USER MOD reduce.3.24.130724 H: found=0, std=0, add=751, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 743 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 85 HIS : no HD1:sc=-0.00949 X(o=-0.019,f=-0.009) USER MOD Set 1.2: A 86 HIS : no HD1:sc= -0.0091 X(o=-0.019,f=0) USER MOD Set 2.1: A 44 GLN : amide:sc= -0.168 X(o=-9.3,f=-9.7) USER MOD Set 2.2: A 48 HIS : no HE2:sc= -9.13! C(o=-9.3!,f=-18!) USER MOD Set 3.1: A 36 ASN : amide:sc= -4.94! C(o=-3.8!,f=-11!) USER MOD Set 3.2: A 37 SER OG : rot 76:sc= 1.19 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 169:sc= 0.309 (180deg=0.189!) USER MOD Single : A 5 THR OG1 : rot -84:sc= -0.836! USER MOD Single : A 10 LYS NZ :NH3+ -139:sc= -3.51 (180deg=-7.3!) USER MOD Single : A 14 SER OG : rot -160:sc= -0.226 USER MOD Single : A 18 LYS NZ :NH3+ -139:sc= 0 (180deg=-1.02) USER MOD Single : A 23 SER OG : rot -21:sc= 0.0806 USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -101:sc= -4.8! (180deg=-7.31!) USER MOD Single : A 30 LYS NZ :NH3+ -147:sc= 0 (180deg=-0.452) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 35 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 38 ASN : amide:sc= -1.79 K(o=-1.8,f=-6.3!) USER MOD Single : A 47 MET CE :methyl 163:sc= -0.472 (180deg=-0.991) USER MOD Single : A 51 MET CE :methyl -171:sc= -0.138 (180deg=-0.219) USER MOD Single : A 57 TYR OH : rot 30:sc= -0.0139 USER MOD Single : A 60 SER OG : rot 81:sc= 0.639 USER MOD Single : A 61 GLN : amide:sc= -5.4! C(o=-5.4!,f=-4.8!) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 142:sc= -1.85 USER MOD Single : A 68 ASN : amide:sc= -0.452 K(o=-0.45,f=-1.8) USER MOD Single : A 75 THR OG1 : rot 48:sc= 0.856 USER MOD Single : A 76 GLN : amide:sc= -0.0453 K(o=-0.045,f=-3.3!) USER MOD Single : A 79 LYS NZ :NH3+ -128:sc= -0.179 (180deg=-1.23!) USER MOD Single : A 87 HIS : no HD1:sc= -0.052 X(o=-0.052,f=-0.074) USER MOD Single : A 88 HIS : no HD1:sc= -2.97! C(o=-3!,f=-3.7!) USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=-0.00092) USER MOD Single : A 90 HIS : no HD1:sc= 0 X(o=0,f=-0.053) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.176 -11.982 11.325 1.00 0.00 N ATOM 2 CA MET A 1 -4.933 -11.164 11.419 1.00 0.00 C ATOM 3 C MET A 1 -4.345 -11.294 12.818 1.00 0.00 C ATOM 4 O MET A 1 -3.134 -11.440 12.981 1.00 0.00 O ATOM 5 CB MET A 1 -5.267 -9.699 11.128 1.00 0.00 C ATOM 6 CG MET A 1 -5.722 -9.556 9.673 1.00 0.00 C ATOM 7 SD MET A 1 -7.415 -10.175 9.509 1.00 0.00 S ATOM 8 CE MET A 1 -7.891 -9.158 8.090 1.00 0.00 C ATOM 0 H1 MET A 1 -6.677 -11.752 10.443 1.00 0.00 H new ATOM 0 H2 MET A 1 -5.928 -12.992 11.329 1.00 0.00 H new ATOM 0 H3 MET A 1 -6.791 -11.773 12.137 1.00 0.00 H new ATOM 0 HA MET A 1 -4.204 -11.518 10.690 1.00 0.00 H new ATOM 0 HB2 MET A 1 -6.052 -9.354 11.801 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.393 -9.073 11.310 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.674 -8.511 9.366 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.054 -10.112 9.015 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.921 -9.380 7.812 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.806 -8.104 8.353 1.00 0.00 H new ATOM 0 HE3 MET A 1 -7.233 -9.377 7.249 1.00 0.00 H new ATOM 20 N GLY A 2 -5.210 -11.244 13.827 1.00 0.00 N ATOM 21 CA GLY A 2 -4.763 -11.358 15.211 1.00 0.00 C ATOM 22 C GLY A 2 -4.682 -12.818 15.632 1.00 0.00 C ATOM 23 O GLY A 2 -5.696 -13.435 15.947 1.00 0.00 O ATOM 0 H GLY A 2 -6.217 -11.126 13.714 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -3.786 -10.888 15.323 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -5.451 -10.823 15.866 1.00 0.00 H new ATOM 27 N VAL A 3 -3.466 -13.366 15.634 1.00 0.00 N ATOM 28 CA VAL A 3 -3.259 -14.762 16.022 1.00 0.00 C ATOM 29 C VAL A 3 -2.205 -14.854 17.119 1.00 0.00 C ATOM 30 O VAL A 3 -1.133 -14.258 17.017 1.00 0.00 O ATOM 31 CB VAL A 3 -2.818 -15.580 14.806 1.00 0.00 C ATOM 32 CG1 VAL A 3 -2.420 -16.989 15.254 1.00 0.00 C ATOM 33 CG2 VAL A 3 -3.974 -15.667 13.808 1.00 0.00 C ATOM 0 H VAL A 3 -2.615 -12.868 15.373 1.00 0.00 H new ATOM 0 HA VAL A 3 -4.198 -15.164 16.403 1.00 0.00 H new ATOM 0 HB VAL A 3 -1.963 -15.097 14.332 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -2.106 -17.571 14.388 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -1.597 -16.926 15.966 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -3.273 -17.475 15.728 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -3.663 -16.249 12.941 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.828 -16.150 14.282 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -4.256 -14.663 13.489 1.00 0.00 H new ATOM 43 N TRP A 4 -2.522 -15.608 18.167 1.00 0.00 N ATOM 44 CA TRP A 4 -1.605 -15.780 19.292 1.00 0.00 C ATOM 45 C TRP A 4 -0.690 -16.975 19.060 1.00 0.00 C ATOM 46 O TRP A 4 -1.125 -18.023 18.583 1.00 0.00 O ATOM 47 CB TRP A 4 -2.400 -15.992 20.574 1.00 0.00 C ATOM 48 CG TRP A 4 -3.437 -14.921 20.689 1.00 0.00 C ATOM 49 CD1 TRP A 4 -4.771 -15.115 20.581 1.00 0.00 C ATOM 50 CD2 TRP A 4 -3.248 -13.495 20.923 1.00 0.00 C ATOM 51 NE1 TRP A 4 -5.414 -13.900 20.738 1.00 0.00 N ATOM 52 CE2 TRP A 4 -4.517 -12.871 20.953 1.00 0.00 C ATOM 53 CE3 TRP A 4 -2.110 -12.692 21.115 1.00 0.00 C ATOM 54 CZ2 TRP A 4 -4.652 -11.498 21.161 1.00 0.00 C ATOM 55 CZ3 TRP A 4 -2.242 -11.309 21.325 1.00 0.00 C ATOM 56 CH2 TRP A 4 -3.511 -10.714 21.350 1.00 0.00 C ATOM 0 H TRP A 4 -3.405 -16.110 18.262 1.00 0.00 H new ATOM 0 HA TRP A 4 -0.994 -14.882 19.382 1.00 0.00 H new ATOM 0 HB2 TRP A 4 -2.873 -16.974 20.565 1.00 0.00 H new ATOM 0 HB3 TRP A 4 -1.735 -15.966 21.437 1.00 0.00 H new ATOM 0 HD1 TRP A 4 -5.255 -16.063 20.402 1.00 0.00 H new ATOM 0 HE1 TRP A 4 -6.426 -13.779 20.700 1.00 0.00 H new ATOM 0 HE3 TRP A 4 -1.128 -13.141 21.101 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 -5.632 -11.044 21.176 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 -1.361 -10.701 21.468 1.00 0.00 H new ATOM 0 HH2 TRP A 4 -3.607 -9.651 21.515 1.00 0.00 H new ATOM 67 N THR A 5 0.580 -16.804 19.402 1.00 0.00 N ATOM 68 CA THR A 5 1.572 -17.860 19.231 1.00 0.00 C ATOM 69 C THR A 5 2.961 -17.345 19.602 1.00 0.00 C ATOM 70 O THR A 5 3.692 -17.998 20.348 1.00 0.00 O ATOM 71 CB THR A 5 1.578 -18.368 17.761 1.00 0.00 C ATOM 72 OG1 THR A 5 0.639 -17.630 16.991 1.00 0.00 O ATOM 73 CG2 THR A 5 1.216 -19.850 17.717 1.00 0.00 C ATOM 0 H THR A 5 0.950 -15.941 19.801 1.00 0.00 H new ATOM 0 HA THR A 5 1.309 -18.687 19.890 1.00 0.00 H new ATOM 0 HB THR A 5 2.577 -18.230 17.346 1.00 0.00 H new ATOM 0 HG1 THR A 5 -0.252 -18.024 17.097 1.00 0.00 H new ATOM 0 HG21 THR A 5 1.223 -20.196 16.683 1.00 0.00 H new ATOM 0 HG22 THR A 5 1.944 -20.420 18.295 1.00 0.00 H new ATOM 0 HG23 THR A 5 0.222 -19.995 18.141 1.00 0.00 H new ATOM 81 N PRO A 6 3.326 -16.198 19.088 1.00 0.00 N ATOM 82 CA PRO A 6 4.660 -15.588 19.350 1.00 0.00 C ATOM 83 C PRO A 6 4.999 -15.571 20.836 1.00 0.00 C ATOM 84 O PRO A 6 4.195 -15.982 21.669 1.00 0.00 O ATOM 85 CB PRO A 6 4.505 -14.164 18.796 1.00 0.00 C ATOM 86 CG PRO A 6 3.488 -14.290 17.714 1.00 0.00 C ATOM 87 CD PRO A 6 2.507 -15.345 18.196 1.00 0.00 C ATOM 0 HA PRO A 6 5.475 -16.145 18.888 1.00 0.00 H new ATOM 0 HB2 PRO A 6 4.176 -13.471 19.570 1.00 0.00 H new ATOM 0 HB3 PRO A 6 5.451 -13.784 18.409 1.00 0.00 H new ATOM 0 HG2 PRO A 6 2.985 -13.339 17.536 1.00 0.00 H new ATOM 0 HG3 PRO A 6 3.951 -14.586 16.773 1.00 0.00 H new ATOM 0 HD2 PRO A 6 1.667 -14.899 18.728 1.00 0.00 H new ATOM 0 HD3 PRO A 6 2.091 -15.916 17.366 1.00 0.00 H new ATOM 95 N GLU A 7 6.196 -15.097 21.156 1.00 0.00 N ATOM 96 CA GLU A 7 6.630 -15.029 22.544 1.00 0.00 C ATOM 97 C GLU A 7 5.525 -14.449 23.418 1.00 0.00 C ATOM 98 O GLU A 7 5.541 -14.597 24.641 1.00 0.00 O ATOM 99 CB GLU A 7 7.888 -14.169 22.663 1.00 0.00 C ATOM 100 CG GLU A 7 9.060 -14.883 21.988 1.00 0.00 C ATOM 101 CD GLU A 7 10.302 -13.998 22.027 1.00 0.00 C ATOM 102 OE1 GLU A 7 10.226 -12.928 22.607 1.00 0.00 O ATOM 103 OE2 GLU A 7 11.310 -14.405 21.474 1.00 0.00 O ATOM 0 H GLU A 7 6.879 -14.757 20.479 1.00 0.00 H new ATOM 0 HA GLU A 7 6.856 -16.040 22.884 1.00 0.00 H new ATOM 0 HB2 GLU A 7 7.723 -13.198 22.197 1.00 0.00 H new ATOM 0 HB3 GLU A 7 8.117 -13.984 23.713 1.00 0.00 H new ATOM 0 HG2 GLU A 7 9.261 -15.828 22.493 1.00 0.00 H new ATOM 0 HG3 GLU A 7 8.805 -15.121 20.955 1.00 0.00 H new ATOM 110 N VAL A 8 4.565 -13.790 22.781 1.00 0.00 N ATOM 111 CA VAL A 8 3.455 -13.190 23.508 1.00 0.00 C ATOM 112 C VAL A 8 2.694 -14.265 24.270 1.00 0.00 C ATOM 113 O VAL A 8 2.184 -14.020 25.364 1.00 0.00 O ATOM 114 CB VAL A 8 2.504 -12.487 22.534 1.00 0.00 C ATOM 115 CG1 VAL A 8 3.282 -11.456 21.713 1.00 0.00 C ATOM 116 CG2 VAL A 8 1.876 -13.522 21.595 1.00 0.00 C ATOM 0 H VAL A 8 4.533 -13.658 21.770 1.00 0.00 H new ATOM 0 HA VAL A 8 3.853 -12.458 24.211 1.00 0.00 H new ATOM 0 HB VAL A 8 1.717 -11.983 23.096 1.00 0.00 H new ATOM 0 HG11 VAL A 8 2.605 -10.956 21.020 1.00 0.00 H new ATOM 0 HG12 VAL A 8 3.726 -10.719 22.382 1.00 0.00 H new ATOM 0 HG13 VAL A 8 4.070 -11.958 21.151 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.199 -13.022 20.902 1.00 0.00 H new ATOM 0 HG22 VAL A 8 2.661 -14.028 21.034 1.00 0.00 H new ATOM 0 HG23 VAL A 8 1.320 -14.254 22.180 1.00 0.00 H new ATOM 126 N LEU A 9 2.616 -15.455 23.686 1.00 0.00 N ATOM 127 CA LEU A 9 1.911 -16.550 24.333 1.00 0.00 C ATOM 128 C LEU A 9 2.567 -16.886 25.666 1.00 0.00 C ATOM 129 O LEU A 9 1.900 -16.971 26.697 1.00 0.00 O ATOM 130 CB LEU A 9 1.930 -17.789 23.426 1.00 0.00 C ATOM 131 CG LEU A 9 1.242 -18.970 24.130 1.00 0.00 C ATOM 132 CD1 LEU A 9 -0.193 -18.581 24.521 1.00 0.00 C ATOM 133 CD2 LEU A 9 1.212 -20.174 23.186 1.00 0.00 C ATOM 0 H LEU A 9 3.026 -15.683 22.780 1.00 0.00 H new ATOM 0 HA LEU A 9 0.880 -16.245 24.511 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.422 -17.570 22.487 1.00 0.00 H new ATOM 0 HB3 LEU A 9 2.958 -18.052 23.178 1.00 0.00 H new ATOM 0 HG LEU A 9 1.798 -19.228 25.032 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -0.675 -19.422 25.019 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.167 -17.726 25.196 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.756 -18.319 23.625 1.00 0.00 H new ATOM 0 HD21 LEU A 9 0.725 -21.013 23.682 1.00 0.00 H new ATOM 0 HD22 LEU A 9 0.658 -19.915 22.283 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.231 -20.453 22.919 1.00 0.00 H new ATOM 145 N LYS A 10 3.882 -17.069 25.636 1.00 0.00 N ATOM 146 CA LYS A 10 4.624 -17.387 26.848 1.00 0.00 C ATOM 147 C LYS A 10 4.593 -16.206 27.803 1.00 0.00 C ATOM 148 O LYS A 10 4.439 -16.373 29.011 1.00 0.00 O ATOM 149 CB LYS A 10 6.071 -17.736 26.507 1.00 0.00 C ATOM 150 CG LYS A 10 6.111 -19.030 25.688 1.00 0.00 C ATOM 151 CD LYS A 10 7.535 -19.591 25.687 1.00 0.00 C ATOM 152 CE LYS A 10 8.508 -18.522 25.191 1.00 0.00 C ATOM 153 NZ LYS A 10 7.943 -17.858 23.985 1.00 0.00 N ATOM 0 H LYS A 10 4.452 -17.003 24.793 1.00 0.00 H new ATOM 0 HA LYS A 10 4.156 -18.247 27.327 1.00 0.00 H new ATOM 0 HB2 LYS A 10 6.528 -16.923 25.943 1.00 0.00 H new ATOM 0 HB3 LYS A 10 6.652 -17.855 27.422 1.00 0.00 H new ATOM 0 HG2 LYS A 10 5.421 -19.761 26.110 1.00 0.00 H new ATOM 0 HG3 LYS A 10 5.785 -18.836 24.666 1.00 0.00 H new ATOM 0 HD2 LYS A 10 7.811 -19.910 26.692 1.00 0.00 H new ATOM 0 HD3 LYS A 10 7.589 -20.471 25.047 1.00 0.00 H new ATOM 0 HE2 LYS A 10 8.686 -17.786 25.975 1.00 0.00 H new ATOM 0 HE3 LYS A 10 9.471 -18.974 24.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 8.698 -17.707 23.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 7.204 -18.461 23.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 7.532 -16.941 24.254 1.00 0.00 H new ATOM 167 N ALA A 11 4.742 -15.007 27.248 1.00 0.00 N ATOM 168 CA ALA A 11 4.727 -13.796 28.061 1.00 0.00 C ATOM 169 C ALA A 11 3.585 -13.855 29.069 1.00 0.00 C ATOM 170 O ALA A 11 3.589 -13.143 30.072 1.00 0.00 O ATOM 171 CB ALA A 11 4.562 -12.565 27.166 1.00 0.00 C ATOM 0 H ALA A 11 4.873 -14.849 26.249 1.00 0.00 H new ATOM 0 HA ALA A 11 5.673 -13.724 28.598 1.00 0.00 H new ATOM 0 HB1 ALA A 11 4.552 -11.666 27.782 1.00 0.00 H new ATOM 0 HB2 ALA A 11 5.392 -12.513 26.462 1.00 0.00 H new ATOM 0 HB3 ALA A 11 3.624 -12.638 26.616 1.00 0.00 H new ATOM 177 N ARG A 12 2.611 -14.715 28.795 1.00 0.00 N ATOM 178 CA ARG A 12 1.469 -14.866 29.688 1.00 0.00 C ATOM 179 C ARG A 12 1.911 -15.480 31.007 1.00 0.00 C ATOM 180 O ARG A 12 1.747 -14.875 32.064 1.00 0.00 O ATOM 181 CB ARG A 12 0.422 -15.769 29.031 1.00 0.00 C ATOM 182 CG ARG A 12 0.006 -15.195 27.670 1.00 0.00 C ATOM 183 CD ARG A 12 -0.958 -14.020 27.868 1.00 0.00 C ATOM 184 NE ARG A 12 -1.463 -13.566 26.580 1.00 0.00 N ATOM 185 CZ ARG A 12 -0.829 -12.632 25.880 1.00 0.00 C ATOM 186 NH1 ARG A 12 0.280 -12.113 26.335 1.00 0.00 N ATOM 187 NH2 ARG A 12 -1.312 -12.235 24.736 1.00 0.00 N ATOM 0 H ARG A 12 2.589 -15.313 27.969 1.00 0.00 H new ATOM 0 HA ARG A 12 1.038 -13.883 29.881 1.00 0.00 H new ATOM 0 HB2 ARG A 12 0.826 -16.773 28.902 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -0.450 -15.857 29.679 1.00 0.00 H new ATOM 0 HG2 ARG A 12 0.888 -14.864 27.121 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -0.471 -15.970 27.070 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -1.788 -14.324 28.506 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -0.447 -13.202 28.376 1.00 0.00 H new ATOM 0 HE ARG A 12 -2.321 -13.973 26.208 1.00 0.00 H new ATOM 0 HH11 ARG A 12 0.660 -12.425 27.229 1.00 0.00 H new ATOM 0 HH12 ARG A 12 0.766 -11.396 25.797 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -2.177 -12.642 24.379 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -0.825 -11.518 24.198 1.00 0.00 H new ATOM 201 N ALA A 13 2.481 -16.677 30.934 1.00 0.00 N ATOM 202 CA ALA A 13 2.961 -17.363 32.131 1.00 0.00 C ATOM 203 C ALA A 13 4.424 -17.022 32.379 1.00 0.00 C ATOM 204 O ALA A 13 4.838 -16.788 33.514 1.00 0.00 O ATOM 205 CB ALA A 13 2.803 -18.873 31.968 1.00 0.00 C ATOM 0 H ALA A 13 2.622 -17.192 30.065 1.00 0.00 H new ATOM 0 HA ALA A 13 2.369 -17.033 32.985 1.00 0.00 H new ATOM 0 HB1 ALA A 13 3.164 -19.376 32.865 1.00 0.00 H new ATOM 0 HB2 ALA A 13 1.751 -19.114 31.815 1.00 0.00 H new ATOM 0 HB3 ALA A 13 3.381 -19.209 31.107 1.00 0.00 H new ATOM 211 N SER A 14 5.201 -16.998 31.301 1.00 0.00 N ATOM 212 CA SER A 14 6.621 -16.688 31.395 1.00 0.00 C ATOM 213 C SER A 14 6.826 -15.199 31.623 1.00 0.00 C ATOM 214 O SER A 14 7.960 -14.725 31.701 1.00 0.00 O ATOM 215 CB SER A 14 7.343 -17.121 30.119 1.00 0.00 C ATOM 216 OG SER A 14 6.905 -18.422 29.752 1.00 0.00 O ATOM 0 H SER A 14 4.871 -17.189 30.355 1.00 0.00 H new ATOM 0 HA SER A 14 7.037 -17.234 32.242 1.00 0.00 H new ATOM 0 HB2 SER A 14 7.139 -16.415 29.314 1.00 0.00 H new ATOM 0 HB3 SER A 14 8.421 -17.119 30.279 1.00 0.00 H new ATOM 0 HG SER A 14 7.562 -18.831 29.151 1.00 0.00 H new ATOM 222 N VAL A 15 5.719 -14.467 31.719 1.00 0.00 N ATOM 223 CA VAL A 15 5.777 -13.024 31.936 1.00 0.00 C ATOM 224 C VAL A 15 6.449 -12.331 30.760 1.00 0.00 C ATOM 225 O VAL A 15 5.805 -11.595 30.017 1.00 0.00 O ATOM 226 CB VAL A 15 6.544 -12.713 33.221 1.00 0.00 C ATOM 227 CG1 VAL A 15 6.303 -11.257 33.619 1.00 0.00 C ATOM 228 CG2 VAL A 15 6.057 -13.640 34.340 1.00 0.00 C ATOM 0 H VAL A 15 4.775 -14.847 31.650 1.00 0.00 H new ATOM 0 HA VAL A 15 4.756 -12.652 32.027 1.00 0.00 H new ATOM 0 HB VAL A 15 7.610 -12.870 33.058 1.00 0.00 H new ATOM 0 HG11 VAL A 15 6.850 -11.035 34.535 1.00 0.00 H new ATOM 0 HG12 VAL A 15 6.649 -10.600 32.821 1.00 0.00 H new ATOM 0 HG13 VAL A 15 5.238 -11.097 33.784 1.00 0.00 H new ATOM 0 HG21 VAL A 15 6.603 -13.420 35.258 1.00 0.00 H new ATOM 0 HG22 VAL A 15 4.991 -13.483 34.505 1.00 0.00 H new ATOM 0 HG23 VAL A 15 6.231 -14.677 34.054 1.00 0.00 H new ATOM 238 N ILE A 16 7.750 -12.569 30.599 1.00 0.00 N ATOM 239 CA ILE A 16 8.511 -11.956 29.509 1.00 0.00 C ATOM 240 C ILE A 16 9.250 -13.022 28.708 1.00 0.00 C ATOM 241 O ILE A 16 9.879 -13.916 29.275 1.00 0.00 O ATOM 242 CB ILE A 16 9.511 -10.955 30.087 1.00 0.00 C ATOM 243 CG1 ILE A 16 10.175 -10.184 28.945 1.00 0.00 C ATOM 244 CG2 ILE A 16 10.580 -11.702 30.887 1.00 0.00 C ATOM 245 CD1 ILE A 16 10.943 -8.993 29.517 1.00 0.00 C ATOM 0 H ILE A 16 8.298 -13.179 31.206 1.00 0.00 H new ATOM 0 HA ILE A 16 7.820 -11.439 28.843 1.00 0.00 H new ATOM 0 HB ILE A 16 8.989 -10.258 30.743 1.00 0.00 H new ATOM 0 HG12 ILE A 16 10.852 -10.838 28.395 1.00 0.00 H new ATOM 0 HG13 ILE A 16 9.421 -9.839 28.238 1.00 0.00 H new ATOM 0 HG21 ILE A 16 11.292 -10.987 31.299 1.00 0.00 H new ATOM 0 HG22 ILE A 16 10.107 -12.252 31.700 1.00 0.00 H new ATOM 0 HG23 ILE A 16 11.103 -12.400 30.233 1.00 0.00 H new ATOM 0 HD11 ILE A 16 11.417 -8.442 28.705 1.00 0.00 H new ATOM 0 HD12 ILE A 16 10.253 -8.336 30.047 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.707 -9.350 30.207 1.00 0.00 H new ATOM 257 N GLY A 17 9.164 -12.920 27.387 1.00 0.00 N ATOM 258 CA GLY A 17 9.823 -13.880 26.510 1.00 0.00 C ATOM 259 C GLY A 17 11.337 -13.823 26.684 1.00 0.00 C ATOM 260 O GLY A 17 11.898 -12.769 26.985 1.00 0.00 O ATOM 0 H GLY A 17 8.647 -12.186 26.902 1.00 0.00 H new ATOM 0 HA2 GLY A 17 9.465 -14.886 26.730 1.00 0.00 H new ATOM 0 HA3 GLY A 17 9.564 -13.669 25.473 1.00 0.00 H new ATOM 264 N LYS A 18 11.991 -14.964 26.491 1.00 0.00 N ATOM 265 CA LYS A 18 13.440 -15.032 26.627 1.00 0.00 C ATOM 266 C LYS A 18 13.962 -16.382 26.125 1.00 0.00 C ATOM 267 O LYS A 18 14.303 -17.266 26.911 1.00 0.00 O ATOM 268 CB LYS A 18 13.840 -14.815 28.097 1.00 0.00 C ATOM 269 CG LYS A 18 15.217 -14.142 28.164 1.00 0.00 C ATOM 270 CD LYS A 18 16.253 -15.017 27.455 1.00 0.00 C ATOM 271 CE LYS A 18 17.657 -14.534 27.814 1.00 0.00 C ATOM 272 NZ LYS A 18 18.655 -15.206 26.933 1.00 0.00 N ATOM 0 H LYS A 18 11.545 -15.847 26.242 1.00 0.00 H new ATOM 0 HA LYS A 18 13.887 -14.245 26.020 1.00 0.00 H new ATOM 0 HB2 LYS A 18 13.097 -14.195 28.599 1.00 0.00 H new ATOM 0 HB3 LYS A 18 13.865 -15.770 28.622 1.00 0.00 H new ATOM 0 HG2 LYS A 18 15.175 -13.159 27.695 1.00 0.00 H new ATOM 0 HG3 LYS A 18 15.507 -13.988 29.203 1.00 0.00 H new ATOM 0 HD2 LYS A 18 16.128 -16.059 27.750 1.00 0.00 H new ATOM 0 HD3 LYS A 18 16.106 -14.972 26.376 1.00 0.00 H new ATOM 0 HE2 LYS A 18 17.722 -13.452 27.696 1.00 0.00 H new ATOM 0 HE3 LYS A 18 17.873 -14.754 28.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 19.489 -15.474 27.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 18.231 -16.058 26.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 18.943 -14.555 26.175 1.00 0.00 H new ATOM 286 N PRO A 19 14.027 -16.560 24.834 1.00 0.00 N ATOM 287 CA PRO A 19 14.511 -17.827 24.227 1.00 0.00 C ATOM 288 C PRO A 19 16.035 -17.915 24.221 1.00 0.00 C ATOM 289 O PRO A 19 16.710 -17.087 23.614 1.00 0.00 O ATOM 290 CB PRO A 19 13.950 -17.781 22.802 1.00 0.00 C ATOM 291 CG PRO A 19 13.805 -16.322 22.482 1.00 0.00 C ATOM 292 CD PRO A 19 13.641 -15.576 23.815 1.00 0.00 C ATOM 0 HA PRO A 19 14.185 -18.704 24.786 1.00 0.00 H new ATOM 0 HB2 PRO A 19 14.621 -18.273 22.099 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.991 -18.295 22.740 1.00 0.00 H new ATOM 0 HG2 PRO A 19 14.680 -15.958 21.943 1.00 0.00 H new ATOM 0 HG3 PRO A 19 12.941 -16.154 21.839 1.00 0.00 H new ATOM 0 HD2 PRO A 19 14.276 -14.691 23.856 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.615 -15.238 23.958 1.00 0.00 H new ATOM 300 N ILE A 20 16.567 -18.928 24.900 1.00 0.00 N ATOM 301 CA ILE A 20 18.012 -19.122 24.963 1.00 0.00 C ATOM 302 C ILE A 20 18.504 -19.926 23.764 1.00 0.00 C ATOM 303 O ILE A 20 17.793 -20.788 23.249 1.00 0.00 O ATOM 304 CB ILE A 20 18.387 -19.833 26.262 1.00 0.00 C ATOM 305 CG1 ILE A 20 17.647 -21.167 26.338 1.00 0.00 C ATOM 306 CG2 ILE A 20 17.999 -18.960 27.459 1.00 0.00 C ATOM 307 CD1 ILE A 20 18.161 -21.973 27.533 1.00 0.00 C ATOM 0 H ILE A 20 16.023 -19.623 25.411 1.00 0.00 H new ATOM 0 HA ILE A 20 18.492 -18.144 24.939 1.00 0.00 H new ATOM 0 HB ILE A 20 19.462 -20.010 26.283 1.00 0.00 H new ATOM 0 HG12 ILE A 20 16.575 -20.995 26.437 1.00 0.00 H new ATOM 0 HG13 ILE A 20 17.796 -21.730 25.416 1.00 0.00 H new ATOM 0 HG21 ILE A 20 18.268 -19.470 28.384 1.00 0.00 H new ATOM 0 HG22 ILE A 20 18.528 -18.009 27.402 1.00 0.00 H new ATOM 0 HG23 ILE A 20 16.924 -18.779 27.444 1.00 0.00 H new ATOM 0 HD11 ILE A 20 17.631 -22.924 27.585 1.00 0.00 H new ATOM 0 HD12 ILE A 20 19.229 -22.158 27.415 1.00 0.00 H new ATOM 0 HD13 ILE A 20 17.989 -21.412 28.451 1.00 0.00 H new ATOM 319 N GLY A 21 19.725 -19.638 23.325 1.00 0.00 N ATOM 320 CA GLY A 21 20.298 -20.345 22.184 1.00 0.00 C ATOM 321 C GLY A 21 20.291 -21.848 22.427 1.00 0.00 C ATOM 322 O GLY A 21 21.038 -22.354 23.266 1.00 0.00 O ATOM 0 H GLY A 21 20.331 -18.928 23.736 1.00 0.00 H new ATOM 0 HA2 GLY A 21 19.729 -20.114 21.283 1.00 0.00 H new ATOM 0 HA3 GLY A 21 21.319 -20.003 22.013 1.00 0.00 H new ATOM 326 N GLU A 22 19.442 -22.559 21.686 1.00 0.00 N ATOM 327 CA GLU A 22 19.339 -24.010 21.827 1.00 0.00 C ATOM 328 C GLU A 22 18.229 -24.559 20.936 1.00 0.00 C ATOM 329 O GLU A 22 17.702 -23.859 20.074 1.00 0.00 O ATOM 330 CB GLU A 22 19.060 -24.380 23.310 1.00 0.00 C ATOM 331 CG GLU A 22 20.226 -25.195 23.878 1.00 0.00 C ATOM 332 CD GLU A 22 20.308 -26.537 23.157 1.00 0.00 C ATOM 333 OE1 GLU A 22 19.272 -27.161 22.988 1.00 0.00 O ATOM 334 OE2 GLU A 22 21.402 -26.916 22.780 1.00 0.00 O ATOM 0 H GLU A 22 18.819 -22.156 20.986 1.00 0.00 H new ATOM 0 HA GLU A 22 20.284 -24.456 21.518 1.00 0.00 H new ATOM 0 HB2 GLU A 22 18.919 -23.474 23.899 1.00 0.00 H new ATOM 0 HB3 GLU A 22 18.136 -24.954 23.382 1.00 0.00 H new ATOM 0 HG2 GLU A 22 21.160 -24.647 23.756 1.00 0.00 H new ATOM 0 HG3 GLU A 22 20.086 -25.353 24.947 1.00 0.00 H new ATOM 341 N SER A 23 17.882 -25.821 21.156 1.00 0.00 N ATOM 342 CA SER A 23 16.825 -26.459 20.384 1.00 0.00 C ATOM 343 C SER A 23 15.455 -26.045 20.920 1.00 0.00 C ATOM 344 O SER A 23 14.439 -26.221 20.254 1.00 0.00 O ATOM 345 CB SER A 23 16.964 -27.977 20.443 1.00 0.00 C ATOM 346 OG SER A 23 15.959 -28.569 19.630 1.00 0.00 O ATOM 0 H SER A 23 18.315 -26.420 21.859 1.00 0.00 H new ATOM 0 HA SER A 23 16.915 -26.136 19.347 1.00 0.00 H new ATOM 0 HB2 SER A 23 17.953 -28.278 20.097 1.00 0.00 H new ATOM 0 HB3 SER A 23 16.868 -28.324 21.472 1.00 0.00 H new ATOM 0 HG SER A 23 15.230 -27.929 19.493 1.00 0.00 H new ATOM 352 N TYR A 24 15.433 -25.512 22.134 1.00 0.00 N ATOM 353 CA TYR A 24 14.177 -25.089 22.746 1.00 0.00 C ATOM 354 C TYR A 24 13.509 -24.005 21.908 1.00 0.00 C ATOM 355 O TYR A 24 12.302 -24.044 21.670 1.00 0.00 O ATOM 356 CB TYR A 24 14.429 -24.560 24.158 1.00 0.00 C ATOM 357 CG TYR A 24 13.135 -24.044 24.743 1.00 0.00 C ATOM 358 CD1 TYR A 24 12.269 -24.917 25.410 1.00 0.00 C ATOM 359 CD2 TYR A 24 12.805 -22.688 24.618 1.00 0.00 C ATOM 360 CE1 TYR A 24 11.070 -24.436 25.951 1.00 0.00 C ATOM 361 CE2 TYR A 24 11.606 -22.207 25.158 1.00 0.00 C ATOM 362 CZ TYR A 24 10.739 -23.081 25.826 1.00 0.00 C ATOM 363 OH TYR A 24 9.556 -22.606 26.359 1.00 0.00 O ATOM 0 H TYR A 24 16.261 -25.362 22.711 1.00 0.00 H new ATOM 0 HA TYR A 24 13.515 -25.954 22.797 1.00 0.00 H new ATOM 0 HB2 TYR A 24 14.834 -25.352 24.787 1.00 0.00 H new ATOM 0 HB3 TYR A 24 15.172 -23.763 24.132 1.00 0.00 H new ATOM 0 HD1 TYR A 24 12.525 -25.962 25.508 1.00 0.00 H new ATOM 0 HD2 TYR A 24 13.475 -22.014 24.105 1.00 0.00 H new ATOM 0 HE1 TYR A 24 10.401 -25.110 26.465 1.00 0.00 H new ATOM 0 HE2 TYR A 24 11.350 -21.162 25.059 1.00 0.00 H new ATOM 0 HH TYR A 24 9.482 -21.644 26.185 1.00 0.00 H new ATOM 373 N LYS A 25 14.298 -23.031 21.475 1.00 0.00 N ATOM 374 CA LYS A 25 13.770 -21.935 20.673 1.00 0.00 C ATOM 375 C LYS A 25 13.540 -22.387 19.236 1.00 0.00 C ATOM 376 O LYS A 25 13.192 -21.585 18.369 1.00 0.00 O ATOM 377 CB LYS A 25 14.743 -20.751 20.704 1.00 0.00 C ATOM 378 CG LYS A 25 16.005 -21.082 19.905 1.00 0.00 C ATOM 379 CD LYS A 25 17.008 -19.939 20.027 1.00 0.00 C ATOM 380 CE LYS A 25 18.139 -20.146 19.015 1.00 0.00 C ATOM 381 NZ LYS A 25 18.808 -21.454 19.270 1.00 0.00 N ATOM 0 H LYS A 25 15.299 -22.977 21.664 1.00 0.00 H new ATOM 0 HA LYS A 25 12.814 -21.623 21.094 1.00 0.00 H new ATOM 0 HB2 LYS A 25 14.263 -19.865 20.288 1.00 0.00 H new ATOM 0 HB3 LYS A 25 15.008 -20.516 21.735 1.00 0.00 H new ATOM 0 HG2 LYS A 25 16.448 -22.007 20.274 1.00 0.00 H new ATOM 0 HG3 LYS A 25 15.751 -21.245 18.858 1.00 0.00 H new ATOM 0 HD2 LYS A 25 16.513 -18.985 19.846 1.00 0.00 H new ATOM 0 HD3 LYS A 25 17.412 -19.901 21.039 1.00 0.00 H new ATOM 0 HE2 LYS A 25 17.741 -20.122 18.000 1.00 0.00 H new ATOM 0 HE3 LYS A 25 18.863 -19.335 19.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 19.696 -21.295 19.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 18.181 -22.060 19.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 19.014 -21.921 18.364 1.00 0.00 H new ATOM 395 N ARG A 26 13.754 -23.672 18.984 1.00 0.00 N ATOM 396 CA ARG A 26 13.581 -24.209 17.648 1.00 0.00 C ATOM 397 C ARG A 26 12.122 -24.121 17.224 1.00 0.00 C ATOM 398 O ARG A 26 11.809 -23.664 16.126 1.00 0.00 O ATOM 399 CB ARG A 26 14.048 -25.664 17.621 1.00 0.00 C ATOM 400 CG ARG A 26 14.066 -26.181 16.174 1.00 0.00 C ATOM 401 CD ARG A 26 12.633 -26.502 15.686 1.00 0.00 C ATOM 402 NE ARG A 26 12.646 -27.699 14.873 1.00 0.00 N ATOM 403 CZ ARG A 26 13.089 -27.674 13.625 1.00 0.00 C ATOM 404 NH1 ARG A 26 13.539 -26.561 13.112 1.00 0.00 N ATOM 405 NH2 ARG A 26 13.074 -28.763 12.913 1.00 0.00 N ATOM 0 H ARG A 26 14.045 -24.354 19.684 1.00 0.00 H new ATOM 0 HA ARG A 26 14.178 -23.623 16.949 1.00 0.00 H new ATOM 0 HB2 ARG A 26 15.044 -25.744 18.057 1.00 0.00 H new ATOM 0 HB3 ARG A 26 13.384 -26.279 18.228 1.00 0.00 H new ATOM 0 HG2 ARG A 26 14.518 -25.434 15.522 1.00 0.00 H new ATOM 0 HG3 ARG A 26 14.685 -27.076 16.111 1.00 0.00 H new ATOM 0 HD2 ARG A 26 11.971 -26.640 16.541 1.00 0.00 H new ATOM 0 HD3 ARG A 26 12.240 -25.665 15.110 1.00 0.00 H new ATOM 0 HE ARG A 26 12.308 -28.577 15.268 1.00 0.00 H new ATOM 0 HH11 ARG A 26 13.550 -25.709 13.672 1.00 0.00 H new ATOM 0 HH12 ARG A 26 13.880 -26.544 12.151 1.00 0.00 H new ATOM 0 HH21 ARG A 26 12.722 -29.631 13.316 1.00 0.00 H new ATOM 0 HH22 ARG A 26 13.414 -28.748 11.951 1.00 0.00 H new ATOM 419 N ILE A 27 11.232 -24.543 18.114 1.00 0.00 N ATOM 420 CA ILE A 27 9.806 -24.499 17.829 1.00 0.00 C ATOM 421 C ILE A 27 9.326 -23.058 17.733 1.00 0.00 C ATOM 422 O ILE A 27 8.507 -22.713 16.880 1.00 0.00 O ATOM 423 CB ILE A 27 9.027 -25.246 18.915 1.00 0.00 C ATOM 424 CG1 ILE A 27 9.437 -24.717 20.291 1.00 0.00 C ATOM 425 CG2 ILE A 27 9.333 -26.743 18.831 1.00 0.00 C ATOM 426 CD1 ILE A 27 8.636 -25.428 21.375 1.00 0.00 C ATOM 0 H ILE A 27 11.471 -24.917 19.032 1.00 0.00 H new ATOM 0 HA ILE A 27 9.628 -24.987 16.871 1.00 0.00 H new ATOM 0 HB ILE A 27 7.959 -25.088 18.767 1.00 0.00 H new ATOM 0 HG12 ILE A 27 10.503 -24.877 20.450 1.00 0.00 H new ATOM 0 HG13 ILE A 27 9.265 -23.642 20.344 1.00 0.00 H new ATOM 0 HG21 ILE A 27 8.777 -27.272 19.605 1.00 0.00 H new ATOM 0 HG22 ILE A 27 9.039 -27.120 17.851 1.00 0.00 H new ATOM 0 HG23 ILE A 27 10.401 -26.905 18.977 1.00 0.00 H new ATOM 0 HD11 ILE A 27 8.931 -25.049 22.353 1.00 0.00 H new ATOM 0 HD12 ILE A 27 7.573 -25.245 21.220 1.00 0.00 H new ATOM 0 HD13 ILE A 27 8.831 -26.499 21.328 1.00 0.00 H new ATOM 438 N LEU A 28 9.837 -22.222 18.623 1.00 0.00 N ATOM 439 CA LEU A 28 9.466 -20.816 18.648 1.00 0.00 C ATOM 440 C LEU A 28 9.940 -20.121 17.381 1.00 0.00 C ATOM 441 O LEU A 28 9.276 -19.226 16.867 1.00 0.00 O ATOM 442 CB LEU A 28 10.083 -20.141 19.882 1.00 0.00 C ATOM 443 CG LEU A 28 9.231 -20.450 21.133 1.00 0.00 C ATOM 444 CD1 LEU A 28 10.109 -20.389 22.384 1.00 0.00 C ATOM 445 CD2 LEU A 28 8.104 -19.412 21.259 1.00 0.00 C ATOM 0 H LEU A 28 10.511 -22.493 19.339 1.00 0.00 H new ATOM 0 HA LEU A 28 8.380 -20.737 18.701 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.103 -20.496 20.029 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.140 -19.064 19.727 1.00 0.00 H new ATOM 0 HG LEU A 28 8.803 -21.448 21.035 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.504 -20.608 23.264 1.00 0.00 H new ATOM 0 HD12 LEU A 28 10.910 -21.124 22.303 1.00 0.00 H new ATOM 0 HD13 LEU A 28 10.540 -19.392 22.478 1.00 0.00 H new ATOM 0 HD21 LEU A 28 7.504 -19.632 22.142 1.00 0.00 H new ATOM 0 HD22 LEU A 28 8.536 -18.416 21.352 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.472 -19.452 20.372 1.00 0.00 H new ATOM 457 N ALA A 29 11.101 -20.529 16.892 1.00 0.00 N ATOM 458 CA ALA A 29 11.657 -19.929 15.688 1.00 0.00 C ATOM 459 C ALA A 29 10.687 -20.080 14.520 1.00 0.00 C ATOM 460 O ALA A 29 10.639 -19.236 13.626 1.00 0.00 O ATOM 461 CB ALA A 29 12.988 -20.596 15.342 1.00 0.00 C ATOM 0 H ALA A 29 11.672 -21.266 17.305 1.00 0.00 H new ATOM 0 HA ALA A 29 11.822 -18.867 15.873 1.00 0.00 H new ATOM 0 HB1 ALA A 29 13.399 -20.142 14.440 1.00 0.00 H new ATOM 0 HB2 ALA A 29 13.688 -20.461 16.167 1.00 0.00 H new ATOM 0 HB3 ALA A 29 12.828 -21.661 15.172 1.00 0.00 H new ATOM 467 N LYS A 30 9.915 -21.160 14.535 1.00 0.00 N ATOM 468 CA LYS A 30 8.947 -21.408 13.473 1.00 0.00 C ATOM 469 C LYS A 30 7.884 -20.321 13.455 1.00 0.00 C ATOM 470 O LYS A 30 7.444 -19.891 12.394 1.00 0.00 O ATOM 471 CB LYS A 30 8.279 -22.769 13.680 1.00 0.00 C ATOM 472 CG LYS A 30 9.329 -23.880 13.600 1.00 0.00 C ATOM 473 CD LYS A 30 9.780 -24.091 12.146 1.00 0.00 C ATOM 474 CE LYS A 30 10.473 -25.447 12.011 1.00 0.00 C ATOM 475 NZ LYS A 30 9.444 -26.517 11.906 1.00 0.00 N ATOM 0 H LYS A 30 9.939 -21.873 15.264 1.00 0.00 H new ATOM 0 HA LYS A 30 9.475 -21.403 12.520 1.00 0.00 H new ATOM 0 HB2 LYS A 30 7.781 -22.796 14.649 1.00 0.00 H new ATOM 0 HB3 LYS A 30 7.511 -22.926 12.922 1.00 0.00 H new ATOM 0 HG2 LYS A 30 10.188 -23.622 14.220 1.00 0.00 H new ATOM 0 HG3 LYS A 30 8.917 -24.807 13.997 1.00 0.00 H new ATOM 0 HD2 LYS A 30 8.920 -24.044 11.478 1.00 0.00 H new ATOM 0 HD3 LYS A 30 10.460 -23.293 11.847 1.00 0.00 H new ATOM 0 HE2 LYS A 30 11.114 -25.455 11.129 1.00 0.00 H new ATOM 0 HE3 LYS A 30 11.115 -25.628 12.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 9.798 -27.385 12.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 8.573 -26.209 12.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 9.240 -26.705 10.904 1.00 0.00 H new ATOM 489 N LEU A 31 7.476 -19.884 14.635 1.00 0.00 N ATOM 490 CA LEU A 31 6.451 -18.853 14.737 1.00 0.00 C ATOM 491 C LEU A 31 6.919 -17.582 14.044 1.00 0.00 C ATOM 492 O LEU A 31 6.147 -16.934 13.340 1.00 0.00 O ATOM 493 CB LEU A 31 6.161 -18.561 16.215 1.00 0.00 C ATOM 494 CG LEU A 31 5.230 -19.633 16.787 1.00 0.00 C ATOM 495 CD1 LEU A 31 5.798 -21.023 16.485 1.00 0.00 C ATOM 496 CD2 LEU A 31 5.112 -19.448 18.303 1.00 0.00 C ATOM 0 H LEU A 31 7.833 -20.222 15.529 1.00 0.00 H new ATOM 0 HA LEU A 31 5.541 -19.206 14.252 1.00 0.00 H new ATOM 0 HB2 LEU A 31 7.093 -18.538 16.780 1.00 0.00 H new ATOM 0 HB3 LEU A 31 5.703 -17.577 16.317 1.00 0.00 H new ATOM 0 HG LEU A 31 4.245 -19.539 16.330 1.00 0.00 H new ATOM 0 HD11 LEU A 31 5.133 -21.784 16.893 1.00 0.00 H new ATOM 0 HD12 LEU A 31 5.882 -21.155 15.406 1.00 0.00 H new ATOM 0 HD13 LEU A 31 6.784 -21.120 16.940 1.00 0.00 H new ATOM 0 HD21 LEU A 31 4.449 -20.211 18.712 1.00 0.00 H new ATOM 0 HD22 LEU A 31 6.098 -19.541 18.759 1.00 0.00 H new ATOM 0 HD23 LEU A 31 4.705 -18.460 18.518 1.00 0.00 H new ATOM 508 N GLN A 32 8.184 -17.235 14.240 1.00 0.00 N ATOM 509 CA GLN A 32 8.738 -16.040 13.620 1.00 0.00 C ATOM 510 C GLN A 32 8.642 -16.138 12.100 1.00 0.00 C ATOM 511 O GLN A 32 8.235 -15.189 11.432 1.00 0.00 O ATOM 512 CB GLN A 32 10.201 -15.872 14.033 1.00 0.00 C ATOM 513 CG GLN A 32 10.276 -15.498 15.514 1.00 0.00 C ATOM 514 CD GLN A 32 11.732 -15.395 15.954 1.00 0.00 C ATOM 515 OE1 GLN A 32 12.540 -14.749 15.287 1.00 0.00 O ATOM 516 NE2 GLN A 32 12.119 -16.000 17.044 1.00 0.00 N ATOM 0 H GLN A 32 8.841 -17.759 14.818 1.00 0.00 H new ATOM 0 HA GLN A 32 8.165 -15.175 13.955 1.00 0.00 H new ATOM 0 HB2 GLN A 32 10.749 -16.797 13.853 1.00 0.00 H new ATOM 0 HB3 GLN A 32 10.674 -15.099 13.428 1.00 0.00 H new ATOM 0 HG2 GLN A 32 9.768 -14.548 15.684 1.00 0.00 H new ATOM 0 HG3 GLN A 32 9.759 -16.247 16.113 1.00 0.00 H new ATOM 0 HE21 GLN A 32 11.448 -16.535 17.596 1.00 0.00 H new ATOM 0 HE22 GLN A 32 13.092 -15.938 17.344 1.00 0.00 H new ATOM 525 N ARG A 33 9.014 -17.294 11.561 1.00 0.00 N ATOM 526 CA ARG A 33 8.955 -17.503 10.118 1.00 0.00 C ATOM 527 C ARG A 33 7.505 -17.595 9.654 1.00 0.00 C ATOM 528 O ARG A 33 7.130 -17.028 8.628 1.00 0.00 O ATOM 529 CB ARG A 33 9.697 -18.784 9.739 1.00 0.00 C ATOM 530 CG ARG A 33 9.705 -18.939 8.215 1.00 0.00 C ATOM 531 CD ARG A 33 10.501 -20.186 7.831 1.00 0.00 C ATOM 532 NE ARG A 33 11.915 -19.996 8.137 1.00 0.00 N ATOM 533 CZ ARG A 33 12.778 -21.002 8.042 1.00 0.00 C ATOM 534 NH1 ARG A 33 12.361 -22.186 7.685 1.00 0.00 N ATOM 535 NH2 ARG A 33 14.040 -20.807 8.307 1.00 0.00 N ATOM 0 H ARG A 33 9.356 -18.093 12.094 1.00 0.00 H new ATOM 0 HA ARG A 33 9.432 -16.654 9.628 1.00 0.00 H new ATOM 0 HB2 ARG A 33 10.719 -18.750 10.117 1.00 0.00 H new ATOM 0 HB3 ARG A 33 9.215 -19.646 10.200 1.00 0.00 H new ATOM 0 HG2 ARG A 33 8.684 -19.018 7.842 1.00 0.00 H new ATOM 0 HG3 ARG A 33 10.146 -18.057 7.752 1.00 0.00 H new ATOM 0 HD2 ARG A 33 10.118 -21.052 8.371 1.00 0.00 H new ATOM 0 HD3 ARG A 33 10.376 -20.393 6.768 1.00 0.00 H new ATOM 0 HE ARG A 33 12.246 -19.076 8.428 1.00 0.00 H new ATOM 0 HH11 ARG A 33 11.374 -22.338 7.479 1.00 0.00 H new ATOM 0 HH12 ARG A 33 13.022 -22.959 7.612 1.00 0.00 H new ATOM 0 HH21 ARG A 33 14.365 -19.882 8.587 1.00 0.00 H new ATOM 0 HH22 ARG A 33 14.702 -21.580 8.234 1.00 0.00 H new ATOM 549 N ILE A 34 6.696 -18.321 10.418 1.00 0.00 N ATOM 550 CA ILE A 34 5.288 -18.489 10.084 1.00 0.00 C ATOM 551 C ILE A 34 4.541 -17.170 10.242 1.00 0.00 C ATOM 552 O ILE A 34 3.491 -16.961 9.634 1.00 0.00 O ATOM 553 CB ILE A 34 4.658 -19.553 10.987 1.00 0.00 C ATOM 554 CG1 ILE A 34 5.260 -20.925 10.661 1.00 0.00 C ATOM 555 CG2 ILE A 34 3.144 -19.595 10.754 1.00 0.00 C ATOM 556 CD1 ILE A 34 4.851 -21.926 11.738 1.00 0.00 C ATOM 0 H ILE A 34 6.990 -18.800 11.269 1.00 0.00 H new ATOM 0 HA ILE A 34 5.215 -18.811 9.045 1.00 0.00 H new ATOM 0 HB ILE A 34 4.859 -19.305 12.029 1.00 0.00 H new ATOM 0 HG12 ILE A 34 4.914 -21.263 9.684 1.00 0.00 H new ATOM 0 HG13 ILE A 34 6.346 -20.855 10.608 1.00 0.00 H new ATOM 0 HG21 ILE A 34 2.698 -20.353 11.398 1.00 0.00 H new ATOM 0 HG22 ILE A 34 2.713 -18.621 10.987 1.00 0.00 H new ATOM 0 HG23 ILE A 34 2.943 -19.841 9.711 1.00 0.00 H new ATOM 0 HD11 ILE A 34 5.278 -22.902 11.508 1.00 0.00 H new ATOM 0 HD12 ILE A 34 5.218 -21.588 12.707 1.00 0.00 H new ATOM 0 HD13 ILE A 34 3.764 -22.003 11.769 1.00 0.00 H new ATOM 568 N HIS A 35 5.085 -16.284 11.068 1.00 0.00 N ATOM 569 CA HIS A 35 4.455 -14.992 11.306 1.00 0.00 C ATOM 570 C HIS A 35 4.316 -14.220 9.998 1.00 0.00 C ATOM 571 O HIS A 35 3.243 -13.708 9.679 1.00 0.00 O ATOM 572 CB HIS A 35 5.298 -14.179 12.291 1.00 0.00 C ATOM 573 CG HIS A 35 4.620 -12.870 12.577 1.00 0.00 C ATOM 574 ND1 HIS A 35 3.529 -12.777 13.426 1.00 0.00 N ATOM 575 CD2 HIS A 35 4.865 -11.595 12.137 1.00 0.00 C ATOM 576 CE1 HIS A 35 3.162 -11.485 13.473 1.00 0.00 C ATOM 577 NE2 HIS A 35 3.943 -10.721 12.704 1.00 0.00 N ATOM 0 H HIS A 35 5.954 -16.435 11.580 1.00 0.00 H new ATOM 0 HA HIS A 35 3.463 -15.160 11.726 1.00 0.00 H new ATOM 0 HB2 HIS A 35 5.434 -14.739 13.216 1.00 0.00 H new ATOM 0 HB3 HIS A 35 6.290 -14.003 11.876 1.00 0.00 H new ATOM 0 HD2 HIS A 35 5.653 -11.312 11.455 1.00 0.00 H new ATOM 0 HE1 HIS A 35 2.337 -11.110 14.060 1.00 0.00 H new ATOM 0 HE2 HIS A 35 3.877 -9.713 12.563 1.00 0.00 H new ATOM 585 N ASN A 36 5.406 -14.148 9.240 1.00 0.00 N ATOM 586 CA ASN A 36 5.392 -13.444 7.964 1.00 0.00 C ATOM 587 C ASN A 36 4.562 -14.209 6.937 1.00 0.00 C ATOM 588 O ASN A 36 3.826 -13.614 6.153 1.00 0.00 O ATOM 589 CB ASN A 36 6.820 -13.270 7.446 1.00 0.00 C ATOM 590 CG ASN A 36 7.518 -14.623 7.377 1.00 0.00 C ATOM 591 OD1 ASN A 36 7.093 -15.506 6.634 1.00 0.00 O ATOM 592 ND2 ASN A 36 8.571 -14.841 8.117 1.00 0.00 N ATOM 0 H ASN A 36 6.304 -14.566 9.486 1.00 0.00 H new ATOM 0 HA ASN A 36 4.942 -12.463 8.117 1.00 0.00 H new ATOM 0 HB2 ASN A 36 6.804 -12.809 6.458 1.00 0.00 H new ATOM 0 HB3 ASN A 36 7.374 -12.599 8.102 1.00 0.00 H new ATOM 0 HD21 ASN A 36 9.043 -15.745 8.079 1.00 0.00 H new ATOM 0 HD22 ASN A 36 8.922 -14.108 8.733 1.00 0.00 H new ATOM 599 N SER A 37 4.691 -15.534 6.951 1.00 0.00 N ATOM 600 CA SER A 37 3.954 -16.384 6.021 1.00 0.00 C ATOM 601 C SER A 37 2.660 -16.875 6.660 1.00 0.00 C ATOM 602 O SER A 37 2.071 -17.856 6.215 1.00 0.00 O ATOM 603 CB SER A 37 4.811 -17.577 5.610 1.00 0.00 C ATOM 604 OG SER A 37 5.918 -17.116 4.845 1.00 0.00 O ATOM 0 H SER A 37 5.298 -16.041 7.595 1.00 0.00 H new ATOM 0 HA SER A 37 3.709 -15.797 5.136 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.161 -18.110 6.494 1.00 0.00 H new ATOM 0 HB3 SER A 37 4.219 -18.282 5.026 1.00 0.00 H new ATOM 0 HG SER A 37 6.583 -16.713 5.442 1.00 0.00 H new ATOM 610 N ASN A 38 2.232 -16.197 7.718 1.00 0.00 N ATOM 611 CA ASN A 38 1.013 -16.590 8.414 1.00 0.00 C ATOM 612 C ASN A 38 -0.103 -16.876 7.413 1.00 0.00 C ATOM 613 O ASN A 38 -0.491 -16.006 6.633 1.00 0.00 O ATOM 614 CB ASN A 38 0.569 -15.470 9.358 1.00 0.00 C ATOM 615 CG ASN A 38 0.186 -14.228 8.555 1.00 0.00 C ATOM 616 OD1 ASN A 38 0.663 -14.041 7.436 1.00 0.00 O ATOM 617 ND2 ASN A 38 -0.654 -13.368 9.062 1.00 0.00 N ATOM 0 H ASN A 38 2.704 -15.382 8.109 1.00 0.00 H new ATOM 0 HA ASN A 38 1.218 -17.494 8.988 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -0.280 -15.802 9.955 1.00 0.00 H new ATOM 0 HB3 ASN A 38 1.373 -15.229 10.053 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -0.917 -12.538 8.531 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -1.048 -13.526 9.990 1.00 0.00 H new ATOM 624 N ILE A 39 -0.614 -18.102 7.446 1.00 0.00 N ATOM 625 CA ILE A 39 -1.686 -18.500 6.544 1.00 0.00 C ATOM 626 C ILE A 39 -1.238 -18.374 5.095 1.00 0.00 C ATOM 627 O ILE A 39 -1.849 -17.651 4.308 1.00 0.00 O ATOM 628 CB ILE A 39 -2.917 -17.624 6.772 1.00 0.00 C ATOM 629 CG1 ILE A 39 -3.190 -17.516 8.266 1.00 0.00 C ATOM 630 CG2 ILE A 39 -4.127 -18.254 6.079 1.00 0.00 C ATOM 631 CD1 ILE A 39 -4.412 -16.628 8.501 1.00 0.00 C ATOM 0 H ILE A 39 -0.304 -18.834 8.085 1.00 0.00 H new ATOM 0 HA ILE A 39 -1.938 -19.540 6.750 1.00 0.00 H new ATOM 0 HB ILE A 39 -2.738 -16.631 6.360 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.361 -18.507 8.687 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.321 -17.099 8.775 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -5.005 -17.629 6.241 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -3.932 -18.335 5.010 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -4.306 -19.247 6.492 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -4.606 -16.552 9.571 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -4.223 -15.634 8.095 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -5.279 -17.064 8.005 1.00 0.00 H new ATOM 643 N LEU A 40 -0.165 -19.082 4.745 1.00 0.00 N ATOM 644 CA LEU A 40 0.358 -19.045 3.379 1.00 0.00 C ATOM 645 C LEU A 40 0.273 -20.424 2.742 1.00 0.00 C ATOM 646 O LEU A 40 0.768 -21.396 3.297 1.00 0.00 O ATOM 647 CB LEU A 40 1.814 -18.568 3.384 1.00 0.00 C ATOM 648 CG LEU A 40 2.299 -18.361 1.943 1.00 0.00 C ATOM 649 CD1 LEU A 40 1.489 -17.239 1.262 1.00 0.00 C ATOM 650 CD2 LEU A 40 3.784 -17.992 1.959 1.00 0.00 C ATOM 0 H LEU A 40 0.356 -19.684 5.382 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.245 -18.348 2.797 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.899 -17.636 3.943 1.00 0.00 H new ATOM 0 HB3 LEU A 40 2.444 -19.301 3.888 1.00 0.00 H new ATOM 0 HG LEU A 40 2.156 -19.284 1.381 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.844 -17.103 0.240 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.433 -17.510 1.247 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.617 -16.310 1.817 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.133 -17.844 0.937 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.924 -17.072 2.527 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.354 -18.796 2.424 1.00 0.00 H new ATOM 662 N ASP A 41 -0.358 -20.500 1.578 1.00 0.00 N ATOM 663 CA ASP A 41 -0.505 -21.774 0.884 1.00 0.00 C ATOM 664 C ASP A 41 0.821 -22.521 0.814 1.00 0.00 C ATOM 665 O ASP A 41 0.852 -23.751 0.849 1.00 0.00 O ATOM 666 CB ASP A 41 -1.039 -21.542 -0.530 1.00 0.00 C ATOM 667 CG ASP A 41 -0.095 -20.620 -1.294 1.00 0.00 C ATOM 668 OD1 ASP A 41 0.833 -20.117 -0.682 1.00 0.00 O ATOM 669 OD2 ASP A 41 -0.315 -20.429 -2.478 1.00 0.00 O ATOM 0 H ASP A 41 -0.773 -19.702 1.097 1.00 0.00 H new ATOM 0 HA ASP A 41 -1.213 -22.383 1.447 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -1.135 -22.494 -1.053 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -2.035 -21.101 -0.485 1.00 0.00 H new ATOM 674 N GLU A 42 1.906 -21.776 0.706 1.00 0.00 N ATOM 675 CA GLU A 42 3.230 -22.380 0.628 1.00 0.00 C ATOM 676 C GLU A 42 3.641 -22.989 1.967 1.00 0.00 C ATOM 677 O GLU A 42 3.945 -24.178 2.056 1.00 0.00 O ATOM 678 CB GLU A 42 4.250 -21.323 0.217 1.00 0.00 C ATOM 679 CG GLU A 42 4.044 -20.946 -1.252 1.00 0.00 C ATOM 680 CD GLU A 42 4.989 -19.814 -1.642 1.00 0.00 C ATOM 681 OE1 GLU A 42 5.773 -19.404 -0.801 1.00 0.00 O ATOM 682 OE2 GLU A 42 4.917 -19.375 -2.778 1.00 0.00 O ATOM 0 H GLU A 42 1.901 -20.757 0.670 1.00 0.00 H new ATOM 0 HA GLU A 42 3.197 -23.177 -0.115 1.00 0.00 H new ATOM 0 HB2 GLU A 42 4.145 -20.439 0.847 1.00 0.00 H new ATOM 0 HB3 GLU A 42 5.261 -21.703 0.366 1.00 0.00 H new ATOM 0 HG2 GLU A 42 4.223 -21.814 -1.886 1.00 0.00 H new ATOM 0 HG3 GLU A 42 3.011 -20.640 -1.415 1.00 0.00 H new ATOM 689 N ARG A 43 3.651 -22.162 3.003 1.00 0.00 N ATOM 690 CA ARG A 43 4.029 -22.608 4.342 1.00 0.00 C ATOM 691 C ARG A 43 2.890 -23.360 5.004 1.00 0.00 C ATOM 692 O ARG A 43 3.078 -24.007 6.026 1.00 0.00 O ATOM 693 CB ARG A 43 4.451 -21.418 5.204 1.00 0.00 C ATOM 694 CG ARG A 43 5.685 -20.748 4.578 1.00 0.00 C ATOM 695 CD ARG A 43 6.896 -21.693 4.634 1.00 0.00 C ATOM 696 NE ARG A 43 8.131 -20.924 4.593 1.00 0.00 N ATOM 697 CZ ARG A 43 9.269 -21.488 4.208 1.00 0.00 C ATOM 698 NH1 ARG A 43 9.289 -22.747 3.860 1.00 0.00 N ATOM 699 NH2 ARG A 43 10.365 -20.786 4.181 1.00 0.00 N ATOM 0 H ARG A 43 3.401 -21.175 2.944 1.00 0.00 H new ATOM 0 HA ARG A 43 4.876 -23.287 4.245 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.633 -20.701 5.280 1.00 0.00 H new ATOM 0 HB3 ARG A 43 4.678 -21.751 6.217 1.00 0.00 H new ATOM 0 HG2 ARG A 43 5.474 -20.478 3.543 1.00 0.00 H new ATOM 0 HG3 ARG A 43 5.913 -19.823 5.108 1.00 0.00 H new ATOM 0 HD2 ARG A 43 6.860 -22.290 5.545 1.00 0.00 H new ATOM 0 HD3 ARG A 43 6.863 -22.389 3.796 1.00 0.00 H new ATOM 0 HE ARG A 43 8.122 -19.940 4.863 1.00 0.00 H new ATOM 0 HH11 ARG A 43 8.430 -23.297 3.884 1.00 0.00 H new ATOM 0 HH12 ARG A 43 10.164 -23.180 3.564 1.00 0.00 H new ATOM 0 HH21 ARG A 43 10.348 -19.804 4.456 1.00 0.00 H new ATOM 0 HH22 ARG A 43 11.240 -21.218 3.885 1.00 0.00 H new ATOM 713 N GLN A 44 1.701 -23.253 4.434 1.00 0.00 N ATOM 714 CA GLN A 44 0.534 -23.925 4.996 1.00 0.00 C ATOM 715 C GLN A 44 0.896 -25.339 5.441 1.00 0.00 C ATOM 716 O GLN A 44 0.404 -25.823 6.460 1.00 0.00 O ATOM 717 CB GLN A 44 -0.598 -23.969 3.941 1.00 0.00 C ATOM 718 CG GLN A 44 -1.660 -22.911 4.255 1.00 0.00 C ATOM 719 CD GLN A 44 -2.415 -23.306 5.520 1.00 0.00 C ATOM 720 OE1 GLN A 44 -3.018 -24.378 5.573 1.00 0.00 O ATOM 721 NE2 GLN A 44 -2.404 -22.507 6.551 1.00 0.00 N ATOM 0 H GLN A 44 1.516 -22.712 3.589 1.00 0.00 H new ATOM 0 HA GLN A 44 0.190 -23.369 5.868 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -0.185 -23.795 2.947 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -1.054 -24.959 3.928 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -1.189 -21.937 4.389 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -2.354 -22.818 3.419 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -1.903 -21.620 6.503 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -2.896 -22.770 7.405 1.00 0.00 H new ATOM 730 N GLY A 45 1.769 -25.986 4.678 1.00 0.00 N ATOM 731 CA GLY A 45 2.198 -27.335 5.007 1.00 0.00 C ATOM 732 C GLY A 45 2.990 -27.332 6.304 1.00 0.00 C ATOM 733 O GLY A 45 2.970 -28.300 7.062 1.00 0.00 O ATOM 0 H GLY A 45 2.190 -25.599 3.833 1.00 0.00 H new ATOM 0 HA2 GLY A 45 1.330 -27.987 5.104 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.810 -27.737 4.200 1.00 0.00 H new ATOM 737 N LEU A 46 3.695 -26.238 6.551 1.00 0.00 N ATOM 738 CA LEU A 46 4.497 -26.128 7.750 1.00 0.00 C ATOM 739 C LEU A 46 3.605 -26.257 8.987 1.00 0.00 C ATOM 740 O LEU A 46 3.956 -26.924 9.962 1.00 0.00 O ATOM 741 CB LEU A 46 5.228 -24.763 7.773 1.00 0.00 C ATOM 742 CG LEU A 46 6.547 -24.883 8.564 1.00 0.00 C ATOM 743 CD1 LEU A 46 6.259 -25.417 9.977 1.00 0.00 C ATOM 744 CD2 LEU A 46 7.520 -25.837 7.824 1.00 0.00 C ATOM 0 H LEU A 46 3.725 -25.422 5.940 1.00 0.00 H new ATOM 0 HA LEU A 46 5.236 -26.929 7.756 1.00 0.00 H new ATOM 0 HB2 LEU A 46 5.434 -24.435 6.754 1.00 0.00 H new ATOM 0 HB3 LEU A 46 4.589 -24.007 8.229 1.00 0.00 H new ATOM 0 HG LEU A 46 7.009 -23.899 8.643 1.00 0.00 H new ATOM 0 HD11 LEU A 46 7.193 -25.500 10.532 1.00 0.00 H new ATOM 0 HD12 LEU A 46 5.589 -24.731 10.495 1.00 0.00 H new ATOM 0 HD13 LEU A 46 5.790 -26.399 9.906 1.00 0.00 H new ATOM 0 HD21 LEU A 46 8.450 -25.918 8.388 1.00 0.00 H new ATOM 0 HD22 LEU A 46 7.064 -26.823 7.733 1.00 0.00 H new ATOM 0 HD23 LEU A 46 7.731 -25.442 6.830 1.00 0.00 H new ATOM 756 N MET A 47 2.455 -25.618 8.942 1.00 0.00 N ATOM 757 CA MET A 47 1.535 -25.664 10.066 1.00 0.00 C ATOM 758 C MET A 47 1.078 -27.099 10.316 1.00 0.00 C ATOM 759 O MET A 47 0.955 -27.527 11.464 1.00 0.00 O ATOM 760 CB MET A 47 0.319 -24.783 9.773 1.00 0.00 C ATOM 761 CG MET A 47 0.691 -23.312 9.959 1.00 0.00 C ATOM 762 SD MET A 47 2.024 -22.880 8.808 1.00 0.00 S ATOM 763 CE MET A 47 1.329 -21.319 8.214 1.00 0.00 C ATOM 0 H MET A 47 2.134 -25.064 8.148 1.00 0.00 H new ATOM 0 HA MET A 47 2.047 -25.295 10.955 1.00 0.00 H new ATOM 0 HB2 MET A 47 -0.029 -24.954 8.754 1.00 0.00 H new ATOM 0 HB3 MET A 47 -0.502 -25.047 10.439 1.00 0.00 H new ATOM 0 HG2 MET A 47 -0.179 -22.680 9.780 1.00 0.00 H new ATOM 0 HG3 MET A 47 1.009 -23.133 10.986 1.00 0.00 H new ATOM 0 HE1 MET A 47 2.110 -20.734 7.728 1.00 0.00 H new ATOM 0 HE2 MET A 47 0.532 -21.524 7.499 1.00 0.00 H new ATOM 0 HE3 MET A 47 0.926 -20.757 9.056 1.00 0.00 H new ATOM 773 N HIS A 48 0.822 -27.832 9.239 1.00 0.00 N ATOM 774 CA HIS A 48 0.367 -29.211 9.362 1.00 0.00 C ATOM 775 C HIS A 48 1.415 -30.062 10.072 1.00 0.00 C ATOM 776 O HIS A 48 1.108 -30.755 11.041 1.00 0.00 O ATOM 777 CB HIS A 48 0.100 -29.796 7.976 1.00 0.00 C ATOM 778 CG HIS A 48 -1.027 -29.045 7.321 1.00 0.00 C ATOM 779 ND1 HIS A 48 -0.810 -27.905 6.564 1.00 0.00 N ATOM 780 CD2 HIS A 48 -2.383 -29.257 7.301 1.00 0.00 C ATOM 781 CE1 HIS A 48 -2.006 -27.476 6.124 1.00 0.00 C ATOM 782 NE2 HIS A 48 -3.000 -28.264 6.544 1.00 0.00 N ATOM 0 H HIS A 48 0.920 -27.499 8.280 1.00 0.00 H new ATOM 0 HA HIS A 48 -0.552 -29.217 9.948 1.00 0.00 H new ATOM 0 HB2 HIS A 48 0.999 -29.731 7.363 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -0.153 -30.853 8.059 1.00 0.00 H new ATOM 0 HD1 HIS A 48 0.093 -27.470 6.375 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -2.893 -30.070 7.797 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -2.146 -26.601 5.506 1.00 0.00 H new ATOM 790 N GLU A 49 2.651 -30.003 9.587 1.00 0.00 N ATOM 791 CA GLU A 49 3.734 -30.776 10.185 1.00 0.00 C ATOM 792 C GLU A 49 4.087 -30.228 11.559 1.00 0.00 C ATOM 793 O GLU A 49 4.381 -30.983 12.488 1.00 0.00 O ATOM 794 CB GLU A 49 4.968 -30.734 9.282 1.00 0.00 C ATOM 795 CG GLU A 49 4.670 -31.475 7.977 1.00 0.00 C ATOM 796 CD GLU A 49 4.489 -32.966 8.246 1.00 0.00 C ATOM 797 OE1 GLU A 49 4.964 -33.424 9.272 1.00 0.00 O ATOM 798 OE2 GLU A 49 3.878 -33.626 7.422 1.00 0.00 O ATOM 0 H GLU A 49 2.927 -29.433 8.788 1.00 0.00 H new ATOM 0 HA GLU A 49 3.401 -31.808 10.294 1.00 0.00 H new ATOM 0 HB2 GLU A 49 5.243 -29.700 9.071 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.818 -31.193 9.788 1.00 0.00 H new ATOM 0 HG2 GLU A 49 3.769 -31.069 7.518 1.00 0.00 H new ATOM 0 HG3 GLU A 49 5.485 -31.322 7.269 1.00 0.00 H new ATOM 805 N LEU A 50 4.062 -28.909 11.679 1.00 0.00 N ATOM 806 CA LEU A 50 4.388 -28.264 12.940 1.00 0.00 C ATOM 807 C LEU A 50 3.403 -28.687 14.022 1.00 0.00 C ATOM 808 O LEU A 50 3.772 -28.864 15.182 1.00 0.00 O ATOM 809 CB LEU A 50 4.355 -26.743 12.781 1.00 0.00 C ATOM 810 CG LEU A 50 4.741 -26.060 14.099 1.00 0.00 C ATOM 811 CD1 LEU A 50 6.162 -26.481 14.518 1.00 0.00 C ATOM 812 CD2 LEU A 50 4.686 -24.541 13.921 1.00 0.00 C ATOM 0 H LEU A 50 3.821 -28.268 10.923 1.00 0.00 H new ATOM 0 HA LEU A 50 5.392 -28.571 13.234 1.00 0.00 H new ATOM 0 HB2 LEU A 50 5.042 -26.438 11.991 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.358 -26.424 12.477 1.00 0.00 H new ATOM 0 HG LEU A 50 4.039 -26.363 14.876 1.00 0.00 H new ATOM 0 HD11 LEU A 50 6.426 -25.990 15.455 1.00 0.00 H new ATOM 0 HD12 LEU A 50 6.196 -27.562 14.653 1.00 0.00 H new ATOM 0 HD13 LEU A 50 6.871 -26.189 13.743 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.960 -24.055 14.857 1.00 0.00 H new ATOM 0 HD22 LEU A 50 5.383 -24.241 13.139 1.00 0.00 H new ATOM 0 HD23 LEU A 50 3.676 -24.244 13.640 1.00 0.00 H new ATOM 824 N MET A 51 2.139 -28.825 13.636 1.00 0.00 N ATOM 825 CA MET A 51 1.101 -29.205 14.583 1.00 0.00 C ATOM 826 C MET A 51 1.506 -30.472 15.332 1.00 0.00 C ATOM 827 O MET A 51 1.417 -30.532 16.556 1.00 0.00 O ATOM 828 CB MET A 51 -0.214 -29.451 13.837 1.00 0.00 C ATOM 829 CG MET A 51 -1.328 -29.772 14.836 1.00 0.00 C ATOM 830 SD MET A 51 -2.845 -30.185 13.941 1.00 0.00 S ATOM 831 CE MET A 51 -3.386 -28.494 13.601 1.00 0.00 C ATOM 0 H MET A 51 1.812 -28.680 12.681 1.00 0.00 H new ATOM 0 HA MET A 51 0.968 -28.396 15.301 1.00 0.00 H new ATOM 0 HB2 MET A 51 -0.481 -28.571 13.252 1.00 0.00 H new ATOM 0 HB3 MET A 51 -0.095 -30.276 13.135 1.00 0.00 H new ATOM 0 HG2 MET A 51 -1.031 -30.606 15.472 1.00 0.00 H new ATOM 0 HG3 MET A 51 -1.501 -28.918 15.490 1.00 0.00 H new ATOM 0 HE1 MET A 51 -4.395 -28.511 13.190 1.00 0.00 H new ATOM 0 HE2 MET A 51 -3.381 -27.917 14.526 1.00 0.00 H new ATOM 0 HE3 MET A 51 -2.709 -28.033 12.882 1.00 0.00 H new ATOM 841 N GLU A 52 1.948 -31.478 14.590 1.00 0.00 N ATOM 842 CA GLU A 52 2.361 -32.735 15.202 1.00 0.00 C ATOM 843 C GLU A 52 3.595 -32.528 16.069 1.00 0.00 C ATOM 844 O GLU A 52 3.684 -33.059 17.173 1.00 0.00 O ATOM 845 CB GLU A 52 2.664 -33.772 14.112 1.00 0.00 C ATOM 846 CG GLU A 52 1.356 -34.300 13.509 1.00 0.00 C ATOM 847 CD GLU A 52 0.738 -33.245 12.602 1.00 0.00 C ATOM 848 OE1 GLU A 52 1.268 -33.042 11.523 1.00 0.00 O ATOM 849 OE2 GLU A 52 -0.255 -32.657 12.997 1.00 0.00 O ATOM 0 H GLU A 52 2.030 -31.451 13.574 1.00 0.00 H new ATOM 0 HA GLU A 52 1.548 -33.097 15.831 1.00 0.00 H new ATOM 0 HB2 GLU A 52 3.278 -33.322 13.332 1.00 0.00 H new ATOM 0 HB3 GLU A 52 3.238 -34.597 14.533 1.00 0.00 H new ATOM 0 HG2 GLU A 52 1.549 -35.211 12.942 1.00 0.00 H new ATOM 0 HG3 GLU A 52 0.658 -34.561 14.305 1.00 0.00 H new ATOM 856 N LEU A 53 4.543 -31.756 15.558 1.00 0.00 N ATOM 857 CA LEU A 53 5.772 -31.487 16.291 1.00 0.00 C ATOM 858 C LEU A 53 5.469 -30.731 17.575 1.00 0.00 C ATOM 859 O LEU A 53 6.089 -30.975 18.611 1.00 0.00 O ATOM 860 CB LEU A 53 6.728 -30.670 15.423 1.00 0.00 C ATOM 861 CG LEU A 53 7.175 -31.518 14.222 1.00 0.00 C ATOM 862 CD1 LEU A 53 7.963 -30.640 13.244 1.00 0.00 C ATOM 863 CD2 LEU A 53 8.055 -32.698 14.692 1.00 0.00 C ATOM 0 H LEU A 53 4.486 -31.307 14.644 1.00 0.00 H new ATOM 0 HA LEU A 53 6.241 -32.438 16.546 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.236 -29.760 15.078 1.00 0.00 H new ATOM 0 HB3 LEU A 53 7.595 -30.362 16.008 1.00 0.00 H new ATOM 0 HG LEU A 53 6.293 -31.920 13.724 1.00 0.00 H new ATOM 0 HD11 LEU A 53 8.281 -31.240 12.391 1.00 0.00 H new ATOM 0 HD12 LEU A 53 7.330 -29.823 12.897 1.00 0.00 H new ATOM 0 HD13 LEU A 53 8.839 -30.231 13.747 1.00 0.00 H new ATOM 0 HD21 LEU A 53 8.363 -33.288 13.829 1.00 0.00 H new ATOM 0 HD22 LEU A 53 8.938 -32.313 15.202 1.00 0.00 H new ATOM 0 HD23 LEU A 53 7.486 -33.326 15.377 1.00 0.00 H new ATOM 875 N ILE A 54 4.527 -29.802 17.498 1.00 0.00 N ATOM 876 CA ILE A 54 4.170 -29.013 18.664 1.00 0.00 C ATOM 877 C ILE A 54 3.618 -29.903 19.772 1.00 0.00 C ATOM 878 O ILE A 54 4.004 -29.768 20.933 1.00 0.00 O ATOM 879 CB ILE A 54 3.118 -27.959 18.280 1.00 0.00 C ATOM 880 CG1 ILE A 54 3.808 -26.775 17.574 1.00 0.00 C ATOM 881 CG2 ILE A 54 2.386 -27.452 19.537 1.00 0.00 C ATOM 882 CD1 ILE A 54 4.352 -25.775 18.605 1.00 0.00 C ATOM 0 H ILE A 54 4.003 -29.579 16.652 1.00 0.00 H new ATOM 0 HA ILE A 54 5.069 -28.517 19.030 1.00 0.00 H new ATOM 0 HB ILE A 54 2.391 -28.415 17.607 1.00 0.00 H new ATOM 0 HG12 ILE A 54 4.623 -27.141 16.949 1.00 0.00 H new ATOM 0 HG13 ILE A 54 3.100 -26.275 16.913 1.00 0.00 H new ATOM 0 HG21 ILE A 54 1.644 -26.706 19.250 1.00 0.00 H new ATOM 0 HG22 ILE A 54 1.889 -28.287 20.030 1.00 0.00 H new ATOM 0 HG23 ILE A 54 3.106 -27.003 20.221 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.836 -24.946 18.088 1.00 0.00 H new ATOM 0 HD12 ILE A 54 3.530 -25.394 19.211 1.00 0.00 H new ATOM 0 HD13 ILE A 54 5.077 -26.274 19.248 1.00 0.00 H new ATOM 894 N ASP A 55 2.708 -30.793 19.409 1.00 0.00 N ATOM 895 CA ASP A 55 2.096 -31.680 20.382 1.00 0.00 C ATOM 896 C ASP A 55 3.132 -32.619 20.967 1.00 0.00 C ATOM 897 O ASP A 55 3.133 -32.883 22.165 1.00 0.00 O ATOM 898 CB ASP A 55 0.979 -32.488 19.721 1.00 0.00 C ATOM 899 CG ASP A 55 0.337 -33.426 20.738 1.00 0.00 C ATOM 900 OD1 ASP A 55 0.829 -33.483 21.854 1.00 0.00 O ATOM 901 OD2 ASP A 55 -0.632 -34.074 20.386 1.00 0.00 O ATOM 0 H ASP A 55 2.379 -30.919 18.452 1.00 0.00 H new ATOM 0 HA ASP A 55 1.676 -31.077 21.187 1.00 0.00 H new ATOM 0 HB2 ASP A 55 0.227 -31.815 19.311 1.00 0.00 H new ATOM 0 HB3 ASP A 55 1.381 -33.064 18.887 1.00 0.00 H new ATOM 906 N LEU A 56 4.005 -33.131 20.116 1.00 0.00 N ATOM 907 CA LEU A 56 5.034 -34.056 20.564 1.00 0.00 C ATOM 908 C LEU A 56 5.973 -33.390 21.559 1.00 0.00 C ATOM 909 O LEU A 56 6.375 -34.003 22.550 1.00 0.00 O ATOM 910 CB LEU A 56 5.834 -34.565 19.364 1.00 0.00 C ATOM 911 CG LEU A 56 4.955 -35.496 18.512 1.00 0.00 C ATOM 912 CD1 LEU A 56 5.609 -35.698 17.140 1.00 0.00 C ATOM 913 CD2 LEU A 56 4.786 -36.861 19.207 1.00 0.00 C ATOM 0 H LEU A 56 4.023 -32.924 19.117 1.00 0.00 H new ATOM 0 HA LEU A 56 4.545 -34.894 21.060 1.00 0.00 H new ATOM 0 HB2 LEU A 56 6.180 -33.724 18.762 1.00 0.00 H new ATOM 0 HB3 LEU A 56 6.721 -35.099 19.706 1.00 0.00 H new ATOM 0 HG LEU A 56 3.972 -35.040 18.390 1.00 0.00 H new ATOM 0 HD11 LEU A 56 4.988 -36.358 16.534 1.00 0.00 H new ATOM 0 HD12 LEU A 56 5.710 -34.735 16.640 1.00 0.00 H new ATOM 0 HD13 LEU A 56 6.595 -36.145 17.269 1.00 0.00 H new ATOM 0 HD21 LEU A 56 4.161 -37.508 18.591 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.764 -37.323 19.343 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.313 -36.718 20.179 1.00 0.00 H new ATOM 925 N TYR A 57 6.336 -32.148 21.276 1.00 0.00 N ATOM 926 CA TYR A 57 7.247 -31.415 22.146 1.00 0.00 C ATOM 927 C TYR A 57 6.521 -30.889 23.378 1.00 0.00 C ATOM 928 O TYR A 57 6.908 -31.179 24.510 1.00 0.00 O ATOM 929 CB TYR A 57 7.862 -30.246 21.380 1.00 0.00 C ATOM 930 CG TYR A 57 8.990 -29.652 22.189 1.00 0.00 C ATOM 931 CD1 TYR A 57 10.265 -30.227 22.133 1.00 0.00 C ATOM 932 CD2 TYR A 57 8.761 -28.531 22.995 1.00 0.00 C ATOM 933 CE1 TYR A 57 11.312 -29.679 22.883 1.00 0.00 C ATOM 934 CE2 TYR A 57 9.808 -27.983 23.744 1.00 0.00 C ATOM 935 CZ TYR A 57 11.084 -28.557 23.688 1.00 0.00 C ATOM 936 OH TYR A 57 12.117 -28.017 24.426 1.00 0.00 O ATOM 0 H TYR A 57 6.018 -31.629 20.458 1.00 0.00 H new ATOM 0 HA TYR A 57 8.032 -32.098 22.472 1.00 0.00 H new ATOM 0 HB2 TYR A 57 8.233 -30.586 20.413 1.00 0.00 H new ATOM 0 HB3 TYR A 57 7.104 -29.488 21.182 1.00 0.00 H new ATOM 0 HD1 TYR A 57 10.441 -31.093 21.512 1.00 0.00 H new ATOM 0 HD2 TYR A 57 7.776 -28.089 23.039 1.00 0.00 H new ATOM 0 HE1 TYR A 57 12.296 -30.122 22.841 1.00 0.00 H new ATOM 0 HE2 TYR A 57 9.632 -27.117 24.365 1.00 0.00 H new ATOM 0 HH TYR A 57 12.966 -28.174 23.963 1.00 0.00 H new ATOM 946 N GLU A 58 5.468 -30.116 23.145 1.00 0.00 N ATOM 947 CA GLU A 58 4.688 -29.546 24.235 1.00 0.00 C ATOM 948 C GLU A 58 4.192 -30.631 25.165 1.00 0.00 C ATOM 949 O GLU A 58 3.819 -30.349 26.289 1.00 0.00 O ATOM 950 CB GLU A 58 3.504 -28.743 23.701 1.00 0.00 C ATOM 951 CG GLU A 58 4.008 -27.450 23.057 1.00 0.00 C ATOM 952 CD GLU A 58 4.583 -26.518 24.119 1.00 0.00 C ATOM 953 OE1 GLU A 58 4.399 -26.804 25.291 1.00 0.00 O ATOM 954 OE2 GLU A 58 5.185 -25.526 23.745 1.00 0.00 O ATOM 0 H GLU A 58 5.135 -29.870 22.213 1.00 0.00 H new ATOM 0 HA GLU A 58 5.342 -28.875 24.792 1.00 0.00 H new ATOM 0 HB2 GLU A 58 2.951 -29.334 22.970 1.00 0.00 H new ATOM 0 HB3 GLU A 58 2.813 -28.512 24.512 1.00 0.00 H new ATOM 0 HG2 GLU A 58 4.771 -27.680 22.313 1.00 0.00 H new ATOM 0 HG3 GLU A 58 3.191 -26.955 22.533 1.00 0.00 H new ATOM 961 N GLU A 59 4.159 -31.859 24.684 1.00 0.00 N ATOM 962 CA GLU A 59 3.700 -32.994 25.494 1.00 0.00 C ATOM 963 C GLU A 59 4.845 -33.579 26.315 1.00 0.00 C ATOM 964 O GLU A 59 4.625 -34.381 27.220 1.00 0.00 O ATOM 965 CB GLU A 59 3.104 -34.071 24.591 1.00 0.00 C ATOM 966 CG GLU A 59 2.726 -35.295 25.422 1.00 0.00 C ATOM 967 CD GLU A 59 1.884 -36.251 24.593 1.00 0.00 C ATOM 968 OE1 GLU A 59 1.821 -36.062 23.391 1.00 0.00 O ATOM 969 OE2 GLU A 59 1.322 -37.163 25.174 1.00 0.00 O ATOM 0 H GLU A 59 4.443 -32.106 23.736 1.00 0.00 H new ATOM 0 HA GLU A 59 2.935 -32.635 26.182 1.00 0.00 H new ATOM 0 HB2 GLU A 59 2.224 -33.682 24.079 1.00 0.00 H new ATOM 0 HB3 GLU A 59 3.823 -34.351 23.821 1.00 0.00 H new ATOM 0 HG2 GLU A 59 3.627 -35.800 25.770 1.00 0.00 H new ATOM 0 HG3 GLU A 59 2.172 -34.985 26.308 1.00 0.00 H new ATOM 976 N SER A 60 6.070 -33.199 25.974 1.00 0.00 N ATOM 977 CA SER A 60 7.250 -33.718 26.670 1.00 0.00 C ATOM 978 C SER A 60 7.651 -32.841 27.850 1.00 0.00 C ATOM 979 O SER A 60 8.078 -33.342 28.896 1.00 0.00 O ATOM 980 CB SER A 60 8.411 -33.810 25.692 1.00 0.00 C ATOM 981 OG SER A 60 8.142 -34.833 24.740 1.00 0.00 O ATOM 0 H SER A 60 6.276 -32.538 25.225 1.00 0.00 H new ATOM 0 HA SER A 60 6.999 -34.704 27.060 1.00 0.00 H new ATOM 0 HB2 SER A 60 8.553 -32.855 25.187 1.00 0.00 H new ATOM 0 HB3 SER A 60 9.336 -34.028 26.226 1.00 0.00 H new ATOM 0 HG SER A 60 7.547 -34.484 24.044 1.00 0.00 H new ATOM 987 N GLN A 61 7.558 -31.535 27.662 1.00 0.00 N ATOM 988 CA GLN A 61 7.955 -30.578 28.699 1.00 0.00 C ATOM 989 C GLN A 61 7.070 -30.681 29.929 1.00 0.00 C ATOM 990 O GLN A 61 7.569 -30.651 31.062 1.00 0.00 O ATOM 991 CB GLN A 61 7.905 -29.134 28.153 1.00 0.00 C ATOM 992 CG GLN A 61 8.102 -29.147 26.633 1.00 0.00 C ATOM 993 CD GLN A 61 9.315 -30.001 26.275 1.00 0.00 C ATOM 994 OE1 GLN A 61 10.239 -30.132 27.077 1.00 0.00 O ATOM 995 NE2 GLN A 61 9.365 -30.603 25.119 1.00 0.00 N ATOM 0 H GLN A 61 7.212 -31.107 26.803 1.00 0.00 H new ATOM 0 HA GLN A 61 8.976 -30.825 28.988 1.00 0.00 H new ATOM 0 HB2 GLN A 61 6.948 -28.675 28.401 1.00 0.00 H new ATOM 0 HB3 GLN A 61 8.680 -28.530 28.624 1.00 0.00 H new ATOM 0 HG2 GLN A 61 7.211 -29.542 26.145 1.00 0.00 H new ATOM 0 HG3 GLN A 61 8.241 -28.130 26.267 1.00 0.00 H new ATOM 0 HE21 GLN A 61 8.599 -30.495 24.454 1.00 0.00 H new ATOM 0 HE22 GLN A 61 10.170 -31.182 24.880 1.00 0.00 H new ATOM 1004 N PRO A 62 5.782 -30.804 29.752 1.00 0.00 N ATOM 1005 CA PRO A 62 4.827 -30.902 30.868 1.00 0.00 C ATOM 1006 C PRO A 62 4.423 -32.334 31.170 1.00 0.00 C ATOM 1007 O PRO A 62 3.491 -32.879 30.585 1.00 0.00 O ATOM 1008 CB PRO A 62 3.615 -30.133 30.313 1.00 0.00 C ATOM 1009 CG PRO A 62 3.726 -30.202 28.807 1.00 0.00 C ATOM 1010 CD PRO A 62 5.084 -30.823 28.477 1.00 0.00 C ATOM 0 HA PRO A 62 5.238 -30.519 31.802 1.00 0.00 H new ATOM 0 HB2 PRO A 62 2.681 -30.579 30.655 1.00 0.00 H new ATOM 0 HB3 PRO A 62 3.619 -29.099 30.657 1.00 0.00 H new ATOM 0 HG2 PRO A 62 2.918 -30.802 28.390 1.00 0.00 H new ATOM 0 HG3 PRO A 62 3.642 -29.207 28.370 1.00 0.00 H new ATOM 0 HD2 PRO A 62 4.979 -31.837 28.091 1.00 0.00 H new ATOM 0 HD3 PRO A 62 5.616 -30.247 27.719 1.00 0.00 H new ATOM 1018 N SER A 63 5.151 -32.929 32.114 1.00 0.00 N ATOM 1019 CA SER A 63 4.885 -34.294 32.545 1.00 0.00 C ATOM 1020 C SER A 63 3.833 -34.307 33.651 1.00 0.00 C ATOM 1021 O SER A 63 3.402 -35.368 34.095 1.00 0.00 O ATOM 1022 CB SER A 63 6.169 -34.945 33.052 1.00 0.00 C ATOM 1023 OG SER A 63 6.571 -34.320 34.265 1.00 0.00 O ATOM 0 H SER A 63 5.932 -32.482 32.594 1.00 0.00 H new ATOM 0 HA SER A 63 4.509 -34.858 31.691 1.00 0.00 H new ATOM 0 HB2 SER A 63 6.009 -36.011 33.215 1.00 0.00 H new ATOM 0 HB3 SER A 63 6.956 -34.852 32.304 1.00 0.00 H new ATOM 0 HG SER A 63 7.394 -34.739 34.592 1.00 0.00 H new ATOM 1029 N SER A 64 3.440 -33.119 34.103 1.00 0.00 N ATOM 1030 CA SER A 64 2.451 -33.003 35.168 1.00 0.00 C ATOM 1031 C SER A 64 1.042 -33.167 34.622 1.00 0.00 C ATOM 1032 O SER A 64 0.086 -32.633 35.186 1.00 0.00 O ATOM 1033 CB SER A 64 2.577 -31.644 35.859 1.00 0.00 C ATOM 1034 OG SER A 64 1.804 -30.688 35.148 1.00 0.00 O ATOM 0 H SER A 64 3.790 -32.228 33.750 1.00 0.00 H new ATOM 0 HA SER A 64 2.639 -33.797 35.891 1.00 0.00 H new ATOM 0 HB2 SER A 64 2.233 -31.713 36.891 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.621 -31.334 35.891 1.00 0.00 H new ATOM 0 HG SER A 64 1.374 -30.077 35.783 1.00 0.00 H new ATOM 1040 N GLU A 65 0.919 -33.899 33.517 1.00 0.00 N ATOM 1041 CA GLU A 65 -0.383 -34.133 32.899 1.00 0.00 C ATOM 1042 C GLU A 65 -1.048 -32.811 32.519 1.00 0.00 C ATOM 1043 O GLU A 65 -2.155 -32.790 31.982 1.00 0.00 O ATOM 1044 CB GLU A 65 -1.285 -34.904 33.867 1.00 0.00 C ATOM 1045 CG GLU A 65 -0.733 -36.316 34.066 1.00 0.00 C ATOM 1046 CD GLU A 65 -1.569 -37.056 35.104 1.00 0.00 C ATOM 1047 OE1 GLU A 65 -2.476 -36.448 35.649 1.00 0.00 O ATOM 1048 OE2 GLU A 65 -1.291 -38.220 35.337 1.00 0.00 O ATOM 0 H GLU A 65 1.702 -34.339 33.033 1.00 0.00 H new ATOM 0 HA GLU A 65 -0.234 -34.720 31.993 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -1.337 -34.385 34.824 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -2.301 -34.951 33.474 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -0.747 -36.858 33.121 1.00 0.00 H new ATOM 0 HG3 GLU A 65 0.307 -36.268 34.390 1.00 0.00 H new ATOM 1055 N ARG A 66 -0.355 -31.712 32.793 1.00 0.00 N ATOM 1056 CA ARG A 66 -0.866 -30.385 32.479 1.00 0.00 C ATOM 1057 C ARG A 66 -0.818 -30.134 30.980 1.00 0.00 C ATOM 1058 O ARG A 66 -1.378 -29.153 30.492 1.00 0.00 O ATOM 1059 CB ARG A 66 -0.058 -29.316 33.216 1.00 0.00 C ATOM 1060 CG ARG A 66 1.375 -29.295 32.683 1.00 0.00 C ATOM 1061 CD ARG A 66 2.191 -28.255 33.445 1.00 0.00 C ATOM 1062 NE ARG A 66 3.575 -28.274 32.983 1.00 0.00 N ATOM 1063 CZ ARG A 66 4.426 -27.316 33.329 1.00 0.00 C ATOM 1064 NH1 ARG A 66 4.021 -26.321 34.069 1.00 0.00 N ATOM 1065 NH2 ARG A 66 5.665 -27.367 32.925 1.00 0.00 N ATOM 0 H ARG A 66 0.565 -31.715 33.233 1.00 0.00 H new ATOM 0 HA ARG A 66 -1.904 -30.331 32.807 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -0.521 -28.339 33.081 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -0.055 -29.522 34.286 1.00 0.00 H new ATOM 0 HG2 ARG A 66 1.829 -30.280 32.793 1.00 0.00 H new ATOM 0 HG3 ARG A 66 1.374 -29.062 31.618 1.00 0.00 H new ATOM 0 HD2 ARG A 66 1.762 -27.264 33.297 1.00 0.00 H new ATOM 0 HD3 ARG A 66 2.153 -28.462 34.514 1.00 0.00 H new ATOM 0 HE ARG A 66 3.894 -29.036 32.384 1.00 0.00 H new ATOM 0 HH11 ARG A 66 3.051 -26.280 34.381 1.00 0.00 H new ATOM 0 HH12 ARG A 66 4.674 -25.584 34.335 1.00 0.00 H new ATOM 0 HH21 ARG A 66 5.980 -28.143 32.343 1.00 0.00 H new ATOM 0 HH22 ARG A 66 6.319 -26.631 33.191 1.00 0.00 H new ATOM 1079 N LEU A 67 -0.121 -31.008 30.254 1.00 0.00 N ATOM 1080 CA LEU A 67 0.003 -30.854 28.808 1.00 0.00 C ATOM 1081 C LEU A 67 -1.327 -30.434 28.204 1.00 0.00 C ATOM 1082 O LEU A 67 -1.363 -29.897 27.105 1.00 0.00 O ATOM 1083 CB LEU A 67 0.453 -32.172 28.176 1.00 0.00 C ATOM 1084 CG LEU A 67 -0.594 -33.282 28.477 1.00 0.00 C ATOM 1085 CD1 LEU A 67 -1.419 -33.575 27.221 1.00 0.00 C ATOM 1086 CD2 LEU A 67 0.126 -34.559 28.926 1.00 0.00 C ATOM 0 H LEU A 67 0.361 -31.820 30.639 1.00 0.00 H new ATOM 0 HA LEU A 67 0.746 -30.083 28.607 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.568 -32.049 27.099 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.427 -32.461 28.570 1.00 0.00 H new ATOM 0 HG LEU A 67 -1.259 -32.940 29.270 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -2.150 -34.353 27.439 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.937 -32.669 26.906 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.758 -33.912 26.422 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.609 -35.336 29.137 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.795 -34.897 28.135 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.705 -34.353 29.827 1.00 0.00 H new ATOM 1098 N ASN A 68 -2.411 -30.668 28.936 1.00 0.00 N ATOM 1099 CA ASN A 68 -3.739 -30.296 28.462 1.00 0.00 C ATOM 1100 C ASN A 68 -3.722 -28.872 27.912 1.00 0.00 C ATOM 1101 O ASN A 68 -4.549 -28.510 27.075 1.00 0.00 O ATOM 1102 CB ASN A 68 -4.747 -30.389 29.609 1.00 0.00 C ATOM 1103 CG ASN A 68 -6.125 -29.942 29.129 1.00 0.00 C ATOM 1104 OD1 ASN A 68 -6.375 -28.745 28.990 1.00 0.00 O ATOM 1105 ND2 ASN A 68 -7.035 -30.839 28.866 1.00 0.00 N ATOM 0 H ASN A 68 -2.397 -31.111 29.855 1.00 0.00 H new ATOM 0 HA ASN A 68 -4.031 -30.982 27.667 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -4.796 -31.413 29.979 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -4.422 -29.765 30.441 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -7.958 -30.549 28.544 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -6.823 -31.830 28.983 1.00 0.00 H new ATOM 1112 N ALA A 69 -2.773 -28.072 28.388 1.00 0.00 N ATOM 1113 CA ALA A 69 -2.647 -26.693 27.933 1.00 0.00 C ATOM 1114 C ALA A 69 -2.247 -26.653 26.467 1.00 0.00 C ATOM 1115 O ALA A 69 -2.649 -25.758 25.726 1.00 0.00 O ATOM 1116 CB ALA A 69 -1.606 -25.950 28.769 1.00 0.00 C ATOM 0 H ALA A 69 -2.084 -28.353 29.085 1.00 0.00 H new ATOM 0 HA ALA A 69 -3.614 -26.204 28.051 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -1.523 -24.922 28.417 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -1.911 -25.952 29.815 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -0.640 -26.446 28.672 1.00 0.00 H new ATOM 1122 N PHE A 70 -1.446 -27.630 26.052 1.00 0.00 N ATOM 1123 CA PHE A 70 -0.990 -27.699 24.669 1.00 0.00 C ATOM 1124 C PHE A 70 -2.148 -27.404 23.712 1.00 0.00 C ATOM 1125 O PHE A 70 -1.939 -27.081 22.539 1.00 0.00 O ATOM 1126 CB PHE A 70 -0.412 -29.099 24.383 1.00 0.00 C ATOM 1127 CG PHE A 70 -1.517 -30.022 23.900 1.00 0.00 C ATOM 1128 CD1 PHE A 70 -2.730 -30.090 24.599 1.00 0.00 C ATOM 1129 CD2 PHE A 70 -1.337 -30.789 22.743 1.00 0.00 C ATOM 1130 CE1 PHE A 70 -3.752 -30.926 24.152 1.00 0.00 C ATOM 1131 CE2 PHE A 70 -2.363 -31.625 22.294 1.00 0.00 C ATOM 1132 CZ PHE A 70 -3.571 -31.695 22.998 1.00 0.00 C ATOM 0 H PHE A 70 -1.101 -28.381 26.650 1.00 0.00 H new ATOM 0 HA PHE A 70 -0.213 -26.951 24.514 1.00 0.00 H new ATOM 0 HB2 PHE A 70 0.373 -29.032 23.630 1.00 0.00 H new ATOM 0 HB3 PHE A 70 0.045 -29.505 25.285 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -2.873 -29.493 25.487 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -0.406 -30.735 22.198 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -4.683 -30.980 24.697 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -2.224 -32.218 21.402 1.00 0.00 H new ATOM 0 HZ PHE A 70 -4.362 -32.342 22.650 1.00 0.00 H new ATOM 1142 N ARG A 71 -3.366 -27.532 24.224 1.00 0.00 N ATOM 1143 CA ARG A 71 -4.551 -27.292 23.420 1.00 0.00 C ATOM 1144 C ARG A 71 -4.557 -25.853 22.929 1.00 0.00 C ATOM 1145 O ARG A 71 -4.928 -25.578 21.788 1.00 0.00 O ATOM 1146 CB ARG A 71 -5.813 -27.567 24.237 1.00 0.00 C ATOM 1147 CG ARG A 71 -7.046 -27.403 23.344 1.00 0.00 C ATOM 1148 CD ARG A 71 -8.308 -27.666 24.163 1.00 0.00 C ATOM 1149 NE ARG A 71 -9.476 -27.683 23.289 1.00 0.00 N ATOM 1150 CZ ARG A 71 -10.097 -26.560 22.945 1.00 0.00 C ATOM 1151 NH1 ARG A 71 -9.674 -25.414 23.402 1.00 0.00 N ATOM 1152 NH2 ARG A 71 -11.133 -26.603 22.151 1.00 0.00 N ATOM 0 H ARG A 71 -3.556 -27.800 25.190 1.00 0.00 H new ATOM 0 HA ARG A 71 -4.536 -27.965 22.563 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -5.780 -28.576 24.648 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.869 -26.880 25.082 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -7.074 -26.397 22.926 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -6.994 -28.096 22.504 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -8.220 -28.619 24.685 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -8.425 -26.895 24.924 1.00 0.00 H new ATOM 0 HE ARG A 71 -9.823 -28.575 22.935 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -8.866 -25.380 24.024 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -10.151 -24.552 23.138 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -11.466 -27.499 21.795 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -11.609 -25.741 21.887 1.00 0.00 H new ATOM 1166 N GLU A 72 -4.153 -24.938 23.803 1.00 0.00 N ATOM 1167 CA GLU A 72 -4.121 -23.531 23.447 1.00 0.00 C ATOM 1168 C GLU A 72 -3.237 -23.317 22.227 1.00 0.00 C ATOM 1169 O GLU A 72 -3.663 -22.728 21.235 1.00 0.00 O ATOM 1170 CB GLU A 72 -3.583 -22.703 24.616 1.00 0.00 C ATOM 1171 CG GLU A 72 -4.576 -22.749 25.777 1.00 0.00 C ATOM 1172 CD GLU A 72 -5.850 -21.997 25.404 1.00 0.00 C ATOM 1173 OE1 GLU A 72 -5.784 -21.166 24.515 1.00 0.00 O ATOM 1174 OE2 GLU A 72 -6.871 -22.263 26.017 1.00 0.00 O ATOM 0 H GLU A 72 -3.846 -25.146 24.753 1.00 0.00 H new ATOM 0 HA GLU A 72 -5.137 -23.210 23.216 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -2.616 -23.092 24.936 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -3.424 -21.672 24.301 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -4.814 -23.784 26.022 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.129 -22.305 26.666 1.00 0.00 H new ATOM 1181 N LEU A 73 -2.005 -23.796 22.309 1.00 0.00 N ATOM 1182 CA LEU A 73 -1.070 -23.643 21.205 1.00 0.00 C ATOM 1183 C LEU A 73 -1.592 -24.375 19.971 1.00 0.00 C ATOM 1184 O LEU A 73 -1.546 -23.859 18.857 1.00 0.00 O ATOM 1185 CB LEU A 73 0.307 -24.208 21.609 1.00 0.00 C ATOM 1186 CG LEU A 73 1.423 -23.428 20.903 1.00 0.00 C ATOM 1187 CD1 LEU A 73 2.778 -24.028 21.267 1.00 0.00 C ATOM 1188 CD2 LEU A 73 1.214 -23.478 19.383 1.00 0.00 C ATOM 0 H LEU A 73 -1.632 -24.289 23.120 1.00 0.00 H new ATOM 0 HA LEU A 73 -0.968 -22.584 20.968 1.00 0.00 H new ATOM 0 HB2 LEU A 73 0.433 -24.142 22.690 1.00 0.00 H new ATOM 0 HB3 LEU A 73 0.367 -25.264 21.345 1.00 0.00 H new ATOM 0 HG LEU A 73 1.396 -22.388 21.227 1.00 0.00 H new ATOM 0 HD11 LEU A 73 3.569 -23.472 20.764 1.00 0.00 H new ATOM 0 HD12 LEU A 73 2.923 -23.970 22.346 1.00 0.00 H new ATOM 0 HD13 LEU A 73 2.811 -25.071 20.952 1.00 0.00 H new ATOM 0 HD21 LEU A 73 2.010 -22.922 18.888 1.00 0.00 H new ATOM 0 HD22 LEU A 73 1.232 -24.515 19.047 1.00 0.00 H new ATOM 0 HD23 LEU A 73 0.251 -23.033 19.133 1.00 0.00 H new ATOM 1200 N ARG A 74 -2.094 -25.581 20.181 1.00 0.00 N ATOM 1201 CA ARG A 74 -2.621 -26.379 19.085 1.00 0.00 C ATOM 1202 C ARG A 74 -3.828 -25.698 18.473 1.00 0.00 C ATOM 1203 O ARG A 74 -4.037 -25.755 17.260 1.00 0.00 O ATOM 1204 CB ARG A 74 -3.006 -27.770 19.592 1.00 0.00 C ATOM 1205 CG ARG A 74 -1.735 -28.583 19.917 1.00 0.00 C ATOM 1206 CD ARG A 74 -1.224 -29.299 18.658 1.00 0.00 C ATOM 1207 NE ARG A 74 -1.982 -30.536 18.453 1.00 0.00 N ATOM 1208 CZ ARG A 74 -2.984 -30.613 17.577 1.00 0.00 C ATOM 1209 NH1 ARG A 74 -3.323 -29.572 16.869 1.00 0.00 N ATOM 1210 NH2 ARG A 74 -3.635 -31.737 17.427 1.00 0.00 N ATOM 0 H ARG A 74 -2.148 -26.028 21.096 1.00 0.00 H new ATOM 0 HA ARG A 74 -1.851 -26.479 18.320 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -3.629 -27.682 20.482 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -3.598 -28.290 18.839 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -0.961 -27.921 20.307 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -1.952 -29.313 20.696 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -1.329 -28.648 17.790 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -0.163 -29.524 18.761 1.00 0.00 H new ATOM 0 HE ARG A 74 -1.736 -31.363 18.997 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -2.821 -28.692 16.984 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -4.091 -29.638 16.201 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -3.376 -32.554 17.980 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -4.402 -31.797 16.757 1.00 0.00 H new ATOM 1224 N THR A 75 -4.619 -25.054 19.320 1.00 0.00 N ATOM 1225 CA THR A 75 -5.805 -24.358 18.853 1.00 0.00 C ATOM 1226 C THR A 75 -5.416 -23.270 17.865 1.00 0.00 C ATOM 1227 O THR A 75 -6.052 -23.109 16.828 1.00 0.00 O ATOM 1228 CB THR A 75 -6.549 -23.742 20.024 1.00 0.00 C ATOM 1229 OG1 THR A 75 -6.998 -24.769 20.897 1.00 0.00 O ATOM 1230 CG2 THR A 75 -7.746 -22.945 19.511 1.00 0.00 C ATOM 0 H THR A 75 -4.461 -25.000 20.326 1.00 0.00 H new ATOM 0 HA THR A 75 -6.457 -25.077 18.357 1.00 0.00 H new ATOM 0 HB THR A 75 -5.879 -23.075 20.566 1.00 0.00 H new ATOM 0 HG1 THR A 75 -6.260 -25.387 21.082 1.00 0.00 H new ATOM 0 HG21 THR A 75 -8.278 -22.504 20.354 1.00 0.00 H new ATOM 0 HG22 THR A 75 -7.399 -22.153 18.847 1.00 0.00 H new ATOM 0 HG23 THR A 75 -8.417 -23.608 18.965 1.00 0.00 H new ATOM 1238 N GLN A 76 -4.364 -22.526 18.192 1.00 0.00 N ATOM 1239 CA GLN A 76 -3.901 -21.455 17.318 1.00 0.00 C ATOM 1240 C GLN A 76 -3.518 -22.013 15.952 1.00 0.00 C ATOM 1241 O GLN A 76 -4.018 -21.557 14.923 1.00 0.00 O ATOM 1242 CB GLN A 76 -2.687 -20.766 17.946 1.00 0.00 C ATOM 1243 CG GLN A 76 -3.099 -20.096 19.259 1.00 0.00 C ATOM 1244 CD GLN A 76 -4.061 -18.949 18.981 1.00 0.00 C ATOM 1245 OE1 GLN A 76 -3.767 -18.076 18.165 1.00 0.00 O ATOM 1246 NE2 GLN A 76 -5.202 -18.897 19.613 1.00 0.00 N ATOM 0 H GLN A 76 -3.821 -22.643 19.047 1.00 0.00 H new ATOM 0 HA GLN A 76 -4.708 -20.733 17.192 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -1.897 -21.495 18.130 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -2.282 -20.023 17.259 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -3.571 -20.826 19.916 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -2.216 -19.723 19.779 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -5.444 -19.621 20.289 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -5.852 -18.132 19.431 1.00 0.00 H new ATOM 1255 N LEU A 77 -2.642 -23.008 15.950 1.00 0.00 N ATOM 1256 CA LEU A 77 -2.210 -23.630 14.702 1.00 0.00 C ATOM 1257 C LEU A 77 -3.392 -24.306 14.024 1.00 0.00 C ATOM 1258 O LEU A 77 -3.551 -24.235 12.806 1.00 0.00 O ATOM 1259 CB LEU A 77 -1.108 -24.661 14.988 1.00 0.00 C ATOM 1260 CG LEU A 77 0.245 -23.953 15.118 1.00 0.00 C ATOM 1261 CD1 LEU A 77 0.129 -22.799 16.118 1.00 0.00 C ATOM 1262 CD2 LEU A 77 1.291 -24.950 15.613 1.00 0.00 C ATOM 0 H LEU A 77 -2.218 -23.401 16.790 1.00 0.00 H new ATOM 0 HA LEU A 77 -1.814 -22.861 14.038 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.334 -25.204 15.906 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -1.068 -25.396 14.185 1.00 0.00 H new ATOM 0 HG LEU A 77 0.543 -23.560 14.146 1.00 0.00 H new ATOM 0 HD11 LEU A 77 1.093 -22.298 16.208 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.619 -22.088 15.768 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.169 -23.189 17.091 1.00 0.00 H new ATOM 0 HD21 LEU A 77 2.255 -24.450 15.707 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.989 -25.341 16.585 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.376 -25.771 14.901 1.00 0.00 H new ATOM 1274 N GLU A 78 -4.218 -24.967 14.824 1.00 0.00 N ATOM 1275 CA GLU A 78 -5.386 -25.654 14.292 1.00 0.00 C ATOM 1276 C GLU A 78 -6.385 -24.649 13.734 1.00 0.00 C ATOM 1277 O GLU A 78 -7.030 -24.900 12.718 1.00 0.00 O ATOM 1278 CB GLU A 78 -6.047 -26.485 15.397 1.00 0.00 C ATOM 1279 CG GLU A 78 -7.210 -27.290 14.809 1.00 0.00 C ATOM 1280 CD GLU A 78 -7.855 -28.144 15.894 1.00 0.00 C ATOM 1281 OE1 GLU A 78 -7.592 -27.889 17.057 1.00 0.00 O ATOM 1282 OE2 GLU A 78 -8.602 -29.044 15.545 1.00 0.00 O ATOM 0 H GLU A 78 -4.102 -25.042 15.835 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.067 -26.314 13.486 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -5.316 -27.158 15.846 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -6.409 -25.831 16.191 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -7.950 -26.615 14.379 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -6.850 -27.926 14.000 1.00 0.00 H new ATOM 1289 N LYS A 79 -6.501 -23.505 14.400 1.00 0.00 N ATOM 1290 CA LYS A 79 -7.417 -22.467 13.960 1.00 0.00 C ATOM 1291 C LYS A 79 -7.013 -21.973 12.585 1.00 0.00 C ATOM 1292 O LYS A 79 -7.847 -21.837 11.690 1.00 0.00 O ATOM 1293 CB LYS A 79 -7.404 -21.307 14.954 1.00 0.00 C ATOM 1294 CG LYS A 79 -8.436 -20.262 14.532 1.00 0.00 C ATOM 1295 CD LYS A 79 -8.501 -19.138 15.585 1.00 0.00 C ATOM 1296 CE LYS A 79 -9.518 -19.503 16.670 1.00 0.00 C ATOM 1297 NZ LYS A 79 -10.871 -19.617 16.056 1.00 0.00 N ATOM 0 H LYS A 79 -5.973 -23.277 15.242 1.00 0.00 H new ATOM 0 HA LYS A 79 -8.425 -22.879 13.908 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -7.628 -21.671 15.957 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -6.411 -20.858 14.993 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -8.170 -19.847 13.560 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -9.415 -20.728 14.423 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -7.518 -18.987 16.031 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -8.783 -18.198 15.110 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -9.240 -20.445 17.144 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -9.523 -18.743 17.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -11.544 -19.029 16.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -10.833 -19.292 15.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -11.182 -20.609 16.082 1.00 0.00 H new ATOM 1311 N ALA A 80 -5.721 -21.713 12.422 1.00 0.00 N ATOM 1312 CA ALA A 80 -5.210 -21.245 11.146 1.00 0.00 C ATOM 1313 C ALA A 80 -5.343 -22.340 10.098 1.00 0.00 C ATOM 1314 O ALA A 80 -5.503 -22.066 8.907 1.00 0.00 O ATOM 1315 CB ALA A 80 -3.744 -20.822 11.274 1.00 0.00 C ATOM 0 H ALA A 80 -5.016 -21.818 13.152 1.00 0.00 H new ATOM 0 HA ALA A 80 -5.796 -20.379 10.837 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.380 -20.475 10.307 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -3.660 -20.017 12.004 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.147 -21.673 11.602 1.00 0.00 H new ATOM 1321 N LEU A 81 -5.253 -23.584 10.549 1.00 0.00 N ATOM 1322 CA LEU A 81 -5.346 -24.708 9.638 1.00 0.00 C ATOM 1323 C LEU A 81 -6.712 -24.719 8.958 1.00 0.00 C ATOM 1324 O LEU A 81 -6.819 -24.920 7.748 1.00 0.00 O ATOM 1325 CB LEU A 81 -5.135 -26.027 10.413 1.00 0.00 C ATOM 1326 CG LEU A 81 -4.484 -27.076 9.494 1.00 0.00 C ATOM 1327 CD1 LEU A 81 -5.333 -27.251 8.220 1.00 0.00 C ATOM 1328 CD2 LEU A 81 -3.048 -26.618 9.119 1.00 0.00 C ATOM 0 H LEU A 81 -5.117 -23.835 11.528 1.00 0.00 H new ATOM 0 HA LEU A 81 -4.573 -24.612 8.876 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -4.503 -25.851 11.283 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -6.091 -26.398 10.783 1.00 0.00 H new ATOM 0 HG LEU A 81 -4.429 -28.032 10.016 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.868 -27.994 7.572 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.335 -27.583 8.493 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.397 -26.300 7.692 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.587 -27.361 8.468 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -3.095 -25.661 8.600 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -2.452 -26.510 10.025 1.00 0.00 H new ATOM 1340 N GLY A 82 -7.749 -24.502 9.746 1.00 0.00 N ATOM 1341 CA GLY A 82 -9.101 -24.490 9.215 1.00 0.00 C ATOM 1342 C GLY A 82 -9.363 -23.190 8.471 1.00 0.00 C ATOM 1343 O GLY A 82 -10.462 -22.957 7.968 1.00 0.00 O ATOM 0 H GLY A 82 -7.683 -24.333 10.750 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -9.243 -25.337 8.543 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -9.819 -24.604 10.027 1.00 0.00 H new ATOM 1347 N LEU A 83 -8.340 -22.344 8.406 1.00 0.00 N ATOM 1348 CA LEU A 83 -8.460 -21.061 7.723 1.00 0.00 C ATOM 1349 C LEU A 83 -9.629 -20.263 8.280 1.00 0.00 C ATOM 1350 O LEU A 83 -9.956 -19.192 7.771 1.00 0.00 O ATOM 1351 CB LEU A 83 -8.664 -21.293 6.225 1.00 0.00 C ATOM 1352 CG LEU A 83 -7.499 -22.126 5.674 1.00 0.00 C ATOM 1353 CD1 LEU A 83 -7.808 -22.548 4.235 1.00 0.00 C ATOM 1354 CD2 LEU A 83 -6.200 -21.299 5.696 1.00 0.00 C ATOM 0 H LEU A 83 -7.423 -22.522 8.816 1.00 0.00 H new ATOM 0 HA LEU A 83 -7.543 -20.494 7.885 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -9.608 -21.809 6.051 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -8.722 -20.338 5.703 1.00 0.00 H new ATOM 0 HG LEU A 83 -7.370 -23.011 6.297 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -6.980 -23.140 3.844 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -8.720 -23.145 4.219 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -7.944 -21.661 3.617 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -5.380 -21.900 5.303 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -6.325 -20.408 5.080 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -5.974 -21.003 6.720 1.00 0.00 H new ATOM 1366 N GLU A 84 -10.251 -20.786 9.331 1.00 0.00 N ATOM 1367 CA GLU A 84 -11.381 -20.107 9.949 1.00 0.00 C ATOM 1368 C GLU A 84 -10.889 -18.998 10.875 1.00 0.00 C ATOM 1369 O GLU A 84 -9.956 -19.196 11.653 1.00 0.00 O ATOM 1370 CB GLU A 84 -12.220 -21.106 10.746 1.00 0.00 C ATOM 1371 CG GLU A 84 -13.541 -20.451 11.158 1.00 0.00 C ATOM 1372 CD GLU A 84 -14.456 -20.319 9.946 1.00 0.00 C ATOM 1373 OE1 GLU A 84 -14.099 -20.837 8.900 1.00 0.00 O ATOM 1374 OE2 GLU A 84 -15.500 -19.702 10.080 1.00 0.00 O ATOM 0 H GLU A 84 -9.994 -21.671 9.769 1.00 0.00 H new ATOM 0 HA GLU A 84 -11.995 -19.668 9.163 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.414 -21.994 10.145 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -11.673 -21.433 11.630 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -14.028 -21.048 11.929 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -13.351 -19.468 11.589 1.00 0.00 H new ATOM 1381 N HIS A 85 -11.522 -17.834 10.785 1.00 0.00 N ATOM 1382 CA HIS A 85 -11.139 -16.705 11.622 1.00 0.00 C ATOM 1383 C HIS A 85 -12.257 -15.669 11.671 1.00 0.00 C ATOM 1384 O HIS A 85 -12.555 -15.116 12.728 1.00 0.00 O ATOM 1385 CB HIS A 85 -9.864 -16.060 11.076 1.00 0.00 C ATOM 1386 CG HIS A 85 -9.351 -15.046 12.061 1.00 0.00 C ATOM 1387 ND1 HIS A 85 -8.692 -15.415 13.224 1.00 0.00 N ATOM 1388 CD2 HIS A 85 -9.393 -13.673 12.072 1.00 0.00 C ATOM 1389 CE1 HIS A 85 -8.365 -14.287 13.879 1.00 0.00 C ATOM 1390 NE2 HIS A 85 -8.768 -13.197 13.222 1.00 0.00 N ATOM 0 H HIS A 85 -12.296 -17.649 10.147 1.00 0.00 H new ATOM 0 HA HIS A 85 -10.956 -17.071 12.632 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -9.107 -16.823 10.896 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -10.068 -15.581 10.118 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -9.842 -13.057 11.307 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -7.840 -14.265 14.822 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -8.645 -12.224 13.502 1.00 0.00 H new ATOM 1398 N HIS A 86 -12.874 -15.413 10.519 1.00 0.00 N ATOM 1399 CA HIS A 86 -13.965 -14.439 10.437 1.00 0.00 C ATOM 1400 C HIS A 86 -15.313 -15.150 10.483 1.00 0.00 C ATOM 1401 O HIS A 86 -15.391 -16.329 10.830 1.00 0.00 O ATOM 1402 CB HIS A 86 -13.845 -13.634 9.143 1.00 0.00 C ATOM 1403 CG HIS A 86 -12.533 -12.894 9.131 1.00 0.00 C ATOM 1404 ND1 HIS A 86 -12.316 -11.761 9.902 1.00 0.00 N ATOM 1405 CD2 HIS A 86 -11.361 -13.112 8.448 1.00 0.00 C ATOM 1406 CE1 HIS A 86 -11.059 -11.344 9.665 1.00 0.00 C ATOM 1407 NE2 HIS A 86 -10.432 -12.132 8.787 1.00 0.00 N ATOM 0 H HIS A 86 -12.640 -15.862 9.634 1.00 0.00 H new ATOM 0 HA HIS A 86 -13.897 -13.762 11.288 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -13.907 -14.299 8.282 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -14.673 -12.929 9.063 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -11.187 -13.921 7.754 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -10.611 -10.477 10.128 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -9.478 -12.036 8.440 1.00 0.00 H new ATOM 1415 N HIS A 87 -16.375 -14.428 10.138 1.00 0.00 N ATOM 1416 CA HIS A 87 -17.714 -15.007 10.154 1.00 0.00 C ATOM 1417 C HIS A 87 -17.769 -16.276 9.307 1.00 0.00 C ATOM 1418 O HIS A 87 -17.683 -17.384 9.834 1.00 0.00 O ATOM 1419 CB HIS A 87 -18.731 -13.997 9.619 1.00 0.00 C ATOM 1420 CG HIS A 87 -18.728 -12.769 10.487 1.00 0.00 C ATOM 1421 ND1 HIS A 87 -19.125 -12.801 11.815 1.00 0.00 N ATOM 1422 CD2 HIS A 87 -18.386 -11.464 10.231 1.00 0.00 C ATOM 1423 CE1 HIS A 87 -19.012 -11.553 12.304 1.00 0.00 C ATOM 1424 NE2 HIS A 87 -18.566 -10.699 11.379 1.00 0.00 N ATOM 0 H HIS A 87 -16.336 -13.451 9.847 1.00 0.00 H new ATOM 0 HA HIS A 87 -17.959 -15.261 11.185 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -18.486 -13.729 8.591 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -19.726 -14.441 9.604 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -18.031 -11.089 9.283 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -19.252 -11.276 13.320 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -18.394 -9.700 11.490 1.00 0.00 H new ATOM 1432 N HIS A 88 -17.910 -16.106 7.994 1.00 0.00 N ATOM 1433 CA HIS A 88 -17.973 -17.253 7.090 1.00 0.00 C ATOM 1434 C HIS A 88 -17.538 -16.863 5.680 1.00 0.00 C ATOM 1435 O HIS A 88 -18.137 -15.992 5.048 1.00 0.00 O ATOM 1436 CB HIS A 88 -19.395 -17.813 7.062 1.00 0.00 C ATOM 1437 CG HIS A 88 -19.752 -18.335 8.428 1.00 0.00 C ATOM 1438 ND1 HIS A 88 -19.134 -19.445 8.982 1.00 0.00 N ATOM 1439 CD2 HIS A 88 -20.663 -17.909 9.364 1.00 0.00 C ATOM 1440 CE1 HIS A 88 -19.673 -19.647 10.198 1.00 0.00 C ATOM 1441 NE2 HIS A 88 -20.611 -18.739 10.480 1.00 0.00 N ATOM 0 H HIS A 88 -17.982 -15.197 7.536 1.00 0.00 H new ATOM 0 HA HIS A 88 -17.289 -18.018 7.458 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -20.098 -17.036 6.762 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -19.469 -18.612 6.324 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -21.320 -17.059 9.251 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -19.383 -20.446 10.865 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -21.169 -18.669 11.331 1.00 0.00 H new ATOM 1449 N HIS A 89 -16.485 -17.518 5.201 1.00 0.00 N ATOM 1450 CA HIS A 89 -15.946 -17.248 3.872 1.00 0.00 C ATOM 1451 C HIS A 89 -16.912 -17.672 2.761 1.00 0.00 C ATOM 1452 O HIS A 89 -17.077 -16.954 1.775 1.00 0.00 O ATOM 1453 CB HIS A 89 -14.615 -17.985 3.702 1.00 0.00 C ATOM 1454 CG HIS A 89 -13.577 -17.363 4.598 1.00 0.00 C ATOM 1455 ND1 HIS A 89 -13.050 -16.102 4.359 1.00 0.00 N ATOM 1456 CD2 HIS A 89 -12.952 -17.818 5.734 1.00 0.00 C ATOM 1457 CE1 HIS A 89 -12.151 -15.846 5.328 1.00 0.00 C ATOM 1458 NE2 HIS A 89 -12.053 -16.860 6.192 1.00 0.00 N ATOM 0 H HIS A 89 -15.986 -18.243 5.716 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.797 -16.172 3.787 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -14.738 -19.040 3.948 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -14.290 -17.935 2.663 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -13.132 -18.775 6.201 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -11.579 -14.933 5.398 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -11.449 -16.919 7.012 1.00 0.00 H new ATOM 1466 N HIS A 90 -17.543 -18.837 2.907 1.00 0.00 N ATOM 1467 CA HIS A 90 -18.471 -19.308 1.882 1.00 0.00 C ATOM 1468 C HIS A 90 -19.653 -18.353 1.748 1.00 0.00 C ATOM 1469 O HIS A 90 -19.894 -17.606 2.680 1.00 0.00 O ATOM 1470 CB HIS A 90 -18.984 -20.710 2.220 1.00 0.00 C ATOM 1471 CG HIS A 90 -17.845 -21.690 2.162 1.00 0.00 C ATOM 1472 ND1 HIS A 90 -17.102 -22.027 3.282 1.00 0.00 N ATOM 1473 CD2 HIS A 90 -17.312 -22.420 1.127 1.00 0.00 C ATOM 1474 CE1 HIS A 90 -16.173 -22.921 2.900 1.00 0.00 C ATOM 1475 NE2 HIS A 90 -16.256 -23.196 1.596 1.00 0.00 N ATOM 1476 OXT HIS A 90 -20.298 -18.382 0.711 1.00 0.00 O ATOM 0 H HIS A 90 -17.432 -19.460 3.707 1.00 0.00 H new ATOM 0 HA HIS A 90 -17.932 -19.345 0.935 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -19.431 -20.715 3.214 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -19.765 -21.002 1.518 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -17.660 -22.395 0.105 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -15.448 -23.363 3.567 1.00 0.00 H new ATOM 0 HE2 HIS A 90 -15.671 -23.837 1.059 1.00 0.00 H new TER 1484 HIS A 90