USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 810 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 53 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0.774 USER MOD Single : A 59 SER OG : rot -12:sc= 0.838 USER MOD Single : A 66 GLN : amide:sc= -0.311 K(o=-0.31,f=-1.5!) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 MET CE :methyl 164:sc= -0.0126 (180deg=-0.26) USER MOD Single : A 85 SER OG : rot -170:sc= -0.835 USER MOD Single : A 94 THR OG1 : rot 82:sc= 0.948 USER MOD Single : B 53 HIS : no HD1:sc= 0 X(o=0,f=-0.003) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0.665 USER MOD Single : B 59 SER OG : rot -10:sc= 0.815 USER MOD Single : B 66 GLN : amide:sc= -0.262 K(o=-0.26,f=-1.7!) USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 MET CE :methyl 163:sc= -0.0112 (180deg=-0.28) USER MOD Single : B 85 SER OG : rot 180:sc= -0.868 USER MOD Single : B 94 THR OG1 : rot 65:sc= 1.07 USER MOD ----------------------------------------------------------------- ATOM 41 N ALA A 52 5.767 -36.464 -0.070 1.00 0.00 N ATOM 42 CA ALA A 52 5.746 -35.009 -0.003 1.00 0.00 C ATOM 43 C ALA A 52 4.331 -34.487 0.214 1.00 0.00 C ATOM 44 O ALA A 52 3.351 -35.168 -0.092 1.00 0.00 O ATOM 45 CB ALA A 52 6.340 -34.415 -1.271 1.00 0.00 C ATOM 0 HA ALA A 52 6.352 -34.702 0.850 1.00 0.00 H new ATOM 0 HB1 ALA A 52 6.318 -33.327 -1.208 1.00 0.00 H new ATOM 0 HB2 ALA A 52 7.371 -34.752 -1.382 1.00 0.00 H new ATOM 0 HB3 ALA A 52 5.757 -34.740 -2.133 1.00 0.00 H new ATOM 51 N HIS A 53 4.230 -33.271 0.744 1.00 0.00 N ATOM 52 CA HIS A 53 2.935 -32.651 1.002 1.00 0.00 C ATOM 53 C HIS A 53 2.765 -31.390 0.159 1.00 0.00 C ATOM 54 O HIS A 53 1.919 -31.337 -0.734 1.00 0.00 O ATOM 55 CB HIS A 53 2.799 -32.309 2.487 1.00 0.00 C ATOM 56 CG HIS A 53 2.129 -33.380 3.290 1.00 0.00 C ATOM 57 ND1 HIS A 53 0.809 -33.310 3.685 1.00 0.00 N ATOM 58 CD2 HIS A 53 2.602 -34.553 3.775 1.00 0.00 C ATOM 59 CE1 HIS A 53 0.501 -34.393 4.377 1.00 0.00 C ATOM 60 NE2 HIS A 53 1.570 -35.162 4.445 1.00 0.00 N ATOM 0 H HIS A 53 5.031 -32.695 1.003 1.00 0.00 H new ATOM 0 HA HIS A 53 2.154 -33.360 0.728 1.00 0.00 H new ATOM 0 HB2 HIS A 53 3.790 -32.123 2.901 1.00 0.00 H new ATOM 0 HB3 HIS A 53 2.233 -31.383 2.588 1.00 0.00 H new ATOM 0 HD2 HIS A 53 3.604 -34.938 3.657 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -0.463 -34.611 4.813 1.00 0.00 H new ATOM 0 HE2 HIS A 53 1.622 -36.064 4.919 1.00 0.00 H new ATOM 69 N LEU A 54 3.576 -30.378 0.448 1.00 0.00 N ATOM 70 CA LEU A 54 3.523 -29.114 -0.282 1.00 0.00 C ATOM 71 C LEU A 54 3.671 -29.353 -1.787 1.00 0.00 C ATOM 72 O LEU A 54 2.683 -29.408 -2.520 1.00 0.00 O ATOM 73 CB LEU A 54 4.624 -28.178 0.223 1.00 0.00 C ATOM 74 CG LEU A 54 4.153 -27.084 1.182 1.00 0.00 C ATOM 75 CD1 LEU A 54 3.498 -27.697 2.410 1.00 0.00 C ATOM 76 CD2 LEU A 54 5.318 -26.188 1.586 1.00 0.00 C ATOM 0 H LEU A 54 4.281 -30.408 1.185 1.00 0.00 H new ATOM 0 HA LEU A 54 2.553 -28.647 -0.108 1.00 0.00 H new ATOM 0 HB2 LEU A 54 5.386 -28.775 0.723 1.00 0.00 H new ATOM 0 HB3 LEU A 54 5.101 -27.706 -0.636 1.00 0.00 H new ATOM 0 HG LEU A 54 3.412 -26.471 0.668 1.00 0.00 H new ATOM 0 HD11 LEU A 54 3.169 -26.904 3.081 1.00 0.00 H new ATOM 0 HD12 LEU A 54 2.638 -28.293 2.104 1.00 0.00 H new ATOM 0 HD13 LEU A 54 4.216 -28.334 2.926 1.00 0.00 H new ATOM 0 HD21 LEU A 54 4.963 -25.416 2.268 1.00 0.00 H new ATOM 0 HD22 LEU A 54 6.083 -26.787 2.081 1.00 0.00 H new ATOM 0 HD23 LEU A 54 5.742 -25.720 0.698 1.00 0.00 H new ATOM 88 N THR A 55 4.915 -29.513 -2.231 1.00 0.00 N ATOM 89 CA THR A 55 5.222 -29.777 -3.635 1.00 0.00 C ATOM 90 C THR A 55 4.404 -28.920 -4.616 1.00 0.00 C ATOM 91 O THR A 55 4.013 -27.783 -4.313 1.00 0.00 O ATOM 92 CB THR A 55 5.009 -31.264 -3.922 1.00 0.00 C ATOM 93 OG1 THR A 55 5.523 -31.611 -5.195 1.00 0.00 O ATOM 94 CG2 THR A 55 3.557 -31.666 -3.888 1.00 0.00 C ATOM 0 H THR A 55 5.737 -29.464 -1.630 1.00 0.00 H new ATOM 0 HA THR A 55 6.264 -29.500 -3.795 1.00 0.00 H new ATOM 0 HB THR A 55 5.539 -31.793 -3.130 1.00 0.00 H new ATOM 0 HG1 THR A 55 5.378 -32.567 -5.357 1.00 0.00 H new ATOM 0 HG21 THR A 55 3.470 -32.732 -4.099 1.00 0.00 H new ATOM 0 HG22 THR A 55 3.144 -31.456 -2.901 1.00 0.00 H new ATOM 0 HG23 THR A 55 3.005 -31.101 -4.639 1.00 0.00 H new ATOM 102 N GLU A 56 4.177 -29.482 -5.810 1.00 0.00 N ATOM 103 CA GLU A 56 3.440 -28.817 -6.882 1.00 0.00 C ATOM 104 C GLU A 56 2.262 -28.000 -6.363 1.00 0.00 C ATOM 105 O GLU A 56 2.023 -26.901 -6.840 1.00 0.00 O ATOM 106 CB GLU A 56 2.943 -29.852 -7.893 1.00 0.00 C ATOM 107 CG GLU A 56 4.064 -30.553 -8.645 1.00 0.00 C ATOM 108 CD GLU A 56 3.699 -31.969 -9.047 1.00 0.00 C ATOM 109 OE1 GLU A 56 3.032 -32.659 -8.248 1.00 0.00 O ATOM 110 OE2 GLU A 56 4.079 -32.386 -10.161 1.00 0.00 O ATOM 0 H GLU A 56 4.503 -30.416 -6.057 1.00 0.00 H new ATOM 0 HA GLU A 56 4.130 -28.124 -7.363 1.00 0.00 H new ATOM 0 HB2 GLU A 56 2.344 -30.598 -7.372 1.00 0.00 H new ATOM 0 HB3 GLU A 56 2.286 -29.361 -8.611 1.00 0.00 H new ATOM 0 HG2 GLU A 56 4.313 -29.979 -9.537 1.00 0.00 H new ATOM 0 HG3 GLU A 56 4.957 -30.575 -8.021 1.00 0.00 H new ATOM 117 N VAL A 57 1.524 -28.533 -5.397 1.00 0.00 N ATOM 118 CA VAL A 57 0.377 -27.813 -4.849 1.00 0.00 C ATOM 119 C VAL A 57 0.822 -26.533 -4.146 1.00 0.00 C ATOM 120 O VAL A 57 0.214 -25.453 -4.314 1.00 0.00 O ATOM 121 CB VAL A 57 -0.421 -28.684 -3.862 1.00 0.00 C ATOM 122 CG1 VAL A 57 -1.638 -27.929 -3.353 1.00 0.00 C ATOM 123 CG2 VAL A 57 -0.836 -29.993 -4.519 1.00 0.00 C ATOM 0 H VAL A 57 1.694 -29.448 -4.980 1.00 0.00 H new ATOM 0 HA VAL A 57 -0.269 -27.558 -5.689 1.00 0.00 H new ATOM 0 HB VAL A 57 0.219 -28.918 -3.011 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -2.192 -28.559 -2.656 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -1.316 -27.021 -2.844 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -2.281 -27.666 -4.193 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -1.399 -30.595 -3.806 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -1.459 -29.782 -5.388 1.00 0.00 H new ATOM 0 HG23 VAL A 57 0.053 -30.540 -4.834 1.00 0.00 H new ATOM 133 N GLU A 58 1.908 -26.642 -3.378 1.00 0.00 N ATOM 134 CA GLU A 58 2.441 -25.491 -2.681 1.00 0.00 C ATOM 135 C GLU A 58 2.798 -24.420 -3.692 1.00 0.00 C ATOM 136 O GLU A 58 2.316 -23.291 -3.621 1.00 0.00 O ATOM 137 CB GLU A 58 3.652 -25.880 -1.814 1.00 0.00 C ATOM 138 CG GLU A 58 5.010 -25.601 -2.447 1.00 0.00 C ATOM 139 CD GLU A 58 6.154 -25.722 -1.458 1.00 0.00 C ATOM 140 OE1 GLU A 58 6.314 -24.810 -0.620 1.00 0.00 O ATOM 141 OE2 GLU A 58 6.890 -26.729 -1.524 1.00 0.00 O ATOM 0 H GLU A 58 2.424 -27.509 -3.230 1.00 0.00 H new ATOM 0 HA GLU A 58 1.684 -25.096 -2.003 1.00 0.00 H new ATOM 0 HB2 GLU A 58 3.591 -25.342 -0.868 1.00 0.00 H new ATOM 0 HB3 GLU A 58 3.587 -26.943 -1.581 1.00 0.00 H new ATOM 0 HG2 GLU A 58 5.172 -26.297 -3.270 1.00 0.00 H new ATOM 0 HG3 GLU A 58 5.008 -24.598 -2.873 1.00 0.00 H new ATOM 148 N SER A 59 3.615 -24.797 -4.663 1.00 0.00 N ATOM 149 CA SER A 59 4.000 -23.870 -5.714 1.00 0.00 C ATOM 150 C SER A 59 2.761 -23.428 -6.488 1.00 0.00 C ATOM 151 O SER A 59 2.787 -22.437 -7.211 1.00 0.00 O ATOM 152 CB SER A 59 5.009 -24.521 -6.663 1.00 0.00 C ATOM 153 OG SER A 59 4.438 -25.631 -7.332 1.00 0.00 O ATOM 0 H SER A 59 4.021 -25.729 -4.745 1.00 0.00 H new ATOM 0 HA SER A 59 4.470 -22.998 -5.259 1.00 0.00 H new ATOM 0 HB2 SER A 59 5.350 -23.788 -7.394 1.00 0.00 H new ATOM 0 HB3 SER A 59 5.886 -24.843 -6.101 1.00 0.00 H new ATOM 0 HG SER A 59 3.589 -25.869 -6.904 1.00 0.00 H new ATOM 159 N ARG A 60 1.683 -24.196 -6.337 1.00 0.00 N ATOM 160 CA ARG A 60 0.431 -23.926 -7.017 1.00 0.00 C ATOM 161 C ARG A 60 -0.232 -22.678 -6.497 1.00 0.00 C ATOM 162 O ARG A 60 -0.275 -21.659 -7.194 1.00 0.00 O ATOM 163 CB ARG A 60 -0.527 -25.104 -6.854 1.00 0.00 C ATOM 164 CG ARG A 60 -1.529 -25.243 -7.991 1.00 0.00 C ATOM 165 CD ARG A 60 -1.234 -26.462 -8.854 1.00 0.00 C ATOM 166 NE ARG A 60 -2.437 -27.247 -9.119 1.00 0.00 N ATOM 167 CZ ARG A 60 -3.478 -26.798 -9.820 1.00 0.00 C ATOM 168 NH1 ARG A 60 -3.467 -25.571 -10.327 1.00 0.00 N ATOM 169 NH2 ARG A 60 -4.530 -27.581 -10.016 1.00 0.00 N ATOM 0 H ARG A 60 1.660 -25.021 -5.738 1.00 0.00 H new ATOM 0 HA ARG A 60 0.665 -23.779 -8.071 1.00 0.00 H new ATOM 0 HB2 ARG A 60 0.053 -26.024 -6.779 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -1.070 -24.992 -5.916 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -2.536 -25.322 -7.581 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -1.506 -24.345 -8.609 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -0.795 -26.140 -9.799 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -0.494 -27.089 -8.356 1.00 0.00 H new ATOM 0 HE ARG A 60 -2.483 -28.195 -8.745 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -2.659 -24.966 -10.181 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -4.267 -25.233 -10.863 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -4.542 -28.525 -9.631 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -5.327 -27.239 -10.552 1.00 0.00 H new ATOM 183 N LEU A 61 -0.766 -22.728 -5.280 1.00 0.00 N ATOM 184 CA LEU A 61 -1.421 -21.531 -4.777 1.00 0.00 C ATOM 185 C LEU A 61 -0.387 -20.439 -4.539 1.00 0.00 C ATOM 186 O LEU A 61 -0.705 -19.240 -4.535 1.00 0.00 O ATOM 187 CB LEU A 61 -2.283 -21.817 -3.540 1.00 0.00 C ATOM 188 CG LEU A 61 -3.815 -21.778 -3.778 1.00 0.00 C ATOM 189 CD1 LEU A 61 -4.161 -21.601 -5.252 1.00 0.00 C ATOM 190 CD2 LEU A 61 -4.475 -23.041 -3.259 1.00 0.00 C ATOM 0 H LEU A 61 -0.761 -23.535 -4.657 1.00 0.00 H new ATOM 0 HA LEU A 61 -2.118 -21.172 -5.534 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.017 -22.800 -3.151 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.033 -21.090 -2.767 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.194 -20.915 -3.230 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -5.244 -21.579 -5.371 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.737 -20.665 -5.615 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.750 -22.432 -5.825 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -5.549 -22.990 -3.437 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -4.062 -23.907 -3.777 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.289 -23.135 -2.189 1.00 0.00 H new ATOM 202 N GLU A 62 0.870 -20.863 -4.417 1.00 0.00 N ATOM 203 CA GLU A 62 1.971 -19.936 -4.257 1.00 0.00 C ATOM 204 C GLU A 62 2.130 -19.135 -5.538 1.00 0.00 C ATOM 205 O GLU A 62 2.474 -17.955 -5.507 1.00 0.00 O ATOM 206 CB GLU A 62 3.267 -20.685 -3.944 1.00 0.00 C ATOM 207 CG GLU A 62 4.442 -19.770 -3.647 1.00 0.00 C ATOM 208 CD GLU A 62 5.775 -20.401 -4.001 1.00 0.00 C ATOM 209 OE1 GLU A 62 5.948 -20.807 -5.169 1.00 0.00 O ATOM 210 OE2 GLU A 62 6.646 -20.490 -3.110 1.00 0.00 O ATOM 0 H GLU A 62 1.144 -21.846 -4.427 1.00 0.00 H new ATOM 0 HA GLU A 62 1.758 -19.266 -3.424 1.00 0.00 H new ATOM 0 HB2 GLU A 62 3.101 -21.339 -3.088 1.00 0.00 H new ATOM 0 HB3 GLU A 62 3.520 -21.325 -4.789 1.00 0.00 H new ATOM 0 HG2 GLU A 62 4.324 -18.841 -4.204 1.00 0.00 H new ATOM 0 HG3 GLU A 62 4.437 -19.510 -2.589 1.00 0.00 H new ATOM 217 N ARG A 63 1.855 -19.787 -6.672 1.00 0.00 N ATOM 218 CA ARG A 63 1.946 -19.127 -7.965 1.00 0.00 C ATOM 219 C ARG A 63 0.640 -18.404 -8.281 1.00 0.00 C ATOM 220 O ARG A 63 0.604 -17.515 -9.131 1.00 0.00 O ATOM 221 CB ARG A 63 2.264 -20.139 -9.070 1.00 0.00 C ATOM 222 CG ARG A 63 3.728 -20.148 -9.480 1.00 0.00 C ATOM 223 CD ARG A 63 4.192 -21.546 -9.859 1.00 0.00 C ATOM 224 NE ARG A 63 3.911 -21.858 -11.258 1.00 0.00 N ATOM 225 CZ ARG A 63 4.661 -21.443 -12.276 1.00 0.00 C ATOM 226 NH1 ARG A 63 5.727 -20.682 -12.059 1.00 0.00 N ATOM 227 NH2 ARG A 63 4.342 -21.784 -13.517 1.00 0.00 N ATOM 0 H ARG A 63 1.570 -20.765 -6.715 1.00 0.00 H new ATOM 0 HA ARG A 63 2.755 -18.398 -7.920 1.00 0.00 H new ATOM 0 HB2 ARG A 63 1.984 -21.136 -8.730 1.00 0.00 H new ATOM 0 HB3 ARG A 63 1.651 -19.916 -9.944 1.00 0.00 H new ATOM 0 HG2 ARG A 63 3.875 -19.474 -10.324 1.00 0.00 H new ATOM 0 HG3 ARG A 63 4.339 -19.771 -8.660 1.00 0.00 H new ATOM 0 HD2 ARG A 63 5.263 -21.634 -9.677 1.00 0.00 H new ATOM 0 HD3 ARG A 63 3.699 -22.277 -9.219 1.00 0.00 H new ATOM 0 HE ARG A 63 3.091 -22.428 -11.467 1.00 0.00 H new ATOM 0 HH11 ARG A 63 5.976 -20.412 -11.107 1.00 0.00 H new ATOM 0 HH12 ARG A 63 6.297 -20.367 -12.844 1.00 0.00 H new ATOM 0 HH21 ARG A 63 3.522 -22.364 -13.692 1.00 0.00 H new ATOM 0 HH22 ARG A 63 4.917 -21.466 -14.297 1.00 0.00 H new ATOM 241 N LEU A 64 -0.434 -18.788 -7.588 1.00 0.00 N ATOM 242 CA LEU A 64 -1.734 -18.159 -7.803 1.00 0.00 C ATOM 243 C LEU A 64 -1.773 -16.789 -7.152 1.00 0.00 C ATOM 244 O LEU A 64 -2.406 -15.862 -7.657 1.00 0.00 O ATOM 245 CB LEU A 64 -2.865 -19.056 -7.269 1.00 0.00 C ATOM 246 CG LEU A 64 -3.944 -18.355 -6.429 1.00 0.00 C ATOM 247 CD1 LEU A 64 -5.282 -19.069 -6.565 1.00 0.00 C ATOM 248 CD2 LEU A 64 -3.517 -18.287 -4.967 1.00 0.00 C ATOM 0 H LEU A 64 -0.428 -19.523 -6.881 1.00 0.00 H new ATOM 0 HA LEU A 64 -1.885 -18.031 -8.875 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -3.350 -19.538 -8.118 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -2.420 -19.847 -6.665 1.00 0.00 H new ATOM 0 HG LEU A 64 -4.064 -17.338 -6.802 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -6.031 -18.556 -5.962 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -5.592 -19.065 -7.610 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -5.182 -20.098 -6.220 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -4.291 -17.788 -4.385 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -3.369 -19.297 -4.584 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -2.585 -17.728 -4.886 1.00 0.00 H new ATOM 260 N GLU A 65 -1.090 -16.674 -6.032 1.00 0.00 N ATOM 261 CA GLU A 65 -1.033 -15.414 -5.301 1.00 0.00 C ATOM 262 C GLU A 65 0.229 -14.631 -5.652 1.00 0.00 C ATOM 263 O GLU A 65 0.244 -13.402 -5.599 1.00 0.00 O ATOM 264 CB GLU A 65 -1.076 -15.673 -3.800 1.00 0.00 C ATOM 265 CG GLU A 65 -2.482 -15.677 -3.218 1.00 0.00 C ATOM 266 CD GLU A 65 -2.780 -16.924 -2.406 1.00 0.00 C ATOM 267 OE1 GLU A 65 -1.966 -17.871 -2.449 1.00 0.00 O ATOM 268 OE2 GLU A 65 -3.830 -16.957 -1.731 1.00 0.00 O ATOM 0 H GLU A 65 -0.564 -17.436 -5.603 1.00 0.00 H new ATOM 0 HA GLU A 65 -1.900 -14.819 -5.590 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -0.604 -16.633 -3.593 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -0.485 -14.911 -3.292 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -2.611 -14.798 -2.586 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -3.206 -15.596 -4.029 1.00 0.00 H new ATOM 275 N GLN A 66 1.286 -15.350 -6.013 1.00 0.00 N ATOM 276 CA GLN A 66 2.553 -14.726 -6.374 1.00 0.00 C ATOM 277 C GLN A 66 3.186 -14.027 -5.170 1.00 0.00 C ATOM 278 O GLN A 66 3.712 -12.919 -5.288 1.00 0.00 O ATOM 279 CB GLN A 66 2.340 -13.736 -7.519 1.00 0.00 C ATOM 280 CG GLN A 66 3.195 -14.030 -8.740 1.00 0.00 C ATOM 281 CD GLN A 66 2.373 -14.186 -10.005 1.00 0.00 C ATOM 282 OE1 GLN A 66 1.249 -13.691 -10.094 1.00 0.00 O ATOM 283 NE2 GLN A 66 2.930 -14.879 -10.992 1.00 0.00 N ATOM 0 H GLN A 66 1.290 -16.369 -6.063 1.00 0.00 H new ATOM 0 HA GLN A 66 3.239 -15.506 -6.704 1.00 0.00 H new ATOM 0 HB2 GLN A 66 1.289 -13.749 -7.809 1.00 0.00 H new ATOM 0 HB3 GLN A 66 2.561 -12.729 -7.164 1.00 0.00 H new ATOM 0 HG2 GLN A 66 3.916 -13.224 -8.877 1.00 0.00 H new ATOM 0 HG3 GLN A 66 3.766 -14.942 -8.568 1.00 0.00 H new ATOM 0 HE21 GLN A 66 3.864 -15.272 -10.875 1.00 0.00 H new ATOM 0 HE22 GLN A 66 2.424 -15.018 -11.866 1.00 0.00 H new ATOM 292 N LEU A 67 3.135 -14.686 -4.016 1.00 0.00 N ATOM 293 CA LEU A 67 3.708 -14.138 -2.787 1.00 0.00 C ATOM 294 C LEU A 67 2.983 -12.864 -2.358 1.00 0.00 C ATOM 295 O LEU A 67 2.967 -11.873 -3.088 1.00 0.00 O ATOM 296 CB LEU A 67 5.198 -13.847 -2.978 1.00 0.00 C ATOM 297 CG LEU A 67 5.948 -13.442 -1.706 1.00 0.00 C ATOM 298 CD1 LEU A 67 7.308 -14.119 -1.648 1.00 0.00 C ATOM 299 CD2 LEU A 67 6.099 -11.931 -1.633 1.00 0.00 C ATOM 0 H LEU A 67 2.702 -15.603 -3.905 1.00 0.00 H new ATOM 0 HA LEU A 67 3.585 -14.884 -2.002 1.00 0.00 H new ATOM 0 HB2 LEU A 67 5.675 -14.734 -3.396 1.00 0.00 H new ATOM 0 HB3 LEU A 67 5.305 -13.050 -3.714 1.00 0.00 H new ATOM 0 HG LEU A 67 5.365 -13.770 -0.845 1.00 0.00 H new ATOM 0 HD11 LEU A 67 7.825 -13.819 -0.737 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.176 -15.201 -1.650 1.00 0.00 H new ATOM 0 HD13 LEU A 67 7.899 -13.824 -2.515 1.00 0.00 H new ATOM 0 HD21 LEU A 67 6.634 -11.662 -0.722 1.00 0.00 H new ATOM 0 HD22 LEU A 67 6.658 -11.579 -2.500 1.00 0.00 H new ATOM 0 HD23 LEU A 67 5.113 -11.467 -1.624 1.00 0.00 H new ATOM 311 N PHE A 68 2.386 -12.897 -1.169 1.00 0.00 N ATOM 312 CA PHE A 68 1.662 -11.744 -0.647 1.00 0.00 C ATOM 313 C PHE A 68 1.686 -11.729 0.878 1.00 0.00 C ATOM 314 O PHE A 68 1.275 -12.689 1.527 1.00 0.00 O ATOM 315 CB PHE A 68 0.218 -11.764 -1.152 1.00 0.00 C ATOM 316 CG PHE A 68 -0.645 -10.665 -0.593 1.00 0.00 C ATOM 317 CD1 PHE A 68 -0.094 -9.454 -0.206 1.00 0.00 C ATOM 318 CD2 PHE A 68 -2.012 -10.846 -0.457 1.00 0.00 C ATOM 319 CE1 PHE A 68 -0.888 -8.447 0.305 1.00 0.00 C ATOM 320 CE2 PHE A 68 -2.811 -9.844 0.055 1.00 0.00 C ATOM 321 CZ PHE A 68 -2.249 -8.643 0.435 1.00 0.00 C ATOM 0 H PHE A 68 2.390 -13.708 -0.551 1.00 0.00 H new ATOM 0 HA PHE A 68 2.154 -10.839 -1.002 1.00 0.00 H new ATOM 0 HB2 PHE A 68 0.224 -11.689 -2.239 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -0.230 -12.726 -0.901 1.00 0.00 H new ATOM 0 HD1 PHE A 68 0.970 -9.296 -0.305 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -2.458 -11.783 -0.756 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.446 -7.508 0.603 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -3.875 -10.000 0.158 1.00 0.00 H new ATOM 0 HZ PHE A 68 -2.873 -7.857 0.834 1.00 0.00 H new ATOM 331 N LEU A 69 2.171 -10.627 1.443 1.00 0.00 N ATOM 332 CA LEU A 69 2.250 -10.484 2.891 1.00 0.00 C ATOM 333 C LEU A 69 2.731 -9.089 3.279 1.00 0.00 C ATOM 334 O LEU A 69 2.239 -8.498 4.241 1.00 0.00 O ATOM 335 CB LEU A 69 3.185 -11.543 3.479 1.00 0.00 C ATOM 336 CG LEU A 69 3.161 -11.651 5.004 1.00 0.00 C ATOM 337 CD1 LEU A 69 2.027 -12.559 5.457 1.00 0.00 C ATOM 338 CD2 LEU A 69 4.497 -12.167 5.519 1.00 0.00 C ATOM 0 H LEU A 69 2.515 -9.822 0.920 1.00 0.00 H new ATOM 0 HA LEU A 69 1.249 -10.626 3.299 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.922 -12.513 3.057 1.00 0.00 H new ATOM 0 HB3 LEU A 69 4.204 -11.323 3.161 1.00 0.00 H new ATOM 0 HG LEU A 69 2.991 -10.658 5.419 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.025 -12.624 6.545 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.076 -12.150 5.117 1.00 0.00 H new ATOM 0 HD13 LEU A 69 2.167 -13.554 5.034 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.465 -12.239 6.606 1.00 0.00 H new ATOM 0 HD22 LEU A 69 4.694 -13.152 5.096 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.290 -11.480 5.224 1.00 0.00 H new ATOM 350 N LEU A 70 3.698 -8.566 2.529 1.00 0.00 N ATOM 351 CA LEU A 70 4.243 -7.242 2.801 1.00 0.00 C ATOM 352 C LEU A 70 3.712 -6.211 1.808 1.00 0.00 C ATOM 353 O LEU A 70 4.359 -5.196 1.549 1.00 0.00 O ATOM 354 CB LEU A 70 5.771 -7.274 2.754 1.00 0.00 C ATOM 355 CG LEU A 70 6.454 -7.532 4.099 1.00 0.00 C ATOM 356 CD1 LEU A 70 7.933 -7.818 3.899 1.00 0.00 C ATOM 357 CD2 LEU A 70 6.260 -6.344 5.028 1.00 0.00 C ATOM 0 H LEU A 70 4.119 -9.040 1.730 1.00 0.00 H new ATOM 0 HA LEU A 70 3.923 -6.949 3.801 1.00 0.00 H new ATOM 0 HB2 LEU A 70 6.082 -8.047 2.051 1.00 0.00 H new ATOM 0 HB3 LEU A 70 6.127 -6.323 2.359 1.00 0.00 H new ATOM 0 HG LEU A 70 5.995 -8.407 4.558 1.00 0.00 H new ATOM 0 HD11 LEU A 70 8.403 -7.999 4.866 1.00 0.00 H new ATOM 0 HD12 LEU A 70 8.051 -8.699 3.268 1.00 0.00 H new ATOM 0 HD13 LEU A 70 8.408 -6.962 3.420 1.00 0.00 H new ATOM 0 HD21 LEU A 70 6.751 -6.543 5.980 1.00 0.00 H new ATOM 0 HD22 LEU A 70 6.694 -5.453 4.575 1.00 0.00 H new ATOM 0 HD23 LEU A 70 5.195 -6.183 5.196 1.00 0.00 H new ATOM 369 N ILE A 71 2.531 -6.475 1.258 1.00 0.00 N ATOM 370 CA ILE A 71 1.916 -5.568 0.296 1.00 0.00 C ATOM 371 C ILE A 71 0.636 -4.953 0.858 1.00 0.00 C ATOM 372 O ILE A 71 0.219 -3.874 0.437 1.00 0.00 O ATOM 373 CB ILE A 71 1.589 -6.286 -1.027 1.00 0.00 C ATOM 374 CG1 ILE A 71 2.809 -7.058 -1.530 1.00 0.00 C ATOM 375 CG2 ILE A 71 1.121 -5.284 -2.073 1.00 0.00 C ATOM 376 CD1 ILE A 71 2.470 -8.133 -2.541 1.00 0.00 C ATOM 0 H ILE A 71 1.981 -7.309 1.462 1.00 0.00 H new ATOM 0 HA ILE A 71 2.641 -4.778 0.101 1.00 0.00 H new ATOM 0 HB ILE A 71 0.783 -6.997 -0.847 1.00 0.00 H new ATOM 0 HG12 ILE A 71 3.513 -6.357 -1.979 1.00 0.00 H new ATOM 0 HG13 ILE A 71 3.315 -7.516 -0.680 1.00 0.00 H new ATOM 0 HG21 ILE A 71 0.894 -5.807 -3.002 1.00 0.00 H new ATOM 0 HG22 ILE A 71 0.226 -4.775 -1.715 1.00 0.00 H new ATOM 0 HG23 ILE A 71 1.908 -4.551 -2.252 1.00 0.00 H new ATOM 0 HD11 ILE A 71 3.383 -8.639 -2.854 1.00 0.00 H new ATOM 0 HD12 ILE A 71 1.791 -8.856 -2.089 1.00 0.00 H new ATOM 0 HD13 ILE A 71 1.992 -7.679 -3.409 1.00 0.00 H new ATOM 388 N PHE A 72 0.013 -5.649 1.806 1.00 0.00 N ATOM 389 CA PHE A 72 -1.222 -5.175 2.422 1.00 0.00 C ATOM 390 C PHE A 72 -2.344 -5.087 1.387 1.00 0.00 C ATOM 391 O PHE A 72 -2.205 -4.411 0.367 1.00 0.00 O ATOM 392 CB PHE A 72 -1.003 -3.809 3.075 1.00 0.00 C ATOM 393 CG PHE A 72 -0.597 -3.897 4.520 1.00 0.00 C ATOM 394 CD1 PHE A 72 -1.487 -4.363 5.475 1.00 0.00 C ATOM 395 CD2 PHE A 72 0.671 -3.513 4.922 1.00 0.00 C ATOM 396 CE1 PHE A 72 -1.116 -4.447 6.804 1.00 0.00 C ATOM 397 CE2 PHE A 72 1.047 -3.593 6.250 1.00 0.00 C ATOM 398 CZ PHE A 72 0.151 -4.061 7.192 1.00 0.00 C ATOM 0 H PHE A 72 0.345 -6.545 2.164 1.00 0.00 H new ATOM 0 HA PHE A 72 -1.514 -5.890 3.191 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -0.235 -3.269 2.522 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -1.921 -3.226 2.998 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -2.481 -4.664 5.178 1.00 0.00 H new ATOM 0 HD2 PHE A 72 1.375 -3.147 4.189 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -1.817 -4.815 7.538 1.00 0.00 H new ATOM 0 HE2 PHE A 72 2.039 -3.290 6.551 1.00 0.00 H new ATOM 0 HZ PHE A 72 0.442 -4.125 8.230 1.00 0.00 H new ATOM 408 N PRO A 73 -3.474 -5.777 1.629 1.00 0.00 N ATOM 409 CA PRO A 73 -4.610 -5.777 0.711 1.00 0.00 C ATOM 410 C PRO A 73 -5.532 -4.579 0.917 1.00 0.00 C ATOM 411 O PRO A 73 -6.512 -4.658 1.658 1.00 0.00 O ATOM 412 CB PRO A 73 -5.328 -7.075 1.067 1.00 0.00 C ATOM 413 CG PRO A 73 -5.071 -7.258 2.525 1.00 0.00 C ATOM 414 CD PRO A 73 -3.732 -6.621 2.814 1.00 0.00 C ATOM 0 HA PRO A 73 -4.299 -5.708 -0.331 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -6.396 -7.008 0.858 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -4.942 -7.914 0.488 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -5.857 -6.791 3.118 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -5.060 -8.316 2.786 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -3.761 -6.028 3.728 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -2.953 -7.372 2.946 1.00 0.00 H new ATOM 422 N ARG A 74 -5.213 -3.474 0.252 1.00 0.00 N ATOM 423 CA ARG A 74 -6.013 -2.258 0.358 1.00 0.00 C ATOM 424 C ARG A 74 -6.138 -1.804 1.807 1.00 0.00 C ATOM 425 O ARG A 74 -7.162 -1.255 2.213 1.00 0.00 O ATOM 426 CB ARG A 74 -7.397 -2.480 -0.252 1.00 0.00 C ATOM 427 CG ARG A 74 -7.432 -2.285 -1.759 1.00 0.00 C ATOM 428 CD ARG A 74 -8.689 -2.882 -2.371 1.00 0.00 C ATOM 429 NE ARG A 74 -9.796 -1.927 -2.385 1.00 0.00 N ATOM 430 CZ ARG A 74 -10.630 -1.738 -1.365 1.00 0.00 C ATOM 431 NH1 ARG A 74 -10.496 -2.443 -0.247 1.00 0.00 N ATOM 432 NH2 ARG A 74 -11.602 -0.843 -1.462 1.00 0.00 N ATOM 0 H ARG A 74 -4.406 -3.395 -0.367 1.00 0.00 H new ATOM 0 HA ARG A 74 -5.504 -1.470 -0.197 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -7.732 -3.490 -0.016 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -8.105 -1.793 0.212 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -7.384 -1.221 -1.990 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -6.553 -2.748 -2.207 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -8.477 -3.207 -3.390 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -8.981 -3.768 -1.808 1.00 0.00 H new ATOM 0 HE ARG A 74 -9.938 -1.371 -3.228 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -9.750 -3.134 -0.166 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -11.139 -2.293 0.531 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -11.711 -0.299 -2.318 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -12.241 -0.698 -0.681 1.00 0.00 H new ATOM 446 N GLU A 75 -5.080 -2.031 2.578 1.00 0.00 N ATOM 447 CA GLU A 75 -5.057 -1.640 3.981 1.00 0.00 C ATOM 448 C GLU A 75 -4.131 -0.446 4.188 1.00 0.00 C ATOM 449 O GLU A 75 -2.908 -0.586 4.174 1.00 0.00 O ATOM 450 CB GLU A 75 -4.605 -2.815 4.851 1.00 0.00 C ATOM 451 CG GLU A 75 -5.691 -3.341 5.775 1.00 0.00 C ATOM 452 CD GLU A 75 -6.331 -4.615 5.256 1.00 0.00 C ATOM 453 OE1 GLU A 75 -5.799 -5.707 5.547 1.00 0.00 O ATOM 454 OE2 GLU A 75 -7.363 -4.519 4.560 1.00 0.00 O ATOM 0 H GLU A 75 -4.226 -2.485 2.253 1.00 0.00 H new ATOM 0 HA GLU A 75 -6.066 -1.352 4.276 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -4.265 -3.625 4.205 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -3.749 -2.505 5.450 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -5.265 -3.528 6.761 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -6.459 -2.577 5.899 1.00 0.00 H new ATOM 461 N ASP A 76 -4.723 0.731 4.375 1.00 0.00 N ATOM 462 CA ASP A 76 -3.957 1.958 4.581 1.00 0.00 C ATOM 463 C ASP A 76 -3.353 2.454 3.270 1.00 0.00 C ATOM 464 O ASP A 76 -3.849 3.406 2.669 1.00 0.00 O ATOM 465 CB ASP A 76 -2.853 1.740 5.623 1.00 0.00 C ATOM 466 CG ASP A 76 -2.953 2.709 6.784 1.00 0.00 C ATOM 467 OD1 ASP A 76 -2.582 3.889 6.607 1.00 0.00 O ATOM 468 OD2 ASP A 76 -3.403 2.289 7.870 1.00 0.00 O ATOM 0 H ASP A 76 -5.735 0.861 4.388 1.00 0.00 H new ATOM 0 HA ASP A 76 -4.643 2.720 4.953 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -2.910 0.719 6.000 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -1.880 1.850 5.145 1.00 0.00 H new ATOM 473 N LEU A 77 -2.276 1.804 2.830 1.00 0.00 N ATOM 474 CA LEU A 77 -1.604 2.184 1.590 1.00 0.00 C ATOM 475 C LEU A 77 -1.235 3.665 1.603 1.00 0.00 C ATOM 476 O LEU A 77 -1.798 4.466 0.856 1.00 0.00 O ATOM 477 CB LEU A 77 -2.496 1.876 0.387 1.00 0.00 C ATOM 478 CG LEU A 77 -2.548 0.401 -0.019 1.00 0.00 C ATOM 479 CD1 LEU A 77 -3.536 -0.357 0.854 1.00 0.00 C ATOM 480 CD2 LEU A 77 -2.920 0.266 -1.489 1.00 0.00 C ATOM 0 H LEU A 77 -1.851 1.013 3.314 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.686 1.602 1.509 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -3.509 2.212 0.609 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.146 2.460 -0.465 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.558 -0.032 0.126 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.560 -1.404 0.551 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -3.227 -0.288 1.897 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.530 0.077 0.740 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.952 -0.789 -1.761 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.899 0.715 -1.659 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.176 0.776 -2.101 1.00 0.00 H new ATOM 492 N ASP A 78 -0.291 4.022 2.468 1.00 0.00 N ATOM 493 CA ASP A 78 0.152 5.407 2.596 1.00 0.00 C ATOM 494 C ASP A 78 1.606 5.577 2.159 1.00 0.00 C ATOM 495 O ASP A 78 2.048 6.689 1.870 1.00 0.00 O ATOM 496 CB ASP A 78 -0.014 5.870 4.043 1.00 0.00 C ATOM 497 CG ASP A 78 0.006 7.379 4.176 1.00 0.00 C ATOM 498 OD1 ASP A 78 -1.025 8.016 3.876 1.00 0.00 O ATOM 499 OD2 ASP A 78 1.055 7.925 4.582 1.00 0.00 O ATOM 0 H ASP A 78 0.183 3.370 3.093 1.00 0.00 H new ATOM 0 HA ASP A 78 -0.466 6.019 1.940 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -0.955 5.486 4.438 1.00 0.00 H new ATOM 0 HB3 ASP A 78 0.784 5.444 4.651 1.00 0.00 H new ATOM 504 N MET A 79 2.349 4.474 2.117 1.00 0.00 N ATOM 505 CA MET A 79 3.753 4.509 1.718 1.00 0.00 C ATOM 506 C MET A 79 3.915 5.139 0.335 1.00 0.00 C ATOM 507 O MET A 79 4.841 5.916 0.102 1.00 0.00 O ATOM 508 CB MET A 79 4.342 3.097 1.725 1.00 0.00 C ATOM 509 CG MET A 79 5.452 2.906 2.747 1.00 0.00 C ATOM 510 SD MET A 79 6.328 1.345 2.536 1.00 0.00 S ATOM 511 CE MET A 79 7.934 1.927 1.999 1.00 0.00 C ATOM 0 H MET A 79 2.002 3.545 2.354 1.00 0.00 H new ATOM 0 HA MET A 79 4.294 5.123 2.438 1.00 0.00 H new ATOM 0 HB2 MET A 79 3.546 2.381 1.928 1.00 0.00 H new ATOM 0 HB3 MET A 79 4.730 2.869 0.732 1.00 0.00 H new ATOM 0 HG2 MET A 79 6.161 3.730 2.666 1.00 0.00 H new ATOM 0 HG3 MET A 79 5.028 2.948 3.750 1.00 0.00 H new ATOM 0 HE1 MET A 79 8.591 1.075 1.827 1.00 0.00 H new ATOM 0 HE2 MET A 79 7.825 2.494 1.074 1.00 0.00 H new ATOM 0 HE3 MET A 79 8.365 2.568 2.769 1.00 0.00 H new ATOM 521 N ILE A 80 3.009 4.799 -0.575 1.00 0.00 N ATOM 522 CA ILE A 80 3.052 5.332 -1.931 1.00 0.00 C ATOM 523 C ILE A 80 2.765 6.829 -1.942 1.00 0.00 C ATOM 524 O ILE A 80 3.445 7.597 -2.624 1.00 0.00 O ATOM 525 CB ILE A 80 2.039 4.619 -2.850 1.00 0.00 C ATOM 526 CG1 ILE A 80 2.192 3.101 -2.733 1.00 0.00 C ATOM 527 CG2 ILE A 80 2.222 5.067 -4.291 1.00 0.00 C ATOM 528 CD1 ILE A 80 3.588 2.609 -3.048 1.00 0.00 C ATOM 0 H ILE A 80 2.236 4.157 -0.398 1.00 0.00 H new ATOM 0 HA ILE A 80 4.059 5.154 -2.308 1.00 0.00 H new ATOM 0 HB ILE A 80 1.032 4.889 -2.533 1.00 0.00 H new ATOM 0 HG12 ILE A 80 1.927 2.794 -1.721 1.00 0.00 H new ATOM 0 HG13 ILE A 80 1.485 2.619 -3.408 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.499 4.554 -4.926 1.00 0.00 H new ATOM 0 HG22 ILE A 80 2.066 6.144 -4.360 1.00 0.00 H new ATOM 0 HG23 ILE A 80 3.232 4.825 -4.622 1.00 0.00 H new ATOM 0 HD11 ILE A 80 3.623 1.524 -2.945 1.00 0.00 H new ATOM 0 HD12 ILE A 80 3.849 2.885 -4.070 1.00 0.00 H new ATOM 0 HD13 ILE A 80 4.298 3.062 -2.357 1.00 0.00 H new ATOM 540 N LEU A 81 1.754 7.237 -1.181 1.00 0.00 N ATOM 541 CA LEU A 81 1.375 8.642 -1.100 1.00 0.00 C ATOM 542 C LEU A 81 2.485 9.470 -0.456 1.00 0.00 C ATOM 543 O LEU A 81 2.581 10.677 -0.680 1.00 0.00 O ATOM 544 CB LEU A 81 0.078 8.797 -0.304 1.00 0.00 C ATOM 545 CG LEU A 81 -1.193 8.897 -1.150 1.00 0.00 C ATOM 546 CD1 LEU A 81 -1.637 7.517 -1.609 1.00 0.00 C ATOM 547 CD2 LEU A 81 -2.301 9.583 -0.366 1.00 0.00 C ATOM 0 H LEU A 81 1.182 6.613 -0.611 1.00 0.00 H new ATOM 0 HA LEU A 81 1.216 9.009 -2.114 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -0.019 7.947 0.372 1.00 0.00 H new ATOM 0 HB3 LEU A 81 0.155 9.690 0.316 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.974 9.498 -2.033 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.542 7.607 -2.209 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.848 7.061 -2.208 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -1.839 6.892 -0.739 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -3.198 9.646 -0.982 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -2.519 9.008 0.534 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -1.981 10.587 -0.087 1.00 0.00 H new ATOM 559 N LYS A 82 3.320 8.815 0.345 1.00 0.00 N ATOM 560 CA LYS A 82 4.421 9.494 1.020 1.00 0.00 C ATOM 561 C LYS A 82 5.669 9.515 0.142 1.00 0.00 C ATOM 562 O LYS A 82 6.511 10.404 0.266 1.00 0.00 O ATOM 563 CB LYS A 82 4.732 8.805 2.349 1.00 0.00 C ATOM 564 CG LYS A 82 3.644 8.981 3.395 1.00 0.00 C ATOM 565 CD LYS A 82 4.082 8.449 4.749 1.00 0.00 C ATOM 566 CE LYS A 82 3.409 9.200 5.887 1.00 0.00 C ATOM 567 NZ LYS A 82 3.410 8.410 7.149 1.00 0.00 N ATOM 0 H LYS A 82 3.255 7.816 0.542 1.00 0.00 H new ATOM 0 HA LYS A 82 4.117 10.523 1.212 1.00 0.00 H new ATOM 0 HB2 LYS A 82 4.883 7.741 2.170 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.669 9.199 2.742 1.00 0.00 H new ATOM 0 HG2 LYS A 82 3.390 10.037 3.483 1.00 0.00 H new ATOM 0 HG3 LYS A 82 2.741 8.462 3.073 1.00 0.00 H new ATOM 0 HD2 LYS A 82 3.842 7.388 4.819 1.00 0.00 H new ATOM 0 HD3 LYS A 82 5.164 8.538 4.843 1.00 0.00 H new ATOM 0 HE2 LYS A 82 3.923 10.147 6.051 1.00 0.00 H new ATOM 0 HE3 LYS A 82 2.382 9.438 5.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 2.943 8.956 7.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 2.898 7.517 7.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 4.390 8.204 7.429 1.00 0.00 H new ATOM 581 N MET A 83 5.782 8.531 -0.745 1.00 0.00 N ATOM 582 CA MET A 83 6.928 8.438 -1.642 1.00 0.00 C ATOM 583 C MET A 83 6.718 9.290 -2.893 1.00 0.00 C ATOM 584 O MET A 83 7.677 9.644 -3.579 1.00 0.00 O ATOM 585 CB MET A 83 7.173 6.981 -2.038 1.00 0.00 C ATOM 586 CG MET A 83 8.116 6.247 -1.100 1.00 0.00 C ATOM 587 SD MET A 83 8.568 4.611 -1.709 1.00 0.00 S ATOM 588 CE MET A 83 9.674 5.043 -3.050 1.00 0.00 C ATOM 0 H MET A 83 5.094 7.787 -0.861 1.00 0.00 H new ATOM 0 HA MET A 83 7.802 8.817 -1.112 1.00 0.00 H new ATOM 0 HB2 MET A 83 6.219 6.455 -2.065 1.00 0.00 H new ATOM 0 HB3 MET A 83 7.582 6.951 -3.048 1.00 0.00 H new ATOM 0 HG2 MET A 83 9.019 6.841 -0.961 1.00 0.00 H new ATOM 0 HG3 MET A 83 7.646 6.149 -0.122 1.00 0.00 H new ATOM 0 HE1 MET A 83 10.253 4.166 -3.341 1.00 0.00 H new ATOM 0 HE2 MET A 83 9.092 5.393 -3.903 1.00 0.00 H new ATOM 0 HE3 MET A 83 10.351 5.833 -2.723 1.00 0.00 H new ATOM 598 N ASP A 84 5.462 9.616 -3.186 1.00 0.00 N ATOM 599 CA ASP A 84 5.138 10.424 -4.356 1.00 0.00 C ATOM 600 C ASP A 84 4.911 11.883 -3.967 1.00 0.00 C ATOM 601 O ASP A 84 4.166 12.603 -4.631 1.00 0.00 O ATOM 602 CB ASP A 84 3.896 9.872 -5.055 1.00 0.00 C ATOM 603 CG ASP A 84 3.902 10.144 -6.547 1.00 0.00 C ATOM 604 OD1 ASP A 84 4.141 11.305 -6.938 1.00 0.00 O ATOM 605 OD2 ASP A 84 3.670 9.194 -7.323 1.00 0.00 O ATOM 0 H ASP A 84 4.655 9.334 -2.630 1.00 0.00 H new ATOM 0 HA ASP A 84 5.984 10.378 -5.042 1.00 0.00 H new ATOM 0 HB2 ASP A 84 3.834 8.797 -4.885 1.00 0.00 H new ATOM 0 HB3 ASP A 84 3.005 10.316 -4.611 1.00 0.00 H new ATOM 610 N SER A 85 5.559 12.312 -2.887 1.00 0.00 N ATOM 611 CA SER A 85 5.428 13.686 -2.411 1.00 0.00 C ATOM 612 C SER A 85 3.969 14.030 -2.123 1.00 0.00 C ATOM 613 O SER A 85 3.061 13.288 -2.496 1.00 0.00 O ATOM 614 CB SER A 85 5.998 14.661 -3.445 1.00 0.00 C ATOM 615 OG SER A 85 6.192 15.945 -2.879 1.00 0.00 O ATOM 0 H SER A 85 6.179 11.729 -2.326 1.00 0.00 H new ATOM 0 HA SER A 85 5.992 13.776 -1.483 1.00 0.00 H new ATOM 0 HB2 SER A 85 6.946 14.280 -3.825 1.00 0.00 H new ATOM 0 HB3 SER A 85 5.319 14.733 -4.295 1.00 0.00 H new ATOM 0 HG SER A 85 6.405 16.587 -3.589 1.00 0.00 H new ATOM 621 N LEU A 86 3.755 15.160 -1.456 1.00 0.00 N ATOM 622 CA LEU A 86 2.407 15.604 -1.118 1.00 0.00 C ATOM 623 C LEU A 86 2.438 16.971 -0.441 1.00 0.00 C ATOM 624 O LEU A 86 1.593 17.826 -0.707 1.00 0.00 O ATOM 625 CB LEU A 86 1.721 14.580 -0.211 1.00 0.00 C ATOM 626 CG LEU A 86 0.576 13.803 -0.863 1.00 0.00 C ATOM 627 CD1 LEU A 86 0.054 12.730 0.078 1.00 0.00 C ATOM 628 CD2 LEU A 86 -0.545 14.750 -1.270 1.00 0.00 C ATOM 0 H LEU A 86 4.497 15.784 -1.139 1.00 0.00 H new ATOM 0 HA LEU A 86 1.837 15.693 -2.043 1.00 0.00 H new ATOM 0 HB2 LEU A 86 2.469 13.869 0.140 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.335 15.096 0.668 1.00 0.00 H new ATOM 0 HG LEU A 86 0.958 13.315 -1.760 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -0.760 12.188 -0.404 1.00 0.00 H new ATOM 0 HD12 LEU A 86 0.859 12.036 0.320 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -0.312 13.195 0.993 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -1.352 14.181 -1.732 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -0.924 15.266 -0.388 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.163 15.482 -1.982 1.00 0.00 H new ATOM 640 N ARG A 87 3.418 17.171 0.436 1.00 0.00 N ATOM 641 CA ARG A 87 3.557 18.436 1.150 1.00 0.00 C ATOM 642 C ARG A 87 4.358 19.439 0.325 1.00 0.00 C ATOM 643 O ARG A 87 4.138 20.646 0.419 1.00 0.00 O ATOM 644 CB ARG A 87 4.236 18.213 2.503 1.00 0.00 C ATOM 645 CG ARG A 87 3.638 17.063 3.300 1.00 0.00 C ATOM 646 CD ARG A 87 3.068 17.538 4.627 1.00 0.00 C ATOM 647 NE ARG A 87 1.945 18.455 4.444 1.00 0.00 N ATOM 648 CZ ARG A 87 1.079 18.767 5.404 1.00 0.00 C ATOM 649 NH1 ARG A 87 1.203 18.238 6.617 1.00 0.00 N ATOM 650 NH2 ARG A 87 0.087 19.610 5.155 1.00 0.00 N ATOM 0 H ARG A 87 4.126 16.475 0.669 1.00 0.00 H new ATOM 0 HA ARG A 87 2.559 18.842 1.317 1.00 0.00 H new ATOM 0 HB2 ARG A 87 5.296 18.020 2.341 1.00 0.00 H new ATOM 0 HB3 ARG A 87 4.165 19.128 3.091 1.00 0.00 H new ATOM 0 HG2 ARG A 87 2.852 16.585 2.716 1.00 0.00 H new ATOM 0 HG3 ARG A 87 4.404 16.309 3.481 1.00 0.00 H new ATOM 0 HD2 ARG A 87 2.742 16.677 5.210 1.00 0.00 H new ATOM 0 HD3 ARG A 87 3.851 18.034 5.201 1.00 0.00 H new ATOM 0 HE ARG A 87 1.818 18.881 3.526 1.00 0.00 H new ATOM 0 HH11 ARG A 87 1.965 17.590 6.815 1.00 0.00 H new ATOM 0 HH12 ARG A 87 0.536 18.481 7.350 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -0.013 20.020 4.226 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -0.577 19.849 5.892 1.00 0.00 H new ATOM 664 N ASP A 88 5.280 18.933 -0.486 1.00 0.00 N ATOM 665 CA ASP A 88 6.107 19.788 -1.331 1.00 0.00 C ATOM 666 C ASP A 88 5.288 20.397 -2.470 1.00 0.00 C ATOM 667 O ASP A 88 5.755 21.296 -3.169 1.00 0.00 O ATOM 668 CB ASP A 88 7.282 18.989 -1.903 1.00 0.00 C ATOM 669 CG ASP A 88 8.606 19.707 -1.736 1.00 0.00 C ATOM 670 OD1 ASP A 88 9.200 19.609 -0.642 1.00 0.00 O ATOM 671 OD2 ASP A 88 9.049 20.366 -2.698 1.00 0.00 O ATOM 0 H ASP A 88 5.474 17.936 -0.577 1.00 0.00 H new ATOM 0 HA ASP A 88 6.491 20.600 -0.714 1.00 0.00 H new ATOM 0 HB2 ASP A 88 7.333 18.019 -1.408 1.00 0.00 H new ATOM 0 HB3 ASP A 88 7.107 18.798 -2.962 1.00 0.00 H new ATOM 676 N ILE A 89 4.058 19.912 -2.637 1.00 0.00 N ATOM 677 CA ILE A 89 3.170 20.411 -3.675 1.00 0.00 C ATOM 678 C ILE A 89 2.323 21.538 -3.116 1.00 0.00 C ATOM 679 O ILE A 89 2.342 22.659 -3.624 1.00 0.00 O ATOM 680 CB ILE A 89 2.250 19.298 -4.221 1.00 0.00 C ATOM 681 CG1 ILE A 89 3.085 18.135 -4.759 1.00 0.00 C ATOM 682 CG2 ILE A 89 1.337 19.846 -5.309 1.00 0.00 C ATOM 683 CD1 ILE A 89 3.792 17.347 -3.680 1.00 0.00 C ATOM 0 H ILE A 89 3.657 19.171 -2.062 1.00 0.00 H new ATOM 0 HA ILE A 89 3.785 20.774 -4.499 1.00 0.00 H new ATOM 0 HB ILE A 89 1.629 18.931 -3.404 1.00 0.00 H new ATOM 0 HG12 ILE A 89 2.437 17.463 -5.322 1.00 0.00 H new ATOM 0 HG13 ILE A 89 3.826 18.523 -5.458 1.00 0.00 H new ATOM 0 HG21 ILE A 89 0.696 19.047 -5.682 1.00 0.00 H new ATOM 0 HG22 ILE A 89 0.720 20.645 -4.898 1.00 0.00 H new ATOM 0 HG23 ILE A 89 1.941 20.239 -6.127 1.00 0.00 H new ATOM 0 HD11 ILE A 89 4.364 16.539 -4.135 1.00 0.00 H new ATOM 0 HD12 ILE A 89 4.466 18.005 -3.132 1.00 0.00 H new ATOM 0 HD13 ILE A 89 3.056 16.928 -2.994 1.00 0.00 H new ATOM 695 N GLU A 90 1.613 21.238 -2.033 1.00 0.00 N ATOM 696 CA GLU A 90 0.794 22.234 -1.366 1.00 0.00 C ATOM 697 C GLU A 90 1.695 23.350 -0.846 1.00 0.00 C ATOM 698 O GLU A 90 1.245 24.468 -0.607 1.00 0.00 O ATOM 699 CB GLU A 90 0.014 21.599 -0.214 1.00 0.00 C ATOM 700 CG GLU A 90 -0.902 22.572 0.511 1.00 0.00 C ATOM 701 CD GLU A 90 -1.071 22.230 1.979 1.00 0.00 C ATOM 702 OE1 GLU A 90 -1.995 21.457 2.307 1.00 0.00 O ATOM 703 OE2 GLU A 90 -0.276 22.735 2.801 1.00 0.00 O ATOM 0 H GLU A 90 1.591 20.314 -1.602 1.00 0.00 H new ATOM 0 HA GLU A 90 0.075 22.646 -2.074 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -0.582 20.773 -0.602 1.00 0.00 H new ATOM 0 HB3 GLU A 90 0.719 21.176 0.501 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -0.499 23.581 0.421 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -1.879 22.575 0.027 1.00 0.00 H new ATOM 710 N ALA A 91 2.980 23.028 -0.693 1.00 0.00 N ATOM 711 CA ALA A 91 3.969 23.983 -0.224 1.00 0.00 C ATOM 712 C ALA A 91 4.531 24.766 -1.401 1.00 0.00 C ATOM 713 O ALA A 91 4.561 25.997 -1.386 1.00 0.00 O ATOM 714 CB ALA A 91 5.082 23.266 0.520 1.00 0.00 C ATOM 0 H ALA A 91 3.357 22.101 -0.891 1.00 0.00 H new ATOM 0 HA ALA A 91 3.491 24.680 0.464 1.00 0.00 H new ATOM 0 HB1 ALA A 91 5.816 23.994 0.866 1.00 0.00 H new ATOM 0 HB2 ALA A 91 4.665 22.736 1.376 1.00 0.00 H new ATOM 0 HB3 ALA A 91 5.565 22.553 -0.148 1.00 0.00 H new ATOM 720 N LEU A 92 4.951 24.044 -2.439 1.00 0.00 N ATOM 721 CA LEU A 92 5.481 24.682 -3.639 1.00 0.00 C ATOM 722 C LEU A 92 4.472 25.697 -4.165 1.00 0.00 C ATOM 723 O LEU A 92 4.836 26.681 -4.806 1.00 0.00 O ATOM 724 CB LEU A 92 5.788 23.641 -4.719 1.00 0.00 C ATOM 725 CG LEU A 92 7.223 23.113 -4.722 1.00 0.00 C ATOM 726 CD1 LEU A 92 7.285 21.733 -5.363 1.00 0.00 C ATOM 727 CD2 LEU A 92 8.145 24.082 -5.448 1.00 0.00 C ATOM 0 H LEU A 92 4.934 23.025 -2.472 1.00 0.00 H new ATOM 0 HA LEU A 92 6.410 25.191 -3.382 1.00 0.00 H new ATOM 0 HB2 LEU A 92 5.108 22.799 -4.594 1.00 0.00 H new ATOM 0 HB3 LEU A 92 5.576 24.079 -5.694 1.00 0.00 H new ATOM 0 HG LEU A 92 7.560 23.026 -3.689 1.00 0.00 H new ATOM 0 HD11 LEU A 92 8.314 21.374 -5.356 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.656 21.042 -4.801 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.929 21.793 -6.391 1.00 0.00 H new ATOM 0 HD21 LEU A 92 9.162 23.691 -5.441 1.00 0.00 H new ATOM 0 HD22 LEU A 92 7.809 24.201 -6.478 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.125 25.049 -4.946 1.00 0.00 H new ATOM 739 N LEU A 93 3.201 25.452 -3.864 1.00 0.00 N ATOM 740 CA LEU A 93 2.130 26.340 -4.278 1.00 0.00 C ATOM 741 C LEU A 93 1.859 27.371 -3.191 1.00 0.00 C ATOM 742 O LEU A 93 1.576 28.531 -3.481 1.00 0.00 O ATOM 743 CB LEU A 93 0.858 25.540 -4.572 1.00 0.00 C ATOM 744 CG LEU A 93 0.685 25.113 -6.031 1.00 0.00 C ATOM 745 CD1 LEU A 93 0.686 26.326 -6.947 1.00 0.00 C ATOM 746 CD2 LEU A 93 1.780 24.137 -6.434 1.00 0.00 C ATOM 0 H LEU A 93 2.890 24.640 -3.331 1.00 0.00 H new ATOM 0 HA LEU A 93 2.436 26.856 -5.188 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.855 24.648 -3.945 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -0.005 26.138 -4.279 1.00 0.00 H new ATOM 0 HG LEU A 93 -0.277 24.610 -6.130 1.00 0.00 H new ATOM 0 HD11 LEU A 93 0.562 26.002 -7.980 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -0.135 26.989 -6.674 1.00 0.00 H new ATOM 0 HD13 LEU A 93 1.632 26.858 -6.845 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.641 23.844 -7.475 1.00 0.00 H new ATOM 0 HD22 LEU A 93 2.753 24.614 -6.318 1.00 0.00 H new ATOM 0 HD23 LEU A 93 1.731 23.253 -5.798 1.00 0.00 H new ATOM 758 N THR A 94 1.961 26.946 -1.935 1.00 0.00 N ATOM 759 CA THR A 94 1.731 27.855 -0.816 1.00 0.00 C ATOM 760 C THR A 94 2.779 28.970 -0.792 1.00 0.00 C ATOM 761 O THR A 94 2.609 29.973 -0.100 1.00 0.00 O ATOM 762 CB THR A 94 1.742 27.084 0.511 1.00 0.00 C ATOM 763 OG1 THR A 94 0.527 26.377 0.686 1.00 0.00 O ATOM 764 CG2 THR A 94 1.928 27.967 1.730 1.00 0.00 C ATOM 0 H THR A 94 2.198 25.991 -1.668 1.00 0.00 H new ATOM 0 HA THR A 94 0.750 28.313 -0.947 1.00 0.00 H new ATOM 0 HB THR A 94 2.596 26.410 0.439 1.00 0.00 H new ATOM 0 HG1 THR A 94 0.561 25.538 0.181 1.00 0.00 H new ATOM 0 HG21 THR A 94 1.925 27.351 2.629 1.00 0.00 H new ATOM 0 HG22 THR A 94 2.878 28.495 1.655 1.00 0.00 H new ATOM 0 HG23 THR A 94 1.114 28.690 1.783 1.00 0.00 H new ATOM 772 N GLY A 95 3.865 28.789 -1.544 1.00 0.00 N ATOM 773 CA GLY A 95 4.914 29.790 -1.575 1.00 0.00 C ATOM 774 C GLY A 95 5.200 30.314 -2.971 1.00 0.00 C ATOM 775 O GLY A 95 5.615 31.462 -3.132 1.00 0.00 O ATOM 0 H GLY A 95 4.034 27.970 -2.128 1.00 0.00 H new ATOM 0 HA2 GLY A 95 4.631 30.623 -0.932 1.00 0.00 H new ATOM 0 HA3 GLY A 95 5.827 29.363 -1.160 1.00 0.00 H new ATOM 779 N LEU A 96 4.989 29.478 -3.984 1.00 0.00 N ATOM 780 CA LEU A 96 5.244 29.883 -5.365 1.00 0.00 C ATOM 781 C LEU A 96 3.961 30.277 -6.090 1.00 0.00 C ATOM 782 O LEU A 96 3.985 30.591 -7.281 1.00 0.00 O ATOM 783 CB LEU A 96 5.944 28.760 -6.125 1.00 0.00 C ATOM 784 CG LEU A 96 7.013 29.215 -7.121 1.00 0.00 C ATOM 785 CD1 LEU A 96 7.915 28.052 -7.501 1.00 0.00 C ATOM 786 CD2 LEU A 96 6.366 29.817 -8.360 1.00 0.00 C ATOM 0 H LEU A 96 4.645 28.524 -3.877 1.00 0.00 H new ATOM 0 HA LEU A 96 5.891 30.760 -5.332 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.406 28.087 -5.403 1.00 0.00 H new ATOM 0 HB3 LEU A 96 5.192 28.183 -6.662 1.00 0.00 H new ATOM 0 HG LEU A 96 7.623 29.983 -6.645 1.00 0.00 H new ATOM 0 HD11 LEU A 96 8.669 28.393 -8.210 1.00 0.00 H new ATOM 0 HD12 LEU A 96 8.405 27.665 -6.608 1.00 0.00 H new ATOM 0 HD13 LEU A 96 7.318 27.263 -7.958 1.00 0.00 H new ATOM 0 HD21 LEU A 96 7.141 30.135 -9.057 1.00 0.00 H new ATOM 0 HD22 LEU A 96 5.732 29.071 -8.838 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.761 30.677 -8.073 1.00 0.00 H new ATOM 798 N PHE A 97 2.848 30.254 -5.369 1.00 0.00 N ATOM 799 CA PHE A 97 1.542 30.606 -5.936 1.00 0.00 C ATOM 800 C PHE A 97 1.646 31.783 -6.905 1.00 0.00 C ATOM 801 O PHE A 97 2.344 32.761 -6.638 1.00 0.00 O ATOM 802 CB PHE A 97 0.551 30.950 -4.821 1.00 0.00 C ATOM 803 CG PHE A 97 1.074 31.962 -3.841 1.00 0.00 C ATOM 804 CD1 PHE A 97 1.879 31.571 -2.784 1.00 0.00 C ATOM 805 CD2 PHE A 97 0.757 33.304 -3.978 1.00 0.00 C ATOM 806 CE1 PHE A 97 2.360 32.501 -1.880 1.00 0.00 C ATOM 807 CE2 PHE A 97 1.236 34.238 -3.078 1.00 0.00 C ATOM 808 CZ PHE A 97 2.038 33.835 -2.029 1.00 0.00 C ATOM 0 H PHE A 97 2.818 29.994 -4.383 1.00 0.00 H new ATOM 0 HA PHE A 97 1.184 29.738 -6.489 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -0.368 31.330 -5.268 1.00 0.00 H new ATOM 0 HB3 PHE A 97 0.290 30.038 -4.284 1.00 0.00 H new ATOM 0 HD1 PHE A 97 2.134 30.528 -2.664 1.00 0.00 H new ATOM 0 HD2 PHE A 97 0.129 33.624 -4.796 1.00 0.00 H new ATOM 0 HE1 PHE A 97 2.986 32.184 -1.059 1.00 0.00 H new ATOM 0 HE2 PHE A 97 0.983 35.281 -3.195 1.00 0.00 H new ATOM 0 HZ PHE A 97 2.413 34.563 -1.325 1.00 0.00 H new ATOM 818 N VAL A 98 0.944 31.678 -8.029 1.00 0.00 N ATOM 819 CA VAL A 98 0.954 32.730 -9.037 1.00 0.00 C ATOM 820 C VAL A 98 -0.428 32.904 -9.659 1.00 0.00 C ATOM 821 O VAL A 98 -1.135 31.927 -9.905 1.00 0.00 O ATOM 822 CB VAL A 98 1.972 32.429 -10.154 1.00 0.00 C ATOM 823 CG1 VAL A 98 2.108 33.621 -11.088 1.00 0.00 C ATOM 824 CG2 VAL A 98 3.320 32.052 -9.558 1.00 0.00 C ATOM 0 H VAL A 98 0.361 30.874 -8.264 1.00 0.00 H new ATOM 0 HA VAL A 98 1.243 33.651 -8.531 1.00 0.00 H new ATOM 0 HB VAL A 98 1.607 31.582 -10.736 1.00 0.00 H new ATOM 0 HG11 VAL A 98 2.831 33.390 -11.870 1.00 0.00 H new ATOM 0 HG12 VAL A 98 1.141 33.840 -11.541 1.00 0.00 H new ATOM 0 HG13 VAL A 98 2.449 34.489 -10.523 1.00 0.00 H new ATOM 0 HG21 VAL A 98 4.027 31.843 -10.361 1.00 0.00 H new ATOM 0 HG22 VAL A 98 3.693 32.877 -8.952 1.00 0.00 H new ATOM 0 HG23 VAL A 98 3.207 31.166 -8.934 1.00 0.00 H new ATOM 993 N ALA B 52 -6.838 -36.642 -3.642 1.00 0.00 N ATOM 994 CA ALA B 52 -6.838 -35.191 -3.780 1.00 0.00 C ATOM 995 C ALA B 52 -5.429 -34.660 -4.023 1.00 0.00 C ATOM 996 O ALA B 52 -4.441 -35.312 -3.682 1.00 0.00 O ATOM 997 CB ALA B 52 -7.440 -34.543 -2.542 1.00 0.00 C ATOM 0 HA ALA B 52 -7.449 -34.935 -4.646 1.00 0.00 H new ATOM 0 HB1 ALA B 52 -7.434 -33.459 -2.659 1.00 0.00 H new ATOM 0 HB2 ALA B 52 -8.466 -34.888 -2.413 1.00 0.00 H new ATOM 0 HB3 ALA B 52 -6.852 -34.817 -1.666 1.00 0.00 H new ATOM 1003 N HIS B 53 -5.344 -33.472 -4.614 1.00 0.00 N ATOM 1004 CA HIS B 53 -4.057 -32.848 -4.901 1.00 0.00 C ATOM 1005 C HIS B 53 -3.904 -31.544 -4.124 1.00 0.00 C ATOM 1006 O HIS B 53 -3.060 -31.435 -3.234 1.00 0.00 O ATOM 1007 CB HIS B 53 -3.922 -32.579 -6.402 1.00 0.00 C ATOM 1008 CG HIS B 53 -3.237 -33.681 -7.149 1.00 0.00 C ATOM 1009 ND1 HIS B 53 -1.917 -33.614 -7.547 1.00 0.00 N ATOM 1010 CD2 HIS B 53 -3.694 -34.883 -7.574 1.00 0.00 C ATOM 1011 CE1 HIS B 53 -1.593 -34.726 -8.183 1.00 0.00 C ATOM 1012 NE2 HIS B 53 -2.654 -35.513 -8.212 1.00 0.00 N ATOM 0 H HIS B 53 -6.152 -32.922 -4.904 1.00 0.00 H new ATOM 0 HA HIS B 53 -3.269 -33.533 -4.589 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -4.914 -32.426 -6.826 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -3.367 -31.652 -6.548 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -4.691 -35.274 -7.437 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -0.626 -34.953 -8.607 1.00 0.00 H new ATOM 0 HE2 HIS B 53 -2.694 -36.438 -8.639 1.00 0.00 H new ATOM 1021 N LEU B 54 -4.731 -30.560 -4.463 1.00 0.00 N ATOM 1022 CA LEU B 54 -4.697 -29.261 -3.798 1.00 0.00 C ATOM 1023 C LEU B 54 -4.843 -29.424 -2.283 1.00 0.00 C ATOM 1024 O LEU B 54 -3.853 -29.430 -1.548 1.00 0.00 O ATOM 1025 CB LEU B 54 -5.810 -28.366 -4.352 1.00 0.00 C ATOM 1026 CG LEU B 54 -5.352 -27.315 -5.364 1.00 0.00 C ATOM 1027 CD1 LEU B 54 -4.687 -27.981 -6.558 1.00 0.00 C ATOM 1028 CD2 LEU B 54 -6.528 -26.458 -5.814 1.00 0.00 C ATOM 0 H LEU B 54 -5.435 -30.638 -5.197 1.00 0.00 H new ATOM 0 HA LEU B 54 -3.733 -28.791 -3.995 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -6.563 -28.998 -4.823 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -6.296 -27.858 -3.519 1.00 0.00 H new ATOM 0 HG LEU B 54 -4.621 -26.666 -4.881 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -4.367 -27.219 -7.268 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -3.820 -28.550 -6.221 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -5.396 -28.653 -7.042 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -6.183 -25.716 -6.534 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -7.283 -27.092 -6.280 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -6.961 -25.952 -4.951 1.00 0.00 H new ATOM 1040 N THR B 55 -6.084 -29.578 -1.832 1.00 0.00 N ATOM 1041 CA THR B 55 -6.390 -29.777 -0.418 1.00 0.00 C ATOM 1042 C THR B 55 -5.584 -28.859 0.519 1.00 0.00 C ATOM 1043 O THR B 55 -5.210 -27.734 0.158 1.00 0.00 O ATOM 1044 CB THR B 55 -6.157 -31.243 -0.055 1.00 0.00 C ATOM 1045 OG1 THR B 55 -6.668 -31.532 1.232 1.00 0.00 O ATOM 1046 CG2 THR B 55 -4.700 -31.626 -0.068 1.00 0.00 C ATOM 0 H THR B 55 -6.906 -29.568 -2.436 1.00 0.00 H new ATOM 0 HA THR B 55 -7.437 -29.509 -0.274 1.00 0.00 H new ATOM 0 HB THR B 55 -6.679 -31.819 -0.819 1.00 0.00 H new ATOM 0 HG1 THR B 55 -6.509 -32.476 1.443 1.00 0.00 H new ATOM 0 HG21 THR B 55 -4.598 -32.678 0.198 1.00 0.00 H new ATOM 0 HG22 THR B 55 -4.290 -31.462 -1.064 1.00 0.00 H new ATOM 0 HG23 THR B 55 -4.157 -31.015 0.653 1.00 0.00 H new ATOM 1054 N GLU B 56 -5.351 -29.356 1.740 1.00 0.00 N ATOM 1055 CA GLU B 56 -4.626 -28.628 2.776 1.00 0.00 C ATOM 1056 C GLU B 56 -3.458 -27.822 2.218 1.00 0.00 C ATOM 1057 O GLU B 56 -3.234 -26.697 2.639 1.00 0.00 O ATOM 1058 CB GLU B 56 -4.117 -29.603 3.841 1.00 0.00 C ATOM 1059 CG GLU B 56 -5.227 -30.282 4.626 1.00 0.00 C ATOM 1060 CD GLU B 56 -4.842 -31.670 5.100 1.00 0.00 C ATOM 1061 OE1 GLU B 56 -4.165 -32.391 4.337 1.00 0.00 O ATOM 1062 OE2 GLU B 56 -5.218 -32.036 6.233 1.00 0.00 O ATOM 0 H GLU B 56 -5.664 -30.281 2.034 1.00 0.00 H new ATOM 0 HA GLU B 56 -5.327 -27.921 3.219 1.00 0.00 H new ATOM 0 HB2 GLU B 56 -3.505 -30.366 3.360 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -3.470 -29.065 4.534 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -5.486 -29.667 5.488 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -6.119 -30.349 4.003 1.00 0.00 H new ATOM 1069 N VAL B 57 -2.712 -28.393 1.280 1.00 0.00 N ATOM 1070 CA VAL B 57 -1.573 -27.687 0.698 1.00 0.00 C ATOM 1071 C VAL B 57 -2.036 -26.449 -0.068 1.00 0.00 C ATOM 1072 O VAL B 57 -1.442 -25.355 0.046 1.00 0.00 O ATOM 1073 CB VAL B 57 -0.761 -28.596 -0.243 1.00 0.00 C ATOM 1074 CG1 VAL B 57 0.446 -27.850 -0.788 1.00 0.00 C ATOM 1075 CG2 VAL B 57 -0.330 -29.864 0.481 1.00 0.00 C ATOM 0 H VAL B 57 -2.870 -29.330 0.909 1.00 0.00 H new ATOM 0 HA VAL B 57 -0.931 -27.383 1.524 1.00 0.00 H new ATOM 0 HB VAL B 57 -1.395 -28.882 -1.082 1.00 0.00 H new ATOM 0 HG11 VAL B 57 1.010 -28.506 -1.451 1.00 0.00 H new ATOM 0 HG12 VAL B 57 0.112 -26.973 -1.343 1.00 0.00 H new ATOM 0 HG13 VAL B 57 1.083 -27.535 0.039 1.00 0.00 H new ATOM 0 HG21 VAL B 57 0.243 -30.495 -0.199 1.00 0.00 H new ATOM 0 HG22 VAL B 57 0.288 -29.601 1.339 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -1.212 -30.406 0.822 1.00 0.00 H new ATOM 1085 N GLU B 58 -3.118 -26.613 -0.831 1.00 0.00 N ATOM 1086 CA GLU B 58 -3.667 -25.506 -1.587 1.00 0.00 C ATOM 1087 C GLU B 58 -4.040 -24.391 -0.629 1.00 0.00 C ATOM 1088 O GLU B 58 -3.572 -23.260 -0.757 1.00 0.00 O ATOM 1089 CB GLU B 58 -4.871 -25.956 -2.433 1.00 0.00 C ATOM 1090 CG GLU B 58 -6.233 -25.663 -1.817 1.00 0.00 C ATOM 1091 CD GLU B 58 -7.375 -25.850 -2.797 1.00 0.00 C ATOM 1092 OE1 GLU B 58 -7.547 -24.983 -3.679 1.00 0.00 O ATOM 1093 OE2 GLU B 58 -8.098 -26.862 -2.682 1.00 0.00 O ATOM 0 H GLU B 58 -3.621 -27.494 -0.936 1.00 0.00 H new ATOM 0 HA GLU B 58 -2.917 -25.135 -2.285 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -4.816 -25.468 -3.406 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -4.792 -27.029 -2.610 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -6.386 -26.317 -0.959 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -6.245 -24.639 -1.444 1.00 0.00 H new ATOM 1100 N SER B 59 -4.854 -24.729 0.358 1.00 0.00 N ATOM 1101 CA SER B 59 -5.251 -23.755 1.362 1.00 0.00 C ATOM 1102 C SER B 59 -4.019 -23.257 2.112 1.00 0.00 C ATOM 1103 O SER B 59 -4.060 -22.231 2.782 1.00 0.00 O ATOM 1104 CB SER B 59 -6.253 -24.370 2.341 1.00 0.00 C ATOM 1105 OG SER B 59 -5.668 -25.439 3.065 1.00 0.00 O ATOM 0 H SER B 59 -5.249 -25.661 0.485 1.00 0.00 H new ATOM 0 HA SER B 59 -5.732 -22.913 0.864 1.00 0.00 H new ATOM 0 HB2 SER B 59 -6.604 -23.606 3.035 1.00 0.00 H new ATOM 0 HB3 SER B 59 -7.125 -24.730 1.795 1.00 0.00 H new ATOM 0 HG SER B 59 -4.800 -25.665 2.670 1.00 0.00 H new ATOM 1111 N ARG B 60 -2.931 -24.017 2.003 1.00 0.00 N ATOM 1112 CA ARG B 60 -1.684 -23.695 2.668 1.00 0.00 C ATOM 1113 C ARG B 60 -1.039 -22.466 2.085 1.00 0.00 C ATOM 1114 O ARG B 60 -1.011 -21.412 2.731 1.00 0.00 O ATOM 1115 CB ARG B 60 -0.707 -24.866 2.564 1.00 0.00 C ATOM 1116 CG ARG B 60 0.292 -24.935 3.707 1.00 0.00 C ATOM 1117 CD ARG B 60 0.015 -26.110 4.630 1.00 0.00 C ATOM 1118 NE ARG B 60 1.228 -26.866 4.936 1.00 0.00 N ATOM 1119 CZ ARG B 60 2.260 -26.369 5.615 1.00 0.00 C ATOM 1120 NH1 ARG B 60 2.230 -25.117 6.058 1.00 0.00 N ATOM 1121 NH2 ARG B 60 3.323 -27.125 5.849 1.00 0.00 N ATOM 0 H ARG B 60 -2.896 -24.873 1.449 1.00 0.00 H new ATOM 0 HA ARG B 60 -1.921 -23.498 3.714 1.00 0.00 H new ATOM 0 HB2 ARG B 60 -1.273 -25.797 2.532 1.00 0.00 H new ATOM 0 HB3 ARG B 60 -0.163 -24.791 1.622 1.00 0.00 H new ATOM 0 HG2 ARG B 60 1.301 -25.020 3.303 1.00 0.00 H new ATOM 0 HG3 ARG B 60 0.255 -24.008 4.278 1.00 0.00 H new ATOM 0 HD2 ARG B 60 -0.428 -25.746 5.557 1.00 0.00 H new ATOM 0 HD3 ARG B 60 -0.716 -26.771 4.165 1.00 0.00 H new ATOM 0 HE ARG B 60 1.287 -27.831 4.610 1.00 0.00 H new ATOM 0 HH11 ARG B 60 1.414 -24.532 5.879 1.00 0.00 H new ATOM 0 HH12 ARG B 60 3.023 -24.741 6.578 1.00 0.00 H new ATOM 0 HH21 ARG B 60 3.350 -28.086 5.509 1.00 0.00 H new ATOM 0 HH22 ARG B 60 4.114 -26.746 6.369 1.00 0.00 H new ATOM 1135 N LEU B 61 -0.501 -22.571 0.873 1.00 0.00 N ATOM 1136 CA LEU B 61 0.138 -21.392 0.310 1.00 0.00 C ATOM 1137 C LEU B 61 -0.910 -20.327 0.016 1.00 0.00 C ATOM 1138 O LEU B 61 -0.607 -19.126 -0.047 1.00 0.00 O ATOM 1139 CB LEU B 61 1.005 -21.729 -0.910 1.00 0.00 C ATOM 1140 CG LEU B 61 2.536 -21.656 -0.673 1.00 0.00 C ATOM 1141 CD1 LEU B 61 2.877 -21.401 0.789 1.00 0.00 C ATOM 1142 CD2 LEU B 61 3.213 -22.934 -1.128 1.00 0.00 C ATOM 0 H LEU B 61 -0.493 -23.409 0.292 1.00 0.00 H new ATOM 0 HA LEU B 61 0.829 -20.985 1.049 1.00 0.00 H new ATOM 0 HB2 LEU B 61 0.753 -22.734 -1.248 1.00 0.00 H new ATOM 0 HB3 LEU B 61 0.746 -21.047 -1.719 1.00 0.00 H new ATOM 0 HG LEU B 61 2.904 -20.816 -1.262 1.00 0.00 H new ATOM 0 HD11 LEU B 61 3.960 -21.358 0.908 1.00 0.00 H new ATOM 0 HD12 LEU B 61 2.439 -20.454 1.105 1.00 0.00 H new ATOM 0 HD13 LEU B 61 2.477 -22.208 1.402 1.00 0.00 H new ATOM 0 HD21 LEU B 61 4.286 -22.860 -0.952 1.00 0.00 H new ATOM 0 HD22 LEU B 61 2.811 -23.778 -0.568 1.00 0.00 H new ATOM 0 HD23 LEU B 61 3.029 -23.084 -2.192 1.00 0.00 H new ATOM 1154 N GLU B 62 -2.162 -20.775 -0.085 1.00 0.00 N ATOM 1155 CA GLU B 62 -3.276 -19.872 -0.292 1.00 0.00 C ATOM 1156 C GLU B 62 -3.447 -19.010 0.947 1.00 0.00 C ATOM 1157 O GLU B 62 -3.806 -17.837 0.855 1.00 0.00 O ATOM 1158 CB GLU B 62 -4.560 -20.655 -0.568 1.00 0.00 C ATOM 1159 CG GLU B 62 -5.748 -19.772 -0.911 1.00 0.00 C ATOM 1160 CD GLU B 62 -7.072 -20.402 -0.527 1.00 0.00 C ATOM 1161 OE1 GLU B 62 -7.242 -20.751 0.661 1.00 0.00 O ATOM 1162 OE2 GLU B 62 -7.940 -20.548 -1.413 1.00 0.00 O ATOM 0 H GLU B 62 -2.422 -21.760 -0.026 1.00 0.00 H new ATOM 0 HA GLU B 62 -3.072 -19.241 -1.157 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -4.383 -21.348 -1.390 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -4.805 -21.256 0.308 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -5.644 -18.815 -0.401 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -5.745 -19.565 -1.981 1.00 0.00 H new ATOM 1169 N ARG B 63 -3.165 -19.600 2.112 1.00 0.00 N ATOM 1170 CA ARG B 63 -3.266 -18.877 3.371 1.00 0.00 C ATOM 1171 C ARG B 63 -1.970 -18.121 3.649 1.00 0.00 C ATOM 1172 O ARG B 63 -1.947 -17.188 4.453 1.00 0.00 O ATOM 1173 CB ARG B 63 -3.571 -19.835 4.524 1.00 0.00 C ATOM 1174 CG ARG B 63 -5.035 -19.845 4.933 1.00 0.00 C ATOM 1175 CD ARG B 63 -5.482 -21.228 5.383 1.00 0.00 C ATOM 1176 NE ARG B 63 -5.198 -21.464 6.795 1.00 0.00 N ATOM 1177 CZ ARG B 63 -5.955 -21.007 7.792 1.00 0.00 C ATOM 1178 NH1 ARG B 63 -7.031 -20.275 7.535 1.00 0.00 N ATOM 1179 NH2 ARG B 63 -5.633 -21.282 9.048 1.00 0.00 N ATOM 0 H ARG B 63 -2.867 -20.571 2.204 1.00 0.00 H new ATOM 0 HA ARG B 63 -4.085 -18.162 3.290 1.00 0.00 H new ATOM 0 HB2 ARG B 63 -3.276 -20.844 4.235 1.00 0.00 H new ATOM 0 HB3 ARG B 63 -2.963 -19.559 5.386 1.00 0.00 H new ATOM 0 HG2 ARG B 63 -5.192 -19.130 5.741 1.00 0.00 H new ATOM 0 HG3 ARG B 63 -5.650 -19.518 4.094 1.00 0.00 H new ATOM 0 HD2 ARG B 63 -6.552 -21.338 5.205 1.00 0.00 H new ATOM 0 HD3 ARG B 63 -4.979 -21.985 4.781 1.00 0.00 H new ATOM 0 HE ARG B 63 -4.371 -22.011 7.033 1.00 0.00 H new ATOM 0 HH11 ARG B 63 -7.283 -20.059 6.570 1.00 0.00 H new ATOM 0 HH12 ARG B 63 -7.607 -19.928 8.302 1.00 0.00 H new ATOM 0 HH21 ARG B 63 -4.806 -21.843 9.251 1.00 0.00 H new ATOM 0 HH22 ARG B 63 -6.212 -20.932 9.811 1.00 0.00 H new ATOM 1193 N LEU B 64 -0.889 -18.523 2.977 1.00 0.00 N ATOM 1194 CA LEU B 64 0.401 -17.868 3.161 1.00 0.00 C ATOM 1195 C LEU B 64 0.422 -16.531 2.442 1.00 0.00 C ATOM 1196 O LEU B 64 1.041 -15.571 2.901 1.00 0.00 O ATOM 1197 CB LEU B 64 1.543 -18.774 2.673 1.00 0.00 C ATOM 1198 CG LEU B 64 2.614 -18.103 1.799 1.00 0.00 C ATOM 1199 CD1 LEU B 64 3.963 -18.789 1.975 1.00 0.00 C ATOM 1200 CD2 LEU B 64 2.189 -18.114 0.336 1.00 0.00 C ATOM 0 H LEU B 64 -0.884 -19.292 2.307 1.00 0.00 H new ATOM 0 HA LEU B 64 0.549 -17.685 4.225 1.00 0.00 H new ATOM 0 HB2 LEU B 64 2.034 -19.207 3.545 1.00 0.00 H new ATOM 0 HB3 LEU B 64 1.109 -19.600 2.109 1.00 0.00 H new ATOM 0 HG LEU B 64 2.719 -17.066 2.119 1.00 0.00 H new ATOM 0 HD11 LEU B 64 4.706 -18.297 1.347 1.00 0.00 H new ATOM 0 HD12 LEU B 64 4.270 -18.725 3.019 1.00 0.00 H new ATOM 0 HD13 LEU B 64 3.879 -19.836 1.685 1.00 0.00 H new ATOM 0 HD21 LEU B 64 2.958 -17.635 -0.270 1.00 0.00 H new ATOM 0 HD22 LEU B 64 2.054 -19.143 0.004 1.00 0.00 H new ATOM 0 HD23 LEU B 64 1.250 -17.571 0.226 1.00 0.00 H new ATOM 1212 N GLU B 65 -0.263 -16.482 1.318 1.00 0.00 N ATOM 1213 CA GLU B 65 -0.335 -15.263 0.524 1.00 0.00 C ATOM 1214 C GLU B 65 -1.608 -14.480 0.833 1.00 0.00 C ATOM 1215 O GLU B 65 -1.640 -13.256 0.717 1.00 0.00 O ATOM 1216 CB GLU B 65 -0.286 -15.596 -0.963 1.00 0.00 C ATOM 1217 CG GLU B 65 1.121 -15.610 -1.544 1.00 0.00 C ATOM 1218 CD GLU B 65 1.436 -16.892 -2.291 1.00 0.00 C ATOM 1219 OE1 GLU B 65 0.636 -17.846 -2.201 1.00 0.00 O ATOM 1220 OE2 GLU B 65 2.487 -16.944 -2.964 1.00 0.00 O ATOM 0 H GLU B 65 -0.780 -17.271 0.930 1.00 0.00 H new ATOM 0 HA GLU B 65 0.524 -14.644 0.784 1.00 0.00 H new ATOM 0 HB2 GLU B 65 -0.744 -16.572 -1.122 1.00 0.00 H new ATOM 0 HB3 GLU B 65 -0.887 -14.869 -1.509 1.00 0.00 H new ATOM 0 HG2 GLU B 65 1.238 -14.763 -2.220 1.00 0.00 H new ATOM 0 HG3 GLU B 65 1.843 -15.478 -0.738 1.00 0.00 H new ATOM 1227 N GLN B 66 -2.655 -15.193 1.230 1.00 0.00 N ATOM 1228 CA GLN B 66 -3.932 -14.571 1.557 1.00 0.00 C ATOM 1229 C GLN B 66 -4.572 -13.941 0.319 1.00 0.00 C ATOM 1230 O GLN B 66 -5.114 -12.837 0.381 1.00 0.00 O ATOM 1231 CB GLN B 66 -3.735 -13.520 2.650 1.00 0.00 C ATOM 1232 CG GLN B 66 -4.586 -13.763 3.886 1.00 0.00 C ATOM 1233 CD GLN B 66 -3.764 -13.845 5.157 1.00 0.00 C ATOM 1234 OE1 GLN B 66 -2.647 -13.331 5.223 1.00 0.00 O ATOM 1235 NE2 GLN B 66 -4.313 -14.495 6.177 1.00 0.00 N ATOM 0 H GLN B 66 -2.644 -16.208 1.334 1.00 0.00 H new ATOM 0 HA GLN B 66 -4.607 -15.345 1.924 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -2.684 -13.501 2.940 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -3.971 -12.536 2.244 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -5.317 -12.960 3.982 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -5.146 -14.690 3.760 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -5.241 -14.906 6.079 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -3.806 -14.583 7.058 1.00 0.00 H new ATOM 1244 N LEU B 67 -4.511 -14.657 -0.802 1.00 0.00 N ATOM 1245 CA LEU B 67 -5.089 -14.179 -2.056 1.00 0.00 C ATOM 1246 C LEU B 67 -4.383 -12.919 -2.547 1.00 0.00 C ATOM 1247 O LEU B 67 -4.382 -11.892 -1.869 1.00 0.00 O ATOM 1248 CB LEU B 67 -6.584 -13.900 -1.880 1.00 0.00 C ATOM 1249 CG LEU B 67 -7.338 -13.572 -3.172 1.00 0.00 C ATOM 1250 CD1 LEU B 67 -8.690 -14.269 -3.196 1.00 0.00 C ATOM 1251 CD2 LEU B 67 -7.510 -12.068 -3.321 1.00 0.00 C ATOM 0 H LEU B 67 -4.066 -15.572 -0.867 1.00 0.00 H new ATOM 0 HA LEU B 67 -4.953 -14.961 -2.803 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -7.049 -14.771 -1.417 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -6.704 -13.068 -1.186 1.00 0.00 H new ATOM 0 HG LEU B 67 -6.750 -13.937 -4.014 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -9.210 -14.023 -4.122 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -8.544 -15.348 -3.137 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -9.286 -13.936 -2.346 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -8.048 -11.853 -4.244 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -8.075 -11.681 -2.473 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -6.530 -11.591 -3.352 1.00 0.00 H new ATOM 1263 N PHE B 68 -3.784 -13.006 -3.732 1.00 0.00 N ATOM 1264 CA PHE B 68 -3.076 -11.870 -4.312 1.00 0.00 C ATOM 1265 C PHE B 68 -3.099 -11.931 -5.836 1.00 0.00 C ATOM 1266 O PHE B 68 -2.669 -12.916 -6.434 1.00 0.00 O ATOM 1267 CB PHE B 68 -1.632 -11.844 -3.807 1.00 0.00 C ATOM 1268 CG PHE B 68 -0.784 -10.764 -4.419 1.00 0.00 C ATOM 1269 CD1 PHE B 68 -1.352 -9.581 -4.867 1.00 0.00 C ATOM 1270 CD2 PHE B 68 0.587 -10.933 -4.546 1.00 0.00 C ATOM 1271 CE1 PHE B 68 -0.569 -8.591 -5.429 1.00 0.00 C ATOM 1272 CE2 PHE B 68 1.373 -9.946 -5.106 1.00 0.00 C ATOM 1273 CZ PHE B 68 0.794 -8.773 -5.548 1.00 0.00 C ATOM 0 H PHE B 68 -3.775 -13.848 -4.307 1.00 0.00 H new ATOM 0 HA PHE B 68 -3.582 -10.955 -4.002 1.00 0.00 H new ATOM 0 HB2 PHE B 68 -1.640 -11.715 -2.725 1.00 0.00 H new ATOM 0 HB3 PHE B 68 -1.171 -12.811 -4.009 1.00 0.00 H new ATOM 0 HD1 PHE B 68 -2.418 -9.432 -4.776 1.00 0.00 H new ATOM 0 HD2 PHE B 68 1.045 -11.849 -4.202 1.00 0.00 H new ATOM 0 HE1 PHE B 68 -1.024 -7.675 -5.775 1.00 0.00 H new ATOM 0 HE2 PHE B 68 2.439 -10.091 -5.198 1.00 0.00 H new ATOM 0 HZ PHE B 68 1.407 -7.999 -5.986 1.00 0.00 H new ATOM 1283 N LEU B 69 -3.605 -10.871 -6.456 1.00 0.00 N ATOM 1284 CA LEU B 69 -3.684 -10.803 -7.910 1.00 0.00 C ATOM 1285 C LEU B 69 -4.182 -9.436 -8.369 1.00 0.00 C ATOM 1286 O LEU B 69 -3.697 -8.890 -9.361 1.00 0.00 O ATOM 1287 CB LEU B 69 -4.605 -11.905 -8.441 1.00 0.00 C ATOM 1288 CG LEU B 69 -3.977 -12.813 -9.501 1.00 0.00 C ATOM 1289 CD1 LEU B 69 -4.712 -14.144 -9.567 1.00 0.00 C ATOM 1290 CD2 LEU B 69 -3.987 -12.128 -10.859 1.00 0.00 C ATOM 0 H LEU B 69 -3.966 -10.048 -5.975 1.00 0.00 H new ATOM 0 HA LEU B 69 -2.682 -10.952 -8.311 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -4.932 -12.521 -7.603 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -5.497 -11.441 -8.863 1.00 0.00 H new ATOM 0 HG LEU B 69 -2.942 -13.007 -9.221 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -4.252 -14.777 -10.326 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -4.655 -14.640 -8.598 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -5.757 -13.970 -9.824 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -3.537 -12.786 -11.602 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -5.014 -11.905 -11.146 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -3.417 -11.201 -10.803 1.00 0.00 H new ATOM 1302 N LEU B 70 -5.153 -8.885 -7.645 1.00 0.00 N ATOM 1303 CA LEU B 70 -5.714 -7.583 -7.986 1.00 0.00 C ATOM 1304 C LEU B 70 -5.198 -6.497 -7.045 1.00 0.00 C ATOM 1305 O LEU B 70 -5.859 -5.480 -6.837 1.00 0.00 O ATOM 1306 CB LEU B 70 -7.242 -7.635 -7.938 1.00 0.00 C ATOM 1307 CG LEU B 70 -7.918 -7.970 -9.268 1.00 0.00 C ATOM 1308 CD1 LEU B 70 -9.394 -8.267 -9.056 1.00 0.00 C ATOM 1309 CD2 LEU B 70 -7.738 -6.829 -10.258 1.00 0.00 C ATOM 0 H LEU B 70 -5.566 -9.320 -6.820 1.00 0.00 H new ATOM 0 HA LEU B 70 -5.397 -7.335 -8.999 1.00 0.00 H new ATOM 0 HB2 LEU B 70 -7.542 -8.377 -7.198 1.00 0.00 H new ATOM 0 HB3 LEU B 70 -7.613 -6.670 -7.592 1.00 0.00 H new ATOM 0 HG LEU B 70 -7.445 -8.861 -9.681 1.00 0.00 H new ATOM 0 HD11 LEU B 70 -9.859 -8.503 -10.013 1.00 0.00 H new ATOM 0 HD12 LEU B 70 -9.501 -9.116 -8.381 1.00 0.00 H new ATOM 0 HD13 LEU B 70 -9.882 -7.395 -8.621 1.00 0.00 H new ATOM 0 HD21 LEU B 70 -8.225 -7.084 -11.199 1.00 0.00 H new ATOM 0 HD22 LEU B 70 -8.185 -5.921 -9.852 1.00 0.00 H new ATOM 0 HD23 LEU B 70 -6.675 -6.663 -10.433 1.00 0.00 H new ATOM 1321 N ILE B 71 -4.014 -6.718 -6.482 1.00 0.00 N ATOM 1322 CA ILE B 71 -3.412 -5.754 -5.568 1.00 0.00 C ATOM 1323 C ILE B 71 -2.140 -5.151 -6.159 1.00 0.00 C ATOM 1324 O ILE B 71 -1.738 -4.047 -5.793 1.00 0.00 O ATOM 1325 CB ILE B 71 -3.077 -6.399 -4.209 1.00 0.00 C ATOM 1326 CG1 ILE B 71 -4.288 -7.163 -3.668 1.00 0.00 C ATOM 1327 CG2 ILE B 71 -2.625 -5.340 -3.215 1.00 0.00 C ATOM 1328 CD1 ILE B 71 -3.935 -8.178 -2.603 1.00 0.00 C ATOM 0 H ILE B 71 -3.453 -7.555 -6.642 1.00 0.00 H new ATOM 0 HA ILE B 71 -4.148 -4.964 -5.416 1.00 0.00 H new ATOM 0 HB ILE B 71 -2.260 -7.106 -4.353 1.00 0.00 H new ATOM 0 HG12 ILE B 71 -5.003 -6.450 -3.257 1.00 0.00 H new ATOM 0 HG13 ILE B 71 -4.785 -7.672 -4.494 1.00 0.00 H new ATOM 0 HG21 ILE B 71 -2.392 -5.812 -2.261 1.00 0.00 H new ATOM 0 HG22 ILE B 71 -1.736 -4.838 -3.597 1.00 0.00 H new ATOM 0 HG23 ILE B 71 -3.422 -4.610 -3.074 1.00 0.00 H new ATOM 0 HD11 ILE B 71 -4.841 -8.681 -2.266 1.00 0.00 H new ATOM 0 HD12 ILE B 71 -3.244 -8.913 -3.016 1.00 0.00 H new ATOM 0 HD13 ILE B 71 -3.466 -7.672 -1.759 1.00 0.00 H new ATOM 1340 N PHE B 72 -1.506 -5.885 -7.070 1.00 0.00 N ATOM 1341 CA PHE B 72 -0.278 -5.425 -7.708 1.00 0.00 C ATOM 1342 C PHE B 72 0.841 -5.271 -6.678 1.00 0.00 C ATOM 1343 O PHE B 72 0.692 -4.545 -5.694 1.00 0.00 O ATOM 1344 CB PHE B 72 -0.515 -4.097 -8.430 1.00 0.00 C ATOM 1345 CG PHE B 72 -0.916 -4.262 -9.869 1.00 0.00 C ATOM 1346 CD1 PHE B 72 -0.021 -4.767 -10.799 1.00 0.00 C ATOM 1347 CD2 PHE B 72 -2.191 -3.918 -10.291 1.00 0.00 C ATOM 1348 CE1 PHE B 72 -0.387 -4.922 -12.121 1.00 0.00 C ATOM 1349 CE2 PHE B 72 -2.563 -4.071 -11.612 1.00 0.00 C ATOM 1350 CZ PHE B 72 -1.660 -4.573 -12.530 1.00 0.00 C ATOM 0 H PHE B 72 -1.824 -6.802 -7.383 1.00 0.00 H new ATOM 0 HA PHE B 72 0.025 -6.173 -8.440 1.00 0.00 H new ATOM 0 HB2 PHE B 72 -1.292 -3.541 -7.906 1.00 0.00 H new ATOM 0 HB3 PHE B 72 0.394 -3.498 -8.381 1.00 0.00 H new ATOM 0 HD1 PHE B 72 0.975 -5.043 -10.486 1.00 0.00 H new ATOM 0 HD2 PHE B 72 -2.901 -3.526 -9.578 1.00 0.00 H new ATOM 0 HE1 PHE B 72 0.321 -5.316 -12.835 1.00 0.00 H new ATOM 0 HE2 PHE B 72 -3.559 -3.798 -11.928 1.00 0.00 H new ATOM 0 HZ PHE B 72 -1.948 -4.692 -13.564 1.00 0.00 H new ATOM 1360 N PRO B 73 1.980 -5.956 -6.882 1.00 0.00 N ATOM 1361 CA PRO B 73 3.116 -5.895 -5.963 1.00 0.00 C ATOM 1362 C PRO B 73 4.022 -4.699 -6.232 1.00 0.00 C ATOM 1363 O PRO B 73 5.001 -4.805 -6.970 1.00 0.00 O ATOM 1364 CB PRO B 73 3.850 -7.199 -6.254 1.00 0.00 C ATOM 1365 CG PRO B 73 3.599 -7.459 -7.701 1.00 0.00 C ATOM 1366 CD PRO B 73 2.252 -6.856 -8.023 1.00 0.00 C ATOM 0 HA PRO B 73 2.804 -5.778 -4.925 1.00 0.00 H new ATOM 0 HB2 PRO B 73 4.916 -7.108 -6.047 1.00 0.00 H new ATOM 0 HB3 PRO B 73 3.473 -8.013 -5.634 1.00 0.00 H new ATOM 0 HG2 PRO B 73 4.380 -7.012 -8.316 1.00 0.00 H new ATOM 0 HG3 PRO B 73 3.604 -8.529 -7.908 1.00 0.00 H new ATOM 0 HD2 PRO B 73 2.275 -6.309 -8.966 1.00 0.00 H new ATOM 0 HD3 PRO B 73 1.484 -7.623 -8.118 1.00 0.00 H new ATOM 1374 N ARG B 74 3.690 -3.560 -5.631 1.00 0.00 N ATOM 1375 CA ARG B 74 4.481 -2.346 -5.811 1.00 0.00 C ATOM 1376 C ARG B 74 4.649 -2.023 -7.294 1.00 0.00 C ATOM 1377 O ARG B 74 5.613 -1.365 -7.687 1.00 0.00 O ATOM 1378 CB ARG B 74 5.858 -2.513 -5.168 1.00 0.00 C ATOM 1379 CG ARG B 74 5.882 -2.241 -3.675 1.00 0.00 C ATOM 1380 CD ARG B 74 7.146 -2.787 -3.030 1.00 0.00 C ATOM 1381 NE ARG B 74 8.240 -1.819 -3.065 1.00 0.00 N ATOM 1382 CZ ARG B 74 9.074 -1.671 -4.094 1.00 0.00 C ATOM 1383 NH1 ARG B 74 8.953 -2.434 -5.175 1.00 0.00 N ATOM 1384 NH2 ARG B 74 10.035 -0.760 -4.042 1.00 0.00 N ATOM 0 H ARG B 74 2.882 -3.452 -5.018 1.00 0.00 H new ATOM 0 HA ARG B 74 3.952 -1.524 -5.329 1.00 0.00 H new ATOM 0 HB2 ARG B 74 6.210 -3.529 -5.347 1.00 0.00 H new ATOM 0 HB3 ARG B 74 6.561 -1.841 -5.660 1.00 0.00 H new ATOM 0 HG2 ARG B 74 5.817 -1.167 -3.499 1.00 0.00 H new ATOM 0 HG3 ARG B 74 5.008 -2.695 -3.207 1.00 0.00 H new ATOM 0 HD2 ARG B 74 6.936 -3.060 -1.996 1.00 0.00 H new ATOM 0 HD3 ARG B 74 7.451 -3.698 -3.545 1.00 0.00 H new ATOM 0 HE ARG B 74 8.374 -1.219 -2.251 1.00 0.00 H new ATOM 0 HH11 ARG B 74 8.218 -3.139 -5.222 1.00 0.00 H new ATOM 0 HH12 ARG B 74 9.595 -2.314 -5.958 1.00 0.00 H new ATOM 0 HH21 ARG B 74 10.136 -0.172 -3.215 1.00 0.00 H new ATOM 0 HH22 ARG B 74 10.673 -0.647 -4.829 1.00 0.00 H new ATOM 1398 N GLU B 75 3.721 -2.503 -8.116 1.00 0.00 N ATOM 1399 CA GLU B 75 3.787 -2.273 -9.556 1.00 0.00 C ATOM 1400 C GLU B 75 3.191 -0.919 -9.930 1.00 0.00 C ATOM 1401 O GLU B 75 3.919 0.016 -10.264 1.00 0.00 O ATOM 1402 CB GLU B 75 3.062 -3.394 -10.304 1.00 0.00 C ATOM 1403 CG GLU B 75 3.314 -3.387 -11.803 1.00 0.00 C ATOM 1404 CD GLU B 75 4.241 -4.503 -12.243 1.00 0.00 C ATOM 1405 OE1 GLU B 75 3.951 -5.676 -11.926 1.00 0.00 O ATOM 1406 OE2 GLU B 75 5.257 -4.204 -12.906 1.00 0.00 O ATOM 0 H GLU B 75 2.917 -3.052 -7.812 1.00 0.00 H new ATOM 0 HA GLU B 75 4.837 -2.270 -9.848 1.00 0.00 H new ATOM 0 HB2 GLU B 75 3.376 -4.354 -9.896 1.00 0.00 H new ATOM 0 HB3 GLU B 75 1.991 -3.306 -10.124 1.00 0.00 H new ATOM 0 HG2 GLU B 75 2.363 -3.481 -12.328 1.00 0.00 H new ATOM 0 HG3 GLU B 75 3.744 -2.428 -12.091 1.00 0.00 H new ATOM 1413 N ASP B 76 1.868 -0.820 -9.875 1.00 0.00 N ATOM 1414 CA ASP B 76 1.183 0.422 -10.213 1.00 0.00 C ATOM 1415 C ASP B 76 0.192 0.806 -9.122 1.00 0.00 C ATOM 1416 O ASP B 76 -0.983 0.443 -9.178 1.00 0.00 O ATOM 1417 CB ASP B 76 0.456 0.281 -11.552 1.00 0.00 C ATOM 1418 CG ASP B 76 1.292 0.772 -12.717 1.00 0.00 C ATOM 1419 OD1 ASP B 76 2.364 0.182 -12.971 1.00 0.00 O ATOM 1420 OD2 ASP B 76 0.876 1.747 -13.378 1.00 0.00 O ATOM 0 H ASP B 76 1.249 -1.583 -9.600 1.00 0.00 H new ATOM 0 HA ASP B 76 1.931 1.211 -10.296 1.00 0.00 H new ATOM 0 HB2 ASP B 76 0.194 -0.765 -11.712 1.00 0.00 H new ATOM 0 HB3 ASP B 76 -0.478 0.842 -11.516 1.00 0.00 H new ATOM 1425 N LEU B 77 0.674 1.544 -8.127 1.00 0.00 N ATOM 1426 CA LEU B 77 -0.170 1.975 -7.021 1.00 0.00 C ATOM 1427 C LEU B 77 -0.549 3.446 -7.165 1.00 0.00 C ATOM 1428 O LEU B 77 -0.123 4.287 -6.372 1.00 0.00 O ATOM 1429 CB LEU B 77 0.545 1.745 -5.688 1.00 0.00 C ATOM 1430 CG LEU B 77 0.526 0.301 -5.184 1.00 0.00 C ATOM 1431 CD1 LEU B 77 -0.901 -0.222 -5.118 1.00 0.00 C ATOM 1432 CD2 LEU B 77 1.380 -0.586 -6.078 1.00 0.00 C ATOM 0 H LEU B 77 1.643 1.855 -8.065 1.00 0.00 H new ATOM 0 HA LEU B 77 -1.084 1.382 -7.041 1.00 0.00 H new ATOM 0 HB2 LEU B 77 1.582 2.065 -5.789 1.00 0.00 H new ATOM 0 HB3 LEU B 77 0.087 2.384 -4.933 1.00 0.00 H new ATOM 0 HG LEU B 77 0.946 0.281 -4.178 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -0.895 -1.251 -4.757 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -1.485 0.398 -4.437 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -1.347 -0.188 -6.112 1.00 0.00 H new ATOM 0 HD21 LEU B 77 1.355 -1.610 -5.705 1.00 0.00 H new ATOM 0 HD22 LEU B 77 0.989 -0.561 -7.095 1.00 0.00 H new ATOM 0 HD23 LEU B 77 2.408 -0.223 -6.075 1.00 0.00 H new ATOM 1444 N ASP B 78 -1.359 3.748 -8.174 1.00 0.00 N ATOM 1445 CA ASP B 78 -1.803 5.117 -8.410 1.00 0.00 C ATOM 1446 C ASP B 78 -3.260 5.294 -7.992 1.00 0.00 C ATOM 1447 O ASP B 78 -3.717 6.413 -7.764 1.00 0.00 O ATOM 1448 CB ASP B 78 -1.635 5.495 -9.884 1.00 0.00 C ATOM 1449 CG ASP B 78 -1.674 6.995 -10.101 1.00 0.00 C ATOM 1450 OD1 ASP B 78 -0.651 7.662 -9.836 1.00 0.00 O ATOM 1451 OD2 ASP B 78 -2.729 7.504 -10.537 1.00 0.00 O ATOM 0 H ASP B 78 -1.721 3.065 -8.840 1.00 0.00 H new ATOM 0 HA ASP B 78 -1.182 5.778 -7.805 1.00 0.00 H new ATOM 0 HB2 ASP B 78 -0.688 5.101 -10.252 1.00 0.00 H new ATOM 0 HB3 ASP B 78 -2.425 5.025 -10.470 1.00 0.00 H new ATOM 1456 N MET B 79 -3.986 4.181 -7.891 1.00 0.00 N ATOM 1457 CA MET B 79 -5.390 4.216 -7.498 1.00 0.00 C ATOM 1458 C MET B 79 -5.562 4.911 -6.150 1.00 0.00 C ATOM 1459 O MET B 79 -6.499 5.684 -5.955 1.00 0.00 O ATOM 1460 CB MET B 79 -5.957 2.797 -7.435 1.00 0.00 C ATOM 1461 CG MET B 79 -7.061 2.536 -8.446 1.00 0.00 C ATOM 1462 SD MET B 79 -7.916 0.976 -8.157 1.00 0.00 S ATOM 1463 CE MET B 79 -9.531 1.562 -7.651 1.00 0.00 C ATOM 0 H MET B 79 -3.623 3.246 -8.076 1.00 0.00 H new ATOM 0 HA MET B 79 -5.939 4.785 -8.248 1.00 0.00 H new ATOM 0 HB2 MET B 79 -5.149 2.084 -7.600 1.00 0.00 H new ATOM 0 HB3 MET B 79 -6.343 2.614 -6.432 1.00 0.00 H new ATOM 0 HG2 MET B 79 -7.782 3.353 -8.409 1.00 0.00 H new ATOM 0 HG3 MET B 79 -6.635 2.532 -9.449 1.00 0.00 H new ATOM 0 HE1 MET B 79 -10.176 0.710 -7.437 1.00 0.00 H new ATOM 0 HE2 MET B 79 -9.431 2.176 -6.756 1.00 0.00 H new ATOM 0 HE3 MET B 79 -9.970 2.157 -8.452 1.00 0.00 H new ATOM 1473 N ILE B 80 -4.652 4.630 -5.223 1.00 0.00 N ATOM 1474 CA ILE B 80 -4.703 5.228 -3.895 1.00 0.00 C ATOM 1475 C ILE B 80 -4.436 6.728 -3.960 1.00 0.00 C ATOM 1476 O ILE B 80 -5.126 7.520 -3.318 1.00 0.00 O ATOM 1477 CB ILE B 80 -3.681 4.577 -2.943 1.00 0.00 C ATOM 1478 CG1 ILE B 80 -3.813 3.054 -2.981 1.00 0.00 C ATOM 1479 CG2 ILE B 80 -3.871 5.095 -1.525 1.00 0.00 C ATOM 1480 CD1 ILE B 80 -5.201 2.557 -2.642 1.00 0.00 C ATOM 0 H ILE B 80 -3.870 3.991 -5.368 1.00 0.00 H new ATOM 0 HA ILE B 80 -5.707 5.055 -3.508 1.00 0.00 H new ATOM 0 HB ILE B 80 -2.678 4.844 -3.275 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -3.542 2.699 -3.975 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -3.099 2.618 -2.282 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -3.141 4.625 -0.865 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -3.730 6.176 -1.511 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -4.877 4.855 -1.182 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -5.219 1.468 -2.689 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -5.468 2.881 -1.636 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -5.917 2.963 -3.356 1.00 0.00 H new ATOM 1492 N LEU B 81 -3.430 7.110 -4.739 1.00 0.00 N ATOM 1493 CA LEU B 81 -3.070 8.516 -4.890 1.00 0.00 C ATOM 1494 C LEU B 81 -4.189 9.295 -5.577 1.00 0.00 C ATOM 1495 O LEU B 81 -4.301 10.510 -5.415 1.00 0.00 O ATOM 1496 CB LEU B 81 -1.773 8.647 -5.694 1.00 0.00 C ATOM 1497 CG LEU B 81 -0.506 8.807 -4.854 1.00 0.00 C ATOM 1498 CD1 LEU B 81 -0.042 7.459 -4.324 1.00 0.00 C ATOM 1499 CD2 LEU B 81 0.594 9.467 -5.672 1.00 0.00 C ATOM 0 H LEU B 81 -2.849 6.466 -5.276 1.00 0.00 H new ATOM 0 HA LEU B 81 -2.918 8.936 -3.896 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -1.664 7.765 -6.325 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -1.861 9.506 -6.359 1.00 0.00 H new ATOM 0 HG LEU B 81 -0.735 9.449 -4.003 1.00 0.00 H new ATOM 0 HD11 LEU B 81 0.861 7.593 -3.729 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -0.825 7.023 -3.703 1.00 0.00 H new ATOM 0 HD13 LEU B 81 0.171 6.793 -5.160 1.00 0.00 H new ATOM 0 HD21 LEU B 81 1.489 9.574 -5.059 1.00 0.00 H new ATOM 0 HD22 LEU B 81 0.821 8.850 -6.541 1.00 0.00 H new ATOM 0 HD23 LEU B 81 0.261 10.451 -6.002 1.00 0.00 H new ATOM 1511 N LYS B 82 -5.016 8.589 -6.343 1.00 0.00 N ATOM 1512 CA LYS B 82 -6.124 9.217 -7.052 1.00 0.00 C ATOM 1513 C LYS B 82 -7.373 9.266 -6.179 1.00 0.00 C ATOM 1514 O LYS B 82 -8.228 10.135 -6.349 1.00 0.00 O ATOM 1515 CB LYS B 82 -6.424 8.457 -8.347 1.00 0.00 C ATOM 1516 CG LYS B 82 -5.336 8.595 -9.400 1.00 0.00 C ATOM 1517 CD LYS B 82 -5.765 7.989 -10.726 1.00 0.00 C ATOM 1518 CE LYS B 82 -5.101 8.691 -11.900 1.00 0.00 C ATOM 1519 NZ LYS B 82 -5.090 7.838 -13.121 1.00 0.00 N ATOM 0 H LYS B 82 -4.939 7.582 -6.488 1.00 0.00 H new ATOM 0 HA LYS B 82 -5.833 10.239 -7.295 1.00 0.00 H new ATOM 0 HB2 LYS B 82 -6.562 7.401 -8.115 1.00 0.00 H new ATOM 0 HB3 LYS B 82 -7.366 8.818 -8.760 1.00 0.00 H new ATOM 0 HG2 LYS B 82 -5.096 9.649 -9.541 1.00 0.00 H new ATOM 0 HG3 LYS B 82 -4.427 8.105 -9.052 1.00 0.00 H new ATOM 0 HD2 LYS B 82 -5.510 6.929 -10.743 1.00 0.00 H new ATOM 0 HD3 LYS B 82 -6.848 8.058 -10.825 1.00 0.00 H new ATOM 0 HE2 LYS B 82 -5.627 9.622 -12.112 1.00 0.00 H new ATOM 0 HE3 LYS B 82 -4.078 8.957 -11.633 1.00 0.00 H new ATOM 0 HZ1 LYS B 82 -4.629 8.352 -13.899 1.00 0.00 H new ATOM 0 HZ2 LYS B 82 -4.566 6.961 -12.927 1.00 0.00 H new ATOM 0 HZ3 LYS B 82 -6.067 7.605 -13.391 1.00 0.00 H new ATOM 1533 N MET B 83 -7.474 8.326 -5.243 1.00 0.00 N ATOM 1534 CA MET B 83 -8.619 8.262 -4.343 1.00 0.00 C ATOM 1535 C MET B 83 -8.424 9.179 -3.137 1.00 0.00 C ATOM 1536 O MET B 83 -9.387 9.553 -2.470 1.00 0.00 O ATOM 1537 CB MET B 83 -8.844 6.824 -3.874 1.00 0.00 C ATOM 1538 CG MET B 83 -9.776 6.029 -4.775 1.00 0.00 C ATOM 1539 SD MET B 83 -10.206 4.421 -4.084 1.00 0.00 S ATOM 1540 CE MET B 83 -11.320 4.903 -2.768 1.00 0.00 C ATOM 0 H MET B 83 -6.776 7.598 -5.089 1.00 0.00 H new ATOM 0 HA MET B 83 -9.497 8.602 -4.892 1.00 0.00 H new ATOM 0 HB2 MET B 83 -7.882 6.314 -3.819 1.00 0.00 H new ATOM 0 HB3 MET B 83 -9.254 6.840 -2.864 1.00 0.00 H new ATOM 0 HG2 MET B 83 -10.687 6.602 -4.945 1.00 0.00 H new ATOM 0 HG3 MET B 83 -9.303 5.888 -5.747 1.00 0.00 H new ATOM 0 HE1 MET B 83 -11.899 4.037 -2.446 1.00 0.00 H new ATOM 0 HE2 MET B 83 -10.744 5.288 -1.926 1.00 0.00 H new ATOM 0 HE3 MET B 83 -11.996 5.678 -3.129 1.00 0.00 H new ATOM 1550 N ASP B 84 -7.173 9.536 -2.860 1.00 0.00 N ATOM 1551 CA ASP B 84 -6.861 10.408 -1.734 1.00 0.00 C ATOM 1552 C ASP B 84 -6.652 11.847 -2.196 1.00 0.00 C ATOM 1553 O ASP B 84 -5.918 12.610 -1.568 1.00 0.00 O ATOM 1554 CB ASP B 84 -5.611 9.908 -1.005 1.00 0.00 C ATOM 1555 CG ASP B 84 -5.624 10.255 0.470 1.00 0.00 C ATOM 1556 OD1 ASP B 84 -5.879 11.433 0.801 1.00 0.00 O ATOM 1557 OD2 ASP B 84 -5.380 9.350 1.296 1.00 0.00 O ATOM 0 H ASP B 84 -6.361 9.235 -3.399 1.00 0.00 H new ATOM 0 HA ASP B 84 -7.708 10.387 -1.048 1.00 0.00 H new ATOM 0 HB2 ASP B 84 -5.535 8.827 -1.120 1.00 0.00 H new ATOM 0 HB3 ASP B 84 -4.725 10.341 -1.469 1.00 0.00 H new ATOM 1562 N SER B 85 -7.305 12.213 -3.295 1.00 0.00 N ATOM 1563 CA SER B 85 -7.194 13.561 -3.839 1.00 0.00 C ATOM 1564 C SER B 85 -5.740 13.910 -4.146 1.00 0.00 C ATOM 1565 O SER B 85 -4.821 13.201 -3.736 1.00 0.00 O ATOM 1566 CB SER B 85 -7.777 14.579 -2.858 1.00 0.00 C ATOM 1567 OG SER B 85 -7.988 15.831 -3.487 1.00 0.00 O ATOM 0 H SER B 85 -7.917 11.594 -3.826 1.00 0.00 H new ATOM 0 HA SER B 85 -7.760 13.596 -4.770 1.00 0.00 H new ATOM 0 HB2 SER B 85 -8.720 14.205 -2.459 1.00 0.00 H new ATOM 0 HB3 SER B 85 -7.100 14.703 -2.013 1.00 0.00 H new ATOM 0 HG SER B 85 -8.363 16.464 -2.839 1.00 0.00 H new ATOM 1573 N LEU B 86 -5.540 15.008 -4.869 1.00 0.00 N ATOM 1574 CA LEU B 86 -4.198 15.453 -5.230 1.00 0.00 C ATOM 1575 C LEU B 86 -4.247 16.784 -5.974 1.00 0.00 C ATOM 1576 O LEU B 86 -3.414 17.662 -5.749 1.00 0.00 O ATOM 1577 CB LEU B 86 -3.503 14.398 -6.094 1.00 0.00 C ATOM 1578 CG LEU B 86 -1.975 14.504 -6.139 1.00 0.00 C ATOM 1579 CD1 LEU B 86 -1.335 13.332 -5.409 1.00 0.00 C ATOM 1580 CD2 LEU B 86 -1.485 14.568 -7.577 1.00 0.00 C ATOM 0 H LEU B 86 -6.290 15.606 -5.216 1.00 0.00 H new ATOM 0 HA LEU B 86 -3.629 15.592 -4.311 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -3.773 13.410 -5.722 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -3.888 14.472 -7.111 1.00 0.00 H new ATOM 0 HG LEU B 86 -1.681 15.425 -5.635 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -0.250 13.425 -5.452 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -1.658 13.331 -4.368 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -1.638 12.399 -5.883 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -0.398 14.643 -7.588 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -1.792 13.666 -8.106 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -1.914 15.441 -8.069 1.00 0.00 H new ATOM 1592 N ARG B 87 -5.227 16.927 -6.861 1.00 0.00 N ATOM 1593 CA ARG B 87 -5.384 18.153 -7.636 1.00 0.00 C ATOM 1594 C ARG B 87 -6.198 19.185 -6.863 1.00 0.00 C ATOM 1595 O ARG B 87 -5.997 20.387 -7.017 1.00 0.00 O ATOM 1596 CB ARG B 87 -6.056 17.851 -8.976 1.00 0.00 C ATOM 1597 CG ARG B 87 -5.443 16.671 -9.713 1.00 0.00 C ATOM 1598 CD ARG B 87 -4.878 17.086 -11.061 1.00 0.00 C ATOM 1599 NE ARG B 87 -3.767 18.025 -10.925 1.00 0.00 N ATOM 1600 CZ ARG B 87 -2.905 18.301 -11.901 1.00 0.00 C ATOM 1601 NH1 ARG B 87 -3.019 17.709 -13.083 1.00 0.00 N ATOM 1602 NH2 ARG B 87 -1.924 19.169 -11.693 1.00 0.00 N ATOM 0 H ARG B 87 -5.924 16.210 -7.061 1.00 0.00 H new ATOM 0 HA ARG B 87 -4.393 18.566 -7.821 1.00 0.00 H new ATOM 0 HB2 ARG B 87 -7.114 17.652 -8.805 1.00 0.00 H new ATOM 0 HB3 ARG B 87 -5.996 18.735 -9.610 1.00 0.00 H new ATOM 0 HG2 ARG B 87 -4.651 16.233 -9.105 1.00 0.00 H new ATOM 0 HG3 ARG B 87 -6.199 15.899 -9.857 1.00 0.00 H new ATOM 0 HD2 ARG B 87 -4.540 16.201 -11.600 1.00 0.00 H new ATOM 0 HD3 ARG B 87 -5.667 17.542 -11.659 1.00 0.00 H new ATOM 0 HE ARG B 87 -3.645 18.497 -10.029 1.00 0.00 H new ATOM 0 HH11 ARG B 87 -3.770 17.039 -13.247 1.00 0.00 H new ATOM 0 HH12 ARG B 87 -2.356 17.924 -13.827 1.00 0.00 H new ATOM 0 HH21 ARG B 87 -1.830 19.625 -10.785 1.00 0.00 H new ATOM 0 HH22 ARG B 87 -1.263 19.381 -12.441 1.00 0.00 H new ATOM 1616 N ASP B 88 -7.115 18.707 -6.029 1.00 0.00 N ATOM 1617 CA ASP B 88 -7.956 19.591 -5.228 1.00 0.00 C ATOM 1618 C ASP B 88 -7.145 20.269 -4.122 1.00 0.00 C ATOM 1619 O ASP B 88 -7.625 21.195 -3.469 1.00 0.00 O ATOM 1620 CB ASP B 88 -9.119 18.806 -4.618 1.00 0.00 C ATOM 1621 CG ASP B 88 -10.453 19.496 -4.822 1.00 0.00 C ATOM 1622 OD1 ASP B 88 -11.045 19.335 -5.909 1.00 0.00 O ATOM 1623 OD2 ASP B 88 -10.906 20.198 -3.894 1.00 0.00 O ATOM 0 H ASP B 88 -7.295 17.713 -5.890 1.00 0.00 H new ATOM 0 HA ASP B 88 -8.353 20.365 -5.885 1.00 0.00 H new ATOM 0 HB2 ASP B 88 -9.156 17.812 -5.063 1.00 0.00 H new ATOM 0 HB3 ASP B 88 -8.942 18.671 -3.551 1.00 0.00 H new ATOM 1628 N ILE B 89 -5.909 19.810 -3.928 1.00 0.00 N ATOM 1629 CA ILE B 89 -5.029 20.373 -2.916 1.00 0.00 C ATOM 1630 C ILE B 89 -4.197 21.482 -3.532 1.00 0.00 C ATOM 1631 O ILE B 89 -4.231 22.626 -3.081 1.00 0.00 O ATOM 1632 CB ILE B 89 -4.095 19.303 -2.315 1.00 0.00 C ATOM 1633 CG1 ILE B 89 -4.915 18.157 -1.718 1.00 0.00 C ATOM 1634 CG2 ILE B 89 -3.192 19.916 -1.255 1.00 0.00 C ATOM 1635 CD1 ILE B 89 -5.609 17.304 -2.756 1.00 0.00 C ATOM 0 H ILE B 89 -5.497 19.046 -4.464 1.00 0.00 H new ATOM 0 HA ILE B 89 -5.649 20.768 -2.112 1.00 0.00 H new ATOM 0 HB ILE B 89 -3.468 18.905 -3.113 1.00 0.00 H new ATOM 0 HG12 ILE B 89 -4.259 17.525 -1.120 1.00 0.00 H new ATOM 0 HG13 ILE B 89 -5.662 18.571 -1.041 1.00 0.00 H new ATOM 0 HG21 ILE B 89 -2.540 19.146 -0.843 1.00 0.00 H new ATOM 0 HG22 ILE B 89 -2.585 20.702 -1.704 1.00 0.00 H new ATOM 0 HG23 ILE B 89 -3.803 20.340 -0.458 1.00 0.00 H new ATOM 0 HD11 ILE B 89 -6.171 16.512 -2.260 1.00 0.00 H new ATOM 0 HD12 ILE B 89 -6.291 17.923 -3.338 1.00 0.00 H new ATOM 0 HD13 ILE B 89 -4.866 16.861 -3.419 1.00 0.00 H new ATOM 1647 N GLU B 90 -3.482 21.137 -4.597 1.00 0.00 N ATOM 1648 CA GLU B 90 -2.677 22.109 -5.313 1.00 0.00 C ATOM 1649 C GLU B 90 -3.592 23.185 -5.890 1.00 0.00 C ATOM 1650 O GLU B 90 -3.157 24.296 -6.186 1.00 0.00 O ATOM 1651 CB GLU B 90 -1.884 21.428 -6.432 1.00 0.00 C ATOM 1652 CG GLU B 90 -0.981 22.374 -7.205 1.00 0.00 C ATOM 1653 CD GLU B 90 -0.807 21.962 -8.653 1.00 0.00 C ATOM 1654 OE1 GLU B 90 0.129 21.187 -8.941 1.00 0.00 O ATOM 1655 OE2 GLU B 90 -1.606 22.415 -9.500 1.00 0.00 O ATOM 0 H GLU B 90 -3.446 20.192 -4.980 1.00 0.00 H new ATOM 0 HA GLU B 90 -1.966 22.566 -4.625 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -1.277 20.631 -6.002 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -2.582 20.958 -7.125 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -1.397 23.381 -7.165 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -0.004 22.413 -6.723 1.00 0.00 H new ATOM 1662 N ALA B 91 -4.872 22.837 -6.027 1.00 0.00 N ATOM 1663 CA ALA B 91 -5.873 23.754 -6.543 1.00 0.00 C ATOM 1664 C ALA B 91 -6.447 24.588 -5.410 1.00 0.00 C ATOM 1665 O ALA B 91 -6.494 25.817 -5.486 1.00 0.00 O ATOM 1666 CB ALA B 91 -6.975 22.985 -7.253 1.00 0.00 C ATOM 0 H ALA B 91 -5.236 21.916 -5.783 1.00 0.00 H new ATOM 0 HA ALA B 91 -5.403 24.423 -7.264 1.00 0.00 H new ATOM 0 HB1 ALA B 91 -7.719 23.684 -7.635 1.00 0.00 H new ATOM 0 HB2 ALA B 91 -6.549 22.420 -8.082 1.00 0.00 H new ATOM 0 HB3 ALA B 91 -7.449 22.298 -6.552 1.00 0.00 H new ATOM 1672 N LEU B 92 -6.858 23.913 -4.336 1.00 0.00 N ATOM 1673 CA LEU B 92 -7.399 24.605 -3.170 1.00 0.00 C ATOM 1674 C LEU B 92 -6.406 25.659 -2.696 1.00 0.00 C ATOM 1675 O LEU B 92 -6.783 26.669 -2.106 1.00 0.00 O ATOM 1676 CB LEU B 92 -7.692 23.616 -2.039 1.00 0.00 C ATOM 1677 CG LEU B 92 -9.122 23.068 -2.010 1.00 0.00 C ATOM 1678 CD1 LEU B 92 -9.164 21.722 -1.301 1.00 0.00 C ATOM 1679 CD2 LEU B 92 -10.057 24.061 -1.335 1.00 0.00 C ATOM 0 H LEU B 92 -6.827 22.897 -4.251 1.00 0.00 H new ATOM 0 HA LEU B 92 -8.335 25.087 -3.453 1.00 0.00 H new ATOM 0 HB2 LEU B 92 -7.000 22.778 -2.122 1.00 0.00 H new ATOM 0 HB3 LEU B 92 -7.488 24.106 -1.087 1.00 0.00 H new ATOM 0 HG LEU B 92 -9.458 22.923 -3.037 1.00 0.00 H new ATOM 0 HD11 LEU B 92 -10.188 21.348 -1.290 1.00 0.00 H new ATOM 0 HD12 LEU B 92 -8.525 21.013 -1.827 1.00 0.00 H new ATOM 0 HD13 LEU B 92 -8.810 21.839 -0.277 1.00 0.00 H new ATOM 0 HD21 LEU B 92 -11.069 23.657 -1.322 1.00 0.00 H new ATOM 0 HD22 LEU B 92 -9.724 24.237 -0.312 1.00 0.00 H new ATOM 0 HD23 LEU B 92 -10.049 25.001 -1.886 1.00 0.00 H new ATOM 1691 N LEU B 93 -5.130 25.415 -2.984 1.00 0.00 N ATOM 1692 CA LEU B 93 -4.072 26.338 -2.614 1.00 0.00 C ATOM 1693 C LEU B 93 -3.814 27.318 -3.751 1.00 0.00 C ATOM 1694 O LEU B 93 -3.547 28.494 -3.520 1.00 0.00 O ATOM 1695 CB LEU B 93 -2.789 25.573 -2.279 1.00 0.00 C ATOM 1696 CG LEU B 93 -2.611 25.222 -0.801 1.00 0.00 C ATOM 1697 CD1 LEU B 93 -2.631 26.481 0.052 1.00 0.00 C ATOM 1698 CD2 LEU B 93 -3.695 24.253 -0.351 1.00 0.00 C ATOM 0 H LEU B 93 -4.808 24.581 -3.475 1.00 0.00 H new ATOM 0 HA LEU B 93 -4.387 26.893 -1.731 1.00 0.00 H new ATOM 0 HB2 LEU B 93 -2.772 24.651 -2.860 1.00 0.00 H new ATOM 0 HB3 LEU B 93 -1.935 26.169 -2.601 1.00 0.00 H new ATOM 0 HG LEU B 93 -1.643 24.738 -0.675 1.00 0.00 H new ATOM 0 HD11 LEU B 93 -2.503 26.212 1.101 1.00 0.00 H new ATOM 0 HD12 LEU B 93 -1.820 27.141 -0.255 1.00 0.00 H new ATOM 0 HD13 LEU B 93 -3.584 26.993 -0.078 1.00 0.00 H new ATOM 0 HD21 LEU B 93 -3.554 24.013 0.703 1.00 0.00 H new ATOM 0 HD22 LEU B 93 -4.674 24.712 -0.491 1.00 0.00 H new ATOM 0 HD23 LEU B 93 -3.634 23.339 -0.942 1.00 0.00 H new ATOM 1710 N THR B 94 -3.908 26.828 -4.984 1.00 0.00 N ATOM 1711 CA THR B 94 -3.690 27.682 -6.148 1.00 0.00 C ATOM 1712 C THR B 94 -4.753 28.780 -6.229 1.00 0.00 C ATOM 1713 O THR B 94 -4.596 29.750 -6.971 1.00 0.00 O ATOM 1714 CB THR B 94 -3.688 26.845 -7.434 1.00 0.00 C ATOM 1715 OG1 THR B 94 -2.464 26.146 -7.572 1.00 0.00 O ATOM 1716 CG2 THR B 94 -3.885 27.662 -8.697 1.00 0.00 C ATOM 0 H THR B 94 -4.131 25.857 -5.202 1.00 0.00 H new ATOM 0 HA THR B 94 -2.716 28.159 -6.040 1.00 0.00 H new ATOM 0 HB THR B 94 -4.533 26.164 -7.328 1.00 0.00 H new ATOM 0 HG1 THR B 94 -2.380 25.488 -6.851 1.00 0.00 H new ATOM 0 HG21 THR B 94 -3.872 27.001 -9.564 1.00 0.00 H new ATOM 0 HG22 THR B 94 -4.843 28.180 -8.650 1.00 0.00 H new ATOM 0 HG23 THR B 94 -3.082 28.393 -8.786 1.00 0.00 H new ATOM 1724 N GLY B 95 -5.836 28.622 -5.470 1.00 0.00 N ATOM 1725 CA GLY B 95 -6.901 29.608 -5.490 1.00 0.00 C ATOM 1726 C GLY B 95 -7.195 30.199 -4.122 1.00 0.00 C ATOM 1727 O GLY B 95 -7.626 31.347 -4.020 1.00 0.00 O ATOM 0 H GLY B 95 -5.993 27.832 -4.845 1.00 0.00 H new ATOM 0 HA2 GLY B 95 -6.631 30.411 -6.175 1.00 0.00 H new ATOM 0 HA3 GLY B 95 -7.807 29.146 -5.882 1.00 0.00 H new ATOM 1731 N LEU B 96 -6.974 29.417 -3.067 1.00 0.00 N ATOM 1732 CA LEU B 96 -7.234 29.889 -1.710 1.00 0.00 C ATOM 1733 C LEU B 96 -5.960 30.337 -1.005 1.00 0.00 C ATOM 1734 O LEU B 96 -5.989 30.711 0.168 1.00 0.00 O ATOM 1735 CB LEU B 96 -7.922 28.795 -0.894 1.00 0.00 C ATOM 1736 CG LEU B 96 -8.997 29.286 0.077 1.00 0.00 C ATOM 1737 CD1 LEU B 96 -9.884 28.130 0.515 1.00 0.00 C ATOM 1738 CD2 LEU B 96 -8.361 29.959 1.283 1.00 0.00 C ATOM 0 H LEU B 96 -6.619 28.463 -3.125 1.00 0.00 H new ATOM 0 HA LEU B 96 -7.890 30.756 -1.788 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -8.375 28.081 -1.582 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -7.163 28.255 -0.328 1.00 0.00 H new ATOM 0 HG LEU B 96 -9.617 30.021 -0.437 1.00 0.00 H new ATOM 0 HD11 LEU B 96 -10.644 28.496 1.206 1.00 0.00 H new ATOM 0 HD12 LEU B 96 -10.368 27.692 -0.358 1.00 0.00 H new ATOM 0 HD13 LEU B 96 -9.277 27.373 1.011 1.00 0.00 H new ATOM 0 HD21 LEU B 96 -9.142 30.302 1.962 1.00 0.00 H new ATOM 0 HD22 LEU B 96 -7.717 29.247 1.800 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -7.767 30.812 0.953 1.00 0.00 H new ATOM 1750 N PHE B 97 -4.846 30.292 -1.723 1.00 0.00 N ATOM 1751 CA PHE B 97 -3.545 30.691 -1.175 1.00 0.00 C ATOM 1752 C PHE B 97 -3.667 31.915 -0.267 1.00 0.00 C ATOM 1753 O PHE B 97 -4.379 32.867 -0.583 1.00 0.00 O ATOM 1754 CB PHE B 97 -2.557 30.992 -2.304 1.00 0.00 C ATOM 1755 CG PHE B 97 -3.093 31.946 -3.335 1.00 0.00 C ATOM 1756 CD1 PHE B 97 -3.891 31.490 -4.371 1.00 0.00 C ATOM 1757 CD2 PHE B 97 -2.796 33.297 -3.265 1.00 0.00 C ATOM 1758 CE1 PHE B 97 -4.384 32.367 -5.321 1.00 0.00 C ATOM 1759 CE2 PHE B 97 -3.285 34.178 -4.212 1.00 0.00 C ATOM 1760 CZ PHE B 97 -4.080 33.712 -5.241 1.00 0.00 C ATOM 0 H PHE B 97 -4.812 29.982 -2.694 1.00 0.00 H new ATOM 0 HA PHE B 97 -3.176 29.856 -0.579 1.00 0.00 H new ATOM 0 HB2 PHE B 97 -1.645 31.408 -1.876 1.00 0.00 H new ATOM 0 HB3 PHE B 97 -2.282 30.058 -2.794 1.00 0.00 H new ATOM 0 HD1 PHE B 97 -4.131 30.439 -4.438 1.00 0.00 H new ATOM 0 HD2 PHE B 97 -2.176 33.666 -2.462 1.00 0.00 H new ATOM 0 HE1 PHE B 97 -5.006 32.000 -6.124 1.00 0.00 H new ATOM 0 HE2 PHE B 97 -3.046 35.229 -4.147 1.00 0.00 H new ATOM 0 HZ PHE B 97 -4.463 34.398 -5.982 1.00 0.00 H new ATOM 1770 N VAL B 98 -2.965 31.877 0.861 1.00 0.00 N ATOM 1771 CA VAL B 98 -2.991 32.978 1.816 1.00 0.00 C ATOM 1772 C VAL B 98 -1.612 33.201 2.428 1.00 0.00 C ATOM 1773 O VAL B 98 -0.891 32.248 2.725 1.00 0.00 O ATOM 1774 CB VAL B 98 -4.005 32.720 2.946 1.00 0.00 C ATOM 1775 CG1 VAL B 98 -4.159 33.954 3.820 1.00 0.00 C ATOM 1776 CG2 VAL B 98 -5.348 32.293 2.370 1.00 0.00 C ATOM 0 H VAL B 98 -2.371 31.095 1.136 1.00 0.00 H new ATOM 0 HA VAL B 98 -3.293 33.869 1.266 1.00 0.00 H new ATOM 0 HB VAL B 98 -3.628 31.909 3.569 1.00 0.00 H new ATOM 0 HG11 VAL B 98 -4.880 33.751 4.612 1.00 0.00 H new ATOM 0 HG12 VAL B 98 -3.196 34.209 4.262 1.00 0.00 H new ATOM 0 HG13 VAL B 98 -4.512 34.788 3.213 1.00 0.00 H new ATOM 0 HG21 VAL B 98 -6.052 32.115 3.183 1.00 0.00 H new ATOM 0 HG22 VAL B 98 -5.733 33.081 1.722 1.00 0.00 H new ATOM 0 HG23 VAL B 98 -5.222 31.377 1.792 1.00 0.00 H new