USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1236 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 86 ASN :FLIP amide:sc= -4.22! C(o=-12!,f=-4.2!) USER MOD Set 1.2: A 95 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 47 LYS NZ :NH3+ 156:sc= -0.36! (180deg=0) USER MOD Set 2.2: A 87 TYR OH : rot -76:sc= -5.31! USER MOD Single : A 1 GLY N :NH3+ 137:sc= 0.0737 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 MET CE :methyl -154:sc= -0.326 (180deg=-1.7!) USER MOD Single : A 11 CYS SG : rot -100:sc= -10.2! USER MOD Single : A 19 CYS SG : rot -146:sc= -7.82! USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : A 27 ASN : amide:sc= -0.176 X(o=-0.18,f=0) USER MOD Single : A 35 GLN :FLIP amide:sc= -1.39! C(o=-3.7!,f=-1.4!) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 41 HIS :FLIP no HD1:sc= -4.28! C(o=-7!,f=-4.3!) USER MOD Single : A 42 HIS : no HD1:sc= -6.99! C(o=-7!,f=-14!) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.739 USER MOD Single : A 49 HIS :FLIP no HD1:sc= -5.83! C(o=-11!,f=-5.8!) USER MOD Single : A 59 THR OG1 : rot -70:sc= -3.23! USER MOD Single : A 64 THR OG1 : rot 74:sc= -6.03! USER MOD Single : A 65 GLN : amide:sc= -10.4! C(o=-10!,f=-18!) USER MOD Single : A 74 GLN : amide:sc= -5.65! C(o=-5.6!,f=-7.7!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -1.86! C(o=-1.9!,f=-2.5!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot -174:sc= -0.889 USER MOD Single : A 104 LYS NZ :NH3+ 155:sc= -5.16! (180deg=-8.37!) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 HIS : no HD1:sc= -2.33! C(o=-2.3!,f=-2!) USER MOD Single : A 116 HIS : no HD1:sc= -3.03 K(o=-3,f=-4.6!) USER MOD Single : A 117 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 CYS SG : rot 23:sc= -1.38 USER MOD Single : A 129 GLN :FLIP amide:sc= -0.0246 F(o=-2.4!,f=-0.025) USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 LYS NZ :NH3+ 157:sc= -0.19 (180deg=-0.829) USER MOD Single : A 136 MET CE :methyl 157:sc= -3.77! (180deg=-6.85!) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 GLN :FLIP amide:sc=-0.00873 F(o=-1.5!,f=-0.0087) USER MOD Single : A 144 HIS : no HE2:sc= -15.6! C(o=-16!,f=-23!) USER MOD Single : A 145 GLN : amide:sc= -0.0228 K(o=-0.023,f=-2!) USER MOD Single : A 148 CYS SG : rot 76:sc= 0.459 USER MOD Single : A 149 SER OG : rot 75:sc= 0.0182 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.095 -21.242 -11.494 1.00 0.00 N ATOM 2 CA GLY A 1 11.616 -20.187 -10.648 1.00 0.00 C ATOM 3 C GLY A 1 10.947 -18.861 -10.986 1.00 0.00 C ATOM 4 O GLY A 1 10.503 -18.658 -12.114 1.00 0.00 O ATOM 0 H1 GLY A 1 11.878 -21.842 -11.823 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.421 -21.820 -10.953 1.00 0.00 H new ATOM 0 H3 GLY A 1 10.612 -20.823 -12.314 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.443 -20.433 -9.600 1.00 0.00 H new ATOM 0 HA3 GLY A 1 12.694 -20.103 -10.782 1.00 0.00 H new ATOM 8 N PRO A 2 10.877 -17.959 -10.005 1.00 0.00 N ATOM 9 CA PRO A 2 10.273 -16.651 -10.141 1.00 0.00 C ATOM 10 C PRO A 2 11.168 -15.761 -10.991 1.00 0.00 C ATOM 11 O PRO A 2 12.385 -15.935 -11.007 1.00 0.00 O ATOM 12 CB PRO A 2 10.169 -16.119 -8.713 1.00 0.00 C ATOM 13 CG PRO A 2 11.354 -16.784 -8.016 1.00 0.00 C ATOM 14 CD PRO A 2 11.397 -18.163 -8.670 1.00 0.00 C ATOM 0 HA PRO A 2 9.299 -16.681 -10.630 1.00 0.00 H new ATOM 0 HB2 PRO A 2 10.239 -15.032 -8.681 1.00 0.00 H new ATOM 0 HB3 PRO A 2 9.222 -16.391 -8.248 1.00 0.00 H new ATOM 0 HG2 PRO A 2 12.280 -16.231 -8.175 1.00 0.00 H new ATOM 0 HG3 PRO A 2 11.204 -16.851 -6.938 1.00 0.00 H new ATOM 0 HD2 PRO A 2 12.414 -18.555 -8.698 1.00 0.00 H new ATOM 0 HD3 PRO A 2 10.793 -18.882 -8.116 1.00 0.00 H new ATOM 22 N LEU A 3 10.627 -14.821 -11.697 1.00 0.00 N ATOM 23 CA LEU A 3 11.475 -13.934 -12.539 1.00 0.00 C ATOM 24 C LEU A 3 12.087 -12.844 -11.659 1.00 0.00 C ATOM 25 O LEU A 3 11.414 -12.239 -10.849 1.00 0.00 O ATOM 26 CB LEU A 3 10.621 -13.282 -13.629 1.00 0.00 C ATOM 27 CG LEU A 3 9.984 -14.360 -14.506 1.00 0.00 C ATOM 28 CD1 LEU A 3 9.206 -13.694 -15.638 1.00 0.00 C ATOM 29 CD2 LEU A 3 11.080 -15.249 -15.098 1.00 0.00 C ATOM 0 H LEU A 3 9.627 -14.623 -11.731 1.00 0.00 H new ATOM 0 HA LEU A 3 12.265 -14.523 -13.005 1.00 0.00 H new ATOM 0 HB2 LEU A 3 9.845 -12.665 -13.175 1.00 0.00 H new ATOM 0 HB3 LEU A 3 11.237 -12.622 -14.239 1.00 0.00 H new ATOM 0 HG LEU A 3 9.308 -14.968 -13.904 1.00 0.00 H new ATOM 0 HD11 LEU A 3 8.750 -14.460 -16.266 1.00 0.00 H new ATOM 0 HD12 LEU A 3 8.427 -13.057 -15.219 1.00 0.00 H new ATOM 0 HD13 LEU A 3 9.885 -13.089 -16.239 1.00 0.00 H new ATOM 0 HD21 LEU A 3 10.627 -16.018 -15.723 1.00 0.00 H new ATOM 0 HD22 LEU A 3 11.755 -14.642 -15.701 1.00 0.00 H new ATOM 0 HD23 LEU A 3 11.641 -15.721 -14.291 1.00 0.00 H new ATOM 41 N GLY A 4 13.358 -12.588 -11.808 1.00 0.00 N ATOM 42 CA GLY A 4 14.003 -11.537 -10.977 1.00 0.00 C ATOM 43 C GLY A 4 14.143 -12.039 -9.540 1.00 0.00 C ATOM 44 O GLY A 4 14.274 -11.266 -8.613 1.00 0.00 O ATOM 0 H GLY A 4 13.975 -13.061 -12.468 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.983 -11.287 -11.384 1.00 0.00 H new ATOM 0 HA3 GLY A 4 13.407 -10.625 -10.998 1.00 0.00 H new ATOM 48 N SER A 5 14.117 -13.330 -9.349 1.00 0.00 N ATOM 49 CA SER A 5 14.250 -13.878 -7.971 1.00 0.00 C ATOM 50 C SER A 5 13.353 -13.090 -7.014 1.00 0.00 C ATOM 51 O SER A 5 12.156 -12.999 -7.201 1.00 0.00 O ATOM 52 CB SER A 5 15.704 -13.758 -7.520 1.00 0.00 C ATOM 53 OG SER A 5 16.542 -14.415 -8.461 1.00 0.00 O ATOM 0 H SER A 5 14.010 -14.027 -10.086 1.00 0.00 H new ATOM 0 HA SER A 5 13.949 -14.926 -7.966 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.985 -12.708 -7.435 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.829 -14.202 -6.532 1.00 0.00 H new ATOM 0 HG SER A 5 17.477 -14.339 -8.176 1.00 0.00 H new ATOM 59 N MET A 6 13.923 -12.516 -5.991 1.00 0.00 N ATOM 60 CA MET A 6 13.104 -11.735 -5.024 1.00 0.00 C ATOM 61 C MET A 6 12.651 -10.440 -5.681 1.00 0.00 C ATOM 62 O MET A 6 13.230 -9.983 -6.647 1.00 0.00 O ATOM 63 CB MET A 6 13.942 -11.390 -3.797 1.00 0.00 C ATOM 64 CG MET A 6 14.463 -12.673 -3.149 1.00 0.00 C ATOM 65 SD MET A 6 15.289 -12.264 -1.592 1.00 0.00 S ATOM 66 CE MET A 6 16.531 -11.143 -2.282 1.00 0.00 C ATOM 0 H MET A 6 14.921 -12.554 -5.783 1.00 0.00 H new ATOM 0 HA MET A 6 12.241 -12.330 -4.726 1.00 0.00 H new ATOM 0 HB2 MET A 6 14.777 -10.751 -4.084 1.00 0.00 H new ATOM 0 HB3 MET A 6 13.342 -10.828 -3.081 1.00 0.00 H new ATOM 0 HG2 MET A 6 13.639 -13.362 -2.966 1.00 0.00 H new ATOM 0 HG3 MET A 6 15.158 -13.177 -3.821 1.00 0.00 H new ATOM 0 HE1 MET A 6 17.407 -11.127 -1.633 1.00 0.00 H new ATOM 0 HE2 MET A 6 16.821 -11.488 -3.275 1.00 0.00 H new ATOM 0 HE3 MET A 6 16.114 -10.138 -2.354 1.00 0.00 H new ATOM 76 N ALA A 7 11.621 -9.842 -5.162 1.00 0.00 N ATOM 77 CA ALA A 7 11.132 -8.575 -5.756 1.00 0.00 C ATOM 78 C ALA A 7 11.774 -7.385 -5.045 1.00 0.00 C ATOM 79 O ALA A 7 11.992 -7.394 -3.850 1.00 0.00 O ATOM 80 CB ALA A 7 9.615 -8.499 -5.613 1.00 0.00 C ATOM 0 H ALA A 7 11.097 -10.176 -4.353 1.00 0.00 H new ATOM 0 HA ALA A 7 11.401 -8.546 -6.812 1.00 0.00 H new ATOM 0 HB1 ALA A 7 9.255 -7.568 -6.050 1.00 0.00 H new ATOM 0 HB2 ALA A 7 9.158 -9.343 -6.130 1.00 0.00 H new ATOM 0 HB3 ALA A 7 9.347 -8.532 -4.557 1.00 0.00 H new ATOM 86 N LEU A 8 12.073 -6.362 -5.786 1.00 0.00 N ATOM 87 CA LEU A 8 12.695 -5.151 -5.199 1.00 0.00 C ATOM 88 C LEU A 8 11.848 -3.959 -5.622 1.00 0.00 C ATOM 89 O LEU A 8 11.147 -3.356 -4.834 1.00 0.00 O ATOM 90 CB LEU A 8 14.113 -4.989 -5.756 1.00 0.00 C ATOM 91 CG LEU A 8 14.549 -6.288 -6.437 1.00 0.00 C ATOM 92 CD1 LEU A 8 15.686 -5.996 -7.416 1.00 0.00 C ATOM 93 CD2 LEU A 8 15.024 -7.288 -5.381 1.00 0.00 C ATOM 0 H LEU A 8 11.910 -6.313 -6.792 1.00 0.00 H new ATOM 0 HA LEU A 8 12.748 -5.226 -4.113 1.00 0.00 H new ATOM 0 HB2 LEU A 8 14.142 -4.165 -6.469 1.00 0.00 H new ATOM 0 HB3 LEU A 8 14.804 -4.739 -4.951 1.00 0.00 H new ATOM 0 HG LEU A 8 13.704 -6.712 -6.980 1.00 0.00 H new ATOM 0 HD11 LEU A 8 15.996 -6.922 -7.900 1.00 0.00 H new ATOM 0 HD12 LEU A 8 15.343 -5.288 -8.171 1.00 0.00 H new ATOM 0 HD13 LEU A 8 16.531 -5.569 -6.876 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.334 -8.212 -5.869 1.00 0.00 H new ATOM 0 HD22 LEU A 8 15.867 -6.866 -4.834 1.00 0.00 H new ATOM 0 HD23 LEU A 8 14.210 -7.499 -4.687 1.00 0.00 H new ATOM 105 N ARG A 9 11.892 -3.644 -6.883 1.00 0.00 N ATOM 106 CA ARG A 9 11.074 -2.524 -7.407 1.00 0.00 C ATOM 107 C ARG A 9 10.125 -3.081 -8.461 1.00 0.00 C ATOM 108 O ARG A 9 10.541 -3.573 -9.491 1.00 0.00 O ATOM 109 CB ARG A 9 11.985 -1.451 -8.014 1.00 0.00 C ATOM 110 CG ARG A 9 11.346 -0.863 -9.275 1.00 0.00 C ATOM 111 CD ARG A 9 12.186 0.319 -9.760 1.00 0.00 C ATOM 112 NE ARG A 9 12.199 1.378 -8.717 1.00 0.00 N ATOM 113 CZ ARG A 9 12.702 2.553 -8.984 1.00 0.00 C ATOM 114 NH1 ARG A 9 13.200 2.796 -10.165 1.00 0.00 N ATOM 115 NH2 ARG A 9 12.711 3.483 -8.068 1.00 0.00 N ATOM 0 H ARG A 9 12.466 -4.120 -7.579 1.00 0.00 H new ATOM 0 HA ARG A 9 10.501 -2.063 -6.603 1.00 0.00 H new ATOM 0 HB2 ARG A 9 12.162 -0.660 -7.285 1.00 0.00 H new ATOM 0 HB3 ARG A 9 12.955 -1.883 -8.258 1.00 0.00 H new ATOM 0 HG2 ARG A 9 11.283 -1.623 -10.053 1.00 0.00 H new ATOM 0 HG3 ARG A 9 10.327 -0.538 -9.063 1.00 0.00 H new ATOM 0 HD2 ARG A 9 13.204 -0.008 -9.974 1.00 0.00 H new ATOM 0 HD3 ARG A 9 11.775 0.714 -10.689 1.00 0.00 H new ATOM 0 HE ARG A 9 11.815 1.187 -7.792 1.00 0.00 H new ATOM 0 HH11 ARG A 9 13.196 2.068 -10.880 1.00 0.00 H new ATOM 0 HH12 ARG A 9 13.593 3.714 -10.374 1.00 0.00 H new ATOM 0 HH21 ARG A 9 12.325 3.292 -7.143 1.00 0.00 H new ATOM 0 HH22 ARG A 9 13.104 4.401 -8.277 1.00 0.00 H new ATOM 129 N ALA A 10 8.852 -3.017 -8.209 1.00 0.00 N ATOM 130 CA ALA A 10 7.873 -3.545 -9.189 1.00 0.00 C ATOM 131 C ALA A 10 7.157 -2.369 -9.834 1.00 0.00 C ATOM 132 O ALA A 10 7.325 -1.235 -9.435 1.00 0.00 O ATOM 133 CB ALA A 10 6.855 -4.435 -8.471 1.00 0.00 C ATOM 0 H ALA A 10 8.446 -2.620 -7.362 1.00 0.00 H new ATOM 0 HA ALA A 10 8.385 -4.135 -9.949 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.136 -4.822 -9.194 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.372 -5.267 -7.993 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.330 -3.851 -7.715 1.00 0.00 H new ATOM 139 N CYS A 11 6.369 -2.617 -10.830 1.00 0.00 N ATOM 140 CA CYS A 11 5.652 -1.498 -11.486 1.00 0.00 C ATOM 141 C CYS A 11 4.198 -1.901 -11.712 1.00 0.00 C ATOM 142 O CYS A 11 3.909 -3.003 -12.131 1.00 0.00 O ATOM 143 CB CYS A 11 6.337 -1.172 -12.810 1.00 0.00 C ATOM 144 SG CYS A 11 8.021 -1.837 -12.796 1.00 0.00 S ATOM 0 H CYS A 11 6.189 -3.542 -11.219 1.00 0.00 H new ATOM 0 HA CYS A 11 5.674 -0.610 -10.854 1.00 0.00 H new ATOM 0 HB2 CYS A 11 5.773 -1.599 -13.639 1.00 0.00 H new ATOM 0 HB3 CYS A 11 6.362 -0.093 -12.963 1.00 0.00 H new ATOM 0 HG CYS A 11 8.862 -0.883 -12.525 1.00 0.00 H new ATOM 150 N GLY A 12 3.280 -1.024 -11.413 1.00 0.00 N ATOM 151 CA GLY A 12 1.843 -1.365 -11.589 1.00 0.00 C ATOM 152 C GLY A 12 1.196 -0.433 -12.602 1.00 0.00 C ATOM 153 O GLY A 12 1.758 0.573 -12.988 1.00 0.00 O ATOM 0 H GLY A 12 3.464 -0.087 -11.055 1.00 0.00 H new ATOM 0 HA2 GLY A 12 1.746 -2.398 -11.923 1.00 0.00 H new ATOM 0 HA3 GLY A 12 1.325 -1.289 -10.633 1.00 0.00 H new ATOM 157 N LEU A 13 0.012 -0.763 -13.033 1.00 0.00 N ATOM 158 CA LEU A 13 -0.681 0.099 -14.024 1.00 0.00 C ATOM 159 C LEU A 13 -2.012 0.578 -13.453 1.00 0.00 C ATOM 160 O LEU A 13 -2.929 -0.198 -13.272 1.00 0.00 O ATOM 161 CB LEU A 13 -0.988 -0.709 -15.299 1.00 0.00 C ATOM 162 CG LEU A 13 -0.072 -0.328 -16.481 1.00 0.00 C ATOM 163 CD1 LEU A 13 -0.808 -0.586 -17.798 1.00 0.00 C ATOM 164 CD2 LEU A 13 0.311 1.149 -16.439 1.00 0.00 C ATOM 0 H LEU A 13 -0.505 -1.593 -12.741 1.00 0.00 H new ATOM 0 HA LEU A 13 -0.033 0.945 -14.253 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.876 -1.772 -15.086 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -2.028 -0.549 -15.584 1.00 0.00 H new ATOM 0 HG LEU A 13 0.831 -0.934 -16.408 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -0.162 -0.317 -18.634 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.071 -1.642 -17.867 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.715 0.017 -17.832 1.00 0.00 H new ATOM 0 HD21 LEU A 13 0.956 1.382 -17.286 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.590 1.760 -16.491 1.00 0.00 H new ATOM 0 HD23 LEU A 13 0.841 1.361 -15.510 1.00 0.00 H new ATOM 176 N ILE A 14 -2.151 1.851 -13.213 1.00 0.00 N ATOM 177 CA ILE A 14 -3.453 2.348 -12.709 1.00 0.00 C ATOM 178 C ILE A 14 -4.452 2.218 -13.853 1.00 0.00 C ATOM 179 O ILE A 14 -4.634 3.134 -14.631 1.00 0.00 O ATOM 180 CB ILE A 14 -3.321 3.824 -12.312 1.00 0.00 C ATOM 181 CG1 ILE A 14 -2.366 3.963 -11.124 1.00 0.00 C ATOM 182 CG2 ILE A 14 -4.689 4.408 -11.958 1.00 0.00 C ATOM 183 CD1 ILE A 14 -2.961 3.292 -9.882 1.00 0.00 C ATOM 0 H ILE A 14 -1.428 2.558 -13.343 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.777 1.780 -11.837 1.00 0.00 H new ATOM 0 HB ILE A 14 -2.917 4.378 -13.160 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -1.405 3.509 -11.366 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -2.178 5.017 -10.921 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -4.576 5.456 -11.679 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -5.351 4.332 -12.820 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -5.116 3.854 -11.122 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.271 3.399 -9.045 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.910 3.766 -9.632 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -3.126 2.234 -10.084 1.00 0.00 H new ATOM 195 N ILE A 15 -5.100 1.092 -13.982 1.00 0.00 N ATOM 196 CA ILE A 15 -6.070 0.946 -15.099 1.00 0.00 C ATOM 197 C ILE A 15 -7.385 1.587 -14.707 1.00 0.00 C ATOM 198 O ILE A 15 -7.875 1.412 -13.611 1.00 0.00 O ATOM 199 CB ILE A 15 -6.338 -0.523 -15.424 1.00 0.00 C ATOM 200 CG1 ILE A 15 -5.094 -1.168 -16.046 1.00 0.00 C ATOM 201 CG2 ILE A 15 -7.507 -0.595 -16.411 1.00 0.00 C ATOM 202 CD1 ILE A 15 -5.441 -2.588 -16.514 1.00 0.00 C ATOM 0 H ILE A 15 -5.001 0.280 -13.372 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.640 1.430 -15.976 1.00 0.00 H new ATOM 0 HB ILE A 15 -6.582 -1.062 -14.509 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.742 -0.571 -16.887 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.284 -1.200 -15.318 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.713 -1.637 -16.655 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -8.392 -0.146 -15.960 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -7.249 -0.053 -17.321 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.559 -3.051 -16.957 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -5.772 -3.181 -15.662 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -6.238 -2.542 -17.256 1.00 0.00 H new ATOM 214 N PHE A 16 -7.971 2.312 -15.605 1.00 0.00 N ATOM 215 CA PHE A 16 -9.267 2.947 -15.298 1.00 0.00 C ATOM 216 C PHE A 16 -10.036 3.174 -16.600 1.00 0.00 C ATOM 217 O PHE A 16 -9.463 3.266 -17.667 1.00 0.00 O ATOM 218 CB PHE A 16 -9.030 4.287 -14.609 1.00 0.00 C ATOM 219 CG PHE A 16 -8.476 5.268 -15.604 1.00 0.00 C ATOM 220 CD1 PHE A 16 -9.343 5.945 -16.465 1.00 0.00 C ATOM 221 CD2 PHE A 16 -7.098 5.510 -15.660 1.00 0.00 C ATOM 222 CE1 PHE A 16 -8.837 6.865 -17.384 1.00 0.00 C ATOM 223 CE2 PHE A 16 -6.590 6.431 -16.580 1.00 0.00 C ATOM 224 CZ PHE A 16 -7.460 7.109 -17.443 1.00 0.00 C ATOM 0 H PHE A 16 -7.607 2.492 -16.541 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.844 2.299 -14.638 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -9.964 4.664 -14.191 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -8.336 4.163 -13.778 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -10.405 5.756 -16.419 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.429 4.986 -14.993 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.507 7.389 -18.049 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.528 6.620 -16.625 1.00 0.00 H new ATOM 0 HZ PHE A 16 -7.068 7.821 -18.155 1.00 0.00 H new ATOM 234 N ARG A 17 -11.326 3.276 -16.510 1.00 0.00 N ATOM 235 CA ARG A 17 -12.147 3.517 -17.728 1.00 0.00 C ATOM 236 C ARG A 17 -13.106 4.670 -17.448 1.00 0.00 C ATOM 237 O ARG A 17 -13.766 4.708 -16.429 1.00 0.00 O ATOM 238 CB ARG A 17 -12.938 2.248 -18.065 1.00 0.00 C ATOM 239 CG ARG A 17 -13.961 2.531 -19.177 1.00 0.00 C ATOM 240 CD ARG A 17 -13.256 2.785 -20.513 1.00 0.00 C ATOM 241 NE ARG A 17 -14.229 3.384 -21.469 1.00 0.00 N ATOM 242 CZ ARG A 17 -14.031 3.290 -22.755 1.00 0.00 C ATOM 243 NH1 ARG A 17 -12.990 2.648 -23.211 1.00 0.00 N ATOM 244 NH2 ARG A 17 -14.879 3.831 -23.586 1.00 0.00 N ATOM 0 H ARG A 17 -11.854 3.203 -15.641 1.00 0.00 H new ATOM 0 HA ARG A 17 -11.506 3.770 -18.573 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -12.255 1.460 -18.383 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -13.451 1.885 -17.174 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -14.642 1.685 -19.275 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -14.566 3.398 -18.909 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -12.408 3.455 -20.370 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -12.861 1.851 -20.914 1.00 0.00 H new ATOM 0 HE ARG A 17 -15.054 3.870 -21.116 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -12.331 2.219 -22.562 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -12.836 2.575 -24.217 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -15.696 4.327 -23.230 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -14.725 3.758 -24.592 1.00 0.00 H new ATOM 258 N ARG A 18 -13.188 5.618 -18.339 1.00 0.00 N ATOM 259 CA ARG A 18 -14.105 6.765 -18.106 1.00 0.00 C ATOM 260 C ARG A 18 -15.403 6.557 -18.886 1.00 0.00 C ATOM 261 O ARG A 18 -15.397 6.117 -20.018 1.00 0.00 O ATOM 262 CB ARG A 18 -13.436 8.065 -18.547 1.00 0.00 C ATOM 263 CG ARG A 18 -13.059 7.976 -20.025 1.00 0.00 C ATOM 264 CD ARG A 18 -12.080 9.101 -20.367 1.00 0.00 C ATOM 265 NE ARG A 18 -12.829 10.375 -20.553 1.00 0.00 N ATOM 266 CZ ARG A 18 -13.349 10.662 -21.715 1.00 0.00 C ATOM 267 NH1 ARG A 18 -13.205 9.836 -22.715 1.00 0.00 N ATOM 268 NH2 ARG A 18 -14.000 11.780 -21.879 1.00 0.00 N ATOM 0 H ARG A 18 -12.663 5.648 -19.213 1.00 0.00 H new ATOM 0 HA ARG A 18 -14.334 6.828 -17.042 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.111 8.906 -18.384 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -12.546 8.249 -17.945 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -12.607 7.008 -20.239 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -13.952 8.055 -20.645 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -11.345 9.212 -19.570 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -11.530 8.855 -21.275 1.00 0.00 H new ATOM 0 HE ARG A 18 -12.935 11.023 -19.772 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -12.686 8.967 -22.588 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -13.611 10.059 -23.624 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -14.102 12.430 -21.099 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -14.407 12.005 -22.787 1.00 0.00 H new ATOM 282 N CYS A 19 -16.519 6.879 -18.290 1.00 0.00 N ATOM 283 CA CYS A 19 -17.810 6.706 -19.003 1.00 0.00 C ATOM 284 C CYS A 19 -18.151 7.991 -19.748 1.00 0.00 C ATOM 285 O CYS A 19 -17.400 8.946 -19.751 1.00 0.00 O ATOM 286 CB CYS A 19 -18.930 6.378 -18.011 1.00 0.00 C ATOM 287 SG CYS A 19 -19.885 7.873 -17.666 1.00 0.00 S ATOM 0 H CYS A 19 -16.590 7.253 -17.344 1.00 0.00 H new ATOM 0 HA CYS A 19 -17.715 5.881 -19.710 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -19.580 5.605 -18.422 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -18.508 5.982 -17.087 1.00 0.00 H new ATOM 0 HG CYS A 19 -20.288 7.855 -16.430 1.00 0.00 H new ATOM 293 N LEU A 20 -19.276 8.010 -20.389 1.00 0.00 N ATOM 294 CA LEU A 20 -19.693 9.213 -21.161 1.00 0.00 C ATOM 295 C LEU A 20 -19.654 10.446 -20.258 1.00 0.00 C ATOM 296 O LEU A 20 -19.175 11.496 -20.638 1.00 0.00 O ATOM 297 CB LEU A 20 -21.124 8.997 -21.652 1.00 0.00 C ATOM 298 CG LEU A 20 -21.277 7.560 -22.164 1.00 0.00 C ATOM 299 CD1 LEU A 20 -22.758 7.238 -22.345 1.00 0.00 C ATOM 300 CD2 LEU A 20 -20.548 7.407 -23.500 1.00 0.00 C ATOM 0 H LEU A 20 -19.938 7.234 -20.414 1.00 0.00 H new ATOM 0 HA LEU A 20 -19.018 9.366 -22.003 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -21.830 9.183 -20.842 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -21.358 9.705 -22.447 1.00 0.00 H new ATOM 0 HG LEU A 20 -20.843 6.871 -21.440 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -22.866 6.216 -22.709 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -23.272 7.339 -21.389 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -23.195 7.928 -23.066 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -20.659 6.384 -23.860 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -20.975 8.097 -24.228 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -19.490 7.631 -23.365 1.00 0.00 H new ATOM 312 N ILE A 21 -20.154 10.323 -19.063 1.00 0.00 N ATOM 313 CA ILE A 21 -20.151 11.480 -18.125 1.00 0.00 C ATOM 314 C ILE A 21 -20.491 10.977 -16.713 1.00 0.00 C ATOM 315 O ILE A 21 -20.998 9.887 -16.546 1.00 0.00 O ATOM 316 CB ILE A 21 -21.198 12.500 -18.595 1.00 0.00 C ATOM 317 CG1 ILE A 21 -20.558 13.891 -18.742 1.00 0.00 C ATOM 318 CG2 ILE A 21 -22.364 12.554 -17.602 1.00 0.00 C ATOM 319 CD1 ILE A 21 -21.567 14.976 -18.355 1.00 0.00 C ATOM 0 H ILE A 21 -20.567 9.467 -18.692 1.00 0.00 H new ATOM 0 HA ILE A 21 -19.171 11.956 -18.106 1.00 0.00 H new ATOM 0 HB ILE A 21 -21.580 12.188 -19.567 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -19.674 13.962 -18.108 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -20.227 14.041 -19.769 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -23.101 13.280 -17.945 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -22.829 11.571 -17.533 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -21.993 12.849 -16.621 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -21.105 15.957 -18.462 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -22.438 14.912 -19.007 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -21.877 14.832 -17.320 1.00 0.00 H new ATOM 331 N PRO A 22 -20.217 11.760 -15.704 1.00 0.00 N ATOM 332 CA PRO A 22 -20.506 11.377 -14.289 1.00 0.00 C ATOM 333 C PRO A 22 -21.988 11.070 -14.073 1.00 0.00 C ATOM 334 O PRO A 22 -22.852 11.694 -14.659 1.00 0.00 O ATOM 335 CB PRO A 22 -20.076 12.605 -13.478 1.00 0.00 C ATOM 336 CG PRO A 22 -19.140 13.357 -14.366 1.00 0.00 C ATOM 337 CD PRO A 22 -19.610 13.093 -15.789 1.00 0.00 C ATOM 0 HA PRO A 22 -19.980 10.468 -13.995 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -20.936 13.217 -13.205 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -19.586 12.311 -12.550 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -19.159 14.423 -14.140 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -18.113 13.020 -14.225 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -20.329 13.842 -16.120 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -18.781 13.113 -16.496 1.00 0.00 H new ATOM 345 N LYS A 23 -22.290 10.103 -13.250 1.00 0.00 N ATOM 346 CA LYS A 23 -23.716 9.743 -13.016 1.00 0.00 C ATOM 347 C LYS A 23 -24.109 10.036 -11.569 1.00 0.00 C ATOM 348 O LYS A 23 -24.318 11.169 -11.179 1.00 0.00 O ATOM 349 CB LYS A 23 -23.903 8.250 -13.290 1.00 0.00 C ATOM 350 CG LYS A 23 -23.548 7.949 -14.748 1.00 0.00 C ATOM 351 CD LYS A 23 -23.811 6.473 -15.038 1.00 0.00 C ATOM 352 CE LYS A 23 -23.355 6.141 -16.460 1.00 0.00 C ATOM 353 NZ LYS A 23 -24.340 5.219 -17.091 1.00 0.00 N ATOM 0 H LYS A 23 -21.611 9.547 -12.730 1.00 0.00 H new ATOM 0 HA LYS A 23 -24.346 10.334 -13.681 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -23.270 7.665 -12.623 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -24.934 7.959 -13.088 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -24.142 8.574 -15.415 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -22.501 8.187 -14.936 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -23.278 5.850 -14.320 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -24.873 6.253 -14.925 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -23.266 7.054 -17.048 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -22.368 5.678 -16.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -24.032 4.992 -18.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -24.403 4.344 -16.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -25.273 5.677 -17.123 1.00 0.00 H new ATOM 367 N VAL A 24 -24.227 9.008 -10.777 1.00 0.00 N ATOM 368 CA VAL A 24 -24.625 9.189 -9.349 1.00 0.00 C ATOM 369 C VAL A 24 -23.408 9.588 -8.516 1.00 0.00 C ATOM 370 O VAL A 24 -23.471 10.462 -7.675 1.00 0.00 O ATOM 371 CB VAL A 24 -25.191 7.870 -8.820 1.00 0.00 C ATOM 372 CG1 VAL A 24 -26.390 7.450 -9.673 1.00 0.00 C ATOM 373 CG2 VAL A 24 -24.108 6.788 -8.898 1.00 0.00 C ATOM 0 H VAL A 24 -24.064 8.041 -11.058 1.00 0.00 H new ATOM 0 HA VAL A 24 -25.378 9.974 -9.278 1.00 0.00 H new ATOM 0 HB VAL A 24 -25.509 7.998 -7.785 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -26.793 6.510 -9.296 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -27.159 8.221 -9.624 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -26.073 7.320 -10.708 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -24.507 5.846 -8.522 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -23.794 6.661 -9.934 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -23.251 7.086 -8.293 1.00 0.00 H new ATOM 383 N ASP A 25 -22.306 8.942 -8.750 1.00 0.00 N ATOM 384 CA ASP A 25 -21.061 9.245 -7.993 1.00 0.00 C ATOM 385 C ASP A 25 -19.927 8.448 -8.630 1.00 0.00 C ATOM 386 O ASP A 25 -18.866 8.275 -8.060 1.00 0.00 O ATOM 387 CB ASP A 25 -21.226 8.831 -6.527 1.00 0.00 C ATOM 388 CG ASP A 25 -21.946 9.939 -5.753 1.00 0.00 C ATOM 389 OD1 ASP A 25 -21.899 11.075 -6.196 1.00 0.00 O ATOM 390 OD2 ASP A 25 -22.532 9.633 -4.728 1.00 0.00 O ATOM 0 H ASP A 25 -22.211 8.203 -9.446 1.00 0.00 H new ATOM 0 HA ASP A 25 -20.846 10.313 -8.026 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -21.794 7.903 -6.463 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -20.250 8.639 -6.082 1.00 0.00 H new ATOM 396 N ASN A 26 -20.162 7.953 -9.813 1.00 0.00 N ATOM 397 CA ASN A 26 -19.129 7.152 -10.519 1.00 0.00 C ATOM 398 C ASN A 26 -18.121 8.091 -11.180 1.00 0.00 C ATOM 399 O ASN A 26 -17.096 7.668 -11.681 1.00 0.00 O ATOM 400 CB ASN A 26 -19.820 6.300 -11.586 1.00 0.00 C ATOM 401 CG ASN A 26 -20.748 5.288 -10.911 1.00 0.00 C ATOM 402 OD1 ASN A 26 -20.652 5.060 -9.720 1.00 0.00 O ATOM 403 ND2 ASN A 26 -21.649 4.668 -11.623 1.00 0.00 N ATOM 0 H ASN A 26 -21.036 8.072 -10.325 1.00 0.00 H new ATOM 0 HA ASN A 26 -18.604 6.508 -9.813 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -20.390 6.937 -12.262 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -19.076 5.780 -12.189 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -22.272 3.993 -11.181 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -21.730 4.859 -12.622 1.00 0.00 H new ATOM 410 N ASN A 27 -18.402 9.364 -11.179 1.00 0.00 N ATOM 411 CA ASN A 27 -17.464 10.341 -11.797 1.00 0.00 C ATOM 412 C ASN A 27 -17.103 9.884 -13.210 1.00 0.00 C ATOM 413 O ASN A 27 -16.075 10.247 -13.747 1.00 0.00 O ATOM 414 CB ASN A 27 -16.193 10.432 -10.956 1.00 0.00 C ATOM 415 CG ASN A 27 -16.567 10.535 -9.477 1.00 0.00 C ATOM 416 OD1 ASN A 27 -15.951 9.909 -8.638 1.00 0.00 O ATOM 417 ND2 ASN A 27 -17.561 11.301 -9.120 1.00 0.00 N ATOM 0 H ASN A 27 -19.245 9.771 -10.775 1.00 0.00 H new ATOM 0 HA ASN A 27 -17.943 11.319 -11.842 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -15.569 9.554 -11.124 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -15.607 11.301 -11.255 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -17.821 11.374 -8.136 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -18.078 11.827 -9.825 1.00 0.00 H new ATOM 424 N ALA A 28 -17.935 9.085 -13.817 1.00 0.00 N ATOM 425 CA ALA A 28 -17.628 8.604 -15.187 1.00 0.00 C ATOM 426 C ALA A 28 -16.320 7.812 -15.167 1.00 0.00 C ATOM 427 O ALA A 28 -16.064 7.009 -16.036 1.00 0.00 O ATOM 428 CB ALA A 28 -17.480 9.801 -16.129 1.00 0.00 C ATOM 0 H ALA A 28 -18.812 8.746 -13.422 1.00 0.00 H new ATOM 0 HA ALA A 28 -18.439 7.964 -15.536 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.255 9.447 -17.135 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.410 10.369 -16.144 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -16.670 10.441 -15.780 1.00 0.00 H new ATOM 434 N ILE A 29 -15.489 8.035 -14.183 1.00 0.00 N ATOM 435 CA ILE A 29 -14.194 7.302 -14.122 1.00 0.00 C ATOM 436 C ILE A 29 -14.237 6.216 -13.051 1.00 0.00 C ATOM 437 O ILE A 29 -14.704 6.424 -11.947 1.00 0.00 O ATOM 438 CB ILE A 29 -13.071 8.284 -13.796 1.00 0.00 C ATOM 439 CG1 ILE A 29 -13.030 9.382 -14.867 1.00 0.00 C ATOM 440 CG2 ILE A 29 -11.735 7.535 -13.747 1.00 0.00 C ATOM 441 CD1 ILE A 29 -11.679 9.369 -15.591 1.00 0.00 C ATOM 0 H ILE A 29 -15.652 8.693 -13.421 1.00 0.00 H new ATOM 0 HA ILE A 29 -14.014 6.833 -15.090 1.00 0.00 H new ATOM 0 HB ILE A 29 -13.251 8.744 -12.824 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -13.836 9.230 -15.585 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.194 10.356 -14.406 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -10.933 8.236 -13.514 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -11.778 6.764 -12.977 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -11.542 7.071 -14.714 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -11.664 10.153 -16.348 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -10.879 9.544 -14.872 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.532 8.401 -16.069 1.00 0.00 H new ATOM 453 N GLU A 30 -13.737 5.057 -13.376 1.00 0.00 N ATOM 454 CA GLU A 30 -13.717 3.940 -12.397 1.00 0.00 C ATOM 455 C GLU A 30 -12.341 3.275 -12.442 1.00 0.00 C ATOM 456 O GLU A 30 -11.668 3.300 -13.454 1.00 0.00 O ATOM 457 CB GLU A 30 -14.801 2.922 -12.767 1.00 0.00 C ATOM 458 CG GLU A 30 -16.177 3.588 -12.686 1.00 0.00 C ATOM 459 CD GLU A 30 -17.265 2.544 -12.934 1.00 0.00 C ATOM 460 OE1 GLU A 30 -16.921 1.430 -13.284 1.00 0.00 O ATOM 461 OE2 GLU A 30 -18.426 2.881 -12.767 1.00 0.00 O ATOM 0 H GLU A 30 -13.338 4.836 -14.288 1.00 0.00 H new ATOM 0 HA GLU A 30 -13.911 4.315 -11.392 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -14.628 2.541 -13.774 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.758 2.068 -12.091 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -16.314 4.046 -11.706 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -16.250 4.387 -13.424 1.00 0.00 H new ATOM 469 N PHE A 31 -11.915 2.680 -11.363 1.00 0.00 N ATOM 470 CA PHE A 31 -10.579 2.019 -11.366 1.00 0.00 C ATOM 471 C PHE A 31 -10.755 0.507 -11.358 1.00 0.00 C ATOM 472 O PHE A 31 -11.676 -0.021 -10.770 1.00 0.00 O ATOM 473 CB PHE A 31 -9.784 2.399 -10.121 1.00 0.00 C ATOM 474 CG PHE A 31 -9.500 3.876 -10.100 1.00 0.00 C ATOM 475 CD1 PHE A 31 -8.602 4.430 -11.013 1.00 0.00 C ATOM 476 CD2 PHE A 31 -10.120 4.684 -9.149 1.00 0.00 C ATOM 477 CE1 PHE A 31 -8.327 5.803 -10.977 1.00 0.00 C ATOM 478 CE2 PHE A 31 -9.846 6.052 -9.105 1.00 0.00 C ATOM 479 CZ PHE A 31 -8.949 6.615 -10.020 1.00 0.00 C ATOM 0 H PHE A 31 -12.430 2.622 -10.484 1.00 0.00 H new ATOM 0 HA PHE A 31 -10.047 2.345 -12.259 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -10.342 2.119 -9.228 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -8.847 1.843 -10.099 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -8.120 3.801 -11.746 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -10.814 4.251 -8.444 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -7.636 6.235 -11.686 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -10.326 6.676 -8.365 1.00 0.00 H new ATOM 0 HZ PHE A 31 -8.737 7.673 -9.988 1.00 0.00 H new ATOM 489 N LEU A 32 -9.868 -0.187 -12.000 1.00 0.00 N ATOM 490 CA LEU A 32 -9.957 -1.665 -12.029 1.00 0.00 C ATOM 491 C LEU A 32 -8.904 -2.247 -11.073 1.00 0.00 C ATOM 492 O LEU A 32 -7.716 -2.115 -11.283 1.00 0.00 O ATOM 493 CB LEU A 32 -9.726 -2.130 -13.475 1.00 0.00 C ATOM 494 CG LEU A 32 -9.055 -3.510 -13.518 1.00 0.00 C ATOM 495 CD1 LEU A 32 -10.119 -4.607 -13.499 1.00 0.00 C ATOM 496 CD2 LEU A 32 -8.241 -3.632 -14.807 1.00 0.00 C ATOM 0 H LEU A 32 -9.079 0.209 -12.510 1.00 0.00 H new ATOM 0 HA LEU A 32 -10.937 -2.011 -11.701 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.679 -2.170 -14.003 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -9.103 -1.404 -13.997 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.405 -3.620 -12.650 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.635 -5.583 -13.530 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.711 -4.524 -12.588 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -10.770 -4.497 -14.366 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -7.762 -4.610 -14.843 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -8.902 -3.519 -15.667 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.479 -2.853 -14.831 1.00 0.00 H new ATOM 508 N LEU A 33 -9.341 -2.898 -10.026 1.00 0.00 N ATOM 509 CA LEU A 33 -8.385 -3.507 -9.053 1.00 0.00 C ATOM 510 C LEU A 33 -8.514 -5.024 -9.148 1.00 0.00 C ATOM 511 O LEU A 33 -9.487 -5.528 -9.663 1.00 0.00 O ATOM 512 CB LEU A 33 -8.733 -3.075 -7.626 1.00 0.00 C ATOM 513 CG LEU A 33 -8.320 -1.619 -7.395 1.00 0.00 C ATOM 514 CD1 LEU A 33 -9.073 -1.072 -6.180 1.00 0.00 C ATOM 515 CD2 LEU A 33 -6.816 -1.547 -7.119 1.00 0.00 C ATOM 0 H LEU A 33 -10.327 -3.035 -9.802 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.371 -3.182 -9.286 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.804 -3.188 -7.456 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.227 -3.722 -6.909 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.558 -1.031 -8.281 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.784 -0.035 -6.009 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.146 -1.124 -6.363 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -8.826 -1.667 -5.301 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.525 -0.509 -6.955 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.580 -2.134 -6.232 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.270 -1.946 -7.974 1.00 0.00 H new ATOM 527 N LEU A 34 -7.546 -5.756 -8.666 1.00 0.00 N ATOM 528 CA LEU A 34 -7.639 -7.241 -8.744 1.00 0.00 C ATOM 529 C LEU A 34 -7.551 -7.862 -7.352 1.00 0.00 C ATOM 530 O LEU A 34 -6.680 -7.540 -6.569 1.00 0.00 O ATOM 531 CB LEU A 34 -6.503 -7.778 -9.618 1.00 0.00 C ATOM 532 CG LEU A 34 -6.653 -7.222 -11.034 1.00 0.00 C ATOM 533 CD1 LEU A 34 -5.600 -7.841 -11.948 1.00 0.00 C ATOM 534 CD2 LEU A 34 -8.037 -7.578 -11.562 1.00 0.00 C ATOM 0 H LEU A 34 -6.701 -5.393 -8.225 1.00 0.00 H new ATOM 0 HA LEU A 34 -8.601 -7.508 -9.182 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.539 -7.488 -9.201 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.527 -8.868 -9.638 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.523 -6.140 -11.013 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -5.712 -7.441 -12.956 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.605 -7.602 -11.571 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.729 -8.923 -11.971 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -8.153 -7.185 -12.572 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -8.152 -8.662 -11.579 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -8.797 -7.142 -10.914 1.00 0.00 H new ATOM 546 N GLN A 35 -8.440 -8.772 -7.044 1.00 0.00 N ATOM 547 CA GLN A 35 -8.388 -9.431 -5.711 1.00 0.00 C ATOM 548 C GLN A 35 -7.742 -10.802 -5.880 1.00 0.00 C ATOM 549 O GLN A 35 -8.329 -11.713 -6.427 1.00 0.00 O ATOM 550 CB GLN A 35 -9.798 -9.606 -5.143 1.00 0.00 C ATOM 551 CG GLN A 35 -9.728 -9.631 -3.613 1.00 0.00 C ATOM 552 CD GLN A 35 -11.103 -9.976 -3.041 1.00 0.00 C ATOM 553 OE1 GLN A 35 -11.290 -11.140 -2.477 1.00 0.00 O flip ATOM 554 NE2 GLN A 35 -12.019 -9.179 -3.106 1.00 0.00 N flip ATOM 0 H GLN A 35 -9.194 -9.083 -7.656 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.811 -8.813 -5.023 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -10.440 -8.791 -5.476 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -10.239 -10.531 -5.513 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -8.992 -10.365 -3.285 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -9.400 -8.661 -3.238 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -11.874 -8.270 -3.546 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -12.932 -9.419 -2.721 1.00 0.00 H new ATOM 563 N ALA A 36 -6.534 -10.955 -5.420 1.00 0.00 N ATOM 564 CA ALA A 36 -5.854 -12.268 -5.565 1.00 0.00 C ATOM 565 C ALA A 36 -6.661 -13.336 -4.827 1.00 0.00 C ATOM 566 O ALA A 36 -7.191 -13.098 -3.762 1.00 0.00 O ATOM 567 CB ALA A 36 -4.449 -12.173 -4.972 1.00 0.00 C ATOM 0 H ALA A 36 -5.990 -10.230 -4.952 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.782 -12.537 -6.619 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.945 -13.134 -5.075 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.882 -11.407 -5.501 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.517 -11.911 -3.916 1.00 0.00 H new ATOM 573 N SER A 37 -6.765 -14.511 -5.383 1.00 0.00 N ATOM 574 CA SER A 37 -7.548 -15.579 -4.703 1.00 0.00 C ATOM 575 C SER A 37 -6.614 -16.430 -3.845 1.00 0.00 C ATOM 576 O SER A 37 -7.035 -17.051 -2.887 1.00 0.00 O ATOM 577 CB SER A 37 -8.222 -16.461 -5.753 1.00 0.00 C ATOM 578 OG SER A 37 -8.492 -17.737 -5.189 1.00 0.00 O ATOM 0 H SER A 37 -6.344 -14.777 -6.273 1.00 0.00 H new ATOM 0 HA SER A 37 -8.308 -15.124 -4.068 1.00 0.00 H new ATOM 0 HB2 SER A 37 -9.148 -15.998 -6.094 1.00 0.00 H new ATOM 0 HB3 SER A 37 -7.577 -16.565 -6.626 1.00 0.00 H new ATOM 0 HG SER A 37 -8.926 -18.306 -5.859 1.00 0.00 H new ATOM 584 N ASP A 38 -5.349 -16.462 -4.167 1.00 0.00 N ATOM 585 CA ASP A 38 -4.399 -17.270 -3.353 1.00 0.00 C ATOM 586 C ASP A 38 -3.649 -16.353 -2.385 1.00 0.00 C ATOM 587 O ASP A 38 -2.887 -15.499 -2.795 1.00 0.00 O ATOM 588 CB ASP A 38 -3.395 -17.964 -4.272 1.00 0.00 C ATOM 589 CG ASP A 38 -2.501 -18.892 -3.441 1.00 0.00 C ATOM 590 OD1 ASP A 38 -1.413 -18.467 -3.082 1.00 0.00 O ATOM 591 OD2 ASP A 38 -2.919 -20.007 -3.177 1.00 0.00 O ATOM 0 H ASP A 38 -4.934 -15.965 -4.956 1.00 0.00 H new ATOM 0 HA ASP A 38 -4.955 -18.020 -2.791 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -3.920 -18.536 -5.037 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -2.787 -17.223 -4.790 1.00 0.00 H new ATOM 597 N GLY A 39 -3.853 -16.523 -1.108 1.00 0.00 N ATOM 598 CA GLY A 39 -3.141 -15.659 -0.128 1.00 0.00 C ATOM 599 C GLY A 39 -4.108 -15.211 0.969 1.00 0.00 C ATOM 600 O GLY A 39 -4.544 -15.995 1.790 1.00 0.00 O ATOM 0 H GLY A 39 -4.479 -17.219 -0.703 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -2.306 -16.204 0.312 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.722 -14.789 -0.634 1.00 0.00 H new ATOM 604 N ILE A 40 -4.437 -13.951 0.990 1.00 0.00 N ATOM 605 CA ILE A 40 -5.367 -13.428 2.032 1.00 0.00 C ATOM 606 C ILE A 40 -6.544 -12.725 1.360 1.00 0.00 C ATOM 607 O ILE A 40 -7.418 -12.193 2.013 1.00 0.00 O ATOM 608 CB ILE A 40 -4.626 -12.433 2.921 1.00 0.00 C ATOM 609 CG1 ILE A 40 -3.295 -12.037 2.267 1.00 0.00 C ATOM 610 CG2 ILE A 40 -4.345 -13.088 4.272 1.00 0.00 C ATOM 611 CD1 ILE A 40 -3.528 -11.546 0.832 1.00 0.00 C ATOM 0 H ILE A 40 -4.100 -13.254 0.326 1.00 0.00 H new ATOM 0 HA ILE A 40 -5.735 -14.257 2.637 1.00 0.00 H new ATOM 0 HB ILE A 40 -5.239 -11.542 3.055 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -2.814 -11.253 2.852 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -2.618 -12.891 2.260 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -3.816 -12.384 4.914 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -5.287 -13.371 4.742 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -3.732 -13.977 4.125 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -2.574 -11.269 0.383 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -3.988 -12.341 0.246 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -4.187 -10.678 0.847 1.00 0.00 H new ATOM 623 N HIS A 41 -6.570 -12.726 0.053 1.00 0.00 N ATOM 624 CA HIS A 41 -7.685 -12.068 -0.672 1.00 0.00 C ATOM 625 C HIS A 41 -7.523 -10.553 -0.547 1.00 0.00 C ATOM 626 O HIS A 41 -8.264 -9.885 0.147 1.00 0.00 O ATOM 627 CB HIS A 41 -9.017 -12.525 -0.073 1.00 0.00 C ATOM 628 CG HIS A 41 -8.965 -14.012 0.197 1.00 0.00 C ATOM 629 ND1 HIS A 41 -7.917 -14.895 0.369 1.00 0.00 N flip ATOM 630 CD2 HIS A 41 -10.118 -14.773 0.326 1.00 0.00 C flip ATOM 631 CE1 HIS A 41 -8.416 -16.168 0.602 1.00 0.00 C flip ATOM 632 NE2 HIS A 41 -9.744 -16.045 0.565 1.00 0.00 N flip ATOM 0 H HIS A 41 -5.862 -13.157 -0.541 1.00 0.00 H new ATOM 0 HA HIS A 41 -7.671 -12.341 -1.727 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -9.217 -11.984 0.852 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -9.833 -12.297 -0.759 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -11.133 -14.411 0.249 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -7.848 -17.070 0.777 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -10.395 -16.818 0.701 1.00 0.00 H new ATOM 641 N HIS A 42 -6.534 -10.017 -1.208 1.00 0.00 N ATOM 642 CA HIS A 42 -6.273 -8.554 -1.134 1.00 0.00 C ATOM 643 C HIS A 42 -6.529 -7.908 -2.496 1.00 0.00 C ATOM 644 O HIS A 42 -6.244 -8.481 -3.528 1.00 0.00 O ATOM 645 CB HIS A 42 -4.808 -8.345 -0.747 1.00 0.00 C ATOM 646 CG HIS A 42 -3.932 -9.113 -1.702 1.00 0.00 C ATOM 647 ND1 HIS A 42 -3.709 -10.478 -1.571 1.00 0.00 N ATOM 648 CD2 HIS A 42 -3.220 -8.724 -2.811 1.00 0.00 C ATOM 649 CE1 HIS A 42 -2.892 -10.854 -2.574 1.00 0.00 C ATOM 650 NE2 HIS A 42 -2.567 -9.826 -3.354 1.00 0.00 N ATOM 0 H HIS A 42 -5.889 -10.538 -1.803 1.00 0.00 H new ATOM 0 HA HIS A 42 -6.933 -8.099 -0.396 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -4.558 -7.284 -0.778 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -4.637 -8.683 0.275 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -3.174 -7.718 -3.201 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -2.544 -11.865 -2.726 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -1.965 -9.842 -4.177 1.00 0.00 H new ATOM 659 N TRP A 43 -7.053 -6.711 -2.505 1.00 0.00 N ATOM 660 CA TRP A 43 -7.317 -6.017 -3.797 1.00 0.00 C ATOM 661 C TRP A 43 -6.080 -5.234 -4.220 1.00 0.00 C ATOM 662 O TRP A 43 -5.401 -4.636 -3.407 1.00 0.00 O ATOM 663 CB TRP A 43 -8.477 -5.043 -3.630 1.00 0.00 C ATOM 664 CG TRP A 43 -9.772 -5.766 -3.788 1.00 0.00 C ATOM 665 CD1 TRP A 43 -10.588 -6.135 -2.777 1.00 0.00 C ATOM 666 CD2 TRP A 43 -10.421 -6.199 -5.014 1.00 0.00 C ATOM 667 NE1 TRP A 43 -11.695 -6.772 -3.304 1.00 0.00 N ATOM 668 CE2 TRP A 43 -11.638 -6.835 -4.680 1.00 0.00 C ATOM 669 CE3 TRP A 43 -10.072 -6.103 -6.371 1.00 0.00 C ATOM 670 CZ2 TRP A 43 -12.480 -7.357 -5.659 1.00 0.00 C ATOM 671 CZ3 TRP A 43 -10.917 -6.628 -7.359 1.00 0.00 C ATOM 672 CH2 TRP A 43 -12.117 -7.254 -7.004 1.00 0.00 C ATOM 0 H TRP A 43 -7.310 -6.184 -1.671 1.00 0.00 H new ATOM 0 HA TRP A 43 -7.564 -6.761 -4.554 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.430 -4.573 -2.648 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -8.403 -4.245 -4.369 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -10.405 -5.960 -1.727 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -12.460 -7.149 -2.744 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -9.148 -5.622 -6.655 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -13.406 -7.838 -5.380 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.640 -6.549 -8.400 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -12.763 -7.658 -7.770 1.00 0.00 H new ATOM 683 N THR A 44 -5.784 -5.224 -5.488 1.00 0.00 N ATOM 684 CA THR A 44 -4.595 -4.471 -5.956 1.00 0.00 C ATOM 685 C THR A 44 -4.628 -4.355 -7.479 1.00 0.00 C ATOM 686 O THR A 44 -5.124 -5.224 -8.168 1.00 0.00 O ATOM 687 CB THR A 44 -3.330 -5.202 -5.517 1.00 0.00 C ATOM 688 OG1 THR A 44 -2.232 -4.780 -6.314 1.00 0.00 O ATOM 689 CG2 THR A 44 -3.529 -6.710 -5.673 1.00 0.00 C ATOM 0 H THR A 44 -6.313 -5.703 -6.216 1.00 0.00 H new ATOM 0 HA THR A 44 -4.602 -3.470 -5.524 1.00 0.00 H new ATOM 0 HB THR A 44 -3.125 -4.971 -4.472 1.00 0.00 H new ATOM 0 HG1 THR A 44 -1.421 -5.250 -6.029 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.624 -7.231 -5.359 1.00 0.00 H new ATOM 0 HG22 THR A 44 -4.367 -7.032 -5.054 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.738 -6.943 -6.717 1.00 0.00 H new ATOM 697 N PRO A 45 -4.090 -3.286 -7.997 1.00 0.00 N ATOM 698 CA PRO A 45 -4.035 -3.034 -9.463 1.00 0.00 C ATOM 699 C PRO A 45 -2.993 -3.920 -10.138 1.00 0.00 C ATOM 700 O PRO A 45 -2.083 -4.412 -9.502 1.00 0.00 O ATOM 701 CB PRO A 45 -3.612 -1.571 -9.557 1.00 0.00 C ATOM 702 CG PRO A 45 -2.806 -1.346 -8.326 1.00 0.00 C ATOM 703 CD PRO A 45 -3.472 -2.191 -7.241 1.00 0.00 C ATOM 0 HA PRO A 45 -4.983 -3.248 -9.956 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -3.026 -1.382 -10.457 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -4.476 -0.908 -9.594 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -1.769 -1.646 -8.476 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -2.796 -0.291 -8.051 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -2.746 -2.562 -6.517 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -4.213 -1.618 -6.684 1.00 0.00 H new ATOM 711 N PRO A 46 -3.114 -4.114 -11.413 1.00 0.00 N ATOM 712 CA PRO A 46 -2.149 -4.945 -12.165 1.00 0.00 C ATOM 713 C PRO A 46 -0.705 -4.528 -11.856 1.00 0.00 C ATOM 714 O PRO A 46 -0.338 -3.382 -12.022 1.00 0.00 O ATOM 715 CB PRO A 46 -2.467 -4.677 -13.631 1.00 0.00 C ATOM 716 CG PRO A 46 -3.785 -3.976 -13.682 1.00 0.00 C ATOM 717 CD PRO A 46 -4.172 -3.564 -12.263 1.00 0.00 C ATOM 0 HA PRO A 46 -2.232 -5.999 -11.902 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -1.689 -4.065 -14.087 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -2.507 -5.611 -14.192 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -3.723 -3.099 -14.327 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -4.546 -4.631 -14.107 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -4.232 -2.480 -12.168 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.148 -3.963 -11.988 1.00 0.00 H new ATOM 725 N LYS A 47 0.117 -5.435 -11.401 1.00 0.00 N ATOM 726 CA LYS A 47 1.522 -5.058 -11.079 1.00 0.00 C ATOM 727 C LYS A 47 2.396 -6.309 -10.979 1.00 0.00 C ATOM 728 O LYS A 47 1.951 -7.361 -10.563 1.00 0.00 O ATOM 729 CB LYS A 47 1.544 -4.280 -9.751 1.00 0.00 C ATOM 730 CG LYS A 47 2.464 -4.966 -8.731 1.00 0.00 C ATOM 731 CD LYS A 47 1.968 -4.695 -7.312 1.00 0.00 C ATOM 732 CE LYS A 47 2.668 -5.650 -6.340 1.00 0.00 C ATOM 733 NZ LYS A 47 1.655 -6.262 -5.434 1.00 0.00 N ATOM 0 H LYS A 47 -0.122 -6.413 -11.239 1.00 0.00 H new ATOM 0 HA LYS A 47 1.921 -4.427 -11.873 1.00 0.00 H new ATOM 0 HB2 LYS A 47 1.886 -3.260 -9.928 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.534 -4.212 -9.348 1.00 0.00 H new ATOM 0 HG2 LYS A 47 2.489 -6.040 -8.917 1.00 0.00 H new ATOM 0 HG3 LYS A 47 3.484 -4.599 -8.845 1.00 0.00 H new ATOM 0 HD2 LYS A 47 2.172 -3.661 -7.034 1.00 0.00 H new ATOM 0 HD3 LYS A 47 0.888 -4.832 -7.260 1.00 0.00 H new ATOM 0 HE2 LYS A 47 3.195 -6.428 -6.893 1.00 0.00 H new ATOM 0 HE3 LYS A 47 3.415 -5.111 -5.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 2.016 -7.167 -5.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 1.467 -5.619 -4.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 0.774 -6.428 -5.960 1.00 0.00 H new ATOM 747 N GLY A 48 3.642 -6.195 -11.352 1.00 0.00 N ATOM 748 CA GLY A 48 4.558 -7.368 -11.272 1.00 0.00 C ATOM 749 C GLY A 48 5.980 -6.877 -10.998 1.00 0.00 C ATOM 750 O GLY A 48 6.337 -5.765 -11.339 1.00 0.00 O ATOM 0 H GLY A 48 4.065 -5.339 -11.709 1.00 0.00 H new ATOM 0 HA2 GLY A 48 4.235 -8.044 -10.480 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.528 -7.932 -12.204 1.00 0.00 H new ATOM 754 N HIS A 49 6.801 -7.690 -10.390 1.00 0.00 N ATOM 755 CA HIS A 49 8.197 -7.253 -10.105 1.00 0.00 C ATOM 756 C HIS A 49 8.932 -7.045 -11.425 1.00 0.00 C ATOM 757 O HIS A 49 8.460 -7.437 -12.475 1.00 0.00 O ATOM 758 CB HIS A 49 8.925 -8.316 -9.282 1.00 0.00 C ATOM 759 CG HIS A 49 10.397 -8.001 -9.256 1.00 0.00 C ATOM 760 ND1 HIS A 49 11.101 -6.936 -8.745 1.00 0.00 N flip ATOM 761 CD2 HIS A 49 11.344 -8.843 -9.826 1.00 0.00 C flip ATOM 762 CE1 HIS A 49 12.455 -7.113 -8.995 1.00 0.00 C flip ATOM 763 NE2 HIS A 49 12.552 -8.275 -9.644 1.00 0.00 N flip ATOM 0 H HIS A 49 6.567 -8.633 -10.080 1.00 0.00 H new ATOM 0 HA HIS A 49 8.174 -6.322 -9.539 1.00 0.00 H new ATOM 0 HB2 HIS A 49 8.529 -8.342 -8.267 1.00 0.00 H new ATOM 0 HB3 HIS A 49 8.760 -9.303 -9.714 1.00 0.00 H new ATOM 0 HD2 HIS A 49 11.148 -9.781 -10.324 1.00 0.00 H new ATOM 0 HE1 HIS A 49 13.262 -6.449 -8.721 1.00 0.00 H new ATOM 0 HE2 HIS A 49 13.431 -8.682 -9.963 1.00 0.00 H new ATOM 772 N VAL A 50 10.079 -6.431 -11.389 1.00 0.00 N ATOM 773 CA VAL A 50 10.827 -6.203 -12.653 1.00 0.00 C ATOM 774 C VAL A 50 11.870 -7.309 -12.840 1.00 0.00 C ATOM 775 O VAL A 50 12.764 -7.478 -12.036 1.00 0.00 O ATOM 776 CB VAL A 50 11.507 -4.825 -12.588 1.00 0.00 C ATOM 777 CG1 VAL A 50 13.017 -4.972 -12.382 1.00 0.00 C ATOM 778 CG2 VAL A 50 11.245 -4.069 -13.893 1.00 0.00 C ATOM 0 H VAL A 50 10.529 -6.079 -10.544 1.00 0.00 H new ATOM 0 HA VAL A 50 10.144 -6.226 -13.502 1.00 0.00 H new ATOM 0 HB VAL A 50 11.093 -4.272 -11.745 1.00 0.00 H new ATOM 0 HG11 VAL A 50 13.476 -3.984 -12.339 1.00 0.00 H new ATOM 0 HG12 VAL A 50 13.207 -5.501 -11.448 1.00 0.00 H new ATOM 0 HG13 VAL A 50 13.444 -5.535 -13.212 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.726 -3.092 -13.850 1.00 0.00 H new ATOM 0 HG22 VAL A 50 11.651 -4.637 -14.730 1.00 0.00 H new ATOM 0 HG23 VAL A 50 10.171 -3.940 -14.029 1.00 0.00 H new ATOM 788 N GLU A 51 11.768 -8.062 -13.904 1.00 0.00 N ATOM 789 CA GLU A 51 12.761 -9.141 -14.140 1.00 0.00 C ATOM 790 C GLU A 51 14.084 -8.490 -14.578 1.00 0.00 C ATOM 791 O GLU A 51 14.147 -7.291 -14.764 1.00 0.00 O ATOM 792 CB GLU A 51 12.225 -10.097 -15.215 1.00 0.00 C ATOM 793 CG GLU A 51 10.700 -10.206 -15.087 1.00 0.00 C ATOM 794 CD GLU A 51 10.311 -10.250 -13.607 1.00 0.00 C ATOM 795 OE1 GLU A 51 11.054 -10.832 -12.837 1.00 0.00 O ATOM 796 OE2 GLU A 51 9.276 -9.699 -13.274 1.00 0.00 O ATOM 0 H GLU A 51 11.042 -7.974 -14.615 1.00 0.00 H new ATOM 0 HA GLU A 51 12.934 -9.720 -13.233 1.00 0.00 H new ATOM 0 HB2 GLU A 51 12.492 -9.733 -16.207 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.681 -11.080 -15.103 1.00 0.00 H new ATOM 0 HG2 GLU A 51 10.222 -9.356 -15.574 1.00 0.00 H new ATOM 0 HG3 GLU A 51 10.346 -11.104 -15.593 1.00 0.00 H new ATOM 804 N PRO A 52 15.140 -9.254 -14.702 1.00 0.00 N ATOM 805 CA PRO A 52 16.475 -8.712 -15.078 1.00 0.00 C ATOM 806 C PRO A 52 16.590 -8.397 -16.568 1.00 0.00 C ATOM 807 O PRO A 52 17.657 -8.101 -17.071 1.00 0.00 O ATOM 808 CB PRO A 52 17.450 -9.814 -14.668 1.00 0.00 C ATOM 809 CG PRO A 52 16.660 -11.083 -14.665 1.00 0.00 C ATOM 810 CD PRO A 52 15.180 -10.712 -14.514 1.00 0.00 C ATOM 0 HA PRO A 52 16.673 -7.760 -14.586 1.00 0.00 H new ATOM 0 HB2 PRO A 52 18.285 -9.876 -15.366 1.00 0.00 H new ATOM 0 HB3 PRO A 52 17.872 -9.615 -13.683 1.00 0.00 H new ATOM 0 HG2 PRO A 52 16.823 -11.637 -15.590 1.00 0.00 H new ATOM 0 HG3 PRO A 52 16.978 -11.729 -13.846 1.00 0.00 H new ATOM 0 HD2 PRO A 52 14.566 -11.224 -15.255 1.00 0.00 H new ATOM 0 HD3 PRO A 52 14.799 -10.995 -13.533 1.00 0.00 H new ATOM 818 N GLY A 53 15.501 -8.450 -17.274 1.00 0.00 N ATOM 819 CA GLY A 53 15.529 -8.143 -18.734 1.00 0.00 C ATOM 820 C GLY A 53 14.248 -7.401 -19.103 1.00 0.00 C ATOM 821 O GLY A 53 13.571 -7.743 -20.055 1.00 0.00 O ATOM 0 H GLY A 53 14.583 -8.694 -16.903 1.00 0.00 H new ATOM 0 HA2 GLY A 53 16.401 -7.535 -18.975 1.00 0.00 H new ATOM 0 HA3 GLY A 53 15.612 -9.063 -19.312 1.00 0.00 H new ATOM 825 N GLU A 54 13.897 -6.399 -18.345 1.00 0.00 N ATOM 826 CA GLU A 54 12.649 -5.639 -18.632 1.00 0.00 C ATOM 827 C GLU A 54 12.854 -4.166 -18.290 1.00 0.00 C ATOM 828 O GLU A 54 13.963 -3.705 -18.101 1.00 0.00 O ATOM 829 CB GLU A 54 11.516 -6.183 -17.759 1.00 0.00 C ATOM 830 CG GLU A 54 11.838 -7.611 -17.317 1.00 0.00 C ATOM 831 CD GLU A 54 11.694 -8.566 -18.506 1.00 0.00 C ATOM 832 OE1 GLU A 54 12.175 -9.683 -18.406 1.00 0.00 O ATOM 833 OE2 GLU A 54 11.102 -8.164 -19.493 1.00 0.00 O ATOM 0 H GLU A 54 14.424 -6.073 -17.535 1.00 0.00 H new ATOM 0 HA GLU A 54 12.401 -5.745 -19.688 1.00 0.00 H new ATOM 0 HB2 GLU A 54 11.380 -5.545 -16.886 1.00 0.00 H new ATOM 0 HB3 GLU A 54 10.578 -6.168 -18.314 1.00 0.00 H new ATOM 0 HG2 GLU A 54 12.852 -7.659 -16.921 1.00 0.00 H new ATOM 0 HG3 GLU A 54 11.167 -7.913 -16.513 1.00 0.00 H new ATOM 841 N ASP A 55 11.782 -3.432 -18.185 1.00 0.00 N ATOM 842 CA ASP A 55 11.886 -1.991 -17.827 1.00 0.00 C ATOM 843 C ASP A 55 10.887 -1.710 -16.709 1.00 0.00 C ATOM 844 O ASP A 55 10.135 -2.576 -16.319 1.00 0.00 O ATOM 845 CB ASP A 55 11.551 -1.117 -19.037 1.00 0.00 C ATOM 846 CG ASP A 55 12.302 0.213 -18.935 1.00 0.00 C ATOM 847 OD1 ASP A 55 11.914 1.141 -19.625 1.00 0.00 O ATOM 848 OD2 ASP A 55 13.250 0.284 -18.170 1.00 0.00 O ATOM 0 H ASP A 55 10.832 -3.771 -18.333 1.00 0.00 H new ATOM 0 HA ASP A 55 12.902 -1.762 -17.506 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.827 -1.632 -19.957 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.477 -0.937 -19.082 1.00 0.00 H new ATOM 854 N ASP A 56 10.875 -0.521 -16.184 1.00 0.00 N ATOM 855 CA ASP A 56 9.916 -0.219 -15.085 1.00 0.00 C ATOM 856 C ASP A 56 8.489 -0.207 -15.640 1.00 0.00 C ATOM 857 O ASP A 56 7.671 -1.028 -15.278 1.00 0.00 O ATOM 858 CB ASP A 56 10.246 1.142 -14.475 1.00 0.00 C ATOM 859 CG ASP A 56 11.692 1.144 -13.981 1.00 0.00 C ATOM 860 OD1 ASP A 56 12.217 2.219 -13.749 1.00 0.00 O ATOM 861 OD2 ASP A 56 12.254 0.068 -13.847 1.00 0.00 O ATOM 0 H ASP A 56 11.481 0.251 -16.463 1.00 0.00 H new ATOM 0 HA ASP A 56 9.995 -0.985 -14.314 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.103 1.928 -15.216 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.568 1.356 -13.649 1.00 0.00 H new ATOM 867 N LEU A 57 8.174 0.707 -16.522 1.00 0.00 N ATOM 868 CA LEU A 57 6.791 0.730 -17.086 1.00 0.00 C ATOM 869 C LEU A 57 6.560 -0.516 -17.934 1.00 0.00 C ATOM 870 O LEU A 57 5.522 -1.144 -17.853 1.00 0.00 O ATOM 871 CB LEU A 57 6.580 1.977 -17.952 1.00 0.00 C ATOM 872 CG LEU A 57 5.227 1.877 -18.675 1.00 0.00 C ATOM 873 CD1 LEU A 57 4.081 2.131 -17.695 1.00 0.00 C ATOM 874 CD2 LEU A 57 5.173 2.917 -19.793 1.00 0.00 C ATOM 0 H LEU A 57 8.804 1.429 -16.872 1.00 0.00 H new ATOM 0 HA LEU A 57 6.082 0.751 -16.258 1.00 0.00 H new ATOM 0 HB2 LEU A 57 6.607 2.873 -17.331 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.387 2.068 -18.679 1.00 0.00 H new ATOM 0 HG LEU A 57 5.122 0.875 -19.092 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.129 2.057 -18.221 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.113 1.389 -16.897 1.00 0.00 H new ATOM 0 HD13 LEU A 57 4.182 3.128 -17.267 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.215 2.849 -20.308 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.286 3.914 -19.368 1.00 0.00 H new ATOM 0 HD23 LEU A 57 5.980 2.731 -20.502 1.00 0.00 H new ATOM 886 N GLU A 58 7.509 -0.893 -18.743 1.00 0.00 N ATOM 887 CA GLU A 58 7.297 -2.107 -19.570 1.00 0.00 C ATOM 888 C GLU A 58 6.927 -3.241 -18.619 1.00 0.00 C ATOM 889 O GLU A 58 6.128 -4.101 -18.936 1.00 0.00 O ATOM 890 CB GLU A 58 8.574 -2.461 -20.337 1.00 0.00 C ATOM 891 CG GLU A 58 8.905 -1.342 -21.327 1.00 0.00 C ATOM 892 CD GLU A 58 7.770 -1.205 -22.346 1.00 0.00 C ATOM 893 OE1 GLU A 58 7.005 -2.146 -22.482 1.00 0.00 O ATOM 894 OE2 GLU A 58 7.684 -0.162 -22.972 1.00 0.00 O ATOM 0 H GLU A 58 8.406 -0.422 -18.865 1.00 0.00 H new ATOM 0 HA GLU A 58 6.507 -1.938 -20.301 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.401 -2.601 -19.641 1.00 0.00 H new ATOM 0 HB3 GLU A 58 8.442 -3.403 -20.869 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.045 -0.401 -20.795 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.842 -1.561 -21.839 1.00 0.00 H new ATOM 902 N THR A 59 7.484 -3.223 -17.438 1.00 0.00 N ATOM 903 CA THR A 59 7.144 -4.272 -16.440 1.00 0.00 C ATOM 904 C THR A 59 5.686 -4.085 -16.025 1.00 0.00 C ATOM 905 O THR A 59 4.925 -5.030 -15.938 1.00 0.00 O ATOM 906 CB THR A 59 8.052 -4.130 -15.216 1.00 0.00 C ATOM 907 OG1 THR A 59 9.155 -5.014 -15.343 1.00 0.00 O ATOM 908 CG2 THR A 59 7.263 -4.463 -13.950 1.00 0.00 C ATOM 0 H THR A 59 8.159 -2.526 -17.123 1.00 0.00 H new ATOM 0 HA THR A 59 7.287 -5.263 -16.871 1.00 0.00 H new ATOM 0 HB THR A 59 8.417 -3.105 -15.149 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.846 -5.939 -15.242 1.00 0.00 H new ATOM 0 HG21 THR A 59 7.911 -4.361 -13.080 1.00 0.00 H new ATOM 0 HG22 THR A 59 6.420 -3.779 -13.856 1.00 0.00 H new ATOM 0 HG23 THR A 59 6.894 -5.487 -14.010 1.00 0.00 H new ATOM 916 N ALA A 60 5.282 -2.864 -15.783 1.00 0.00 N ATOM 917 CA ALA A 60 3.868 -2.620 -15.398 1.00 0.00 C ATOM 918 C ALA A 60 2.993 -3.042 -16.570 1.00 0.00 C ATOM 919 O ALA A 60 1.994 -3.714 -16.410 1.00 0.00 O ATOM 920 CB ALA A 60 3.659 -1.132 -15.105 1.00 0.00 C ATOM 0 H ALA A 60 5.870 -2.032 -15.836 1.00 0.00 H new ATOM 0 HA ALA A 60 3.611 -3.187 -14.503 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.620 -0.959 -14.823 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.312 -0.827 -14.288 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.895 -0.549 -15.995 1.00 0.00 H new ATOM 926 N LEU A 61 3.390 -2.675 -17.759 1.00 0.00 N ATOM 927 CA LEU A 61 2.620 -3.076 -18.960 1.00 0.00 C ATOM 928 C LEU A 61 2.659 -4.602 -19.054 1.00 0.00 C ATOM 929 O LEU A 61 1.687 -5.245 -19.396 1.00 0.00 O ATOM 930 CB LEU A 61 3.264 -2.443 -20.200 1.00 0.00 C ATOM 931 CG LEU A 61 2.993 -0.937 -20.188 1.00 0.00 C ATOM 932 CD1 LEU A 61 3.893 -0.236 -21.206 1.00 0.00 C ATOM 933 CD2 LEU A 61 1.530 -0.677 -20.552 1.00 0.00 C ATOM 0 H LEU A 61 4.220 -2.112 -17.946 1.00 0.00 H new ATOM 0 HA LEU A 61 1.585 -2.739 -18.896 1.00 0.00 H new ATOM 0 HB2 LEU A 61 4.337 -2.632 -20.205 1.00 0.00 H new ATOM 0 HB3 LEU A 61 2.857 -2.892 -21.106 1.00 0.00 H new ATOM 0 HG LEU A 61 3.201 -0.548 -19.191 1.00 0.00 H new ATOM 0 HD11 LEU A 61 3.694 0.835 -21.191 1.00 0.00 H new ATOM 0 HD12 LEU A 61 4.938 -0.414 -20.952 1.00 0.00 H new ATOM 0 HD13 LEU A 61 3.690 -0.629 -22.202 1.00 0.00 H new ATOM 0 HD21 LEU A 61 1.338 0.396 -20.543 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.326 -1.074 -21.547 1.00 0.00 H new ATOM 0 HD23 LEU A 61 0.882 -1.168 -19.826 1.00 0.00 H new ATOM 945 N ARG A 62 3.779 -5.181 -18.716 1.00 0.00 N ATOM 946 CA ARG A 62 3.898 -6.665 -18.737 1.00 0.00 C ATOM 947 C ARG A 62 2.919 -7.249 -17.717 1.00 0.00 C ATOM 948 O ARG A 62 2.182 -8.173 -18.001 1.00 0.00 O ATOM 949 CB ARG A 62 5.331 -7.049 -18.351 1.00 0.00 C ATOM 950 CG ARG A 62 5.472 -8.569 -18.245 1.00 0.00 C ATOM 951 CD ARG A 62 6.824 -8.894 -17.603 1.00 0.00 C ATOM 952 NE ARG A 62 6.973 -10.369 -17.451 1.00 0.00 N ATOM 953 CZ ARG A 62 7.522 -11.071 -18.401 1.00 0.00 C ATOM 954 NH1 ARG A 62 7.927 -10.488 -19.496 1.00 0.00 N ATOM 955 NH2 ARG A 62 7.668 -12.360 -18.254 1.00 0.00 N ATOM 0 H ARG A 62 4.622 -4.685 -18.424 1.00 0.00 H new ATOM 0 HA ARG A 62 3.669 -7.053 -19.730 1.00 0.00 H new ATOM 0 HB2 ARG A 62 6.029 -6.665 -19.095 1.00 0.00 H new ATOM 0 HB3 ARG A 62 5.593 -6.587 -17.399 1.00 0.00 H new ATOM 0 HG2 ARG A 62 4.660 -8.983 -17.646 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.404 -9.024 -19.233 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.633 -8.500 -18.219 1.00 0.00 H new ATOM 0 HD3 ARG A 62 6.900 -8.410 -16.629 1.00 0.00 H new ATOM 0 HE ARG A 62 6.645 -10.829 -16.602 1.00 0.00 H new ATOM 0 HH11 ARG A 62 7.814 -9.481 -19.609 1.00 0.00 H new ATOM 0 HH12 ARG A 62 8.357 -11.040 -20.239 1.00 0.00 H new ATOM 0 HH21 ARG A 62 7.353 -12.815 -17.397 1.00 0.00 H new ATOM 0 HH22 ARG A 62 8.097 -12.913 -18.996 1.00 0.00 H new ATOM 969 N ALA A 63 2.903 -6.705 -16.530 1.00 0.00 N ATOM 970 CA ALA A 63 1.969 -7.215 -15.490 1.00 0.00 C ATOM 971 C ALA A 63 0.548 -6.802 -15.852 1.00 0.00 C ATOM 972 O ALA A 63 -0.395 -7.530 -15.631 1.00 0.00 O ATOM 973 CB ALA A 63 2.334 -6.626 -14.126 1.00 0.00 C ATOM 0 H ALA A 63 3.497 -5.929 -16.237 1.00 0.00 H new ATOM 0 HA ALA A 63 2.041 -8.301 -15.441 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.646 -7.004 -13.370 1.00 0.00 H new ATOM 0 HB2 ALA A 63 3.352 -6.914 -13.866 1.00 0.00 H new ATOM 0 HB3 ALA A 63 2.264 -5.539 -14.169 1.00 0.00 H new ATOM 979 N THR A 64 0.384 -5.638 -16.414 1.00 0.00 N ATOM 980 CA THR A 64 -0.982 -5.192 -16.780 1.00 0.00 C ATOM 981 C THR A 64 -1.644 -6.285 -17.603 1.00 0.00 C ATOM 982 O THR A 64 -2.788 -6.632 -17.389 1.00 0.00 O ATOM 983 CB THR A 64 -0.894 -3.908 -17.593 1.00 0.00 C ATOM 984 OG1 THR A 64 -0.104 -2.963 -16.884 1.00 0.00 O ATOM 985 CG2 THR A 64 -2.297 -3.342 -17.805 1.00 0.00 C ATOM 0 H THR A 64 1.133 -4.982 -16.634 1.00 0.00 H new ATOM 0 HA THR A 64 -1.570 -5.001 -15.883 1.00 0.00 H new ATOM 0 HB THR A 64 -0.439 -4.116 -18.561 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.839 -3.225 -16.930 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.234 -2.423 -18.387 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.906 -4.070 -18.341 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.753 -3.129 -16.838 1.00 0.00 H new ATOM 993 N GLN A 65 -0.926 -6.849 -18.525 1.00 0.00 N ATOM 994 CA GLN A 65 -1.506 -7.947 -19.336 1.00 0.00 C ATOM 995 C GLN A 65 -1.549 -9.226 -18.500 1.00 0.00 C ATOM 996 O GLN A 65 -2.575 -9.846 -18.344 1.00 0.00 O ATOM 997 CB GLN A 65 -0.643 -8.172 -20.579 1.00 0.00 C ATOM 998 CG GLN A 65 -1.126 -9.415 -21.328 1.00 0.00 C ATOM 999 CD GLN A 65 -2.568 -9.206 -21.796 1.00 0.00 C ATOM 1000 OE1 GLN A 65 -2.905 -8.166 -22.322 1.00 0.00 O ATOM 1001 NE2 GLN A 65 -3.441 -10.161 -21.617 1.00 0.00 N ATOM 0 H GLN A 65 0.036 -6.598 -18.753 1.00 0.00 H new ATOM 0 HA GLN A 65 -2.518 -7.681 -19.643 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -0.695 -7.300 -21.231 1.00 0.00 H new ATOM 0 HB3 GLN A 65 0.401 -8.293 -20.291 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -0.480 -9.610 -22.184 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -1.067 -10.289 -20.679 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -3.157 -11.035 -21.175 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -4.407 -10.033 -21.920 1.00 0.00 H new ATOM 1010 N GLU A 66 -0.438 -9.631 -17.961 1.00 0.00 N ATOM 1011 CA GLU A 66 -0.424 -10.880 -17.152 1.00 0.00 C ATOM 1012 C GLU A 66 -1.406 -10.773 -15.982 1.00 0.00 C ATOM 1013 O GLU A 66 -1.981 -11.755 -15.560 1.00 0.00 O ATOM 1014 CB GLU A 66 0.983 -11.128 -16.614 1.00 0.00 C ATOM 1015 CG GLU A 66 1.034 -12.499 -15.935 1.00 0.00 C ATOM 1016 CD GLU A 66 0.894 -13.601 -16.992 1.00 0.00 C ATOM 1017 OE1 GLU A 66 1.234 -13.344 -18.134 1.00 0.00 O ATOM 1018 OE2 GLU A 66 0.446 -14.680 -16.639 1.00 0.00 O ATOM 0 H GLU A 66 0.460 -9.154 -18.044 1.00 0.00 H new ATOM 0 HA GLU A 66 -0.726 -11.711 -17.790 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.708 -11.086 -17.427 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.255 -10.348 -15.903 1.00 0.00 H new ATOM 0 HG2 GLU A 66 1.975 -12.615 -15.397 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.234 -12.582 -15.200 1.00 0.00 H new ATOM 1026 N GLU A 67 -1.592 -9.601 -15.438 1.00 0.00 N ATOM 1027 CA GLU A 67 -2.524 -9.472 -14.283 1.00 0.00 C ATOM 1028 C GLU A 67 -3.981 -9.476 -14.757 1.00 0.00 C ATOM 1029 O GLU A 67 -4.660 -10.479 -14.667 1.00 0.00 O ATOM 1030 CB GLU A 67 -2.215 -8.188 -13.519 1.00 0.00 C ATOM 1031 CG GLU A 67 -1.326 -8.530 -12.325 1.00 0.00 C ATOM 1032 CD GLU A 67 -0.011 -9.135 -12.821 1.00 0.00 C ATOM 1033 OE1 GLU A 67 0.618 -9.842 -12.052 1.00 0.00 O ATOM 1034 OE2 GLU A 67 0.345 -8.881 -13.962 1.00 0.00 O ATOM 0 H GLU A 67 -1.144 -8.736 -15.740 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.385 -10.326 -13.620 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -1.714 -7.472 -14.170 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -3.138 -7.718 -13.180 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.127 -7.633 -11.738 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.837 -9.234 -11.668 1.00 0.00 H new ATOM 1042 N ALA A 68 -4.485 -8.381 -15.257 1.00 0.00 N ATOM 1043 CA ALA A 68 -5.904 -8.392 -15.711 1.00 0.00 C ATOM 1044 C ALA A 68 -5.987 -8.975 -17.116 1.00 0.00 C ATOM 1045 O ALA A 68 -7.055 -9.123 -17.667 1.00 0.00 O ATOM 1046 CB ALA A 68 -6.479 -6.975 -15.739 1.00 0.00 C ATOM 0 H ALA A 68 -3.988 -7.497 -15.369 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.479 -8.999 -15.011 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.516 -7.010 -16.074 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -6.435 -6.545 -14.739 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.897 -6.360 -16.425 1.00 0.00 H new ATOM 1052 N GLY A 69 -4.878 -9.305 -17.713 1.00 0.00 N ATOM 1053 CA GLY A 69 -4.936 -9.863 -19.087 1.00 0.00 C ATOM 1054 C GLY A 69 -5.098 -8.716 -20.082 1.00 0.00 C ATOM 1055 O GLY A 69 -5.516 -8.915 -21.206 1.00 0.00 O ATOM 0 H GLY A 69 -3.944 -9.213 -17.313 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -4.027 -10.424 -19.304 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -5.770 -10.559 -19.176 1.00 0.00 H new ATOM 1059 N ILE A 70 -4.784 -7.513 -19.680 1.00 0.00 N ATOM 1060 CA ILE A 70 -4.944 -6.364 -20.610 1.00 0.00 C ATOM 1061 C ILE A 70 -3.580 -5.937 -21.150 1.00 0.00 C ATOM 1062 O ILE A 70 -2.671 -5.634 -20.404 1.00 0.00 O ATOM 1063 CB ILE A 70 -5.567 -5.190 -19.862 1.00 0.00 C ATOM 1064 CG1 ILE A 70 -6.687 -5.710 -18.964 1.00 0.00 C ATOM 1065 CG2 ILE A 70 -6.144 -4.201 -20.877 1.00 0.00 C ATOM 1066 CD1 ILE A 70 -7.317 -4.547 -18.201 1.00 0.00 C ATOM 0 H ILE A 70 -4.426 -7.280 -18.754 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.586 -6.664 -21.438 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.812 -4.691 -19.254 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -7.443 -6.215 -19.565 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -6.292 -6.446 -18.263 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.592 -3.358 -20.350 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.347 -3.840 -21.527 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -6.905 -4.699 -21.478 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -8.116 -4.922 -17.561 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -6.558 -4.061 -17.587 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.727 -3.827 -18.909 1.00 0.00 H new ATOM 1078 N GLU A 71 -3.438 -5.895 -22.441 1.00 0.00 N ATOM 1079 CA GLU A 71 -2.140 -5.475 -23.029 1.00 0.00 C ATOM 1080 C GLU A 71 -2.170 -3.979 -23.285 1.00 0.00 C ATOM 1081 O GLU A 71 -3.216 -3.363 -23.335 1.00 0.00 O ATOM 1082 CB GLU A 71 -1.903 -6.216 -24.346 1.00 0.00 C ATOM 1083 CG GLU A 71 -2.990 -5.835 -25.349 1.00 0.00 C ATOM 1084 CD GLU A 71 -2.818 -6.665 -26.623 1.00 0.00 C ATOM 1085 OE1 GLU A 71 -3.718 -6.644 -27.446 1.00 0.00 O ATOM 1086 OE2 GLU A 71 -1.788 -7.305 -26.755 1.00 0.00 O ATOM 0 H GLU A 71 -4.165 -6.133 -23.116 1.00 0.00 H new ATOM 0 HA GLU A 71 -1.333 -5.714 -22.336 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -0.921 -5.964 -24.745 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.911 -7.293 -24.176 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -3.976 -6.010 -24.918 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -2.928 -4.772 -25.583 1.00 0.00 H new ATOM 1094 N ALA A 72 -1.027 -3.385 -23.441 1.00 0.00 N ATOM 1095 CA ALA A 72 -0.982 -1.923 -23.692 1.00 0.00 C ATOM 1096 C ALA A 72 -1.691 -1.616 -25.013 1.00 0.00 C ATOM 1097 O ALA A 72 -2.165 -0.522 -25.240 1.00 0.00 O ATOM 1098 CB ALA A 72 0.472 -1.467 -23.767 1.00 0.00 C ATOM 0 H ALA A 72 -0.119 -3.849 -23.406 1.00 0.00 H new ATOM 0 HA ALA A 72 -1.483 -1.393 -22.882 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.508 -0.393 -23.951 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.972 -1.690 -22.825 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.976 -1.991 -24.579 1.00 0.00 H new ATOM 1104 N GLY A 73 -1.763 -2.581 -25.887 1.00 0.00 N ATOM 1105 CA GLY A 73 -2.432 -2.357 -27.197 1.00 0.00 C ATOM 1106 C GLY A 73 -3.839 -1.798 -26.978 1.00 0.00 C ATOM 1107 O GLY A 73 -4.320 -0.995 -27.755 1.00 0.00 O ATOM 0 H GLY A 73 -1.386 -3.518 -25.749 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -1.846 -1.663 -27.800 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -2.486 -3.294 -27.752 1.00 0.00 H new ATOM 1111 N GLN A 74 -4.508 -2.206 -25.933 1.00 0.00 N ATOM 1112 CA GLN A 74 -5.882 -1.676 -25.693 1.00 0.00 C ATOM 1113 C GLN A 74 -5.836 -0.595 -24.613 1.00 0.00 C ATOM 1114 O GLN A 74 -6.842 -0.012 -24.259 1.00 0.00 O ATOM 1115 CB GLN A 74 -6.830 -2.808 -25.271 1.00 0.00 C ATOM 1116 CG GLN A 74 -6.210 -3.632 -24.148 1.00 0.00 C ATOM 1117 CD GLN A 74 -6.994 -4.937 -23.999 1.00 0.00 C ATOM 1118 OE1 GLN A 74 -6.485 -5.913 -23.480 1.00 0.00 O ATOM 1119 NE2 GLN A 74 -8.222 -4.997 -24.433 1.00 0.00 N ATOM 0 H GLN A 74 -4.168 -2.875 -25.242 1.00 0.00 H new ATOM 0 HA GLN A 74 -6.259 -1.241 -26.619 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.781 -2.390 -24.941 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -7.043 -3.450 -26.126 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -5.164 -3.844 -24.369 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -6.231 -3.071 -23.214 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -8.650 -4.180 -24.868 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -8.755 -5.861 -24.337 1.00 0.00 H new ATOM 1128 N LEU A 75 -4.671 -0.310 -24.096 1.00 0.00 N ATOM 1129 CA LEU A 75 -4.556 0.745 -23.051 1.00 0.00 C ATOM 1130 C LEU A 75 -3.752 1.923 -23.578 1.00 0.00 C ATOM 1131 O LEU A 75 -2.803 1.765 -24.321 1.00 0.00 O ATOM 1132 CB LEU A 75 -3.798 0.216 -21.838 1.00 0.00 C ATOM 1133 CG LEU A 75 -4.483 -1.018 -21.284 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -3.495 -1.770 -20.404 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -5.672 -0.580 -20.439 1.00 0.00 C ATOM 0 H LEU A 75 -3.794 -0.763 -24.353 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.569 1.044 -22.781 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -2.773 -0.024 -22.118 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.746 0.987 -21.069 1.00 0.00 H new ATOM 0 HG LEU A 75 -4.822 -1.661 -22.096 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -3.974 -2.661 -19.998 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.629 -2.062 -20.997 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.174 -1.126 -19.585 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -6.174 -1.459 -20.034 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -5.324 0.049 -19.620 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.370 -0.016 -21.058 1.00 0.00 H new ATOM 1147 N THR A 76 -4.087 3.096 -23.138 1.00 0.00 N ATOM 1148 CA THR A 76 -3.309 4.292 -23.535 1.00 0.00 C ATOM 1149 C THR A 76 -2.742 4.872 -22.247 1.00 0.00 C ATOM 1150 O THR A 76 -3.469 5.145 -21.311 1.00 0.00 O ATOM 1151 CB THR A 76 -4.217 5.304 -24.242 1.00 0.00 C ATOM 1152 OG1 THR A 76 -3.517 5.864 -25.345 1.00 0.00 O ATOM 1153 CG2 THR A 76 -4.618 6.419 -23.276 1.00 0.00 C ATOM 0 H THR A 76 -4.873 3.279 -22.515 1.00 0.00 H new ATOM 0 HA THR A 76 -2.511 4.042 -24.234 1.00 0.00 H new ATOM 0 HB THR A 76 -5.117 4.797 -24.589 1.00 0.00 H new ATOM 0 HG1 THR A 76 -4.093 6.511 -25.803 1.00 0.00 H new ATOM 0 HG21 THR A 76 -5.263 7.132 -23.790 1.00 0.00 H new ATOM 0 HG22 THR A 76 -5.153 5.991 -22.428 1.00 0.00 H new ATOM 0 HG23 THR A 76 -3.724 6.931 -22.920 1.00 0.00 H new ATOM 1161 N ILE A 77 -1.456 5.025 -22.153 1.00 0.00 N ATOM 1162 CA ILE A 77 -0.899 5.547 -20.883 1.00 0.00 C ATOM 1163 C ILE A 77 -0.993 7.060 -20.847 1.00 0.00 C ATOM 1164 O ILE A 77 -0.266 7.757 -21.524 1.00 0.00 O ATOM 1165 CB ILE A 77 0.565 5.142 -20.731 1.00 0.00 C ATOM 1166 CG1 ILE A 77 0.695 3.619 -20.869 1.00 0.00 C ATOM 1167 CG2 ILE A 77 1.060 5.587 -19.349 1.00 0.00 C ATOM 1168 CD1 ILE A 77 1.139 3.021 -19.532 1.00 0.00 C ATOM 0 H ILE A 77 -0.778 4.816 -22.885 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.480 5.123 -20.064 1.00 0.00 H new ATOM 0 HB ILE A 77 1.166 5.618 -21.506 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -0.259 3.188 -21.173 1.00 0.00 H new ATOM 0 HG13 ILE A 77 1.418 3.374 -21.647 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.105 5.303 -19.228 1.00 0.00 H new ATOM 0 HG22 ILE A 77 0.965 6.669 -19.260 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.462 5.105 -18.576 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.231 1.939 -19.630 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.103 3.443 -19.247 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.400 3.254 -18.766 1.00 0.00 H new ATOM 1180 N ILE A 78 -1.851 7.575 -20.021 1.00 0.00 N ATOM 1181 CA ILE A 78 -1.948 9.047 -19.899 1.00 0.00 C ATOM 1182 C ILE A 78 -0.600 9.532 -19.422 1.00 0.00 C ATOM 1183 O ILE A 78 -0.186 10.646 -19.678 1.00 0.00 O ATOM 1184 CB ILE A 78 -2.978 9.417 -18.837 1.00 0.00 C ATOM 1185 CG1 ILE A 78 -4.383 9.242 -19.404 1.00 0.00 C ATOM 1186 CG2 ILE A 78 -2.755 10.865 -18.403 1.00 0.00 C ATOM 1187 CD1 ILE A 78 -4.558 7.787 -19.829 1.00 0.00 C ATOM 0 H ILE A 78 -2.487 7.042 -19.427 1.00 0.00 H new ATOM 0 HA ILE A 78 -2.238 9.489 -20.852 1.00 0.00 H new ATOM 0 HB ILE A 78 -2.868 8.765 -17.971 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -5.129 9.510 -18.656 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -4.533 9.906 -20.256 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.489 11.134 -17.644 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -1.751 10.971 -17.991 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -2.865 11.524 -19.264 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -5.559 7.645 -20.237 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.817 7.538 -20.589 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.423 7.137 -18.965 1.00 0.00 H new ATOM 1199 N GLU A 79 0.061 8.695 -18.681 1.00 0.00 N ATOM 1200 CA GLU A 79 1.372 9.075 -18.116 1.00 0.00 C ATOM 1201 C GLU A 79 1.145 10.261 -17.203 1.00 0.00 C ATOM 1202 O GLU A 79 0.372 10.194 -16.269 1.00 0.00 O ATOM 1203 CB GLU A 79 2.348 9.462 -19.230 1.00 0.00 C ATOM 1204 CG GLU A 79 2.665 8.234 -20.078 1.00 0.00 C ATOM 1205 CD GLU A 79 3.750 8.587 -21.093 1.00 0.00 C ATOM 1206 OE1 GLU A 79 4.078 9.758 -21.198 1.00 0.00 O ATOM 1207 OE2 GLU A 79 4.238 7.681 -21.749 1.00 0.00 O ATOM 0 H GLU A 79 -0.257 7.756 -18.442 1.00 0.00 H new ATOM 0 HA GLU A 79 1.803 8.236 -17.570 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.914 10.245 -19.852 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.264 9.867 -18.801 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.999 7.415 -19.441 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.767 7.892 -20.593 1.00 0.00 H new ATOM 1215 N GLY A 80 1.787 11.350 -17.475 1.00 0.00 N ATOM 1216 CA GLY A 80 1.586 12.550 -16.625 1.00 0.00 C ATOM 1217 C GLY A 80 1.911 12.196 -15.176 1.00 0.00 C ATOM 1218 O GLY A 80 2.775 12.791 -14.563 1.00 0.00 O ATOM 0 H GLY A 80 2.443 11.466 -18.248 1.00 0.00 H new ATOM 0 HA2 GLY A 80 2.226 13.364 -16.966 1.00 0.00 H new ATOM 0 HA3 GLY A 80 0.557 12.899 -16.705 1.00 0.00 H new ATOM 1222 N PHE A 81 1.231 11.230 -14.622 1.00 0.00 N ATOM 1223 CA PHE A 81 1.512 10.846 -13.215 1.00 0.00 C ATOM 1224 C PHE A 81 2.324 9.550 -13.188 1.00 0.00 C ATOM 1225 O PHE A 81 1.881 8.514 -13.647 1.00 0.00 O ATOM 1226 CB PHE A 81 0.191 10.624 -12.473 1.00 0.00 C ATOM 1227 CG PHE A 81 0.465 10.456 -10.997 1.00 0.00 C ATOM 1228 CD1 PHE A 81 0.810 9.200 -10.487 1.00 0.00 C ATOM 1229 CD2 PHE A 81 0.377 11.561 -10.140 1.00 0.00 C ATOM 1230 CE1 PHE A 81 1.064 9.045 -9.118 1.00 0.00 C ATOM 1231 CE2 PHE A 81 0.630 11.405 -8.772 1.00 0.00 C ATOM 1232 CZ PHE A 81 0.976 10.148 -8.261 1.00 0.00 C ATOM 0 H PHE A 81 0.496 10.693 -15.083 1.00 0.00 H new ATOM 0 HA PHE A 81 2.078 11.643 -12.732 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -0.477 11.470 -12.636 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -0.314 9.740 -12.863 1.00 0.00 H new ATOM 0 HD1 PHE A 81 0.881 8.349 -11.149 1.00 0.00 H new ATOM 0 HD2 PHE A 81 0.114 12.532 -10.534 1.00 0.00 H new ATOM 0 HE1 PHE A 81 1.328 8.075 -8.724 1.00 0.00 H new ATOM 0 HE2 PHE A 81 0.558 12.255 -8.110 1.00 0.00 H new ATOM 0 HZ PHE A 81 1.175 10.030 -7.206 1.00 0.00 H new ATOM 1242 N LYS A 82 3.499 9.600 -12.632 1.00 0.00 N ATOM 1243 CA LYS A 82 4.346 8.377 -12.538 1.00 0.00 C ATOM 1244 C LYS A 82 5.259 8.517 -11.335 1.00 0.00 C ATOM 1245 O LYS A 82 6.137 9.352 -11.310 1.00 0.00 O ATOM 1246 CB LYS A 82 5.210 8.222 -13.791 1.00 0.00 C ATOM 1247 CG LYS A 82 6.221 7.076 -13.600 1.00 0.00 C ATOM 1248 CD LYS A 82 7.414 7.531 -12.745 1.00 0.00 C ATOM 1249 CE LYS A 82 8.635 6.660 -13.066 1.00 0.00 C ATOM 1250 NZ LYS A 82 9.864 7.299 -12.516 1.00 0.00 N ATOM 0 H LYS A 82 3.915 10.442 -12.234 1.00 0.00 H new ATOM 0 HA LYS A 82 3.702 7.503 -12.442 1.00 0.00 H new ATOM 0 HB2 LYS A 82 4.578 8.019 -14.655 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.739 9.153 -13.995 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.729 6.228 -13.123 1.00 0.00 H new ATOM 0 HG3 LYS A 82 6.575 6.733 -14.572 1.00 0.00 H new ATOM 0 HD2 LYS A 82 7.639 8.579 -12.944 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.167 7.453 -11.686 1.00 0.00 H new ATOM 0 HE2 LYS A 82 8.507 5.666 -12.638 1.00 0.00 H new ATOM 0 HE3 LYS A 82 8.730 6.533 -14.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 10.691 6.707 -12.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 9.988 8.239 -12.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 9.772 7.398 -11.485 1.00 0.00 H new ATOM 1264 N ARG A 83 5.081 7.696 -10.350 1.00 0.00 N ATOM 1265 CA ARG A 83 5.965 7.775 -9.163 1.00 0.00 C ATOM 1266 C ARG A 83 6.147 6.373 -8.600 1.00 0.00 C ATOM 1267 O ARG A 83 5.468 5.446 -8.992 1.00 0.00 O ATOM 1268 CB ARG A 83 5.350 8.691 -8.103 1.00 0.00 C ATOM 1269 CG ARG A 83 5.355 10.138 -8.607 1.00 0.00 C ATOM 1270 CD ARG A 83 6.796 10.598 -8.856 1.00 0.00 C ATOM 1271 NE ARG A 83 7.006 11.937 -8.236 1.00 0.00 N ATOM 1272 CZ ARG A 83 8.214 12.411 -8.102 1.00 0.00 C ATOM 1273 NH1 ARG A 83 9.235 11.713 -8.516 1.00 0.00 N ATOM 1274 NH2 ARG A 83 8.397 13.580 -7.555 1.00 0.00 N ATOM 0 H ARG A 83 4.362 6.973 -10.313 1.00 0.00 H new ATOM 0 HA ARG A 83 6.932 8.188 -9.451 1.00 0.00 H new ATOM 0 HB2 ARG A 83 4.330 8.376 -7.883 1.00 0.00 H new ATOM 0 HB3 ARG A 83 5.914 8.617 -7.173 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.776 10.214 -9.527 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.877 10.789 -7.875 1.00 0.00 H new ATOM 0 HD2 ARG A 83 7.497 9.877 -8.435 1.00 0.00 H new ATOM 0 HD3 ARG A 83 6.993 10.647 -9.927 1.00 0.00 H new ATOM 0 HE ARG A 83 6.206 12.483 -7.917 1.00 0.00 H new ATOM 0 HH11 ARG A 83 9.088 10.799 -8.943 1.00 0.00 H new ATOM 0 HH12 ARG A 83 10.180 12.082 -8.412 1.00 0.00 H new ATOM 0 HH21 ARG A 83 7.596 14.123 -7.232 1.00 0.00 H new ATOM 0 HH22 ARG A 83 9.341 13.952 -7.450 1.00 0.00 H new ATOM 1288 N GLU A 84 7.061 6.201 -7.695 1.00 0.00 N ATOM 1289 CA GLU A 84 7.271 4.845 -7.138 1.00 0.00 C ATOM 1290 C GLU A 84 6.290 4.601 -5.996 1.00 0.00 C ATOM 1291 O GLU A 84 6.461 5.087 -4.897 1.00 0.00 O ATOM 1292 CB GLU A 84 8.703 4.718 -6.620 1.00 0.00 C ATOM 1293 CG GLU A 84 9.677 4.901 -7.780 1.00 0.00 C ATOM 1294 CD GLU A 84 10.015 6.385 -7.937 1.00 0.00 C ATOM 1295 OE1 GLU A 84 9.442 7.185 -7.216 1.00 0.00 O ATOM 1296 OE2 GLU A 84 10.845 6.697 -8.776 1.00 0.00 O ATOM 0 H GLU A 84 7.666 6.932 -7.320 1.00 0.00 H new ATOM 0 HA GLU A 84 7.104 4.105 -7.921 1.00 0.00 H new ATOM 0 HB2 GLU A 84 8.891 5.467 -5.850 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.849 3.742 -6.158 1.00 0.00 H new ATOM 0 HG2 GLU A 84 10.586 4.328 -7.599 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.237 4.518 -8.701 1.00 0.00 H new ATOM 1304 N LEU A 85 5.277 3.821 -6.248 1.00 0.00 N ATOM 1305 CA LEU A 85 4.299 3.505 -5.181 1.00 0.00 C ATOM 1306 C LEU A 85 4.986 2.525 -4.239 1.00 0.00 C ATOM 1307 O LEU A 85 5.549 1.544 -4.675 1.00 0.00 O ATOM 1308 CB LEU A 85 3.068 2.836 -5.805 1.00 0.00 C ATOM 1309 CG LEU A 85 1.840 3.074 -4.921 1.00 0.00 C ATOM 1310 CD1 LEU A 85 0.892 4.082 -5.582 1.00 0.00 C ATOM 1311 CD2 LEU A 85 1.084 1.760 -4.708 1.00 0.00 C ATOM 0 H LEU A 85 5.087 3.389 -7.152 1.00 0.00 H new ATOM 0 HA LEU A 85 3.979 4.404 -4.654 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.892 3.238 -6.803 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.243 1.766 -5.918 1.00 0.00 H new ATOM 0 HG LEU A 85 2.182 3.467 -3.963 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.025 4.240 -4.941 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.412 5.029 -5.729 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.565 3.695 -6.547 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.213 1.940 -4.078 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.760 1.366 -5.671 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.740 1.037 -4.222 1.00 0.00 H new ATOM 1323 N ASN A 86 4.992 2.781 -2.965 1.00 0.00 N ATOM 1324 CA ASN A 86 5.694 1.842 -2.049 1.00 0.00 C ATOM 1325 C ASN A 86 4.773 1.411 -0.912 1.00 0.00 C ATOM 1326 O ASN A 86 4.213 2.223 -0.202 1.00 0.00 O ATOM 1327 CB ASN A 86 6.940 2.531 -1.496 1.00 0.00 C ATOM 1328 CG ASN A 86 7.904 2.784 -2.652 1.00 0.00 C ATOM 1329 OD1 ASN A 86 7.580 2.370 -3.849 1.00 0.00 O flip ATOM 1330 ND2 ASN A 86 8.960 3.357 -2.471 1.00 0.00 N flip ATOM 0 H ASN A 86 4.549 3.586 -2.521 1.00 0.00 H new ATOM 0 HA ASN A 86 5.985 0.947 -2.599 1.00 0.00 H new ATOM 0 HB2 ASN A 86 6.671 3.471 -1.014 1.00 0.00 H new ATOM 0 HB3 ASN A 86 7.413 1.907 -0.737 1.00 0.00 H new ATOM 0 HD21 ASN A 86 9.212 3.680 -1.537 1.00 0.00 H new ATOM 0 HD22 ASN A 86 9.595 3.516 -3.253 1.00 0.00 H new ATOM 1337 N TYR A 87 4.621 0.129 -0.736 1.00 0.00 N ATOM 1338 CA TYR A 87 3.748 -0.380 0.351 1.00 0.00 C ATOM 1339 C TYR A 87 4.270 -1.735 0.826 1.00 0.00 C ATOM 1340 O TYR A 87 5.104 -2.350 0.190 1.00 0.00 O ATOM 1341 CB TYR A 87 2.309 -0.494 -0.159 1.00 0.00 C ATOM 1342 CG TYR A 87 2.219 -1.508 -1.275 1.00 0.00 C ATOM 1343 CD1 TYR A 87 2.672 -1.179 -2.560 1.00 0.00 C ATOM 1344 CD2 TYR A 87 1.652 -2.764 -1.034 1.00 0.00 C ATOM 1345 CE1 TYR A 87 2.555 -2.105 -3.603 1.00 0.00 C ATOM 1346 CE2 TYR A 87 1.540 -3.692 -2.074 1.00 0.00 C ATOM 1347 CZ TYR A 87 1.990 -3.362 -3.357 1.00 0.00 C ATOM 1348 OH TYR A 87 1.869 -4.273 -4.381 1.00 0.00 O ATOM 0 H TYR A 87 5.068 -0.591 -1.304 1.00 0.00 H new ATOM 0 HA TYR A 87 3.759 0.311 1.194 1.00 0.00 H new ATOM 0 HB2 TYR A 87 1.650 -0.786 0.659 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.965 0.477 -0.514 1.00 0.00 H new ATOM 0 HD1 TYR A 87 3.112 -0.210 -2.745 1.00 0.00 H new ATOM 0 HD2 TYR A 87 1.301 -3.017 -0.045 1.00 0.00 H new ATOM 0 HE1 TYR A 87 2.900 -1.851 -4.594 1.00 0.00 H new ATOM 0 HE2 TYR A 87 1.106 -4.663 -1.887 1.00 0.00 H new ATOM 0 HH TYR A 87 1.121 -4.017 -4.960 1.00 0.00 H new ATOM 1358 N VAL A 88 3.808 -2.192 1.955 1.00 0.00 N ATOM 1359 CA VAL A 88 4.300 -3.493 2.490 1.00 0.00 C ATOM 1360 C VAL A 88 3.176 -4.527 2.490 1.00 0.00 C ATOM 1361 O VAL A 88 3.401 -5.697 2.726 1.00 0.00 O ATOM 1362 CB VAL A 88 4.781 -3.281 3.923 1.00 0.00 C ATOM 1363 CG1 VAL A 88 5.715 -2.074 3.975 1.00 0.00 C ATOM 1364 CG2 VAL A 88 3.574 -3.024 4.829 1.00 0.00 C ATOM 0 H VAL A 88 3.111 -1.721 2.532 1.00 0.00 H new ATOM 0 HA VAL A 88 5.114 -3.856 1.862 1.00 0.00 H new ATOM 0 HB VAL A 88 5.314 -4.169 4.262 1.00 0.00 H new ATOM 0 HG11 VAL A 88 6.058 -1.923 4.999 1.00 0.00 H new ATOM 0 HG12 VAL A 88 6.573 -2.250 3.327 1.00 0.00 H new ATOM 0 HG13 VAL A 88 5.181 -1.186 3.637 1.00 0.00 H new ATOM 0 HG21 VAL A 88 3.914 -2.872 5.853 1.00 0.00 H new ATOM 0 HG22 VAL A 88 3.045 -2.135 4.487 1.00 0.00 H new ATOM 0 HG23 VAL A 88 2.903 -3.882 4.793 1.00 0.00 H new ATOM 1374 N ALA A 89 1.967 -4.112 2.238 1.00 0.00 N ATOM 1375 CA ALA A 89 0.842 -5.084 2.240 1.00 0.00 C ATOM 1376 C ALA A 89 1.030 -6.060 3.405 1.00 0.00 C ATOM 1377 O ALA A 89 0.941 -5.685 4.559 1.00 0.00 O ATOM 1378 CB ALA A 89 0.832 -5.859 0.921 1.00 0.00 C ATOM 0 H ALA A 89 1.711 -3.147 2.032 1.00 0.00 H new ATOM 0 HA ALA A 89 -0.103 -4.553 2.351 1.00 0.00 H new ATOM 0 HB1 ALA A 89 0.007 -6.571 0.924 1.00 0.00 H new ATOM 0 HB2 ALA A 89 0.708 -5.163 0.091 1.00 0.00 H new ATOM 0 HB3 ALA A 89 1.774 -6.395 0.807 1.00 0.00 H new ATOM 1384 N ARG A 90 1.296 -7.303 3.115 1.00 0.00 N ATOM 1385 CA ARG A 90 1.497 -8.297 4.204 1.00 0.00 C ATOM 1386 C ARG A 90 2.706 -7.893 5.056 1.00 0.00 C ATOM 1387 O ARG A 90 2.692 -8.023 6.262 1.00 0.00 O ATOM 1388 CB ARG A 90 1.751 -9.670 3.582 1.00 0.00 C ATOM 1389 CG ARG A 90 0.529 -10.095 2.765 1.00 0.00 C ATOM 1390 CD ARG A 90 0.833 -11.406 2.040 1.00 0.00 C ATOM 1391 NE ARG A 90 0.945 -12.508 3.034 1.00 0.00 N ATOM 1392 CZ ARG A 90 1.825 -13.458 2.865 1.00 0.00 C ATOM 1393 NH1 ARG A 90 2.592 -13.462 1.808 1.00 0.00 N ATOM 1394 NH2 ARG A 90 1.929 -14.411 3.750 1.00 0.00 N ATOM 0 H ARG A 90 1.383 -7.673 2.169 1.00 0.00 H new ATOM 0 HA ARG A 90 0.609 -8.333 4.835 1.00 0.00 H new ATOM 0 HB2 ARG A 90 2.634 -9.634 2.944 1.00 0.00 H new ATOM 0 HB3 ARG A 90 1.952 -10.403 4.363 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -0.334 -10.220 3.419 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.272 -9.319 2.044 1.00 0.00 H new ATOM 0 HD2 ARG A 90 0.044 -11.628 1.322 1.00 0.00 H new ATOM 0 HD3 ARG A 90 1.761 -11.315 1.476 1.00 0.00 H new ATOM 0 HE ARG A 90 0.333 -12.521 3.850 1.00 0.00 H new ATOM 0 HH11 ARG A 90 2.505 -12.722 1.112 1.00 0.00 H new ATOM 0 HH12 ARG A 90 3.278 -14.205 1.679 1.00 0.00 H new ATOM 0 HH21 ARG A 90 1.324 -14.413 4.571 1.00 0.00 H new ATOM 0 HH22 ARG A 90 2.615 -15.154 3.621 1.00 0.00 H new ATOM 1408 N ASN A 91 3.748 -7.404 4.428 1.00 0.00 N ATOM 1409 CA ASN A 91 4.972 -6.987 5.181 1.00 0.00 C ATOM 1410 C ASN A 91 6.173 -6.994 4.228 1.00 0.00 C ATOM 1411 O ASN A 91 7.240 -7.470 4.561 1.00 0.00 O ATOM 1412 CB ASN A 91 5.244 -7.963 6.335 1.00 0.00 C ATOM 1413 CG ASN A 91 6.605 -7.649 6.958 1.00 0.00 C ATOM 1414 OD1 ASN A 91 7.567 -8.358 6.735 1.00 0.00 O ATOM 1415 ND2 ASN A 91 6.727 -6.608 7.735 1.00 0.00 N ATOM 0 H ASN A 91 3.803 -7.275 3.418 1.00 0.00 H new ATOM 0 HA ASN A 91 4.817 -5.987 5.587 1.00 0.00 H new ATOM 0 HB2 ASN A 91 4.460 -7.881 7.088 1.00 0.00 H new ATOM 0 HB3 ASN A 91 5.228 -8.990 5.969 1.00 0.00 H new ATOM 0 HD21 ASN A 91 7.630 -6.389 8.156 1.00 0.00 H new ATOM 0 HD22 ASN A 91 5.919 -6.014 7.922 1.00 0.00 H new ATOM 1422 N LYS A 92 6.006 -6.481 3.041 1.00 0.00 N ATOM 1423 CA LYS A 92 7.136 -6.471 2.068 1.00 0.00 C ATOM 1424 C LYS A 92 7.331 -5.058 1.506 1.00 0.00 C ATOM 1425 O LYS A 92 6.794 -4.721 0.470 1.00 0.00 O ATOM 1426 CB LYS A 92 6.820 -7.437 0.921 1.00 0.00 C ATOM 1427 CG LYS A 92 6.296 -8.752 1.497 1.00 0.00 C ATOM 1428 CD LYS A 92 5.890 -9.687 0.357 1.00 0.00 C ATOM 1429 CE LYS A 92 5.487 -11.048 0.929 1.00 0.00 C ATOM 1430 NZ LYS A 92 5.689 -12.100 -0.108 1.00 0.00 N ATOM 0 H LYS A 92 5.137 -6.068 2.702 1.00 0.00 H new ATOM 0 HA LYS A 92 8.050 -6.782 2.573 1.00 0.00 H new ATOM 0 HB2 LYS A 92 6.078 -6.998 0.254 1.00 0.00 H new ATOM 0 HB3 LYS A 92 7.715 -7.618 0.326 1.00 0.00 H new ATOM 0 HG2 LYS A 92 7.064 -9.223 2.111 1.00 0.00 H new ATOM 0 HG3 LYS A 92 5.441 -8.561 2.146 1.00 0.00 H new ATOM 0 HD2 LYS A 92 5.060 -9.256 -0.202 1.00 0.00 H new ATOM 0 HD3 LYS A 92 6.718 -9.806 -0.342 1.00 0.00 H new ATOM 0 HE2 LYS A 92 6.083 -11.274 1.813 1.00 0.00 H new ATOM 0 HE3 LYS A 92 4.444 -11.028 1.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 5.416 -13.026 0.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 5.102 -11.885 -0.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 6.690 -12.124 -0.388 1.00 0.00 H new ATOM 1444 N PRO A 93 8.090 -4.234 2.183 1.00 0.00 N ATOM 1445 CA PRO A 93 8.347 -2.837 1.729 1.00 0.00 C ATOM 1446 C PRO A 93 9.133 -2.788 0.415 1.00 0.00 C ATOM 1447 O PRO A 93 10.258 -2.333 0.367 1.00 0.00 O ATOM 1448 CB PRO A 93 9.154 -2.202 2.865 1.00 0.00 C ATOM 1449 CG PRO A 93 9.694 -3.335 3.678 1.00 0.00 C ATOM 1450 CD PRO A 93 8.783 -4.540 3.444 1.00 0.00 C ATOM 0 HA PRO A 93 7.414 -2.310 1.526 1.00 0.00 H new ATOM 0 HB2 PRO A 93 9.962 -1.586 2.471 1.00 0.00 H new ATOM 0 HB3 PRO A 93 8.525 -1.552 3.473 1.00 0.00 H new ATOM 0 HG2 PRO A 93 10.718 -3.565 3.383 1.00 0.00 H new ATOM 0 HG3 PRO A 93 9.718 -3.071 4.735 1.00 0.00 H new ATOM 0 HD2 PRO A 93 9.357 -5.464 3.368 1.00 0.00 H new ATOM 0 HD3 PRO A 93 8.077 -4.670 4.264 1.00 0.00 H new ATOM 1458 N LYS A 94 8.542 -3.245 -0.654 1.00 0.00 N ATOM 1459 CA LYS A 94 9.244 -3.218 -1.966 1.00 0.00 C ATOM 1460 C LYS A 94 8.763 -1.997 -2.748 1.00 0.00 C ATOM 1461 O LYS A 94 7.677 -1.500 -2.522 1.00 0.00 O ATOM 1462 CB LYS A 94 8.915 -4.491 -2.752 1.00 0.00 C ATOM 1463 CG LYS A 94 9.195 -5.723 -1.883 1.00 0.00 C ATOM 1464 CD LYS A 94 10.678 -5.765 -1.505 1.00 0.00 C ATOM 1465 CE LYS A 94 11.010 -7.130 -0.901 1.00 0.00 C ATOM 1466 NZ LYS A 94 12.275 -7.034 -0.119 1.00 0.00 N ATOM 0 H LYS A 94 7.601 -3.637 -0.675 1.00 0.00 H new ATOM 0 HA LYS A 94 10.322 -3.164 -1.812 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.869 -4.480 -3.058 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.513 -4.533 -3.662 1.00 0.00 H new ATOM 0 HG2 LYS A 94 8.582 -5.691 -0.983 1.00 0.00 H new ATOM 0 HG3 LYS A 94 8.922 -6.630 -2.423 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.294 -5.585 -2.386 1.00 0.00 H new ATOM 0 HD3 LYS A 94 10.905 -4.974 -0.790 1.00 0.00 H new ATOM 0 HE2 LYS A 94 10.196 -7.462 -0.256 1.00 0.00 H new ATOM 0 HE3 LYS A 94 11.114 -7.873 -1.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 12.501 -7.962 0.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 13.049 -6.736 -0.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 12.159 -6.337 0.644 1.00 0.00 H new ATOM 1480 N THR A 95 9.553 -1.498 -3.657 1.00 0.00 N ATOM 1481 CA THR A 95 9.113 -0.303 -4.427 1.00 0.00 C ATOM 1482 C THR A 95 8.150 -0.721 -5.540 1.00 0.00 C ATOM 1483 O THR A 95 8.282 -1.768 -6.142 1.00 0.00 O ATOM 1484 CB THR A 95 10.326 0.409 -5.035 1.00 0.00 C ATOM 1485 OG1 THR A 95 10.889 1.282 -4.069 1.00 0.00 O ATOM 1486 CG2 THR A 95 9.886 1.210 -6.265 1.00 0.00 C ATOM 0 H THR A 95 10.475 -1.862 -3.898 1.00 0.00 H new ATOM 0 HA THR A 95 8.601 0.380 -3.749 1.00 0.00 H new ATOM 0 HB THR A 95 11.071 -0.327 -5.336 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.666 1.738 -4.454 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.749 1.716 -6.697 1.00 0.00 H new ATOM 0 HG22 THR A 95 9.454 0.535 -7.004 1.00 0.00 H new ATOM 0 HG23 THR A 95 9.141 1.950 -5.970 1.00 0.00 H new ATOM 1494 N VAL A 96 7.181 0.105 -5.806 1.00 0.00 N ATOM 1495 CA VAL A 96 6.186 -0.198 -6.868 1.00 0.00 C ATOM 1496 C VAL A 96 5.880 1.088 -7.640 1.00 0.00 C ATOM 1497 O VAL A 96 5.720 2.132 -7.054 1.00 0.00 O ATOM 1498 CB VAL A 96 4.909 -0.730 -6.219 1.00 0.00 C ATOM 1499 CG1 VAL A 96 3.791 -0.803 -7.260 1.00 0.00 C ATOM 1500 CG2 VAL A 96 5.172 -2.129 -5.656 1.00 0.00 C ATOM 0 H VAL A 96 7.034 0.992 -5.324 1.00 0.00 H new ATOM 0 HA VAL A 96 6.581 -0.948 -7.553 1.00 0.00 H new ATOM 0 HB VAL A 96 4.607 -0.060 -5.414 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.883 -1.183 -6.792 1.00 0.00 H new ATOM 0 HG12 VAL A 96 3.603 0.192 -7.662 1.00 0.00 H new ATOM 0 HG13 VAL A 96 4.089 -1.471 -8.068 1.00 0.00 H new ATOM 0 HG21 VAL A 96 4.263 -2.511 -5.192 1.00 0.00 H new ATOM 0 HG22 VAL A 96 5.475 -2.795 -6.464 1.00 0.00 H new ATOM 0 HG23 VAL A 96 5.966 -2.078 -4.911 1.00 0.00 H new ATOM 1510 N ILE A 97 5.797 1.028 -8.941 1.00 0.00 N ATOM 1511 CA ILE A 97 5.502 2.272 -9.713 1.00 0.00 C ATOM 1512 C ILE A 97 4.113 2.162 -10.336 1.00 0.00 C ATOM 1513 O ILE A 97 3.758 1.152 -10.907 1.00 0.00 O ATOM 1514 CB ILE A 97 6.549 2.462 -10.806 1.00 0.00 C ATOM 1515 CG1 ILE A 97 7.898 1.956 -10.291 1.00 0.00 C ATOM 1516 CG2 ILE A 97 6.666 3.952 -11.147 1.00 0.00 C ATOM 1517 CD1 ILE A 97 9.023 2.609 -11.088 1.00 0.00 C ATOM 0 H ILE A 97 5.919 0.183 -9.499 1.00 0.00 H new ATOM 0 HA ILE A 97 5.531 3.132 -9.044 1.00 0.00 H new ATOM 0 HB ILE A 97 6.257 1.907 -11.698 1.00 0.00 H new ATOM 0 HG12 ILE A 97 8.006 2.189 -9.232 1.00 0.00 H new ATOM 0 HG13 ILE A 97 7.952 0.872 -10.386 1.00 0.00 H new ATOM 0 HG21 ILE A 97 7.414 4.089 -11.928 1.00 0.00 H new ATOM 0 HG22 ILE A 97 5.703 4.322 -11.498 1.00 0.00 H new ATOM 0 HG23 ILE A 97 6.965 4.506 -10.257 1.00 0.00 H new ATOM 0 HD11 ILE A 97 9.985 2.249 -10.722 1.00 0.00 H new ATOM 0 HD12 ILE A 97 8.918 2.354 -12.142 1.00 0.00 H new ATOM 0 HD13 ILE A 97 8.972 3.691 -10.970 1.00 0.00 H new ATOM 1529 N TYR A 98 3.323 3.190 -10.208 1.00 0.00 N ATOM 1530 CA TYR A 98 1.938 3.156 -10.762 1.00 0.00 C ATOM 1531 C TYR A 98 1.789 4.196 -11.881 1.00 0.00 C ATOM 1532 O TYR A 98 2.102 5.359 -11.713 1.00 0.00 O ATOM 1533 CB TYR A 98 0.962 3.483 -9.622 1.00 0.00 C ATOM 1534 CG TYR A 98 0.571 2.238 -8.838 1.00 0.00 C ATOM 1535 CD1 TYR A 98 1.258 1.021 -9.001 1.00 0.00 C ATOM 1536 CD2 TYR A 98 -0.492 2.314 -7.928 1.00 0.00 C ATOM 1537 CE1 TYR A 98 0.878 -0.105 -8.259 1.00 0.00 C ATOM 1538 CE2 TYR A 98 -0.866 1.187 -7.188 1.00 0.00 C ATOM 1539 CZ TYR A 98 -0.184 -0.021 -7.355 1.00 0.00 C ATOM 1540 OH TYR A 98 -0.557 -1.131 -6.624 1.00 0.00 O ATOM 0 H TYR A 98 3.578 4.060 -9.740 1.00 0.00 H new ATOM 0 HA TYR A 98 1.727 2.170 -11.177 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.419 4.208 -8.949 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.067 3.950 -10.033 1.00 0.00 H new ATOM 0 HD1 TYR A 98 2.079 0.955 -9.699 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -1.024 3.245 -7.798 1.00 0.00 H new ATOM 0 HE1 TYR A 98 1.406 -1.038 -8.386 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -1.684 1.251 -6.486 1.00 0.00 H new ATOM 0 HH TYR A 98 -1.366 -0.927 -6.110 1.00 0.00 H new ATOM 1550 N TRP A 99 1.299 3.778 -13.021 1.00 0.00 N ATOM 1551 CA TRP A 99 1.106 4.724 -14.163 1.00 0.00 C ATOM 1552 C TRP A 99 -0.377 4.849 -14.479 1.00 0.00 C ATOM 1553 O TRP A 99 -1.152 3.953 -14.222 1.00 0.00 O ATOM 1554 CB TRP A 99 1.801 4.189 -15.413 1.00 0.00 C ATOM 1555 CG TRP A 99 3.217 4.640 -15.450 1.00 0.00 C ATOM 1556 CD1 TRP A 99 3.635 5.856 -15.859 1.00 0.00 C ATOM 1557 CD2 TRP A 99 4.404 3.894 -15.083 1.00 0.00 C ATOM 1558 NE1 TRP A 99 5.012 5.905 -15.763 1.00 0.00 N ATOM 1559 CE2 TRP A 99 5.531 4.717 -15.288 1.00 0.00 C ATOM 1560 CE3 TRP A 99 4.607 2.595 -14.596 1.00 0.00 C ATOM 1561 CZ2 TRP A 99 6.821 4.265 -15.019 1.00 0.00 C ATOM 1562 CZ3 TRP A 99 5.902 2.136 -14.325 1.00 0.00 C ATOM 1563 CH2 TRP A 99 7.008 2.971 -14.536 1.00 0.00 C ATOM 0 H TRP A 99 1.022 2.815 -13.211 1.00 0.00 H new ATOM 0 HA TRP A 99 1.525 5.690 -13.881 1.00 0.00 H new ATOM 0 HB2 TRP A 99 1.759 3.100 -15.423 1.00 0.00 H new ATOM 0 HB3 TRP A 99 1.278 4.536 -16.304 1.00 0.00 H new ATOM 0 HD1 TRP A 99 2.999 6.658 -16.204 1.00 0.00 H new ATOM 0 HE1 TRP A 99 5.576 6.718 -16.012 1.00 0.00 H new ATOM 0 HE3 TRP A 99 3.761 1.945 -14.429 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.670 4.912 -15.183 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 6.049 1.133 -13.951 1.00 0.00 H new ATOM 0 HH2 TRP A 99 8.004 2.612 -14.324 1.00 0.00 H new ATOM 1574 N LEU A 100 -0.773 5.941 -15.067 1.00 0.00 N ATOM 1575 CA LEU A 100 -2.205 6.104 -15.431 1.00 0.00 C ATOM 1576 C LEU A 100 -2.461 5.410 -16.769 1.00 0.00 C ATOM 1577 O LEU A 100 -1.759 5.623 -17.737 1.00 0.00 O ATOM 1578 CB LEU A 100 -2.540 7.596 -15.538 1.00 0.00 C ATOM 1579 CG LEU A 100 -2.618 8.207 -14.139 1.00 0.00 C ATOM 1580 CD1 LEU A 100 -2.863 9.714 -14.249 1.00 0.00 C ATOM 1581 CD2 LEU A 100 -3.782 7.571 -13.375 1.00 0.00 C ATOM 0 H LEU A 100 -0.169 6.726 -15.311 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.837 5.655 -14.665 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.779 8.108 -16.127 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.489 7.729 -16.057 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.681 8.025 -13.613 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.918 10.147 -13.250 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.044 10.176 -14.801 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.801 9.893 -14.775 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.841 8.004 -12.376 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.714 7.760 -13.908 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.621 6.496 -13.295 1.00 0.00 H new ATOM 1593 N ALA A 101 -3.461 4.572 -16.825 1.00 0.00 N ATOM 1594 CA ALA A 101 -3.758 3.855 -18.094 1.00 0.00 C ATOM 1595 C ALA A 101 -5.270 3.846 -18.324 1.00 0.00 C ATOM 1596 O ALA A 101 -6.047 3.654 -17.410 1.00 0.00 O ATOM 1597 CB ALA A 101 -3.257 2.409 -17.989 1.00 0.00 C ATOM 0 H ALA A 101 -4.083 4.354 -16.047 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.261 4.357 -18.924 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.473 1.881 -18.918 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.181 2.409 -17.813 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -3.760 1.909 -17.161 1.00 0.00 H new ATOM 1603 N GLU A 102 -5.690 4.046 -19.541 1.00 0.00 N ATOM 1604 CA GLU A 102 -7.148 4.043 -19.840 1.00 0.00 C ATOM 1605 C GLU A 102 -7.456 2.950 -20.860 1.00 0.00 C ATOM 1606 O GLU A 102 -6.746 2.775 -21.828 1.00 0.00 O ATOM 1607 CB GLU A 102 -7.557 5.397 -20.423 1.00 0.00 C ATOM 1608 CG GLU A 102 -9.066 5.416 -20.664 1.00 0.00 C ATOM 1609 CD GLU A 102 -9.451 6.705 -21.390 1.00 0.00 C ATOM 1610 OE1 GLU A 102 -10.617 6.855 -21.711 1.00 0.00 O ATOM 1611 OE2 GLU A 102 -8.570 7.520 -21.615 1.00 0.00 O ATOM 0 H GLU A 102 -5.084 4.212 -20.344 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.702 3.858 -18.920 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -7.278 6.198 -19.739 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.027 5.577 -21.358 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.361 4.550 -21.257 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -9.597 5.348 -19.715 1.00 0.00 H new ATOM 1619 N VAL A 103 -8.518 2.225 -20.660 1.00 0.00 N ATOM 1620 CA VAL A 103 -8.874 1.161 -21.635 1.00 0.00 C ATOM 1621 C VAL A 103 -9.815 1.746 -22.682 1.00 0.00 C ATOM 1622 O VAL A 103 -10.907 2.179 -22.373 1.00 0.00 O ATOM 1623 CB VAL A 103 -9.581 0.004 -20.920 1.00 0.00 C ATOM 1624 CG1 VAL A 103 -8.602 -0.750 -20.024 1.00 0.00 C ATOM 1625 CG2 VAL A 103 -10.703 0.557 -20.056 1.00 0.00 C ATOM 0 H VAL A 103 -9.152 2.322 -19.867 1.00 0.00 H new ATOM 0 HA VAL A 103 -7.965 0.788 -22.107 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.979 -0.678 -21.672 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -9.122 -1.568 -19.525 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.790 -1.152 -20.630 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.194 -0.069 -19.277 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.208 -0.264 -19.546 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.289 1.243 -19.317 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -11.418 1.088 -20.684 1.00 0.00 H new ATOM 1635 N LYS A 104 -9.415 1.748 -23.921 1.00 0.00 N ATOM 1636 CA LYS A 104 -10.309 2.287 -24.976 1.00 0.00 C ATOM 1637 C LYS A 104 -11.455 1.299 -25.161 1.00 0.00 C ATOM 1638 O LYS A 104 -12.424 1.563 -25.845 1.00 0.00 O ATOM 1639 CB LYS A 104 -9.522 2.454 -26.274 1.00 0.00 C ATOM 1640 CG LYS A 104 -8.892 1.118 -26.671 1.00 0.00 C ATOM 1641 CD LYS A 104 -7.765 1.361 -27.679 1.00 0.00 C ATOM 1642 CE LYS A 104 -6.653 2.188 -27.022 1.00 0.00 C ATOM 1643 NZ LYS A 104 -6.750 2.069 -25.539 1.00 0.00 N ATOM 0 H LYS A 104 -8.512 1.401 -24.246 1.00 0.00 H new ATOM 0 HA LYS A 104 -10.705 3.263 -24.694 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.181 2.806 -27.067 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -8.746 3.209 -26.146 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -8.501 0.612 -25.788 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -9.647 0.463 -27.105 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -7.365 0.409 -28.029 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -8.152 1.884 -28.553 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -5.678 1.839 -27.362 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -6.739 3.233 -27.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -5.817 2.246 -25.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -7.432 2.767 -25.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -7.069 1.111 -25.288 1.00 0.00 H new ATOM 1657 N ASP A 105 -11.351 0.165 -24.521 1.00 0.00 N ATOM 1658 CA ASP A 105 -12.427 -0.857 -24.610 1.00 0.00 C ATOM 1659 C ASP A 105 -13.212 -0.857 -23.298 1.00 0.00 C ATOM 1660 O ASP A 105 -12.798 -1.436 -22.314 1.00 0.00 O ATOM 1661 CB ASP A 105 -11.807 -2.239 -24.824 1.00 0.00 C ATOM 1662 CG ASP A 105 -11.533 -2.461 -26.314 1.00 0.00 C ATOM 1663 OD1 ASP A 105 -11.876 -1.589 -27.096 1.00 0.00 O ATOM 1664 OD2 ASP A 105 -10.984 -3.498 -26.647 1.00 0.00 O ATOM 0 H ASP A 105 -10.558 -0.097 -23.936 1.00 0.00 H new ATOM 0 HA ASP A 105 -13.088 -0.625 -25.445 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.879 -2.323 -24.258 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -12.479 -3.011 -24.450 1.00 0.00 H new ATOM 1670 N TYR A 106 -14.343 -0.213 -23.278 1.00 0.00 N ATOM 1671 CA TYR A 106 -15.155 -0.180 -22.032 1.00 0.00 C ATOM 1672 C TYR A 106 -15.469 -1.618 -21.625 1.00 0.00 C ATOM 1673 O TYR A 106 -15.685 -1.919 -20.468 1.00 0.00 O ATOM 1674 CB TYR A 106 -16.459 0.577 -22.297 1.00 0.00 C ATOM 1675 CG TYR A 106 -17.162 0.870 -20.992 1.00 0.00 C ATOM 1676 CD1 TYR A 106 -17.929 -0.123 -20.365 1.00 0.00 C ATOM 1677 CD2 TYR A 106 -17.046 2.137 -20.407 1.00 0.00 C ATOM 1678 CE1 TYR A 106 -18.579 0.156 -19.156 1.00 0.00 C ATOM 1679 CE2 TYR A 106 -17.698 2.416 -19.200 1.00 0.00 C ATOM 1680 CZ TYR A 106 -18.463 1.425 -18.573 1.00 0.00 C ATOM 1681 OH TYR A 106 -19.105 1.700 -17.383 1.00 0.00 O ATOM 0 H TYR A 106 -14.741 0.292 -24.070 1.00 0.00 H new ATOM 0 HA TYR A 106 -14.607 0.323 -21.235 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -16.248 1.508 -22.823 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -17.107 -0.014 -22.944 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -18.018 -1.101 -20.814 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -16.452 2.900 -20.888 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -19.170 -0.608 -18.673 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -17.611 3.395 -18.753 1.00 0.00 H new ATOM 0 HH TYR A 106 -18.919 2.625 -17.117 1.00 0.00 H new ATOM 1691 N ASP A 107 -15.498 -2.505 -22.582 1.00 0.00 N ATOM 1692 CA ASP A 107 -15.797 -3.929 -22.281 1.00 0.00 C ATOM 1693 C ASP A 107 -14.500 -4.744 -22.298 1.00 0.00 C ATOM 1694 O ASP A 107 -14.526 -5.954 -22.411 1.00 0.00 O ATOM 1695 CB ASP A 107 -16.754 -4.473 -23.345 1.00 0.00 C ATOM 1696 CG ASP A 107 -18.098 -3.749 -23.240 1.00 0.00 C ATOM 1697 OD1 ASP A 107 -18.324 -3.105 -22.229 1.00 0.00 O ATOM 1698 OD2 ASP A 107 -18.878 -3.849 -24.173 1.00 0.00 O ATOM 0 H ASP A 107 -15.326 -2.300 -23.566 1.00 0.00 H new ATOM 0 HA ASP A 107 -16.256 -4.006 -21.295 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -16.329 -4.331 -24.339 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -16.895 -5.545 -23.209 1.00 0.00 H new ATOM 1704 N VAL A 108 -13.365 -4.100 -22.193 1.00 0.00 N ATOM 1705 CA VAL A 108 -12.084 -4.864 -22.211 1.00 0.00 C ATOM 1706 C VAL A 108 -12.246 -6.114 -21.362 1.00 0.00 C ATOM 1707 O VAL A 108 -13.006 -6.140 -20.413 1.00 0.00 O ATOM 1708 CB VAL A 108 -10.936 -4.011 -21.662 1.00 0.00 C ATOM 1709 CG1 VAL A 108 -11.226 -3.583 -20.221 1.00 0.00 C ATOM 1710 CG2 VAL A 108 -9.642 -4.823 -21.698 1.00 0.00 C ATOM 0 H VAL A 108 -13.271 -3.089 -22.097 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.845 -5.137 -23.239 1.00 0.00 H new ATOM 0 HB VAL A 108 -10.834 -3.118 -22.279 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -10.400 -2.978 -19.848 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -12.145 -2.998 -20.193 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -11.340 -4.468 -19.595 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.823 -4.219 -21.308 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -9.757 -5.718 -21.086 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -9.422 -5.112 -22.726 1.00 0.00 H new ATOM 1720 N GLU A 109 -11.551 -7.161 -21.699 1.00 0.00 N ATOM 1721 CA GLU A 109 -11.688 -8.407 -20.911 1.00 0.00 C ATOM 1722 C GLU A 109 -10.511 -8.556 -19.970 1.00 0.00 C ATOM 1723 O GLU A 109 -9.402 -8.861 -20.363 1.00 0.00 O ATOM 1724 CB GLU A 109 -11.755 -9.617 -21.841 1.00 0.00 C ATOM 1725 CG GLU A 109 -12.018 -10.875 -21.012 1.00 0.00 C ATOM 1726 CD GLU A 109 -13.425 -10.808 -20.417 1.00 0.00 C ATOM 1727 OE1 GLU A 109 -14.270 -10.163 -21.015 1.00 0.00 O ATOM 1728 OE2 GLU A 109 -13.633 -11.400 -19.371 1.00 0.00 O ATOM 0 H GLU A 109 -10.898 -7.206 -22.482 1.00 0.00 H new ATOM 0 HA GLU A 109 -12.609 -8.352 -20.331 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -12.546 -9.481 -22.578 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -10.820 -9.719 -22.392 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -11.918 -11.763 -21.637 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -11.278 -10.960 -20.216 1.00 0.00 H new ATOM 1736 N ILE A 110 -10.765 -8.356 -18.722 1.00 0.00 N ATOM 1737 CA ILE A 110 -9.698 -8.492 -17.712 1.00 0.00 C ATOM 1738 C ILE A 110 -9.425 -9.971 -17.475 1.00 0.00 C ATOM 1739 O ILE A 110 -9.891 -10.555 -16.517 1.00 0.00 O ATOM 1740 CB ILE A 110 -10.171 -7.859 -16.418 1.00 0.00 C ATOM 1741 CG1 ILE A 110 -10.080 -6.339 -16.527 1.00 0.00 C ATOM 1742 CG2 ILE A 110 -9.308 -8.350 -15.265 1.00 0.00 C ATOM 1743 CD1 ILE A 110 -10.626 -5.889 -17.865 1.00 0.00 C ATOM 0 H ILE A 110 -11.680 -8.100 -18.351 1.00 0.00 H new ATOM 0 HA ILE A 110 -8.788 -8.001 -18.057 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.208 -8.141 -16.233 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -10.643 -5.873 -15.718 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -9.044 -6.019 -16.420 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -9.649 -7.894 -14.335 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -9.387 -9.434 -15.188 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -8.269 -8.074 -15.445 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -10.559 -4.804 -17.939 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -10.044 -6.344 -18.667 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -11.668 -6.195 -17.954 1.00 0.00 H new ATOM 1755 N ARG A 111 -8.668 -10.587 -18.327 1.00 0.00 N ATOM 1756 CA ARG A 111 -8.369 -12.025 -18.122 1.00 0.00 C ATOM 1757 C ARG A 111 -7.386 -12.150 -16.966 1.00 0.00 C ATOM 1758 O ARG A 111 -6.358 -11.505 -16.943 1.00 0.00 O ATOM 1759 CB ARG A 111 -7.761 -12.614 -19.397 1.00 0.00 C ATOM 1760 CG ARG A 111 -8.877 -13.184 -20.268 1.00 0.00 C ATOM 1761 CD ARG A 111 -8.411 -13.248 -21.726 1.00 0.00 C ATOM 1762 NE ARG A 111 -7.350 -14.284 -21.863 1.00 0.00 N ATOM 1763 CZ ARG A 111 -6.822 -14.528 -23.031 1.00 0.00 C ATOM 1764 NH1 ARG A 111 -7.220 -13.863 -24.081 1.00 0.00 N ATOM 1765 NH2 ARG A 111 -5.895 -15.438 -23.148 1.00 0.00 N ATOM 0 H ARG A 111 -8.245 -10.162 -19.152 1.00 0.00 H new ATOM 0 HA ARG A 111 -9.284 -12.571 -17.891 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -7.214 -11.845 -19.943 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -7.045 -13.396 -19.145 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -9.151 -14.180 -19.919 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -9.768 -12.562 -20.188 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -9.252 -13.485 -22.378 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -8.029 -12.277 -22.040 1.00 0.00 H new ATOM 0 HE ARG A 111 -7.036 -14.803 -21.043 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -7.945 -13.151 -23.989 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -6.806 -14.055 -24.993 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -5.584 -15.958 -22.327 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -5.481 -15.630 -24.060 1.00 0.00 H new ATOM 1779 N LEU A 112 -7.695 -12.965 -15.998 1.00 0.00 N ATOM 1780 CA LEU A 112 -6.768 -13.104 -14.845 1.00 0.00 C ATOM 1781 C LEU A 112 -5.936 -14.374 -15.015 1.00 0.00 C ATOM 1782 O LEU A 112 -6.419 -15.474 -14.841 1.00 0.00 O ATOM 1783 CB LEU A 112 -7.564 -13.182 -13.536 1.00 0.00 C ATOM 1784 CG LEU A 112 -8.635 -12.088 -13.518 1.00 0.00 C ATOM 1785 CD1 LEU A 112 -9.264 -11.997 -12.128 1.00 0.00 C ATOM 1786 CD2 LEU A 112 -8.002 -10.745 -13.877 1.00 0.00 C ATOM 0 H LEU A 112 -8.540 -13.535 -15.955 1.00 0.00 H new ATOM 0 HA LEU A 112 -6.110 -12.236 -14.808 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.030 -14.163 -13.440 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.894 -13.063 -12.684 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.407 -12.335 -14.247 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.025 -11.217 -12.123 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.723 -12.952 -11.873 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.494 -11.757 -11.395 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.766 -9.968 -13.864 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -7.225 -10.503 -13.151 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.562 -10.805 -14.873 1.00 0.00 H new ATOM 1798 N SER A 113 -4.686 -14.225 -15.347 1.00 0.00 N ATOM 1799 CA SER A 113 -3.811 -15.415 -15.524 1.00 0.00 C ATOM 1800 C SER A 113 -3.346 -15.905 -14.153 1.00 0.00 C ATOM 1801 O SER A 113 -3.613 -15.284 -13.142 1.00 0.00 O ATOM 1802 CB SER A 113 -2.595 -15.030 -16.365 1.00 0.00 C ATOM 1803 OG SER A 113 -3.017 -14.710 -17.684 1.00 0.00 O ATOM 0 H SER A 113 -4.230 -13.326 -15.504 1.00 0.00 H new ATOM 0 HA SER A 113 -4.365 -16.207 -16.028 1.00 0.00 H new ATOM 0 HB2 SER A 113 -2.084 -14.177 -15.917 1.00 0.00 H new ATOM 0 HB3 SER A 113 -1.880 -15.853 -16.389 1.00 0.00 H new ATOM 0 HG SER A 113 -2.239 -14.461 -18.225 1.00 0.00 H new ATOM 1809 N HIS A 114 -2.650 -17.006 -14.106 1.00 0.00 N ATOM 1810 CA HIS A 114 -2.165 -17.518 -12.794 1.00 0.00 C ATOM 1811 C HIS A 114 -1.688 -16.338 -11.946 1.00 0.00 C ATOM 1812 O HIS A 114 -0.576 -15.870 -12.084 1.00 0.00 O ATOM 1813 CB HIS A 114 -1.003 -18.489 -13.019 1.00 0.00 C ATOM 1814 CG HIS A 114 0.075 -18.216 -12.008 1.00 0.00 C ATOM 1815 ND1 HIS A 114 -0.037 -18.610 -10.680 1.00 0.00 N ATOM 1816 CD2 HIS A 114 1.282 -17.567 -12.105 1.00 0.00 C ATOM 1817 CE1 HIS A 114 1.074 -18.199 -10.041 1.00 0.00 C ATOM 1818 NE2 HIS A 114 1.906 -17.558 -10.863 1.00 0.00 N ATOM 0 H HIS A 114 -2.397 -17.572 -14.916 1.00 0.00 H new ATOM 0 HA HIS A 114 -2.973 -18.039 -12.281 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -1.351 -19.518 -12.928 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -0.608 -18.374 -14.029 1.00 0.00 H new ATOM 0 HD2 HIS A 114 1.684 -17.131 -13.007 1.00 0.00 H new ATOM 0 HE1 HIS A 114 1.268 -18.367 -8.992 1.00 0.00 H new ATOM 0 HE2 HIS A 114 2.810 -17.148 -10.629 1.00 0.00 H new ATOM 1827 N GLU A 115 -2.525 -15.845 -11.074 1.00 0.00 N ATOM 1828 CA GLU A 115 -2.119 -14.689 -10.222 1.00 0.00 C ATOM 1829 C GLU A 115 -3.348 -14.102 -9.532 1.00 0.00 C ATOM 1830 O GLU A 115 -3.419 -14.021 -8.320 1.00 0.00 O ATOM 1831 CB GLU A 115 -1.476 -13.607 -11.092 1.00 0.00 C ATOM 1832 CG GLU A 115 -0.007 -13.438 -10.699 1.00 0.00 C ATOM 1833 CD GLU A 115 0.638 -12.381 -11.595 1.00 0.00 C ATOM 1834 OE1 GLU A 115 0.000 -11.980 -12.553 1.00 0.00 O ATOM 1835 OE2 GLU A 115 1.757 -11.987 -11.306 1.00 0.00 O ATOM 0 H GLU A 115 -3.471 -16.191 -10.914 1.00 0.00 H new ATOM 0 HA GLU A 115 -1.405 -15.034 -9.474 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -1.552 -13.880 -12.145 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -2.007 -12.663 -10.968 1.00 0.00 H new ATOM 0 HG2 GLU A 115 0.070 -13.140 -9.653 1.00 0.00 H new ATOM 0 HG3 GLU A 115 0.520 -14.387 -10.800 1.00 0.00 H new ATOM 1843 N HIS A 116 -4.312 -13.684 -10.302 1.00 0.00 N ATOM 1844 CA HIS A 116 -5.537 -13.086 -9.707 1.00 0.00 C ATOM 1845 C HIS A 116 -6.773 -13.838 -10.191 1.00 0.00 C ATOM 1846 O HIS A 116 -6.725 -14.603 -11.132 1.00 0.00 O ATOM 1847 CB HIS A 116 -5.646 -11.620 -10.130 1.00 0.00 C ATOM 1848 CG HIS A 116 -4.493 -10.845 -9.559 1.00 0.00 C ATOM 1849 ND1 HIS A 116 -3.235 -10.853 -10.144 1.00 0.00 N ATOM 1850 CD2 HIS A 116 -4.390 -10.035 -8.456 1.00 0.00 C ATOM 1851 CE1 HIS A 116 -2.435 -10.073 -9.396 1.00 0.00 C ATOM 1852 NE2 HIS A 116 -3.090 -9.552 -8.355 1.00 0.00 N ATOM 0 H HIS A 116 -4.304 -13.731 -11.321 1.00 0.00 H new ATOM 0 HA HIS A 116 -5.474 -13.155 -8.621 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -5.646 -11.544 -11.217 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -6.589 -11.199 -9.781 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -5.194 -9.808 -7.772 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -1.392 -9.890 -9.610 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -2.716 -8.931 -7.638 1.00 0.00 H new ATOM 1861 N GLN A 117 -7.884 -13.614 -9.553 1.00 0.00 N ATOM 1862 CA GLN A 117 -9.139 -14.294 -9.970 1.00 0.00 C ATOM 1863 C GLN A 117 -10.316 -13.379 -9.633 1.00 0.00 C ATOM 1864 O GLN A 117 -11.430 -13.821 -9.441 1.00 0.00 O ATOM 1865 CB GLN A 117 -9.276 -15.624 -9.224 1.00 0.00 C ATOM 1866 CG GLN A 117 -10.371 -16.473 -9.877 1.00 0.00 C ATOM 1867 CD GLN A 117 -10.377 -17.870 -9.254 1.00 0.00 C ATOM 1868 OE1 GLN A 117 -9.474 -18.224 -8.522 1.00 0.00 O ATOM 1869 NE2 GLN A 117 -11.365 -18.682 -9.514 1.00 0.00 N ATOM 0 H GLN A 117 -7.978 -12.985 -8.755 1.00 0.00 H new ATOM 0 HA GLN A 117 -9.122 -14.497 -11.041 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -8.328 -16.161 -9.241 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -9.520 -15.441 -8.177 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -11.343 -15.999 -9.741 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -10.199 -16.543 -10.951 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -12.122 -18.383 -10.129 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -11.380 -19.615 -9.103 1.00 0.00 H new ATOM 1878 N ALA A 118 -10.070 -12.097 -9.556 1.00 0.00 N ATOM 1879 CA ALA A 118 -11.168 -11.146 -9.226 1.00 0.00 C ATOM 1880 C ALA A 118 -10.842 -9.758 -9.771 1.00 0.00 C ATOM 1881 O ALA A 118 -9.827 -9.179 -9.444 1.00 0.00 O ATOM 1882 CB ALA A 118 -11.311 -11.040 -7.712 1.00 0.00 C ATOM 0 H ALA A 118 -9.156 -11.670 -9.708 1.00 0.00 H new ATOM 0 HA ALA A 118 -12.092 -11.513 -9.673 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -12.114 -10.344 -7.470 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.544 -12.021 -7.299 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -10.377 -10.679 -7.283 1.00 0.00 H new ATOM 1888 N TYR A 119 -11.707 -9.206 -10.570 1.00 0.00 N ATOM 1889 CA TYR A 119 -11.458 -7.840 -11.101 1.00 0.00 C ATOM 1890 C TYR A 119 -12.790 -7.110 -11.216 1.00 0.00 C ATOM 1891 O TYR A 119 -13.758 -7.641 -11.719 1.00 0.00 O ATOM 1892 CB TYR A 119 -10.774 -7.927 -12.461 1.00 0.00 C ATOM 1893 CG TYR A 119 -11.751 -8.324 -13.529 1.00 0.00 C ATOM 1894 CD1 TYR A 119 -12.024 -9.675 -13.731 1.00 0.00 C ATOM 1895 CD2 TYR A 119 -12.364 -7.353 -14.331 1.00 0.00 C ATOM 1896 CE1 TYR A 119 -12.912 -10.067 -14.734 1.00 0.00 C ATOM 1897 CE2 TYR A 119 -13.252 -7.742 -15.338 1.00 0.00 C ATOM 1898 CZ TYR A 119 -13.529 -9.100 -15.541 1.00 0.00 C ATOM 1899 OH TYR A 119 -14.400 -9.483 -16.539 1.00 0.00 O ATOM 0 H TYR A 119 -12.576 -9.641 -10.879 1.00 0.00 H new ATOM 0 HA TYR A 119 -10.802 -7.291 -10.426 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -10.328 -6.964 -12.710 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -9.962 -8.653 -12.418 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -11.548 -10.420 -13.111 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -12.151 -6.306 -14.172 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -13.124 -11.115 -14.889 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -13.724 -6.996 -15.959 1.00 0.00 H new ATOM 0 HH TYR A 119 -14.738 -8.688 -17.001 1.00 0.00 H new ATOM 1909 N ARG A 120 -12.856 -5.903 -10.732 1.00 0.00 N ATOM 1910 CA ARG A 120 -14.141 -5.155 -10.793 1.00 0.00 C ATOM 1911 C ARG A 120 -13.903 -3.714 -11.236 1.00 0.00 C ATOM 1912 O ARG A 120 -12.851 -3.146 -11.018 1.00 0.00 O ATOM 1913 CB ARG A 120 -14.770 -5.132 -9.400 1.00 0.00 C ATOM 1914 CG ARG A 120 -15.157 -6.544 -8.967 1.00 0.00 C ATOM 1915 CD ARG A 120 -15.469 -6.536 -7.468 1.00 0.00 C ATOM 1916 NE ARG A 120 -16.729 -7.280 -7.206 1.00 0.00 N ATOM 1917 CZ ARG A 120 -17.418 -7.031 -6.125 1.00 0.00 C ATOM 1918 NH1 ARG A 120 -16.997 -6.133 -5.276 1.00 0.00 N ATOM 1919 NH2 ARG A 120 -18.524 -7.685 -5.889 1.00 0.00 N ATOM 0 H ARG A 120 -12.080 -5.403 -10.298 1.00 0.00 H new ATOM 0 HA ARG A 120 -14.798 -5.649 -11.509 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -14.068 -4.705 -8.684 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -15.652 -4.491 -9.403 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -16.025 -6.886 -9.531 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -14.345 -7.239 -9.179 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -14.647 -6.991 -6.915 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -15.563 -5.510 -7.113 1.00 0.00 H new ATOM 0 HE ARG A 120 -17.055 -7.983 -7.869 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -16.130 -5.626 -5.457 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -17.535 -5.938 -4.431 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -18.850 -8.391 -6.549 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -19.062 -7.490 -5.044 1.00 0.00 H new ATOM 1933 N TRP A 121 -14.895 -3.108 -11.823 1.00 0.00 N ATOM 1934 CA TRP A 121 -14.766 -1.689 -12.247 1.00 0.00 C ATOM 1935 C TRP A 121 -15.530 -0.831 -11.233 1.00 0.00 C ATOM 1936 O TRP A 121 -16.743 -0.836 -11.198 1.00 0.00 O ATOM 1937 CB TRP A 121 -15.376 -1.523 -13.642 1.00 0.00 C ATOM 1938 CG TRP A 121 -14.451 -2.101 -14.667 1.00 0.00 C ATOM 1939 CD1 TRP A 121 -14.567 -3.329 -15.229 1.00 0.00 C ATOM 1940 CD2 TRP A 121 -13.273 -1.491 -15.263 1.00 0.00 C ATOM 1941 NE1 TRP A 121 -13.533 -3.506 -16.131 1.00 0.00 N ATOM 1942 CE2 TRP A 121 -12.708 -2.402 -16.187 1.00 0.00 C ATOM 1943 CE3 TRP A 121 -12.643 -0.248 -15.091 1.00 0.00 C ATOM 1944 CZ2 TRP A 121 -11.562 -2.085 -16.916 1.00 0.00 C ATOM 1945 CZ3 TRP A 121 -11.490 0.070 -15.824 1.00 0.00 C ATOM 1946 CH2 TRP A 121 -10.951 -0.848 -16.732 1.00 0.00 C ATOM 0 H TRP A 121 -15.796 -3.539 -12.029 1.00 0.00 H new ATOM 0 HA TRP A 121 -13.720 -1.385 -12.285 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -16.344 -2.022 -13.688 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -15.551 -0.467 -13.850 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -15.340 -4.051 -15.009 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -13.397 -4.350 -16.687 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -13.048 0.467 -14.391 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -11.151 -2.795 -17.619 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -11.015 1.030 -15.687 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -10.061 -0.597 -17.290 1.00 0.00 H new ATOM 1957 N LEU A 122 -14.833 -0.121 -10.381 1.00 0.00 N ATOM 1958 CA LEU A 122 -15.536 0.694 -9.347 1.00 0.00 C ATOM 1959 C LEU A 122 -15.060 2.147 -9.375 1.00 0.00 C ATOM 1960 O LEU A 122 -14.145 2.506 -10.088 1.00 0.00 O ATOM 1961 CB LEU A 122 -15.252 0.135 -7.954 1.00 0.00 C ATOM 1962 CG LEU A 122 -14.719 -1.299 -8.035 1.00 0.00 C ATOM 1963 CD1 LEU A 122 -13.350 -1.356 -7.360 1.00 0.00 C ATOM 1964 CD2 LEU A 122 -15.678 -2.259 -7.317 1.00 0.00 C ATOM 0 H LEU A 122 -13.814 -0.071 -10.357 1.00 0.00 H new ATOM 0 HA LEU A 122 -16.602 0.652 -9.568 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -14.525 0.769 -7.445 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -16.164 0.154 -7.358 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.636 -1.596 -9.080 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.961 -2.373 -7.412 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.665 -0.679 -7.870 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -13.446 -1.057 -6.316 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -15.290 -3.276 -7.380 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -15.767 -1.969 -6.270 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -16.659 -2.215 -7.790 1.00 0.00 H new ATOM 1976 N GLY A 123 -15.683 2.984 -8.584 1.00 0.00 N ATOM 1977 CA GLY A 123 -15.287 4.419 -8.538 1.00 0.00 C ATOM 1978 C GLY A 123 -14.098 4.610 -7.591 1.00 0.00 C ATOM 1979 O GLY A 123 -13.583 3.670 -7.020 1.00 0.00 O ATOM 0 H GLY A 123 -16.453 2.730 -7.965 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -15.024 4.763 -9.538 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -16.129 5.025 -8.204 1.00 0.00 H new ATOM 1983 N LEU A 124 -13.659 5.830 -7.431 1.00 0.00 N ATOM 1984 CA LEU A 124 -12.498 6.121 -6.536 1.00 0.00 C ATOM 1985 C LEU A 124 -12.741 5.585 -5.125 1.00 0.00 C ATOM 1986 O LEU A 124 -11.904 4.910 -4.561 1.00 0.00 O ATOM 1987 CB LEU A 124 -12.305 7.639 -6.475 1.00 0.00 C ATOM 1988 CG LEU A 124 -11.321 8.019 -5.362 1.00 0.00 C ATOM 1989 CD1 LEU A 124 -10.027 7.212 -5.494 1.00 0.00 C ATOM 1990 CD2 LEU A 124 -10.993 9.509 -5.476 1.00 0.00 C ATOM 0 H LEU A 124 -14.060 6.649 -7.888 1.00 0.00 H new ATOM 0 HA LEU A 124 -11.610 5.632 -6.935 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -11.934 8.002 -7.434 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -13.265 8.125 -6.300 1.00 0.00 H new ATOM 0 HG LEU A 124 -11.777 7.802 -4.396 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -9.339 7.494 -4.696 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -10.252 6.148 -5.420 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -9.566 7.419 -6.460 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -10.294 9.789 -4.688 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -10.543 9.709 -6.449 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -11.908 10.092 -5.373 1.00 0.00 H new ATOM 2002 N GLU A 125 -13.862 5.890 -4.544 1.00 0.00 N ATOM 2003 CA GLU A 125 -14.128 5.405 -3.158 1.00 0.00 C ATOM 2004 C GLU A 125 -14.089 3.878 -3.103 1.00 0.00 C ATOM 2005 O GLU A 125 -13.341 3.301 -2.339 1.00 0.00 O ATOM 2006 CB GLU A 125 -15.494 5.911 -2.697 1.00 0.00 C ATOM 2007 CG GLU A 125 -16.226 4.810 -1.930 1.00 0.00 C ATOM 2008 CD GLU A 125 -17.505 5.380 -1.318 1.00 0.00 C ATOM 2009 OE1 GLU A 125 -17.765 6.555 -1.522 1.00 0.00 O ATOM 2010 OE2 GLU A 125 -18.206 4.633 -0.654 1.00 0.00 O ATOM 0 H GLU A 125 -14.605 6.451 -4.962 1.00 0.00 H new ATOM 0 HA GLU A 125 -13.353 5.790 -2.495 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -15.371 6.788 -2.062 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -16.086 6.221 -3.558 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -16.467 3.984 -2.599 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -15.583 4.408 -1.147 1.00 0.00 H new ATOM 2018 N GLU A 126 -14.876 3.212 -3.898 1.00 0.00 N ATOM 2019 CA GLU A 126 -14.849 1.725 -3.866 1.00 0.00 C ATOM 2020 C GLU A 126 -13.451 1.261 -4.265 1.00 0.00 C ATOM 2021 O GLU A 126 -12.941 0.279 -3.764 1.00 0.00 O ATOM 2022 CB GLU A 126 -15.884 1.159 -4.830 1.00 0.00 C ATOM 2023 CG GLU A 126 -15.947 -0.357 -4.658 1.00 0.00 C ATOM 2024 CD GLU A 126 -17.367 -0.848 -4.946 1.00 0.00 C ATOM 2025 OE1 GLU A 126 -17.645 -1.998 -4.651 1.00 0.00 O ATOM 2026 OE2 GLU A 126 -18.152 -0.067 -5.460 1.00 0.00 O ATOM 0 H GLU A 126 -15.530 3.627 -4.562 1.00 0.00 H new ATOM 0 HA GLU A 126 -15.088 1.370 -2.863 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -16.861 1.601 -4.635 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.619 1.411 -5.857 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -15.241 -0.839 -5.334 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -15.656 -0.630 -3.644 1.00 0.00 H new ATOM 2034 N ALA A 127 -12.811 1.975 -5.149 1.00 0.00 N ATOM 2035 CA ALA A 127 -11.435 1.582 -5.541 1.00 0.00 C ATOM 2036 C ALA A 127 -10.531 1.789 -4.328 1.00 0.00 C ATOM 2037 O ALA A 127 -9.751 0.933 -3.957 1.00 0.00 O ATOM 2038 CB ALA A 127 -10.958 2.465 -6.694 1.00 0.00 C ATOM 0 H ALA A 127 -13.180 2.806 -5.612 1.00 0.00 H new ATOM 0 HA ALA A 127 -11.410 0.541 -5.865 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.947 2.175 -6.980 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -11.626 2.343 -7.547 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.960 3.508 -6.378 1.00 0.00 H new ATOM 2044 N CYS A 128 -10.668 2.921 -3.689 1.00 0.00 N ATOM 2045 CA CYS A 128 -9.865 3.201 -2.469 1.00 0.00 C ATOM 2046 C CYS A 128 -10.362 2.270 -1.370 1.00 0.00 C ATOM 2047 O CYS A 128 -9.620 1.826 -0.515 1.00 0.00 O ATOM 2048 CB CYS A 128 -10.080 4.656 -2.045 1.00 0.00 C ATOM 2049 SG CYS A 128 -10.096 4.763 -0.238 1.00 0.00 S ATOM 0 H CYS A 128 -11.307 3.667 -3.964 1.00 0.00 H new ATOM 0 HA CYS A 128 -8.803 3.041 -2.657 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -9.287 5.285 -2.450 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -11.021 5.029 -2.450 1.00 0.00 H new ATOM 0 HG CYS A 128 -9.467 3.742 0.263 1.00 0.00 H new ATOM 2055 N GLN A 129 -11.629 1.967 -1.413 1.00 0.00 N ATOM 2056 CA GLN A 129 -12.239 1.054 -0.411 1.00 0.00 C ATOM 2057 C GLN A 129 -11.479 -0.267 -0.412 1.00 0.00 C ATOM 2058 O GLN A 129 -11.099 -0.790 0.616 1.00 0.00 O ATOM 2059 CB GLN A 129 -13.680 0.792 -0.858 1.00 0.00 C ATOM 2060 CG GLN A 129 -14.385 -0.186 0.078 1.00 0.00 C ATOM 2061 CD GLN A 129 -15.002 0.576 1.250 1.00 0.00 C ATOM 2062 OE1 GLN A 129 -14.525 1.746 1.567 1.00 0.00 O flip ATOM 2063 NE2 GLN A 129 -15.929 0.104 1.879 1.00 0.00 N flip ATOM 0 H GLN A 129 -12.279 2.322 -2.115 1.00 0.00 H new ATOM 0 HA GLN A 129 -12.206 1.491 0.587 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -14.231 1.732 -0.886 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -13.681 0.392 -1.872 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -15.160 -0.728 -0.464 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -13.676 -0.927 0.447 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -16.301 -0.812 1.629 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -16.335 0.624 2.657 1.00 0.00 H new ATOM 2072 N LEU A 130 -11.278 -0.807 -1.572 1.00 0.00 N ATOM 2073 CA LEU A 130 -10.566 -2.101 -1.698 1.00 0.00 C ATOM 2074 C LEU A 130 -9.057 -1.898 -1.563 1.00 0.00 C ATOM 2075 O LEU A 130 -8.356 -2.735 -1.027 1.00 0.00 O ATOM 2076 CB LEU A 130 -10.882 -2.671 -3.072 1.00 0.00 C ATOM 2077 CG LEU A 130 -12.400 -2.754 -3.243 1.00 0.00 C ATOM 2078 CD1 LEU A 130 -12.755 -2.637 -4.719 1.00 0.00 C ATOM 2079 CD2 LEU A 130 -12.910 -4.094 -2.719 1.00 0.00 C ATOM 0 H LEU A 130 -11.582 -0.400 -2.456 1.00 0.00 H new ATOM 0 HA LEU A 130 -10.889 -2.782 -0.910 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -10.450 -2.040 -3.849 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -10.437 -3.660 -3.180 1.00 0.00 H new ATOM 0 HG LEU A 130 -12.863 -1.941 -2.683 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -13.837 -2.696 -4.839 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -12.399 -1.681 -5.104 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -12.284 -3.449 -5.272 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -13.992 -4.146 -2.844 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -12.441 -4.905 -3.276 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -12.662 -4.189 -1.662 1.00 0.00 H new ATOM 2091 N ALA A 131 -8.543 -0.804 -2.052 1.00 0.00 N ATOM 2092 CA ALA A 131 -7.075 -0.573 -1.957 1.00 0.00 C ATOM 2093 C ALA A 131 -6.634 -0.650 -0.495 1.00 0.00 C ATOM 2094 O ALA A 131 -5.784 -1.437 -0.139 1.00 0.00 O ATOM 2095 CB ALA A 131 -6.739 0.807 -2.518 1.00 0.00 C ATOM 0 H ALA A 131 -9.073 -0.063 -2.511 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.552 -1.337 -2.532 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.664 0.976 -2.449 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -7.048 0.860 -3.562 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -7.264 1.571 -1.945 1.00 0.00 H new ATOM 2101 N GLN A 132 -7.217 0.142 0.358 1.00 0.00 N ATOM 2102 CA GLN A 132 -6.839 0.093 1.801 1.00 0.00 C ATOM 2103 C GLN A 132 -5.387 0.556 1.992 1.00 0.00 C ATOM 2104 O GLN A 132 -4.905 0.649 3.103 1.00 0.00 O ATOM 2105 CB GLN A 132 -7.009 -1.345 2.313 1.00 0.00 C ATOM 2106 CG GLN A 132 -5.646 -1.953 2.673 1.00 0.00 C ATOM 2107 CD GLN A 132 -5.814 -3.449 2.939 1.00 0.00 C ATOM 2108 OE1 GLN A 132 -5.961 -4.228 2.020 1.00 0.00 O ATOM 2109 NE2 GLN A 132 -5.799 -3.886 4.169 1.00 0.00 N ATOM 0 H GLN A 132 -7.939 0.822 0.121 1.00 0.00 H new ATOM 0 HA GLN A 132 -7.486 0.763 2.367 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -7.659 -1.351 3.188 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -7.495 -1.954 1.551 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -4.938 -1.794 1.860 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -5.236 -1.459 3.554 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -5.675 -3.231 4.941 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -5.911 -4.882 4.358 1.00 0.00 H new ATOM 2118 N PHE A 133 -4.683 0.854 0.929 1.00 0.00 N ATOM 2119 CA PHE A 133 -3.268 1.308 1.084 1.00 0.00 C ATOM 2120 C PHE A 133 -3.211 2.837 0.953 1.00 0.00 C ATOM 2121 O PHE A 133 -3.841 3.416 0.093 1.00 0.00 O ATOM 2122 CB PHE A 133 -2.396 0.685 -0.007 1.00 0.00 C ATOM 2123 CG PHE A 133 -2.748 -0.774 -0.185 1.00 0.00 C ATOM 2124 CD1 PHE A 133 -2.233 -1.733 0.696 1.00 0.00 C ATOM 2125 CD2 PHE A 133 -3.577 -1.171 -1.245 1.00 0.00 C ATOM 2126 CE1 PHE A 133 -2.551 -3.084 0.524 1.00 0.00 C ATOM 2127 CE2 PHE A 133 -3.891 -2.523 -1.418 1.00 0.00 C ATOM 2128 CZ PHE A 133 -3.378 -3.480 -0.536 1.00 0.00 C ATOM 0 H PHE A 133 -5.023 0.803 -0.031 1.00 0.00 H new ATOM 0 HA PHE A 133 -2.900 1.000 2.062 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -2.539 1.219 -0.947 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -1.343 0.783 0.258 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -1.590 -1.429 1.509 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -3.973 -0.433 -1.927 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -2.159 -3.822 1.208 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -4.530 -2.828 -2.233 1.00 0.00 H new ATOM 0 HZ PHE A 133 -3.619 -4.524 -0.672 1.00 0.00 H new ATOM 2138 N LYS A 134 -2.461 3.494 1.796 1.00 0.00 N ATOM 2139 CA LYS A 134 -2.374 4.983 1.710 1.00 0.00 C ATOM 2140 C LYS A 134 -1.890 5.401 0.321 1.00 0.00 C ATOM 2141 O LYS A 134 -2.408 6.324 -0.276 1.00 0.00 O ATOM 2142 CB LYS A 134 -1.385 5.497 2.757 1.00 0.00 C ATOM 2143 CG LYS A 134 -1.352 7.031 2.730 1.00 0.00 C ATOM 2144 CD LYS A 134 -0.295 7.537 3.714 1.00 0.00 C ATOM 2145 CE LYS A 134 -0.320 9.068 3.758 1.00 0.00 C ATOM 2146 NZ LYS A 134 -1.677 9.534 4.162 1.00 0.00 N ATOM 0 H LYS A 134 -1.906 3.068 2.538 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.362 5.406 1.891 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -1.675 5.148 3.748 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -0.390 5.099 2.558 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -1.125 7.383 1.724 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -2.331 7.431 2.994 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -0.486 7.132 4.708 1.00 0.00 H new ATOM 0 HD3 LYS A 134 0.693 7.188 3.412 1.00 0.00 H new ATOM 0 HE2 LYS A 134 0.426 9.434 4.463 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -0.061 9.474 2.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -1.610 10.491 4.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -2.300 9.551 3.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -2.069 8.885 4.874 1.00 0.00 H new ATOM 2160 N GLU A 135 -0.894 4.741 -0.194 1.00 0.00 N ATOM 2161 CA GLU A 135 -0.374 5.120 -1.535 1.00 0.00 C ATOM 2162 C GLU A 135 -1.431 4.843 -2.604 1.00 0.00 C ATOM 2163 O GLU A 135 -1.699 5.673 -3.446 1.00 0.00 O ATOM 2164 CB GLU A 135 0.877 4.303 -1.841 1.00 0.00 C ATOM 2165 CG GLU A 135 1.946 4.592 -0.786 1.00 0.00 C ATOM 2166 CD GLU A 135 1.654 3.776 0.474 1.00 0.00 C ATOM 2167 OE1 GLU A 135 2.275 4.048 1.488 1.00 0.00 O ATOM 2168 OE2 GLU A 135 0.814 2.895 0.404 1.00 0.00 O ATOM 0 H GLU A 135 -0.418 3.958 0.253 1.00 0.00 H new ATOM 0 HA GLU A 135 -0.132 6.183 -1.537 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.637 3.240 -1.849 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.253 4.552 -2.833 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.933 4.340 -1.175 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.959 5.656 -0.548 1.00 0.00 H new ATOM 2176 N MET A 136 -2.032 3.685 -2.582 1.00 0.00 N ATOM 2177 CA MET A 136 -3.065 3.367 -3.607 1.00 0.00 C ATOM 2178 C MET A 136 -4.199 4.381 -3.554 1.00 0.00 C ATOM 2179 O MET A 136 -4.633 4.895 -4.567 1.00 0.00 O ATOM 2180 CB MET A 136 -3.654 1.994 -3.329 1.00 0.00 C ATOM 2181 CG MET A 136 -2.681 0.904 -3.774 1.00 0.00 C ATOM 2182 SD MET A 136 -3.538 -0.258 -4.864 1.00 0.00 S ATOM 2183 CE MET A 136 -4.272 0.965 -5.985 1.00 0.00 C ATOM 0 H MET A 136 -1.853 2.947 -1.901 1.00 0.00 H new ATOM 0 HA MET A 136 -2.590 3.393 -4.588 1.00 0.00 H new ATOM 0 HB2 MET A 136 -3.867 1.890 -2.265 1.00 0.00 H new ATOM 0 HB3 MET A 136 -4.602 1.883 -3.856 1.00 0.00 H new ATOM 0 HG2 MET A 136 -1.832 1.349 -4.294 1.00 0.00 H new ATOM 0 HG3 MET A 136 -2.283 0.379 -2.905 1.00 0.00 H new ATOM 0 HE1 MET A 136 -4.495 0.493 -6.942 1.00 0.00 H new ATOM 0 HE2 MET A 136 -5.192 1.353 -5.548 1.00 0.00 H new ATOM 0 HE3 MET A 136 -3.570 1.784 -6.139 1.00 0.00 H new ATOM 2193 N LYS A 137 -4.692 4.677 -2.386 1.00 0.00 N ATOM 2194 CA LYS A 137 -5.799 5.658 -2.298 1.00 0.00 C ATOM 2195 C LYS A 137 -5.322 6.952 -2.939 1.00 0.00 C ATOM 2196 O LYS A 137 -5.990 7.535 -3.769 1.00 0.00 O ATOM 2197 CB LYS A 137 -6.138 5.916 -0.832 1.00 0.00 C ATOM 2198 CG LYS A 137 -6.669 4.635 -0.198 1.00 0.00 C ATOM 2199 CD LYS A 137 -7.008 4.898 1.268 1.00 0.00 C ATOM 2200 CE LYS A 137 -7.099 3.567 2.008 1.00 0.00 C ATOM 2201 NZ LYS A 137 -8.253 3.596 2.953 1.00 0.00 N ATOM 0 H LYS A 137 -4.378 4.285 -1.498 1.00 0.00 H new ATOM 0 HA LYS A 137 -6.686 5.279 -2.805 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -5.252 6.258 -0.298 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -6.883 6.708 -0.754 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -7.555 4.292 -0.732 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -5.924 3.843 -0.274 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -6.244 5.529 1.723 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -7.953 5.436 1.344 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -7.220 2.751 1.295 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -6.174 3.379 2.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -8.313 2.688 3.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -8.119 4.365 3.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -9.133 3.756 2.422 1.00 0.00 H new ATOM 2215 N ALA A 138 -4.149 7.391 -2.568 1.00 0.00 N ATOM 2216 CA ALA A 138 -3.600 8.638 -3.157 1.00 0.00 C ATOM 2217 C ALA A 138 -3.205 8.379 -4.611 1.00 0.00 C ATOM 2218 O ALA A 138 -3.445 9.195 -5.478 1.00 0.00 O ATOM 2219 CB ALA A 138 -2.380 9.088 -2.359 1.00 0.00 C ATOM 0 H ALA A 138 -3.549 6.936 -1.880 1.00 0.00 H new ATOM 0 HA ALA A 138 -4.356 9.423 -3.123 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -1.979 10.004 -2.793 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -2.670 9.274 -1.325 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -1.619 8.309 -2.388 1.00 0.00 H new ATOM 2225 N ALA A 139 -2.620 7.241 -4.899 1.00 0.00 N ATOM 2226 CA ALA A 139 -2.246 6.957 -6.313 1.00 0.00 C ATOM 2227 C ALA A 139 -3.512 7.058 -7.156 1.00 0.00 C ATOM 2228 O ALA A 139 -3.514 7.610 -8.239 1.00 0.00 O ATOM 2229 CB ALA A 139 -1.665 5.544 -6.428 1.00 0.00 C ATOM 0 H ALA A 139 -2.390 6.510 -4.226 1.00 0.00 H new ATOM 0 HA ALA A 139 -1.495 7.669 -6.656 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.394 5.345 -7.465 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -0.778 5.463 -5.800 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -2.409 4.817 -6.101 1.00 0.00 H new ATOM 2235 N LEU A 140 -4.595 6.540 -6.648 1.00 0.00 N ATOM 2236 CA LEU A 140 -5.882 6.616 -7.388 1.00 0.00 C ATOM 2237 C LEU A 140 -6.416 8.048 -7.318 1.00 0.00 C ATOM 2238 O LEU A 140 -6.839 8.616 -8.307 1.00 0.00 O ATOM 2239 CB LEU A 140 -6.889 5.674 -6.731 1.00 0.00 C ATOM 2240 CG LEU A 140 -6.514 4.227 -7.036 1.00 0.00 C ATOM 2241 CD1 LEU A 140 -6.967 3.331 -5.884 1.00 0.00 C ATOM 2242 CD2 LEU A 140 -7.220 3.786 -8.316 1.00 0.00 C ATOM 0 H LEU A 140 -4.643 6.065 -5.747 1.00 0.00 H new ATOM 0 HA LEU A 140 -5.730 6.329 -8.429 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -6.904 5.836 -5.653 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -7.893 5.885 -7.099 1.00 0.00 H new ATOM 0 HG LEU A 140 -5.434 4.148 -7.160 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -6.700 2.297 -6.101 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -6.477 3.647 -4.963 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -8.048 3.409 -5.766 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -6.956 2.752 -8.540 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -8.299 3.864 -8.182 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -6.910 4.426 -9.142 1.00 0.00 H new ATOM 2254 N GLN A 141 -6.397 8.635 -6.149 1.00 0.00 N ATOM 2255 CA GLN A 141 -6.902 10.026 -6.008 1.00 0.00 C ATOM 2256 C GLN A 141 -6.005 10.971 -6.807 1.00 0.00 C ATOM 2257 O GLN A 141 -6.481 11.793 -7.566 1.00 0.00 O ATOM 2258 CB GLN A 141 -6.905 10.417 -4.523 1.00 0.00 C ATOM 2259 CG GLN A 141 -6.266 11.794 -4.334 1.00 0.00 C ATOM 2260 CD GLN A 141 -6.428 12.227 -2.876 1.00 0.00 C ATOM 2261 OE1 GLN A 141 -7.106 11.468 -2.058 1.00 0.00 O flip ATOM 2262 NE2 GLN A 141 -5.936 13.263 -2.478 1.00 0.00 N flip ATOM 0 H GLN A 141 -6.053 8.208 -5.289 1.00 0.00 H new ATOM 0 HA GLN A 141 -7.920 10.095 -6.393 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -7.927 10.428 -4.145 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -6.359 9.673 -3.943 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -5.210 11.758 -4.600 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -6.737 12.521 -4.996 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -5.407 13.855 -3.118 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -6.052 13.541 -1.504 1.00 0.00 H new ATOM 2271 N GLU A 142 -4.713 10.849 -6.668 1.00 0.00 N ATOM 2272 CA GLU A 142 -3.806 11.732 -7.451 1.00 0.00 C ATOM 2273 C GLU A 142 -3.982 11.399 -8.929 1.00 0.00 C ATOM 2274 O GLU A 142 -3.938 12.259 -9.784 1.00 0.00 O ATOM 2275 CB GLU A 142 -2.356 11.484 -7.034 1.00 0.00 C ATOM 2276 CG GLU A 142 -2.160 11.905 -5.574 1.00 0.00 C ATOM 2277 CD GLU A 142 -2.413 13.408 -5.437 1.00 0.00 C ATOM 2278 OE1 GLU A 142 -2.624 13.853 -4.321 1.00 0.00 O ATOM 2279 OE2 GLU A 142 -2.389 14.087 -6.448 1.00 0.00 O ATOM 0 H GLU A 142 -4.250 10.181 -6.051 1.00 0.00 H new ATOM 0 HA GLU A 142 -4.046 12.779 -7.268 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -2.108 10.430 -7.155 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -1.681 12.046 -7.679 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -2.843 11.351 -4.930 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -1.148 11.665 -5.248 1.00 0.00 H new ATOM 2287 N GLY A 143 -4.202 10.151 -9.234 1.00 0.00 N ATOM 2288 CA GLY A 143 -4.405 9.761 -10.654 1.00 0.00 C ATOM 2289 C GLY A 143 -5.671 10.439 -11.173 1.00 0.00 C ATOM 2290 O GLY A 143 -5.694 10.987 -12.255 1.00 0.00 O ATOM 0 H GLY A 143 -4.250 9.386 -8.561 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.545 10.058 -11.254 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.495 8.678 -10.739 1.00 0.00 H new ATOM 2294 N HIS A 144 -6.723 10.418 -10.396 1.00 0.00 N ATOM 2295 CA HIS A 144 -7.987 11.072 -10.833 1.00 0.00 C ATOM 2296 C HIS A 144 -7.727 12.559 -11.058 1.00 0.00 C ATOM 2297 O HIS A 144 -8.318 13.181 -11.917 1.00 0.00 O ATOM 2298 CB HIS A 144 -9.055 10.902 -9.749 1.00 0.00 C ATOM 2299 CG HIS A 144 -10.065 9.880 -10.190 1.00 0.00 C ATOM 2300 ND1 HIS A 144 -10.572 8.918 -9.326 1.00 0.00 N ATOM 2301 CD2 HIS A 144 -10.676 9.657 -11.399 1.00 0.00 C ATOM 2302 CE1 HIS A 144 -11.446 8.169 -10.021 1.00 0.00 C ATOM 2303 NE2 HIS A 144 -11.544 8.577 -11.285 1.00 0.00 N ATOM 0 H HIS A 144 -6.759 9.975 -9.478 1.00 0.00 H new ATOM 0 HA HIS A 144 -8.336 10.613 -11.758 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -8.591 10.589 -8.814 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -9.548 11.855 -9.557 1.00 0.00 H new ATOM 0 HD1 HIS A 144 -10.326 8.801 -8.343 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -10.508 10.231 -12.298 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -12.000 7.340 -9.606 1.00 0.00 H new ATOM 2312 N GLN A 145 -6.848 13.135 -10.286 1.00 0.00 N ATOM 2313 CA GLN A 145 -6.548 14.583 -10.448 1.00 0.00 C ATOM 2314 C GLN A 145 -6.118 14.870 -11.886 1.00 0.00 C ATOM 2315 O GLN A 145 -6.640 15.754 -12.535 1.00 0.00 O ATOM 2316 CB GLN A 145 -5.418 14.968 -9.492 1.00 0.00 C ATOM 2317 CG GLN A 145 -5.045 16.431 -9.711 1.00 0.00 C ATOM 2318 CD GLN A 145 -4.086 16.883 -8.610 1.00 0.00 C ATOM 2319 OE1 GLN A 145 -3.788 16.132 -7.702 1.00 0.00 O ATOM 2320 NE2 GLN A 145 -3.591 18.088 -8.647 1.00 0.00 N ATOM 0 H GLN A 145 -6.324 12.664 -9.549 1.00 0.00 H new ATOM 0 HA GLN A 145 -7.441 15.165 -10.222 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -5.731 14.812 -8.460 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -4.550 14.331 -9.662 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -4.579 16.556 -10.688 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -5.942 17.051 -9.704 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -3.841 18.719 -9.409 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -2.954 18.400 -7.914 1.00 0.00 H new ATOM 2329 N PHE A 146 -5.174 14.127 -12.392 1.00 0.00 N ATOM 2330 CA PHE A 146 -4.716 14.359 -13.791 1.00 0.00 C ATOM 2331 C PHE A 146 -5.871 14.090 -14.753 1.00 0.00 C ATOM 2332 O PHE A 146 -6.151 14.877 -15.632 1.00 0.00 O ATOM 2333 CB PHE A 146 -3.560 13.411 -14.117 1.00 0.00 C ATOM 2334 CG PHE A 146 -2.867 13.848 -15.391 1.00 0.00 C ATOM 2335 CD1 PHE A 146 -3.522 13.751 -16.625 1.00 0.00 C ATOM 2336 CD2 PHE A 146 -1.560 14.349 -15.335 1.00 0.00 C ATOM 2337 CE1 PHE A 146 -2.869 14.148 -17.797 1.00 0.00 C ATOM 2338 CE2 PHE A 146 -0.910 14.742 -16.511 1.00 0.00 C ATOM 2339 CZ PHE A 146 -1.570 14.643 -17.740 1.00 0.00 C ATOM 0 H PHE A 146 -4.700 13.370 -11.899 1.00 0.00 H new ATOM 0 HA PHE A 146 -4.382 15.391 -13.895 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -2.847 13.399 -13.293 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -3.935 12.394 -14.229 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.531 13.370 -16.672 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -1.054 14.432 -14.385 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -3.375 14.070 -18.748 1.00 0.00 H new ATOM 0 HE2 PHE A 146 0.100 15.121 -16.469 1.00 0.00 H new ATOM 0 HZ PHE A 146 -1.070 14.951 -18.646 1.00 0.00 H new ATOM 2349 N LEU A 147 -6.543 12.976 -14.593 1.00 0.00 N ATOM 2350 CA LEU A 147 -7.674 12.648 -15.507 1.00 0.00 C ATOM 2351 C LEU A 147 -8.631 13.835 -15.574 1.00 0.00 C ATOM 2352 O LEU A 147 -9.095 14.206 -16.633 1.00 0.00 O ATOM 2353 CB LEU A 147 -8.414 11.414 -14.982 1.00 0.00 C ATOM 2354 CG LEU A 147 -7.429 10.249 -14.831 1.00 0.00 C ATOM 2355 CD1 LEU A 147 -8.187 8.977 -14.452 1.00 0.00 C ATOM 2356 CD2 LEU A 147 -6.691 10.024 -16.152 1.00 0.00 C ATOM 0 H LEU A 147 -6.355 12.282 -13.869 1.00 0.00 H new ATOM 0 HA LEU A 147 -7.289 12.438 -16.505 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -8.879 11.637 -14.022 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -9.216 11.139 -15.668 1.00 0.00 H new ATOM 0 HG LEU A 147 -6.710 10.490 -14.048 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -7.483 8.152 -14.346 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.709 9.132 -13.508 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -8.910 8.739 -15.232 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -5.992 9.195 -16.041 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -7.411 9.789 -16.936 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -6.144 10.927 -16.421 1.00 0.00 H new ATOM 2368 N CYS A 148 -8.917 14.448 -14.459 1.00 0.00 N ATOM 2369 CA CYS A 148 -9.832 15.622 -14.473 1.00 0.00 C ATOM 2370 C CYS A 148 -9.221 16.721 -15.344 1.00 0.00 C ATOM 2371 O CYS A 148 -9.915 17.519 -15.939 1.00 0.00 O ATOM 2372 CB CYS A 148 -10.021 16.139 -13.046 1.00 0.00 C ATOM 2373 SG CYS A 148 -10.967 14.929 -12.086 1.00 0.00 S ATOM 0 H CYS A 148 -8.557 14.187 -13.541 1.00 0.00 H new ATOM 0 HA CYS A 148 -10.801 15.331 -14.879 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -9.051 16.312 -12.579 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -10.543 17.096 -13.061 1.00 0.00 H new ATOM 0 HG CYS A 148 -10.197 13.931 -11.767 1.00 0.00 H new ATOM 2379 N SER A 149 -7.918 16.765 -15.418 1.00 0.00 N ATOM 2380 CA SER A 149 -7.245 17.808 -16.242 1.00 0.00 C ATOM 2381 C SER A 149 -7.241 17.390 -17.714 1.00 0.00 C ATOM 2382 O SER A 149 -6.810 18.129 -18.575 1.00 0.00 O ATOM 2383 CB SER A 149 -5.800 17.966 -15.770 1.00 0.00 C ATOM 2384 OG SER A 149 -5.790 18.350 -14.403 1.00 0.00 O ATOM 0 H SER A 149 -7.289 16.120 -14.941 1.00 0.00 H new ATOM 0 HA SER A 149 -7.783 18.750 -16.134 1.00 0.00 H new ATOM 0 HB2 SER A 149 -5.259 17.029 -15.900 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.289 18.716 -16.374 1.00 0.00 H new ATOM 0 HG SER A 149 -6.012 17.576 -13.844 1.00 0.00 H new ATOM 2390 N ILE A 150 -7.706 16.209 -18.013 1.00 0.00 N ATOM 2391 CA ILE A 150 -7.714 15.753 -19.425 1.00 0.00 C ATOM 2392 C ILE A 150 -9.107 15.927 -20.009 1.00 0.00 C ATOM 2393 O ILE A 150 -9.811 16.873 -19.715 1.00 0.00 O ATOM 2394 CB ILE A 150 -7.334 14.274 -19.475 1.00 0.00 C ATOM 2395 CG1 ILE A 150 -6.102 14.045 -18.607 1.00 0.00 C ATOM 2396 CG2 ILE A 150 -7.025 13.876 -20.917 1.00 0.00 C ATOM 2397 CD1 ILE A 150 -5.566 12.626 -18.829 1.00 0.00 C ATOM 0 H ILE A 150 -8.080 15.542 -17.338 1.00 0.00 H new ATOM 0 HA ILE A 150 -7.000 16.342 -20.001 1.00 0.00 H new ATOM 0 HB ILE A 150 -8.161 13.669 -19.104 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -5.332 14.777 -18.852 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -6.355 14.188 -17.556 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -6.754 12.821 -20.953 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -7.905 14.046 -21.538 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.196 14.477 -21.291 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -4.686 12.468 -18.206 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.335 11.901 -18.562 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -5.296 12.499 -19.877 1.00 0.00 H new ATOM 2409 N GLU A 151 -9.510 15.007 -20.828 1.00 0.00 N ATOM 2410 CA GLU A 151 -10.863 15.086 -21.437 1.00 0.00 C ATOM 2411 C GLU A 151 -11.847 14.361 -20.526 1.00 0.00 C ATOM 2412 O GLU A 151 -12.950 14.016 -20.903 1.00 0.00 O ATOM 2413 CB GLU A 151 -10.836 14.444 -22.825 1.00 0.00 C ATOM 2414 CG GLU A 151 -12.209 14.585 -23.471 1.00 0.00 C ATOM 2415 CD GLU A 151 -12.128 14.178 -24.945 1.00 0.00 C ATOM 2416 OE1 GLU A 151 -11.030 13.900 -25.403 1.00 0.00 O ATOM 2417 OE2 GLU A 151 -13.163 14.150 -25.590 1.00 0.00 O ATOM 0 H GLU A 151 -8.958 14.196 -21.106 1.00 0.00 H new ATOM 0 HA GLU A 151 -11.173 16.125 -21.547 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -10.078 14.923 -23.445 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -10.565 13.391 -22.746 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -12.933 13.959 -22.950 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -12.558 15.614 -23.386 1.00 0.00 H new ATOM 2425 N ALA A 152 -11.437 14.137 -19.318 1.00 0.00 N ATOM 2426 CA ALA A 152 -12.308 13.441 -18.335 1.00 0.00 C ATOM 2427 C ALA A 152 -13.422 14.381 -17.871 1.00 0.00 C ATOM 2428 O ALA A 152 -14.549 13.976 -17.668 1.00 0.00 O ATOM 2429 CB ALA A 152 -11.469 13.017 -17.129 1.00 0.00 C ATOM 0 H ALA A 152 -10.521 14.410 -18.961 1.00 0.00 H new ATOM 0 HA ALA A 152 -12.751 12.563 -18.805 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -12.104 12.506 -16.405 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -10.677 12.344 -17.456 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -11.027 13.899 -16.665 1.00 0.00 H new ATOM 2435 N LEU A 153 -13.108 15.636 -17.691 1.00 0.00 N ATOM 2436 CA LEU A 153 -14.139 16.606 -17.227 1.00 0.00 C ATOM 2437 C LEU A 153 -14.621 17.444 -18.415 1.00 0.00 C ATOM 2438 O LEU A 153 -14.174 17.249 -19.543 1.00 0.00 O ATOM 2439 CB LEU A 153 -13.524 17.527 -16.169 1.00 0.00 C ATOM 2440 CG LEU A 153 -14.613 18.403 -15.546 1.00 0.00 C ATOM 2441 CD1 LEU A 153 -15.456 17.571 -14.577 1.00 0.00 C ATOM 2442 CD2 LEU A 153 -13.957 19.556 -14.783 1.00 0.00 C ATOM 0 H LEU A 153 -12.180 16.031 -17.846 1.00 0.00 H new ATOM 0 HA LEU A 153 -14.983 16.067 -16.797 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -13.036 16.933 -15.396 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -12.756 18.154 -16.622 1.00 0.00 H new ATOM 0 HG LEU A 153 -15.254 18.798 -16.334 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -16.230 18.199 -14.136 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -15.922 16.746 -15.116 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -14.818 17.174 -13.788 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -14.729 20.183 -14.337 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -13.317 19.155 -13.997 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -13.357 20.152 -15.470 1.00 0.00 H new TER 2454 LEU A 153