USER MOD reduce.3.24.130724 H: found=0, std=0, add=682, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 681 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 60 SER OG : rot 180:sc= -0.153 USER MOD Set 1.2: A 61 GLN : amide:sc= -5.28! K(o=-5.4!,f=0.16) USER MOD Set 2.1: A 23 SER OG : rot 110:sc= 0.986 USER MOD Set 2.2: A 57 TYR OH : rot -162:sc= 1.22 USER MOD Set 3.1: A 5 THR OG1 : rot -46:sc= -0.205! USER MOD Set 3.2: A 76 GLN : amide:sc= -0.462 K(o=-0.67,f=-3.4!) USER MOD Single : A 10 LYS NZ :NH3+ -173:sc= -1.87 (180deg=-1.92) USER MOD Single : A 14 SER OG : rot 73:sc= 1.13 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -162:sc= -0.0505 (180deg=-0.385) USER MOD Single : A 30 LYS NZ :NH3+ 143:sc= -1.36 (180deg=-3.71!) USER MOD Single : A 32 GLN : amide:sc= -0.225 K(o=-0.23,f=-2.1!) USER MOD Single : A 35 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 36 ASN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 37 SER OG : rot 86:sc= 1 USER MOD Single : A 38 ASN : amide:sc= -2.34! C(o=-2.3!,f=-3.6!) USER MOD Single : A 44 GLN : amide:sc= -0.86 K(o=-0.86,f=-2.3!) USER MOD Single : A 47 MET CE :methyl -173:sc= -1.45 (180deg=-1.84) USER MOD Single : A 48 HIS : no HE2:sc= 0.489 K(o=0.49,f=-3.4!) USER MOD Single : A 51 MET CE :methyl -176:sc= 0 (180deg=-0.0213) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -2.11! C(o=-2.1!,f=-3.5!) USER MOD Single : A 75 THR OG1 : rot 66:sc= 0.165 USER MOD Single : A 79 LYS NZ :NH3+ -160:sc= -0.0239 (180deg=-0.368) USER MOD ----------------------------------------------------------------- ATOM 27 N VAL A 3 -4.226 -17.236 15.174 1.00 0.00 N ATOM 28 CA VAL A 3 -2.991 -17.998 15.371 1.00 0.00 C ATOM 29 C VAL A 3 -1.881 -17.084 15.866 1.00 0.00 C ATOM 30 O VAL A 3 -0.913 -16.829 15.153 1.00 0.00 O ATOM 31 CB VAL A 3 -2.567 -18.651 14.058 1.00 0.00 C ATOM 32 CG1 VAL A 3 -1.450 -19.659 14.333 1.00 0.00 C ATOM 33 CG2 VAL A 3 -3.767 -19.376 13.444 1.00 0.00 C ATOM 0 HA VAL A 3 -3.174 -18.771 16.117 1.00 0.00 H new ATOM 0 HB VAL A 3 -2.208 -17.888 13.367 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -1.144 -20.128 13.398 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -0.597 -19.145 14.777 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -1.811 -20.424 15.021 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -3.468 -19.844 12.506 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.122 -20.141 14.134 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -4.566 -18.660 13.254 1.00 0.00 H new ATOM 43 N TRP A 4 -2.032 -16.592 17.095 1.00 0.00 N ATOM 44 CA TRP A 4 -1.037 -15.702 17.692 1.00 0.00 C ATOM 45 C TRP A 4 -0.567 -16.246 19.037 1.00 0.00 C ATOM 46 O TRP A 4 -1.376 -16.585 19.901 1.00 0.00 O ATOM 47 CB TRP A 4 -1.647 -14.315 17.884 1.00 0.00 C ATOM 48 CG TRP A 4 -2.309 -13.889 16.610 1.00 0.00 C ATOM 49 CD1 TRP A 4 -1.745 -13.953 15.382 1.00 0.00 C ATOM 50 CD2 TRP A 4 -3.645 -13.340 16.419 1.00 0.00 C ATOM 51 NE1 TRP A 4 -2.651 -13.478 14.449 1.00 0.00 N ATOM 52 CE2 TRP A 4 -3.835 -13.087 15.040 1.00 0.00 C ATOM 53 CE3 TRP A 4 -4.700 -13.039 17.300 1.00 0.00 C ATOM 54 CZ2 TRP A 4 -5.030 -12.555 14.551 1.00 0.00 C ATOM 55 CZ3 TRP A 4 -5.903 -12.504 16.812 1.00 0.00 C ATOM 56 CH2 TRP A 4 -6.068 -12.262 15.441 1.00 0.00 C ATOM 0 H TRP A 4 -2.831 -16.794 17.695 1.00 0.00 H new ATOM 0 HA TRP A 4 -0.178 -15.638 17.024 1.00 0.00 H new ATOM 0 HB2 TRP A 4 -2.373 -14.333 18.697 1.00 0.00 H new ATOM 0 HB3 TRP A 4 -0.873 -13.600 18.163 1.00 0.00 H new ATOM 0 HD1 TRP A 4 -0.751 -14.315 15.165 1.00 0.00 H new ATOM 0 HE1 TRP A 4 -2.466 -13.424 13.447 1.00 0.00 H new ATOM 0 HE3 TRP A 4 -4.584 -13.221 18.358 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 -5.152 -12.371 13.494 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 -6.706 -12.277 17.497 1.00 0.00 H new ATOM 0 HH2 TRP A 4 -6.996 -11.850 15.073 1.00 0.00 H new ATOM 67 N THR A 5 0.747 -16.307 19.206 1.00 0.00 N ATOM 68 CA THR A 5 1.337 -16.787 20.447 1.00 0.00 C ATOM 69 C THR A 5 2.837 -16.495 20.466 1.00 0.00 C ATOM 70 O THR A 5 3.639 -17.347 20.849 1.00 0.00 O ATOM 71 CB THR A 5 1.102 -18.294 20.596 1.00 0.00 C ATOM 72 OG1 THR A 5 -0.201 -18.614 20.133 1.00 0.00 O ATOM 73 CG2 THR A 5 1.238 -18.694 22.065 1.00 0.00 C ATOM 0 H THR A 5 1.426 -16.029 18.497 1.00 0.00 H new ATOM 0 HA THR A 5 0.863 -16.268 21.280 1.00 0.00 H new ATOM 0 HB THR A 5 1.842 -18.837 20.008 1.00 0.00 H new ATOM 0 HG1 THR A 5 -0.845 -17.974 20.501 1.00 0.00 H new ATOM 0 HG21 THR A 5 1.070 -19.766 22.167 1.00 0.00 H new ATOM 0 HG22 THR A 5 2.240 -18.448 22.418 1.00 0.00 H new ATOM 0 HG23 THR A 5 0.501 -18.153 22.659 1.00 0.00 H new ATOM 81 N PRO A 6 3.218 -15.314 20.063 1.00 0.00 N ATOM 82 CA PRO A 6 4.647 -14.890 20.029 1.00 0.00 C ATOM 83 C PRO A 6 5.249 -14.814 21.433 1.00 0.00 C ATOM 84 O PRO A 6 4.563 -15.037 22.431 1.00 0.00 O ATOM 85 CB PRO A 6 4.590 -13.499 19.364 1.00 0.00 C ATOM 86 CG PRO A 6 3.212 -13.008 19.651 1.00 0.00 C ATOM 87 CD PRO A 6 2.326 -14.239 19.592 1.00 0.00 C ATOM 0 HA PRO A 6 5.282 -15.594 19.491 1.00 0.00 H new ATOM 0 HB2 PRO A 6 5.345 -12.830 19.777 1.00 0.00 H new ATOM 0 HB3 PRO A 6 4.774 -13.563 18.292 1.00 0.00 H new ATOM 0 HG2 PRO A 6 3.160 -12.533 20.631 1.00 0.00 H new ATOM 0 HG3 PRO A 6 2.900 -12.263 18.919 1.00 0.00 H new ATOM 0 HD2 PRO A 6 1.448 -14.135 20.230 1.00 0.00 H new ATOM 0 HD3 PRO A 6 1.965 -14.428 18.581 1.00 0.00 H new ATOM 95 N GLU A 7 6.531 -14.492 21.496 1.00 0.00 N ATOM 96 CA GLU A 7 7.221 -14.378 22.773 1.00 0.00 C ATOM 97 C GLU A 7 6.428 -13.497 23.726 1.00 0.00 C ATOM 98 O GLU A 7 6.695 -13.471 24.926 1.00 0.00 O ATOM 99 CB GLU A 7 8.624 -13.796 22.576 1.00 0.00 C ATOM 100 CG GLU A 7 9.450 -14.726 21.668 1.00 0.00 C ATOM 101 CD GLU A 7 9.150 -14.436 20.198 1.00 0.00 C ATOM 102 OE1 GLU A 7 8.278 -13.622 19.938 1.00 0.00 O ATOM 103 OE2 GLU A 7 9.800 -15.030 19.355 1.00 0.00 O ATOM 0 H GLU A 7 7.115 -14.305 20.681 1.00 0.00 H new ATOM 0 HA GLU A 7 7.311 -15.376 23.202 1.00 0.00 H new ATOM 0 HB2 GLU A 7 8.557 -12.803 22.131 1.00 0.00 H new ATOM 0 HB3 GLU A 7 9.119 -13.680 23.540 1.00 0.00 H new ATOM 0 HG2 GLU A 7 10.513 -14.586 21.864 1.00 0.00 H new ATOM 0 HG3 GLU A 7 9.218 -15.767 21.895 1.00 0.00 H new ATOM 110 N VAL A 8 5.467 -12.759 23.183 1.00 0.00 N ATOM 111 CA VAL A 8 4.665 -11.857 24.001 1.00 0.00 C ATOM 112 C VAL A 8 3.991 -12.637 25.121 1.00 0.00 C ATOM 113 O VAL A 8 4.044 -12.239 26.284 1.00 0.00 O ATOM 114 CB VAL A 8 3.587 -11.197 23.139 1.00 0.00 C ATOM 115 CG1 VAL A 8 2.817 -10.174 23.967 1.00 0.00 C ATOM 116 CG2 VAL A 8 4.237 -10.510 21.934 1.00 0.00 C ATOM 0 H VAL A 8 5.226 -12.766 22.192 1.00 0.00 H new ATOM 0 HA VAL A 8 5.317 -11.093 24.425 1.00 0.00 H new ATOM 0 HB VAL A 8 2.895 -11.960 22.784 1.00 0.00 H new ATOM 0 HG11 VAL A 8 2.051 -9.707 23.348 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.345 -10.672 24.814 1.00 0.00 H new ATOM 0 HG13 VAL A 8 3.504 -9.410 24.332 1.00 0.00 H new ATOM 0 HG21 VAL A 8 3.466 -10.041 21.323 1.00 0.00 H new ATOM 0 HG22 VAL A 8 4.936 -9.750 22.282 1.00 0.00 H new ATOM 0 HG23 VAL A 8 4.772 -11.250 21.339 1.00 0.00 H new ATOM 126 N LEU A 9 3.376 -13.758 24.773 1.00 0.00 N ATOM 127 CA LEU A 9 2.723 -14.584 25.771 1.00 0.00 C ATOM 128 C LEU A 9 3.743 -15.106 26.775 1.00 0.00 C ATOM 129 O LEU A 9 3.506 -15.097 27.983 1.00 0.00 O ATOM 130 CB LEU A 9 2.018 -15.755 25.091 1.00 0.00 C ATOM 131 CG LEU A 9 1.386 -16.688 26.164 1.00 0.00 C ATOM 132 CD1 LEU A 9 -0.012 -17.126 25.718 1.00 0.00 C ATOM 133 CD2 LEU A 9 2.269 -17.932 26.356 1.00 0.00 C ATOM 0 H LEU A 9 3.317 -14.111 23.818 1.00 0.00 H new ATOM 0 HA LEU A 9 1.987 -13.980 26.302 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.245 -15.384 24.418 1.00 0.00 H new ATOM 0 HB3 LEU A 9 2.728 -16.315 24.483 1.00 0.00 H new ATOM 0 HG LEU A 9 1.312 -16.143 27.105 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -0.447 -17.779 26.475 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.645 -16.248 25.589 1.00 0.00 H new ATOM 0 HD13 LEU A 9 0.060 -17.664 24.773 1.00 0.00 H new ATOM 0 HD21 LEU A 9 1.823 -18.582 27.108 1.00 0.00 H new ATOM 0 HD22 LEU A 9 2.349 -18.471 25.412 1.00 0.00 H new ATOM 0 HD23 LEU A 9 3.262 -17.626 26.684 1.00 0.00 H new ATOM 145 N LYS A 10 4.882 -15.557 26.264 1.00 0.00 N ATOM 146 CA LYS A 10 5.942 -16.073 27.118 1.00 0.00 C ATOM 147 C LYS A 10 6.482 -14.964 28.008 1.00 0.00 C ATOM 148 O LYS A 10 6.819 -15.195 29.167 1.00 0.00 O ATOM 149 CB LYS A 10 7.069 -16.645 26.263 1.00 0.00 C ATOM 150 CG LYS A 10 8.115 -17.303 27.168 1.00 0.00 C ATOM 151 CD LYS A 10 9.122 -18.082 26.314 1.00 0.00 C ATOM 152 CE LYS A 10 10.039 -17.111 25.565 1.00 0.00 C ATOM 153 NZ LYS A 10 11.199 -17.857 25.011 1.00 0.00 N ATOM 0 H LYS A 10 5.094 -15.576 25.266 1.00 0.00 H new ATOM 0 HA LYS A 10 5.534 -16.865 27.746 1.00 0.00 H new ATOM 0 HB2 LYS A 10 6.671 -17.376 25.559 1.00 0.00 H new ATOM 0 HB3 LYS A 10 7.530 -15.853 25.673 1.00 0.00 H new ATOM 0 HG2 LYS A 10 8.632 -16.543 27.754 1.00 0.00 H new ATOM 0 HG3 LYS A 10 7.627 -17.974 27.875 1.00 0.00 H new ATOM 0 HD2 LYS A 10 9.716 -18.740 26.948 1.00 0.00 H new ATOM 0 HD3 LYS A 10 8.593 -18.717 25.603 1.00 0.00 H new ATOM 0 HE2 LYS A 10 9.490 -16.621 24.761 1.00 0.00 H new ATOM 0 HE3 LYS A 10 10.385 -16.327 26.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 11.882 -17.186 24.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 11.657 -18.400 25.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 10.871 -18.508 24.269 1.00 0.00 H new ATOM 167 N ALA A 11 6.557 -13.758 27.457 1.00 0.00 N ATOM 168 CA ALA A 11 7.051 -12.616 28.214 1.00 0.00 C ATOM 169 C ALA A 11 6.103 -12.302 29.365 1.00 0.00 C ATOM 170 O ALA A 11 6.536 -11.971 30.467 1.00 0.00 O ATOM 171 CB ALA A 11 7.174 -11.395 27.298 1.00 0.00 C ATOM 0 H ALA A 11 6.284 -13.547 26.497 1.00 0.00 H new ATOM 0 HA ALA A 11 8.033 -12.861 28.618 1.00 0.00 H new ATOM 0 HB1 ALA A 11 7.544 -10.545 27.872 1.00 0.00 H new ATOM 0 HB2 ALA A 11 7.869 -11.616 26.488 1.00 0.00 H new ATOM 0 HB3 ALA A 11 6.196 -11.153 26.881 1.00 0.00 H new ATOM 177 N ARG A 12 4.807 -12.413 29.099 1.00 0.00 N ATOM 178 CA ARG A 12 3.803 -12.146 30.121 1.00 0.00 C ATOM 179 C ARG A 12 3.848 -13.218 31.197 1.00 0.00 C ATOM 180 O ARG A 12 3.851 -12.915 32.390 1.00 0.00 O ATOM 181 CB ARG A 12 2.412 -12.117 29.479 1.00 0.00 C ATOM 182 CG ARG A 12 2.300 -10.920 28.519 1.00 0.00 C ATOM 183 CD ARG A 12 1.951 -9.645 29.300 1.00 0.00 C ATOM 184 NE ARG A 12 1.750 -8.535 28.379 1.00 0.00 N ATOM 185 CZ ARG A 12 2.764 -7.769 27.993 1.00 0.00 C ATOM 186 NH1 ARG A 12 3.971 -8.016 28.427 1.00 0.00 N ATOM 187 NH2 ARG A 12 2.555 -6.773 27.180 1.00 0.00 N ATOM 0 H ARG A 12 4.429 -12.684 28.191 1.00 0.00 H new ATOM 0 HA ARG A 12 4.013 -11.180 30.579 1.00 0.00 H new ATOM 0 HB2 ARG A 12 2.233 -13.046 28.937 1.00 0.00 H new ATOM 0 HB3 ARG A 12 1.647 -12.046 30.252 1.00 0.00 H new ATOM 0 HG2 ARG A 12 3.241 -10.783 27.986 1.00 0.00 H new ATOM 0 HG3 ARG A 12 1.534 -11.117 27.769 1.00 0.00 H new ATOM 0 HD2 ARG A 12 1.049 -9.806 29.890 1.00 0.00 H new ATOM 0 HD3 ARG A 12 2.752 -9.407 30.000 1.00 0.00 H new ATOM 0 HE ARG A 12 0.813 -8.342 28.024 1.00 0.00 H new ATOM 0 HH11 ARG A 12 4.135 -8.797 29.062 1.00 0.00 H new ATOM 0 HH12 ARG A 12 4.750 -7.428 28.131 1.00 0.00 H new ATOM 0 HH21 ARG A 12 1.613 -6.581 26.840 1.00 0.00 H new ATOM 0 HH22 ARG A 12 3.334 -6.185 26.884 1.00 0.00 H new ATOM 201 N ALA A 13 3.901 -14.471 30.764 1.00 0.00 N ATOM 202 CA ALA A 13 3.964 -15.586 31.699 1.00 0.00 C ATOM 203 C ALA A 13 5.317 -15.601 32.399 1.00 0.00 C ATOM 204 O ALA A 13 5.408 -15.857 33.598 1.00 0.00 O ATOM 205 CB ALA A 13 3.754 -16.906 30.958 1.00 0.00 C ATOM 0 H ALA A 13 3.902 -14.739 29.780 1.00 0.00 H new ATOM 0 HA ALA A 13 3.176 -15.466 32.442 1.00 0.00 H new ATOM 0 HB1 ALA A 13 3.803 -17.733 31.667 1.00 0.00 H new ATOM 0 HB2 ALA A 13 2.777 -16.900 30.474 1.00 0.00 H new ATOM 0 HB3 ALA A 13 4.532 -17.028 30.204 1.00 0.00 H new ATOM 211 N SER A 14 6.367 -15.322 31.632 1.00 0.00 N ATOM 212 CA SER A 14 7.723 -15.298 32.170 1.00 0.00 C ATOM 213 C SER A 14 8.045 -13.921 32.736 1.00 0.00 C ATOM 214 O SER A 14 9.119 -13.704 33.297 1.00 0.00 O ATOM 215 CB SER A 14 8.727 -15.651 31.073 1.00 0.00 C ATOM 216 OG SER A 14 8.281 -16.811 30.383 1.00 0.00 O ATOM 0 H SER A 14 6.305 -15.109 30.636 1.00 0.00 H new ATOM 0 HA SER A 14 7.791 -16.034 32.971 1.00 0.00 H new ATOM 0 HB2 SER A 14 8.831 -14.818 30.378 1.00 0.00 H new ATOM 0 HB3 SER A 14 9.711 -15.828 31.508 1.00 0.00 H new ATOM 0 HG SER A 14 7.515 -16.581 29.817 1.00 0.00 H new ATOM 222 N VAL A 15 7.105 -12.994 32.580 1.00 0.00 N ATOM 223 CA VAL A 15 7.288 -11.634 33.072 1.00 0.00 C ATOM 224 C VAL A 15 8.509 -10.987 32.430 1.00 0.00 C ATOM 225 O VAL A 15 8.382 -10.131 31.557 1.00 0.00 O ATOM 226 CB VAL A 15 7.461 -11.647 34.590 1.00 0.00 C ATOM 227 CG1 VAL A 15 7.339 -10.222 35.130 1.00 0.00 C ATOM 228 CG2 VAL A 15 6.378 -12.527 35.217 1.00 0.00 C ATOM 0 H VAL A 15 6.211 -13.160 32.118 1.00 0.00 H new ATOM 0 HA VAL A 15 6.403 -11.054 32.809 1.00 0.00 H new ATOM 0 HB VAL A 15 8.444 -12.046 34.841 1.00 0.00 H new ATOM 0 HG11 VAL A 15 7.462 -10.231 36.213 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.111 -9.596 34.682 1.00 0.00 H new ATOM 0 HG13 VAL A 15 6.357 -9.821 34.880 1.00 0.00 H new ATOM 0 HG21 VAL A 15 6.500 -12.538 36.300 1.00 0.00 H new ATOM 0 HG22 VAL A 15 5.395 -12.128 34.966 1.00 0.00 H new ATOM 0 HG23 VAL A 15 6.467 -13.543 34.832 1.00 0.00 H new ATOM 238 N ILE A 16 9.694 -11.401 32.867 1.00 0.00 N ATOM 239 CA ILE A 16 10.940 -10.855 32.331 1.00 0.00 C ATOM 240 C ILE A 16 11.458 -11.722 31.188 1.00 0.00 C ATOM 241 O ILE A 16 11.415 -12.951 31.259 1.00 0.00 O ATOM 242 CB ILE A 16 11.987 -10.781 33.439 1.00 0.00 C ATOM 243 CG1 ILE A 16 13.264 -10.140 32.892 1.00 0.00 C ATOM 244 CG2 ILE A 16 12.298 -12.189 33.946 1.00 0.00 C ATOM 245 CD1 ILE A 16 14.233 -9.872 34.045 1.00 0.00 C ATOM 0 H ILE A 16 9.820 -12.111 33.589 1.00 0.00 H new ATOM 0 HA ILE A 16 10.746 -9.854 31.946 1.00 0.00 H new ATOM 0 HB ILE A 16 11.602 -10.178 34.262 1.00 0.00 H new ATOM 0 HG12 ILE A 16 13.729 -10.798 32.158 1.00 0.00 H new ATOM 0 HG13 ILE A 16 13.025 -9.208 32.379 1.00 0.00 H new ATOM 0 HG21 ILE A 16 13.046 -12.134 34.737 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.388 -12.644 34.338 1.00 0.00 H new ATOM 0 HG23 ILE A 16 12.682 -12.795 33.125 1.00 0.00 H new ATOM 0 HD11 ILE A 16 15.143 -9.415 33.657 1.00 0.00 H new ATOM 0 HD12 ILE A 16 13.766 -9.198 34.763 1.00 0.00 H new ATOM 0 HD13 ILE A 16 14.481 -10.812 34.538 1.00 0.00 H new ATOM 257 N GLY A 17 11.939 -11.073 30.132 1.00 0.00 N ATOM 258 CA GLY A 17 12.457 -11.796 28.974 1.00 0.00 C ATOM 259 C GLY A 17 13.578 -12.741 29.384 1.00 0.00 C ATOM 260 O GLY A 17 14.428 -12.392 30.202 1.00 0.00 O ATOM 0 H GLY A 17 11.981 -10.057 30.053 1.00 0.00 H new ATOM 0 HA2 GLY A 17 11.653 -12.361 28.503 1.00 0.00 H new ATOM 0 HA3 GLY A 17 12.826 -11.087 28.232 1.00 0.00 H new ATOM 264 N LYS A 18 13.574 -13.940 28.808 1.00 0.00 N ATOM 265 CA LYS A 18 14.595 -14.934 29.121 1.00 0.00 C ATOM 266 C LYS A 18 14.440 -16.154 28.215 1.00 0.00 C ATOM 267 O LYS A 18 14.275 -17.277 28.694 1.00 0.00 O ATOM 268 CB LYS A 18 14.474 -15.365 30.584 1.00 0.00 C ATOM 269 CG LYS A 18 15.756 -16.082 31.010 1.00 0.00 C ATOM 270 CD LYS A 18 15.584 -16.632 32.424 1.00 0.00 C ATOM 271 CE LYS A 18 16.942 -17.083 32.965 1.00 0.00 C ATOM 272 NZ LYS A 18 16.786 -17.550 34.371 1.00 0.00 N ATOM 0 H LYS A 18 12.879 -14.245 28.126 1.00 0.00 H new ATOM 0 HA LYS A 18 15.576 -14.489 28.955 1.00 0.00 H new ATOM 0 HB2 LYS A 18 14.303 -14.495 31.218 1.00 0.00 H new ATOM 0 HB3 LYS A 18 13.616 -16.025 30.710 1.00 0.00 H new ATOM 0 HG2 LYS A 18 15.979 -16.893 30.317 1.00 0.00 H new ATOM 0 HG3 LYS A 18 16.600 -15.393 30.976 1.00 0.00 H new ATOM 0 HD2 LYS A 18 15.158 -15.868 33.074 1.00 0.00 H new ATOM 0 HD3 LYS A 18 14.887 -17.470 32.417 1.00 0.00 H new ATOM 0 HE2 LYS A 18 17.344 -17.886 32.346 1.00 0.00 H new ATOM 0 HE3 LYS A 18 17.655 -16.259 32.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 17.709 -17.857 34.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 16.421 -16.772 34.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 16.119 -18.348 34.400 1.00 0.00 H new ATOM 286 N PRO A 19 14.482 -15.950 26.924 1.00 0.00 N ATOM 287 CA PRO A 19 14.332 -17.053 25.928 1.00 0.00 C ATOM 288 C PRO A 19 15.482 -18.056 26.009 1.00 0.00 C ATOM 289 O PRO A 19 16.645 -17.673 26.120 1.00 0.00 O ATOM 290 CB PRO A 19 14.316 -16.326 24.571 1.00 0.00 C ATOM 291 CG PRO A 19 14.994 -15.017 24.826 1.00 0.00 C ATOM 292 CD PRO A 19 14.676 -14.646 26.272 1.00 0.00 C ATOM 0 HA PRO A 19 13.433 -17.644 26.100 1.00 0.00 H new ATOM 0 HB2 PRO A 19 14.842 -16.901 23.809 1.00 0.00 H new ATOM 0 HB3 PRO A 19 13.297 -16.180 24.213 1.00 0.00 H new ATOM 0 HG2 PRO A 19 16.070 -15.100 24.673 1.00 0.00 H new ATOM 0 HG3 PRO A 19 14.633 -14.251 24.139 1.00 0.00 H new ATOM 0 HD2 PRO A 19 15.490 -14.084 26.731 1.00 0.00 H new ATOM 0 HD3 PRO A 19 13.782 -14.026 26.340 1.00 0.00 H new ATOM 300 N ILE A 20 15.146 -19.339 25.938 1.00 0.00 N ATOM 301 CA ILE A 20 16.158 -20.392 25.992 1.00 0.00 C ATOM 302 C ILE A 20 16.690 -20.692 24.599 1.00 0.00 C ATOM 303 O ILE A 20 15.920 -20.849 23.657 1.00 0.00 O ATOM 304 CB ILE A 20 15.559 -21.660 26.597 1.00 0.00 C ATOM 305 CG1 ILE A 20 15.087 -21.363 28.025 1.00 0.00 C ATOM 306 CG2 ILE A 20 16.628 -22.756 26.634 1.00 0.00 C ATOM 307 CD1 ILE A 20 14.223 -22.523 28.539 1.00 0.00 C ATOM 0 H ILE A 20 14.188 -19.676 25.844 1.00 0.00 H new ATOM 0 HA ILE A 20 16.982 -20.048 26.616 1.00 0.00 H new ATOM 0 HB ILE A 20 14.715 -21.993 25.993 1.00 0.00 H new ATOM 0 HG12 ILE A 20 15.947 -21.220 28.680 1.00 0.00 H new ATOM 0 HG13 ILE A 20 14.515 -20.435 28.043 1.00 0.00 H new ATOM 0 HG21 ILE A 20 16.204 -23.663 27.065 1.00 0.00 H new ATOM 0 HG22 ILE A 20 16.972 -22.963 25.621 1.00 0.00 H new ATOM 0 HG23 ILE A 20 17.469 -22.424 27.242 1.00 0.00 H new ATOM 0 HD11 ILE A 20 13.890 -22.307 29.554 1.00 0.00 H new ATOM 0 HD12 ILE A 20 13.355 -22.645 27.891 1.00 0.00 H new ATOM 0 HD13 ILE A 20 14.809 -23.442 28.537 1.00 0.00 H new ATOM 319 N GLY A 21 18.009 -20.776 24.470 1.00 0.00 N ATOM 320 CA GLY A 21 18.617 -21.067 23.175 1.00 0.00 C ATOM 321 C GLY A 21 18.666 -22.568 22.931 1.00 0.00 C ATOM 322 O GLY A 21 19.446 -23.284 23.560 1.00 0.00 O ATOM 0 H GLY A 21 18.672 -20.649 25.235 1.00 0.00 H new ATOM 0 HA2 GLY A 21 18.046 -20.583 22.382 1.00 0.00 H new ATOM 0 HA3 GLY A 21 19.625 -20.654 23.140 1.00 0.00 H new ATOM 326 N GLU A 22 17.827 -23.039 22.008 1.00 0.00 N ATOM 327 CA GLU A 22 17.775 -24.462 21.682 1.00 0.00 C ATOM 328 C GLU A 22 16.617 -24.749 20.727 1.00 0.00 C ATOM 329 O GLU A 22 15.915 -23.839 20.288 1.00 0.00 O ATOM 330 CB GLU A 22 17.615 -25.306 22.979 1.00 0.00 C ATOM 331 CG GLU A 22 18.837 -26.205 23.173 1.00 0.00 C ATOM 332 CD GLU A 22 18.708 -26.978 24.474 1.00 0.00 C ATOM 333 OE1 GLU A 22 18.672 -26.344 25.514 1.00 0.00 O ATOM 334 OE2 GLU A 22 18.647 -28.195 24.412 1.00 0.00 O ATOM 0 H GLU A 22 17.178 -22.459 21.476 1.00 0.00 H new ATOM 0 HA GLU A 22 18.709 -24.738 21.193 1.00 0.00 H new ATOM 0 HB2 GLU A 22 17.498 -24.647 23.839 1.00 0.00 H new ATOM 0 HB3 GLU A 22 16.712 -25.914 22.918 1.00 0.00 H new ATOM 0 HG2 GLU A 22 18.927 -26.897 22.336 1.00 0.00 H new ATOM 0 HG3 GLU A 22 19.745 -25.602 23.187 1.00 0.00 H new ATOM 341 N SER A 23 16.425 -26.031 20.425 1.00 0.00 N ATOM 342 CA SER A 23 15.348 -26.444 19.539 1.00 0.00 C ATOM 343 C SER A 23 13.994 -26.100 20.151 1.00 0.00 C ATOM 344 O SER A 23 13.069 -25.703 19.447 1.00 0.00 O ATOM 345 CB SER A 23 15.424 -27.945 19.269 1.00 0.00 C ATOM 346 OG SER A 23 14.197 -28.380 18.699 1.00 0.00 O ATOM 0 H SER A 23 16.999 -26.795 20.780 1.00 0.00 H new ATOM 0 HA SER A 23 15.458 -25.908 18.596 1.00 0.00 H new ATOM 0 HB2 SER A 23 16.251 -28.164 18.593 1.00 0.00 H new ATOM 0 HB3 SER A 23 15.619 -28.484 20.196 1.00 0.00 H new ATOM 0 HG SER A 23 14.339 -28.616 17.758 1.00 0.00 H new ATOM 352 N TYR A 24 13.882 -26.266 21.468 1.00 0.00 N ATOM 353 CA TYR A 24 12.632 -25.973 22.156 1.00 0.00 C ATOM 354 C TYR A 24 12.149 -24.572 21.800 1.00 0.00 C ATOM 355 O TYR A 24 10.964 -24.264 21.919 1.00 0.00 O ATOM 356 CB TYR A 24 12.828 -26.076 23.668 1.00 0.00 C ATOM 357 CG TYR A 24 11.527 -25.756 24.368 1.00 0.00 C ATOM 358 CD1 TYR A 24 10.518 -26.723 24.444 1.00 0.00 C ATOM 359 CD2 TYR A 24 11.332 -24.495 24.944 1.00 0.00 C ATOM 360 CE1 TYR A 24 9.311 -26.427 25.090 1.00 0.00 C ATOM 361 CE2 TYR A 24 10.126 -24.199 25.590 1.00 0.00 C ATOM 362 CZ TYR A 24 9.117 -25.166 25.667 1.00 0.00 C ATOM 363 OH TYR A 24 7.928 -24.875 26.305 1.00 0.00 O ATOM 0 H TYR A 24 14.634 -26.598 22.072 1.00 0.00 H new ATOM 0 HA TYR A 24 11.884 -26.700 21.839 1.00 0.00 H new ATOM 0 HB2 TYR A 24 13.160 -27.079 23.935 1.00 0.00 H new ATOM 0 HB3 TYR A 24 13.607 -25.386 23.992 1.00 0.00 H new ATOM 0 HD1 TYR A 24 10.670 -27.698 24.004 1.00 0.00 H new ATOM 0 HD2 TYR A 24 12.112 -23.750 24.890 1.00 0.00 H new ATOM 0 HE1 TYR A 24 8.530 -27.171 25.143 1.00 0.00 H new ATOM 0 HE2 TYR A 24 9.974 -23.224 26.029 1.00 0.00 H new ATOM 0 HH TYR A 24 7.958 -23.958 26.650 1.00 0.00 H new ATOM 373 N LYS A 25 13.075 -23.726 21.358 1.00 0.00 N ATOM 374 CA LYS A 25 12.731 -22.359 20.976 1.00 0.00 C ATOM 375 C LYS A 25 12.313 -22.305 19.510 1.00 0.00 C ATOM 376 O LYS A 25 11.706 -21.334 19.060 1.00 0.00 O ATOM 377 CB LYS A 25 13.931 -21.438 21.212 1.00 0.00 C ATOM 378 CG LYS A 25 13.540 -19.991 20.902 1.00 0.00 C ATOM 379 CD LYS A 25 14.683 -19.055 21.295 1.00 0.00 C ATOM 380 CE LYS A 25 14.279 -17.606 21.008 1.00 0.00 C ATOM 381 NZ LYS A 25 14.135 -17.413 19.537 1.00 0.00 N ATOM 0 H LYS A 25 14.063 -23.960 21.256 1.00 0.00 H new ATOM 0 HA LYS A 25 11.894 -22.023 21.588 1.00 0.00 H new ATOM 0 HB2 LYS A 25 14.267 -21.520 22.246 1.00 0.00 H new ATOM 0 HB3 LYS A 25 14.765 -21.743 20.580 1.00 0.00 H new ATOM 0 HG2 LYS A 25 13.317 -19.883 19.840 1.00 0.00 H new ATOM 0 HG3 LYS A 25 12.634 -19.724 21.446 1.00 0.00 H new ATOM 0 HD2 LYS A 25 14.918 -19.175 22.352 1.00 0.00 H new ATOM 0 HD3 LYS A 25 15.584 -19.310 20.737 1.00 0.00 H new ATOM 0 HE2 LYS A 25 13.340 -17.373 21.510 1.00 0.00 H new ATOM 0 HE3 LYS A 25 15.030 -16.922 21.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 14.165 -16.397 19.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 14.913 -17.897 19.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 13.227 -17.809 19.222 1.00 0.00 H new ATOM 395 N ARG A 26 12.637 -23.358 18.769 1.00 0.00 N ATOM 396 CA ARG A 26 12.295 -23.421 17.360 1.00 0.00 C ATOM 397 C ARG A 26 10.785 -23.400 17.188 1.00 0.00 C ATOM 398 O ARG A 26 10.263 -22.699 16.328 1.00 0.00 O ATOM 399 CB ARG A 26 12.868 -24.699 16.739 1.00 0.00 C ATOM 400 CG ARG A 26 12.597 -24.704 15.230 1.00 0.00 C ATOM 401 CD ARG A 26 13.103 -26.010 14.620 1.00 0.00 C ATOM 402 NE ARG A 26 13.025 -25.947 13.167 1.00 0.00 N ATOM 403 CZ ARG A 26 13.099 -27.047 12.427 1.00 0.00 C ATOM 404 NH1 ARG A 26 13.240 -28.212 12.999 1.00 0.00 N ATOM 405 NH2 ARG A 26 13.028 -26.963 11.127 1.00 0.00 N ATOM 0 H ARG A 26 13.134 -24.175 19.122 1.00 0.00 H new ATOM 0 HA ARG A 26 12.723 -22.555 16.856 1.00 0.00 H new ATOM 0 HB2 ARG A 26 13.940 -24.757 16.926 1.00 0.00 H new ATOM 0 HB3 ARG A 26 12.415 -25.575 17.203 1.00 0.00 H new ATOM 0 HG2 ARG A 26 11.529 -24.594 15.042 1.00 0.00 H new ATOM 0 HG3 ARG A 26 13.093 -23.855 14.759 1.00 0.00 H new ATOM 0 HD2 ARG A 26 14.133 -26.190 14.929 1.00 0.00 H new ATOM 0 HD3 ARG A 26 12.509 -26.847 14.988 1.00 0.00 H new ATOM 0 HE ARG A 26 12.912 -25.042 12.710 1.00 0.00 H new ATOM 0 HH11 ARG A 26 13.293 -28.278 14.015 1.00 0.00 H new ATOM 0 HH12 ARG A 26 13.297 -29.056 12.429 1.00 0.00 H new ATOM 0 HH21 ARG A 26 12.916 -26.053 10.680 1.00 0.00 H new ATOM 0 HH22 ARG A 26 13.085 -27.807 10.558 1.00 0.00 H new ATOM 419 N ILE A 27 10.089 -24.168 18.017 1.00 0.00 N ATOM 420 CA ILE A 27 8.638 -24.226 17.941 1.00 0.00 C ATOM 421 C ILE A 27 8.040 -22.850 18.200 1.00 0.00 C ATOM 422 O ILE A 27 7.072 -22.444 17.553 1.00 0.00 O ATOM 423 CB ILE A 27 8.098 -25.235 18.963 1.00 0.00 C ATOM 424 CG1 ILE A 27 8.826 -25.044 20.295 1.00 0.00 C ATOM 425 CG2 ILE A 27 8.331 -26.661 18.457 1.00 0.00 C ATOM 426 CD1 ILE A 27 8.115 -25.836 21.388 1.00 0.00 C ATOM 0 H ILE A 27 10.503 -24.754 18.743 1.00 0.00 H new ATOM 0 HA ILE A 27 8.353 -24.548 16.940 1.00 0.00 H new ATOM 0 HB ILE A 27 7.029 -25.072 19.100 1.00 0.00 H new ATOM 0 HG12 ILE A 27 9.860 -25.376 20.206 1.00 0.00 H new ATOM 0 HG13 ILE A 27 8.852 -23.986 20.558 1.00 0.00 H new ATOM 0 HG21 ILE A 27 7.946 -27.373 19.186 1.00 0.00 H new ATOM 0 HG22 ILE A 27 7.814 -26.799 17.507 1.00 0.00 H new ATOM 0 HG23 ILE A 27 9.399 -26.827 18.317 1.00 0.00 H new ATOM 0 HD11 ILE A 27 8.636 -25.698 22.335 1.00 0.00 H new ATOM 0 HD12 ILE A 27 7.088 -25.483 21.484 1.00 0.00 H new ATOM 0 HD13 ILE A 27 8.112 -26.894 21.127 1.00 0.00 H new ATOM 438 N LEU A 28 8.621 -22.143 19.157 1.00 0.00 N ATOM 439 CA LEU A 28 8.156 -20.816 19.509 1.00 0.00 C ATOM 440 C LEU A 28 8.455 -19.836 18.383 1.00 0.00 C ATOM 441 O LEU A 28 7.693 -18.908 18.138 1.00 0.00 O ATOM 442 CB LEU A 28 8.830 -20.348 20.801 1.00 0.00 C ATOM 443 CG LEU A 28 8.220 -19.010 21.254 1.00 0.00 C ATOM 444 CD1 LEU A 28 6.738 -19.201 21.641 1.00 0.00 C ATOM 445 CD2 LEU A 28 9.008 -18.478 22.455 1.00 0.00 C ATOM 0 H LEU A 28 9.418 -22.470 19.704 1.00 0.00 H new ATOM 0 HA LEU A 28 7.078 -20.854 19.665 1.00 0.00 H new ATOM 0 HB2 LEU A 28 8.702 -21.099 21.581 1.00 0.00 H new ATOM 0 HB3 LEU A 28 9.902 -20.234 20.641 1.00 0.00 H new ATOM 0 HG LEU A 28 8.275 -18.294 20.434 1.00 0.00 H new ATOM 0 HD11 LEU A 28 6.319 -18.246 21.960 1.00 0.00 H new ATOM 0 HD12 LEU A 28 6.182 -19.572 20.780 1.00 0.00 H new ATOM 0 HD13 LEU A 28 6.665 -19.920 22.457 1.00 0.00 H new ATOM 0 HD21 LEU A 28 8.580 -17.530 22.780 1.00 0.00 H new ATOM 0 HD22 LEU A 28 8.957 -19.198 23.272 1.00 0.00 H new ATOM 0 HD23 LEU A 28 10.049 -18.327 22.169 1.00 0.00 H new ATOM 457 N ALA A 29 9.588 -20.032 17.721 1.00 0.00 N ATOM 458 CA ALA A 29 9.988 -19.153 16.630 1.00 0.00 C ATOM 459 C ALA A 29 9.082 -19.347 15.418 1.00 0.00 C ATOM 460 O ALA A 29 8.745 -18.391 14.720 1.00 0.00 O ATOM 461 CB ALA A 29 11.438 -19.433 16.239 1.00 0.00 C ATOM 0 H ALA A 29 10.243 -20.788 17.919 1.00 0.00 H new ATOM 0 HA ALA A 29 9.897 -18.122 16.970 1.00 0.00 H new ATOM 0 HB1 ALA A 29 11.729 -18.772 15.423 1.00 0.00 H new ATOM 0 HB2 ALA A 29 12.087 -19.257 17.097 1.00 0.00 H new ATOM 0 HB3 ALA A 29 11.534 -20.470 15.918 1.00 0.00 H new ATOM 467 N LYS A 30 8.695 -20.593 15.170 1.00 0.00 N ATOM 468 CA LYS A 30 7.831 -20.901 14.037 1.00 0.00 C ATOM 469 C LYS A 30 6.655 -19.944 13.986 1.00 0.00 C ATOM 470 O LYS A 30 6.056 -19.738 12.936 1.00 0.00 O ATOM 471 CB LYS A 30 7.324 -22.345 14.144 1.00 0.00 C ATOM 472 CG LYS A 30 8.469 -23.329 13.839 1.00 0.00 C ATOM 473 CD LYS A 30 8.582 -23.557 12.332 1.00 0.00 C ATOM 474 CE LYS A 30 9.725 -24.528 12.047 1.00 0.00 C ATOM 475 NZ LYS A 30 9.881 -24.681 10.573 1.00 0.00 N ATOM 0 H LYS A 30 8.963 -21.400 15.733 1.00 0.00 H new ATOM 0 HA LYS A 30 8.409 -20.789 13.120 1.00 0.00 H new ATOM 0 HB2 LYS A 30 6.933 -22.529 15.145 1.00 0.00 H new ATOM 0 HB3 LYS A 30 6.502 -22.503 13.446 1.00 0.00 H new ATOM 0 HG2 LYS A 30 9.409 -22.936 14.226 1.00 0.00 H new ATOM 0 HG3 LYS A 30 8.288 -24.277 14.345 1.00 0.00 H new ATOM 0 HD2 LYS A 30 7.646 -23.957 11.943 1.00 0.00 H new ATOM 0 HD3 LYS A 30 8.760 -22.610 11.823 1.00 0.00 H new ATOM 0 HE2 LYS A 30 10.651 -24.157 12.486 1.00 0.00 H new ATOM 0 HE3 LYS A 30 9.519 -25.495 12.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 10.890 -24.766 10.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 9.379 -25.536 10.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 9.482 -23.849 10.093 1.00 0.00 H new ATOM 489 N LEU A 31 6.330 -19.363 15.126 1.00 0.00 N ATOM 490 CA LEU A 31 5.217 -18.430 15.201 1.00 0.00 C ATOM 491 C LEU A 31 5.470 -17.234 14.301 1.00 0.00 C ATOM 492 O LEU A 31 4.555 -16.733 13.647 1.00 0.00 O ATOM 493 CB LEU A 31 5.024 -17.965 16.651 1.00 0.00 C ATOM 494 CG LEU A 31 4.253 -19.038 17.442 1.00 0.00 C ATOM 495 CD1 LEU A 31 2.788 -19.122 16.947 1.00 0.00 C ATOM 496 CD2 LEU A 31 4.940 -20.403 17.258 1.00 0.00 C ATOM 0 H LEU A 31 6.817 -19.518 16.009 1.00 0.00 H new ATOM 0 HA LEU A 31 4.312 -18.935 14.864 1.00 0.00 H new ATOM 0 HB2 LEU A 31 5.993 -17.782 17.116 1.00 0.00 H new ATOM 0 HB3 LEU A 31 4.478 -17.022 16.671 1.00 0.00 H new ATOM 0 HG LEU A 31 4.252 -18.767 18.498 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.255 -19.885 17.515 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.300 -18.157 17.088 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.776 -19.383 15.889 1.00 0.00 H new ATOM 0 HD21 LEU A 31 4.395 -21.163 17.818 1.00 0.00 H new ATOM 0 HD22 LEU A 31 4.948 -20.667 16.200 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.965 -20.347 17.625 1.00 0.00 H new ATOM 508 N GLN A 32 6.713 -16.781 14.272 1.00 0.00 N ATOM 509 CA GLN A 32 7.072 -15.641 13.444 1.00 0.00 C ATOM 510 C GLN A 32 6.792 -15.949 11.976 1.00 0.00 C ATOM 511 O GLN A 32 6.212 -15.131 11.263 1.00 0.00 O ATOM 512 CB GLN A 32 8.555 -15.315 13.630 1.00 0.00 C ATOM 513 CG GLN A 32 8.902 -14.030 12.875 1.00 0.00 C ATOM 514 CD GLN A 32 8.203 -12.840 13.523 1.00 0.00 C ATOM 515 OE1 GLN A 32 7.821 -12.905 14.691 1.00 0.00 O ATOM 516 NE2 GLN A 32 8.010 -11.753 12.830 1.00 0.00 N ATOM 0 H GLN A 32 7.484 -17.181 14.807 1.00 0.00 H new ATOM 0 HA GLN A 32 6.473 -14.782 13.745 1.00 0.00 H new ATOM 0 HB2 GLN A 32 8.781 -15.197 14.690 1.00 0.00 H new ATOM 0 HB3 GLN A 32 9.167 -16.139 13.264 1.00 0.00 H new ATOM 0 HG2 GLN A 32 9.981 -13.875 12.880 1.00 0.00 H new ATOM 0 HG3 GLN A 32 8.597 -14.118 11.832 1.00 0.00 H new ATOM 0 HE21 GLN A 32 8.328 -11.702 11.862 1.00 0.00 H new ATOM 0 HE22 GLN A 32 7.541 -10.953 13.256 1.00 0.00 H new ATOM 525 N ARG A 33 7.203 -17.133 11.531 1.00 0.00 N ATOM 526 CA ARG A 33 6.983 -17.532 10.147 1.00 0.00 C ATOM 527 C ARG A 33 5.498 -17.757 9.891 1.00 0.00 C ATOM 528 O ARG A 33 4.962 -17.336 8.867 1.00 0.00 O ATOM 529 CB ARG A 33 7.758 -18.813 9.837 1.00 0.00 C ATOM 530 CG ARG A 33 7.575 -19.175 8.360 1.00 0.00 C ATOM 531 CD ARG A 33 8.427 -20.396 8.022 1.00 0.00 C ATOM 532 NE ARG A 33 9.844 -20.047 8.049 1.00 0.00 N ATOM 533 CZ ARG A 33 10.783 -20.988 8.056 1.00 0.00 C ATOM 534 NH1 ARG A 33 10.444 -22.247 8.054 1.00 0.00 N ATOM 535 NH2 ARG A 33 12.044 -20.651 8.066 1.00 0.00 N ATOM 0 H ARG A 33 7.685 -17.826 12.103 1.00 0.00 H new ATOM 0 HA ARG A 33 7.339 -16.733 9.497 1.00 0.00 H new ATOM 0 HB2 ARG A 33 8.816 -18.674 10.060 1.00 0.00 H new ATOM 0 HB3 ARG A 33 7.403 -19.627 10.469 1.00 0.00 H new ATOM 0 HG2 ARG A 33 6.525 -19.383 8.154 1.00 0.00 H new ATOM 0 HG3 ARG A 33 7.863 -18.333 7.731 1.00 0.00 H new ATOM 0 HD2 ARG A 33 8.229 -21.195 8.736 1.00 0.00 H new ATOM 0 HD3 ARG A 33 8.157 -20.775 7.036 1.00 0.00 H new ATOM 0 HE ARG A 33 10.118 -19.065 8.063 1.00 0.00 H new ATOM 0 HH11 ARG A 33 9.458 -22.510 8.047 1.00 0.00 H new ATOM 0 HH12 ARG A 33 11.164 -22.969 8.059 1.00 0.00 H new ATOM 0 HH21 ARG A 33 12.309 -19.666 8.068 1.00 0.00 H new ATOM 0 HH22 ARG A 33 12.765 -21.373 8.071 1.00 0.00 H new ATOM 549 N ILE A 34 4.840 -18.420 10.836 1.00 0.00 N ATOM 550 CA ILE A 34 3.416 -18.694 10.711 1.00 0.00 C ATOM 551 C ILE A 34 2.634 -17.386 10.674 1.00 0.00 C ATOM 552 O ILE A 34 1.706 -17.233 9.887 1.00 0.00 O ATOM 553 CB ILE A 34 2.939 -19.549 11.889 1.00 0.00 C ATOM 554 CG1 ILE A 34 3.543 -20.954 11.781 1.00 0.00 C ATOM 555 CG2 ILE A 34 1.410 -19.650 11.873 1.00 0.00 C ATOM 556 CD1 ILE A 34 3.330 -21.704 13.098 1.00 0.00 C ATOM 0 H ILE A 34 5.268 -18.775 11.691 1.00 0.00 H new ATOM 0 HA ILE A 34 3.244 -19.239 9.783 1.00 0.00 H new ATOM 0 HB ILE A 34 3.260 -19.084 12.821 1.00 0.00 H new ATOM 0 HG12 ILE A 34 3.077 -21.499 10.960 1.00 0.00 H new ATOM 0 HG13 ILE A 34 4.607 -20.887 11.556 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.077 -20.259 12.713 1.00 0.00 H new ATOM 0 HG22 ILE A 34 0.979 -18.652 11.955 1.00 0.00 H new ATOM 0 HG23 ILE A 34 1.086 -20.110 10.940 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.759 -22.703 13.021 1.00 0.00 H new ATOM 0 HD12 ILE A 34 3.816 -21.161 13.909 1.00 0.00 H new ATOM 0 HD13 ILE A 34 2.262 -21.783 13.303 1.00 0.00 H new ATOM 568 N HIS A 35 3.011 -16.453 11.536 1.00 0.00 N ATOM 569 CA HIS A 35 2.331 -15.165 11.593 1.00 0.00 C ATOM 570 C HIS A 35 2.165 -14.588 10.189 1.00 0.00 C ATOM 571 O HIS A 35 1.045 -14.422 9.705 1.00 0.00 O ATOM 572 CB HIS A 35 3.143 -14.193 12.453 1.00 0.00 C ATOM 573 CG HIS A 35 2.403 -12.890 12.574 1.00 0.00 C ATOM 574 ND1 HIS A 35 3.004 -11.670 12.301 1.00 0.00 N ATOM 575 CD2 HIS A 35 1.112 -12.599 12.938 1.00 0.00 C ATOM 576 CE1 HIS A 35 2.083 -10.710 12.504 1.00 0.00 C ATOM 577 NE2 HIS A 35 0.912 -11.222 12.893 1.00 0.00 N ATOM 0 H HIS A 35 3.777 -16.561 12.201 1.00 0.00 H new ATOM 0 HA HIS A 35 1.344 -15.308 12.034 1.00 0.00 H new ATOM 0 HB2 HIS A 35 3.312 -14.620 13.441 1.00 0.00 H new ATOM 0 HB3 HIS A 35 4.123 -14.026 12.005 1.00 0.00 H new ATOM 0 HD2 HIS A 35 0.365 -13.327 13.217 1.00 0.00 H new ATOM 0 HE1 HIS A 35 2.268 -9.655 12.369 1.00 0.00 H new ATOM 0 HE2 HIS A 35 0.055 -10.713 13.110 1.00 0.00 H new ATOM 585 N ASN A 36 3.285 -14.292 9.539 1.00 0.00 N ATOM 586 CA ASN A 36 3.252 -13.744 8.188 1.00 0.00 C ATOM 587 C ASN A 36 2.726 -14.777 7.194 1.00 0.00 C ATOM 588 O ASN A 36 1.949 -14.452 6.297 1.00 0.00 O ATOM 589 CB ASN A 36 4.655 -13.302 7.769 1.00 0.00 C ATOM 590 CG ASN A 36 4.638 -12.806 6.327 1.00 0.00 C ATOM 591 OD1 ASN A 36 3.680 -12.161 5.901 1.00 0.00 O ATOM 592 ND2 ASN A 36 5.647 -13.075 5.543 1.00 0.00 N ATOM 0 H ASN A 36 4.221 -14.421 9.922 1.00 0.00 H new ATOM 0 HA ASN A 36 2.582 -12.885 8.186 1.00 0.00 H new ATOM 0 HB2 ASN A 36 5.008 -12.511 8.430 1.00 0.00 H new ATOM 0 HB3 ASN A 36 5.352 -14.134 7.868 1.00 0.00 H new ATOM 0 HD21 ASN A 36 5.642 -12.751 4.576 1.00 0.00 H new ATOM 0 HD22 ASN A 36 6.440 -13.610 5.898 1.00 0.00 H new ATOM 599 N SER A 37 3.164 -16.019 7.360 1.00 0.00 N ATOM 600 CA SER A 37 2.747 -17.106 6.477 1.00 0.00 C ATOM 601 C SER A 37 1.425 -17.701 6.946 1.00 0.00 C ATOM 602 O SER A 37 1.077 -18.827 6.588 1.00 0.00 O ATOM 603 CB SER A 37 3.818 -18.195 6.437 1.00 0.00 C ATOM 604 OG SER A 37 5.090 -17.593 6.232 1.00 0.00 O ATOM 0 H SER A 37 3.809 -16.301 8.098 1.00 0.00 H new ATOM 0 HA SER A 37 2.613 -16.699 5.475 1.00 0.00 H new ATOM 0 HB2 SER A 37 3.815 -18.759 7.370 1.00 0.00 H new ATOM 0 HB3 SER A 37 3.604 -18.903 5.636 1.00 0.00 H new ATOM 0 HG SER A 37 5.465 -17.319 7.095 1.00 0.00 H new ATOM 610 N ASN A 38 0.701 -16.948 7.766 1.00 0.00 N ATOM 611 CA ASN A 38 -0.572 -17.419 8.291 1.00 0.00 C ATOM 612 C ASN A 38 -1.418 -18.005 7.178 1.00 0.00 C ATOM 613 O ASN A 38 -1.422 -17.483 6.066 1.00 0.00 O ATOM 614 CB ASN A 38 -1.331 -16.263 8.945 1.00 0.00 C ATOM 615 CG ASN A 38 -1.506 -15.118 7.950 1.00 0.00 C ATOM 616 OD1 ASN A 38 -1.250 -15.279 6.759 1.00 0.00 O ATOM 617 ND2 ASN A 38 -1.926 -13.958 8.372 1.00 0.00 N ATOM 0 H ASN A 38 0.972 -16.016 8.079 1.00 0.00 H new ATOM 0 HA ASN A 38 -0.372 -18.191 9.034 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -2.306 -16.607 9.290 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -0.788 -15.912 9.823 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -2.041 -13.187 7.714 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -2.139 -13.821 9.360 1.00 0.00 H new ATOM 624 N ILE A 39 -2.135 -19.093 7.485 1.00 0.00 N ATOM 625 CA ILE A 39 -2.994 -19.751 6.498 1.00 0.00 C ATOM 626 C ILE A 39 -2.431 -19.609 5.092 1.00 0.00 C ATOM 627 O ILE A 39 -3.139 -19.222 4.164 1.00 0.00 O ATOM 628 CB ILE A 39 -4.398 -19.163 6.558 1.00 0.00 C ATOM 629 CG1 ILE A 39 -4.315 -17.654 6.434 1.00 0.00 C ATOM 630 CG2 ILE A 39 -5.054 -19.536 7.889 1.00 0.00 C ATOM 631 CD1 ILE A 39 -5.710 -17.080 6.228 1.00 0.00 C ATOM 0 H ILE A 39 -2.136 -19.533 8.405 1.00 0.00 H new ATOM 0 HA ILE A 39 -3.034 -20.813 6.739 1.00 0.00 H new ATOM 0 HB ILE A 39 -4.997 -19.562 5.739 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.865 -17.230 7.332 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.672 -17.383 5.597 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -6.058 -19.115 7.930 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -5.112 -20.621 7.975 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -4.460 -19.138 8.712 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -5.648 -15.995 6.139 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -6.143 -17.494 5.318 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -6.339 -17.339 7.080 1.00 0.00 H new ATOM 643 N LEU A 40 -1.141 -19.908 4.945 1.00 0.00 N ATOM 644 CA LEU A 40 -0.479 -19.792 3.650 1.00 0.00 C ATOM 645 C LEU A 40 -0.302 -21.166 3.024 1.00 0.00 C ATOM 646 O LEU A 40 0.148 -22.102 3.681 1.00 0.00 O ATOM 647 CB LEU A 40 0.893 -19.128 3.815 1.00 0.00 C ATOM 648 CG LEU A 40 1.494 -18.834 2.429 1.00 0.00 C ATOM 649 CD1 LEU A 40 0.648 -17.771 1.692 1.00 0.00 C ATOM 650 CD2 LEU A 40 2.932 -18.330 2.592 1.00 0.00 C ATOM 0 H LEU A 40 -0.538 -20.230 5.702 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.101 -19.178 2.999 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.795 -18.203 4.384 1.00 0.00 H new ATOM 0 HB3 LEU A 40 1.558 -19.781 4.380 1.00 0.00 H new ATOM 0 HG LEU A 40 1.493 -19.751 1.840 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.085 -17.573 0.713 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.370 -18.139 1.567 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.632 -16.850 2.275 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.358 -18.122 1.611 1.00 0.00 H new ATOM 0 HD22 LEU A 40 2.932 -17.418 3.189 1.00 0.00 H new ATOM 0 HD23 LEU A 40 3.530 -19.091 3.093 1.00 0.00 H new ATOM 662 N ASP A 41 -0.662 -21.278 1.749 1.00 0.00 N ATOM 663 CA ASP A 41 -0.545 -22.547 1.041 1.00 0.00 C ATOM 664 C ASP A 41 0.760 -23.247 1.393 1.00 0.00 C ATOM 665 O ASP A 41 0.814 -24.474 1.477 1.00 0.00 O ATOM 666 CB ASP A 41 -0.617 -22.314 -0.469 1.00 0.00 C ATOM 667 CG ASP A 41 -2.013 -21.836 -0.862 1.00 0.00 C ATOM 668 OD1 ASP A 41 -2.912 -21.953 -0.046 1.00 0.00 O ATOM 669 OD2 ASP A 41 -2.160 -21.356 -1.974 1.00 0.00 O ATOM 0 H ASP A 41 -1.034 -20.511 1.189 1.00 0.00 H new ATOM 0 HA ASP A 41 -1.373 -23.186 1.348 1.00 0.00 H new ATOM 0 HB2 ASP A 41 0.126 -21.574 -0.766 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -0.378 -23.236 -0.999 1.00 0.00 H new ATOM 674 N GLU A 42 1.803 -22.462 1.602 1.00 0.00 N ATOM 675 CA GLU A 42 3.100 -23.015 1.956 1.00 0.00 C ATOM 676 C GLU A 42 3.112 -23.486 3.404 1.00 0.00 C ATOM 677 O GLU A 42 3.669 -24.537 3.724 1.00 0.00 O ATOM 678 CB GLU A 42 4.184 -21.964 1.754 1.00 0.00 C ATOM 679 CG GLU A 42 4.374 -21.699 0.259 1.00 0.00 C ATOM 680 CD GLU A 42 5.441 -20.630 0.046 1.00 0.00 C ATOM 681 OE1 GLU A 42 5.978 -20.150 1.031 1.00 0.00 O ATOM 682 OE2 GLU A 42 5.708 -20.309 -1.100 1.00 0.00 O ATOM 0 H GLU A 42 1.778 -21.445 1.533 1.00 0.00 H new ATOM 0 HA GLU A 42 3.294 -23.871 1.310 1.00 0.00 H new ATOM 0 HB2 GLU A 42 3.909 -21.041 2.265 1.00 0.00 H new ATOM 0 HB3 GLU A 42 5.121 -22.305 2.195 1.00 0.00 H new ATOM 0 HG2 GLU A 42 4.665 -22.620 -0.247 1.00 0.00 H new ATOM 0 HG3 GLU A 42 3.432 -21.376 -0.183 1.00 0.00 H new ATOM 689 N ARG A 43 2.509 -22.694 4.280 1.00 0.00 N ATOM 690 CA ARG A 43 2.471 -23.037 5.690 1.00 0.00 C ATOM 691 C ARG A 43 1.529 -24.208 5.941 1.00 0.00 C ATOM 692 O ARG A 43 1.635 -24.896 6.955 1.00 0.00 O ATOM 693 CB ARG A 43 2.014 -21.827 6.511 1.00 0.00 C ATOM 694 CG ARG A 43 2.184 -22.112 8.029 1.00 0.00 C ATOM 695 CD ARG A 43 0.848 -22.533 8.646 1.00 0.00 C ATOM 696 NE ARG A 43 0.020 -21.361 8.890 1.00 0.00 N ATOM 697 CZ ARG A 43 -0.909 -21.367 9.837 1.00 0.00 C ATOM 698 NH1 ARG A 43 -1.092 -22.436 10.559 1.00 0.00 N ATOM 699 NH2 ARG A 43 -1.639 -20.307 10.042 1.00 0.00 N ATOM 0 H ARG A 43 2.044 -21.818 4.040 1.00 0.00 H new ATOM 0 HA ARG A 43 3.476 -23.328 5.996 1.00 0.00 H new ATOM 0 HB2 ARG A 43 2.595 -20.948 6.231 1.00 0.00 H new ATOM 0 HB3 ARG A 43 0.970 -21.602 6.291 1.00 0.00 H new ATOM 0 HG2 ARG A 43 2.924 -22.898 8.177 1.00 0.00 H new ATOM 0 HG3 ARG A 43 2.560 -21.222 8.533 1.00 0.00 H new ATOM 0 HD2 ARG A 43 0.330 -23.221 7.978 1.00 0.00 H new ATOM 0 HD3 ARG A 43 1.022 -23.066 9.581 1.00 0.00 H new ATOM 0 HE ARG A 43 0.156 -20.523 8.325 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -0.522 -23.266 10.395 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -1.806 -22.443 11.288 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -1.496 -19.472 9.474 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -2.353 -20.313 10.770 1.00 0.00 H new ATOM 713 N GLN A 44 0.601 -24.425 5.017 1.00 0.00 N ATOM 714 CA GLN A 44 -0.357 -25.514 5.160 1.00 0.00 C ATOM 715 C GLN A 44 0.364 -26.829 5.432 1.00 0.00 C ATOM 716 O GLN A 44 -0.078 -27.628 6.257 1.00 0.00 O ATOM 717 CB GLN A 44 -1.202 -25.642 3.887 1.00 0.00 C ATOM 718 CG GLN A 44 -2.209 -24.493 3.817 1.00 0.00 C ATOM 719 CD GLN A 44 -3.094 -24.648 2.583 1.00 0.00 C ATOM 720 OE1 GLN A 44 -2.992 -25.645 1.867 1.00 0.00 O ATOM 721 NE2 GLN A 44 -3.960 -23.717 2.291 1.00 0.00 N ATOM 0 H GLN A 44 0.492 -23.868 4.169 1.00 0.00 H new ATOM 0 HA GLN A 44 -1.009 -25.290 6.004 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -0.557 -25.627 3.008 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -1.726 -26.598 3.882 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -2.824 -24.483 4.717 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -1.683 -23.539 3.780 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -4.042 -22.892 2.886 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -4.555 -23.814 1.468 1.00 0.00 H new ATOM 730 N GLY A 45 1.480 -27.044 4.744 1.00 0.00 N ATOM 731 CA GLY A 45 2.255 -28.260 4.930 1.00 0.00 C ATOM 732 C GLY A 45 2.912 -28.270 6.302 1.00 0.00 C ATOM 733 O GLY A 45 2.912 -29.284 6.998 1.00 0.00 O ATOM 0 H GLY A 45 1.864 -26.395 4.057 1.00 0.00 H new ATOM 0 HA2 GLY A 45 1.607 -29.130 4.824 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.018 -28.334 4.155 1.00 0.00 H new ATOM 737 N LEU A 46 3.474 -27.130 6.686 1.00 0.00 N ATOM 738 CA LEU A 46 4.133 -27.017 7.974 1.00 0.00 C ATOM 739 C LEU A 46 3.110 -27.166 9.104 1.00 0.00 C ATOM 740 O LEU A 46 3.401 -27.718 10.163 1.00 0.00 O ATOM 741 CB LEU A 46 4.858 -25.659 8.085 1.00 0.00 C ATOM 742 CG LEU A 46 6.114 -25.801 8.955 1.00 0.00 C ATOM 743 CD1 LEU A 46 6.850 -24.464 9.011 1.00 0.00 C ATOM 744 CD2 LEU A 46 5.729 -26.241 10.378 1.00 0.00 C ATOM 0 H LEU A 46 3.485 -26.278 6.125 1.00 0.00 H new ATOM 0 HA LEU A 46 4.871 -27.814 8.062 1.00 0.00 H new ATOM 0 HB2 LEU A 46 5.132 -25.302 7.092 1.00 0.00 H new ATOM 0 HB3 LEU A 46 4.189 -24.915 8.517 1.00 0.00 H new ATOM 0 HG LEU A 46 6.765 -26.558 8.517 1.00 0.00 H new ATOM 0 HD11 LEU A 46 7.742 -24.565 9.629 1.00 0.00 H new ATOM 0 HD12 LEU A 46 7.139 -24.165 8.003 1.00 0.00 H new ATOM 0 HD13 LEU A 46 6.195 -23.706 9.441 1.00 0.00 H new ATOM 0 HD21 LEU A 46 6.629 -26.338 10.985 1.00 0.00 H new ATOM 0 HD22 LEU A 46 5.070 -25.496 10.823 1.00 0.00 H new ATOM 0 HD23 LEU A 46 5.215 -27.201 10.335 1.00 0.00 H new ATOM 756 N MET A 47 1.916 -26.646 8.868 1.00 0.00 N ATOM 757 CA MET A 47 0.863 -26.703 9.870 1.00 0.00 C ATOM 758 C MET A 47 0.713 -28.125 10.403 1.00 0.00 C ATOM 759 O MET A 47 0.587 -28.334 11.609 1.00 0.00 O ATOM 760 CB MET A 47 -0.465 -26.254 9.256 1.00 0.00 C ATOM 761 CG MET A 47 -1.495 -26.010 10.364 1.00 0.00 C ATOM 762 SD MET A 47 -3.163 -26.091 9.668 1.00 0.00 S ATOM 763 CE MET A 47 -3.062 -24.592 8.664 1.00 0.00 C ATOM 0 H MET A 47 1.653 -26.183 7.998 1.00 0.00 H new ATOM 0 HA MET A 47 1.131 -26.039 10.691 1.00 0.00 H new ATOM 0 HB2 MET A 47 -0.318 -25.342 8.677 1.00 0.00 H new ATOM 0 HB3 MET A 47 -0.833 -27.014 8.567 1.00 0.00 H new ATOM 0 HG2 MET A 47 -1.382 -26.756 11.151 1.00 0.00 H new ATOM 0 HG3 MET A 47 -1.328 -25.035 10.822 1.00 0.00 H new ATOM 0 HE1 MET A 47 -4.040 -24.375 8.234 1.00 0.00 H new ATOM 0 HE2 MET A 47 -2.747 -23.756 9.289 1.00 0.00 H new ATOM 0 HE3 MET A 47 -2.338 -24.739 7.863 1.00 0.00 H new ATOM 773 N HIS A 48 0.724 -29.099 9.498 1.00 0.00 N ATOM 774 CA HIS A 48 0.584 -30.495 9.895 1.00 0.00 C ATOM 775 C HIS A 48 1.732 -30.916 10.808 1.00 0.00 C ATOM 776 O HIS A 48 1.512 -31.502 11.868 1.00 0.00 O ATOM 777 CB HIS A 48 0.567 -31.390 8.655 1.00 0.00 C ATOM 778 CG HIS A 48 -0.708 -31.165 7.891 1.00 0.00 C ATOM 779 ND1 HIS A 48 -0.822 -30.189 6.914 1.00 0.00 N ATOM 780 CD2 HIS A 48 -1.933 -31.782 7.951 1.00 0.00 C ATOM 781 CE1 HIS A 48 -2.076 -30.246 6.430 1.00 0.00 C ATOM 782 NE2 HIS A 48 -2.795 -31.199 7.026 1.00 0.00 N ATOM 0 H HIS A 48 0.827 -28.949 8.494 1.00 0.00 H new ATOM 0 HA HIS A 48 -0.355 -30.603 10.439 1.00 0.00 H new ATOM 0 HB2 HIS A 48 1.426 -31.169 8.022 1.00 0.00 H new ATOM 0 HB3 HIS A 48 0.648 -32.437 8.948 1.00 0.00 H new ATOM 0 HD1 HIS A 48 -0.089 -29.545 6.616 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -2.189 -32.595 8.614 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -2.455 -29.599 5.653 1.00 0.00 H new ATOM 790 N GLU A 49 2.954 -30.611 10.390 1.00 0.00 N ATOM 791 CA GLU A 49 4.127 -30.960 11.181 1.00 0.00 C ATOM 792 C GLU A 49 4.127 -30.184 12.487 1.00 0.00 C ATOM 793 O GLU A 49 4.649 -30.650 13.500 1.00 0.00 O ATOM 794 CB GLU A 49 5.404 -30.660 10.392 1.00 0.00 C ATOM 795 CG GLU A 49 6.629 -31.062 11.218 1.00 0.00 C ATOM 796 CD GLU A 49 7.899 -30.860 10.401 1.00 0.00 C ATOM 797 OE1 GLU A 49 7.789 -30.731 9.193 1.00 0.00 O ATOM 798 OE2 GLU A 49 8.964 -30.832 10.996 1.00 0.00 O ATOM 0 H GLU A 49 3.158 -30.127 9.516 1.00 0.00 H new ATOM 0 HA GLU A 49 4.094 -32.026 11.405 1.00 0.00 H new ATOM 0 HB2 GLU A 49 5.396 -31.205 9.448 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.451 -29.599 10.148 1.00 0.00 H new ATOM 0 HG2 GLU A 49 6.675 -30.466 12.129 1.00 0.00 H new ATOM 0 HG3 GLU A 49 6.545 -32.105 11.523 1.00 0.00 H new ATOM 805 N LEU A 50 3.560 -28.988 12.454 1.00 0.00 N ATOM 806 CA LEU A 50 3.522 -28.157 13.641 1.00 0.00 C ATOM 807 C LEU A 50 2.730 -28.850 14.749 1.00 0.00 C ATOM 808 O LEU A 50 3.150 -28.892 15.905 1.00 0.00 O ATOM 809 CB LEU A 50 2.865 -26.799 13.300 1.00 0.00 C ATOM 810 CG LEU A 50 3.436 -25.692 14.206 1.00 0.00 C ATOM 811 CD1 LEU A 50 3.266 -26.086 15.679 1.00 0.00 C ATOM 812 CD2 LEU A 50 4.940 -25.477 13.890 1.00 0.00 C ATOM 0 H LEU A 50 3.125 -28.577 11.628 1.00 0.00 H new ATOM 0 HA LEU A 50 4.541 -27.992 13.990 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.045 -26.552 12.254 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.785 -26.866 13.431 1.00 0.00 H new ATOM 0 HG LEU A 50 2.895 -24.764 14.019 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.672 -25.299 16.315 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.207 -26.221 15.900 1.00 0.00 H new ATOM 0 HD13 LEU A 50 3.798 -27.018 15.870 1.00 0.00 H new ATOM 0 HD21 LEU A 50 5.339 -24.693 14.534 1.00 0.00 H new ATOM 0 HD22 LEU A 50 5.485 -26.404 14.067 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.054 -25.183 12.847 1.00 0.00 H new ATOM 824 N MET A 51 1.577 -29.382 14.386 1.00 0.00 N ATOM 825 CA MET A 51 0.731 -30.055 15.357 1.00 0.00 C ATOM 826 C MET A 51 1.416 -31.309 15.883 1.00 0.00 C ATOM 827 O MET A 51 1.396 -31.585 17.082 1.00 0.00 O ATOM 828 CB MET A 51 -0.606 -30.427 14.712 1.00 0.00 C ATOM 829 CG MET A 51 -1.533 -31.060 15.759 1.00 0.00 C ATOM 830 SD MET A 51 -1.112 -32.808 15.970 1.00 0.00 S ATOM 831 CE MET A 51 -2.148 -33.452 14.635 1.00 0.00 C ATOM 0 H MET A 51 1.207 -29.362 13.436 1.00 0.00 H new ATOM 0 HA MET A 51 0.553 -29.378 16.192 1.00 0.00 H new ATOM 0 HB2 MET A 51 -1.075 -29.539 14.288 1.00 0.00 H new ATOM 0 HB3 MET A 51 -0.442 -31.124 13.890 1.00 0.00 H new ATOM 0 HG2 MET A 51 -1.436 -30.535 16.709 1.00 0.00 H new ATOM 0 HG3 MET A 51 -2.572 -30.962 15.445 1.00 0.00 H new ATOM 0 HE1 MET A 51 -2.097 -34.541 14.628 1.00 0.00 H new ATOM 0 HE2 MET A 51 -3.180 -33.138 14.792 1.00 0.00 H new ATOM 0 HE3 MET A 51 -1.792 -33.066 13.680 1.00 0.00 H new ATOM 841 N GLU A 52 2.017 -32.070 14.975 1.00 0.00 N ATOM 842 CA GLU A 52 2.702 -33.300 15.354 1.00 0.00 C ATOM 843 C GLU A 52 3.966 -32.986 16.141 1.00 0.00 C ATOM 844 O GLU A 52 4.301 -33.680 17.103 1.00 0.00 O ATOM 845 CB GLU A 52 3.062 -34.103 14.101 1.00 0.00 C ATOM 846 CG GLU A 52 1.781 -34.553 13.396 1.00 0.00 C ATOM 847 CD GLU A 52 1.059 -35.604 14.232 1.00 0.00 C ATOM 848 OE1 GLU A 52 1.632 -36.053 15.211 1.00 0.00 O ATOM 849 OE2 GLU A 52 -0.065 -35.934 13.892 1.00 0.00 O ATOM 0 H GLU A 52 2.044 -31.859 13.977 1.00 0.00 H new ATOM 0 HA GLU A 52 2.034 -33.889 15.983 1.00 0.00 H new ATOM 0 HB2 GLU A 52 3.666 -33.495 13.427 1.00 0.00 H new ATOM 0 HB3 GLU A 52 3.664 -34.970 14.373 1.00 0.00 H new ATOM 0 HG2 GLU A 52 1.127 -33.696 13.233 1.00 0.00 H new ATOM 0 HG3 GLU A 52 2.022 -34.962 12.415 1.00 0.00 H new ATOM 856 N LEU A 53 4.666 -31.940 15.724 1.00 0.00 N ATOM 857 CA LEU A 53 5.896 -31.550 16.394 1.00 0.00 C ATOM 858 C LEU A 53 5.618 -31.173 17.844 1.00 0.00 C ATOM 859 O LEU A 53 6.370 -31.542 18.747 1.00 0.00 O ATOM 860 CB LEU A 53 6.535 -30.360 15.665 1.00 0.00 C ATOM 861 CG LEU A 53 7.807 -29.910 16.403 1.00 0.00 C ATOM 862 CD1 LEU A 53 8.803 -31.079 16.489 1.00 0.00 C ATOM 863 CD2 LEU A 53 8.445 -28.741 15.651 1.00 0.00 C ATOM 0 H LEU A 53 4.406 -31.352 14.932 1.00 0.00 H new ATOM 0 HA LEU A 53 6.583 -32.396 16.376 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.779 -30.640 14.640 1.00 0.00 H new ATOM 0 HB3 LEU A 53 5.826 -29.534 15.609 1.00 0.00 H new ATOM 0 HG LEU A 53 7.545 -29.592 17.412 1.00 0.00 H new ATOM 0 HD11 LEU A 53 9.702 -30.753 17.013 1.00 0.00 H new ATOM 0 HD12 LEU A 53 8.346 -31.907 17.032 1.00 0.00 H new ATOM 0 HD13 LEU A 53 9.068 -31.406 15.484 1.00 0.00 H new ATOM 0 HD21 LEU A 53 9.347 -28.421 16.173 1.00 0.00 H new ATOM 0 HD22 LEU A 53 8.704 -29.056 14.640 1.00 0.00 H new ATOM 0 HD23 LEU A 53 7.740 -27.911 15.603 1.00 0.00 H new ATOM 875 N ILE A 54 4.542 -30.431 18.056 1.00 0.00 N ATOM 876 CA ILE A 54 4.179 -30.002 19.397 1.00 0.00 C ATOM 877 C ILE A 54 3.872 -31.205 20.276 1.00 0.00 C ATOM 878 O ILE A 54 4.263 -31.248 21.438 1.00 0.00 O ATOM 879 CB ILE A 54 2.968 -29.068 19.352 1.00 0.00 C ATOM 880 CG1 ILE A 54 3.384 -27.729 18.706 1.00 0.00 C ATOM 881 CG2 ILE A 54 2.444 -28.821 20.780 1.00 0.00 C ATOM 882 CD1 ILE A 54 3.955 -26.766 19.764 1.00 0.00 C ATOM 0 H ILE A 54 3.909 -30.115 17.322 1.00 0.00 H new ATOM 0 HA ILE A 54 5.025 -29.461 19.822 1.00 0.00 H new ATOM 0 HB ILE A 54 2.175 -29.527 18.761 1.00 0.00 H new ATOM 0 HG12 ILE A 54 4.130 -27.910 17.932 1.00 0.00 H new ATOM 0 HG13 ILE A 54 2.523 -27.272 18.219 1.00 0.00 H new ATOM 0 HG21 ILE A 54 1.582 -28.155 20.741 1.00 0.00 H new ATOM 0 HG22 ILE A 54 2.150 -29.770 21.229 1.00 0.00 H new ATOM 0 HG23 ILE A 54 3.229 -28.363 21.382 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.242 -25.829 19.286 1.00 0.00 H new ATOM 0 HD12 ILE A 54 3.198 -26.570 20.523 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.830 -27.217 20.232 1.00 0.00 H new ATOM 894 N ASP A 55 3.161 -32.172 19.714 1.00 0.00 N ATOM 895 CA ASP A 55 2.784 -33.361 20.455 1.00 0.00 C ATOM 896 C ASP A 55 4.022 -34.082 20.960 1.00 0.00 C ATOM 897 O ASP A 55 3.989 -34.736 22.001 1.00 0.00 O ATOM 898 CB ASP A 55 1.972 -34.297 19.558 1.00 0.00 C ATOM 899 CG ASP A 55 0.603 -33.689 19.269 1.00 0.00 C ATOM 900 OD1 ASP A 55 0.227 -32.762 19.968 1.00 0.00 O ATOM 901 OD2 ASP A 55 -0.049 -34.159 18.350 1.00 0.00 O ATOM 0 H ASP A 55 2.835 -32.154 18.748 1.00 0.00 H new ATOM 0 HA ASP A 55 2.176 -33.063 21.309 1.00 0.00 H new ATOM 0 HB2 ASP A 55 2.506 -34.472 18.624 1.00 0.00 H new ATOM 0 HB3 ASP A 55 1.853 -35.266 20.043 1.00 0.00 H new ATOM 906 N LEU A 56 5.112 -33.967 20.216 1.00 0.00 N ATOM 907 CA LEU A 56 6.359 -34.615 20.602 1.00 0.00 C ATOM 908 C LEU A 56 7.144 -33.742 21.574 1.00 0.00 C ATOM 909 O LEU A 56 7.923 -34.243 22.383 1.00 0.00 O ATOM 910 CB LEU A 56 7.209 -34.887 19.363 1.00 0.00 C ATOM 911 CG LEU A 56 6.461 -35.852 18.433 1.00 0.00 C ATOM 912 CD1 LEU A 56 7.228 -35.985 17.113 1.00 0.00 C ATOM 913 CD2 LEU A 56 6.325 -37.238 19.099 1.00 0.00 C ATOM 0 H LEU A 56 5.160 -33.435 19.347 1.00 0.00 H new ATOM 0 HA LEU A 56 6.117 -35.557 21.094 1.00 0.00 H new ATOM 0 HB2 LEU A 56 7.421 -33.953 18.842 1.00 0.00 H new ATOM 0 HB3 LEU A 56 8.168 -35.315 19.654 1.00 0.00 H new ATOM 0 HG LEU A 56 5.464 -35.458 18.238 1.00 0.00 H new ATOM 0 HD11 LEU A 56 6.698 -36.670 16.452 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.305 -35.008 16.637 1.00 0.00 H new ATOM 0 HD13 LEU A 56 8.228 -36.372 17.310 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.793 -37.913 18.429 1.00 0.00 H new ATOM 0 HD22 LEU A 56 7.316 -37.641 19.307 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.770 -37.140 20.032 1.00 0.00 H new ATOM 925 N TYR A 57 6.944 -32.434 21.476 1.00 0.00 N ATOM 926 CA TYR A 57 7.646 -31.488 22.342 1.00 0.00 C ATOM 927 C TYR A 57 6.881 -31.273 23.644 1.00 0.00 C ATOM 928 O TYR A 57 7.465 -30.920 24.668 1.00 0.00 O ATOM 929 CB TYR A 57 7.822 -30.148 21.609 1.00 0.00 C ATOM 930 CG TYR A 57 9.080 -30.184 20.767 1.00 0.00 C ATOM 931 CD1 TYR A 57 9.281 -31.227 19.853 1.00 0.00 C ATOM 932 CD2 TYR A 57 10.049 -29.183 20.906 1.00 0.00 C ATOM 933 CE1 TYR A 57 10.446 -31.265 19.079 1.00 0.00 C ATOM 934 CE2 TYR A 57 11.211 -29.220 20.131 1.00 0.00 C ATOM 935 CZ TYR A 57 11.411 -30.263 19.220 1.00 0.00 C ATOM 936 OH TYR A 57 12.559 -30.299 18.456 1.00 0.00 O ATOM 0 H TYR A 57 6.304 -32.002 20.809 1.00 0.00 H new ATOM 0 HA TYR A 57 8.625 -31.901 22.585 1.00 0.00 H new ATOM 0 HB2 TYR A 57 6.956 -29.953 20.977 1.00 0.00 H new ATOM 0 HB3 TYR A 57 7.880 -29.333 22.331 1.00 0.00 H new ATOM 0 HD1 TYR A 57 8.536 -32.002 19.746 1.00 0.00 H new ATOM 0 HD2 TYR A 57 9.898 -28.381 21.613 1.00 0.00 H new ATOM 0 HE1 TYR A 57 10.600 -32.068 18.373 1.00 0.00 H new ATOM 0 HE2 TYR A 57 11.955 -28.444 20.235 1.00 0.00 H new ATOM 0 HH TYR A 57 13.239 -29.720 18.860 1.00 0.00 H new ATOM 946 N GLU A 58 5.573 -31.464 23.592 1.00 0.00 N ATOM 947 CA GLU A 58 4.747 -31.265 24.769 1.00 0.00 C ATOM 948 C GLU A 58 5.100 -32.288 25.853 1.00 0.00 C ATOM 949 O GLU A 58 5.070 -31.997 27.046 1.00 0.00 O ATOM 950 CB GLU A 58 3.261 -31.387 24.393 1.00 0.00 C ATOM 951 CG GLU A 58 2.828 -32.859 24.401 1.00 0.00 C ATOM 952 CD GLU A 58 1.457 -33.012 23.768 1.00 0.00 C ATOM 953 OE1 GLU A 58 0.846 -32.001 23.474 1.00 0.00 O ATOM 954 OE2 GLU A 58 1.036 -34.143 23.594 1.00 0.00 O ATOM 0 H GLU A 58 5.065 -31.754 22.756 1.00 0.00 H new ATOM 0 HA GLU A 58 4.936 -30.266 25.162 1.00 0.00 H new ATOM 0 HB2 GLU A 58 2.653 -30.818 25.097 1.00 0.00 H new ATOM 0 HB3 GLU A 58 3.092 -30.957 23.406 1.00 0.00 H new ATOM 0 HG2 GLU A 58 3.556 -33.461 23.857 1.00 0.00 H new ATOM 0 HG3 GLU A 58 2.806 -33.233 25.425 1.00 0.00 H new ATOM 961 N GLU A 59 5.394 -33.505 25.419 1.00 0.00 N ATOM 962 CA GLU A 59 5.740 -34.580 26.341 1.00 0.00 C ATOM 963 C GLU A 59 7.250 -34.609 26.574 1.00 0.00 C ATOM 964 O GLU A 59 7.737 -35.290 27.474 1.00 0.00 O ATOM 965 CB GLU A 59 5.266 -35.927 25.790 1.00 0.00 C ATOM 966 CG GLU A 59 5.430 -37.005 26.867 1.00 0.00 C ATOM 967 CD GLU A 59 4.776 -38.302 26.415 1.00 0.00 C ATOM 968 OE1 GLU A 59 4.453 -38.402 25.243 1.00 0.00 O ATOM 969 OE2 GLU A 59 4.607 -39.178 27.247 1.00 0.00 O ATOM 0 H GLU A 59 5.400 -33.774 24.435 1.00 0.00 H new ATOM 0 HA GLU A 59 5.240 -34.397 27.292 1.00 0.00 H new ATOM 0 HB2 GLU A 59 4.222 -35.860 25.483 1.00 0.00 H new ATOM 0 HB3 GLU A 59 5.842 -36.193 24.904 1.00 0.00 H new ATOM 0 HG2 GLU A 59 6.488 -37.173 27.066 1.00 0.00 H new ATOM 0 HG3 GLU A 59 4.980 -36.668 27.801 1.00 0.00 H new ATOM 976 N SER A 60 7.990 -33.904 25.724 1.00 0.00 N ATOM 977 CA SER A 60 9.444 -33.914 25.829 1.00 0.00 C ATOM 978 C SER A 60 9.906 -33.417 27.188 1.00 0.00 C ATOM 979 O SER A 60 10.597 -34.135 27.914 1.00 0.00 O ATOM 980 CB SER A 60 10.041 -33.015 24.747 1.00 0.00 C ATOM 981 OG SER A 60 11.405 -32.756 25.048 1.00 0.00 O ATOM 0 H SER A 60 7.616 -33.329 24.969 1.00 0.00 H new ATOM 0 HA SER A 60 9.781 -34.943 25.701 1.00 0.00 H new ATOM 0 HB2 SER A 60 9.957 -33.496 23.772 1.00 0.00 H new ATOM 0 HB3 SER A 60 9.486 -32.079 24.689 1.00 0.00 H new ATOM 0 HG SER A 60 11.789 -32.180 24.354 1.00 0.00 H new ATOM 987 N GLN A 61 9.529 -32.189 27.530 1.00 0.00 N ATOM 988 CA GLN A 61 9.909 -31.593 28.818 1.00 0.00 C ATOM 989 C GLN A 61 8.708 -31.453 29.743 1.00 0.00 C ATOM 990 O GLN A 61 8.797 -31.763 30.933 1.00 0.00 O ATOM 991 CB GLN A 61 10.555 -30.209 28.586 1.00 0.00 C ATOM 992 CG GLN A 61 11.930 -30.147 29.240 1.00 0.00 C ATOM 993 CD GLN A 61 12.889 -31.073 28.504 1.00 0.00 C ATOM 994 OE1 GLN A 61 14.061 -31.161 28.864 1.00 0.00 O ATOM 995 NE2 GLN A 61 12.459 -31.780 27.491 1.00 0.00 N ATOM 0 H GLN A 61 8.961 -31.583 26.938 1.00 0.00 H new ATOM 0 HA GLN A 61 10.628 -32.258 29.297 1.00 0.00 H new ATOM 0 HB2 GLN A 61 10.645 -30.018 27.517 1.00 0.00 H new ATOM 0 HB3 GLN A 61 9.915 -29.428 28.997 1.00 0.00 H new ATOM 0 HG2 GLN A 61 12.308 -29.125 29.219 1.00 0.00 H new ATOM 0 HG3 GLN A 61 11.859 -30.439 30.288 1.00 0.00 H new ATOM 0 HE21 GLN A 61 11.486 -31.706 27.194 1.00 0.00 H new ATOM 0 HE22 GLN A 61 13.097 -32.406 26.998 1.00 0.00 H new ATOM 1004 N PRO A 62 7.596 -30.993 29.225 1.00 0.00 N ATOM 1005 CA PRO A 62 6.372 -30.798 30.032 1.00 0.00 C ATOM 1006 C PRO A 62 5.403 -31.964 29.904 1.00 0.00 C ATOM 1007 O PRO A 62 4.291 -31.836 29.402 1.00 0.00 O ATOM 1008 CB PRO A 62 5.769 -29.536 29.381 1.00 0.00 C ATOM 1009 CG PRO A 62 6.269 -29.515 27.948 1.00 0.00 C ATOM 1010 CD PRO A 62 7.404 -30.545 27.840 1.00 0.00 C ATOM 0 HA PRO A 62 6.575 -30.717 31.100 1.00 0.00 H new ATOM 0 HB2 PRO A 62 4.680 -29.565 29.412 1.00 0.00 H new ATOM 0 HB3 PRO A 62 6.079 -28.637 29.914 1.00 0.00 H new ATOM 0 HG2 PRO A 62 5.462 -29.759 27.257 1.00 0.00 H new ATOM 0 HG3 PRO A 62 6.627 -28.521 27.681 1.00 0.00 H new ATOM 0 HD2 PRO A 62 7.133 -31.373 27.185 1.00 0.00 H new ATOM 0 HD3 PRO A 62 8.312 -30.100 27.433 1.00 0.00 H new ATOM 1018 N SER A 63 5.849 -33.108 30.416 1.00 0.00 N ATOM 1019 CA SER A 63 5.037 -34.316 30.419 1.00 0.00 C ATOM 1020 C SER A 63 4.189 -34.375 31.688 1.00 0.00 C ATOM 1021 O SER A 63 3.416 -35.310 31.883 1.00 0.00 O ATOM 1022 CB SER A 63 5.924 -35.554 30.341 1.00 0.00 C ATOM 1023 OG SER A 63 6.632 -35.705 31.563 1.00 0.00 O ATOM 0 H SER A 63 6.772 -33.221 30.835 1.00 0.00 H new ATOM 0 HA SER A 63 4.382 -34.293 29.548 1.00 0.00 H new ATOM 0 HB2 SER A 63 5.317 -36.438 30.148 1.00 0.00 H new ATOM 0 HB3 SER A 63 6.625 -35.461 29.511 1.00 0.00 H new ATOM 0 HG SER A 63 7.201 -36.501 31.515 1.00 0.00 H new ATOM 1029 N SER A 64 4.352 -33.376 32.554 1.00 0.00 N ATOM 1030 CA SER A 64 3.610 -33.336 33.810 1.00 0.00 C ATOM 1031 C SER A 64 2.159 -32.943 33.568 1.00 0.00 C ATOM 1032 O SER A 64 1.510 -32.374 34.444 1.00 0.00 O ATOM 1033 CB SER A 64 4.256 -32.332 34.769 1.00 0.00 C ATOM 1034 OG SER A 64 5.458 -32.883 35.286 1.00 0.00 O ATOM 0 H SER A 64 4.986 -32.590 32.410 1.00 0.00 H new ATOM 0 HA SER A 64 3.635 -34.332 34.252 1.00 0.00 H new ATOM 0 HB2 SER A 64 4.465 -31.397 34.248 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.571 -32.097 35.583 1.00 0.00 H new ATOM 0 HG SER A 64 5.875 -32.242 35.899 1.00 0.00 H new ATOM 1040 N GLU A 65 1.660 -33.257 32.377 1.00 0.00 N ATOM 1041 CA GLU A 65 0.281 -32.945 32.021 1.00 0.00 C ATOM 1042 C GLU A 65 0.121 -31.447 31.770 1.00 0.00 C ATOM 1043 O GLU A 65 -0.979 -30.963 31.502 1.00 0.00 O ATOM 1044 CB GLU A 65 -0.662 -33.386 33.154 1.00 0.00 C ATOM 1045 CG GLU A 65 -2.061 -33.646 32.593 1.00 0.00 C ATOM 1046 CD GLU A 65 -2.060 -34.940 31.788 1.00 0.00 C ATOM 1047 OE1 GLU A 65 -1.054 -35.631 31.816 1.00 0.00 O ATOM 1048 OE2 GLU A 65 -3.064 -35.221 31.156 1.00 0.00 O ATOM 0 H GLU A 65 2.190 -33.727 31.643 1.00 0.00 H new ATOM 0 HA GLU A 65 0.026 -33.482 31.108 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -0.277 -34.289 33.629 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -0.706 -32.615 33.923 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -2.783 -33.713 33.407 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -2.370 -32.814 31.961 1.00 0.00 H new ATOM 1055 N ARG A 66 1.223 -30.722 31.869 1.00 0.00 N ATOM 1056 CA ARG A 66 1.205 -29.280 31.667 1.00 0.00 C ATOM 1057 C ARG A 66 0.911 -28.944 30.213 1.00 0.00 C ATOM 1058 O ARG A 66 0.558 -27.811 29.888 1.00 0.00 O ATOM 1059 CB ARG A 66 2.553 -28.685 32.074 1.00 0.00 C ATOM 1060 CG ARG A 66 2.881 -29.063 33.525 1.00 0.00 C ATOM 1061 CD ARG A 66 2.061 -28.207 34.496 1.00 0.00 C ATOM 1062 NE ARG A 66 2.505 -28.445 35.862 1.00 0.00 N ATOM 1063 CZ ARG A 66 1.977 -29.413 36.604 1.00 0.00 C ATOM 1064 NH1 ARG A 66 1.028 -30.167 36.118 1.00 0.00 N ATOM 1065 NH2 ARG A 66 2.407 -29.609 37.819 1.00 0.00 N ATOM 0 H ARG A 66 2.142 -31.107 32.088 1.00 0.00 H new ATOM 0 HA ARG A 66 0.417 -28.852 32.287 1.00 0.00 H new ATOM 0 HB2 ARG A 66 3.336 -29.050 31.409 1.00 0.00 H new ATOM 0 HB3 ARG A 66 2.527 -27.600 31.970 1.00 0.00 H new ATOM 0 HG2 ARG A 66 2.667 -30.119 33.690 1.00 0.00 H new ATOM 0 HG3 ARG A 66 3.945 -28.921 33.713 1.00 0.00 H new ATOM 0 HD2 ARG A 66 2.172 -27.152 34.247 1.00 0.00 H new ATOM 0 HD3 ARG A 66 1.002 -28.447 34.401 1.00 0.00 H new ATOM 0 HE ARG A 66 3.237 -27.856 36.258 1.00 0.00 H new ATOM 0 HH11 ARG A 66 0.691 -30.013 35.168 1.00 0.00 H new ATOM 0 HH12 ARG A 66 0.624 -30.909 36.689 1.00 0.00 H new ATOM 0 HH21 ARG A 66 3.148 -29.020 38.199 1.00 0.00 H new ATOM 0 HH22 ARG A 66 2.003 -30.352 38.390 1.00 0.00 H new ATOM 1079 N LEU A 67 1.050 -29.932 29.344 1.00 0.00 N ATOM 1080 CA LEU A 67 0.786 -29.725 27.928 1.00 0.00 C ATOM 1081 C LEU A 67 -0.614 -29.153 27.732 1.00 0.00 C ATOM 1082 O LEU A 67 -0.921 -28.581 26.686 1.00 0.00 O ATOM 1083 CB LEU A 67 0.906 -31.048 27.175 1.00 0.00 C ATOM 1084 CG LEU A 67 -0.026 -32.117 27.815 1.00 0.00 C ATOM 1085 CD1 LEU A 67 -1.274 -32.306 26.947 1.00 0.00 C ATOM 1086 CD2 LEU A 67 0.721 -33.449 27.932 1.00 0.00 C ATOM 0 H LEU A 67 1.342 -30.878 29.590 1.00 0.00 H new ATOM 0 HA LEU A 67 1.519 -29.019 27.537 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.641 -30.904 26.128 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.939 -31.395 27.197 1.00 0.00 H new ATOM 0 HG LEU A 67 -0.325 -31.780 28.807 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -1.922 -33.056 27.400 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.811 -31.360 26.871 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.978 -32.637 25.951 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.066 -34.196 28.381 1.00 0.00 H new ATOM 0 HD22 LEU A 67 1.026 -33.783 26.940 1.00 0.00 H new ATOM 0 HD23 LEU A 67 1.603 -33.318 28.558 1.00 0.00 H new ATOM 1098 N ASN A 68 -1.459 -29.317 28.746 1.00 0.00 N ATOM 1099 CA ASN A 68 -2.825 -28.812 28.676 1.00 0.00 C ATOM 1100 C ASN A 68 -2.809 -27.316 28.382 1.00 0.00 C ATOM 1101 O ASN A 68 -3.633 -26.813 27.621 1.00 0.00 O ATOM 1102 CB ASN A 68 -3.550 -29.067 30.001 1.00 0.00 C ATOM 1103 CG ASN A 68 -4.961 -28.493 29.942 1.00 0.00 C ATOM 1104 OD1 ASN A 68 -5.327 -27.842 28.962 1.00 0.00 O ATOM 1105 ND2 ASN A 68 -5.781 -28.696 30.936 1.00 0.00 N ATOM 0 H ASN A 68 -1.224 -29.791 29.618 1.00 0.00 H new ATOM 0 HA ASN A 68 -3.352 -29.332 27.876 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -3.592 -30.138 30.202 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -2.997 -28.610 30.822 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -6.727 -28.316 30.903 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -5.476 -29.235 31.746 1.00 0.00 H new ATOM 1112 N ALA A 69 -1.861 -26.609 28.983 1.00 0.00 N ATOM 1113 CA ALA A 69 -1.740 -25.174 28.762 1.00 0.00 C ATOM 1114 C ALA A 69 -1.345 -24.896 27.314 1.00 0.00 C ATOM 1115 O ALA A 69 -1.798 -23.925 26.708 1.00 0.00 O ATOM 1116 CB ALA A 69 -0.688 -24.585 29.702 1.00 0.00 C ATOM 0 H ALA A 69 -1.170 -27.002 29.622 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.704 -24.708 28.965 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.605 -23.512 29.529 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -0.983 -24.764 30.736 1.00 0.00 H new ATOM 0 HB3 ALA A 69 0.275 -25.058 29.512 1.00 0.00 H new ATOM 1122 N PHE A 70 -0.495 -25.760 26.768 1.00 0.00 N ATOM 1123 CA PHE A 70 -0.041 -25.610 25.390 1.00 0.00 C ATOM 1124 C PHE A 70 -1.096 -26.136 24.426 1.00 0.00 C ATOM 1125 O PHE A 70 -1.071 -25.828 23.233 1.00 0.00 O ATOM 1126 CB PHE A 70 1.273 -26.370 25.184 1.00 0.00 C ATOM 1127 CG PHE A 70 2.401 -25.621 25.852 1.00 0.00 C ATOM 1128 CD1 PHE A 70 2.699 -25.858 27.199 1.00 0.00 C ATOM 1129 CD2 PHE A 70 3.147 -24.686 25.124 1.00 0.00 C ATOM 1130 CE1 PHE A 70 3.745 -25.162 27.818 1.00 0.00 C ATOM 1131 CE2 PHE A 70 4.193 -23.991 25.741 1.00 0.00 C ATOM 1132 CZ PHE A 70 4.491 -24.228 27.089 1.00 0.00 C ATOM 0 H PHE A 70 -0.108 -26.568 27.256 1.00 0.00 H new ATOM 0 HA PHE A 70 0.123 -24.551 25.191 1.00 0.00 H new ATOM 0 HB2 PHE A 70 1.193 -27.374 25.600 1.00 0.00 H new ATOM 0 HB3 PHE A 70 1.477 -26.482 24.119 1.00 0.00 H new ATOM 0 HD1 PHE A 70 2.122 -26.578 27.761 1.00 0.00 H new ATOM 0 HD2 PHE A 70 2.915 -24.501 24.086 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.976 -25.346 28.857 1.00 0.00 H new ATOM 0 HE2 PHE A 70 4.770 -23.272 25.178 1.00 0.00 H new ATOM 0 HZ PHE A 70 5.297 -23.690 27.566 1.00 0.00 H new ATOM 1142 N ARG A 71 -2.020 -26.933 24.951 1.00 0.00 N ATOM 1143 CA ARG A 71 -3.078 -27.500 24.127 1.00 0.00 C ATOM 1144 C ARG A 71 -3.871 -26.384 23.461 1.00 0.00 C ATOM 1145 O ARG A 71 -4.447 -26.574 22.389 1.00 0.00 O ATOM 1146 CB ARG A 71 -4.011 -28.360 24.981 1.00 0.00 C ATOM 1147 CG ARG A 71 -5.037 -29.054 24.085 1.00 0.00 C ATOM 1148 CD ARG A 71 -5.983 -29.890 24.946 1.00 0.00 C ATOM 1149 NE ARG A 71 -6.860 -30.687 24.097 1.00 0.00 N ATOM 1150 CZ ARG A 71 -7.767 -31.504 24.622 1.00 0.00 C ATOM 1151 NH1 ARG A 71 -7.875 -31.615 25.917 1.00 0.00 N ATOM 1152 NH2 ARG A 71 -8.548 -32.199 23.840 1.00 0.00 N ATOM 0 H ARG A 71 -2.057 -27.199 25.935 1.00 0.00 H new ATOM 0 HA ARG A 71 -2.626 -28.127 23.358 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -3.434 -29.103 25.532 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -4.519 -27.739 25.719 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -5.602 -28.313 23.520 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -4.530 -29.690 23.359 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -5.408 -30.543 25.603 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -6.578 -29.238 25.586 1.00 0.00 H new ATOM 0 HE ARG A 71 -6.776 -30.616 23.083 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -7.263 -31.074 26.528 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -8.572 -32.242 26.319 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -8.462 -32.115 22.827 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -9.245 -32.826 24.242 1.00 0.00 H new ATOM 1166 N GLU A 72 -3.888 -25.219 24.097 1.00 0.00 N ATOM 1167 CA GLU A 72 -4.603 -24.079 23.548 1.00 0.00 C ATOM 1168 C GLU A 72 -3.979 -23.673 22.222 1.00 0.00 C ATOM 1169 O GLU A 72 -4.674 -23.262 21.292 1.00 0.00 O ATOM 1170 CB GLU A 72 -4.551 -22.901 24.524 1.00 0.00 C ATOM 1171 CG GLU A 72 -5.377 -23.234 25.768 1.00 0.00 C ATOM 1172 CD GLU A 72 -6.855 -23.320 25.408 1.00 0.00 C ATOM 1173 OE1 GLU A 72 -7.232 -22.749 24.398 1.00 0.00 O ATOM 1174 OE2 GLU A 72 -7.590 -23.953 26.149 1.00 0.00 O ATOM 0 H GLU A 72 -3.419 -25.042 24.985 1.00 0.00 H new ATOM 0 HA GLU A 72 -5.644 -24.359 23.389 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -3.519 -22.693 24.805 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -4.939 -22.001 24.046 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -5.043 -24.180 26.193 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -5.224 -22.470 26.531 1.00 0.00 H new ATOM 1181 N LEU A 73 -2.662 -23.793 22.143 1.00 0.00 N ATOM 1182 CA LEU A 73 -1.951 -23.450 20.924 1.00 0.00 C ATOM 1183 C LEU A 73 -2.307 -24.422 19.808 1.00 0.00 C ATOM 1184 O LEU A 73 -2.501 -24.025 18.666 1.00 0.00 O ATOM 1185 CB LEU A 73 -0.437 -23.476 21.169 1.00 0.00 C ATOM 1186 CG LEU A 73 0.317 -23.162 19.864 1.00 0.00 C ATOM 1187 CD1 LEU A 73 -0.130 -21.795 19.314 1.00 0.00 C ATOM 1188 CD2 LEU A 73 1.822 -23.142 20.140 1.00 0.00 C ATOM 0 H LEU A 73 -2.069 -24.123 22.904 1.00 0.00 H new ATOM 0 HA LEU A 73 -2.248 -22.445 20.624 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -0.172 -22.747 21.935 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -0.138 -24.455 21.544 1.00 0.00 H new ATOM 0 HG LEU A 73 0.093 -23.930 19.124 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.408 -21.581 18.391 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -1.201 -21.816 19.113 1.00 0.00 H new ATOM 0 HD13 LEU A 73 0.086 -21.019 20.048 1.00 0.00 H new ATOM 0 HD21 LEU A 73 2.358 -22.920 19.217 1.00 0.00 H new ATOM 0 HD22 LEU A 73 2.046 -22.376 20.883 1.00 0.00 H new ATOM 0 HD23 LEU A 73 2.136 -24.116 20.517 1.00 0.00 H new ATOM 1200 N ARG A 74 -2.385 -25.700 20.152 1.00 0.00 N ATOM 1201 CA ARG A 74 -2.704 -26.729 19.175 1.00 0.00 C ATOM 1202 C ARG A 74 -4.071 -26.471 18.570 1.00 0.00 C ATOM 1203 O ARG A 74 -4.310 -26.767 17.398 1.00 0.00 O ATOM 1204 CB ARG A 74 -2.671 -28.115 19.827 1.00 0.00 C ATOM 1205 CG ARG A 74 -1.218 -28.553 20.058 1.00 0.00 C ATOM 1206 CD ARG A 74 -1.201 -30.006 20.536 1.00 0.00 C ATOM 1207 NE ARG A 74 -1.720 -30.102 21.892 1.00 0.00 N ATOM 1208 CZ ARG A 74 -2.079 -31.273 22.406 1.00 0.00 C ATOM 1209 NH1 ARG A 74 -1.959 -32.359 21.694 1.00 0.00 N ATOM 1210 NH2 ARG A 74 -2.551 -31.336 23.621 1.00 0.00 N ATOM 0 H ARG A 74 -2.232 -26.048 21.099 1.00 0.00 H new ATOM 0 HA ARG A 74 -1.956 -26.698 18.383 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -3.208 -28.092 20.775 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -3.180 -28.838 19.190 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -0.645 -28.454 19.136 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -0.745 -27.908 20.799 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -1.801 -30.622 19.866 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -0.183 -30.395 20.501 1.00 0.00 H new ATOM 0 HE ARG A 74 -1.809 -29.257 22.456 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -1.590 -32.308 20.744 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -2.234 -33.259 22.087 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -2.644 -30.486 24.177 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -2.827 -32.236 24.015 1.00 0.00 H new ATOM 1224 N THR A 75 -4.963 -25.910 19.373 1.00 0.00 N ATOM 1225 CA THR A 75 -6.304 -25.607 18.904 1.00 0.00 C ATOM 1226 C THR A 75 -6.233 -24.651 17.721 1.00 0.00 C ATOM 1227 O THR A 75 -6.929 -24.832 16.723 1.00 0.00 O ATOM 1228 CB THR A 75 -7.121 -24.983 20.022 1.00 0.00 C ATOM 1229 OG1 THR A 75 -7.246 -25.905 21.096 1.00 0.00 O ATOM 1230 CG2 THR A 75 -8.504 -24.613 19.502 1.00 0.00 C ATOM 0 H THR A 75 -4.783 -25.658 20.345 1.00 0.00 H new ATOM 0 HA THR A 75 -6.786 -26.533 18.589 1.00 0.00 H new ATOM 0 HB THR A 75 -6.617 -24.084 20.376 1.00 0.00 H new ATOM 0 HG1 THR A 75 -6.365 -26.067 21.493 1.00 0.00 H new ATOM 0 HG21 THR A 75 -9.088 -24.166 20.307 1.00 0.00 H new ATOM 0 HG22 THR A 75 -8.406 -23.899 18.684 1.00 0.00 H new ATOM 0 HG23 THR A 75 -9.009 -25.509 19.142 1.00 0.00 H new ATOM 1238 N GLN A 76 -5.381 -23.638 17.835 1.00 0.00 N ATOM 1239 CA GLN A 76 -5.221 -22.666 16.760 1.00 0.00 C ATOM 1240 C GLN A 76 -4.766 -23.370 15.488 1.00 0.00 C ATOM 1241 O GLN A 76 -5.307 -23.137 14.408 1.00 0.00 O ATOM 1242 CB GLN A 76 -4.193 -21.607 17.167 1.00 0.00 C ATOM 1243 CG GLN A 76 -4.741 -20.788 18.337 1.00 0.00 C ATOM 1244 CD GLN A 76 -3.695 -19.783 18.806 1.00 0.00 C ATOM 1245 OE1 GLN A 76 -2.626 -19.671 18.207 1.00 0.00 O ATOM 1246 NE2 GLN A 76 -3.937 -19.044 19.854 1.00 0.00 N ATOM 0 H GLN A 76 -4.795 -23.469 18.653 1.00 0.00 H new ATOM 0 HA GLN A 76 -6.178 -22.180 16.573 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -3.256 -22.085 17.451 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.974 -20.953 16.322 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -5.648 -20.266 18.033 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -5.015 -21.450 19.158 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -4.823 -19.137 20.350 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.240 -18.373 20.177 1.00 0.00 H new ATOM 1255 N LEU A 77 -3.777 -24.241 15.628 1.00 0.00 N ATOM 1256 CA LEU A 77 -3.266 -24.989 14.489 1.00 0.00 C ATOM 1257 C LEU A 77 -4.341 -25.898 13.935 1.00 0.00 C ATOM 1258 O LEU A 77 -4.488 -26.033 12.721 1.00 0.00 O ATOM 1259 CB LEU A 77 -2.035 -25.812 14.912 1.00 0.00 C ATOM 1260 CG LEU A 77 -0.777 -24.923 14.924 1.00 0.00 C ATOM 1261 CD1 LEU A 77 -0.333 -24.607 13.486 1.00 0.00 C ATOM 1262 CD2 LEU A 77 -1.069 -23.615 15.674 1.00 0.00 C ATOM 0 H LEU A 77 -3.315 -24.446 16.514 1.00 0.00 H new ATOM 0 HA LEU A 77 -2.970 -24.288 13.709 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -2.197 -26.239 15.902 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -1.893 -26.646 14.225 1.00 0.00 H new ATOM 0 HG LEU A 77 0.025 -25.459 15.432 1.00 0.00 H new ATOM 0 HD11 LEU A 77 0.557 -23.978 13.510 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.107 -25.536 12.963 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.134 -24.083 12.965 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.175 -22.991 15.679 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.880 -23.083 15.176 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.359 -23.841 16.700 1.00 0.00 H new ATOM 1274 N GLU A 78 -5.088 -26.516 14.833 1.00 0.00 N ATOM 1275 CA GLU A 78 -6.152 -27.414 14.423 1.00 0.00 C ATOM 1276 C GLU A 78 -7.214 -26.643 13.645 1.00 0.00 C ATOM 1277 O GLU A 78 -7.676 -27.090 12.598 1.00 0.00 O ATOM 1278 CB GLU A 78 -6.787 -28.061 15.656 1.00 0.00 C ATOM 1279 CG GLU A 78 -7.721 -29.190 15.220 1.00 0.00 C ATOM 1280 CD GLU A 78 -6.903 -30.369 14.708 1.00 0.00 C ATOM 1281 OE1 GLU A 78 -5.689 -30.323 14.834 1.00 0.00 O ATOM 1282 OE2 GLU A 78 -7.499 -31.303 14.198 1.00 0.00 O ATOM 0 H GLU A 78 -4.979 -26.414 15.842 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.733 -28.191 13.783 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -6.011 -28.451 16.314 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.342 -27.315 16.225 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -8.343 -29.504 16.058 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -8.394 -28.836 14.439 1.00 0.00 H new ATOM 1289 N LYS A 79 -7.581 -25.471 14.159 1.00 0.00 N ATOM 1290 CA LYS A 79 -8.574 -24.637 13.501 1.00 0.00 C ATOM 1291 C LYS A 79 -8.040 -24.144 12.166 1.00 0.00 C ATOM 1292 O LYS A 79 -8.767 -24.092 11.174 1.00 0.00 O ATOM 1293 CB LYS A 79 -8.940 -23.446 14.389 1.00 0.00 C ATOM 1294 CG LYS A 79 -9.776 -23.930 15.577 1.00 0.00 C ATOM 1295 CD LYS A 79 -10.161 -22.735 16.450 1.00 0.00 C ATOM 1296 CE LYS A 79 -11.074 -23.204 17.585 1.00 0.00 C ATOM 1297 NZ LYS A 79 -12.397 -23.597 17.023 1.00 0.00 N ATOM 0 H LYS A 79 -7.206 -25.082 15.024 1.00 0.00 H new ATOM 0 HA LYS A 79 -9.470 -25.233 13.327 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -8.035 -22.953 14.745 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -9.500 -22.709 13.814 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -10.672 -24.438 15.222 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -9.210 -24.654 16.163 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -9.266 -22.267 16.859 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -10.669 -21.981 15.849 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -10.622 -24.048 18.105 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -11.200 -22.408 18.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -13.112 -23.589 17.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -12.672 -22.924 16.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -12.332 -24.553 16.618 1.00 0.00 H new ATOM 1311 N ALA A 80 -6.763 -23.780 12.153 1.00 0.00 N ATOM 1312 CA ALA A 80 -6.137 -23.286 10.934 1.00 0.00 C ATOM 1313 C ALA A 80 -6.266 -24.319 9.822 1.00 0.00 C ATOM 1314 O ALA A 80 -6.466 -23.975 8.656 1.00 0.00 O ATOM 1315 CB ALA A 80 -4.658 -22.981 11.184 1.00 0.00 C ATOM 0 H ALA A 80 -6.146 -23.817 12.965 1.00 0.00 H new ATOM 0 HA ALA A 80 -6.643 -22.369 10.631 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -4.202 -22.613 10.265 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.569 -22.223 11.962 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -4.148 -23.890 11.503 1.00 0.00 H new ATOM 1321 N LEU A 81 -6.159 -25.584 10.195 1.00 0.00 N ATOM 1322 CA LEU A 81 -6.273 -26.660 9.229 1.00 0.00 C ATOM 1323 C LEU A 81 -7.659 -26.666 8.601 1.00 0.00 C ATOM 1324 O LEU A 81 -7.876 -27.263 7.547 1.00 0.00 O ATOM 1325 CB LEU A 81 -6.007 -28.001 9.907 1.00 0.00 C ATOM 1326 CG LEU A 81 -6.129 -29.151 8.865 1.00 0.00 C ATOM 1327 CD1 LEU A 81 -4.998 -30.162 9.068 1.00 0.00 C ATOM 1328 CD2 LEU A 81 -7.482 -29.864 9.032 1.00 0.00 C ATOM 0 H LEU A 81 -5.994 -25.888 11.155 1.00 0.00 H new ATOM 0 HA LEU A 81 -5.533 -26.502 8.444 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -5.011 -28.004 10.351 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -6.718 -28.156 10.719 1.00 0.00 H new ATOM 0 HG LEU A 81 -6.061 -28.727 7.863 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.091 -30.963 8.335 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.037 -29.663 8.941 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.060 -30.580 10.073 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -7.562 -30.668 8.300 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -7.553 -30.280 10.037 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -8.291 -29.150 8.877 1.00 0.00 H new ATOM 1340 N GLY A 82 -8.597 -25.997 9.259 1.00 0.00 N ATOM 1341 CA GLY A 82 -9.962 -25.923 8.759 1.00 0.00 C ATOM 1342 C GLY A 82 -10.009 -25.144 7.451 1.00 0.00 C ATOM 1343 O GLY A 82 -10.915 -25.323 6.638 1.00 0.00 O ATOM 0 H GLY A 82 -8.438 -25.500 10.136 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -10.354 -26.928 8.605 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -10.601 -25.442 9.499 1.00 0.00 H new ATOM 1347 N LEU A 83 -9.021 -24.278 7.257 1.00 0.00 N ATOM 1348 CA LEU A 83 -8.950 -23.468 6.046 1.00 0.00 C ATOM 1349 C LEU A 83 -10.270 -22.759 5.790 1.00 0.00 C ATOM 1350 O LEU A 83 -10.580 -22.395 4.657 1.00 0.00 O ATOM 1351 CB LEU A 83 -8.605 -24.360 4.850 1.00 0.00 C ATOM 1352 CG LEU A 83 -7.252 -25.045 5.090 1.00 0.00 C ATOM 1353 CD1 LEU A 83 -6.954 -26.007 3.935 1.00 0.00 C ATOM 1354 CD2 LEU A 83 -6.134 -23.987 5.185 1.00 0.00 C ATOM 0 H LEU A 83 -8.261 -24.119 7.919 1.00 0.00 H new ATOM 0 HA LEU A 83 -8.174 -22.715 6.180 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -9.383 -25.110 4.707 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -8.565 -23.764 3.938 1.00 0.00 H new ATOM 0 HG LEU A 83 -7.294 -25.602 6.026 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.993 -26.493 4.105 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -7.738 -26.762 3.879 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -6.918 -25.451 2.998 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -5.178 -24.482 5.355 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -6.089 -23.421 4.255 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -6.344 -23.309 6.012 1.00 0.00 H new