 -22.800 -9.955 -0.707 1.00 0.00 H new ATOM 0 HA LYS A 30 -21.298 -11.002 -2.790 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -24.119 -9.870 -2.431 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -23.597 -10.436 -4.005 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -23.082 -12.690 -3.053 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -23.517 -12.133 -1.449 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -25.803 -11.729 -2.077 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -25.430 -11.790 -3.788 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -25.470 -14.158 -1.873 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -26.661 -13.799 -3.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -25.270 -15.352 -4.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -24.695 -13.883 -4.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -23.855 -14.655 -3.460 1.00 0.00 H new ATOM 455 N GLU A 31 -21.932 -7.931 -3.225 1.00 0.00 N ATOM 456 CA GLU A 31 -21.581 -6.717 -3.895 1.00 0.00 C ATOM 457 C GLU A 31 -20.150 -6.306 -3.849 1.00 0.00 C ATOM 458 O GLU A 31 -19.609 -5.912 -4.881 1.00 0.00 O ATOM 459 CB GLU A 31 -22.427 -5.577 -3.303 1.00 0.00 C ATOM 460 CG GLU A 31 -23.884 -5.947 -3.587 1.00 0.00 C ATOM 461 CD GLU A 31 -24.820 -4.969 -2.892 1.00 0.00 C ATOM 462 OE1 GLU A 31 -25.071 -5.071 -1.661 1.00 0.00 O ATOM 463 OE2 GLU A 31 -25.502 -4.176 -3.594 1.00 0.00 O ATOM 0 H GLU A 31 -22.635 -7.792 -2.499 1.00 0.00 H new ATOM 0 HA GLU A 31 -21.778 -6.918 -4.948 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -22.251 -5.475 -2.232 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -22.170 -4.622 -3.760 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -24.067 -5.935 -4.661 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -24.083 -6.961 -3.241 1.00 0.00 H new ATOM 470 N LEU A 32 -19.494 -6.489 -2.689 1.00 0.00 N ATOM 471 CA LEU A 32 -18.127 -6.132 -2.469 1.00 0.00 C ATOM 472 C LEU A 32 -17.302 -7.190 -3.117 1.00 0.00 C ATOM 473 O LEU A 32 -16.206 -6.885 -3.585 1.00 0.00 O ATOM 474 CB LEU A 32 -17.785 -5.939 -0.982 1.00 0.00 C ATOM 475 CG LEU A 32 -16.484 -5.288 -0.485 1.00 0.00 C ATOM 476 CD1 LEU A 32 -15.329 -6.288 -0.307 1.00 0.00 C ATOM 477 CD2 LEU A 32 -16.058 -4.046 -1.287 1.00 0.00 C ATOM 0 H LEU A 32 -19.936 -6.904 -1.869 1.00 0.00 H new ATOM 0 HA LEU A 32 -17.917 -5.158 -2.910 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -18.601 -5.358 -0.553 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -17.825 -6.929 -0.528 1.00 0.00 H new ATOM 0 HG LEU A 32 -16.732 -4.924 0.512 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -14.442 -5.761 0.046 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -15.614 -7.047 0.422 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -15.111 -6.766 -1.262 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -15.132 -3.646 -0.874 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -15.901 -4.322 -2.330 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -16.839 -3.288 -1.227 1.00 0.00 H new ATOM 489 N GLY A 33 -17.740 -8.462 -3.111 1.00 0.00 N ATOM 490 CA GLY A 33 -17.237 -9.467 -3.994 1.00 0.00 C ATOM 491 C GLY A 33 -17.129 -9.060 -5.424 1.00 0.00 C ATOM 492 O GLY A 33 -16.059 -9.144 -6.025 1.00 0.00 O ATOM 0 H GLY A 33 -18.463 -8.800 -2.475 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.251 -9.774 -3.645 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -17.885 -10.341 -3.930 1.00 0.00 H new ATOM 496 N THR A 34 -18.217 -8.508 -5.989 1.00 0.00 N ATOM 497 CA THR A 34 -18.256 -8.197 -7.384 1.00 0.00 C ATOM 498 C THR A 34 -17.270 -7.119 -7.677 1.00 0.00 C ATOM 499 O THR A 34 -16.623 -7.132 -8.723 1.00 0.00 O ATOM 500 CB THR A 34 -19.623 -7.790 -7.848 1.00 0.00 C ATOM 501 OG1 THR A 34 -20.593 -8.799 -7.605 1.00 0.00 O ATOM 502 CG2 THR A 34 -19.687 -7.344 -9.318 1.00 0.00 C ATOM 0 H THR A 34 -19.070 -8.277 -5.480 1.00 0.00 H new ATOM 0 HA THR A 34 -17.997 -9.103 -7.932 1.00 0.00 H new ATOM 0 HB THR A 34 -19.860 -6.913 -7.245 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.639 -8.984 -6.644 1.00 0.00 H new ATOM 0 HG21 THR A 34 -20.711 -7.067 -9.570 1.00 0.00 H new ATOM 0 HG22 THR A 34 -19.032 -6.485 -9.467 1.00 0.00 H new ATOM 0 HG23 THR A 34 -19.364 -8.163 -9.961 1.00 0.00 H new ATOM 510 N VAL A 35 -16.953 -6.196 -6.752 1.00 0.00 N ATOM 511 CA VAL A 35 -15.973 -5.155 -6.787 1.00 0.00 C ATOM 512 C VAL A 35 -14.568 -5.620 -6.957 1.00 0.00 C ATOM 513 O VAL A 35 -13.850 -5.251 -7.885 1.00 0.00 O ATOM 514 CB VAL A 35 -16.198 -4.226 -5.631 1.00 0.00 C ATOM 515 CG1 VAL A 35 -15.122 -3.128 -5.575 1.00 0.00 C ATOM 516 CG2 VAL A 35 -17.522 -3.514 -5.956 1.00 0.00 C ATOM 0 H VAL A 35 -17.453 -6.182 -5.863 1.00 0.00 H new ATOM 0 HA VAL A 35 -16.119 -4.587 -7.706 1.00 0.00 H new ATOM 0 HB VAL A 35 -16.187 -4.779 -4.692 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -15.315 -2.472 -4.726 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -14.140 -3.587 -5.463 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -15.148 -2.546 -6.496 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -17.763 -2.812 -5.158 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -17.423 -2.973 -6.897 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -18.320 -4.252 -6.044 1.00 0.00 H new ATOM 526 N MET A 36 -14.117 -6.517 -6.063 1.00 0.00 N ATOM 527 CA MET A 36 -12.837 -7.156 -6.059 1.00 0.00 C ATOM 528 C MET A 36 -12.746 -8.002 -7.282 1.00 0.00 C ATOM 529 O MET A 36 -11.687 -8.184 -7.882 1.00 0.00 O ATOM 530 CB MET A 36 -12.558 -7.910 -4.747 1.00 0.00 C ATOM 531 CG MET A 36 -12.608 -6.982 -3.532 1.00 0.00 C ATOM 532 SD MET A 36 -11.466 -5.577 -3.694 1.00 0.00 S ATOM 533 CE MET A 36 -11.722 -4.986 -1.996 1.00 0.00 C ATOM 0 H MET A 36 -14.696 -6.819 -5.279 1.00 0.00 H new ATOM 0 HA MET A 36 -12.042 -6.411 -6.094 1.00 0.00 H new ATOM 0 HB2 MET A 36 -13.290 -8.708 -4.624 1.00 0.00 H new ATOM 0 HB3 MET A 36 -11.578 -8.383 -4.802 1.00 0.00 H new ATOM 0 HG2 MET A 36 -13.624 -6.609 -3.403 1.00 0.00 H new ATOM 0 HG3 MET A 36 -12.360 -7.548 -2.634 1.00 0.00 H new ATOM 0 HE1 MET A 36 -11.114 -4.098 -1.824 1.00 0.00 H new ATOM 0 HE2 MET A 36 -12.774 -4.740 -1.851 1.00 0.00 H new ATOM 0 HE3 MET A 36 -11.432 -5.766 -1.292 1.00 0.00 H new ATOM 543 N ARG A 37 -13.825 -8.617 -7.796 1.00 0.00 N ATOM 544 CA ARG A 37 -13.755 -9.524 -8.899 1.00 0.00 C ATOM 545 C ARG A 37 -13.528 -8.827 -10.196 1.00 0.00 C ATOM 546 O ARG A 37 -12.843 -9.273 -11.115 1.00 0.00 O ATOM 547 CB ARG A 37 -14.941 -10.498 -9.006 1.00 0.00 C ATOM 548 CG ARG A 37 -15.124 -11.586 -7.946 1.00 0.00 C ATOM 549 CD ARG A 37 -14.191 -12.798 -7.960 1.00 0.00 C ATOM 550 NE ARG A 37 -14.536 -13.666 -6.799 1.00 0.00 N ATOM 551 CZ ARG A 37 -13.694 -14.694 -6.486 1.00 0.00 C ATOM 552 NH1 ARG A 37 -12.558 -14.967 -7.192 1.00 0.00 N ATOM 553 NH2 ARG A 37 -13.992 -15.368 -5.337 1.00 0.00 N ATOM 0 H ARG A 37 -14.770 -8.481 -7.436 1.00 0.00 H new ATOM 0 HA ARG A 37 -12.882 -10.138 -8.678 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -15.853 -9.901 -9.021 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -14.869 -10.994 -9.974 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -15.033 -11.112 -6.969 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -16.146 -11.956 -8.027 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -14.300 -13.351 -8.893 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -13.151 -12.478 -7.899 1.00 0.00 H new ATOM 0 HE ARG A 37 -15.380 -13.496 -6.252 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -12.305 -14.390 -7.995 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -11.962 -15.748 -6.917 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -14.799 -15.091 -4.778 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -13.408 -16.149 -5.038 1.00 0.00 H new ATOM 567 N SER A 38 -14.110 -7.617 -10.278 1.00 0.00 N ATOM 568 CA SER A 38 -14.092 -6.809 -11.458 1.00 0.00 C ATOM 569 C SER A 38 -12.797 -6.088 -11.609 1.00 0.00 C ATOM 570 O SER A 38 -12.530 -5.361 -12.565 1.00 0.00 O ATOM 571 CB SER A 38 -15.162 -5.707 -11.392 1.00 0.00 C ATOM 572 OG SER A 38 -16.463 -6.256 -11.235 1.00 0.00 O ATOM 0 H SER A 38 -14.609 -7.187 -9.499 1.00 0.00 H new ATOM 0 HA SER A 38 -14.266 -7.496 -12.286 1.00 0.00 H new ATOM 0 HB2 SER A 38 -14.945 -5.037 -10.560 1.00 0.00 H new ATOM 0 HB3 SER A 38 -15.126 -5.108 -12.302 1.00 0.00 H new ATOM 0 HG SER A 38 -16.668 -6.344 -10.281 1.00 0.00 H new ATOM 578 N LEU A 39 -11.872 -6.251 -10.646 1.00 0.00 N ATOM 579 CA LEU A 39 -10.510 -5.815 -10.629 1.00 0.00 C ATOM 580 C LEU A 39 -9.584 -6.884 -11.098 1.00 0.00 C ATOM 581 O LEU A 39 -8.389 -6.705 -11.330 1.00 0.00 O ATOM 582 CB LEU A 39 -10.064 -5.271 -9.261 1.00 0.00 C ATOM 583 CG LEU A 39 -10.832 -4.076 -8.673 1.00 0.00 C ATOM 584 CD1 LEU A 39 -10.363 -3.834 -7.229 1.00 0.00 C ATOM 585 CD2 LEU A 39 -10.699 -2.865 -9.612 1.00 0.00 C ATOM 0 H LEU A 39 -12.109 -6.744 -9.785 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.459 -4.982 -11.330 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -10.119 -6.089 -8.543 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -9.015 -4.987 -9.341 1.00 0.00 H new ATOM 0 HG LEU A 39 -11.901 -4.277 -8.609 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -10.905 -2.987 -6.808 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -10.557 -4.724 -6.630 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.294 -3.619 -7.225 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -11.244 -2.019 -9.194 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -9.647 -2.602 -9.719 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -11.112 -3.115 -10.589 1.00 0.00 H new ATOM 597 N GLY A 40 -10.047 -8.136 -11.259 1.00 0.00 N ATOM 598 CA GLY A 40 -9.173 -9.249 -11.464 1.00 0.00 C ATOM 599 C GLY A 40 -8.537 -9.860 -10.264 1.00 0.00 C ATOM 600 O GLY A 40 -7.462 -10.456 -10.207 1.00 0.00 O ATOM 0 H GLY A 40 -11.038 -8.379 -11.247 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -9.737 -10.028 -11.978 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.379 -8.932 -12.140 1.00 0.00 H new ATOM 604 N GLN A 41 -9.189 -9.559 -9.127 1.00 0.00 N ATOM 605 CA GLN A 41 -8.802 -10.169 -7.893 1.00 0.00 C ATOM 606 C GLN A 41 -9.369 -11.531 -7.687 1.00 0.00 C ATOM 607 O GLN A 41 -10.298 -12.052 -8.303 1.00 0.00 O ATOM 608 CB GLN A 41 -8.903 -9.273 -6.647 1.00 0.00 C ATOM 609 CG GLN A 41 -8.188 -7.924 -6.747 1.00 0.00 C ATOM 610 CD GLN A 41 -6.780 -7.993 -7.321 1.00 0.00 C ATOM 611 OE1 GLN A 41 -6.556 -7.481 -8.417 1.00 0.00 O ATOM 612 NE2 GLN A 41 -5.838 -8.654 -6.597 1.00 0.00 N ATOM 0 H GLN A 41 -9.970 -8.906 -9.061 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.729 -10.311 -8.021 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.957 -9.091 -6.436 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -8.496 -9.818 -5.795 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.786 -7.256 -7.367 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.139 -7.479 -5.753 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -6.081 -9.059 -5.693 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -4.888 -8.745 -6.958 1.00 0.00 H new ATOM 621 N ASN A 42 -8.889 -12.192 -6.619 1.00 0.00 N ATOM 622 CA ASN A 42 -9.293 -13.469 -6.117 1.00 0.00 C ATOM 623 C ASN A 42 -9.650 -13.315 -4.678 1.00 0.00 C ATOM 624 O ASN A 42 -8.822 -13.695 -3.852 1.00 0.00 O ATOM 625 CB ASN A 42 -8.126 -14.466 -6.204 1.00 0.00 C ATOM 626 CG ASN A 42 -7.660 -14.504 -7.653 1.00 0.00 C ATOM 627 OD1 ASN A 42 -6.711 -13.787 -7.965 1.00 0.00 O ATOM 628 ND2 ASN A 42 -8.398 -15.251 -8.517 1.00 0.00 N ATOM 0 H ASN A 42 -8.143 -11.790 -6.052 1.00 0.00 H new ATOM 0 HA ASN A 42 -10.136 -13.834 -6.703 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -7.311 -14.160 -5.548 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -8.443 -15.456 -5.878 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -8.179 -15.244 -9.513 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -9.171 -15.819 -8.169 1.00 0.00 H new ATOM 635 N PRO A 43 -10.793 -12.818 -4.308 1.00 0.00 N ATOM 636 CA PRO A 43 -11.255 -12.872 -2.951 1.00 0.00 C ATOM 637 C PRO A 43 -11.697 -14.230 -2.524 1.00 0.00 C ATOM 638 O PRO A 43 -11.883 -15.141 -3.329 1.00 0.00 O ATOM 639 CB PRO A 43 -12.373 -11.833 -2.926 1.00 0.00 C ATOM 640 CG PRO A 43 -12.934 -11.926 -4.354 1.00 0.00 C ATOM 641 CD PRO A 43 -11.608 -11.938 -5.131 1.00 0.00 C ATOM 0 HA PRO A 43 -10.465 -12.657 -2.232 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -13.129 -12.066 -2.176 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -11.997 -10.835 -2.700 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -13.526 -12.827 -4.516 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -13.567 -11.078 -4.614 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -11.730 -12.322 -6.144 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -11.175 -10.941 -5.218 1.00 0.00 H new ATOM 649 N THR A 44 -11.847 -14.309 -1.190 1.00 0.00 N ATOM 650 CA THR A 44 -12.602 -15.298 -0.486 1.00 0.00 C ATOM 651 C THR A 44 -13.608 -14.616 0.376 1.00 0.00 C ATOM 652 O THR A 44 -13.374 -13.549 0.942 1.00 0.00 O ATOM 653 CB THR A 44 -11.831 -16.142 0.486 1.00 0.00 C ATOM 654 OG1 THR A 44 -10.910 -15.366 1.237 1.00 0.00 O ATOM 655 CG2 THR A 44 -10.882 -16.908 -0.451 1.00 0.00 C ATOM 0 H THR A 44 -11.410 -13.635 -0.561 1.00 0.00 H new ATOM 0 HA THR A 44 -12.998 -15.932 -1.279 1.00 0.00 H new ATOM 0 HB THR A 44 -12.507 -16.692 1.141 1.00 0.00 H new ATOM 0 HG1 THR A 44 -10.426 -15.946 1.861 1.00 0.00 H new ATOM 0 HG21 THR A 44 -10.249 -17.574 0.136 1.00 0.00 H new ATOM 0 HG22 THR A 44 -11.466 -17.495 -1.160 1.00 0.00 H new ATOM 0 HG23 THR A 44 -10.257 -16.199 -0.994 1.00 0.00 H new ATOM 663 N GLU A 45 -14.813 -15.197 0.515 1.00 0.00 N ATOM 664 CA GLU A 45 -15.902 -14.782 1.344 1.00 0.00 C ATOM 665 C GLU A 45 -15.512 -14.335 2.711 1.00 0.00 C ATOM 666 O GLU A 45 -16.015 -13.263 3.046 1.00 0.00 O ATOM 667 CB GLU A 45 -16.969 -15.889 1.352 1.00 0.00 C ATOM 668 CG GLU A 45 -17.550 -16.131 -0.043 1.00 0.00 C ATOM 669 CD GLU A 45 -18.244 -14.924 -0.658 1.00 0.00 C ATOM 670 OE1 GLU A 45 -19.335 -14.549 -0.150 1.00 0.00 O ATOM 671 OE2 GLU A 45 -17.807 -14.441 -1.736 1.00 0.00 O ATOM 0 H GLU A 45 -15.045 -16.042 -0.007 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.322 -13.876 0.907 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -16.530 -16.813 1.728 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.771 -15.615 2.037 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.746 -16.449 -0.707 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -18.262 -16.954 0.012 1.00 0.00 H new ATOM 678 N ALA A 46 -14.720 -15.115 3.468 1.00 0.00 N ATOM 679 CA ALA A 46 -14.401 -14.604 4.765 1.00 0.00 C ATOM 680 C ALA A 46 -13.548 -13.383 4.802 1.00 0.00 C ATOM 681 O ALA A 46 -13.631 -12.457 5.608 1.00 0.00 O ATOM 682 CB ALA A 46 -13.698 -15.754 5.507 1.00 0.00 C ATOM 0 H ALA A 46 -14.329 -16.022 3.215 1.00 0.00 H new ATOM 0 HA ALA A 46 -15.332 -14.275 5.227 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -13.426 -15.427 6.511 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -14.371 -16.609 5.573 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -12.798 -16.042 4.963 1.00 0.00 H new ATOM 688 N GLU A 47 -12.649 -13.236 3.813 1.00 0.00 N ATOM 689 CA GLU A 47 -11.759 -12.132 3.632 1.00 0.00 C ATOM 690 C GLU A 47 -12.371 -10.874 3.121 1.00 0.00 C ATOM 691 O GLU A 47 -12.002 -9.769 3.516 1.00 0.00 O ATOM 692 CB GLU A 47 -10.529 -12.423 2.755 1.00 0.00 C ATOM 693 CG GLU A 47 -9.328 -11.633 3.276 1.00 0.00 C ATOM 694 CD GLU A 47 -8.115 -11.586 2.358 1.00 0.00 C ATOM 695 OE1 GLU A 47 -8.196 -10.877 1.319 1.00 0.00 O ATOM 696 OE2 GLU A 47 -7.045 -12.101 2.781 1.00 0.00 O ATOM 0 H GLU A 47 -12.537 -13.943 3.086 1.00 0.00 H new ATOM 0 HA GLU A 47 -11.451 -11.978 4.666 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -10.307 -13.490 2.765 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.735 -12.150 1.720 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.649 -10.610 3.475 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -9.021 -12.062 4.230 1.00 0.00 H new ATOM 703 N LEU A 48 -13.375 -10.949 2.228 1.00 0.00 N ATOM 704 CA LEU A 48 -14.374 -9.982 1.895 1.00 0.00 C ATOM 705 C LEU A 48 -15.083 -9.547 3.131 1.00 0.00 C ATOM 706 O LEU A 48 -15.134 -8.343 3.378 1.00 0.00 O ATOM 707 CB LEU A 48 -15.456 -10.667 1.042 1.00 0.00 C ATOM 708 CG LEU A 48 -15.088 -10.925 -0.429 1.00 0.00 C ATOM 709 CD1 LEU A 48 -16.215 -11.528 -1.285 1.00 0.00 C ATOM 710 CD2 LEU A 48 -14.821 -9.613 -1.185 1.00 0.00 C ATOM 0 H LEU A 48 -13.497 -11.796 1.673 1.00 0.00 H new ATOM 0 HA LEU A 48 -13.891 -9.149 1.384 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -15.707 -11.621 1.506 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -16.356 -10.052 1.069 1.00 0.00 H new ATOM 0 HG LEU A 48 -14.235 -11.597 -0.331 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -15.859 -11.673 -2.305 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -16.516 -12.488 -0.866 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -17.069 -10.851 -1.291 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -14.564 -9.836 -2.221 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -15.715 -8.990 -1.159 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -13.995 -9.082 -0.712 1.00 0.00 H new ATOM 722 N GLN A 49 -15.588 -10.443 3.998 1.00 0.00 N ATOM 723 CA GLN A 49 -16.339 -10.291 5.206 1.00 0.00 C ATOM 724 C GLN A 49 -15.501 -9.598 6.225 1.00 0.00 C ATOM 725 O GLN A 49 -15.901 -8.729 6.998 1.00 0.00 O ATOM 726 CB GLN A 49 -16.975 -11.643 5.571 1.00 0.00 C ATOM 727 CG GLN A 49 -17.666 -11.638 6.936 1.00 0.00 C ATOM 728 CD GLN A 49 -17.812 -13.010 7.579 1.00 0.00 C ATOM 729 OE1 GLN A 49 -18.858 -13.575 7.896 1.00 0.00 O ATOM 730 NE2 GLN A 49 -16.652 -13.715 7.654 1.00 0.00 N ATOM 0 H GLN A 49 -15.441 -11.435 3.814 1.00 0.00 H new ATOM 0 HA GLN A 49 -17.198 -9.628 5.108 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -17.701 -11.914 4.805 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -16.204 -12.413 5.565 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -17.103 -10.993 7.611 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -18.656 -11.196 6.825 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -15.769 -13.273 7.398 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -16.665 -14.686 7.967 1.00 0.00 H new ATOM 739 N ASP A 50 -14.197 -9.915 6.318 1.00 0.00 N ATOM 740 CA ASP A 50 -13.221 -9.284 7.151 1.00 0.00 C ATOM 741 C ASP A 50 -13.010 -7.841 6.846 1.00 0.00 C ATOM 742 O ASP A 50 -13.002 -6.997 7.741 1.00 0.00 O ATOM 743 CB ASP A 50 -11.934 -10.111 6.994 1.00 0.00 C ATOM 744 CG ASP A 50 -11.032 -9.944 8.209 1.00 0.00 C ATOM 745 OD1 ASP A 50 -11.566 -9.795 9.340 1.00 0.00 O ATOM 746 OD2 ASP A 50 -9.784 -10.077 8.099 1.00 0.00 O ATOM 0 H ASP A 50 -13.795 -10.673 5.766 1.00 0.00 H new ATOM 0 HA ASP A 50 -13.565 -9.272 8.185 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -12.186 -11.163 6.865 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -11.403 -9.798 6.095 1.00 0.00 H new ATOM 751 N MET A 51 -12.811 -7.497 5.561 1.00 0.00 N ATOM 752 CA MET A 51 -12.561 -6.135 5.206 1.00 0.00 C ATOM 753 C MET A 51 -13.716 -5.233 5.481 1.00 0.00 C ATOM 754 O MET A 51 -13.507 -4.086 5.871 1.00 0.00 O ATOM 755 CB MET A 51 -12.302 -6.038 3.693 1.00 0.00 C ATOM 756 CG MET A 51 -11.786 -4.664 3.261 1.00 0.00 C ATOM 757 SD MET A 51 -11.187 -4.586 1.546 1.00 0.00 S ATOM 758 CE MET A 51 -10.088 -3.163 1.801 1.00 0.00 C ATOM 0 H MET A 51 -12.823 -8.151 4.778 1.00 0.00 H new ATOM 0 HA MET A 51 -11.707 -5.824 5.808 1.00 0.00 H new ATOM 0 HB2 MET A 51 -11.577 -6.799 3.405 1.00 0.00 H new ATOM 0 HB3 MET A 51 -13.225 -6.258 3.157 1.00 0.00 H new ATOM 0 HG2 MET A 51 -12.586 -3.934 3.386 1.00 0.00 H new ATOM 0 HG3 MET A 51 -10.977 -4.368 3.929 1.00 0.00 H new ATOM 0 HE1 MET A 51 -9.590 -2.915 0.863 1.00 0.00 H new ATOM 0 HE2 MET A 51 -10.673 -2.307 2.139 1.00 0.00 H new ATOM 0 HE3 MET A 51 -9.340 -3.411 2.554 1.00 0.00 H new ATOM 768 N ILE A 52 -14.953 -5.740 5.335 1.00 0.00 N ATOM 769 CA ILE A 52 -16.200 -5.169 5.741 1.00 0.00 C ATOM 770 C ILE A 52 -16.236 -4.952 7.215 1.00 0.00 C ATOM 771 O ILE A 52 -16.349 -3.843 7.736 1.00 0.00 O ATOM 772 CB ILE A 52 -17.342 -6.077 5.394 1.00 0.00 C ATOM 773 CG1 ILE A 52 -17.473 -6.031 3.862 1.00 0.00 C ATOM 774 CG2 ILE A 52 -18.638 -5.589 6.063 1.00 0.00 C ATOM 775 CD1 ILE A 52 -18.663 -6.842 3.351 1.00 0.00 C ATOM 0 H ILE A 52 -15.091 -6.645 4.885 1.00 0.00 H new ATOM 0 HA ILE A 52 -16.295 -4.218 5.217 1.00 0.00 H new ATOM 0 HB ILE A 52 -17.165 -7.093 5.746 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -17.579 -4.995 3.541 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -16.557 -6.412 3.411 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -19.457 -6.259 5.801 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -18.508 -5.581 7.145 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -18.869 -4.581 5.717 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -18.709 -6.775 2.264 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -18.546 -7.885 3.646 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -19.584 -6.445 3.778 1.00 0.00 H new ATOM 787 N ASN A 53 -15.968 -5.955 8.069 1.00 0.00 N ATOM 788 CA ASN A 53 -16.033 -6.003 9.497 1.00 0.00 C ATOM 789 C ASN A 53 -15.044 -5.147 10.211 1.00 0.00 C ATOM 790 O ASN A 53 -15.175 -4.798 11.383 1.00 0.00 O ATOM 791 CB ASN A 53 -15.768 -7.446 9.958 1.00 0.00 C ATOM 792 CG ASN A 53 -17.030 -8.281 9.798 1.00 0.00 C ATOM 793 OD1 ASN A 53 -18.087 -7.876 9.316 1.00 0.00 O ATOM 794 ND2 ASN A 53 -16.837 -9.575 10.166 1.00 0.00 N ATOM 0 H ASN A 53 -15.663 -6.856 7.701 1.00 0.00 H new ATOM 0 HA ASN A 53 -17.027 -5.630 9.745 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -14.957 -7.881 9.373 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -15.448 -7.451 11.000 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -17.587 -10.256 10.046 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -15.943 -9.865 10.562 1.00 0.00 H new ATOM 801 N GLU A 54 -13.976 -4.736 9.504 1.00 0.00 N ATOM 802 CA GLU A 54 -12.903 -3.868 9.878 1.00 0.00 C ATOM 803 C GLU A 54 -13.481 -2.500 10.003 1.00 0.00 C ATOM 804 O GLU A 54 -13.226 -1.930 11.063 1.00 0.00 O ATOM 805 CB GLU A 54 -11.776 -3.790 8.836 1.00 0.00 C ATOM 806 CG GLU A 54 -10.515 -2.958 9.076 1.00 0.00 C ATOM 807 CD GLU A 54 -9.340 -3.117 8.122 1.00 0.00 C ATOM 808 OE1 GLU A 54 -9.660 -3.117 6.903 1.00 0.00 O ATOM 809 OE2 GLU A 54 -8.157 -3.133 8.556 1.00 0.00 O ATOM 0 H GLU A 54 -13.854 -5.058 8.544 1.00 0.00 H new ATOM 0 HA GLU A 54 -12.467 -4.257 10.798 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -11.449 -4.813 8.648 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -12.225 -3.424 7.912 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -10.806 -1.908 9.069 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.157 -3.183 10.081 1.00 0.00 H new ATOM 816 N VAL A 55 -14.262 -2.013 9.022 1.00 0.00 N ATOM 817 CA VAL A 55 -14.757 -0.672 9.055 1.00 0.00 C ATOM 818 C VAL A 55 -16.130 -0.518 9.612 1.00 0.00 C ATOM 819 O VAL A 55 -16.588 0.595 9.867 1.00 0.00 O ATOM 820 CB VAL A 55 -14.630 -0.074 7.685 1.00 0.00 C ATOM 821 CG1 VAL A 55 -13.118 -0.072 7.401 1.00 0.00 C ATOM 822 CG2 VAL A 55 -15.404 -0.893 6.638 1.00 0.00 C ATOM 0 H VAL A 55 -14.551 -2.550 8.204 1.00 0.00 H new ATOM 0 HA VAL A 55 -14.138 -0.122 9.764 1.00 0.00 H new ATOM 0 HB VAL A 55 -15.056 0.928 7.633 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -12.934 0.351 6.414 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.607 0.528 8.154 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -12.740 -1.094 7.434 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -15.290 -0.431 5.657 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -15.011 -1.909 6.608 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -16.460 -0.920 6.906 1.00 0.00 H new ATOM 832 N ASP A 56 -16.765 -1.669 9.898 1.00 0.00 N ATOM 833 CA ASP A 56 -18.117 -1.841 10.329 1.00 0.00 C ATOM 834 C ASP A 56 -18.276 -1.323 11.717 1.00 0.00 C ATOM 835 O ASP A 56 -17.757 -1.844 12.703 1.00 0.00 O ATOM 836 CB ASP A 56 -18.625 -3.290 10.237 1.00 0.00 C ATOM 837 CG ASP A 56 -20.115 -3.422 9.958 1.00 0.00 C ATOM 838 OD1 ASP A 56 -20.787 -2.391 9.691 1.00 0.00 O ATOM 839 OD2 ASP A 56 -20.582 -4.592 9.985 1.00 0.00 O ATOM 0 H ASP A 56 -16.282 -2.564 9.819 1.00 0.00 H new ATOM 0 HA ASP A 56 -18.734 -1.266 9.638 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -18.074 -3.805 9.450 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -18.397 -3.801 11.172 1.00 0.00 H new ATOM 844 N ALA A 57 -18.950 -0.163 11.814 1.00 0.00 N ATOM 845 CA ALA A 57 -19.198 0.578 13.012 1.00 0.00 C ATOM 846 C ALA A 57 -20.397 0.113 13.764 1.00 0.00 C ATOM 847 O ALA A 57 -20.368 0.018 14.990 1.00 0.00 O ATOM 848 CB ALA A 57 -19.359 2.056 12.619 1.00 0.00 C ATOM 0 H ALA A 57 -19.351 0.290 10.993 1.00 0.00 H new ATOM 0 HA ALA A 57 -18.355 0.428 13.686 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -19.550 2.651 13.512 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -18.446 2.406 12.138 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -20.196 2.160 11.928 1.00 0.00 H new ATOM 854 N ASP A 58 -21.488 -0.128 13.015 1.00 0.00 N ATOM 855 CA ASP A 58 -22.757 -0.561 13.512 1.00 0.00 C ATOM 856 C ASP A 58 -22.875 -2.024 13.773 1.00 0.00 C ATOM 857 O ASP A 58 -23.742 -2.528 14.485 1.00 0.00 O ATOM 858 CB ASP A 58 -23.876 0.003 12.621 1.00 0.00 C ATOM 859 CG ASP A 58 -23.658 -0.231 11.133 1.00 0.00 C ATOM 860 OD1 ASP A 58 -23.205 -1.369 10.835 1.00 0.00 O ATOM 861 OD2 ASP A 58 -23.766 0.715 10.307 1.00 0.00 O ATOM 0 H ASP A 58 -21.483 -0.013 12.001 1.00 0.00 H new ATOM 0 HA ASP A 58 -22.864 -0.146 14.514 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -24.823 -0.449 12.915 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -23.965 1.074 12.801 1.00 0.00 H new ATOM 866 N GLY A 59 -22.047 -2.753 13.005 1.00 0.00 N ATOM 867 CA GLY A 59 -22.008 -4.182 12.963 1.00 0.00 C ATOM 868 C GLY A 59 -23.147 -4.898 12.322 1.00 0.00 C ATOM 869 O GLY A 59 -23.454 -6.051 12.620 1.00 0.00 O ATOM 0 H GLY A 59 -21.367 -2.322 12.379 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -21.096 -4.475 12.444 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -21.922 -4.543 13.988 1.00 0.00 H new ATOM 873 N ASN A 60 -23.767 -4.216 11.342 1.00 0.00 N ATOM 874 CA ASN A 60 -24.834 -4.689 10.516 1.00 0.00 C ATOM 875 C ASN A 60 -24.392 -5.718 9.533 1.00 0.00 C ATOM 876 O ASN A 60 -25.164 -6.522 9.013 1.00 0.00 O ATOM 877 CB ASN A 60 -25.818 -3.648 9.954 1.00 0.00 C ATOM 878 CG ASN A 60 -25.240 -2.634 8.978 1.00 0.00 C ATOM 879 OD1 ASN A 60 -24.101 -2.720 8.522 1.00 0.00 O ATOM 880 ND2 ASN A 60 -25.997 -1.557 8.637 1.00 0.00 N ATOM 0 H ASN A 60 -23.500 -3.259 11.111 1.00 0.00 H new ATOM 0 HA ASN A 60 -25.480 -5.196 11.232 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -26.630 -4.178 9.456 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -26.258 -3.106 10.791 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -25.617 -0.843 8.016 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -26.945 -1.463 9.002 1.00 0.00 H new ATOM 887 N GLY A 61 -23.071 -5.736 9.283 1.00 0.00 N ATOM 888 CA GLY A 61 -22.365 -6.608 8.396 1.00 0.00 C ATOM 889 C GLY A 61 -22.218 -6.106 7.001 1.00 0.00 C ATOM 890 O GLY A 61 -21.668 -6.751 6.110 1.00 0.00 O ATOM 0 H GLY A 61 -22.441 -5.080 9.745 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -21.372 -6.792 8.806 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -22.881 -7.568 8.368 1.00 0.00 H new ATOM 894 N THR A 62 -22.697 -4.881 6.722 1.00 0.00 N ATOM 895 CA THR A 62 -22.636 -4.357 5.393 1.00 0.00 C ATOM 896 C THR A 62 -21.757 -3.160 5.512 1.00 0.00 C ATOM 897 O THR A 62 -21.716 -2.548 6.578 1.00 0.00 O ATOM 898 CB THR A 62 -23.945 -3.813 4.903 1.00 0.00 C ATOM 899 OG1 THR A 62 -24.612 -2.962 5.824 1.00 0.00 O ATOM 900 CG2 THR A 62 -24.787 -5.075 4.650 1.00 0.00 C ATOM 0 H THR A 62 -23.123 -4.258 7.409 1.00 0.00 H new ATOM 0 HA THR A 62 -22.314 -5.149 4.717 1.00 0.00 H new ATOM 0 HB THR A 62 -23.789 -3.182 4.028 1.00 0.00 H new ATOM 0 HG1 THR A 62 -24.129 -2.960 6.677 1.00 0.00 H new ATOM 0 HG21 THR A 62 -25.773 -4.787 4.286 1.00 0.00 H new ATOM 0 HG22 THR A 62 -24.293 -5.699 3.905 1.00 0.00 H new ATOM 0 HG23 THR A 62 -24.893 -5.634 5.580 1.00 0.00 H new ATOM 908 N ILE A 63 -21.068 -2.699 4.452 1.00 0.00 N ATOM 909 CA ILE A 63 -20.439 -1.423 4.310 1.00 0.00 C ATOM 910 C ILE A 63 -21.552 -0.494 3.967 1.00 0.00 C ATOM 911 O ILE A 63 -22.075 -0.519 2.854 1.00 0.00 O ATOM 912 CB ILE A 63 -19.326 -1.374 3.305 1.00 0.00 C ATOM 913 CG1 ILE A 63 -18.343 -2.555 3.242 1.00 0.00 C ATOM 914 CG2 ILE A 63 -18.435 -0.145 3.552 1.00 0.00 C ATOM 915 CD1 ILE A 63 -17.831 -2.629 1.804 1.00 0.00 C ATOM 0 H ILE A 63 -20.941 -3.274 3.619 1.00 0.00 H new ATOM 0 HA ILE A 63 -19.926 -1.151 5.232 1.00 0.00 H new ATOM 0 HB ILE A 63 -19.889 -1.372 2.372 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -17.518 -2.408 3.939 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -18.837 -3.485 3.524 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -17.632 -0.124 2.815 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -19.033 0.762 3.463 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -18.007 -0.201 4.553 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -17.127 -3.456 1.711 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -18.670 -2.788 1.127 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -17.330 -1.695 1.548 1.00 0.00 H new ATOM 927 N ASP A 64 -22.045 0.344 4.897 1.00 0.00 N ATOM 928 CA ASP A 64 -22.761 1.552 4.628 1.00 0.00 C ATOM 929 C ASP A 64 -21.879 2.653 4.148 1.00 0.00 C ATOM 930 O ASP A 64 -20.699 2.630 4.496 1.00 0.00 O ATOM 931 CB ASP A 64 -23.667 1.921 5.815 1.00 0.00 C ATOM 932 CG ASP A 64 -24.422 0.767 6.458 1.00 0.00 C ATOM 933 OD1 ASP A 64 -23.816 -0.260 6.865 1.00 0.00 O ATOM 934 OD2 ASP A 64 -25.674 0.888 6.539 1.00 0.00 O ATOM 0 H ASP A 64 -21.937 0.167 5.896 1.00 0.00 H new ATOM 0 HA ASP A 64 -23.428 1.375 3.784 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -23.055 2.400 6.579 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -24.392 2.661 5.477 1.00 0.00 H new ATOM 939 N PHE A 65 -22.472 3.669 3.497 1.00 0.00 N ATOM 940 CA PHE A 65 -21.751 4.807 3.016 1.00 0.00 C ATOM 941 C PHE A 65 -20.761 5.493 3.894 1.00 0.00 C ATOM 942 O PHE A 65 -19.619 5.538 3.441 1.00 0.00 O ATOM 943 CB PHE A 65 -22.670 5.732 2.201 1.00 0.00 C ATOM 944 CG PHE A 65 -21.912 6.856 1.582 1.00 0.00 C ATOM 945 CD1 PHE A 65 -21.047 6.665 0.530 1.00 0.00 C ATOM 946 CD2 PHE A 65 -22.049 8.121 2.101 1.00 0.00 C ATOM 947 CE1 PHE A 65 -20.316 7.655 -0.083 1.00 0.00 C ATOM 948 CE2 PHE A 65 -21.350 9.137 1.492 1.00 0.00 C ATOM 949 CZ PHE A 65 -20.430 8.896 0.499 1.00 0.00 C ATOM 0 H PHE A 65 -23.472 3.701 3.301 1.00 0.00 H new ATOM 0 HA PHE A 65 -21.014 4.358 2.350 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -23.167 5.155 1.421 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -23.450 6.132 2.848 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.933 5.658 0.156 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -22.682 8.310 2.955 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -19.701 7.473 -0.952 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -21.529 10.155 1.803 1.00 0.00 H new ATOM 0 HZ PHE A 65 -19.784 9.697 0.170 1.00 0.00 H new ATOM 959 N PRO A 66 -20.972 5.801 5.139 1.00 0.00 N ATOM 960 CA PRO A 66 -19.934 6.371 5.948 1.00 0.00 C ATOM 961 C PRO A 66 -18.774 5.504 6.300 1.00 0.00 C ATOM 962 O PRO A 66 -17.694 6.046 6.530 1.00 0.00 O ATOM 963 CB PRO A 66 -20.664 6.837 7.205 1.00 0.00 C ATOM 964 CG PRO A 66 -21.835 5.851 7.350 1.00 0.00 C ATOM 965 CD PRO A 66 -22.219 5.653 5.875 1.00 0.00 C ATOM 0 HA PRO A 66 -19.442 7.154 5.372 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -20.011 6.811 8.077 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -21.018 7.863 7.103 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -21.535 4.919 7.829 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -22.654 6.263 7.940 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.660 4.670 5.710 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -22.956 6.391 5.556 1.00 0.00 H new ATOM 973 N GLU A 67 -18.948 4.170 6.292 1.00 0.00 N ATOM 974 CA GLU A 67 -17.904 3.205 6.440 1.00 0.00 C ATOM 975 C GLU A 67 -17.138 2.919 5.194 1.00 0.00 C ATOM 976 O GLU A 67 -16.003 2.448 5.235 1.00 0.00 O ATOM 977 CB GLU A 67 -18.368 1.884 7.078 1.00 0.00 C ATOM 978 CG GLU A 67 -19.317 2.122 8.254 1.00 0.00 C ATOM 979 CD GLU A 67 -20.366 1.031 8.418 1.00 0.00 C ATOM 980 OE1 GLU A 67 -20.892 0.484 7.413 1.00 0.00 O ATOM 981 OE2 GLU A 67 -20.775 0.721 9.569 1.00 0.00 O ATOM 0 H GLU A 67 -19.867 3.743 6.176 1.00 0.00 H new ATOM 0 HA GLU A 67 -17.222 3.699 7.131 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -18.868 1.273 6.326 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -17.500 1.321 7.420 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -18.734 2.195 9.172 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -19.819 3.080 8.118 1.00 0.00 H new ATOM 988 N PHE A 68 -17.774 3.109 4.024 1.00 0.00 N ATOM 989 CA PHE A 68 -17.194 3.187 2.719 1.00 0.00 C ATOM 990 C PHE A 68 -16.265 4.352 2.692 1.00 0.00 C ATOM 991 O PHE A 68 -15.185 4.206 2.123 1.00 0.00 O ATOM 992 CB PHE A 68 -18.300 3.353 1.663 1.00 0.00 C ATOM 993 CG PHE A 68 -17.663 3.202 0.324 1.00 0.00 C ATOM 994 CD1 PHE A 68 -17.342 1.957 -0.163 1.00 0.00 C ATOM 995 CD2 PHE A 68 -17.336 4.281 -0.464 1.00 0.00 C ATOM 996 CE1 PHE A 68 -16.782 1.762 -1.404 1.00 0.00 C ATOM 997 CE2 PHE A 68 -16.711 4.120 -1.678 1.00 0.00 C ATOM 998 CZ PHE A 68 -16.489 2.859 -2.179 1.00 0.00 C ATOM 0 H PHE A 68 -18.788 3.218 3.991 1.00 0.00 H new ATOM 0 HA PHE A 68 -16.645 2.273 2.492 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -19.080 2.605 1.803 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -18.775 4.330 1.754 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -17.538 1.094 0.456 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -17.576 5.277 -0.121 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.576 0.765 -1.763 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -16.394 4.986 -2.240 1.00 0.00 H new ATOM 0 HZ PHE A 68 -16.088 2.731 -3.173 1.00 0.00 H new ATOM 1008 N LEU A 69 -16.565 5.492 3.340 1.00 0.00 N ATOM 1009 CA LEU A 69 -15.674 6.600 3.492 1.00 0.00 C ATOM 1010 C LEU A 69 -14.485 6.372 4.361 1.00 0.00 C ATOM 1011 O LEU A 69 -13.422 6.940 4.113 1.00 0.00 O ATOM 1012 CB LEU A 69 -16.460 7.833 3.969 1.00 0.00 C ATOM 1013 CG LEU A 69 -17.524 8.435 3.036 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -18.386 9.533 3.682 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -16.987 8.786 1.638 1.00 0.00 C ATOM 0 H LEU A 69 -17.472 5.648 3.779 1.00 0.00 H new ATOM 0 HA LEU A 69 -15.250 6.759 2.500 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -16.952 7.570 4.905 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -15.738 8.617 4.197 1.00 0.00 H new ATOM 0 HG LEU A 69 -18.232 7.624 2.863 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -19.110 9.902 2.955 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -18.914 9.122 4.543 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -17.746 10.354 4.006 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -17.791 9.206 1.034 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -16.183 9.517 1.730 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -16.605 7.885 1.158 1.00 0.00 H new ATOM 1027 N THR A 70 -14.697 5.506 5.368 1.00 0.00 N ATOM 1028 CA THR A 70 -13.679 5.051 6.263 1.00 0.00 C ATOM 1029 C THR A 70 -12.764 4.150 5.508 1.00 0.00 C ATOM 1030 O THR A 70 -11.548 4.282 5.642 1.00 0.00 O ATOM 1031 CB THR A 70 -14.336 4.543 7.512 1.00 0.00 C ATOM 1032 OG1 THR A 70 -14.958 5.581 8.256 1.00 0.00 O ATOM 1033 CG2 THR A 70 -13.236 3.924 8.391 1.00 0.00 C ATOM 0 H THR A 70 -15.614 5.107 5.567 1.00 0.00 H new ATOM 0 HA THR A 70 -13.013 5.829 6.636 1.00 0.00 H new ATOM 0 HB THR A 70 -15.106 3.825 7.229 1.00 0.00 H new ATOM 0 HG1 THR A 70 -15.816 5.811 7.843 1.00 0.00 H new ATOM 0 HG21 THR A 70 -13.678 3.542 9.312 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.757 3.106 7.852 1.00 0.00 H new ATOM 0 HG23 THR A 70 -12.493 4.684 8.633 1.00 0.00 H new ATOM 1041 N MET A 71 -13.262 3.116 4.807 1.00 0.00 N ATOM 1042 CA MET A 71 -12.430 2.328 3.951 1.00 0.00 C ATOM 1043 C MET A 71 -11.593 3.047 2.950 1.00 0.00 C ATOM 1044 O MET A 71 -10.381 2.842 2.895 1.00 0.00 O ATOM 1045 CB MET A 71 -13.274 1.249 3.254 1.00 0.00 C ATOM 1046 CG MET A 71 -12.553 0.246 2.351 1.00 0.00 C ATOM 1047 SD MET A 71 -13.610 -0.937 1.462 1.00 0.00 S ATOM 1048 CE MET A 71 -14.504 -1.576 2.908 1.00 0.00 C ATOM 0 H MET A 71 -14.239 2.826 4.833 1.00 0.00 H new ATOM 0 HA MET A 71 -11.695 1.900 4.632 1.00 0.00 H new ATOM 0 HB2 MET A 71 -13.800 0.686 4.025 1.00 0.00 H new ATOM 0 HB3 MET A 71 -14.032 1.753 2.655 1.00 0.00 H new ATOM 0 HG2 MET A 71 -11.970 0.803 1.618 1.00 0.00 H new ATOM 0 HG3 MET A 71 -11.846 -0.317 2.960 1.00 0.00 H new ATOM 0 HE1 MET A 71 -14.944 -2.543 2.665 1.00 0.00 H new ATOM 0 HE2 MET A 71 -13.812 -1.691 3.742 1.00 0.00 H new ATOM 0 HE3 MET A 71 -15.294 -0.878 3.186 1.00 0.00 H new ATOM 1058 N MET A 72 -12.120 4.047 2.221 1.00 0.00 N ATOM 1059 CA MET A 72 -11.289 4.803 1.336 1.00 0.00 C ATOM 1060 C MET A 72 -10.182 5.583 1.957 1.00 0.00 C ATOM 1061 O MET A 72 -9.010 5.588 1.584 1.00 0.00 O ATOM 1062 CB MET A 72 -12.276 5.701 0.571 1.00 0.00 C ATOM 1063 CG MET A 72 -13.212 4.848 -0.287 1.00 0.00 C ATOM 1064 SD MET A 72 -12.512 3.994 -1.731 1.00 0.00 S ATOM 1065 CE MET A 72 -12.846 2.283 -1.224 1.00 0.00 C ATOM 0 H MET A 72 -13.100 4.328 2.242 1.00 0.00 H new ATOM 0 HA MET A 72 -10.723 4.121 0.701 1.00 0.00 H new ATOM 0 HB2 MET A 72 -12.858 6.296 1.275 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.728 6.400 -0.061 1.00 0.00 H new ATOM 0 HG2 MET A 72 -13.663 4.095 0.359 1.00 0.00 H new ATOM 0 HG3 MET A 72 -14.019 5.490 -0.639 1.00 0.00 H new ATOM 0 HE1 MET A 72 -12.582 1.605 -2.036 1.00 0.00 H new ATOM 0 HE2 MET A 72 -12.252 2.042 -0.342 1.00 0.00 H new ATOM 0 HE3 MET A 72 -13.905 2.173 -0.989 1.00 0.00 H new ATOM 1075 N ALA A 73 -10.510 6.355 3.008 1.00 0.00 N ATOM 1076 CA ALA A 73 -9.599 7.069 3.847 1.00 0.00 C ATOM 1077 C ALA A 73 -8.448 6.259 4.337 1.00 0.00 C ATOM 1078 O ALA A 73 -7.292 6.679 4.331 1.00 0.00 O ATOM 1079 CB ALA A 73 -10.348 7.736 5.013 1.00 0.00 C ATOM 0 H ALA A 73 -11.481 6.489 3.290 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.155 7.838 3.216 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.638 8.275 5.641 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -11.087 8.434 4.619 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.851 6.973 5.607 1.00 0.00 H new ATOM 1234 N GLU A 83 -3.353 11.822 -7.525 1.00 0.00 N ATOM 1235 CA GLU A 83 -3.233 13.230 -7.749 1.00 0.00 C ATOM 1236 C GLU A 83 -2.185 13.576 -8.751 1.00 0.00 C ATOM 1237 O GLU A 83 -2.375 14.471 -9.573 1.00 0.00 O ATOM 1238 CB GLU A 83 -2.915 13.995 -6.454 1.00 0.00 C ATOM 1239 CG GLU A 83 -4.078 14.243 -5.491 1.00 0.00 C ATOM 1240 CD GLU A 83 -3.739 15.412 -4.578 1.00 0.00 C ATOM 1241 OE1 GLU A 83 -3.161 16.427 -5.051 1.00 0.00 O ATOM 1242 OE2 GLU A 83 -4.129 15.271 -3.388 1.00 0.00 O ATOM 0 HA GLU A 83 -4.207 13.530 -8.134 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -2.142 13.446 -5.917 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -2.489 14.961 -6.727 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -4.989 14.457 -6.051 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -4.271 13.349 -4.898 1.00 0.00 H new ATOM 1249 N GLU A 84 -1.224 12.656 -8.945 1.00 0.00 N ATOM 1250 CA GLU A 84 -0.168 12.968 -9.857 1.00 0.00 C ATOM 1251 C GLU A 84 -0.699 12.771 -11.235 1.00 0.00 C ATOM 1252 O GLU A 84 -0.522 13.582 -12.143 1.00 0.00 O ATOM 1253 CB GLU A 84 1.126 12.218 -9.497 1.00 0.00 C ATOM 1254 CG GLU A 84 2.316 12.757 -10.293 1.00 0.00 C ATOM 1255 CD GLU A 84 3.660 12.209 -9.834 1.00 0.00 C ATOM 1256 OE1 GLU A 84 4.061 11.043 -10.095 1.00 0.00 O ATOM 1257 OE2 GLU A 84 4.310 12.989 -9.089 1.00 0.00 O ATOM 0 H GLU A 84 -1.175 11.741 -8.497 1.00 0.00 H new ATOM 0 HA GLU A 84 0.147 14.009 -9.791 1.00 0.00 H new ATOM 0 HB2 GLU A 84 1.323 12.319 -8.430 1.00 0.00 H new ATOM 0 HB3 GLU A 84 1.001 11.154 -9.699 1.00 0.00 H new ATOM 0 HG2 GLU A 84 2.176 12.515 -11.347 1.00 0.00 H new ATOM 0 HG3 GLU A 84 2.331 13.844 -10.215 1.00 0.00 H new ATOM 1264 N ILE A 85 -1.300 11.590 -11.464 1.00 0.00 N ATOM 1265 CA ILE A 85 -1.803 11.088 -12.705 1.00 0.00 C ATOM 1266 C ILE A 85 -3.077 11.764 -13.079 1.00 0.00 C ATOM 1267 O ILE A 85 -3.273 12.021 -14.266 1.00 0.00 O ATOM 1268 CB ILE A 85 -1.856 9.592 -12.801 1.00 0.00 C ATOM 1269 CG1 ILE A 85 -3.033 9.080 -11.954 1.00 0.00 C ATOM 1270 CG2 ILE A 85 -0.502 9.017 -12.350 1.00 0.00 C ATOM 1271 CD1 ILE A 85 -2.779 7.670 -11.423 1.00 0.00 C ATOM 0 H ILE A 85 -1.447 10.924 -10.705 1.00 0.00 H new ATOM 0 HA ILE A 85 -1.065 11.352 -13.462 1.00 0.00 H new ATOM 0 HB ILE A 85 -2.025 9.264 -13.826 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -3.201 9.759 -11.118 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -3.942 9.084 -12.555 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -0.529 7.929 -12.416 1.00 0.00 H new ATOM 0 HG22 ILE A 85 0.289 9.400 -12.995 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -0.306 9.314 -11.320 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -3.634 7.345 -10.830 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -2.637 6.986 -12.260 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -1.885 7.671 -10.800 1.00 0.00 H new ATOM 1283 N ARG A 86 -3.852 12.274 -12.105 1.00 0.00 N ATOM 1284 CA ARG A 86 -4.974 13.097 -12.434 1.00 0.00 C ATOM 1285 C ARG A 86 -4.595 14.478 -12.843 1.00 0.00 C ATOM 1286 O ARG A 86 -5.236 15.054 -13.721 1.00 0.00 O ATOM 1287 CB ARG A 86 -6.004 13.181 -11.295 1.00 0.00 C ATOM 1288 CG ARG A 86 -7.327 13.865 -11.646 1.00 0.00 C ATOM 1289 CD ARG A 86 -8.290 13.961 -10.461 1.00 0.00 C ATOM 1290 NE ARG A 86 -7.974 15.128 -9.591 1.00 0.00 N ATOM 1291 CZ ARG A 86 -8.781 15.726 -8.667 1.00 0.00 C ATOM 1292 NH1 ARG A 86 -10.039 15.292 -8.366 1.00 0.00 N ATOM 1293 NH2 ARG A 86 -8.390 16.962 -8.237 1.00 0.00 N ATOM 0 H ARG A 86 -3.706 12.121 -11.107 1.00 0.00 H new ATOM 0 HA ARG A 86 -5.428 12.598 -13.290 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -6.219 12.170 -10.949 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -5.551 13.714 -10.459 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -7.122 14.868 -12.021 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -7.809 13.315 -12.454 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -9.313 14.047 -10.828 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -8.238 13.044 -9.874 1.00 0.00 H new ATOM 0 HE ARG A 86 -7.042 15.529 -9.699 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -10.425 14.477 -8.842 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -10.594 15.783 -7.665 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -7.538 17.385 -8.606 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -8.950 17.463 -7.547 1.00 0.00 H new ATOM 1307 N GLU A 87 -3.594 15.101 -12.196 1.00 0.00 N ATOM 1308 CA GLU A 87 -3.087 16.347 -12.681 1.00 0.00 C ATOM 1309 C GLU A 87 -2.598 16.248 -14.085 1.00 0.00 C ATOM 1310 O GLU A 87 -2.751 17.085 -14.973 1.00 0.00 O ATOM 1311 CB GLU A 87 -2.084 17.050 -11.751 1.00 0.00 C ATOM 1312 CG GLU A 87 -1.650 18.472 -12.114 1.00 0.00 C ATOM 1313 CD GLU A 87 -0.961 19.221 -10.983 1.00 0.00 C ATOM 1314 OE1 GLU A 87 0.088 18.734 -10.482 1.00 0.00 O ATOM 1315 OE2 GLU A 87 -1.454 20.292 -10.539 1.00 0.00 O ATOM 0 H GLU A 87 -3.142 14.750 -11.352 1.00 0.00 H new ATOM 0 HA GLU A 87 -3.951 17.011 -12.683 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -2.517 17.077 -10.751 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.189 16.431 -11.694 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -0.975 18.427 -12.969 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -2.526 19.038 -12.429 1.00 0.00 H new ATOM 1322 N ALA A 88 -1.951 15.115 -14.415 1.00 0.00 N ATOM 1323 CA ALA A 88 -1.475 14.978 -15.756 1.00 0.00 C ATOM 1324 C ALA A 88 -2.503 14.725 -16.804 1.00 0.00 C ATOM 1325 O ALA A 88 -2.282 15.138 -17.941 1.00 0.00 O ATOM 1326 CB ALA A 88 -0.380 13.897 -15.759 1.00 0.00 C ATOM 0 H ALA A 88 -1.764 14.331 -13.790 1.00 0.00 H new ATOM 0 HA ALA A 88 -1.084 15.953 -16.048 1.00 0.00 H new ATOM 0 HB1 ALA A 88 0.003 13.770 -16.772 1.00 0.00 H new ATOM 0 HB2 ALA A 88 0.433 14.200 -15.099 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -0.799 12.954 -15.409 1.00 0.00 H new ATOM 1332 N PHE A 89 -3.643 14.118 -16.426 1.00 0.00 N ATOM 1333 CA PHE A 89 -4.748 13.987 -17.324 1.00 0.00 C ATOM 1334 C PHE A 89 -5.316 15.220 -17.938 1.00 0.00 C ATOM 1335 O PHE A 89 -5.686 15.229 -19.112 1.00 0.00 O ATOM 1336 CB PHE A 89 -5.789 13.146 -16.567 1.00 0.00 C ATOM 1337 CG PHE A 89 -7.027 12.867 -17.348 1.00 0.00 C ATOM 1338 CD1 PHE A 89 -6.881 11.974 -18.383 1.00 0.00 C ATOM 1339 CD2 PHE A 89 -8.246 13.385 -16.980 1.00 0.00 C ATOM 1340 CE1 PHE A 89 -8.028 11.433 -18.915 1.00 0.00 C ATOM 1341 CE2 PHE A 89 -9.373 12.881 -17.585 1.00 0.00 C ATOM 1342 CZ PHE A 89 -9.265 11.917 -18.559 1.00 0.00 C ATOM 0 H PHE A 89 -3.799 13.719 -15.500 1.00 0.00 H new ATOM 0 HA PHE A 89 -4.382 13.509 -18.233 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -5.334 12.199 -16.276 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -6.061 13.665 -15.648 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -5.906 11.708 -18.763 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -8.316 14.166 -16.237 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -7.956 10.619 -19.621 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -10.348 13.244 -17.294 1.00 0.00 H new ATOM 0 HZ PHE A 89 -10.152 11.539 -19.045 1.00 0.00 H new ATOM 1352 N ARG A 90 -5.335 16.297 -17.132 1.00 0.00 N ATOM 1353 CA ARG A 90 -5.778 17.576 -17.591 1.00 0.00 C ATOM 1354 C ARG A 90 -4.640 18.467 -17.956 1.00 0.00 C ATOM 1355 O ARG A 90 -4.941 19.431 -18.659 1.00 0.00 O ATOM 1356 CB ARG A 90 -6.565 18.280 -16.473 1.00 0.00 C ATOM 1357 CG ARG A 90 -5.773 18.630 -15.211 1.00 0.00 C ATOM 1358 CD ARG A 90 -6.511 19.638 -14.328 1.00 0.00 C ATOM 1359 NE ARG A 90 -6.382 20.883 -15.135 1.00 0.00 N ATOM 1360 CZ ARG A 90 -6.993 22.016 -14.681 1.00 0.00 C ATOM 1361 NH1 ARG A 90 -7.502 22.018 -13.414 1.00 0.00 N ATOM 1362 NH2 ARG A 90 -7.035 23.131 -15.467 1.00 0.00 N ATOM 0 H ARG A 90 -5.041 16.280 -16.155 1.00 0.00 H new ATOM 0 HA ARG A 90 -6.394 17.400 -18.473 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -6.989 19.199 -16.878 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -7.401 17.642 -16.188 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -5.581 17.721 -14.640 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -4.803 19.039 -15.494 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -7.552 19.359 -14.167 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -6.052 19.736 -13.344 1.00 0.00 H new ATOM 0 HE ARG A 90 -5.850 20.889 -16.005 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -7.421 21.185 -12.830 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -7.963 22.852 -13.051 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -6.610 23.118 -16.394 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -7.492 23.977 -15.127 1.00 0.00 H new ATOM 1376 N VAL A 91 -3.364 18.198 -17.630 1.00 0.00 N ATOM 1377 CA VAL A 91 -2.294 18.789 -18.373 1.00 0.00 C ATOM 1378 C VAL A 91 -2.396 18.305 -19.779 1.00 0.00 C ATOM 1379 O VAL A 91 -2.396 19.080 -20.733 1.00 0.00 O ATOM 1380 CB VAL A 91 -0.978 18.367 -17.791 1.00 0.00 C ATOM 1381 CG1 VAL A 91 0.207 18.613 -18.740 1.00 0.00 C ATOM 1382 CG2 VAL A 91 -0.861 19.152 -16.473 1.00 0.00 C ATOM 0 H VAL A 91 -3.076 17.584 -16.868 1.00 0.00 H new ATOM 0 HA VAL A 91 -2.359 19.876 -18.335 1.00 0.00 H new ATOM 0 HB VAL A 91 -0.943 17.291 -17.623 1.00 0.00 H new ATOM 0 HG11 VAL A 91 1.130 18.287 -18.261 1.00 0.00 H new ATOM 0 HG12 VAL A 91 0.058 18.050 -19.662 1.00 0.00 H new ATOM 0 HG13 VAL A 91 0.274 19.676 -18.971 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.079 18.900 -15.982 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -0.885 20.221 -16.683 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -1.694 18.892 -15.819 1.00 0.00 H new ATOM 1392 N PHE A 92 -2.491 16.988 -20.034 1.00 0.00 N ATOM 1393 CA PHE A 92 -2.441 16.440 -21.354 1.00 0.00 C ATOM 1394 C PHE A 92 -3.546 16.808 -22.284 1.00 0.00 C ATOM 1395 O PHE A 92 -3.253 16.999 -23.463 1.00 0.00 O ATOM 1396 CB PHE A 92 -2.514 14.916 -21.160 1.00 0.00 C ATOM 1397 CG PHE A 92 -1.255 14.246 -20.728 1.00 0.00 C ATOM 1398 CD1 PHE A 92 -0.113 14.898 -20.327 1.00 0.00 C ATOM 1399 CD2 PHE A 92 -1.261 12.871 -20.713 1.00 0.00 C ATOM 1400 CE1 PHE A 92 1.005 14.220 -19.901 1.00 0.00 C ATOM 1401 CE2 PHE A 92 -0.120 12.203 -20.335 1.00 0.00 C ATOM 1402 CZ PHE A 92 0.994 12.846 -19.849 1.00 0.00 C ATOM 0 H PHE A 92 -2.606 16.286 -19.303 1.00 0.00 H new ATOM 0 HA PHE A 92 -1.538 16.835 -21.820 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -3.287 14.701 -20.422 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -2.836 14.466 -22.099 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -0.093 15.978 -20.347 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -2.149 12.324 -20.994 1.00 0.00 H new ATOM 0 HE1 PHE A 92 1.890 14.766 -19.608 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -0.098 11.127 -20.424 1.00 0.00 H new ATOM 0 HZ PHE A 92 1.828 12.293 -19.442 1.00 0.00 H new ATOM 1412 N ASP A 93 -4.801 16.912 -21.811 1.00 0.00 N ATOM 1413 CA ASP A 93 -5.840 17.445 -22.636 1.00 0.00 C ATOM 1414 C ASP A 93 -5.750 18.932 -22.618 1.00 0.00 C ATOM 1415 O ASP A 93 -5.560 19.576 -21.588 1.00 0.00 O ATOM 1416 CB ASP A 93 -7.212 16.810 -22.352 1.00 0.00 C ATOM 1417 CG ASP A 93 -8.117 16.874 -23.574 1.00 0.00 C ATOM 1418 OD1 ASP A 93 -7.719 16.289 -24.616 1.00 0.00 O ATOM 1419 OD2 ASP A 93 -9.232 17.462 -23.583 1.00 0.00 O ATOM 0 H ASP A 93 -5.093 16.633 -20.874 1.00 0.00 H new ATOM 0 HA ASP A 93 -5.699 17.159 -23.678 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -7.078 15.771 -22.050 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -7.688 17.326 -21.518 1.00 0.00 H new ATOM 1424 N LYS A 94 -6.023 19.524 -23.795 1.00 0.00 N ATOM 1425 CA LYS A 94 -6.056 20.945 -23.953 1.00 0.00 C ATOM 1426 C LYS A 94 -7.308 21.648 -23.556 1.00 0.00 C ATOM 1427 O LYS A 94 -7.353 22.490 -22.660 1.00 0.00 O ATOM 1428 CB LYS A 94 -5.463 21.509 -25.255 1.00 0.00 C ATOM 1429 CG LYS A 94 -5.067 22.984 -25.338 1.00 0.00 C ATOM 1430 CD LYS A 94 -4.132 23.207 -26.529 1.00 0.00 C ATOM 1431 CE LYS A 94 -3.542 24.611 -26.677 1.00 0.00 C ATOM 1432 NZ LYS A 94 -2.494 24.653 -25.633 1.00 0.00 N ATOM 0 H LYS A 94 -6.224 19.007 -24.651 1.00 0.00 H new ATOM 0 HA LYS A 94 -5.339 21.202 -23.173 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -4.575 20.921 -25.488 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -6.187 21.322 -26.049 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -5.958 23.603 -25.443 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -4.574 23.289 -24.415 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -3.309 22.497 -26.455 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -4.678 22.968 -27.442 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -3.125 24.769 -27.672 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -4.296 25.382 -26.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -2.627 25.498 -25.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.561 23.802 -25.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -1.557 24.689 -26.083 1.00 0.00 H new ATOM 1446 N ASP A 95 -8.408 21.329 -24.260 1.00 0.00 N ATOM 1447 CA ASP A 95 -9.767 21.727 -24.056 1.00 0.00 C ATOM 1448 C ASP A 95 -10.367 21.224 -22.788 1.00 0.00 C ATOM 1449 O ASP A 95 -11.186 21.876 -22.143 1.00 0.00 O ATOM 1450 CB ASP A 95 -10.479 21.204 -25.315 1.00 0.00 C ATOM 1451 CG ASP A 95 -10.273 19.749 -25.711 1.00 0.00 C ATOM 1452 OD1 ASP A 95 -9.090 19.360 -25.900 1.00 0.00 O ATOM 1453 OD2 ASP A 95 -11.193 18.935 -25.428 1.00 0.00 O ATOM 0 H ASP A 95 -8.331 20.716 -25.072 1.00 0.00 H new ATOM 0 HA ASP A 95 -9.862 22.806 -23.932 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -11.549 21.364 -25.182 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -10.166 21.824 -26.155 1.00 0.00 H new ATOM 1458 N GLY A 96 -9.983 20.004 -22.373 1.00 0.00 N ATOM 1459 CA GLY A 96 -10.404 19.347 -21.175 1.00 0.00 C ATOM 1460 C GLY A 96 -11.792 18.808 -21.197 1.00 0.00 C ATOM 1461 O GLY A 96 -12.369 18.574 -20.135 1.00 0.00 O ATOM 0 H GLY A 96 -9.331 19.437 -22.915 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -9.717 18.526 -20.970 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -10.318 20.049 -20.346 1.00 0.00 H new ATOM 1465 N ASN A 97 -12.380 18.416 -22.341 1.00 0.00 N ATOM 1466 CA ASN A 97 -13.727 17.952 -22.457 1.00 0.00 C ATOM 1467 C ASN A 97 -14.151 16.852 -21.545 1.00 0.00 C ATOM 1468 O ASN A 97 -15.284 16.887 -21.069 1.00 0.00 O ATOM 1469 CB ASN A 97 -13.886 17.466 -23.907 1.00 0.00 C ATOM 1470 CG ASN A 97 -12.960 16.352 -24.374 1.00 0.00 C ATOM 1471 OD1 ASN A 97 -11.737 16.477 -24.391 1.00 0.00 O ATOM 1472 ND2 ASN A 97 -13.528 15.173 -24.746 1.00 0.00 N ATOM 0 H ASN A 97 -11.888 18.424 -23.234 1.00 0.00 H new ATOM 0 HA ASN A 97 -14.363 18.789 -22.170 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -14.914 17.128 -24.039 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -13.744 18.322 -24.567 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -12.939 14.393 -25.039 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -14.543 15.069 -24.732 1.00 0.00 H new ATOM 1479 N GLY A 98 -13.242 15.898 -21.276 1.00 0.00 N ATOM 1480 CA GLY A 98 -13.597 14.865 -20.353 1.00 0.00 C ATOM 1481 C GLY A 98 -12.769 13.671 -20.684 1.00 0.00 C ATOM 1482 O GLY A 98 -12.275 12.982 -19.793 1.00 0.00 O ATOM 0 H GLY A 98 -12.305 15.839 -21.675 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -13.415 15.187 -19.328 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -14.659 14.630 -20.429 1.00 0.00 H new ATOM 1486 N TYR A 99 -12.493 13.366 -21.965 1.00 0.00 N ATOM 1487 CA TYR A 99 -11.667 12.268 -22.360 1.00 0.00 C ATOM 1488 C TYR A 99 -10.373 12.755 -22.917 1.00 0.00 C ATOM 1489 O TYR A 99 -10.094 13.952 -22.973 1.00 0.00 O ATOM 1490 CB TYR A 99 -12.288 11.577 -23.586 1.00 0.00 C ATOM 1491 CG TYR A 99 -13.645 11.062 -23.252 1.00 0.00 C ATOM 1492 CD1 TYR A 99 -13.858 9.905 -22.539 1.00 0.00 C ATOM 1493 CD2 TYR A 99 -14.745 11.865 -23.437 1.00 0.00 C ATOM 1494 CE1 TYR A 99 -15.117 9.482 -22.185 1.00 0.00 C ATOM 1495 CE2 TYR A 99 -16.007 11.576 -22.973 1.00 0.00 C ATOM 1496 CZ TYR A 99 -16.177 10.324 -22.430 1.00 0.00 C ATOM 1497 OH TYR A 99 -17.448 9.984 -21.920 1.00 0.00 O ATOM 0 H TYR A 99 -12.858 13.902 -22.752 1.00 0.00 H new ATOM 0 HA TYR A 99 -11.556 11.633 -21.481 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -12.352 12.281 -24.416 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -11.649 10.756 -23.913 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -13.006 9.308 -22.247 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -14.609 12.786 -23.984 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -15.270 8.516 -21.727 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -16.816 12.289 -23.032 1.00 0.00 H new ATOM 0 HH TYR A 99 -18.097 10.674 -22.172 1.00 0.00 H new ATOM 1507 N ILE A 100 -9.405 11.951 -23.390 1.00 0.00 N ATOM 1508 CA ILE A 100 -8.368 12.195 -24.345 1.00 0.00 C ATOM 1509 C ILE A 100 -8.687 11.287 -25.482 1.00 0.00 C ATOM 1510 O ILE A 100 -9.011 10.131 -25.214 1.00 0.00 O ATOM 1511 CB ILE A 100 -6.948 12.050 -23.883 1.00 0.00 C ATOM 1512 CG1 ILE A 100 -6.843 12.188 -22.355 1.00 0.00 C ATOM 1513 CG2 ILE A 100 -6.236 13.226 -24.574 1.00 0.00 C ATOM 1514 CD1 ILE A 100 -5.485 11.754 -21.803 1.00 0.00 C ATOM 0 H ILE A 100 -9.346 10.991 -23.049 1.00 0.00 H new ATOM 0 HA ILE A 100 -8.377 13.254 -24.601 1.00 0.00 H new ATOM 0 HB ILE A 100 -6.522 11.076 -24.125 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -7.026 13.226 -22.077 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -7.626 11.590 -21.888 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.180 13.220 -24.306 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -6.336 13.128 -25.655 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -6.687 14.165 -24.252 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -5.477 11.876 -20.720 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -5.309 10.707 -22.052 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.700 12.369 -22.243 1.00 0.00 H new ATOM 1526 N SER A 101 -8.649 11.675 -26.769 1.00 0.00 N ATOM 1527 CA SER A 101 -8.787 10.721 -27.826 1.00 0.00 C ATOM 1528 C SER A 101 -7.447 10.156 -28.149 1.00 0.00 C ATOM 1529 O SER A 101 -6.448 10.805 -27.843 1.00 0.00 O ATOM 1530 CB SER A 101 -9.412 11.306 -29.104 1.00 0.00 C ATOM 1531 OG SER A 101 -8.665 12.315 -29.767 1.00 0.00 O ATOM 0 H SER A 101 -8.524 12.639 -27.076 1.00 0.00 H new ATOM 0 HA SER A 101 -9.469 9.949 -27.469 1.00 0.00 H new ATOM 0 HB2 SER A 101 -9.582 10.490 -29.806 1.00 0.00 H new ATOM 0 HB3 SER A 101 -10.389 11.716 -28.850 1.00 0.00 H new ATOM 0 HG SER A 101 -8.681 13.137 -29.234 1.00 0.00 H new ATOM 1537 N ALA A 102 -7.418 8.945 -28.735 1.00 0.00 N ATOM 1538 CA ALA A 102 -6.220 8.336 -29.222 1.00 0.00 C ATOM 1539 C ALA A 102 -5.246 9.211 -29.934 1.00 0.00 C ATOM 1540 O ALA A 102 -4.058 9.176 -29.618 1.00 0.00 O ATOM 1541 CB ALA A 102 -6.516 7.047 -30.006 1.00 0.00 C ATOM 0 H ALA A 102 -8.252 8.374 -28.874 1.00 0.00 H new ATOM 0 HA ALA A 102 -5.685 8.088 -28.305 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -5.581 6.613 -30.360 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -7.023 6.334 -29.356 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -7.154 7.278 -30.859 1.00 0.00 H new ATOM 1547 N ALA A 103 -5.771 10.038 -30.856 1.00 0.00 N ATOM 1548 CA ALA A 103 -5.250 11.069 -31.698 1.00 0.00 C ATOM 1549 C ALA A 103 -4.409 11.995 -30.888 1.00 0.00 C ATOM 1550 O ALA A 103 -3.267 12.318 -31.211 1.00 0.00 O ATOM 1551 CB ALA A 103 -6.276 11.957 -32.424 1.00 0.00 C ATOM 0 H ALA A 103 -6.771 9.955 -31.039 1.00 0.00 H new ATOM 0 HA ALA A 103 -4.708 10.515 -32.465 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -5.753 12.698 -33.029 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -6.901 11.339 -33.068 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -6.902 12.465 -31.690 1.00 0.00 H new ATOM 1557 N GLU A 104 -5.036 12.623 -29.877 1.00 0.00 N ATOM 1558 CA GLU A 104 -4.408 13.592 -29.033 1.00 0.00 C ATOM 1559 C GLU A 104 -3.423 12.941 -28.125 1.00 0.00 C ATOM 1560 O GLU A 104 -2.319 13.468 -27.999 1.00 0.00 O ATOM 1561 CB GLU A 104 -5.495 14.198 -28.130 1.00 0.00 C ATOM 1562 CG GLU A 104 -6.448 15.185 -28.807 1.00 0.00 C ATOM 1563 CD GLU A 104 -7.742 15.331 -28.019 1.00 0.00 C ATOM 1564 OE1 GLU A 104 -8.411 14.265 -27.975 1.00 0.00 O ATOM 1565 OE2 GLU A 104 -8.286 16.417 -27.684 1.00 0.00 O ATOM 0 H GLU A 104 -6.013 12.451 -29.639 1.00 0.00 H new ATOM 0 HA GLU A 104 -3.909 14.333 -29.657 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.085 13.385 -27.707 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -5.008 14.705 -27.297 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -5.964 16.157 -28.899 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.671 14.843 -29.818 1.00 0.00 H new ATOM 1572 N LEU A 105 -3.753 11.785 -27.520 1.00 0.00 N ATOM 1573 CA LEU A 105 -2.980 11.029 -26.585 1.00 0.00 C ATOM 1574 C LEU A 105 -1.666 10.660 -27.183 1.00 0.00 C ATOM 1575 O LEU A 105 -0.606 10.879 -26.599 1.00 0.00 O ATOM 1576 CB LEU A 105 -3.870 9.958 -25.933 1.00 0.00 C ATOM 1577 CG LEU A 105 -3.155 8.971 -24.994 1.00 0.00 C ATOM 1578 CD1 LEU A 105 -2.868 9.515 -23.584 1.00 0.00 C ATOM 1579 CD2 LEU A 105 -3.903 7.633 -24.862 1.00 0.00 C ATOM 0 H LEU A 105 -4.651 11.338 -27.707 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.653 11.600 -25.716 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -4.656 10.460 -25.370 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -4.358 9.388 -26.724 1.00 0.00 H new ATOM 0 HG LEU A 105 -2.195 8.813 -25.486 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -2.363 8.750 -22.995 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.231 10.397 -23.657 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.807 9.785 -23.100 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -3.355 6.975 -24.188 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -4.901 7.812 -24.462 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -3.984 7.163 -25.842 1.00 0.00 H new ATOM 1591 N ARG A 106 -1.723 10.142 -28.423 1.00 0.00 N ATOM 1592 CA ARG A 106 -0.523 9.622 -29.001 1.00 0.00 C ATOM 1593 C ARG A 106 0.502 10.657 -29.316 1.00 0.00 C ATOM 1594 O ARG A 106 1.710 10.461 -29.193 1.00 0.00 O ATOM 1595 CB ARG A 106 -0.647 8.795 -30.292 1.00 0.00 C ATOM 1596 CG ARG A 106 -1.427 9.453 -31.432 1.00 0.00 C ATOM 1597 CD ARG A 106 -1.637 8.446 -32.564 1.00 0.00 C ATOM 1598 NE ARG A 106 -0.299 8.203 -33.173 1.00 0.00 N ATOM 1599 CZ ARG A 106 -0.150 7.284 -34.171 1.00 0.00 C ATOM 1600 NH1 ARG A 106 -1.216 6.975 -34.966 1.00 0.00 N ATOM 1601 NH2 ARG A 106 1.100 6.887 -34.549 1.00 0.00 N ATOM 0 H ARG A 106 -2.559 10.083 -29.004 1.00 0.00 H new ATOM 0 HA ARG A 106 -0.229 8.964 -28.183 1.00 0.00 H new ATOM 0 HB2 ARG A 106 0.356 8.563 -30.650 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -1.126 7.847 -30.049 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -2.390 9.810 -31.067 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -0.884 10.322 -31.802 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -2.063 7.518 -32.183 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -2.335 8.836 -33.305 1.00 0.00 H new ATOM 0 HE ARG A 106 0.511 8.727 -32.842 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -2.116 7.430 -34.812 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -1.113 6.289 -35.714 1.00 0.00 H new ATOM 0 HH21 ARG A 106 1.921 7.277 -34.086 1.00 0.00 H new ATOM 0 HH22 ARG A 106 1.213 6.200 -35.295 1.00 0.00 H new ATOM 1615 N HIS A 107 0.069 11.864 -29.723 1.00 0.00 N ATOM 1616 CA HIS A 107 0.948 12.982 -29.875 1.00 0.00 C ATOM 1617 C HIS A 107 1.560 13.340 -28.565 1.00 0.00 C ATOM 1618 O HIS A 107 2.736 13.650 -28.377 1.00 0.00 O ATOM 1619 CB HIS A 107 0.165 14.154 -30.491 1.00 0.00 C ATOM 1620 CG HIS A 107 1.056 15.361 -30.467 1.00 0.00 C ATOM 1621 ND1 HIS A 107 2.192 15.502 -31.238 1.00 0.00 N ATOM 1622 CD2 HIS A 107 0.936 16.541 -29.803 1.00 0.00 C ATOM 1623 CE1 HIS A 107 2.686 16.741 -30.970 1.00 0.00 C ATOM 1624 NE2 HIS A 107 1.978 17.404 -30.074 1.00 0.00 N ATOM 0 H HIS A 107 -0.905 12.067 -29.950 1.00 0.00 H new ATOM 0 HA HIS A 107 1.767 12.728 -30.548 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -0.134 13.919 -31.513 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -0.749 14.342 -29.927 1.00 0.00 H new ATOM 0 HD2 HIS A 107 0.118 16.776 -29.139 1.00 0.00 H new ATOM 0 HE1 HIS A 107 3.570 17.143 -31.443 1.00 0.00 H new ATOM 0 HE2 HIS A 107 2.157 18.327 -29.679 1.00 0.00 H new ATOM 1632 N VAL A 108 0.749 13.474 -27.500 1.00 0.00 N ATOM 1633 CA VAL A 108 1.279 13.718 -26.195 1.00 0.00 C ATOM 1634 C VAL A 108 2.340 12.806 -25.682 1.00 0.00 C ATOM 1635 O VAL A 108 3.356 13.253 -25.152 1.00 0.00 O ATOM 1636 CB VAL A 108 0.198 13.923 -25.175 1.00 0.00 C ATOM 1637 CG1 VAL A 108 0.802 14.216 -23.791 1.00 0.00 C ATOM 1638 CG2 VAL A 108 -0.721 15.121 -25.463 1.00 0.00 C ATOM 0 H VAL A 108 -0.268 13.414 -27.542 1.00 0.00 H new ATOM 0 HA VAL A 108 1.825 14.648 -26.355 1.00 0.00 H new ATOM 0 HB VAL A 108 -0.375 12.996 -25.211 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -0.000 14.361 -23.067 1.00 0.00 H new ATOM 0 HG12 VAL A 108 1.424 13.376 -23.480 1.00 0.00 H new ATOM 0 HG13 VAL A 108 1.411 15.118 -23.843 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -1.474 15.199 -24.679 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -0.129 16.036 -25.489 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -1.213 14.979 -26.425 1.00 0.00 H new ATOM 1648 N MET A 109 2.134 11.483 -25.806 1.00 0.00 N ATOM 1649 CA MET A 109 3.061 10.533 -25.274 1.00 0.00 C ATOM 1650 C MET A 109 4.253 10.530 -26.168 1.00 0.00 C ATOM 1651 O MET A 109 5.289 10.438 -25.510 1.00 0.00 O ATOM 1652 CB MET A 109 2.659 9.078 -24.980 1.00 0.00 C ATOM 1653 CG MET A 109 1.549 8.833 -23.956 1.00 0.00 C ATOM 1654 SD MET A 109 2.173 9.174 -22.283 1.00 0.00 S ATOM 1655 CE MET A 109 0.571 8.834 -21.498 1.00 0.00 C ATOM 0 H MET A 109 1.327 11.071 -26.274 1.00 0.00 H new ATOM 0 HA MET A 109 3.204 10.902 -24.258 1.00 0.00 H new ATOM 0 HB2 MET A 109 2.353 8.619 -25.920 1.00 0.00 H new ATOM 0 HB3 MET A 109 3.549 8.547 -24.641 1.00 0.00 H new ATOM 0 HG2 MET A 109 0.693 9.472 -24.173 1.00 0.00 H new ATOM 0 HG3 MET A 109 1.201 7.802 -24.022 1.00 0.00 H new ATOM 0 HE1 MET A 109 0.658 8.971 -20.420 1.00 0.00 H new ATOM 0 HE2 MET A 109 -0.180 9.519 -21.891 1.00 0.00 H new ATOM 0 HE3 MET A 109 0.272 7.808 -21.711 1.00 0.00 H new ATOM 1665 N THR A 110 4.112 10.785 -27.481 1.00 0.00 N ATOM 1666 CA THR A 110 5.177 10.794 -28.435 1.00 0.00 C ATOM 1667 C THR A 110 6.009 12.024 -28.312 1.00 0.00 C ATOM 1668 O THR A 110 7.228 11.873 -28.366 1.00 0.00 O ATOM 1669 CB THR A 110 4.703 10.730 -29.856 1.00 0.00 C ATOM 1670 OG1 THR A 110 3.990 9.521 -30.073 1.00 0.00 O ATOM 1671 CG2 THR A 110 5.798 10.807 -30.933 1.00 0.00 C ATOM 0 H THR A 110 3.206 10.996 -27.899 1.00 0.00 H new ATOM 0 HA THR A 110 5.756 9.899 -28.207 1.00 0.00 H new ATOM 0 HB THR A 110 4.085 11.621 -29.967 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.100 9.589 -29.669 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.341 10.751 -31.921 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.339 11.748 -30.836 1.00 0.00 H new ATOM 0 HG23 THR A 110 6.492 9.976 -30.807 1.00 0.00 H new ATOM 1679 N ASN A 111 5.458 13.214 -28.012 1.00 0.00 N ATOM 1680 CA ASN A 111 6.280 14.374 -27.851 1.00 0.00 C ATOM 1681 C ASN A 111 7.024 14.267 -26.565 1.00 0.00 C ATOM 1682 O ASN A 111 8.220 14.528 -26.441 1.00 0.00 O ATOM 1683 CB ASN A 111 5.502 15.678 -28.092 1.00 0.00 C ATOM 1684 CG ASN A 111 6.309 16.815 -28.703 1.00 0.00 C ATOM 1685 OD1 ASN A 111 7.041 17.554 -28.046 1.00 0.00 O ATOM 1686 ND2 ASN A 111 6.322 16.767 -30.062 1.00 0.00 N ATOM 0 H ASN A 111 4.459 13.373 -27.882 1.00 0.00 H new ATOM 0 HA ASN A 111 7.042 14.419 -28.630 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.657 15.462 -28.746 1.00 0.00 H new ATOM 0 HB3 ASN A 111 5.090 16.017 -27.141 1.00 0.00 H new ATOM 0 HD21 ASN A 111 6.961 17.363 -30.587 1.00 0.00 H new ATOM 0 HD22 ASN A 111 5.692 16.135 -30.556 1.00 0.00 H new ATOM 1693 N LEU A 112 6.424 13.835 -25.441 1.00 0.00 N ATOM 1694 CA LEU A 112 6.799 13.682 -24.070 1.00 0.00 C ATOM 1695 C LEU A 112 8.012 12.824 -23.957 1.00 0.00 C ATOM 1696 O LEU A 112 9.052 13.300 -23.505 1.00 0.00 O ATOM 1697 CB LEU A 112 5.717 13.273 -23.056 1.00 0.00 C ATOM 1698 CG LEU A 112 6.027 13.386 -21.554 1.00 0.00 C ATOM 1699 CD1 LEU A 112 6.291 14.827 -21.085 1.00 0.00 C ATOM 1700 CD2 LEU A 112 4.897 12.774 -20.709 1.00 0.00 C ATOM 0 H LEU A 112 5.456 13.526 -25.531 1.00 0.00 H new ATOM 0 HA LEU A 112 7.010 14.705 -23.758 1.00 0.00 H new ATOM 0 HB2 LEU A 112 4.832 13.877 -23.256 1.00 0.00 H new ATOM 0 HB3 LEU A 112 5.449 12.237 -23.260 1.00 0.00 H new ATOM 0 HG LEU A 112 6.950 12.825 -21.406 1.00 0.00 H new ATOM 0 HD11 LEU A 112 6.502 14.829 -20.016 1.00 0.00 H new ATOM 0 HD12 LEU A 112 7.146 15.234 -21.624 1.00 0.00 H new ATOM 0 HD13 LEU A 112 5.412 15.441 -21.282 1.00 0.00 H new ATOM 0 HD21 LEU A 112 5.142 12.867 -19.651 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.964 13.300 -20.913 1.00 0.00 H new ATOM 0 HD23 LEU A 112 4.782 11.720 -20.963 1.00 0.00 H new ATOM 1712 N GLY A 113 7.920 11.555 -24.394 1.00 0.00 N ATOM 1713 CA GLY A 113 8.802 10.588 -23.820 1.00 0.00 C ATOM 1714 C GLY A 113 9.026 9.593 -24.906 1.00 0.00 C ATOM 1715 O GLY A 113 9.900 9.667 -25.768 1.00 0.00 O ATOM 0 H GLY A 113 7.274 11.211 -25.104 1.00 0.00 H new ATOM 0 HA2 GLY A 113 9.739 11.045 -23.502 1.00 0.00 H new ATOM 0 HA3 GLY A 113 8.360 10.121 -22.940 1.00 0.00 H new ATOM 1719 N GLU A 114 8.339 8.440 -24.813 1.00 0.00 N ATOM 1720 CA GLU A 114 8.361 7.272 -25.637 1.00 0.00 C ATOM 1721 C GLU A 114 7.717 7.502 -26.960 1.00 0.00 C ATOM 1722 O GLU A 114 6.550 7.885 -27.041 1.00 0.00 O ATOM 1723 CB GLU A 114 7.780 6.046 -24.911 1.00 0.00 C ATOM 1724 CG GLU A 114 8.373 5.858 -23.514 1.00 0.00 C ATOM 1725 CD GLU A 114 7.605 4.797 -22.737 1.00 0.00 C ATOM 1726 OE1 GLU A 114 7.680 3.624 -23.191 1.00 0.00 O ATOM 1727 OE2 GLU A 114 7.070 5.117 -21.643 1.00 0.00 O ATOM 0 H GLU A 114 7.675 8.316 -24.048 1.00 0.00 H new ATOM 0 HA GLU A 114 9.409 7.050 -25.840 1.00 0.00 H new ATOM 0 HB2 GLU A 114 6.698 6.154 -24.832 1.00 0.00 H new ATOM 0 HB3 GLU A 114 7.969 5.152 -25.506 1.00 0.00 H new ATOM 0 HG2 GLU A 114 9.421 5.568 -23.595 1.00 0.00 H new ATOM 0 HG3 GLU A 114 8.345 6.803 -22.972 1.00 0.00 H new ATOM 1734 N LYS A 115 8.415 7.442 -28.108 1.00 0.00 N ATOM 1735 CA LYS A 115 7.918 7.771 -29.408 1.00 0.00 C ATOM 1736 C LYS A 115 7.056 6.680 -29.942 1.00 0.00 C ATOM 1737 O LYS A 115 7.541 5.551 -29.998 1.00 0.00 O ATOM 1738 CB LYS A 115 8.994 8.240 -30.403 1.00 0.00 C ATOM 1739 CG LYS A 115 9.563 9.634 -30.128 1.00 0.00 C ATOM 1740 CD LYS A 115 10.645 9.981 -31.153 1.00 0.00 C ATOM 1741 CE LYS A 115 10.901 11.489 -31.173 1.00 0.00 C ATOM 1742 NZ LYS A 115 11.652 11.909 -29.969 1.00 0.00 N ATOM 0 H LYS A 115 9.390 7.144 -28.129 1.00 0.00 H new ATOM 0 HA LYS A 115 7.290 8.653 -29.279 1.00 0.00 H new ATOM 0 HB2 LYS A 115 9.813 7.521 -30.395 1.00 0.00 H new ATOM 0 HB3 LYS A 115 8.569 8.228 -31.407 1.00 0.00 H new ATOM 0 HG2 LYS A 115 8.764 10.374 -30.169 1.00 0.00 H new ATOM 0 HG3 LYS A 115 9.981 9.671 -29.122 1.00 0.00 H new ATOM 0 HD2 LYS A 115 11.567 9.453 -30.910 1.00 0.00 H new ATOM 0 HD3 LYS A 115 10.337 9.645 -32.143 1.00 0.00 H new ATOM 0 HE2 LYS A 115 11.462 11.756 -32.069 1.00 0.00 H new ATOM 0 HE3 LYS A 115 9.952 12.023 -31.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 11.815 12.936 -30.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 11.103 11.673 -29.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 12.566 11.414 -29.940 1.00 0.00 H new ATOM 1756 N LEU A 116 5.776 6.957 -30.251 1.00 0.00 N ATOM 1757 CA LEU A 116 4.885 5.874 -30.531 1.00 0.00 C ATOM 1758 C LEU A 116 4.618 5.800 -31.995 1.00 0.00 C ATOM 1759 O LEU A 116 4.282 6.811 -32.610 1.00 0.00 O ATOM 1760 CB LEU A 116 3.533 6.137 -29.848 1.00 0.00 C ATOM 1761 CG LEU A 116 3.622 6.388 -28.334 1.00 0.00 C ATOM 1762 CD1 LEU A 116 2.274 6.699 -27.664 1.00 0.00 C ATOM 1763 CD2 LEU A 116 4.140 5.244 -27.445 1.00 0.00 C ATOM 0 H LEU A 116 5.370 7.891 -30.306 1.00 0.00 H new ATOM 0 HA LEU A 116 5.342 4.952 -30.172 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.064 7.000 -30.320 1.00 0.00 H new ATOM 0 HB3 LEU A 116 2.879 5.283 -30.024 1.00 0.00 H new ATOM 0 HG LEU A 116 4.327 7.218 -28.368 1.00 0.00 H new ATOM 0 HD11 LEU A 116 2.427 6.863 -26.597 1.00 0.00 H new ATOM 0 HD12 LEU A 116 1.844 7.595 -28.111 1.00 0.00 H new ATOM 0 HD13 LEU A 116 1.594 5.860 -27.808 1.00 0.00 H new ATOM 0 HD21 LEU A 116 4.147 5.567 -26.404 1.00 0.00 H new ATOM 0 HD22 LEU A 116 3.488 4.377 -27.552 1.00 0.00 H new ATOM 0 HD23 LEU A 116 5.152 4.977 -27.749 1.00 0.00 H new ATOM 1775 N THR A 117 4.629 4.574 -32.547 1.00 0.00 N ATOM 1776 CA THR A 117 4.221 4.196 -33.865 1.00 0.00 C ATOM 1777 C THR A 117 2.784 3.807 -33.829 1.00 0.00 C ATOM 1778 O THR A 117 2.140 3.699 -32.787 1.00 0.00 O ATOM 1779 CB THR A 117 5.095 3.127 -34.452 1.00 0.00 C ATOM 1780 OG1 THR A 117 5.028 2.032 -33.551 1.00 0.00 O ATOM 1781 CG2 THR A 117 6.574 3.537 -34.545 1.00 0.00 C ATOM 0 H THR A 117 4.957 3.768 -32.015 1.00 0.00 H new ATOM 0 HA THR A 117 4.338 5.050 -34.532 1.00 0.00 H new ATOM 0 HB THR A 117 4.747 2.910 -35.462 1.00 0.00 H new ATOM 0 HG1 THR A 117 5.583 1.298 -33.887 1.00 0.00 H new ATOM 0 HG21 THR A 117 7.152 2.720 -34.978 1.00 0.00 H new ATOM 0 HG22 THR A 117 6.667 4.421 -35.175 1.00 0.00 H new ATOM 0 HG23 THR A 117 6.953 3.761 -33.548 1.00 0.00 H new ATOM 1789 N ASP A 118 2.134 3.715 -35.003 1.00 0.00 N ATOM 1790 CA ASP A 118 0.798 3.211 -35.074 1.00 0.00 C ATOM 1791 C ASP A 118 0.647 1.811 -34.587 1.00 0.00 C ATOM 1792 O ASP A 118 -0.368 1.502 -33.965 1.00 0.00 O ATOM 1793 CB ASP A 118 0.363 3.398 -36.538 1.00 0.00 C ATOM 1794 CG ASP A 118 -0.055 4.814 -36.907 1.00 0.00 C ATOM 1795 OD1 ASP A 118 0.808 5.722 -37.045 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -1.280 5.078 -37.044 1.00 0.00 O ATOM 0 H ASP A 118 2.533 3.989 -35.901 1.00 0.00 H new ATOM 0 HA ASP A 118 0.147 3.761 -34.394 1.00 0.00 H new ATOM 0 HB2 ASP A 118 1.185 3.097 -37.187 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -0.469 2.724 -36.743 1.00 0.00 H new ATOM 1801 N GLU A 119 1.722 1.008 -34.682 1.00 0.00 N ATOM 1802 CA GLU A 119 1.793 -0.276 -34.056 1.00 0.00 C ATOM 1803 C GLU A 119 1.848 -0.132 -32.574 1.00 0.00 C ATOM 1804 O GLU A 119 1.100 -0.832 -31.893 1.00 0.00 O ATOM 1805 CB GLU A 119 3.047 -1.065 -34.470 1.00 0.00 C ATOM 1806 CG GLU A 119 3.282 -1.238 -35.972 1.00 0.00 C ATOM 1807 CD GLU A 119 4.002 -0.048 -36.590 1.00 0.00 C ATOM 1808 OE1 GLU A 119 3.359 0.982 -36.929 1.00 0.00 O ATOM 1809 OE2 GLU A 119 5.227 -0.109 -36.878 1.00 0.00 O ATOM 0 H GLU A 119 2.561 1.257 -35.206 1.00 0.00 H new ATOM 0 HA GLU A 119 0.900 -0.812 -34.376 1.00 0.00 H new ATOM 0 HB2 GLU A 119 3.918 -0.568 -34.044 1.00 0.00 H new ATOM 0 HB3 GLU A 119 2.992 -2.055 -34.017 1.00 0.00 H new ATOM 0 HG2 GLU A 119 3.867 -2.142 -36.143 1.00 0.00 H new ATOM 0 HG3 GLU A 119 2.324 -1.379 -36.473 1.00 0.00 H new ATOM 1816 N GLU A 120 2.734 0.751 -32.080 1.00 0.00 N ATOM 1817 CA GLU A 120 2.787 1.033 -30.679 1.00 0.00 C ATOM 1818 C GLU A 120 1.619 1.619 -29.963 1.00 0.00 C ATOM 1819 O GLU A 120 1.360 1.315 -28.799 1.00 0.00 O ATOM 1820 CB GLU A 120 3.929 1.999 -30.322 1.00 0.00 C ATOM 1821 CG GLU A 120 4.522 1.898 -28.916 1.00 0.00 C ATOM 1822 CD GLU A 120 5.409 0.662 -28.879 1.00 0.00 C ATOM 1823 OE1 GLU A 120 6.577 0.635 -29.350 1.00 0.00 O ATOM 1824 OE2 GLU A 120 4.880 -0.309 -28.275 1.00 0.00 O ATOM 0 H GLU A 120 3.409 1.266 -32.645 1.00 0.00 H new ATOM 0 HA GLU A 120 2.885 0.000 -30.344 1.00 0.00 H new ATOM 0 HB2 GLU A 120 4.735 1.847 -31.039 1.00 0.00 H new ATOM 0 HB3 GLU A 120 3.565 3.017 -30.462 1.00 0.00 H new ATOM 0 HG2 GLU A 120 5.100 2.791 -28.679 1.00 0.00 H new ATOM 0 HG3 GLU A 120 3.730 1.824 -28.171 1.00 0.00 H new ATOM 1831 N VAL A 121 0.813 2.446 -30.652 1.00 0.00 N ATOM 1832 CA VAL A 121 -0.505 2.807 -30.233 1.00 0.00 C ATOM 1833 C VAL A 121 -1.349 1.602 -29.997 1.00 0.00 C ATOM 1834 O VAL A 121 -2.038 1.492 -28.984 1.00 0.00 O ATOM 1835 CB VAL A 121 -1.126 3.781 -31.190 1.00 0.00 C ATOM 1836 CG1 VAL A 121 -2.579 4.095 -30.793 1.00 0.00 C ATOM 1837 CG2 VAL A 121 -0.415 5.144 -31.159 1.00 0.00 C ATOM 0 H VAL A 121 1.089 2.879 -31.533 1.00 0.00 H new ATOM 0 HA VAL A 121 -0.433 3.319 -29.273 1.00 0.00 H new ATOM 0 HB VAL A 121 -1.053 3.309 -32.170 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -3.005 4.803 -31.503 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -3.165 3.176 -30.801 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -2.597 4.528 -29.793 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -0.895 5.821 -31.866 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -0.477 5.564 -30.155 1.00 0.00 H new ATOM 0 HG23 VAL A 121 0.632 5.015 -31.434 1.00 0.00 H new ATOM 1847 N ASP A 122 -1.434 0.657 -30.950 1.00 0.00 N ATOM 1848 CA ASP A 122 -2.346 -0.445 -30.923 1.00 0.00 C ATOM 1849 C ASP A 122 -2.148 -1.399 -29.797 1.00 0.00 C ATOM 1850 O ASP A 122 -3.129 -1.946 -29.295 1.00 0.00 O ATOM 1851 CB ASP A 122 -2.232 -1.167 -32.277 1.00 0.00 C ATOM 1852 CG ASP A 122 -2.976 -0.613 -33.483 1.00 0.00 C ATOM 1853 OD1 ASP A 122 -3.589 0.477 -33.328 1.00 0.00 O ATOM 1854 OD2 ASP A 122 -2.973 -1.248 -34.572 1.00 0.00 O ATOM 0 H ASP A 122 -0.839 0.661 -31.778 1.00 0.00 H new ATOM 0 HA ASP A 122 -3.345 -0.043 -30.754 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -1.174 -1.210 -32.537 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -2.566 -2.194 -32.130 1.00 0.00 H new ATOM 1859 N GLU A 123 -0.880 -1.585 -29.390 1.00 0.00 N ATOM 1860 CA GLU A 123 -0.330 -2.400 -28.352 1.00 0.00 C ATOM 1861 C GLU A 123 -0.644 -1.718 -27.065 1.00 0.00 C ATOM 1862 O GLU A 123 -1.090 -2.373 -26.124 1.00 0.00 O ATOM 1863 CB GLU A 123 1.173 -2.681 -28.520 1.00 0.00 C ATOM 1864 CG GLU A 123 1.554 -3.290 -29.871 1.00 0.00 C ATOM 1865 CD GLU A 123 2.636 -4.348 -29.710 1.00 0.00 C ATOM 1866 OE1 GLU A 123 2.431 -5.483 -29.202 1.00 0.00 O ATOM 1867 OE2 GLU A 123 3.819 -3.989 -29.951 1.00 0.00 O ATOM 0 H GLU A 123 -0.131 -1.083 -29.867 1.00 0.00 H new ATOM 0 HA GLU A 123 -0.778 -3.393 -28.386 1.00 0.00 H new ATOM 0 HB2 GLU A 123 1.722 -1.749 -28.388 1.00 0.00 H new ATOM 0 HB3 GLU A 123 1.495 -3.356 -27.727 1.00 0.00 H new ATOM 0 HG2 GLU A 123 0.673 -3.734 -30.335 1.00 0.00 H new ATOM 0 HG3 GLU A 123 1.905 -2.505 -30.541 1.00 0.00 H new ATOM 1874 N MET A 124 -0.483 -0.390 -26.923 1.00 0.00 N ATOM 1875 CA MET A 124 -0.930 0.303 -25.754 1.00 0.00 C ATOM 1876 C MET A 124 -2.383 0.249 -25.426 1.00 0.00 C ATOM 1877 O MET A 124 -2.771 0.031 -24.279 1.00 0.00 O ATOM 1878 CB MET A 124 -0.694 1.789 -26.069 1.00 0.00 C ATOM 1879 CG MET A 124 -1.200 2.797 -25.035 1.00 0.00 C ATOM 1880 SD MET A 124 -0.913 4.545 -25.442 1.00 0.00 S ATOM 1881 CE MET A 124 -2.193 4.629 -26.728 1.00 0.00 C ATOM 0 H MET A 124 -0.041 0.207 -27.622 1.00 0.00 H new ATOM 0 HA MET A 124 -0.401 -0.160 -24.921 1.00 0.00 H new ATOM 0 HB2 MET A 124 0.377 1.944 -26.200 1.00 0.00 H new ATOM 0 HB3 MET A 124 -1.168 2.014 -27.025 1.00 0.00 H new ATOM 0 HG2 MET A 124 -2.271 2.645 -24.898 1.00 0.00 H new ATOM 0 HG3 MET A 124 -0.723 2.581 -24.079 1.00 0.00 H new ATOM 0 HE1 MET A 124 -2.331 5.665 -27.037 1.00 0.00 H new ATOM 0 HE2 MET A 124 -1.886 4.032 -27.587 1.00 0.00 H new ATOM 0 HE3 MET A 124 -3.132 4.240 -26.333 1.00 0.00 H new ATOM 1891 N ILE A 125 -3.162 0.411 -26.510 1.00 0.00 N ATOM 1892 CA ILE A 125 -4.586 0.284 -26.484 1.00 0.00 C ATOM 1893 C ILE A 125 -5.190 -0.998 -26.024 1.00 0.00 C ATOM 1894 O ILE A 125 -6.037 -1.111 -25.139 1.00 0.00 O ATOM 1895 CB ILE A 125 -5.246 0.816 -27.722 1.00 0.00 C ATOM 1896 CG1 ILE A 125 -5.076 2.341 -27.830 1.00 0.00 C ATOM 1897 CG2 ILE A 125 -6.736 0.458 -27.854 1.00 0.00 C ATOM 1898 CD1 ILE A 125 -5.223 2.871 -29.256 1.00 0.00 C ATOM 0 H ILE A 125 -2.790 0.637 -27.432 1.00 0.00 H new ATOM 0 HA ILE A 125 -4.822 0.939 -25.645 1.00 0.00 H new ATOM 0 HB ILE A 125 -4.732 0.319 -28.545 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -5.814 2.827 -27.192 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -4.093 2.617 -27.448 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -7.132 0.883 -28.777 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -6.849 -0.626 -27.875 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -7.284 0.863 -27.004 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -5.091 3.953 -29.257 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -4.468 2.413 -29.894 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -6.215 2.626 -29.635 1.00 0.00 H new ATOM 1910 N ARG A 126 -4.584 -2.072 -26.562 1.00 0.00 N ATOM 1911 CA ARG A 126 -4.752 -3.456 -26.246 1.00 0.00 C ATOM 1912 C ARG A 126 -4.977 -3.705 -24.794 1.00 0.00 C ATOM 1913 O ARG A 126 -5.994 -4.219 -24.330 1.00 0.00 O ATOM 1914 CB ARG A 126 -3.628 -4.347 -26.802 1.00 0.00 C ATOM 1915 CG ARG A 126 -3.872 -5.857 -26.803 1.00 0.00 C ATOM 1916 CD ARG A 126 -2.699 -6.713 -27.288 1.00 0.00 C ATOM 1917 NE ARG A 126 -1.448 -6.374 -26.553 1.00 0.00 N ATOM 1918 CZ ARG A 126 -0.180 -6.287 -27.050 1.00 0.00 C ATOM 1919 NH1 ARG A 126 0.049 -6.077 -28.380 1.00 0.00 N ATOM 1920 NH2 ARG A 126 0.861 -6.106 -26.186 1.00 0.00 N ATOM 0 H ARG A 126 -3.896 -1.951 -27.305 1.00 0.00 H new ATOM 0 HA ARG A 126 -5.668 -3.747 -26.761 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -3.426 -4.036 -27.827 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -2.724 -4.151 -26.225 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -4.131 -6.166 -25.790 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -4.737 -6.067 -27.432 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -2.932 -7.768 -27.148 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -2.550 -6.559 -28.357 1.00 0.00 H new ATOM 0 HE ARG A 126 -1.552 -6.184 -25.556 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -0.736 -5.982 -29.024 1.00 0.00 H new ATOM 0 HH12 ARG A 126 1.005 -6.015 -28.729 1.00 0.00 H new ATOM 0 HH21 ARG A 126 0.686 -6.038 -25.184 1.00 0.00 H new ATOM 0 HH22 ARG A 126 1.814 -6.039 -26.543 1.00 0.00 H new ATOM 1934 N GLU A 127 -4.013 -3.323 -23.938 1.00 0.00 N ATOM 1935 CA GLU A 127 -4.077 -3.387 -22.511 1.00 0.00 C ATOM 1936 C GLU A 127 -4.786 -2.278 -21.813 1.00 0.00 C ATOM 1937 O GLU A 127 -5.614 -2.619 -20.969 1.00 0.00 O ATOM 1938 CB GLU A 127 -2.686 -3.477 -21.860 1.00 0.00 C ATOM 1939 CG GLU A 127 -1.696 -4.474 -22.466 1.00 0.00 C ATOM 1940 CD GLU A 127 -2.389 -5.801 -22.737 1.00 0.00 C ATOM 1941 OE1 GLU A 127 -2.928 -6.324 -21.725 1.00 0.00 O ATOM 1942 OE2 GLU A 127 -2.266 -6.407 -23.834 1.00 0.00 O ATOM 0 H GLU A 127 -3.126 -2.942 -24.268 1.00 0.00 H new ATOM 0 HA GLU A 127 -4.665 -4.295 -22.379 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -2.232 -2.487 -21.894 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -2.820 -3.730 -20.808 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -1.286 -4.073 -23.393 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -0.858 -4.625 -21.786 1.00 0.00 H new ATOM 1949 N ALA A 128 -4.682 -0.984 -22.164 1.00 0.00 N ATOM 1950 CA ALA A 128 -5.173 0.144 -21.435 1.00 0.00 C ATOM 1951 C ALA A 128 -6.647 0.353 -21.485 1.00 0.00 C ATOM 1952 O ALA A 128 -7.292 0.532 -20.454 1.00 0.00 O ATOM 1953 CB ALA A 128 -4.401 1.320 -22.056 1.00 0.00 C ATOM 0 H ALA A 128 -4.217 -0.706 -23.028 1.00 0.00 H new ATOM 0 HA ALA A 128 -5.010 0.013 -20.365 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -4.700 2.249 -21.570 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -3.331 1.166 -21.918 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -4.625 1.380 -23.121 1.00 0.00 H new ATOM 1959 N ASP A 129 -7.248 0.264 -22.685 1.00 0.00 N ATOM 1960 CA ASP A 129 -8.593 0.730 -22.821 1.00 0.00 C ATOM 1961 C ASP A 129 -9.579 -0.351 -22.541 1.00 0.00 C ATOM 1962 O ASP A 129 -9.509 -1.478 -23.029 1.00 0.00 O ATOM 1963 CB ASP A 129 -8.790 1.340 -24.219 1.00 0.00 C ATOM 1964 CG ASP A 129 -10.012 2.246 -24.274 1.00 0.00 C ATOM 1965 OD1 ASP A 129 -11.183 1.781 -24.261 1.00 0.00 O ATOM 1966 OD2 ASP A 129 -9.906 3.500 -24.314 1.00 0.00 O ATOM 0 H ASP A 129 -6.823 -0.115 -23.531 1.00 0.00 H new ATOM 0 HA ASP A 129 -8.772 1.507 -22.078 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -7.903 1.910 -24.495 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -8.897 0.541 -24.952 1.00 0.00 H new ATOM 1971 N ILE A 130 -10.591 -0.093 -21.693 1.00 0.00 N ATOM 1972 CA ILE A 130 -11.596 -1.014 -21.262 1.00 0.00 C ATOM 1973 C ILE A 130 -12.677 -1.320 -22.241 1.00 0.00 C ATOM 1974 O ILE A 130 -13.137 -2.452 -22.380 1.00 0.00 O ATOM 1975 CB ILE A 130 -12.103 -0.546 -19.931 1.00 0.00 C ATOM 1976 CG1 ILE A 130 -11.082 -0.022 -18.907 1.00 0.00 C ATOM 1977 CG2 ILE A 130 -13.120 -1.572 -19.404 1.00 0.00 C ATOM 1978 CD1 ILE A 130 -10.225 -1.169 -18.373 1.00 0.00 C ATOM 0 H ILE A 130 -10.714 0.831 -21.278 1.00 0.00 H new ATOM 0 HA ILE A 130 -11.126 -1.993 -21.170 1.00 0.00 H new ATOM 0 HB ILE A 130 -12.609 0.403 -20.110 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -10.445 0.730 -19.372 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -11.602 0.466 -18.083 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -13.498 -1.245 -18.435 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -13.949 -1.657 -20.107 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -12.635 -2.542 -19.295 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -9.508 -0.781 -17.650 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -10.865 -1.907 -17.889 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -9.690 -1.638 -19.199 1.00 0.00 H new ATOM 1990 N ASP A 131 -13.083 -0.289 -23.003 1.00 0.00 N ATOM 1991 CA ASP A 131 -13.907 -0.390 -24.167 1.00 0.00 C ATOM 1992 C ASP A 131 -13.196 -0.906 -25.371 1.00 0.00 C ATOM 1993 O ASP A 131 -13.641 -1.867 -25.995 1.00 0.00 O ATOM 1994 CB ASP A 131 -14.502 0.981 -24.533 1.00 0.00 C ATOM 1995 CG ASP A 131 -14.936 1.660 -23.242 1.00 0.00 C ATOM 1996 OD1 ASP A 131 -15.975 1.360 -22.596 1.00 0.00 O ATOM 1997 OD2 ASP A 131 -14.196 2.606 -22.862 1.00 0.00 O ATOM 0 H ASP A 131 -12.819 0.674 -22.793 1.00 0.00 H new ATOM 0 HA ASP A 131 -14.683 -1.106 -23.897 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -13.765 1.590 -25.056 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -15.351 0.861 -25.206 1.00 0.00 H new ATOM 2002 N GLY A 132 -12.071 -0.283 -25.767 1.00 0.00 N ATOM 2003 CA GLY A 132 -11.358 -0.526 -26.983 1.00 0.00 C ATOM 2004 C GLY A 132 -11.868 0.485 -27.951 1.00 0.00 C ATOM 2005 O GLY A 132 -11.558 0.262 -29.120 1.00 0.00 O ATOM 0 H GLY A 132 -11.630 0.440 -25.198 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -10.283 -0.421 -26.836 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -11.533 -1.539 -27.345 1.00 0.00 H new ATOM 2009 N ASP A 133 -12.565 1.523 -27.456 1.00 0.00 N ATOM 2010 CA ASP A 133 -13.084 2.508 -28.354 1.00 0.00 C ATOM 2011 C ASP A 133 -11.907 3.208 -28.939 1.00 0.00 C ATOM 2012 O ASP A 133 -11.854 3.573 -30.113 1.00 0.00 O ATOM 2013 CB ASP A 133 -14.131 3.384 -27.646 1.00 0.00 C ATOM 2014 CG ASP A 133 -13.719 4.016 -26.324 1.00 0.00 C ATOM 2015 OD1 ASP A 133 -12.675 3.672 -25.709 1.00 0.00 O ATOM 2016 OD2 ASP A 133 -14.601 4.688 -25.725 1.00 0.00 O ATOM 0 H ASP A 133 -12.765 1.679 -26.468 1.00 0.00 H new ATOM 0 HA ASP A 133 -13.649 2.088 -29.186 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -14.422 4.183 -28.328 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -15.019 2.776 -27.470 1.00 0.00 H new ATOM 2021 N GLY A 134 -11.041 3.604 -27.989 1.00 0.00 N ATOM 2022 CA GLY A 134 -9.837 4.291 -28.342 1.00 0.00 C ATOM 2023 C GLY A 134 -9.557 5.460 -27.462 1.00 0.00 C ATOM 2024 O GLY A 134 -8.410 5.726 -27.108 1.00 0.00 O ATOM 0 H GLY A 134 -11.171 3.451 -26.989 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -8.999 3.595 -28.291 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -9.908 4.629 -29.376 1.00 0.00 H new ATOM 2028 N GLN A 135 -10.599 6.170 -26.994 1.00 0.00 N ATOM 2029 CA GLN A 135 -10.560 7.327 -26.155 1.00 0.00 C ATOM 2030 C GLN A 135 -10.464 6.968 -24.712 1.00 0.00 C ATOM 2031 O GLN A 135 -11.158 6.086 -24.209 1.00 0.00 O ATOM 2032 CB GLN A 135 -11.791 8.211 -26.417 1.00 0.00 C ATOM 2033 CG GLN A 135 -13.200 7.908 -25.901 1.00 0.00 C ATOM 2034 CD GLN A 135 -14.058 9.096 -26.312 1.00 0.00 C ATOM 2035 OE1 GLN A 135 -13.674 10.093 -26.923 1.00 0.00 O ATOM 2036 NE2 GLN A 135 -15.347 9.067 -25.881 1.00 0.00 N ATOM 0 H GLN A 135 -11.557 5.908 -27.226 1.00 0.00 H new ATOM 0 HA GLN A 135 -9.659 7.888 -26.404 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -11.537 9.202 -26.040 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -11.878 8.295 -27.500 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -13.583 6.982 -26.331 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -13.201 7.781 -24.818 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -15.696 8.255 -25.372 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -15.965 9.857 -26.067 1.00 0.00 H new ATOM 2045 N VAL A 136 -9.521 7.595 -23.987 1.00 0.00 N ATOM 2046 CA VAL A 136 -9.299 7.278 -22.610 1.00 0.00 C ATOM 2047 C VAL A 136 -10.100 8.182 -21.737 1.00 0.00 C ATOM 2048 O VAL A 136 -10.102 9.401 -21.899 1.00 0.00 O ATOM 2049 CB VAL A 136 -7.821 7.264 -22.356 1.00 0.00 C ATOM 2050 CG1 VAL A 136 -7.174 8.626 -22.054 1.00 0.00 C ATOM 2051 CG2 VAL A 136 -7.518 6.170 -21.318 1.00 0.00 C ATOM 0 H VAL A 136 -8.910 8.324 -24.356 1.00 0.00 H new ATOM 0 HA VAL A 136 -9.656 6.280 -22.357 1.00 0.00 H new ATOM 0 HB VAL A 136 -7.328 7.018 -23.296 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.105 8.492 -21.888 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -7.328 9.297 -22.899 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -7.629 9.055 -21.161 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -6.447 6.144 -21.119 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -8.053 6.387 -20.394 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -7.839 5.203 -21.705 1.00 0.00 H new ATOM 2061 N ASN A 137 -10.904 7.575 -20.845 1.00 0.00 N ATOM 2062 CA ASN A 137 -11.453 8.298 -19.741 1.00 0.00 C ATOM 2063 C ASN A 137 -10.502 8.418 -18.599 1.00 0.00 C ATOM 2064 O ASN A 137 -9.423 7.831 -18.657 1.00 0.00 O ATOM 2065 CB ASN A 137 -12.888 7.980 -19.289 1.00 0.00 C ATOM 2066 CG ASN A 137 -12.964 6.595 -18.663 1.00 0.00 C ATOM 2067 OD1 ASN A 137 -12.706 6.411 -17.474 1.00 0.00 O ATOM 2068 ND2 ASN A 137 -13.422 5.654 -19.531 1.00 0.00 N ATOM 0 H ASN A 137 -11.172 6.592 -20.888 1.00 0.00 H new ATOM 0 HA ASN A 137 -11.591 9.282 -20.189 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -13.221 8.728 -18.569 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -13.564 8.036 -20.143 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -13.580 4.698 -19.211 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -13.608 5.904 -20.502 1.00 0.00 H new ATOM 2075 N TYR A 138 -10.876 9.110 -17.508 1.00 0.00 N ATOM 2076 CA TYR A 138 -10.149 9.331 -16.297 1.00 0.00 C ATOM 2077 C TYR A 138 -9.710 8.052 -15.669 1.00 0.00 C ATOM 2078 O TYR A 138 -8.516 7.858 -15.450 1.00 0.00 O ATOM 2079 CB TYR A 138 -10.980 10.213 -15.350 1.00 0.00 C ATOM 2080 CG TYR A 138 -10.346 10.303 -14.005 1.00 0.00 C ATOM 2081 CD1 TYR A 138 -9.135 10.929 -13.825 1.00 0.00 C ATOM 2082 CD2 TYR A 138 -10.971 9.733 -12.921 1.00 0.00 C ATOM 2083 CE1 TYR A 138 -8.454 10.758 -12.643 1.00 0.00 C ATOM 2084 CE2 TYR A 138 -10.421 9.764 -11.662 1.00 0.00 C ATOM 2085 CZ TYR A 138 -9.116 10.188 -11.580 1.00 0.00 C ATOM 2086 OH TYR A 138 -8.433 10.195 -10.345 1.00 0.00 O ATOM 0 H TYR A 138 -11.789 9.563 -17.474 1.00 0.00 H new ATOM 0 HA TYR A 138 -9.228 9.867 -16.529 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -11.082 11.212 -15.775 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -11.985 9.803 -15.255 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -8.722 11.550 -14.606 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -11.924 9.246 -13.063 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -7.422 11.064 -12.551 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -10.982 9.472 -10.787 1.00 0.00 H new ATOM 0 HH TYR A 138 -8.990 9.769 -9.661 1.00 0.00 H new ATOM 2096 N GLU A 139 -10.665 7.145 -15.398 1.00 0.00 N ATOM 2097 CA GLU A 139 -10.479 5.960 -14.619 1.00 0.00 C ATOM 2098 C GLU A 139 -9.549 5.048 -15.344 1.00 0.00 C ATOM 2099 O GLU A 139 -8.648 4.372 -14.851 1.00 0.00 O ATOM 2100 CB GLU A 139 -11.814 5.299 -14.236 1.00 0.00 C ATOM 2101 CG GLU A 139 -11.778 4.111 -13.273 1.00 0.00 C ATOM 2102 CD GLU A 139 -13.156 3.466 -13.278 1.00 0.00 C ATOM 2103 OE1 GLU A 139 -13.344 2.604 -14.177 1.00 0.00 O ATOM 2104 OE2 GLU A 139 -13.910 3.706 -12.296 1.00 0.00 O ATOM 0 H GLU A 139 -11.620 7.244 -15.742 1.00 0.00 H new ATOM 0 HA GLU A 139 -10.022 6.220 -13.664 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -12.452 6.066 -13.796 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -12.299 4.969 -15.155 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -11.019 3.392 -13.581 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -11.515 4.442 -12.268 1.00 0.00 H new ATOM 2111 N GLU A 140 -9.698 5.015 -16.680 1.00 0.00 N ATOM 2112 CA GLU A 140 -8.781 4.327 -17.536 1.00 0.00 C ATOM 2113 C GLU A 140 -7.393 4.844 -17.692 1.00 0.00 C ATOM 2114 O GLU A 140 -6.436 4.078 -17.801 1.00 0.00 O ATOM 2115 CB GLU A 140 -9.331 4.342 -18.972 1.00 0.00 C ATOM 2116 CG GLU A 140 -10.723 3.752 -19.203 1.00 0.00 C ATOM 2117 CD GLU A 140 -11.123 3.752 -20.672 1.00 0.00 C ATOM 2118 OE1 GLU A 140 -11.084 4.807 -21.360 1.00 0.00 O ATOM 2119 OE2 GLU A 140 -11.520 2.678 -21.196 1.00 0.00 O ATOM 0 H GLU A 140 -10.465 5.472 -17.174 1.00 0.00 H new ATOM 0 HA GLU A 140 -8.704 3.365 -17.030 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -9.343 5.376 -19.316 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -8.628 3.803 -19.607 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -10.748 2.730 -18.824 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -11.455 4.323 -18.631 1.00 0.00 H new ATOM 2126 N PHE A 141 -7.238 6.178 -17.615 1.00 0.00 N ATOM 2127 CA PHE A 141 -5.928 6.751 -17.607 1.00 0.00 C ATOM 2128 C PHE A 141 -5.283 6.558 -16.278 1.00 0.00 C ATOM 2129 O PHE A 141 -4.059 6.437 -16.253 1.00 0.00 O ATOM 2130 CB PHE A 141 -6.096 8.270 -17.785 1.00 0.00 C ATOM 2131 CG PHE A 141 -4.842 9.027 -18.053 1.00 0.00 C ATOM 2132 CD1 PHE A 141 -4.092 8.638 -19.137 1.00 0.00 C ATOM 2133 CD2 PHE A 141 -4.271 9.830 -17.094 1.00 0.00 C ATOM 2134 CE1 PHE A 141 -2.850 9.192 -19.339 1.00 0.00 C ATOM 2135 CE2 PHE A 141 -3.092 10.485 -17.360 1.00 0.00 C ATOM 2136 CZ PHE A 141 -2.333 10.092 -18.437 1.00 0.00 C ATOM 0 H PHE A 141 -8.004 6.849 -17.559 1.00 0.00 H new ATOM 0 HA PHE A 141 -5.327 6.287 -18.389 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -6.789 8.447 -18.607 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -6.559 8.675 -16.885 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -4.476 7.901 -19.827 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -4.748 9.946 -16.132 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -2.276 8.918 -20.212 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -2.766 11.299 -16.730 1.00 0.00 H new ATOM 0 HZ PHE A 141 -1.337 10.488 -18.574 1.00 0.00 H new ATOM 2146 N VAL A 142 -5.975 6.400 -15.136 1.00 0.00 N ATOM 2147 CA VAL A 142 -5.462 5.988 -13.867 1.00 0.00 C ATOM 2148 C VAL A 142 -4.858 4.633 -14.008 1.00 0.00 C ATOM 2149 O VAL A 142 -3.684 4.378 -13.746 1.00 0.00 O ATOM 2150 CB VAL A 142 -6.461 6.009 -12.749 1.00 0.00 C ATOM 2151 CG1 VAL A 142 -5.971 5.547 -11.366 1.00 0.00 C ATOM 2152 CG2 VAL A 142 -7.056 7.422 -12.629 1.00 0.00 C ATOM 0 H VAL A 142 -6.979 6.576 -15.099 1.00 0.00 H new ATOM 0 HA VAL A 142 -4.711 6.724 -13.580 1.00 0.00 H new ATOM 0 HB VAL A 142 -7.201 5.261 -13.035 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -6.790 5.611 -10.650 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -5.624 4.516 -11.429 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -5.151 6.186 -11.038 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -7.783 7.443 -11.817 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -6.259 8.136 -12.421 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -7.548 7.690 -13.564 1.00 0.00 H new ATOM 2162 N GLN A 143 -5.682 3.705 -14.527 1.00 0.00 N ATOM 2163 CA GLN A 143 -5.405 2.306 -14.635 1.00 0.00 C ATOM 2164 C GLN A 143 -4.295 2.027 -15.589 1.00 0.00 C ATOM 2165 O GLN A 143 -3.386 1.247 -15.311 1.00 0.00 O ATOM 2166 CB GLN A 143 -6.613 1.414 -14.968 1.00 0.00 C ATOM 2167 CG GLN A 143 -7.655 1.301 -13.854 1.00 0.00 C ATOM 2168 CD GLN A 143 -8.911 0.528 -14.231 1.00 0.00 C ATOM 2169 OE1 GLN A 143 -9.947 0.915 -13.693 1.00 0.00 O ATOM 2170 NE2 GLN A 143 -8.882 -0.389 -15.236 1.00 0.00 N ATOM 0 H GLN A 143 -6.602 3.949 -14.895 1.00 0.00 H new ATOM 0 HA GLN A 143 -5.102 2.033 -13.624 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -7.099 1.804 -15.862 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -6.252 0.415 -15.211 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -7.194 0.819 -12.992 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -7.943 2.305 -13.542 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -7.990 -0.671 -15.643 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -9.752 -0.794 -15.582 1.00 0.00 H new ATOM 2179 N MET A 144 -4.245 2.761 -16.714 1.00 0.00 N ATOM 2180 CA MET A 144 -3.050 2.861 -17.494 1.00 0.00 C ATOM 2181 C MET A 144 -1.821 3.179 -16.713 1.00 0.00 C ATOM 2182 O MET A 144 -0.810 2.480 -16.738 1.00 0.00 O ATOM 2183 CB MET A 144 -3.127 3.754 -18.743 1.00 0.00 C ATOM 2184 CG MET A 144 -1.955 3.774 -19.726 1.00 0.00 C ATOM 2185 SD MET A 144 -2.365 4.394 -21.385 1.00 0.00 S ATOM 2186 CE MET A 144 -2.885 6.104 -21.062 1.00 0.00 C ATOM 0 H MET A 144 -5.036 3.288 -17.085 1.00 0.00 H new ATOM 0 HA MET A 144 -2.964 1.837 -17.857 1.00 0.00 H new ATOM 0 HB2 MET A 144 -4.016 3.460 -19.301 1.00 0.00 H new ATOM 0 HB3 MET A 144 -3.287 4.777 -18.404 1.00 0.00 H new ATOM 0 HG2 MET A 144 -1.159 4.391 -19.309 1.00 0.00 H new ATOM 0 HG3 MET A 144 -1.559 2.763 -19.819 1.00 0.00 H new ATOM 0 HE1 MET A 144 -2.542 6.748 -21.872 1.00 0.00 H new ATOM 0 HE2 MET A 144 -3.972 6.148 -21.000 1.00 0.00 H new ATOM 0 HE3 MET A 144 -2.453 6.444 -20.121 1.00 0.00 H new ATOM 2196 N MET A 145 -1.821 4.373 -16.092 1.00 0.00 N ATOM 2197 CA MET A 145 -0.678 4.964 -15.469 1.00 0.00 C ATOM 2198 C MET A 145 -0.173 4.315 -14.226 1.00 0.00 C ATOM 2199 O MET A 145 1.021 4.314 -13.929 1.00 0.00 O ATOM 2200 CB MET A 145 -0.863 6.485 -15.338 1.00 0.00 C ATOM 2201 CG MET A 145 -0.867 7.339 -16.607 1.00 0.00 C ATOM 2202 SD MET A 145 0.790 7.465 -17.343 1.00 0.00 S ATOM 2203 CE MET A 145 1.451 8.840 -16.358 1.00 0.00 C ATOM 0 H MET A 145 -2.657 4.953 -16.022 1.00 0.00 H new ATOM 0 HA MET A 145 0.146 4.765 -16.154 1.00 0.00 H new ATOM 0 HB2 MET A 145 -1.806 6.659 -14.820 1.00 0.00 H new ATOM 0 HB3 MET A 145 -0.070 6.859 -14.691 1.00 0.00 H new ATOM 0 HG2 MET A 145 -1.555 6.907 -17.333 1.00 0.00 H new ATOM 0 HG3 MET A 145 -1.237 8.337 -16.372 1.00 0.00 H new ATOM 0 HE1 MET A 145 2.471 9.058 -16.676 1.00 0.00 H new ATOM 0 HE2 MET A 145 0.829 9.723 -16.503 1.00 0.00 H new ATOM 0 HE3 MET A 145 1.450 8.565 -15.303 1.00 0.00 H new