USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 775 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 34 GLN : amide:sc= 0.0587 K(o=1.1,f=1.7) USER MOD Set 1.2: A 61 THR OG1 : rot 102:sc= 1.27 USER MOD Set 1.3: A 64 HIS : no HE2:sc= -0.288 K(o=1.1,f=-2.7!) USER MOD Set 1.4: A 104 TYR OH : rot 180:sc= 0.0519 USER MOD Set 2.1: A 77 SER OG : rot -0:sc= 2.08 USER MOD Set 2.2: A 79 SER OG : rot 100:sc= 0.923 USER MOD Set 3.1: A 41 MET CE :methyl -166:sc= 0 (180deg=-0.216) USER MOD Set 3.2: A 71 MET CE :methyl 174:sc= -0.375 (180deg=-0.489) USER MOD Single : A 29 SER OG : rot -110:sc= 0.753 USER MOD Single : A 35 SER OG : rot -44:sc= 1.32 USER MOD Single : A 44 ASN : amide:sc= 0.987 K(o=0.99,f=-1.6) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 HIS : no HD1:sc= -0.0414 X(o=-0.041,f=-0.12) USER MOD Single : A 69 THR OG1 : rot 73:sc= 0.258 USER MOD Single : A 75 GLN : amide:sc= 0.688 K(o=0.69,f=-1!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot -76:sc= 1.3 USER MOD Single : A 93 GLN : amide:sc= 1.12 K(o=1.1,f=-2.2!) USER MOD Single : A 95 GLN : amide:sc= -0.638 X(o=-0.64,f=-0.24) USER MOD Single : A 98 SER OG : rot 180:sc= 0.00746 USER MOD Single : A 109 SER OG : rot -27:sc= 0.187 USER MOD Single : A 110 LYS NZ :NH3+ -159:sc= 0.0874 (180deg=-0.95!) USER MOD Single : A 111 ASN : amide:sc= -0.931 K(o=-0.93,f=-0.23) USER MOD Single : A 112 THR OG1 : rot -140:sc= 1.14 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= 0.619 K(o=0.62,f=-0.068) USER MOD Single : A 119 SER OG : rot 180:sc= 0.0357 USER MOD Single : A 121 TYR OH : rot 30:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 103 N SER A 29 5.013 11.232 -3.158 1.00 0.00 N ATOM 104 CA SER A 29 5.483 10.283 -4.146 1.00 0.00 C ATOM 105 C SER A 29 4.384 9.238 -4.218 1.00 0.00 C ATOM 106 O SER A 29 4.607 8.073 -3.918 1.00 0.00 O ATOM 107 CB SER A 29 6.869 9.730 -3.790 1.00 0.00 C ATOM 108 OG SER A 29 7.819 10.779 -3.821 1.00 0.00 O ATOM 0 HA SER A 29 5.647 10.728 -5.127 1.00 0.00 H new ATOM 0 HB2 SER A 29 6.847 9.274 -2.800 1.00 0.00 H new ATOM 0 HB3 SER A 29 7.152 8.948 -4.495 1.00 0.00 H new ATOM 0 HG SER A 29 8.418 10.655 -4.586 1.00 0.00 H new ATOM 114 N ILE A 30 3.187 9.702 -4.590 1.00 0.00 N ATOM 115 CA ILE A 30 1.974 8.924 -4.803 1.00 0.00 C ATOM 116 C ILE A 30 2.354 7.682 -5.593 1.00 0.00 C ATOM 117 O ILE A 30 2.063 6.574 -5.178 1.00 0.00 O ATOM 118 CB ILE A 30 0.954 9.819 -5.570 1.00 0.00 C ATOM 119 CG1 ILE A 30 0.563 11.091 -4.787 1.00 0.00 C ATOM 120 CG2 ILE A 30 -0.309 9.097 -6.080 1.00 0.00 C ATOM 121 CD1 ILE A 30 -0.326 10.822 -3.571 1.00 0.00 C ATOM 0 H ILE A 30 3.035 10.696 -4.760 1.00 0.00 H new ATOM 0 HA ILE A 30 1.511 8.609 -3.868 1.00 0.00 H new ATOM 0 HB ILE A 30 1.511 10.110 -6.460 1.00 0.00 H new ATOM 0 HG12 ILE A 30 1.471 11.596 -4.457 1.00 0.00 H new ATOM 0 HG13 ILE A 30 0.045 11.775 -5.459 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.951 9.809 -6.598 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -0.021 8.301 -6.767 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -0.850 8.669 -5.236 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -0.557 11.764 -3.074 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -1.251 10.346 -3.895 1.00 0.00 H new ATOM 0 HD13 ILE A 30 0.197 10.164 -2.877 1.00 0.00 H new ATOM 133 N GLU A 31 2.993 7.849 -6.738 1.00 0.00 N ATOM 134 CA GLU A 31 3.330 6.729 -7.593 1.00 0.00 C ATOM 135 C GLU A 31 4.356 5.778 -6.985 1.00 0.00 C ATOM 136 O GLU A 31 4.251 4.576 -7.180 1.00 0.00 O ATOM 137 CB GLU A 31 3.784 7.277 -8.921 1.00 0.00 C ATOM 138 CG GLU A 31 2.589 7.937 -9.618 1.00 0.00 C ATOM 139 CD GLU A 31 3.003 8.522 -10.975 1.00 0.00 C ATOM 140 OE1 GLU A 31 4.225 8.654 -11.243 1.00 0.00 O ATOM 141 OE2 GLU A 31 2.106 8.948 -11.739 1.00 0.00 O ATOM 0 H GLU A 31 3.290 8.757 -7.097 1.00 0.00 H new ATOM 0 HA GLU A 31 2.440 6.113 -7.722 1.00 0.00 H new ATOM 0 HB2 GLU A 31 4.584 8.003 -8.776 1.00 0.00 H new ATOM 0 HB3 GLU A 31 4.188 6.477 -9.541 1.00 0.00 H new ATOM 0 HG2 GLU A 31 1.795 7.204 -9.760 1.00 0.00 H new ATOM 0 HG3 GLU A 31 2.184 8.727 -8.985 1.00 0.00 H new ATOM 148 N ALA A 32 5.337 6.285 -6.234 1.00 0.00 N ATOM 149 CA ALA A 32 6.259 5.416 -5.507 1.00 0.00 C ATOM 150 C ALA A 32 5.489 4.609 -4.457 1.00 0.00 C ATOM 151 O ALA A 32 5.686 3.404 -4.355 1.00 0.00 O ATOM 152 CB ALA A 32 7.392 6.218 -4.861 1.00 0.00 C ATOM 0 H ALA A 32 5.511 7.283 -6.115 1.00 0.00 H new ATOM 0 HA ALA A 32 6.717 4.727 -6.217 1.00 0.00 H new ATOM 0 HB1 ALA A 32 8.059 5.541 -4.328 1.00 0.00 H new ATOM 0 HB2 ALA A 32 7.951 6.745 -5.634 1.00 0.00 H new ATOM 0 HB3 ALA A 32 6.973 6.940 -4.160 1.00 0.00 H new ATOM 158 N GLU A 33 4.592 5.262 -3.711 1.00 0.00 N ATOM 159 CA GLU A 33 3.673 4.632 -2.773 1.00 0.00 C ATOM 160 C GLU A 33 2.878 3.534 -3.499 1.00 0.00 C ATOM 161 O GLU A 33 2.845 2.397 -3.027 1.00 0.00 O ATOM 162 CB GLU A 33 2.758 5.697 -2.127 1.00 0.00 C ATOM 163 CG GLU A 33 3.375 6.507 -0.975 1.00 0.00 C ATOM 164 CD GLU A 33 2.375 7.496 -0.348 1.00 0.00 C ATOM 165 OE1 GLU A 33 1.142 7.274 -0.433 1.00 0.00 O ATOM 166 OE2 GLU A 33 2.814 8.539 0.200 1.00 0.00 O ATOM 0 H GLU A 33 4.487 6.276 -3.749 1.00 0.00 H new ATOM 0 HA GLU A 33 4.228 4.159 -1.963 1.00 0.00 H new ATOM 0 HB2 GLU A 33 2.439 6.392 -2.903 1.00 0.00 H new ATOM 0 HB3 GLU A 33 1.862 5.200 -1.756 1.00 0.00 H new ATOM 0 HG2 GLU A 33 3.735 5.823 -0.206 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.241 7.056 -1.344 1.00 0.00 H new ATOM 173 N GLN A 34 2.298 3.841 -4.666 1.00 0.00 N ATOM 174 CA GLN A 34 1.573 2.886 -5.496 1.00 0.00 C ATOM 175 C GLN A 34 2.464 1.691 -5.834 1.00 0.00 C ATOM 176 O GLN A 34 2.078 0.549 -5.594 1.00 0.00 O ATOM 177 CB GLN A 34 1.054 3.512 -6.805 1.00 0.00 C ATOM 178 CG GLN A 34 -0.115 4.476 -6.616 1.00 0.00 C ATOM 179 CD GLN A 34 -0.813 4.862 -7.917 1.00 0.00 C ATOM 180 OE1 GLN A 34 -0.186 5.130 -8.938 1.00 0.00 O ATOM 181 NE2 GLN A 34 -2.135 4.929 -7.896 1.00 0.00 N ATOM 0 H GLN A 34 2.323 4.780 -5.063 1.00 0.00 H new ATOM 0 HA GLN A 34 0.710 2.562 -4.914 1.00 0.00 H new ATOM 0 HB2 GLN A 34 1.873 4.042 -7.291 1.00 0.00 H new ATOM 0 HB3 GLN A 34 0.746 2.713 -7.480 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -0.844 4.021 -5.945 1.00 0.00 H new ATOM 0 HG3 GLN A 34 0.248 5.380 -6.127 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -2.644 4.704 -7.041 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -2.645 5.206 -8.735 1.00 0.00 H new ATOM 190 N SER A 35 3.633 1.936 -6.427 1.00 0.00 N ATOM 191 CA SER A 35 4.517 0.902 -6.934 1.00 0.00 C ATOM 192 C SER A 35 5.124 0.044 -5.821 1.00 0.00 C ATOM 193 O SER A 35 5.431 -1.125 -6.065 1.00 0.00 O ATOM 194 CB SER A 35 5.621 1.552 -7.766 1.00 0.00 C ATOM 195 OG SER A 35 5.076 2.262 -8.862 1.00 0.00 O ATOM 0 H SER A 35 3.993 2.880 -6.568 1.00 0.00 H new ATOM 0 HA SER A 35 3.923 0.230 -7.553 1.00 0.00 H new ATOM 0 HB2 SER A 35 6.202 2.230 -7.141 1.00 0.00 H new ATOM 0 HB3 SER A 35 6.307 0.787 -8.128 1.00 0.00 H new ATOM 0 HG SER A 35 4.381 1.720 -9.290 1.00 0.00 H new ATOM 201 N VAL A 36 5.289 0.575 -4.610 1.00 0.00 N ATOM 202 CA VAL A 36 5.642 -0.224 -3.443 1.00 0.00 C ATOM 203 C VAL A 36 4.509 -1.209 -3.181 1.00 0.00 C ATOM 204 O VAL A 36 4.726 -2.418 -3.205 1.00 0.00 O ATOM 205 CB VAL A 36 5.930 0.690 -2.230 1.00 0.00 C ATOM 206 CG1 VAL A 36 5.955 -0.057 -0.893 1.00 0.00 C ATOM 207 CG2 VAL A 36 7.293 1.364 -2.391 1.00 0.00 C ATOM 0 H VAL A 36 5.181 1.570 -4.413 1.00 0.00 H new ATOM 0 HA VAL A 36 6.557 -0.789 -3.622 1.00 0.00 H new ATOM 0 HB VAL A 36 5.114 1.412 -2.211 1.00 0.00 H new ATOM 0 HG11 VAL A 36 6.162 0.647 -0.087 1.00 0.00 H new ATOM 0 HG12 VAL A 36 4.988 -0.530 -0.722 1.00 0.00 H new ATOM 0 HG13 VAL A 36 6.733 -0.820 -0.917 1.00 0.00 H new ATOM 0 HG21 VAL A 36 7.486 2.005 -1.531 1.00 0.00 H new ATOM 0 HG22 VAL A 36 8.070 0.602 -2.457 1.00 0.00 H new ATOM 0 HG23 VAL A 36 7.296 1.965 -3.300 1.00 0.00 H new ATOM 217 N LEU A 37 3.304 -0.698 -2.945 1.00 0.00 N ATOM 218 CA LEU A 37 2.165 -1.499 -2.511 1.00 0.00 C ATOM 219 C LEU A 37 1.785 -2.529 -3.574 1.00 0.00 C ATOM 220 O LEU A 37 1.445 -3.662 -3.246 1.00 0.00 O ATOM 221 CB LEU A 37 1.010 -0.549 -2.178 1.00 0.00 C ATOM 222 CG LEU A 37 1.325 0.360 -0.971 1.00 0.00 C ATOM 223 CD1 LEU A 37 0.327 1.512 -0.934 1.00 0.00 C ATOM 224 CD2 LEU A 37 1.321 -0.373 0.376 1.00 0.00 C ATOM 0 H LEU A 37 3.089 0.294 -3.051 1.00 0.00 H new ATOM 0 HA LEU A 37 2.420 -2.069 -1.618 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.790 0.070 -3.048 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.113 -1.132 -1.966 1.00 0.00 H new ATOM 0 HG LEU A 37 2.341 0.727 -1.113 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.546 2.156 -0.083 1.00 0.00 H new ATOM 0 HD12 LEU A 37 0.404 2.089 -1.855 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.684 1.115 -0.838 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.551 0.332 1.175 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.338 -0.810 0.549 1.00 0.00 H new ATOM 0 HD23 LEU A 37 2.072 -1.163 0.363 1.00 0.00 H new ATOM 236 N GLY A 38 1.909 -2.159 -4.843 1.00 0.00 N ATOM 237 CA GLY A 38 1.809 -3.052 -5.981 1.00 0.00 C ATOM 238 C GLY A 38 2.900 -4.114 -5.985 1.00 0.00 C ATOM 239 O GLY A 38 2.627 -5.292 -6.209 1.00 0.00 O ATOM 0 H GLY A 38 2.089 -1.192 -5.113 1.00 0.00 H new ATOM 0 HA2 GLY A 38 0.833 -3.538 -5.973 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.868 -2.471 -6.901 1.00 0.00 H new ATOM 243 N GLY A 39 4.147 -3.717 -5.725 1.00 0.00 N ATOM 244 CA GLY A 39 5.287 -4.613 -5.783 1.00 0.00 C ATOM 245 C GLY A 39 5.253 -5.669 -4.685 1.00 0.00 C ATOM 246 O GLY A 39 5.826 -6.738 -4.867 1.00 0.00 O ATOM 0 H GLY A 39 4.388 -2.760 -5.468 1.00 0.00 H new ATOM 0 HA2 GLY A 39 5.310 -5.105 -6.756 1.00 0.00 H new ATOM 0 HA3 GLY A 39 6.206 -4.033 -5.697 1.00 0.00 H new ATOM 250 N LEU A 40 4.555 -5.407 -3.580 1.00 0.00 N ATOM 251 CA LEU A 40 4.289 -6.400 -2.548 1.00 0.00 C ATOM 252 C LEU A 40 3.409 -7.524 -3.097 1.00 0.00 C ATOM 253 O LEU A 40 3.685 -8.692 -2.844 1.00 0.00 O ATOM 254 CB LEU A 40 3.601 -5.728 -1.352 1.00 0.00 C ATOM 255 CG LEU A 40 4.491 -4.739 -0.582 1.00 0.00 C ATOM 256 CD1 LEU A 40 3.662 -3.997 0.467 1.00 0.00 C ATOM 257 CD2 LEU A 40 5.658 -5.457 0.092 1.00 0.00 C ATOM 0 H LEU A 40 4.156 -4.490 -3.377 1.00 0.00 H new ATOM 0 HA LEU A 40 5.235 -6.833 -2.224 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.715 -5.201 -1.707 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.258 -6.501 -0.664 1.00 0.00 H new ATOM 0 HG LEU A 40 4.898 -4.023 -1.296 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.300 -3.298 1.008 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.859 -3.448 -0.025 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.235 -4.715 1.167 1.00 0.00 H new ATOM 0 HD21 LEU A 40 6.270 -4.732 0.629 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.273 -6.197 0.793 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.265 -5.955 -0.664 1.00 0.00 H new ATOM 269 N MET A 41 2.377 -7.191 -3.880 1.00 0.00 N ATOM 270 CA MET A 41 1.518 -8.186 -4.522 1.00 0.00 C ATOM 271 C MET A 41 2.306 -8.998 -5.566 1.00 0.00 C ATOM 272 O MET A 41 1.948 -10.138 -5.882 1.00 0.00 O ATOM 273 CB MET A 41 0.300 -7.518 -5.180 1.00 0.00 C ATOM 274 CG MET A 41 -0.483 -6.592 -4.241 1.00 0.00 C ATOM 275 SD MET A 41 -1.970 -5.901 -5.011 1.00 0.00 S ATOM 276 CE MET A 41 -2.336 -4.526 -3.905 1.00 0.00 C ATOM 0 H MET A 41 2.116 -6.226 -4.085 1.00 0.00 H new ATOM 0 HA MET A 41 1.163 -8.867 -3.748 1.00 0.00 H new ATOM 0 HB2 MET A 41 0.635 -6.944 -6.044 1.00 0.00 H new ATOM 0 HB3 MET A 41 -0.370 -8.293 -5.552 1.00 0.00 H new ATOM 0 HG2 MET A 41 -0.767 -7.146 -3.346 1.00 0.00 H new ATOM 0 HG3 MET A 41 0.165 -5.777 -3.919 1.00 0.00 H new ATOM 0 HE1 MET A 41 -3.346 -4.163 -4.098 1.00 0.00 H new ATOM 0 HE2 MET A 41 -2.262 -4.862 -2.871 1.00 0.00 H new ATOM 0 HE3 MET A 41 -1.622 -3.721 -4.077 1.00 0.00 H new ATOM 286 N LEU A 42 3.374 -8.424 -6.128 1.00 0.00 N ATOM 287 CA LEU A 42 4.281 -9.130 -7.029 1.00 0.00 C ATOM 288 C LEU A 42 5.201 -10.086 -6.274 1.00 0.00 C ATOM 289 O LEU A 42 5.489 -11.177 -6.767 1.00 0.00 O ATOM 290 CB LEU A 42 5.087 -8.165 -7.883 1.00 0.00 C ATOM 291 CG LEU A 42 4.201 -7.410 -8.888 1.00 0.00 C ATOM 292 CD1 LEU A 42 5.135 -6.508 -9.668 1.00 0.00 C ATOM 293 CD2 LEU A 42 3.475 -8.304 -9.900 1.00 0.00 C ATOM 0 H LEU A 42 3.632 -7.450 -5.968 1.00 0.00 H new ATOM 0 HA LEU A 42 3.660 -9.727 -7.696 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.596 -7.449 -7.239 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.859 -8.715 -8.421 1.00 0.00 H new ATOM 0 HG LEU A 42 3.424 -6.893 -8.325 1.00 0.00 H new ATOM 0 HD11 LEU A 42 4.564 -5.941 -10.403 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.631 -5.819 -8.984 1.00 0.00 H new ATOM 0 HD13 LEU A 42 5.883 -7.114 -10.179 1.00 0.00 H new ATOM 0 HD21 LEU A 42 2.875 -7.685 -10.567 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.207 -8.862 -10.483 1.00 0.00 H new ATOM 0 HD23 LEU A 42 2.826 -9.001 -9.370 1.00 0.00 H new ATOM 305 N ASP A 43 5.691 -9.679 -5.106 1.00 0.00 N ATOM 306 CA ASP A 43 6.746 -10.361 -4.358 1.00 0.00 C ATOM 307 C ASP A 43 6.610 -10.118 -2.856 1.00 0.00 C ATOM 308 O ASP A 43 7.009 -9.076 -2.325 1.00 0.00 O ATOM 309 CB ASP A 43 8.111 -9.920 -4.881 1.00 0.00 C ATOM 310 CG ASP A 43 9.283 -10.636 -4.208 1.00 0.00 C ATOM 311 OD1 ASP A 43 9.126 -11.371 -3.209 1.00 0.00 O ATOM 312 OD2 ASP A 43 10.420 -10.434 -4.697 1.00 0.00 O ATOM 0 H ASP A 43 5.354 -8.838 -4.638 1.00 0.00 H new ATOM 0 HA ASP A 43 6.648 -11.436 -4.510 1.00 0.00 H new ATOM 0 HB2 ASP A 43 8.155 -10.099 -5.955 1.00 0.00 H new ATOM 0 HB3 ASP A 43 8.218 -8.846 -4.732 1.00 0.00 H new ATOM 317 N ASN A 44 6.052 -11.116 -2.169 1.00 0.00 N ATOM 318 CA ASN A 44 5.726 -11.041 -0.748 1.00 0.00 C ATOM 319 C ASN A 44 6.971 -10.907 0.126 1.00 0.00 C ATOM 320 O ASN A 44 6.867 -10.374 1.232 1.00 0.00 O ATOM 321 CB ASN A 44 4.927 -12.260 -0.266 1.00 0.00 C ATOM 322 CG ASN A 44 3.473 -12.233 -0.714 1.00 0.00 C ATOM 323 OD1 ASN A 44 2.883 -11.188 -0.944 1.00 0.00 O ATOM 324 ND2 ASN A 44 2.853 -13.384 -0.845 1.00 0.00 N ATOM 0 H ASN A 44 5.811 -12.012 -2.593 1.00 0.00 H new ATOM 0 HA ASN A 44 5.113 -10.145 -0.645 1.00 0.00 H new ATOM 0 HB2 ASN A 44 5.400 -13.168 -0.640 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.965 -12.305 0.822 1.00 0.00 H new ATOM 0 HD21 ASN A 44 1.877 -13.407 -1.139 1.00 0.00 H new ATOM 0 HD22 ASN A 44 3.348 -14.255 -0.652 1.00 0.00 H new ATOM 331 N GLU A 45 8.149 -11.382 -0.300 1.00 0.00 N ATOM 332 CA GLU A 45 9.347 -11.268 0.545 1.00 0.00 C ATOM 333 C GLU A 45 9.885 -9.832 0.552 1.00 0.00 C ATOM 334 O GLU A 45 10.663 -9.461 1.436 1.00 0.00 O ATOM 335 CB GLU A 45 10.428 -12.299 0.181 1.00 0.00 C ATOM 336 CG GLU A 45 10.018 -13.716 0.629 1.00 0.00 C ATOM 337 CD GLU A 45 11.216 -14.604 0.983 1.00 0.00 C ATOM 338 OE1 GLU A 45 11.924 -14.314 1.977 1.00 0.00 O ATOM 339 OE2 GLU A 45 11.427 -15.657 0.336 1.00 0.00 O ATOM 0 H GLU A 45 8.298 -11.838 -1.200 1.00 0.00 H new ATOM 0 HA GLU A 45 9.045 -11.506 1.565 1.00 0.00 H new ATOM 0 HB2 GLU A 45 10.596 -12.289 -0.896 1.00 0.00 H new ATOM 0 HB3 GLU A 45 11.371 -12.024 0.653 1.00 0.00 H new ATOM 0 HG2 GLU A 45 9.360 -13.641 1.495 1.00 0.00 H new ATOM 0 HG3 GLU A 45 9.444 -14.191 -0.167 1.00 0.00 H new ATOM 346 N ARG A 46 9.406 -8.971 -0.352 1.00 0.00 N ATOM 347 CA ARG A 46 9.707 -7.546 -0.293 1.00 0.00 C ATOM 348 C ARG A 46 8.926 -6.877 0.831 1.00 0.00 C ATOM 349 O ARG A 46 9.269 -5.748 1.162 1.00 0.00 O ATOM 350 CB ARG A 46 9.431 -6.853 -1.640 1.00 0.00 C ATOM 351 CG ARG A 46 9.998 -7.584 -2.870 1.00 0.00 C ATOM 352 CD ARG A 46 11.518 -7.537 -3.092 1.00 0.00 C ATOM 353 NE ARG A 46 12.293 -8.089 -1.981 1.00 0.00 N ATOM 354 CZ ARG A 46 12.618 -9.360 -1.731 1.00 0.00 C ATOM 355 NH1 ARG A 46 12.180 -10.378 -2.470 1.00 0.00 N ATOM 356 NH2 ARG A 46 13.410 -9.567 -0.693 1.00 0.00 N ATOM 0 H ARG A 46 8.808 -9.242 -1.133 1.00 0.00 H new ATOM 0 HA ARG A 46 10.771 -7.441 -0.083 1.00 0.00 H new ATOM 0 HB2 ARG A 46 8.353 -6.746 -1.763 1.00 0.00 H new ATOM 0 HB3 ARG A 46 9.850 -5.847 -1.608 1.00 0.00 H new ATOM 0 HG2 ARG A 46 9.701 -8.631 -2.804 1.00 0.00 H new ATOM 0 HG3 ARG A 46 9.517 -7.171 -3.757 1.00 0.00 H new ATOM 0 HD2 ARG A 46 11.760 -8.087 -4.001 1.00 0.00 H new ATOM 0 HD3 ARG A 46 11.820 -6.503 -3.255 1.00 0.00 H new ATOM 0 HE ARG A 46 12.633 -7.408 -1.302 1.00 0.00 H new ATOM 0 HH11 ARG A 46 11.568 -10.203 -3.267 1.00 0.00 H new ATOM 0 HH12 ARG A 46 12.456 -11.332 -2.239 1.00 0.00 H new ATOM 0 HH21 ARG A 46 13.737 -8.778 -0.135 1.00 0.00 H new ATOM 0 HH22 ARG A 46 13.695 -10.516 -0.450 1.00 0.00 H new ATOM 370 N TRP A 47 7.952 -7.541 1.466 1.00 0.00 N ATOM 371 CA TRP A 47 7.292 -7.018 2.657 1.00 0.00 C ATOM 372 C TRP A 47 8.322 -6.625 3.697 1.00 0.00 C ATOM 373 O TRP A 47 8.291 -5.506 4.188 1.00 0.00 O ATOM 374 CB TRP A 47 6.324 -8.035 3.253 1.00 0.00 C ATOM 375 CG TRP A 47 5.658 -7.551 4.503 1.00 0.00 C ATOM 376 CD1 TRP A 47 6.067 -7.822 5.763 1.00 0.00 C ATOM 377 CD2 TRP A 47 4.538 -6.628 4.640 1.00 0.00 C ATOM 378 NE1 TRP A 47 5.216 -7.207 6.657 1.00 0.00 N ATOM 379 CE2 TRP A 47 4.280 -6.422 6.024 1.00 0.00 C ATOM 380 CE3 TRP A 47 3.726 -5.929 3.729 1.00 0.00 C ATOM 381 CZ2 TRP A 47 3.242 -5.593 6.476 1.00 0.00 C ATOM 382 CZ3 TRP A 47 2.700 -5.070 4.167 1.00 0.00 C ATOM 383 CH2 TRP A 47 2.453 -4.904 5.540 1.00 0.00 C ATOM 0 H TRP A 47 7.604 -8.452 1.166 1.00 0.00 H new ATOM 0 HA TRP A 47 6.721 -6.139 2.358 1.00 0.00 H new ATOM 0 HB2 TRP A 47 5.561 -8.278 2.513 1.00 0.00 H new ATOM 0 HB3 TRP A 47 6.863 -8.957 3.470 1.00 0.00 H new ATOM 0 HD1 TRP A 47 6.924 -8.424 6.027 1.00 0.00 H new ATOM 0 HE1 TRP A 47 5.274 -7.321 7.669 1.00 0.00 H new ATOM 0 HE3 TRP A 47 3.893 -6.054 2.669 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 3.051 -5.486 7.534 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 2.100 -4.536 3.444 1.00 0.00 H new ATOM 0 HH2 TRP A 47 1.661 -4.250 5.874 1.00 0.00 H new ATOM 394 N ASP A 48 9.255 -7.522 4.002 1.00 0.00 N ATOM 395 CA ASP A 48 10.269 -7.281 5.020 1.00 0.00 C ATOM 396 C ASP A 48 11.190 -6.135 4.646 1.00 0.00 C ATOM 397 O ASP A 48 11.853 -5.571 5.505 1.00 0.00 O ATOM 398 CB ASP A 48 11.115 -8.532 5.241 1.00 0.00 C ATOM 399 CG ASP A 48 10.803 -9.154 6.596 1.00 0.00 C ATOM 400 OD1 ASP A 48 11.020 -8.493 7.638 1.00 0.00 O ATOM 401 OD2 ASP A 48 10.360 -10.320 6.637 1.00 0.00 O ATOM 0 H ASP A 48 9.328 -8.434 3.551 1.00 0.00 H new ATOM 0 HA ASP A 48 9.737 -7.019 5.935 1.00 0.00 H new ATOM 0 HB2 ASP A 48 10.920 -9.255 4.449 1.00 0.00 H new ATOM 0 HB3 ASP A 48 12.173 -8.277 5.186 1.00 0.00 H new ATOM 406 N ASP A 49 11.334 -5.861 3.354 1.00 0.00 N ATOM 407 CA ASP A 49 12.230 -4.821 2.855 1.00 0.00 C ATOM 408 C ASP A 49 11.535 -3.474 2.921 1.00 0.00 C ATOM 409 O ASP A 49 12.121 -2.483 3.360 1.00 0.00 O ATOM 410 CB ASP A 49 12.676 -5.123 1.418 1.00 0.00 C ATOM 411 CG ASP A 49 13.536 -6.377 1.300 1.00 0.00 C ATOM 412 OD1 ASP A 49 14.166 -6.811 2.293 1.00 0.00 O ATOM 413 OD2 ASP A 49 13.615 -6.921 0.176 1.00 0.00 O ATOM 0 H ASP A 49 10.830 -6.356 2.618 1.00 0.00 H new ATOM 0 HA ASP A 49 13.120 -4.797 3.483 1.00 0.00 H new ATOM 0 HB2 ASP A 49 11.794 -5.236 0.788 1.00 0.00 H new ATOM 0 HB3 ASP A 49 13.235 -4.271 1.033 1.00 0.00 H new ATOM 418 N VAL A 50 10.275 -3.443 2.508 1.00 0.00 N ATOM 419 CA VAL A 50 9.406 -2.293 2.573 1.00 0.00 C ATOM 420 C VAL A 50 9.188 -1.950 4.047 1.00 0.00 C ATOM 421 O VAL A 50 9.550 -0.854 4.459 1.00 0.00 O ATOM 422 CB VAL A 50 8.122 -2.632 1.797 1.00 0.00 C ATOM 423 CG1 VAL A 50 7.040 -1.561 1.981 1.00 0.00 C ATOM 424 CG2 VAL A 50 8.418 -2.733 0.289 1.00 0.00 C ATOM 0 H VAL A 50 9.818 -4.259 2.102 1.00 0.00 H new ATOM 0 HA VAL A 50 9.827 -1.402 2.107 1.00 0.00 H new ATOM 0 HB VAL A 50 7.764 -3.583 2.192 1.00 0.00 H new ATOM 0 HG11 VAL A 50 6.151 -1.841 1.416 1.00 0.00 H new ATOM 0 HG12 VAL A 50 6.787 -1.478 3.038 1.00 0.00 H new ATOM 0 HG13 VAL A 50 7.412 -0.602 1.620 1.00 0.00 H new ATOM 0 HG21 VAL A 50 7.500 -2.973 -0.247 1.00 0.00 H new ATOM 0 HG22 VAL A 50 8.809 -1.781 -0.070 1.00 0.00 H new ATOM 0 HG23 VAL A 50 9.155 -3.516 0.115 1.00 0.00 H new ATOM 434 N ALA A 51 8.652 -2.861 4.861 1.00 0.00 N ATOM 435 CA ALA A 51 8.365 -2.637 6.271 1.00 0.00 C ATOM 436 C ALA A 51 9.619 -2.425 7.123 1.00 0.00 C ATOM 437 O ALA A 51 9.504 -1.991 8.273 1.00 0.00 O ATOM 438 CB ALA A 51 7.536 -3.803 6.822 1.00 0.00 C ATOM 0 H ALA A 51 8.401 -3.798 4.546 1.00 0.00 H new ATOM 0 HA ALA A 51 7.796 -1.709 6.334 1.00 0.00 H new ATOM 0 HB1 ALA A 51 7.323 -3.632 7.877 1.00 0.00 H new ATOM 0 HB2 ALA A 51 6.599 -3.876 6.270 1.00 0.00 H new ATOM 0 HB3 ALA A 51 8.096 -4.732 6.711 1.00 0.00 H new ATOM 444 N GLU A 52 10.817 -2.703 6.608 1.00 0.00 N ATOM 445 CA GLU A 52 12.049 -2.317 7.257 1.00 0.00 C ATOM 446 C GLU A 52 12.287 -0.824 7.086 1.00 0.00 C ATOM 447 O GLU A 52 12.879 -0.198 7.968 1.00 0.00 O ATOM 448 CB GLU A 52 13.244 -3.105 6.706 1.00 0.00 C ATOM 449 CG GLU A 52 13.574 -4.282 7.633 1.00 0.00 C ATOM 450 CD GLU A 52 14.477 -3.813 8.766 1.00 0.00 C ATOM 451 OE1 GLU A 52 15.712 -3.778 8.559 1.00 0.00 O ATOM 452 OE2 GLU A 52 13.968 -3.425 9.841 1.00 0.00 O ATOM 0 H GLU A 52 10.950 -3.203 5.729 1.00 0.00 H new ATOM 0 HA GLU A 52 11.953 -2.548 8.318 1.00 0.00 H new ATOM 0 HB2 GLU A 52 13.016 -3.473 5.706 1.00 0.00 H new ATOM 0 HB3 GLU A 52 14.110 -2.450 6.615 1.00 0.00 H new ATOM 0 HG2 GLU A 52 12.655 -4.704 8.040 1.00 0.00 H new ATOM 0 HG3 GLU A 52 14.066 -5.074 7.068 1.00 0.00 H new ATOM 459 N ARG A 53 11.860 -0.248 5.962 1.00 0.00 N ATOM 460 CA ARG A 53 12.078 1.155 5.634 1.00 0.00 C ATOM 461 C ARG A 53 10.922 1.988 6.137 1.00 0.00 C ATOM 462 O ARG A 53 11.171 2.988 6.800 1.00 0.00 O ATOM 463 CB ARG A 53 12.242 1.349 4.118 1.00 0.00 C ATOM 464 CG ARG A 53 13.551 0.737 3.610 1.00 0.00 C ATOM 465 CD ARG A 53 13.632 0.852 2.087 1.00 0.00 C ATOM 466 NE ARG A 53 14.790 0.122 1.554 1.00 0.00 N ATOM 467 CZ ARG A 53 15.954 0.634 1.144 1.00 0.00 C ATOM 468 NH1 ARG A 53 16.254 1.907 1.367 1.00 0.00 N ATOM 469 NH2 ARG A 53 16.809 -0.133 0.485 1.00 0.00 N ATOM 0 H ARG A 53 11.344 -0.755 5.243 1.00 0.00 H new ATOM 0 HA ARG A 53 12.997 1.480 6.121 1.00 0.00 H new ATOM 0 HB2 ARG A 53 11.400 0.891 3.599 1.00 0.00 H new ATOM 0 HB3 ARG A 53 12.222 2.413 3.882 1.00 0.00 H new ATOM 0 HG2 ARG A 53 14.400 1.246 4.066 1.00 0.00 H new ATOM 0 HG3 ARG A 53 13.610 -0.310 3.907 1.00 0.00 H new ATOM 0 HD2 ARG A 53 12.717 0.460 1.642 1.00 0.00 H new ATOM 0 HD3 ARG A 53 13.700 1.902 1.803 1.00 0.00 H new ATOM 0 HE ARG A 53 14.695 -0.891 1.490 1.00 0.00 H new ATOM 0 HH11 ARG A 53 15.592 2.509 1.857 1.00 0.00 H new ATOM 0 HH12 ARG A 53 17.147 2.284 1.048 1.00 0.00 H new ATOM 0 HH21 ARG A 53 16.577 -1.108 0.294 1.00 0.00 H new ATOM 0 HH22 ARG A 53 17.700 0.251 0.169 1.00 0.00 H new ATOM 483 N VAL A 54 9.693 1.579 5.846 1.00 0.00 N ATOM 484 CA VAL A 54 8.501 2.378 6.049 1.00 0.00 C ATOM 485 C VAL A 54 7.513 1.696 6.997 1.00 0.00 C ATOM 486 O VAL A 54 7.687 0.536 7.379 1.00 0.00 O ATOM 487 CB VAL A 54 7.884 2.723 4.674 1.00 0.00 C ATOM 488 CG1 VAL A 54 8.730 3.738 3.893 1.00 0.00 C ATOM 489 CG2 VAL A 54 7.649 1.514 3.756 1.00 0.00 C ATOM 0 H VAL A 54 9.498 0.658 5.453 1.00 0.00 H new ATOM 0 HA VAL A 54 8.769 3.312 6.543 1.00 0.00 H new ATOM 0 HB VAL A 54 6.915 3.147 4.938 1.00 0.00 H new ATOM 0 HG11 VAL A 54 8.254 3.947 2.935 1.00 0.00 H new ATOM 0 HG12 VAL A 54 8.812 4.661 4.467 1.00 0.00 H new ATOM 0 HG13 VAL A 54 9.725 3.327 3.722 1.00 0.00 H new ATOM 0 HG21 VAL A 54 7.214 1.851 2.815 1.00 0.00 H new ATOM 0 HG22 VAL A 54 8.599 1.016 3.560 1.00 0.00 H new ATOM 0 HG23 VAL A 54 6.967 0.816 4.241 1.00 0.00 H new ATOM 499 N VAL A 55 6.470 2.419 7.388 1.00 0.00 N ATOM 500 CA VAL A 55 5.325 1.946 8.165 1.00 0.00 C ATOM 501 C VAL A 55 4.052 2.446 7.471 1.00 0.00 C ATOM 502 O VAL A 55 4.145 3.301 6.591 1.00 0.00 O ATOM 503 CB VAL A 55 5.438 2.436 9.627 1.00 0.00 C ATOM 504 CG1 VAL A 55 6.516 1.654 10.388 1.00 0.00 C ATOM 505 CG2 VAL A 55 5.742 3.939 9.746 1.00 0.00 C ATOM 0 H VAL A 55 6.394 3.410 7.159 1.00 0.00 H new ATOM 0 HA VAL A 55 5.296 0.857 8.208 1.00 0.00 H new ATOM 0 HB VAL A 55 4.457 2.258 10.068 1.00 0.00 H new ATOM 0 HG11 VAL A 55 6.574 2.019 11.413 1.00 0.00 H new ATOM 0 HG12 VAL A 55 6.261 0.594 10.394 1.00 0.00 H new ATOM 0 HG13 VAL A 55 7.480 1.792 9.898 1.00 0.00 H new ATOM 0 HG21 VAL A 55 5.808 4.215 10.799 1.00 0.00 H new ATOM 0 HG22 VAL A 55 6.689 4.159 9.253 1.00 0.00 H new ATOM 0 HG23 VAL A 55 4.945 4.510 9.270 1.00 0.00 H new ATOM 515 N ALA A 56 2.858 1.978 7.862 1.00 0.00 N ATOM 516 CA ALA A 56 1.619 2.479 7.262 1.00 0.00 C ATOM 517 C ALA A 56 1.502 3.993 7.472 1.00 0.00 C ATOM 518 O ALA A 56 1.021 4.705 6.598 1.00 0.00 O ATOM 519 CB ALA A 56 0.390 1.769 7.846 1.00 0.00 C ATOM 0 H ALA A 56 2.727 1.265 8.579 1.00 0.00 H new ATOM 0 HA ALA A 56 1.655 2.268 6.193 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -0.513 2.163 7.380 1.00 0.00 H new ATOM 0 HB2 ALA A 56 0.461 0.699 7.651 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.348 1.940 8.922 1.00 0.00 H new ATOM 525 N ASP A 57 1.986 4.490 8.612 1.00 0.00 N ATOM 526 CA ASP A 57 1.924 5.894 9.022 1.00 0.00 C ATOM 527 C ASP A 57 2.670 6.837 8.069 1.00 0.00 C ATOM 528 O ASP A 57 2.466 8.053 8.133 1.00 0.00 O ATOM 529 CB ASP A 57 2.507 6.043 10.433 1.00 0.00 C ATOM 530 CG ASP A 57 1.636 5.360 11.480 1.00 0.00 C ATOM 531 OD1 ASP A 57 0.645 5.979 11.926 1.00 0.00 O ATOM 532 OD2 ASP A 57 1.886 4.168 11.790 1.00 0.00 O ATOM 0 H ASP A 57 2.451 3.901 9.303 1.00 0.00 H new ATOM 0 HA ASP A 57 0.872 6.180 9.000 1.00 0.00 H new ATOM 0 HB2 ASP A 57 3.509 5.616 10.459 1.00 0.00 H new ATOM 0 HB3 ASP A 57 2.605 7.101 10.676 1.00 0.00 H new ATOM 537 N ASP A 58 3.526 6.301 7.199 1.00 0.00 N ATOM 538 CA ASP A 58 4.310 7.038 6.211 1.00 0.00 C ATOM 539 C ASP A 58 3.485 7.328 4.950 1.00 0.00 C ATOM 540 O ASP A 58 3.760 8.297 4.236 1.00 0.00 O ATOM 541 CB ASP A 58 5.542 6.204 5.819 1.00 0.00 C ATOM 542 CG ASP A 58 6.620 6.107 6.906 1.00 0.00 C ATOM 543 OD1 ASP A 58 6.559 6.840 7.917 1.00 0.00 O ATOM 544 OD2 ASP A 58 7.544 5.284 6.735 1.00 0.00 O ATOM 0 H ASP A 58 3.699 5.296 7.163 1.00 0.00 H new ATOM 0 HA ASP A 58 4.613 7.987 6.654 1.00 0.00 H new ATOM 0 HB2 ASP A 58 5.215 5.197 5.559 1.00 0.00 H new ATOM 0 HB3 ASP A 58 5.987 6.636 4.922 1.00 0.00 H new ATOM 549 N PHE A 59 2.474 6.503 4.657 1.00 0.00 N ATOM 550 CA PHE A 59 1.647 6.603 3.465 1.00 0.00 C ATOM 551 C PHE A 59 0.549 7.625 3.740 1.00 0.00 C ATOM 552 O PHE A 59 -0.489 7.300 4.321 1.00 0.00 O ATOM 553 CB PHE A 59 1.071 5.233 3.081 1.00 0.00 C ATOM 554 CG PHE A 59 2.109 4.244 2.580 1.00 0.00 C ATOM 555 CD1 PHE A 59 2.950 3.592 3.496 1.00 0.00 C ATOM 556 CD2 PHE A 59 2.252 3.985 1.205 1.00 0.00 C ATOM 557 CE1 PHE A 59 3.940 2.703 3.049 1.00 0.00 C ATOM 558 CE2 PHE A 59 3.222 3.070 0.754 1.00 0.00 C ATOM 559 CZ PHE A 59 4.069 2.431 1.677 1.00 0.00 C ATOM 0 H PHE A 59 2.207 5.728 5.264 1.00 0.00 H new ATOM 0 HA PHE A 59 2.244 6.933 2.615 1.00 0.00 H new ATOM 0 HB2 PHE A 59 0.567 4.807 3.948 1.00 0.00 H new ATOM 0 HB3 PHE A 59 0.314 5.372 2.309 1.00 0.00 H new ATOM 0 HD1 PHE A 59 2.834 3.776 4.554 1.00 0.00 H new ATOM 0 HD2 PHE A 59 1.616 4.490 0.493 1.00 0.00 H new ATOM 0 HE1 PHE A 59 4.602 2.229 3.759 1.00 0.00 H new ATOM 0 HE2 PHE A 59 3.316 2.859 -0.301 1.00 0.00 H new ATOM 0 HZ PHE A 59 4.817 1.733 1.332 1.00 0.00 H new ATOM 569 N TYR A 60 0.793 8.875 3.351 1.00 0.00 N ATOM 570 CA TYR A 60 -0.132 9.990 3.529 1.00 0.00 C ATOM 571 C TYR A 60 -1.490 9.692 2.895 1.00 0.00 C ATOM 572 O TYR A 60 -2.545 10.005 3.458 1.00 0.00 O ATOM 573 CB TYR A 60 0.500 11.233 2.895 1.00 0.00 C ATOM 574 CG TYR A 60 -0.313 12.496 3.064 1.00 0.00 C ATOM 575 CD1 TYR A 60 -0.271 13.164 4.297 1.00 0.00 C ATOM 576 CD2 TYR A 60 -1.084 13.013 2.004 1.00 0.00 C ATOM 577 CE1 TYR A 60 -0.967 14.368 4.475 1.00 0.00 C ATOM 578 CE2 TYR A 60 -1.778 14.225 2.172 1.00 0.00 C ATOM 579 CZ TYR A 60 -1.705 14.918 3.403 1.00 0.00 C ATOM 580 OH TYR A 60 -2.328 16.117 3.555 1.00 0.00 O ATOM 0 H TYR A 60 1.662 9.146 2.892 1.00 0.00 H new ATOM 0 HA TYR A 60 -0.308 10.155 4.592 1.00 0.00 H new ATOM 0 HB2 TYR A 60 1.487 11.388 3.332 1.00 0.00 H new ATOM 0 HB3 TYR A 60 0.648 11.049 1.831 1.00 0.00 H new ATOM 0 HD1 TYR A 60 0.301 12.748 5.114 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -1.142 12.481 1.066 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -0.939 14.874 5.429 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -2.367 14.627 1.361 1.00 0.00 H new ATOM 0 HH TYR A 60 -2.790 16.353 2.724 1.00 0.00 H new ATOM 590 N THR A 61 -1.462 9.083 1.718 1.00 0.00 N ATOM 591 CA THR A 61 -2.604 8.858 0.858 1.00 0.00 C ATOM 592 C THR A 61 -3.465 7.745 1.461 1.00 0.00 C ATOM 593 O THR A 61 -3.026 6.601 1.557 1.00 0.00 O ATOM 594 CB THR A 61 -2.110 8.564 -0.556 1.00 0.00 C ATOM 595 OG1 THR A 61 -0.763 8.953 -0.777 1.00 0.00 O ATOM 596 CG2 THR A 61 -2.930 9.309 -1.600 1.00 0.00 C ATOM 0 H THR A 61 -0.597 8.716 1.322 1.00 0.00 H new ATOM 0 HA THR A 61 -3.240 9.741 0.787 1.00 0.00 H new ATOM 0 HB THR A 61 -2.208 7.483 -0.652 1.00 0.00 H new ATOM 0 HG1 THR A 61 -0.184 8.163 -0.739 1.00 0.00 H new ATOM 0 HG21 THR A 61 -2.550 9.076 -2.595 1.00 0.00 H new ATOM 0 HG22 THR A 61 -3.974 9.003 -1.529 1.00 0.00 H new ATOM 0 HG23 THR A 61 -2.854 10.382 -1.425 1.00 0.00 H new ATOM 604 N ARG A 62 -4.682 8.064 1.908 1.00 0.00 N ATOM 605 CA ARG A 62 -5.550 7.139 2.637 1.00 0.00 C ATOM 606 C ARG A 62 -5.744 5.789 1.933 1.00 0.00 C ATOM 607 O ARG A 62 -5.578 4.779 2.615 1.00 0.00 O ATOM 608 CB ARG A 62 -6.887 7.797 3.037 1.00 0.00 C ATOM 609 CG ARG A 62 -6.690 9.072 3.881 1.00 0.00 C ATOM 610 CD ARG A 62 -7.853 9.405 4.828 1.00 0.00 C ATOM 611 NE ARG A 62 -9.098 9.772 4.136 1.00 0.00 N ATOM 612 CZ ARG A 62 -10.141 8.983 3.864 1.00 0.00 C ATOM 613 NH1 ARG A 62 -10.128 7.685 4.134 1.00 0.00 N ATOM 614 NH2 ARG A 62 -11.215 9.523 3.317 1.00 0.00 N ATOM 0 H ARG A 62 -5.097 8.986 1.771 1.00 0.00 H new ATOM 0 HA ARG A 62 -5.021 6.902 3.560 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -7.450 8.045 2.137 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -7.486 7.081 3.600 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -5.780 8.963 4.471 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -6.535 9.916 3.208 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -8.045 8.544 5.469 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -7.555 10.227 5.479 1.00 0.00 H new ATOM 0 HE ARG A 62 -9.174 10.741 3.828 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -9.305 7.261 4.562 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -10.941 7.110 3.914 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -11.235 10.522 3.112 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -12.024 8.941 3.100 1.00 0.00 H new ATOM 628 N PRO A 63 -6.052 5.683 0.624 1.00 0.00 N ATOM 629 CA PRO A 63 -6.175 4.373 -0.012 1.00 0.00 C ATOM 630 C PRO A 63 -4.836 3.630 -0.093 1.00 0.00 C ATOM 631 O PRO A 63 -4.826 2.407 -0.004 1.00 0.00 O ATOM 632 CB PRO A 63 -6.778 4.631 -1.394 1.00 0.00 C ATOM 633 CG PRO A 63 -6.378 6.072 -1.700 1.00 0.00 C ATOM 634 CD PRO A 63 -6.397 6.736 -0.325 1.00 0.00 C ATOM 0 HA PRO A 63 -6.813 3.715 0.578 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -6.384 3.939 -2.138 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -7.861 4.509 -1.387 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -5.392 6.127 -2.161 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -7.078 6.547 -2.387 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -5.682 7.557 -0.276 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -7.379 7.155 -0.106 1.00 0.00 H new ATOM 642 N HIS A 64 -3.704 4.331 -0.217 1.00 0.00 N ATOM 643 CA HIS A 64 -2.394 3.690 -0.156 1.00 0.00 C ATOM 644 C HIS A 64 -2.163 3.129 1.254 1.00 0.00 C ATOM 645 O HIS A 64 -1.756 1.979 1.415 1.00 0.00 O ATOM 646 CB HIS A 64 -1.289 4.681 -0.562 1.00 0.00 C ATOM 647 CG HIS A 64 -1.355 5.221 -1.973 1.00 0.00 C ATOM 648 ND1 HIS A 64 -0.502 6.173 -2.490 1.00 0.00 N ATOM 649 CD2 HIS A 64 -2.169 4.802 -2.992 1.00 0.00 C ATOM 650 CE1 HIS A 64 -0.761 6.299 -3.806 1.00 0.00 C ATOM 651 NE2 HIS A 64 -1.808 5.520 -4.136 1.00 0.00 N ATOM 0 H HIS A 64 -3.673 5.340 -0.360 1.00 0.00 H new ATOM 0 HA HIS A 64 -2.361 2.862 -0.864 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -1.316 5.524 0.128 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -0.325 4.191 -0.429 1.00 0.00 H new ATOM 0 HD1 HIS A 64 0.203 6.692 -1.967 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -2.946 4.055 -2.924 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -0.213 6.928 -4.491 1.00 0.00 H new ATOM 659 N ARG A 65 -2.491 3.914 2.287 1.00 0.00 N ATOM 660 CA ARG A 65 -2.426 3.501 3.679 1.00 0.00 C ATOM 661 C ARG A 65 -3.211 2.225 3.902 1.00 0.00 C ATOM 662 O ARG A 65 -2.671 1.273 4.449 1.00 0.00 O ATOM 663 CB ARG A 65 -2.939 4.621 4.593 1.00 0.00 C ATOM 664 CG ARG A 65 -2.177 4.605 5.920 1.00 0.00 C ATOM 665 CD ARG A 65 -2.864 5.416 7.019 1.00 0.00 C ATOM 666 NE ARG A 65 -4.194 4.890 7.351 1.00 0.00 N ATOM 667 CZ ARG A 65 -5.379 5.317 6.903 1.00 0.00 C ATOM 668 NH1 ARG A 65 -5.510 6.436 6.194 1.00 0.00 N ATOM 669 NH2 ARG A 65 -6.449 4.577 7.151 1.00 0.00 N ATOM 0 H ARG A 65 -2.815 4.874 2.167 1.00 0.00 H new ATOM 0 HA ARG A 65 -1.384 3.301 3.928 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -2.813 5.587 4.104 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -4.006 4.493 4.775 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -2.065 3.574 6.255 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -1.173 4.999 5.760 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -2.241 5.413 7.913 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -2.956 6.454 6.698 1.00 0.00 H new ATOM 0 HE ARG A 65 -4.217 4.105 8.001 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -4.689 7.000 5.975 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -6.431 6.729 5.869 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -6.356 3.705 7.672 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -7.366 4.879 6.821 1.00 0.00 H new ATOM 683 N HIS A 66 -4.468 2.205 3.459 1.00 0.00 N ATOM 684 CA HIS A 66 -5.360 1.071 3.589 1.00 0.00 C ATOM 685 C HIS A 66 -4.757 -0.235 3.089 1.00 0.00 C ATOM 686 O HIS A 66 -5.097 -1.288 3.630 1.00 0.00 O ATOM 687 CB HIS A 66 -6.649 1.347 2.816 1.00 0.00 C ATOM 688 CG HIS A 66 -7.631 2.183 3.569 1.00 0.00 C ATOM 689 ND1 HIS A 66 -8.209 3.368 3.178 1.00 0.00 N ATOM 690 CD2 HIS A 66 -8.187 1.810 4.754 1.00 0.00 C ATOM 691 CE1 HIS A 66 -9.094 3.705 4.125 1.00 0.00 C ATOM 692 NE2 HIS A 66 -9.116 2.787 5.109 1.00 0.00 N ATOM 0 H HIS A 66 -4.898 3.002 2.989 1.00 0.00 H new ATOM 0 HA HIS A 66 -5.554 0.949 4.655 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -6.401 1.847 1.880 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -7.117 0.398 2.556 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -7.951 0.919 5.317 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -9.707 4.594 4.102 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -9.697 2.803 5.947 1.00 0.00 H new ATOM 700 N ILE A 67 -3.930 -0.205 2.043 1.00 0.00 N ATOM 701 CA ILE A 67 -3.278 -1.407 1.549 1.00 0.00 C ATOM 702 C ILE A 67 -2.313 -1.883 2.631 1.00 0.00 C ATOM 703 O ILE A 67 -2.491 -2.990 3.128 1.00 0.00 O ATOM 704 CB ILE A 67 -2.656 -1.176 0.158 1.00 0.00 C ATOM 705 CG1 ILE A 67 -3.771 -0.847 -0.859 1.00 0.00 C ATOM 706 CG2 ILE A 67 -1.899 -2.437 -0.290 1.00 0.00 C ATOM 707 CD1 ILE A 67 -3.264 -0.228 -2.158 1.00 0.00 C ATOM 0 H ILE A 67 -3.699 0.642 1.524 1.00 0.00 H new ATOM 0 HA ILE A 67 -3.990 -2.213 1.372 1.00 0.00 H new ATOM 0 HB ILE A 67 -1.958 -0.341 0.210 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -4.316 -1.761 -1.093 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -4.481 -0.162 -0.395 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -1.461 -2.268 -1.274 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -1.108 -2.660 0.426 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -2.591 -3.278 -0.340 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -4.107 -0.027 -2.819 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -2.744 0.705 -1.938 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -2.577 -0.919 -2.647 1.00 0.00 H new ATOM 719 N PHE A 68 -1.357 -1.047 3.050 1.00 0.00 N ATOM 720 CA PHE A 68 -0.394 -1.406 4.092 1.00 0.00 C ATOM 721 C PHE A 68 -1.118 -1.884 5.355 1.00 0.00 C ATOM 722 O PHE A 68 -0.752 -2.917 5.914 1.00 0.00 O ATOM 723 CB PHE A 68 0.530 -0.213 4.393 1.00 0.00 C ATOM 724 CG PHE A 68 1.860 -0.568 5.047 1.00 0.00 C ATOM 725 CD1 PHE A 68 1.919 -1.153 6.329 1.00 0.00 C ATOM 726 CD2 PHE A 68 3.060 -0.292 4.368 1.00 0.00 C ATOM 727 CE1 PHE A 68 3.158 -1.462 6.917 1.00 0.00 C ATOM 728 CE2 PHE A 68 4.299 -0.575 4.966 1.00 0.00 C ATOM 729 CZ PHE A 68 4.352 -1.168 6.238 1.00 0.00 C ATOM 0 H PHE A 68 -1.231 -0.106 2.677 1.00 0.00 H new ATOM 0 HA PHE A 68 0.223 -2.230 3.734 1.00 0.00 H new ATOM 0 HB2 PHE A 68 0.732 0.314 3.460 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -0.002 0.482 5.043 1.00 0.00 H new ATOM 0 HD1 PHE A 68 1.005 -1.365 6.863 1.00 0.00 H new ATOM 0 HD2 PHE A 68 3.029 0.141 3.379 1.00 0.00 H new ATOM 0 HE1 PHE A 68 3.192 -1.926 7.892 1.00 0.00 H new ATOM 0 HE2 PHE A 68 5.215 -0.336 4.446 1.00 0.00 H new ATOM 0 HZ PHE A 68 5.305 -1.397 6.691 1.00 0.00 H new ATOM 739 N THR A 69 -2.157 -1.164 5.784 1.00 0.00 N ATOM 740 CA THR A 69 -2.986 -1.528 6.915 1.00 0.00 C ATOM 741 C THR A 69 -3.522 -2.936 6.741 1.00 0.00 C ATOM 742 O THR A 69 -3.242 -3.760 7.607 1.00 0.00 O ATOM 743 CB THR A 69 -4.122 -0.507 7.098 1.00 0.00 C ATOM 744 OG1 THR A 69 -3.604 0.789 7.327 1.00 0.00 O ATOM 745 CG2 THR A 69 -5.069 -0.863 8.249 1.00 0.00 C ATOM 0 H THR A 69 -2.445 -0.293 5.338 1.00 0.00 H new ATOM 0 HA THR A 69 -2.380 -1.512 7.821 1.00 0.00 H new ATOM 0 HB THR A 69 -4.692 -0.531 6.169 1.00 0.00 H new ATOM 0 HG1 THR A 69 -3.235 1.146 6.492 1.00 0.00 H new ATOM 0 HG21 THR A 69 -5.848 -0.105 8.327 1.00 0.00 H new ATOM 0 HG22 THR A 69 -5.525 -1.834 8.058 1.00 0.00 H new ATOM 0 HG23 THR A 69 -4.508 -0.904 9.183 1.00 0.00 H new ATOM 753 N GLU A 70 -4.306 -3.225 5.701 1.00 0.00 N ATOM 754 CA GLU A 70 -4.992 -4.507 5.660 1.00 0.00 C ATOM 755 C GLU A 70 -4.010 -5.647 5.361 1.00 0.00 C ATOM 756 O GLU A 70 -4.220 -6.761 5.833 1.00 0.00 O ATOM 757 CB GLU A 70 -6.205 -4.454 4.721 1.00 0.00 C ATOM 758 CG GLU A 70 -7.203 -5.590 5.022 1.00 0.00 C ATOM 759 CD GLU A 70 -7.895 -5.493 6.389 1.00 0.00 C ATOM 760 OE1 GLU A 70 -7.816 -4.432 7.052 1.00 0.00 O ATOM 761 OE2 GLU A 70 -8.577 -6.469 6.781 1.00 0.00 O ATOM 0 H GLU A 70 -4.475 -2.610 4.905 1.00 0.00 H new ATOM 0 HA GLU A 70 -5.400 -4.726 6.647 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -6.706 -3.491 4.826 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -5.869 -4.528 3.687 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -7.966 -5.600 4.244 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -6.676 -6.542 4.964 1.00 0.00 H new ATOM 768 N MET A 71 -2.896 -5.369 4.675 1.00 0.00 N ATOM 769 CA MET A 71 -1.791 -6.307 4.530 1.00 0.00 C ATOM 770 C MET A 71 -1.255 -6.682 5.920 1.00 0.00 C ATOM 771 O MET A 71 -1.232 -7.861 6.274 1.00 0.00 O ATOM 772 CB MET A 71 -0.690 -5.695 3.651 1.00 0.00 C ATOM 773 CG MET A 71 -1.034 -5.624 2.157 1.00 0.00 C ATOM 774 SD MET A 71 0.344 -4.976 1.172 1.00 0.00 S ATOM 775 CE MET A 71 -0.130 -5.478 -0.503 1.00 0.00 C ATOM 0 H MET A 71 -2.740 -4.478 4.203 1.00 0.00 H new ATOM 0 HA MET A 71 -2.140 -7.215 4.038 1.00 0.00 H new ATOM 0 HB2 MET A 71 -0.474 -4.688 4.009 1.00 0.00 H new ATOM 0 HB3 MET A 71 0.222 -6.279 3.774 1.00 0.00 H new ATOM 0 HG2 MET A 71 -1.300 -6.619 1.799 1.00 0.00 H new ATOM 0 HG3 MET A 71 -1.910 -4.990 2.016 1.00 0.00 H new ATOM 0 HE1 MET A 71 0.571 -5.054 -1.222 1.00 0.00 H new ATOM 0 HE2 MET A 71 -0.111 -6.565 -0.576 1.00 0.00 H new ATOM 0 HE3 MET A 71 -1.135 -5.117 -0.720 1.00 0.00 H new ATOM 785 N ALA A 72 -0.871 -5.701 6.744 1.00 0.00 N ATOM 786 CA ALA A 72 -0.382 -5.956 8.097 1.00 0.00 C ATOM 787 C ALA A 72 -1.472 -6.574 8.989 1.00 0.00 C ATOM 788 O ALA A 72 -1.178 -7.391 9.865 1.00 0.00 O ATOM 789 CB ALA A 72 0.143 -4.652 8.701 1.00 0.00 C ATOM 0 H ALA A 72 -0.891 -4.713 6.490 1.00 0.00 H new ATOM 0 HA ALA A 72 0.430 -6.681 8.041 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.508 -4.840 9.711 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.957 -4.268 8.086 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -0.662 -3.918 8.737 1.00 0.00 H new ATOM 795 N ARG A 73 -2.741 -6.206 8.774 1.00 0.00 N ATOM 796 CA ARG A 73 -3.894 -6.782 9.466 1.00 0.00 C ATOM 797 C ARG A 73 -3.962 -8.275 9.195 1.00 0.00 C ATOM 798 O ARG A 73 -4.161 -9.044 10.130 1.00 0.00 O ATOM 799 CB ARG A 73 -5.191 -6.064 9.024 1.00 0.00 C ATOM 800 CG ARG A 73 -6.387 -6.208 9.971 1.00 0.00 C ATOM 801 CD ARG A 73 -7.123 -7.561 9.928 1.00 0.00 C ATOM 802 NE ARG A 73 -7.834 -7.810 11.193 1.00 0.00 N ATOM 803 CZ ARG A 73 -7.235 -7.994 12.376 1.00 0.00 C ATOM 804 NH1 ARG A 73 -5.927 -8.234 12.456 1.00 0.00 N ATOM 805 NH2 ARG A 73 -7.959 -7.916 13.486 1.00 0.00 N ATOM 0 H ARG A 73 -2.997 -5.485 8.100 1.00 0.00 H new ATOM 0 HA ARG A 73 -3.785 -6.639 10.541 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -4.973 -5.003 8.902 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -5.479 -6.445 8.044 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -6.041 -6.037 10.990 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -7.104 -5.419 9.742 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -7.832 -7.568 9.100 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -6.408 -8.363 9.743 1.00 0.00 H new ATOM 0 HE ARG A 73 -8.853 -7.845 11.166 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -5.364 -8.280 11.607 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -5.488 -8.372 13.367 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -8.958 -7.718 13.430 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -7.516 -8.054 14.394 1.00 0.00 H new ATOM 819 N LEU A 74 -3.830 -8.696 7.942 1.00 0.00 N ATOM 820 CA LEU A 74 -3.819 -10.092 7.554 1.00 0.00 C ATOM 821 C LEU A 74 -2.602 -10.803 8.102 1.00 0.00 C ATOM 822 O LEU A 74 -2.737 -11.921 8.605 1.00 0.00 O ATOM 823 CB LEU A 74 -3.825 -10.156 6.024 1.00 0.00 C ATOM 824 CG LEU A 74 -5.237 -10.005 5.450 1.00 0.00 C ATOM 825 CD1 LEU A 74 -5.116 -9.595 3.985 1.00 0.00 C ATOM 826 CD2 LEU A 74 -6.025 -11.315 5.602 1.00 0.00 C ATOM 0 H LEU A 74 -3.726 -8.057 7.154 1.00 0.00 H new ATOM 0 HA LEU A 74 -4.697 -10.592 7.963 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -3.185 -9.369 5.626 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.401 -11.106 5.699 1.00 0.00 H new ATOM 0 HG LEU A 74 -5.786 -9.238 5.996 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -6.111 -9.482 3.555 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -4.581 -8.648 3.915 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -4.569 -10.362 3.436 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -7.025 -11.188 5.188 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -5.510 -12.113 5.068 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -6.099 -11.575 6.658 1.00 0.00 H new ATOM 838 N GLN A 75 -1.436 -10.171 8.049 1.00 0.00 N ATOM 839 CA GLN A 75 -0.205 -10.754 8.551 1.00 0.00 C ATOM 840 C GLN A 75 -0.278 -11.035 10.042 1.00 0.00 C ATOM 841 O GLN A 75 0.329 -11.997 10.510 1.00 0.00 O ATOM 842 CB GLN A 75 0.937 -9.783 8.283 1.00 0.00 C ATOM 843 CG GLN A 75 2.279 -10.520 8.277 1.00 0.00 C ATOM 844 CD GLN A 75 3.387 -9.700 7.661 1.00 0.00 C ATOM 845 OE1 GLN A 75 4.242 -9.166 8.366 1.00 0.00 O ATOM 846 NE2 GLN A 75 3.407 -9.619 6.342 1.00 0.00 N ATOM 0 H GLN A 75 -1.321 -9.237 7.655 1.00 0.00 H new ATOM 0 HA GLN A 75 -0.043 -11.703 8.040 1.00 0.00 H new ATOM 0 HB2 GLN A 75 0.783 -9.288 7.324 1.00 0.00 H new ATOM 0 HB3 GLN A 75 0.947 -9.005 9.046 1.00 0.00 H new ATOM 0 HG2 GLN A 75 2.551 -10.782 9.300 1.00 0.00 H new ATOM 0 HG3 GLN A 75 2.174 -11.455 7.726 1.00 0.00 H new ATOM 0 HE21 GLN A 75 2.680 -10.076 5.792 1.00 0.00 H new ATOM 0 HE22 GLN A 75 4.150 -9.100 5.874 1.00 0.00 H new ATOM 855 N GLU A 76 -1.080 -10.256 10.765 1.00 0.00 N ATOM 856 CA GLU A 76 -1.398 -10.549 12.160 1.00 0.00 C ATOM 857 C GLU A 76 -1.955 -11.969 12.291 1.00 0.00 C ATOM 858 O GLU A 76 -1.549 -12.719 13.184 1.00 0.00 O ATOM 859 CB GLU A 76 -2.388 -9.527 12.737 1.00 0.00 C ATOM 860 CG GLU A 76 -2.614 -9.772 14.229 1.00 0.00 C ATOM 861 CD GLU A 76 -3.663 -8.863 14.866 1.00 0.00 C ATOM 862 OE1 GLU A 76 -3.861 -7.703 14.423 1.00 0.00 O ATOM 863 OE2 GLU A 76 -4.286 -9.301 15.856 1.00 0.00 O ATOM 0 H GLU A 76 -1.524 -9.412 10.404 1.00 0.00 H new ATOM 0 HA GLU A 76 -0.475 -10.477 12.736 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -2.006 -8.518 12.583 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.337 -9.593 12.205 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -2.915 -10.810 14.373 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -1.668 -9.638 14.754 1.00 0.00 H new ATOM 870 N SER A 77 -2.839 -12.378 11.378 1.00 0.00 N ATOM 871 CA SER A 77 -3.382 -13.736 11.379 1.00 0.00 C ATOM 872 C SER A 77 -2.454 -14.736 10.676 1.00 0.00 C ATOM 873 O SER A 77 -2.829 -15.890 10.480 1.00 0.00 O ATOM 874 CB SER A 77 -4.795 -13.736 10.790 1.00 0.00 C ATOM 875 OG SER A 77 -4.862 -13.295 9.441 1.00 0.00 O ATOM 0 H SER A 77 -3.194 -11.786 10.627 1.00 0.00 H new ATOM 0 HA SER A 77 -3.447 -14.075 12.413 1.00 0.00 H new ATOM 0 HB2 SER A 77 -5.203 -14.745 10.852 1.00 0.00 H new ATOM 0 HB3 SER A 77 -5.432 -13.097 11.402 1.00 0.00 H new ATOM 0 HG SER A 77 -3.963 -13.062 9.128 1.00 0.00 H new ATOM 881 N GLY A 78 -1.256 -14.316 10.270 1.00 0.00 N ATOM 882 CA GLY A 78 -0.326 -15.134 9.508 1.00 0.00 C ATOM 883 C GLY A 78 -0.809 -15.344 8.078 1.00 0.00 C ATOM 884 O GLY A 78 -0.256 -16.191 7.375 1.00 0.00 O ATOM 0 H GLY A 78 -0.903 -13.380 10.468 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.654 -14.657 9.496 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -0.204 -16.100 9.998 1.00 0.00 H new ATOM 888 N SER A 79 -1.829 -14.599 7.650 1.00 0.00 N ATOM 889 CA SER A 79 -2.359 -14.698 6.299 1.00 0.00 C ATOM 890 C SER A 79 -1.414 -13.949 5.357 1.00 0.00 C ATOM 891 O SER A 79 -0.706 -13.046 5.817 1.00 0.00 O ATOM 892 CB SER A 79 -3.763 -14.092 6.245 1.00 0.00 C ATOM 893 OG SER A 79 -4.677 -14.816 7.050 1.00 0.00 O ATOM 0 H SER A 79 -2.307 -13.912 8.233 1.00 0.00 H new ATOM 0 HA SER A 79 -2.430 -15.742 5.995 1.00 0.00 H new ATOM 0 HB2 SER A 79 -3.725 -13.055 6.580 1.00 0.00 H new ATOM 0 HB3 SER A 79 -4.115 -14.081 5.214 1.00 0.00 H new ATOM 0 HG SER A 79 -4.797 -14.353 7.906 1.00 0.00 H new ATOM 899 N PRO A 80 -1.394 -14.276 4.055 1.00 0.00 N ATOM 900 CA PRO A 80 -0.587 -13.543 3.098 1.00 0.00 C ATOM 901 C PRO A 80 -1.139 -12.133 2.904 1.00 0.00 C ATOM 902 O PRO A 80 -2.308 -11.858 3.184 1.00 0.00 O ATOM 903 CB PRO A 80 -0.667 -14.348 1.800 1.00 0.00 C ATOM 904 CG PRO A 80 -2.036 -15.018 1.895 1.00 0.00 C ATOM 905 CD PRO A 80 -2.154 -15.321 3.386 1.00 0.00 C ATOM 0 HA PRO A 80 0.444 -13.428 3.434 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -0.592 -13.706 0.922 1.00 0.00 H new ATOM 0 HB3 PRO A 80 0.137 -15.081 1.729 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -2.834 -14.361 1.550 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -2.087 -15.924 1.292 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -3.196 -15.315 3.707 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -1.754 -16.308 3.619 1.00 0.00 H new ATOM 913 N ILE A 81 -0.315 -11.285 2.299 1.00 0.00 N ATOM 914 CA ILE A 81 -0.665 -9.937 1.861 1.00 0.00 C ATOM 915 C ILE A 81 -1.109 -9.936 0.388 1.00 0.00 C ATOM 916 O ILE A 81 -1.205 -8.884 -0.243 1.00 0.00 O ATOM 917 CB ILE A 81 0.539 -9.003 2.142 1.00 0.00 C ATOM 918 CG1 ILE A 81 1.753 -9.354 1.255 1.00 0.00 C ATOM 919 CG2 ILE A 81 0.925 -9.024 3.638 1.00 0.00 C ATOM 920 CD1 ILE A 81 2.928 -8.400 1.444 1.00 0.00 C ATOM 0 H ILE A 81 0.654 -11.527 2.092 1.00 0.00 H new ATOM 0 HA ILE A 81 -1.521 -9.561 2.421 1.00 0.00 H new ATOM 0 HB ILE A 81 0.228 -7.990 1.887 1.00 0.00 H new ATOM 0 HG12 ILE A 81 2.078 -10.370 1.480 1.00 0.00 H new ATOM 0 HG13 ILE A 81 1.447 -9.341 0.209 1.00 0.00 H new ATOM 0 HG21 ILE A 81 1.773 -8.359 3.804 1.00 0.00 H new ATOM 0 HG22 ILE A 81 0.078 -8.689 4.237 1.00 0.00 H new ATOM 0 HG23 ILE A 81 1.197 -10.039 3.929 1.00 0.00 H new ATOM 0 HD11 ILE A 81 3.749 -8.701 0.793 1.00 0.00 H new ATOM 0 HD12 ILE A 81 2.618 -7.386 1.192 1.00 0.00 H new ATOM 0 HD13 ILE A 81 3.258 -8.431 2.482 1.00 0.00 H new ATOM 932 N ASP A 82 -1.380 -11.128 -0.143 1.00 0.00 N ATOM 933 CA ASP A 82 -1.674 -11.386 -1.549 1.00 0.00 C ATOM 934 C ASP A 82 -2.960 -10.678 -1.943 1.00 0.00 C ATOM 935 O ASP A 82 -3.898 -10.652 -1.148 1.00 0.00 O ATOM 936 CB ASP A 82 -1.893 -12.893 -1.770 1.00 0.00 C ATOM 937 CG ASP A 82 -0.666 -13.605 -2.313 1.00 0.00 C ATOM 938 OD1 ASP A 82 0.189 -14.045 -1.518 1.00 0.00 O ATOM 939 OD2 ASP A 82 -0.613 -13.830 -3.544 1.00 0.00 O ATOM 0 H ASP A 82 -1.401 -11.977 0.422 1.00 0.00 H new ATOM 0 HA ASP A 82 -0.836 -11.027 -2.146 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -2.183 -13.353 -0.826 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -2.723 -13.035 -2.462 1.00 0.00 H new ATOM 944 N LEU A 83 -3.039 -10.194 -3.189 1.00 0.00 N ATOM 945 CA LEU A 83 -4.148 -9.378 -3.688 1.00 0.00 C ATOM 946 C LEU A 83 -5.504 -9.994 -3.355 1.00 0.00 C ATOM 947 O LEU A 83 -6.377 -9.292 -2.860 1.00 0.00 O ATOM 948 CB LEU A 83 -4.012 -9.113 -5.194 1.00 0.00 C ATOM 949 CG LEU A 83 -5.243 -8.444 -5.823 1.00 0.00 C ATOM 950 CD1 LEU A 83 -5.676 -7.166 -5.136 1.00 0.00 C ATOM 951 CD2 LEU A 83 -4.935 -8.006 -7.246 1.00 0.00 C ATOM 0 H LEU A 83 -2.318 -10.363 -3.891 1.00 0.00 H new ATOM 0 HA LEU A 83 -4.096 -8.418 -3.174 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -3.141 -8.481 -5.364 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -3.824 -10.058 -5.704 1.00 0.00 H new ATOM 0 HG LEU A 83 -6.023 -9.201 -5.744 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -6.551 -6.759 -5.643 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -5.925 -7.378 -4.096 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -4.864 -6.440 -5.174 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -5.816 -7.533 -7.680 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -4.109 -7.295 -7.237 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -4.659 -8.875 -7.843 1.00 0.00 H new ATOM 963 N ILE A 84 -5.719 -11.279 -3.626 1.00 0.00 N ATOM 964 CA ILE A 84 -7.021 -11.872 -3.422 1.00 0.00 C ATOM 965 C ILE A 84 -7.369 -11.838 -1.934 1.00 0.00 C ATOM 966 O ILE A 84 -8.384 -11.261 -1.559 1.00 0.00 O ATOM 967 CB ILE A 84 -7.028 -13.275 -4.043 1.00 0.00 C ATOM 968 CG1 ILE A 84 -6.317 -13.338 -5.420 1.00 0.00 C ATOM 969 CG2 ILE A 84 -8.461 -13.821 -4.105 1.00 0.00 C ATOM 970 CD1 ILE A 84 -6.974 -12.552 -6.561 1.00 0.00 C ATOM 0 H ILE A 84 -5.009 -11.918 -3.984 1.00 0.00 H new ATOM 0 HA ILE A 84 -7.806 -11.306 -3.924 1.00 0.00 H new ATOM 0 HB ILE A 84 -6.441 -13.921 -3.390 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.298 -12.973 -5.296 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -6.246 -14.383 -5.721 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -8.452 -14.817 -4.548 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -8.874 -13.875 -3.098 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -9.077 -13.159 -4.714 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -6.387 -12.673 -7.471 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -7.983 -12.928 -6.728 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -7.020 -11.496 -6.296 1.00 0.00 H new ATOM 982 N THR A 85 -6.512 -12.397 -1.083 1.00 0.00 N ATOM 983 CA THR A 85 -6.693 -12.395 0.358 1.00 0.00 C ATOM 984 C THR A 85 -6.901 -10.975 0.907 1.00 0.00 C ATOM 985 O THR A 85 -7.816 -10.751 1.700 1.00 0.00 O ATOM 986 CB THR A 85 -5.535 -13.172 1.009 1.00 0.00 C ATOM 987 OG1 THR A 85 -5.646 -14.548 0.674 1.00 0.00 O ATOM 988 CG2 THR A 85 -5.538 -13.071 2.530 1.00 0.00 C ATOM 0 H THR A 85 -5.660 -12.870 -1.385 1.00 0.00 H new ATOM 0 HA THR A 85 -7.615 -12.914 0.621 1.00 0.00 H new ATOM 0 HB THR A 85 -4.612 -12.731 0.633 1.00 0.00 H new ATOM 0 HG1 THR A 85 -4.909 -15.045 1.086 1.00 0.00 H new ATOM 0 HG21 THR A 85 -4.699 -13.638 2.934 1.00 0.00 H new ATOM 0 HG22 THR A 85 -5.445 -12.026 2.825 1.00 0.00 H new ATOM 0 HG23 THR A 85 -6.472 -13.477 2.920 1.00 0.00 H new ATOM 996 N LEU A 86 -6.093 -10.022 0.452 1.00 0.00 N ATOM 997 CA LEU A 86 -6.156 -8.598 0.755 1.00 0.00 C ATOM 998 C LEU A 86 -7.515 -8.011 0.422 1.00 0.00 C ATOM 999 O LEU A 86 -8.171 -7.441 1.289 1.00 0.00 O ATOM 1000 CB LEU A 86 -5.055 -7.874 -0.030 1.00 0.00 C ATOM 1001 CG LEU A 86 -5.041 -6.352 0.176 1.00 0.00 C ATOM 1002 CD1 LEU A 86 -4.645 -5.980 1.607 1.00 0.00 C ATOM 1003 CD2 LEU A 86 -4.087 -5.722 -0.836 1.00 0.00 C ATOM 0 H LEU A 86 -5.324 -10.241 -0.182 1.00 0.00 H new ATOM 0 HA LEU A 86 -6.003 -8.463 1.826 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -4.087 -8.279 0.264 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -5.180 -8.086 -1.092 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.048 -5.966 0.017 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -4.646 -4.895 1.715 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -5.359 -6.415 2.307 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.648 -6.365 1.820 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -4.071 -4.641 -0.697 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -3.084 -6.122 -0.688 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -4.424 -5.953 -1.847 1.00 0.00 H new ATOM 1015 N ALA A 87 -7.910 -8.104 -0.842 1.00 0.00 N ATOM 1016 CA ALA A 87 -9.157 -7.552 -1.347 1.00 0.00 C ATOM 1017 C ALA A 87 -10.348 -8.171 -0.619 1.00 0.00 C ATOM 1018 O ALA A 87 -11.288 -7.460 -0.264 1.00 0.00 O ATOM 1019 CB ALA A 87 -9.244 -7.802 -2.847 1.00 0.00 C ATOM 0 H ALA A 87 -7.359 -8.576 -1.559 1.00 0.00 H new ATOM 0 HA ALA A 87 -9.180 -6.478 -1.165 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -10.177 -7.390 -3.231 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -8.403 -7.321 -3.345 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -9.214 -8.874 -3.039 1.00 0.00 H new ATOM 1025 N GLU A 88 -10.288 -9.476 -0.355 1.00 0.00 N ATOM 1026 CA GLU A 88 -11.280 -10.185 0.432 1.00 0.00 C ATOM 1027 C GLU A 88 -11.347 -9.609 1.845 1.00 0.00 C ATOM 1028 O GLU A 88 -12.449 -9.411 2.361 1.00 0.00 O ATOM 1029 CB GLU A 88 -10.960 -11.693 0.462 1.00 0.00 C ATOM 1030 CG GLU A 88 -11.179 -12.401 -0.887 1.00 0.00 C ATOM 1031 CD GLU A 88 -12.640 -12.728 -1.173 1.00 0.00 C ATOM 1032 OE1 GLU A 88 -13.558 -12.047 -0.657 1.00 0.00 O ATOM 1033 OE2 GLU A 88 -12.908 -13.697 -1.916 1.00 0.00 O ATOM 0 H GLU A 88 -9.533 -10.075 -0.691 1.00 0.00 H new ATOM 0 HA GLU A 88 -12.258 -10.055 -0.032 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -9.923 -11.829 0.769 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -11.582 -12.172 1.218 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -10.793 -11.769 -1.687 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -10.599 -13.324 -0.902 1.00 0.00 H new ATOM 1040 N SER A 89 -10.199 -9.313 2.458 1.00 0.00 N ATOM 1041 CA SER A 89 -10.124 -8.764 3.806 1.00 0.00 C ATOM 1042 C SER A 89 -10.696 -7.351 3.817 1.00 0.00 C ATOM 1043 O SER A 89 -11.468 -6.994 4.702 1.00 0.00 O ATOM 1044 CB SER A 89 -8.677 -8.811 4.310 1.00 0.00 C ATOM 1045 OG SER A 89 -8.614 -8.848 5.726 1.00 0.00 O ATOM 0 H SER A 89 -9.286 -9.451 2.024 1.00 0.00 H new ATOM 0 HA SER A 89 -10.724 -9.366 4.489 1.00 0.00 H new ATOM 0 HB2 SER A 89 -8.178 -9.689 3.901 1.00 0.00 H new ATOM 0 HB3 SER A 89 -8.136 -7.938 3.945 1.00 0.00 H new ATOM 0 HG SER A 89 -8.793 -7.954 6.085 1.00 0.00 H new ATOM 1051 N LEU A 90 -10.382 -6.552 2.800 1.00 0.00 N ATOM 1052 CA LEU A 90 -10.923 -5.213 2.637 1.00 0.00 C ATOM 1053 C LEU A 90 -12.436 -5.277 2.506 1.00 0.00 C ATOM 1054 O LEU A 90 -13.122 -4.445 3.092 1.00 0.00 O ATOM 1055 CB LEU A 90 -10.286 -4.531 1.422 1.00 0.00 C ATOM 1056 CG LEU A 90 -8.837 -4.108 1.722 1.00 0.00 C ATOM 1057 CD1 LEU A 90 -8.043 -3.976 0.424 1.00 0.00 C ATOM 1058 CD2 LEU A 90 -8.777 -2.810 2.549 1.00 0.00 C ATOM 0 H LEU A 90 -9.736 -6.824 2.059 1.00 0.00 H new ATOM 0 HA LEU A 90 -10.685 -4.618 3.518 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -10.301 -5.211 0.570 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -10.873 -3.656 1.142 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.380 -4.890 2.329 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -7.020 -3.676 0.652 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -8.033 -4.934 -0.095 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.508 -3.223 -0.212 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.736 -2.547 2.738 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -9.260 -2.004 1.997 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -9.292 -2.959 3.498 1.00 0.00 H new ATOM 1070 N GLU A 91 -12.987 -6.257 1.794 1.00 0.00 N ATOM 1071 CA GLU A 91 -14.409 -6.505 1.789 1.00 0.00 C ATOM 1072 C GLU A 91 -14.952 -6.917 3.160 1.00 0.00 C ATOM 1073 O GLU A 91 -16.040 -6.472 3.522 1.00 0.00 O ATOM 1074 CB GLU A 91 -14.753 -7.562 0.732 1.00 0.00 C ATOM 1075 CG GLU A 91 -16.006 -7.060 0.027 1.00 0.00 C ATOM 1076 CD GLU A 91 -16.799 -8.139 -0.703 1.00 0.00 C ATOM 1077 OE1 GLU A 91 -17.003 -9.242 -0.154 1.00 0.00 O ATOM 1078 OE2 GLU A 91 -17.334 -7.841 -1.796 1.00 0.00 O ATOM 0 H GLU A 91 -12.452 -6.897 1.207 1.00 0.00 H new ATOM 0 HA GLU A 91 -14.896 -5.563 1.538 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -13.932 -7.689 0.026 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -14.928 -8.533 1.194 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -16.655 -6.585 0.763 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -15.720 -6.290 -0.690 1.00 0.00 H new ATOM 1085 N ARG A 92 -14.214 -7.701 3.956 1.00 0.00 N ATOM 1086 CA ARG A 92 -14.609 -8.013 5.336 1.00 0.00 C ATOM 1087 C ARG A 92 -14.577 -6.758 6.213 1.00 0.00 C ATOM 1088 O ARG A 92 -15.297 -6.686 7.209 1.00 0.00 O ATOM 1089 CB ARG A 92 -13.723 -9.112 5.955 1.00 0.00 C ATOM 1090 CG ARG A 92 -13.601 -10.396 5.111 1.00 0.00 C ATOM 1091 CD ARG A 92 -13.790 -11.713 5.884 1.00 0.00 C ATOM 1092 NE ARG A 92 -15.008 -12.420 5.450 1.00 0.00 N ATOM 1093 CZ ARG A 92 -16.272 -12.030 5.652 1.00 0.00 C ATOM 1094 NH1 ARG A 92 -16.545 -11.096 6.554 1.00 0.00 N ATOM 1095 NH2 ARG A 92 -17.251 -12.572 4.933 1.00 0.00 N ATOM 0 H ARG A 92 -13.336 -8.133 3.667 1.00 0.00 H new ATOM 0 HA ARG A 92 -15.631 -8.390 5.295 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -12.725 -8.705 6.118 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -14.124 -9.374 6.934 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -14.339 -10.355 4.310 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -12.618 -10.409 4.639 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -12.922 -12.354 5.732 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -13.849 -11.505 6.952 1.00 0.00 H new ATOM 0 HE ARG A 92 -14.874 -13.296 4.944 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -15.791 -10.674 7.095 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -17.509 -10.800 6.706 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -17.036 -13.281 4.232 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -18.216 -12.279 5.083 1.00 0.00 H new ATOM 1109 N GLN A 93 -13.762 -5.757 5.877 1.00 0.00 N ATOM 1110 CA GLN A 93 -13.806 -4.436 6.497 1.00 0.00 C ATOM 1111 C GLN A 93 -14.934 -3.575 5.908 1.00 0.00 C ATOM 1112 O GLN A 93 -15.306 -2.582 6.526 1.00 0.00 O ATOM 1113 CB GLN A 93 -12.460 -3.708 6.336 1.00 0.00 C ATOM 1114 CG GLN A 93 -11.228 -4.424 6.912 1.00 0.00 C ATOM 1115 CD GLN A 93 -11.075 -4.296 8.428 1.00 0.00 C ATOM 1116 OE1 GLN A 93 -12.048 -4.196 9.174 1.00 0.00 O ATOM 1117 NE2 GLN A 93 -9.852 -4.276 8.926 1.00 0.00 N ATOM 0 H GLN A 93 -13.044 -5.844 5.157 1.00 0.00 H new ATOM 0 HA GLN A 93 -14.005 -4.586 7.558 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -12.290 -3.534 5.274 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -12.541 -2.730 6.810 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -11.283 -5.481 6.652 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.334 -4.024 6.434 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -9.047 -4.359 8.305 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -9.712 -4.177 9.932 1.00 0.00 H new ATOM 1126 N GLY A 94 -15.494 -3.920 4.744 1.00 0.00 N ATOM 1127 CA GLY A 94 -16.436 -3.076 4.014 1.00 0.00 C ATOM 1128 C GLY A 94 -15.743 -1.906 3.306 1.00 0.00 C ATOM 1129 O GLY A 94 -16.397 -0.933 2.932 1.00 0.00 O ATOM 0 H GLY A 94 -15.301 -4.807 4.279 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -16.966 -3.680 3.278 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -17.183 -2.688 4.706 1.00 0.00 H new ATOM 1133 N GLN A 95 -14.422 -1.977 3.128 1.00 0.00 N ATOM 1134 CA GLN A 95 -13.561 -0.900 2.652 1.00 0.00 C ATOM 1135 C GLN A 95 -13.121 -1.090 1.197 1.00 0.00 C ATOM 1136 O GLN A 95 -12.378 -0.249 0.700 1.00 0.00 O ATOM 1137 CB GLN A 95 -12.328 -0.803 3.571 1.00 0.00 C ATOM 1138 CG GLN A 95 -12.678 -0.224 4.953 1.00 0.00 C ATOM 1139 CD GLN A 95 -11.564 -0.331 5.999 1.00 0.00 C ATOM 1140 OE1 GLN A 95 -11.789 0.002 7.159 1.00 0.00 O ATOM 1141 NE2 GLN A 95 -10.377 -0.819 5.661 1.00 0.00 N ATOM 0 H GLN A 95 -13.901 -2.832 3.323 1.00 0.00 H new ATOM 0 HA GLN A 95 -14.136 0.025 2.683 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -11.890 -1.793 3.694 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -11.572 -0.177 3.097 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -12.945 0.826 4.834 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -13.562 -0.736 5.332 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -10.195 -1.094 4.696 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -9.647 -0.919 6.366 1.00 0.00 H new ATOM 1150 N LEU A 96 -13.531 -2.163 0.509 1.00 0.00 N ATOM 1151 CA LEU A 96 -13.071 -2.450 -0.852 1.00 0.00 C ATOM 1152 C LEU A 96 -13.389 -1.286 -1.804 1.00 0.00 C ATOM 1153 O LEU A 96 -12.489 -0.766 -2.460 1.00 0.00 O ATOM 1154 CB LEU A 96 -13.618 -3.802 -1.323 1.00 0.00 C ATOM 1155 CG LEU A 96 -13.101 -4.216 -2.715 1.00 0.00 C ATOM 1156 CD1 LEU A 96 -11.569 -4.286 -2.799 1.00 0.00 C ATOM 1157 CD2 LEU A 96 -13.664 -5.596 -3.043 1.00 0.00 C ATOM 0 H LEU A 96 -14.187 -2.851 0.879 1.00 0.00 H new ATOM 0 HA LEU A 96 -11.985 -2.538 -0.855 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -13.345 -4.569 -0.598 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -14.707 -3.758 -1.346 1.00 0.00 H new ATOM 0 HG LEU A 96 -13.429 -3.455 -3.423 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -11.273 -4.583 -3.805 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -11.147 -3.307 -2.571 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -11.198 -5.018 -2.081 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -13.310 -5.909 -4.025 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -13.331 -6.313 -2.292 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -14.753 -5.553 -3.046 1.00 0.00 H new ATOM 1169 N ASP A 97 -14.637 -0.810 -1.828 1.00 0.00 N ATOM 1170 CA ASP A 97 -15.016 0.413 -2.549 1.00 0.00 C ATOM 1171 C ASP A 97 -14.182 1.617 -2.099 1.00 0.00 C ATOM 1172 O ASP A 97 -13.703 2.396 -2.928 1.00 0.00 O ATOM 1173 CB ASP A 97 -16.506 0.713 -2.336 1.00 0.00 C ATOM 1174 CG ASP A 97 -16.868 2.124 -2.805 1.00 0.00 C ATOM 1175 OD1 ASP A 97 -17.039 2.332 -4.030 1.00 0.00 O ATOM 1176 OD2 ASP A 97 -16.995 3.026 -1.944 1.00 0.00 O ATOM 0 H ASP A 97 -15.416 -1.261 -1.348 1.00 0.00 H new ATOM 0 HA ASP A 97 -14.823 0.242 -3.608 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -17.106 -0.017 -2.879 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -16.752 0.605 -1.280 1.00 0.00 H new ATOM 1181 N SER A 98 -13.973 1.751 -0.788 1.00 0.00 N ATOM 1182 CA SER A 98 -13.273 2.869 -0.168 1.00 0.00 C ATOM 1183 C SER A 98 -11.797 2.968 -0.563 1.00 0.00 C ATOM 1184 O SER A 98 -11.178 4.005 -0.308 1.00 0.00 O ATOM 1185 CB SER A 98 -13.405 2.789 1.359 1.00 0.00 C ATOM 1186 OG SER A 98 -14.713 2.394 1.755 1.00 0.00 O ATOM 0 H SER A 98 -14.298 1.061 -0.111 1.00 0.00 H new ATOM 0 HA SER A 98 -13.750 3.775 -0.542 1.00 0.00 H new ATOM 0 HB2 SER A 98 -12.677 2.079 1.750 1.00 0.00 H new ATOM 0 HB3 SER A 98 -13.170 3.760 1.796 1.00 0.00 H new ATOM 0 HG SER A 98 -14.760 2.352 2.733 1.00 0.00 H new ATOM 1192 N VAL A 99 -11.226 1.944 -1.202 1.00 0.00 N ATOM 1193 CA VAL A 99 -9.853 1.967 -1.704 1.00 0.00 C ATOM 1194 C VAL A 99 -9.807 2.003 -3.233 1.00 0.00 C ATOM 1195 O VAL A 99 -8.719 2.034 -3.803 1.00 0.00 O ATOM 1196 CB VAL A 99 -9.023 0.836 -1.078 1.00 0.00 C ATOM 1197 CG1 VAL A 99 -9.041 0.968 0.451 1.00 0.00 C ATOM 1198 CG2 VAL A 99 -9.491 -0.569 -1.468 1.00 0.00 C ATOM 0 H VAL A 99 -11.711 1.066 -1.387 1.00 0.00 H new ATOM 0 HA VAL A 99 -9.382 2.897 -1.387 1.00 0.00 H new ATOM 0 HB VAL A 99 -8.013 0.948 -1.472 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -8.452 0.164 0.893 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -8.616 1.930 0.738 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -10.068 0.904 0.810 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -8.855 -1.311 -0.986 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -10.523 -0.711 -1.146 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -9.429 -0.686 -2.550 1.00 0.00 H new ATOM 1208 N GLY A 100 -10.962 2.054 -3.904 1.00 0.00 N ATOM 1209 CA GLY A 100 -11.061 2.160 -5.353 1.00 0.00 C ATOM 1210 C GLY A 100 -11.531 0.872 -6.018 1.00 0.00 C ATOM 1211 O GLY A 100 -11.472 0.772 -7.246 1.00 0.00 O ATOM 0 H GLY A 100 -11.870 2.022 -3.440 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -11.751 2.965 -5.606 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.087 2.436 -5.758 1.00 0.00 H new ATOM 1215 N GLY A 101 -12.005 -0.099 -5.236 1.00 0.00 N ATOM 1216 CA GLY A 101 -12.517 -1.357 -5.735 1.00 0.00 C ATOM 1217 C GLY A 101 -11.392 -2.323 -6.087 1.00 0.00 C ATOM 1218 O GLY A 101 -10.204 -1.984 -6.061 1.00 0.00 O ATOM 0 H GLY A 101 -12.040 -0.022 -4.219 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -13.164 -1.810 -4.984 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -13.131 -1.176 -6.617 1.00 0.00 H new ATOM 1222 N PHE A 102 -11.777 -3.546 -6.453 1.00 0.00 N ATOM 1223 CA PHE A 102 -10.843 -4.600 -6.829 1.00 0.00 C ATOM 1224 C PHE A 102 -10.011 -4.162 -8.041 1.00 0.00 C ATOM 1225 O PHE A 102 -8.836 -4.513 -8.138 1.00 0.00 O ATOM 1226 CB PHE A 102 -11.606 -5.913 -7.093 1.00 0.00 C ATOM 1227 CG PHE A 102 -10.845 -7.174 -6.711 1.00 0.00 C ATOM 1228 CD1 PHE A 102 -9.611 -7.483 -7.315 1.00 0.00 C ATOM 1229 CD2 PHE A 102 -11.363 -8.043 -5.730 1.00 0.00 C ATOM 1230 CE1 PHE A 102 -8.872 -8.601 -6.903 1.00 0.00 C ATOM 1231 CE2 PHE A 102 -10.632 -9.176 -5.330 1.00 0.00 C ATOM 1232 CZ PHE A 102 -9.369 -9.432 -5.890 1.00 0.00 C ATOM 0 H PHE A 102 -12.755 -3.832 -6.496 1.00 0.00 H new ATOM 0 HA PHE A 102 -10.150 -4.783 -6.008 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -12.545 -5.890 -6.541 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -11.860 -5.964 -8.152 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -9.230 -6.852 -8.104 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -12.325 -7.838 -5.284 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -7.921 -8.821 -7.366 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -11.042 -9.850 -4.592 1.00 0.00 H new ATOM 0 HZ PHE A 102 -8.782 -10.268 -5.540 1.00 0.00 H new ATOM 1242 N ALA A 103 -10.587 -3.368 -8.952 1.00 0.00 N ATOM 1243 CA ALA A 103 -9.876 -2.864 -10.118 1.00 0.00 C ATOM 1244 C ALA A 103 -8.666 -2.027 -9.719 1.00 0.00 C ATOM 1245 O ALA A 103 -7.596 -2.226 -10.283 1.00 0.00 O ATOM 1246 CB ALA A 103 -10.820 -2.056 -11.013 1.00 0.00 C ATOM 0 H ALA A 103 -11.558 -3.061 -8.896 1.00 0.00 H new ATOM 0 HA ALA A 103 -9.510 -3.723 -10.680 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.272 -1.687 -11.880 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -11.640 -2.693 -11.346 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -11.221 -1.213 -10.451 1.00 0.00 H new ATOM 1252 N TYR A 104 -8.802 -1.122 -8.746 1.00 0.00 N ATOM 1253 CA TYR A 104 -7.679 -0.290 -8.339 1.00 0.00 C ATOM 1254 C TYR A 104 -6.572 -1.146 -7.733 1.00 0.00 C ATOM 1255 O TYR A 104 -5.404 -0.949 -8.050 1.00 0.00 O ATOM 1256 CB TYR A 104 -8.152 0.790 -7.364 1.00 0.00 C ATOM 1257 CG TYR A 104 -7.161 1.914 -7.142 1.00 0.00 C ATOM 1258 CD1 TYR A 104 -6.950 2.849 -8.171 1.00 0.00 C ATOM 1259 CD2 TYR A 104 -6.503 2.072 -5.909 1.00 0.00 C ATOM 1260 CE1 TYR A 104 -6.132 3.968 -7.956 1.00 0.00 C ATOM 1261 CE2 TYR A 104 -5.685 3.193 -5.683 1.00 0.00 C ATOM 1262 CZ TYR A 104 -5.513 4.156 -6.701 1.00 0.00 C ATOM 1263 OH TYR A 104 -4.769 5.271 -6.464 1.00 0.00 O ATOM 0 H TYR A 104 -9.668 -0.952 -8.235 1.00 0.00 H new ATOM 0 HA TYR A 104 -7.266 0.207 -9.217 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -9.085 1.214 -7.736 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -8.374 0.323 -6.404 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -7.420 2.705 -9.132 1.00 0.00 H new ATOM 0 HD2 TYR A 104 -6.626 1.330 -5.134 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -5.976 4.684 -8.749 1.00 0.00 H new ATOM 0 HE2 TYR A 104 -5.189 3.317 -4.732 1.00 0.00 H new ATOM 0 HH TYR A 104 -4.416 5.241 -5.550 1.00 0.00 H new ATOM 1273 N LEU A 105 -6.919 -2.133 -6.905 1.00 0.00 N ATOM 1274 CA LEU A 105 -5.910 -3.018 -6.331 1.00 0.00 C ATOM 1275 C LEU A 105 -5.227 -3.836 -7.429 1.00 0.00 C ATOM 1276 O LEU A 105 -4.012 -4.007 -7.390 1.00 0.00 O ATOM 1277 CB LEU A 105 -6.508 -3.954 -5.276 1.00 0.00 C ATOM 1278 CG LEU A 105 -7.297 -3.269 -4.144 1.00 0.00 C ATOM 1279 CD1 LEU A 105 -7.949 -4.333 -3.256 1.00 0.00 C ATOM 1280 CD2 LEU A 105 -6.381 -2.378 -3.293 1.00 0.00 C ATOM 0 H LEU A 105 -7.877 -2.336 -6.621 1.00 0.00 H new ATOM 0 HA LEU A 105 -5.169 -2.389 -5.838 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -7.168 -4.662 -5.777 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -5.699 -4.533 -4.831 1.00 0.00 H new ATOM 0 HG LEU A 105 -8.066 -2.640 -4.593 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -8.507 -3.847 -2.456 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -8.628 -4.940 -3.855 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -7.177 -4.970 -2.825 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -6.964 -1.907 -2.502 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -5.592 -2.986 -2.850 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -5.935 -1.608 -3.923 1.00 0.00 H new ATOM 1292 N ALA A 106 -5.984 -4.337 -8.411 1.00 0.00 N ATOM 1293 CA ALA A 106 -5.423 -5.105 -9.511 1.00 0.00 C ATOM 1294 C ALA A 106 -4.517 -4.246 -10.391 1.00 0.00 C ATOM 1295 O ALA A 106 -3.476 -4.713 -10.851 1.00 0.00 O ATOM 1296 CB ALA A 106 -6.548 -5.734 -10.329 1.00 0.00 C ATOM 0 H ALA A 106 -6.996 -4.219 -8.460 1.00 0.00 H new ATOM 0 HA ALA A 106 -4.803 -5.899 -9.095 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -6.122 -6.308 -11.152 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -7.136 -6.394 -9.692 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -7.190 -4.949 -10.728 1.00 0.00 H new ATOM 1302 N GLU A 107 -4.893 -2.994 -10.632 1.00 0.00 N ATOM 1303 CA GLU A 107 -4.069 -2.016 -11.325 1.00 0.00 C ATOM 1304 C GLU A 107 -2.758 -1.862 -10.570 1.00 0.00 C ATOM 1305 O GLU A 107 -1.694 -2.080 -11.146 1.00 0.00 O ATOM 1306 CB GLU A 107 -4.841 -0.691 -11.452 1.00 0.00 C ATOM 1307 CG GLU A 107 -4.027 0.457 -12.064 1.00 0.00 C ATOM 1308 CD GLU A 107 -3.833 0.289 -13.568 1.00 0.00 C ATOM 1309 OE1 GLU A 107 -3.197 -0.684 -14.019 1.00 0.00 O ATOM 1310 OE2 GLU A 107 -4.348 1.129 -14.341 1.00 0.00 O ATOM 0 H GLU A 107 -5.799 -2.625 -10.344 1.00 0.00 H new ATOM 0 HA GLU A 107 -3.835 -2.346 -12.337 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -5.728 -0.858 -12.063 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -5.187 -0.389 -10.463 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -4.532 1.403 -11.868 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -3.053 0.509 -11.577 1.00 0.00 H new ATOM 1317 N LEU A 108 -2.831 -1.561 -9.270 1.00 0.00 N ATOM 1318 CA LEU A 108 -1.662 -1.404 -8.416 1.00 0.00 C ATOM 1319 C LEU A 108 -0.775 -2.638 -8.473 1.00 0.00 C ATOM 1320 O LEU A 108 0.434 -2.482 -8.599 1.00 0.00 O ATOM 1321 CB LEU A 108 -2.068 -1.093 -6.970 1.00 0.00 C ATOM 1322 CG LEU A 108 -2.677 0.310 -6.797 1.00 0.00 C ATOM 1323 CD1 LEU A 108 -3.193 0.453 -5.369 1.00 0.00 C ATOM 1324 CD2 LEU A 108 -1.661 1.419 -7.044 1.00 0.00 C ATOM 0 H LEU A 108 -3.715 -1.419 -8.781 1.00 0.00 H new ATOM 0 HA LEU A 108 -1.089 -0.557 -8.793 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.789 -1.838 -6.634 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -1.193 -1.183 -6.327 1.00 0.00 H new ATOM 0 HG LEU A 108 -3.478 0.410 -7.529 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -3.627 1.444 -5.236 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -3.954 -0.304 -5.180 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -2.368 0.321 -4.669 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -2.141 2.388 -6.909 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -0.836 1.321 -6.338 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -1.278 1.342 -8.062 1.00 0.00 H new ATOM 1336 N SER A 109 -1.347 -3.843 -8.485 1.00 0.00 N ATOM 1337 CA SER A 109 -0.616 -5.103 -8.550 1.00 0.00 C ATOM 1338 C SER A 109 0.253 -5.206 -9.806 1.00 0.00 C ATOM 1339 O SER A 109 1.110 -6.085 -9.860 1.00 0.00 O ATOM 1340 CB SER A 109 -1.602 -6.277 -8.493 1.00 0.00 C ATOM 1341 OG SER A 109 -0.930 -7.507 -8.296 1.00 0.00 O ATOM 0 H SER A 109 -2.358 -3.970 -8.449 1.00 0.00 H new ATOM 0 HA SER A 109 0.054 -5.140 -7.691 1.00 0.00 H new ATOM 0 HB2 SER A 109 -2.315 -6.116 -7.684 1.00 0.00 H new ATOM 0 HB3 SER A 109 -2.175 -6.318 -9.419 1.00 0.00 H new ATOM 0 HG SER A 109 -0.022 -7.445 -8.659 1.00 0.00 H new ATOM 1347 N LYS A 110 0.045 -4.360 -10.823 1.00 0.00 N ATOM 1348 CA LYS A 110 0.928 -4.277 -11.986 1.00 0.00 C ATOM 1349 C LYS A 110 1.421 -2.848 -12.225 1.00 0.00 C ATOM 1350 O LYS A 110 2.020 -2.586 -13.271 1.00 0.00 O ATOM 1351 CB LYS A 110 0.270 -4.889 -13.235 1.00 0.00 C ATOM 1352 CG LYS A 110 -0.015 -6.399 -13.138 1.00 0.00 C ATOM 1353 CD LYS A 110 -1.346 -6.824 -12.504 1.00 0.00 C ATOM 1354 CE LYS A 110 -2.572 -6.615 -13.399 1.00 0.00 C ATOM 1355 NZ LYS A 110 -2.981 -5.203 -13.532 1.00 0.00 N ATOM 0 H LYS A 110 -0.743 -3.714 -10.859 1.00 0.00 H new ATOM 0 HA LYS A 110 1.813 -4.875 -11.770 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -0.668 -4.368 -13.427 1.00 0.00 H new ATOM 0 HB3 LYS A 110 0.916 -4.710 -14.094 1.00 0.00 H new ATOM 0 HG2 LYS A 110 0.028 -6.816 -14.144 1.00 0.00 H new ATOM 0 HG3 LYS A 110 0.792 -6.859 -12.568 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -1.285 -7.878 -12.234 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -1.488 -6.265 -11.579 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -2.359 -7.016 -14.390 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -3.406 -7.188 -12.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -3.976 -5.156 -13.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -2.873 -4.722 -12.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -2.383 -4.734 -14.242 1.00 0.00 H new ATOM 1369 N ASN A 111 1.248 -1.926 -11.280 1.00 0.00 N ATOM 1370 CA ASN A 111 1.771 -0.560 -11.344 1.00 0.00 C ATOM 1371 C ASN A 111 3.226 -0.511 -10.857 1.00 0.00 C ATOM 1372 O ASN A 111 3.679 0.481 -10.285 1.00 0.00 O ATOM 1373 CB ASN A 111 0.865 0.381 -10.535 1.00 0.00 C ATOM 1374 CG ASN A 111 1.177 1.836 -10.855 1.00 0.00 C ATOM 1375 OD1 ASN A 111 0.994 2.279 -11.984 1.00 0.00 O ATOM 1376 ND2 ASN A 111 1.650 2.612 -9.898 1.00 0.00 N ATOM 0 H ASN A 111 0.726 -2.112 -10.424 1.00 0.00 H new ATOM 0 HA ASN A 111 1.770 -0.223 -12.381 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -0.180 0.170 -10.761 1.00 0.00 H new ATOM 0 HB3 ASN A 111 1.004 0.200 -9.469 1.00 0.00 H new ATOM 0 HD21 ASN A 111 1.867 3.589 -10.094 1.00 0.00 H new ATOM 0 HD22 ASN A 111 1.799 2.235 -8.962 1.00 0.00 H new ATOM 1383 N THR A 112 3.966 -1.598 -11.047 1.00 0.00 N ATOM 1384 CA THR A 112 5.345 -1.739 -10.625 1.00 0.00 C ATOM 1385 C THR A 112 6.075 -2.508 -11.723 1.00 0.00 C ATOM 1386 O THR A 112 5.567 -3.554 -12.140 1.00 0.00 O ATOM 1387 CB THR A 112 5.410 -2.519 -9.297 1.00 0.00 C ATOM 1388 OG1 THR A 112 4.442 -2.050 -8.386 1.00 0.00 O ATOM 1389 CG2 THR A 112 6.797 -2.416 -8.652 1.00 0.00 C ATOM 0 H THR A 112 3.606 -2.430 -11.515 1.00 0.00 H new ATOM 0 HA THR A 112 5.806 -0.764 -10.466 1.00 0.00 H new ATOM 0 HB THR A 112 5.207 -3.563 -9.534 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.827 -2.021 -7.485 1.00 0.00 H new ATOM 0 HG21 THR A 112 6.806 -2.978 -7.718 1.00 0.00 H new ATOM 0 HG22 THR A 112 7.545 -2.827 -9.330 1.00 0.00 H new ATOM 0 HG23 THR A 112 7.027 -1.370 -8.449 1.00 0.00 H new ATOM 1397 N PRO A 113 7.258 -2.064 -12.176 1.00 0.00 N ATOM 1398 CA PRO A 113 8.111 -2.862 -13.039 1.00 0.00 C ATOM 1399 C PRO A 113 8.632 -4.055 -12.234 1.00 0.00 C ATOM 1400 O PRO A 113 9.637 -3.935 -11.536 1.00 0.00 O ATOM 1401 CB PRO A 113 9.214 -1.910 -13.517 1.00 0.00 C ATOM 1402 CG PRO A 113 9.312 -0.880 -12.392 1.00 0.00 C ATOM 1403 CD PRO A 113 7.862 -0.766 -11.929 1.00 0.00 C ATOM 0 HA PRO A 113 7.604 -3.282 -13.907 1.00 0.00 H new ATOM 0 HB2 PRO A 113 10.159 -2.433 -13.665 1.00 0.00 H new ATOM 0 HB3 PRO A 113 8.956 -1.443 -14.467 1.00 0.00 H new ATOM 0 HG2 PRO A 113 9.970 -1.215 -11.590 1.00 0.00 H new ATOM 0 HG3 PRO A 113 9.702 0.074 -12.747 1.00 0.00 H new ATOM 0 HD2 PRO A 113 7.810 -0.506 -10.872 1.00 0.00 H new ATOM 0 HD3 PRO A 113 7.339 0.018 -12.476 1.00 0.00 H new ATOM 1411 N SER A 114 7.914 -5.179 -12.271 1.00 0.00 N ATOM 1412 CA SER A 114 8.314 -6.496 -11.774 1.00 0.00 C ATOM 1413 C SER A 114 8.859 -6.528 -10.332 1.00 0.00 C ATOM 1414 O SER A 114 9.648 -7.411 -10.005 1.00 0.00 O ATOM 1415 CB SER A 114 9.308 -7.101 -12.780 1.00 0.00 C ATOM 1416 OG SER A 114 8.810 -6.992 -14.106 1.00 0.00 O ATOM 0 H SER A 114 6.978 -5.194 -12.675 1.00 0.00 H new ATOM 0 HA SER A 114 7.410 -7.101 -11.701 1.00 0.00 H new ATOM 0 HB2 SER A 114 10.267 -6.589 -12.703 1.00 0.00 H new ATOM 0 HB3 SER A 114 9.486 -8.149 -12.538 1.00 0.00 H new ATOM 0 HG SER A 114 9.457 -7.381 -14.731 1.00 0.00 H new ATOM 1422 N ALA A 115 8.493 -5.567 -9.465 1.00 0.00 N ATOM 1423 CA ALA A 115 9.117 -5.352 -8.147 1.00 0.00 C ATOM 1424 C ALA A 115 10.658 -5.221 -8.241 1.00 0.00 C ATOM 1425 O ALA A 115 11.351 -5.349 -7.237 1.00 0.00 O ATOM 1426 CB ALA A 115 8.645 -6.424 -7.152 1.00 0.00 C ATOM 0 H ALA A 115 7.742 -4.906 -9.664 1.00 0.00 H new ATOM 0 HA ALA A 115 8.782 -4.391 -7.758 1.00 0.00 H new ATOM 0 HB1 ALA A 115 9.114 -6.253 -6.183 1.00 0.00 H new ATOM 0 HB2 ALA A 115 7.562 -6.370 -7.046 1.00 0.00 H new ATOM 0 HB3 ALA A 115 8.924 -7.411 -7.521 1.00 0.00 H new ATOM 1432 N ALA A 116 11.200 -4.919 -9.424 1.00 0.00 N ATOM 1433 CA ALA A 116 12.625 -4.785 -9.703 1.00 0.00 C ATOM 1434 C ALA A 116 13.211 -3.473 -9.172 1.00 0.00 C ATOM 1435 O ALA A 116 14.417 -3.363 -8.961 1.00 0.00 O ATOM 1436 CB ALA A 116 12.811 -4.826 -11.220 1.00 0.00 C ATOM 0 H ALA A 116 10.626 -4.754 -10.251 1.00 0.00 H new ATOM 0 HA ALA A 116 13.147 -5.600 -9.201 1.00 0.00 H new ATOM 0 HB1 ALA A 116 13.870 -4.728 -11.460 1.00 0.00 H new ATOM 0 HB2 ALA A 116 12.438 -5.774 -11.607 1.00 0.00 H new ATOM 0 HB3 ALA A 116 12.258 -4.005 -11.677 1.00 0.00 H new ATOM 1442 N ASN A 117 12.354 -2.468 -8.982 1.00 0.00 N ATOM 1443 CA ASN A 117 12.695 -1.125 -8.506 1.00 0.00 C ATOM 1444 C ASN A 117 12.026 -0.854 -7.151 1.00 0.00 C ATOM 1445 O ASN A 117 11.915 0.287 -6.708 1.00 0.00 O ATOM 1446 CB ASN A 117 12.277 -0.109 -9.583 1.00 0.00 C ATOM 1447 CG ASN A 117 12.918 1.258 -9.378 1.00 0.00 C ATOM 1448 OD1 ASN A 117 14.092 1.440 -9.690 1.00 0.00 O ATOM 1449 ND2 ASN A 117 12.185 2.254 -8.912 1.00 0.00 N ATOM 0 H ASN A 117 11.356 -2.573 -9.164 1.00 0.00 H new ATOM 0 HA ASN A 117 13.769 -1.034 -8.343 1.00 0.00 H new ATOM 0 HB2 ASN A 117 12.553 -0.492 -10.565 1.00 0.00 H new ATOM 0 HB3 ASN A 117 11.192 -0.003 -9.576 1.00 0.00 H new ATOM 0 HD21 ASN A 117 12.593 3.183 -8.809 1.00 0.00 H new ATOM 0 HD22 ASN A 117 11.211 2.094 -8.655 1.00 0.00 H new ATOM 1456 N ILE A 118 11.491 -1.896 -6.512 1.00 0.00 N ATOM 1457 CA ILE A 118 10.627 -1.808 -5.340 1.00 0.00 C ATOM 1458 C ILE A 118 11.372 -1.179 -4.168 1.00 0.00 C ATOM 1459 O ILE A 118 10.858 -0.273 -3.515 1.00 0.00 O ATOM 1460 CB ILE A 118 10.036 -3.212 -5.089 1.00 0.00 C ATOM 1461 CG1 ILE A 118 8.569 -3.217 -4.637 1.00 0.00 C ATOM 1462 CG2 ILE A 118 10.902 -4.173 -4.267 1.00 0.00 C ATOM 1463 CD1 ILE A 118 8.348 -2.819 -3.186 1.00 0.00 C ATOM 0 H ILE A 118 11.655 -2.858 -6.810 1.00 0.00 H new ATOM 0 HA ILE A 118 9.784 -1.135 -5.494 1.00 0.00 H new ATOM 0 HB ILE A 118 10.048 -3.632 -6.095 1.00 0.00 H new ATOM 0 HG12 ILE A 118 8.004 -2.538 -5.276 1.00 0.00 H new ATOM 0 HG13 ILE A 118 8.159 -4.215 -4.792 1.00 0.00 H new ATOM 0 HG21 ILE A 118 10.384 -5.126 -4.157 1.00 0.00 H new ATOM 0 HG22 ILE A 118 11.852 -4.333 -4.777 1.00 0.00 H new ATOM 0 HG23 ILE A 118 11.087 -3.744 -3.282 1.00 0.00 H new ATOM 0 HD11 ILE A 118 7.283 -2.852 -2.958 1.00 0.00 H new ATOM 0 HD12 ILE A 118 8.880 -3.512 -2.534 1.00 0.00 H new ATOM 0 HD13 ILE A 118 8.723 -1.808 -3.025 1.00 0.00 H new ATOM 1475 N SER A 119 12.614 -1.605 -3.967 1.00 0.00 N ATOM 1476 CA SER A 119 13.491 -1.111 -2.918 1.00 0.00 C ATOM 1477 C SER A 119 13.765 0.382 -3.089 1.00 0.00 C ATOM 1478 O SER A 119 13.811 1.118 -2.103 1.00 0.00 O ATOM 1479 CB SER A 119 14.800 -1.916 -2.913 1.00 0.00 C ATOM 1480 OG SER A 119 14.558 -3.288 -3.190 1.00 0.00 O ATOM 0 H SER A 119 13.048 -2.323 -4.547 1.00 0.00 H new ATOM 0 HA SER A 119 12.995 -1.243 -1.956 1.00 0.00 H new ATOM 0 HB2 SER A 119 15.485 -1.507 -3.656 1.00 0.00 H new ATOM 0 HB3 SER A 119 15.287 -1.818 -1.943 1.00 0.00 H new ATOM 0 HG SER A 119 15.407 -3.778 -3.183 1.00 0.00 H new ATOM 1486 N ALA A 120 13.917 0.829 -4.338 1.00 0.00 N ATOM 1487 CA ALA A 120 14.153 2.226 -4.675 1.00 0.00 C ATOM 1488 C ALA A 120 12.892 3.052 -4.431 1.00 0.00 C ATOM 1489 O ALA A 120 12.978 4.142 -3.866 1.00 0.00 O ATOM 1490 CB ALA A 120 14.624 2.352 -6.127 1.00 0.00 C ATOM 0 H ALA A 120 13.878 0.217 -5.153 1.00 0.00 H new ATOM 0 HA ALA A 120 14.941 2.615 -4.030 1.00 0.00 H new ATOM 0 HB1 ALA A 120 14.796 3.402 -6.364 1.00 0.00 H new ATOM 0 HB2 ALA A 120 15.551 1.794 -6.259 1.00 0.00 H new ATOM 0 HB3 ALA A 120 13.861 1.950 -6.793 1.00 0.00 H new ATOM 1496 N TYR A 121 11.713 2.545 -4.809 1.00 0.00 N ATOM 1497 CA TYR A 121 10.468 3.241 -4.543 1.00 0.00 C ATOM 1498 C TYR A 121 10.243 3.348 -3.031 1.00 0.00 C ATOM 1499 O TYR A 121 9.864 4.416 -2.562 1.00 0.00 O ATOM 1500 CB TYR A 121 9.293 2.515 -5.198 1.00 0.00 C ATOM 1501 CG TYR A 121 9.241 2.455 -6.716 1.00 0.00 C ATOM 1502 CD1 TYR A 121 9.286 3.621 -7.508 1.00 0.00 C ATOM 1503 CD2 TYR A 121 9.046 1.210 -7.337 1.00 0.00 C ATOM 1504 CE1 TYR A 121 9.145 3.534 -8.911 1.00 0.00 C ATOM 1505 CE2 TYR A 121 8.933 1.113 -8.728 1.00 0.00 C ATOM 1506 CZ TYR A 121 8.961 2.275 -9.527 1.00 0.00 C ATOM 1507 OH TYR A 121 8.845 2.141 -10.875 1.00 0.00 O ATOM 0 H TYR A 121 11.604 1.657 -5.298 1.00 0.00 H new ATOM 0 HA TYR A 121 10.533 4.243 -4.967 1.00 0.00 H new ATOM 0 HB2 TYR A 121 9.284 1.491 -4.824 1.00 0.00 H new ATOM 0 HB3 TYR A 121 8.374 2.989 -4.852 1.00 0.00 H new ATOM 0 HD1 TYR A 121 9.429 4.584 -7.040 1.00 0.00 H new ATOM 0 HD2 TYR A 121 8.983 0.317 -6.733 1.00 0.00 H new ATOM 0 HE1 TYR A 121 9.178 4.430 -9.513 1.00 0.00 H new ATOM 0 HE2 TYR A 121 8.824 0.144 -9.192 1.00 0.00 H new ATOM 0 HH TYR A 121 9.354 2.851 -11.319 1.00 0.00 H new ATOM 1517 N ALA A 122 10.495 2.288 -2.257 1.00 0.00 N ATOM 1518 CA ALA A 122 10.342 2.313 -0.802 1.00 0.00 C ATOM 1519 C ALA A 122 11.284 3.333 -0.159 1.00 0.00 C ATOM 1520 O ALA A 122 10.892 4.017 0.785 1.00 0.00 O ATOM 1521 CB ALA A 122 10.576 0.912 -0.231 1.00 0.00 C ATOM 0 H ALA A 122 10.811 1.390 -2.623 1.00 0.00 H new ATOM 0 HA ALA A 122 9.324 2.623 -0.567 1.00 0.00 H new ATOM 0 HB1 ALA A 122 10.461 0.937 0.853 1.00 0.00 H new ATOM 0 HB2 ALA A 122 9.850 0.219 -0.657 1.00 0.00 H new ATOM 0 HB3 ALA A 122 11.584 0.581 -0.481 1.00 0.00 H new ATOM 1527 N ASP A 123 12.501 3.460 -0.685 1.00 0.00 N ATOM 1528 CA ASP A 123 13.469 4.479 -0.283 1.00 0.00 C ATOM 1529 C ASP A 123 12.875 5.872 -0.490 1.00 0.00 C ATOM 1530 O ASP A 123 12.906 6.726 0.398 1.00 0.00 O ATOM 1531 CB ASP A 123 14.753 4.320 -1.119 1.00 0.00 C ATOM 1532 CG ASP A 123 16.027 4.519 -0.312 1.00 0.00 C ATOM 1533 OD1 ASP A 123 16.055 5.354 0.614 1.00 0.00 O ATOM 1534 OD2 ASP A 123 17.022 3.816 -0.598 1.00 0.00 O ATOM 0 H ASP A 123 12.849 2.843 -1.419 1.00 0.00 H new ATOM 0 HA ASP A 123 13.710 4.356 0.773 1.00 0.00 H new ATOM 0 HB2 ASP A 123 14.766 3.326 -1.566 1.00 0.00 H new ATOM 0 HB3 ASP A 123 14.735 5.038 -1.939 1.00 0.00 H new ATOM 1539 N ILE A 124 12.296 6.098 -1.669 1.00 0.00 N ATOM 1540 CA ILE A 124 11.655 7.346 -2.053 1.00 0.00 C ATOM 1541 C ILE A 124 10.477 7.642 -1.114 1.00 0.00 C ATOM 1542 O ILE A 124 10.388 8.767 -0.621 1.00 0.00 O ATOM 1543 CB ILE A 124 11.311 7.283 -3.562 1.00 0.00 C ATOM 1544 CG1 ILE A 124 12.629 7.441 -4.357 1.00 0.00 C ATOM 1545 CG2 ILE A 124 10.284 8.339 -3.999 1.00 0.00 C ATOM 1546 CD1 ILE A 124 12.487 7.202 -5.860 1.00 0.00 C ATOM 0 H ILE A 124 12.262 5.392 -2.404 1.00 0.00 H new ATOM 0 HA ILE A 124 12.320 8.201 -1.934 1.00 0.00 H new ATOM 0 HB ILE A 124 10.841 6.321 -3.766 1.00 0.00 H new ATOM 0 HG12 ILE A 124 13.019 8.446 -4.196 1.00 0.00 H new ATOM 0 HG13 ILE A 124 13.367 6.745 -3.958 1.00 0.00 H new ATOM 0 HG21 ILE A 124 10.090 8.238 -5.067 1.00 0.00 H new ATOM 0 HG22 ILE A 124 9.356 8.195 -3.446 1.00 0.00 H new ATOM 0 HG23 ILE A 124 10.677 9.335 -3.795 1.00 0.00 H new ATOM 0 HD11 ILE A 124 13.456 7.332 -6.342 1.00 0.00 H new ATOM 0 HD12 ILE A 124 12.128 6.188 -6.035 1.00 0.00 H new ATOM 0 HD13 ILE A 124 11.776 7.915 -6.276 1.00 0.00 H new ATOM 1558 N VAL A 125 9.602 6.673 -0.821 1.00 0.00 N ATOM 1559 CA VAL A 125 8.513 6.863 0.141 1.00 0.00 C ATOM 1560 C VAL A 125 9.101 7.268 1.496 1.00 0.00 C ATOM 1561 O VAL A 125 8.630 8.240 2.092 1.00 0.00 O ATOM 1562 CB VAL A 125 7.624 5.603 0.244 1.00 0.00 C ATOM 1563 CG1 VAL A 125 6.504 5.764 1.288 1.00 0.00 C ATOM 1564 CG2 VAL A 125 6.938 5.291 -1.096 1.00 0.00 C ATOM 0 H VAL A 125 9.629 5.744 -1.240 1.00 0.00 H new ATOM 0 HA VAL A 125 7.862 7.665 -0.207 1.00 0.00 H new ATOM 0 HB VAL A 125 8.297 4.797 0.536 1.00 0.00 H new ATOM 0 HG11 VAL A 125 5.906 4.853 1.324 1.00 0.00 H new ATOM 0 HG12 VAL A 125 6.944 5.948 2.268 1.00 0.00 H new ATOM 0 HG13 VAL A 125 5.868 6.605 1.012 1.00 0.00 H new ATOM 0 HG21 VAL A 125 6.320 4.399 -0.990 1.00 0.00 H new ATOM 0 HG22 VAL A 125 6.312 6.134 -1.389 1.00 0.00 H new ATOM 0 HG23 VAL A 125 7.695 5.119 -1.861 1.00 0.00 H new ATOM 1574 N ARG A 126 10.141 6.579 1.979 1.00 0.00 N ATOM 1575 CA ARG A 126 10.744 6.945 3.258 1.00 0.00 C ATOM 1576 C ARG A 126 11.314 8.361 3.225 1.00 0.00 C ATOM 1577 O ARG A 126 11.174 9.054 4.221 1.00 0.00 O ATOM 1578 CB ARG A 126 11.787 5.912 3.713 1.00 0.00 C ATOM 1579 CG ARG A 126 12.243 6.101 5.175 1.00 0.00 C ATOM 1580 CD ARG A 126 11.086 6.164 6.190 1.00 0.00 C ATOM 1581 NE ARG A 126 11.570 5.977 7.563 1.00 0.00 N ATOM 1582 CZ ARG A 126 10.924 5.361 8.560 1.00 0.00 C ATOM 1583 NH1 ARG A 126 9.620 5.099 8.535 1.00 0.00 N ATOM 1584 NH2 ARG A 126 11.622 4.979 9.618 1.00 0.00 N ATOM 0 H ARG A 126 10.573 5.781 1.512 1.00 0.00 H new ATOM 0 HA ARG A 126 9.950 6.939 4.005 1.00 0.00 H new ATOM 0 HB2 ARG A 126 11.370 4.911 3.597 1.00 0.00 H new ATOM 0 HB3 ARG A 126 12.657 5.973 3.059 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.906 5.280 5.447 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.826 7.019 5.247 1.00 0.00 H new ATOM 0 HD2 ARG A 126 10.580 7.126 6.108 1.00 0.00 H new ATOM 0 HD3 ARG A 126 10.350 5.396 5.954 1.00 0.00 H new ATOM 0 HE ARG A 126 12.492 6.355 7.779 1.00 0.00 H new ATOM 0 HH11 ARG A 126 9.061 5.371 7.727 1.00 0.00 H new ATOM 0 HH12 ARG A 126 9.180 4.626 9.324 1.00 0.00 H new ATOM 0 HH21 ARG A 126 12.626 5.156 9.658 1.00 0.00 H new ATOM 0 HH22 ARG A 126 11.156 4.507 10.393 1.00 0.00 H new ATOM 1598 N GLU A 127 11.877 8.840 2.116 1.00 0.00 N ATOM 1599 CA GLU A 127 12.365 10.220 2.002 1.00 0.00 C ATOM 1600 C GLU A 127 11.217 11.222 2.166 1.00 0.00 C ATOM 1601 O GLU A 127 11.360 12.296 2.758 1.00 0.00 O ATOM 1602 CB GLU A 127 12.993 10.414 0.619 1.00 0.00 C ATOM 1603 CG GLU A 127 13.843 11.686 0.479 1.00 0.00 C ATOM 1604 CD GLU A 127 15.108 11.750 1.330 1.00 0.00 C ATOM 1605 OE1 GLU A 127 16.151 11.221 0.878 1.00 0.00 O ATOM 1606 OE2 GLU A 127 15.114 12.483 2.342 1.00 0.00 O ATOM 0 H GLU A 127 12.009 8.285 1.270 1.00 0.00 H new ATOM 0 HA GLU A 127 13.100 10.394 2.788 1.00 0.00 H new ATOM 0 HB2 GLU A 127 13.616 9.549 0.392 1.00 0.00 H new ATOM 0 HB3 GLU A 127 12.198 10.439 -0.127 1.00 0.00 H new ATOM 0 HG2 GLU A 127 14.129 11.793 -0.567 1.00 0.00 H new ATOM 0 HG3 GLU A 127 13.219 12.544 0.729 1.00 0.00 H new ATOM 1613 N ARG A 128 10.060 10.899 1.588 1.00 0.00 N ATOM 1614 CA ARG A 128 8.855 11.712 1.772 1.00 0.00 C ATOM 1615 C ARG A 128 8.412 11.687 3.234 1.00 0.00 C ATOM 1616 O ARG A 128 8.102 12.748 3.777 1.00 0.00 O ATOM 1617 CB ARG A 128 7.702 11.260 0.860 1.00 0.00 C ATOM 1618 CG ARG A 128 8.003 11.265 -0.646 1.00 0.00 C ATOM 1619 CD ARG A 128 8.447 12.626 -1.195 1.00 0.00 C ATOM 1620 NE ARG A 128 9.904 12.821 -1.141 1.00 0.00 N ATOM 1621 CZ ARG A 128 10.806 12.444 -2.056 1.00 0.00 C ATOM 1622 NH1 ARG A 128 10.453 11.702 -3.093 1.00 0.00 N ATOM 1623 NH2 ARG A 128 12.069 12.832 -1.919 1.00 0.00 N ATOM 0 H ARG A 128 9.930 10.083 0.990 1.00 0.00 H new ATOM 0 HA ARG A 128 9.111 12.733 1.491 1.00 0.00 H new ATOM 0 HB2 ARG A 128 7.408 10.251 1.150 1.00 0.00 H new ATOM 0 HB3 ARG A 128 6.844 11.907 1.042 1.00 0.00 H new ATOM 0 HG2 ARG A 128 8.783 10.531 -0.851 1.00 0.00 H new ATOM 0 HG3 ARG A 128 7.112 10.942 -1.184 1.00 0.00 H new ATOM 0 HD2 ARG A 128 8.111 12.722 -2.228 1.00 0.00 H new ATOM 0 HD3 ARG A 128 7.959 13.418 -0.626 1.00 0.00 H new ATOM 0 HE ARG A 128 10.268 13.296 -0.315 1.00 0.00 H new ATOM 0 HH11 ARG A 128 9.482 11.409 -3.204 1.00 0.00 H new ATOM 0 HH12 ARG A 128 11.152 11.423 -3.782 1.00 0.00 H new ATOM 0 HH21 ARG A 128 12.342 13.410 -1.124 1.00 0.00 H new ATOM 0 HH22 ARG A 128 12.766 12.552 -2.609 1.00 0.00 H new ATOM 1637 N ALA A 129 8.393 10.519 3.875 1.00 0.00 N ATOM 1638 CA ALA A 129 8.014 10.390 5.277 1.00 0.00 C ATOM 1639 C ALA A 129 9.019 11.072 6.209 1.00 0.00 C ATOM 1640 O ALA A 129 8.625 11.664 7.211 1.00 0.00 O ATOM 1641 CB ALA A 129 7.865 8.918 5.633 1.00 0.00 C ATOM 0 H ALA A 129 8.641 9.634 3.433 1.00 0.00 H new ATOM 0 HA ALA A 129 7.059 10.896 5.416 1.00 0.00 H new ATOM 0 HB1 ALA A 129 7.582 8.824 6.681 1.00 0.00 H new ATOM 0 HB2 ALA A 129 7.094 8.469 5.007 1.00 0.00 H new ATOM 0 HB3 ALA A 129 8.812 8.406 5.466 1.00 0.00 H new ATOM 1647 N VAL A 130 10.302 11.072 5.855 1.00 0.00 N ATOM 1648 CA VAL A 130 11.333 11.838 6.530 1.00 0.00 C ATOM 1649 C VAL A 130 10.928 13.308 6.519 1.00 0.00 C ATOM 1650 O VAL A 130 10.888 13.921 7.571 1.00 0.00 O ATOM 1651 CB VAL A 130 12.715 11.518 5.917 1.00 0.00 C ATOM 1652 CG1 VAL A 130 13.760 12.608 6.176 1.00 0.00 C ATOM 1653 CG2 VAL A 130 13.232 10.194 6.503 1.00 0.00 C ATOM 0 H VAL A 130 10.657 10.524 5.071 1.00 0.00 H new ATOM 0 HA VAL A 130 11.432 11.561 7.580 1.00 0.00 H new ATOM 0 HB VAL A 130 12.574 11.453 4.838 1.00 0.00 H new ATOM 0 HG11 VAL A 130 14.707 12.320 5.719 1.00 0.00 H new ATOM 0 HG12 VAL A 130 13.419 13.549 5.744 1.00 0.00 H new ATOM 0 HG13 VAL A 130 13.898 12.732 7.250 1.00 0.00 H new ATOM 0 HG21 VAL A 130 14.207 9.963 6.074 1.00 0.00 H new ATOM 0 HG22 VAL A 130 13.324 10.286 7.585 1.00 0.00 H new ATOM 0 HG23 VAL A 130 12.532 9.393 6.266 1.00 0.00 H new ATOM 1663 N VAL A 131 10.537 13.879 5.383 1.00 0.00 N ATOM 1664 CA VAL A 131 10.028 15.256 5.336 1.00 0.00 C ATOM 1665 C VAL A 131 8.687 15.403 6.068 1.00 0.00 C ATOM 1666 O VAL A 131 8.322 16.507 6.476 1.00 0.00 O ATOM 1667 CB VAL A 131 9.948 15.697 3.865 1.00 0.00 C ATOM 1668 CG1 VAL A 131 9.273 17.054 3.616 1.00 0.00 C ATOM 1669 CG2 VAL A 131 11.379 15.821 3.334 1.00 0.00 C ATOM 0 H VAL A 131 10.561 13.411 4.477 1.00 0.00 H new ATOM 0 HA VAL A 131 10.715 15.914 5.867 1.00 0.00 H new ATOM 0 HB VAL A 131 9.339 14.943 3.367 1.00 0.00 H new ATOM 0 HG11 VAL A 131 9.270 17.268 2.547 1.00 0.00 H new ATOM 0 HG12 VAL A 131 8.247 17.023 3.983 1.00 0.00 H new ATOM 0 HG13 VAL A 131 9.822 17.835 4.141 1.00 0.00 H new ATOM 0 HG21 VAL A 131 11.354 16.133 2.290 1.00 0.00 H new ATOM 0 HG22 VAL A 131 11.922 16.561 3.921 1.00 0.00 H new ATOM 0 HG23 VAL A 131 11.881 14.857 3.412 1.00 0.00 H new