USER MOD reduce.3.24.130724 H: found=0, std=0, add=1607, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1608 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 NoAdj-H: B 63 LYS HZ1 : B 63 LYS NZ : A 76 GLY C :(NH2R) USER MOD NoAdj-H: B 63 LYS HZ2 : B 63 LYS NZ : A 76 GLY C :(NH2R) USER MOD Set 1.1: B 68 HIS : no HD1:sc= 0.393 K(o=1.9,f=-0.61) USER MOD Set 1.2: C 92 SER OG : rot 75:sc= 1.51 USER MOD Set 2.1: B 55 THR OG1 : rot -66:sc= 1.25 USER MOD Set 2.2: B 57 SER OG : rot 180:sc= 0 USER MOD Set 3.1: B 7 THR OG1 : rot 144:sc= 1.35 USER MOD Set 3.2: B 9 THR OG1 : rot 180:sc= 1.05 USER MOD Set 4.1: B 6 LYS NZ :NH3+ 166:sc= 0.782 (180deg=0) USER MOD Set 4.2: B 12 THR OG1 : rot 141:sc= 0.708 USER MOD Set 5.1: A 55 THR OG1 : rot -60:sc= 1.23 USER MOD Set 5.2: A 57 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 6 LYS NZ :NH3+ 169:sc= 0.769 (180deg=0) USER MOD Set 6.2: A 12 THR OG1 : rot 150:sc= 0.683 USER MOD Set 7.1: A 7 THR OG1 : rot 128:sc= 1.43 USER MOD Set 7.2: A 9 THR OG1 : rot 180:sc= 0.962 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 175:sc= 1.15 (180deg=1.12) USER MOD Single : A 2 GLN : amide:sc= 0.74 K(o=0.74,f=-0.96) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot -81:sc= 0.239 USER MOD Single : A 20 SER OG : rot 180:sc= 0.00644 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.26 USER MOD Single : A 25 ASN : amide:sc= 1.12 K(o=1.1,f=-0.36) USER MOD Single : A 27 LYS NZ :NH3+ -163:sc= 0.38 (180deg=0.316) USER MOD Single : A 29 LYS NZ :NH3+ 172:sc= 1.13 (180deg=1.07) USER MOD Single : A 31 GLN : amide:sc= -0.329 X(o=-0.33,f=-0.77) USER MOD Single : A 33 LYS NZ :NH3+ 176:sc= 0.959 (180deg=0.946) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 41 GLN : amide:sc= 1.14 K(o=1.1,f=-3.7!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.557 K(o=0.56,f=-6.4!) USER MOD Single : A 59 TYR OH : rot 50:sc= 0.377 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= 0.849 K(o=0.85,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 72:sc= 1.31 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 176:sc= 1.16 (180deg=1.15) USER MOD Single : B 2 GLN : amide:sc= 0.565 K(o=0.56,f=-0.84) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 THR OG1 : rot -76:sc= 0.179 USER MOD Single : B 20 SER OG : rot 180:sc= 0.00686 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.277 USER MOD Single : B 25 ASN : amide:sc= 1.11 K(o=1.1,f=-0.41) USER MOD Single : B 27 LYS NZ :NH3+ -166:sc= 0.54 (180deg=0.469) USER MOD Single : B 29 LYS NZ :NH3+ 172:sc= 1.13 (180deg=1.06) USER MOD Single : B 31 GLN : amide:sc= -0.338 X(o=-0.34,f=-0.83) USER MOD Single : B 33 LYS NZ :NH3+ 177:sc= 0.936 (180deg=0.928) USER MOD Single : B 40 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : B 41 GLN : amide:sc= 1.06 K(o=1.1,f=-3.8!) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : B 59 TYR OH : rot 50:sc= 0.292 USER MOD Single : B 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 62 GLN : amide:sc= 0.718 K(o=0.72,f=0) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot 85:sc= 1.38 USER MOD Single : B 66 THR OG1 : rot 161:sc= 1.25 USER MOD Single : C 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 80 THR OG1 : rot 180:sc= 0 USER MOD Single : C 84 GLN : amide:sc= -0.24 X(o=-0.24,f=-0.17) USER MOD Single : C 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 91 MET CE :methyl 179:sc= -0.416 (180deg=-0.416) USER MOD Single : C 94 GLN :FLIP amide:sc= 0 F(o=-0.61,f=0) USER MOD Single : C 100 ASN : amide:sc= 1.17 K(o=1.2,f=0) USER MOD Single : C 101 SER OG : rot 180:sc= 0 USER MOD Single : C 102 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : C 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 117 SER OG : rot 87:sc= 1.28 USER MOD Single : C 119 ASN : amide:sc= 1.1 K(o=1.1,f=0) USER MOD Single : C 120 SER OG : rot 180:sc= 0 USER MOD Single : C 121 CYS SG : rot 180:sc= 0 USER MOD Single : C 124 SER OG : rot 13:sc= 0.504 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.980 0.089 0.738 1.00 0.00 N ATOM 2 CA MET A 1 1.652 -0.076 -0.589 1.00 0.00 C ATOM 3 C MET A 1 1.088 -1.274 -1.374 1.00 0.00 C ATOM 4 O MET A 1 0.330 -2.072 -0.831 1.00 0.00 O ATOM 5 CB MET A 1 3.201 -0.130 -0.466 1.00 0.00 C ATOM 6 CG MET A 1 3.793 -1.389 0.194 1.00 0.00 C ATOM 7 SD MET A 1 5.606 -1.448 0.188 1.00 0.00 S ATOM 8 CE MET A 1 5.874 -3.099 0.891 1.00 0.00 C ATOM 0 H1 MET A 1 1.445 0.852 1.270 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.022 0.328 0.593 1.00 0.00 H new ATOM 0 H3 MET A 1 1.049 -0.799 1.275 1.00 0.00 H new ATOM 0 HA MET A 1 1.422 0.818 -1.169 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.626 -0.036 -1.465 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.529 0.740 0.103 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.442 -1.445 1.224 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.410 -2.270 -0.321 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.944 -3.297 0.957 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.434 -3.146 1.887 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.406 -3.847 0.251 1.00 0.00 H new ATOM 20 N GLN A 2 1.459 -1.419 -2.652 1.00 0.00 N ATOM 21 CA GLN A 2 1.116 -2.580 -3.493 1.00 0.00 C ATOM 22 C GLN A 2 2.385 -3.360 -3.877 1.00 0.00 C ATOM 23 O GLN A 2 3.408 -2.746 -4.184 1.00 0.00 O ATOM 24 CB GLN A 2 0.377 -2.124 -4.768 1.00 0.00 C ATOM 25 CG GLN A 2 -0.857 -1.228 -4.549 1.00 0.00 C ATOM 26 CD GLN A 2 -2.021 -1.879 -3.794 1.00 0.00 C ATOM 27 OE1 GLN A 2 -2.152 -3.091 -3.695 1.00 0.00 O ATOM 28 NE2 GLN A 2 -2.925 -1.086 -3.251 1.00 0.00 N ATOM 0 H GLN A 2 2.017 -0.721 -3.143 1.00 0.00 H new ATOM 0 HA GLN A 2 0.459 -3.234 -2.919 1.00 0.00 H new ATOM 0 HB2 GLN A 2 1.083 -1.587 -5.401 1.00 0.00 H new ATOM 0 HB3 GLN A 2 0.064 -3.011 -5.320 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -0.545 -0.338 -4.003 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -1.219 -0.895 -5.522 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -2.827 -0.074 -3.327 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -3.722 -1.485 -2.755 1.00 0.00 H new ATOM 37 N ILE A 3 2.313 -4.693 -3.908 1.00 0.00 N ATOM 38 CA ILE A 3 3.358 -5.581 -4.457 1.00 0.00 C ATOM 39 C ILE A 3 2.748 -6.580 -5.451 1.00 0.00 C ATOM 40 O ILE A 3 1.544 -6.849 -5.422 1.00 0.00 O ATOM 41 CB ILE A 3 4.175 -6.305 -3.356 1.00 0.00 C ATOM 42 CG1 ILE A 3 3.315 -7.287 -2.526 1.00 0.00 C ATOM 43 CG2 ILE A 3 4.912 -5.277 -2.479 1.00 0.00 C ATOM 44 CD1 ILE A 3 4.121 -8.180 -1.571 1.00 0.00 C ATOM 0 H ILE A 3 1.509 -5.204 -3.544 1.00 0.00 H new ATOM 0 HA ILE A 3 4.067 -4.947 -4.990 1.00 0.00 H new ATOM 0 HB ILE A 3 4.924 -6.925 -3.848 1.00 0.00 H new ATOM 0 HG12 ILE A 3 2.590 -6.716 -1.946 1.00 0.00 H new ATOM 0 HG13 ILE A 3 2.749 -7.922 -3.208 1.00 0.00 H new ATOM 0 HG21 ILE A 3 5.482 -5.797 -1.710 1.00 0.00 H new ATOM 0 HG22 ILE A 3 5.590 -4.690 -3.098 1.00 0.00 H new ATOM 0 HG23 ILE A 3 4.186 -4.615 -2.007 1.00 0.00 H new ATOM 0 HD11 ILE A 3 3.442 -8.838 -1.028 1.00 0.00 H new ATOM 0 HD12 ILE A 3 4.828 -8.781 -2.144 1.00 0.00 H new ATOM 0 HD13 ILE A 3 4.666 -7.556 -0.862 1.00 0.00 H new ATOM 56 N PHE A 4 3.589 -7.156 -6.306 1.00 0.00 N ATOM 57 CA PHE A 4 3.216 -8.174 -7.286 1.00 0.00 C ATOM 58 C PHE A 4 3.809 -9.540 -6.924 1.00 0.00 C ATOM 59 O PHE A 4 4.908 -9.624 -6.373 1.00 0.00 O ATOM 60 CB PHE A 4 3.658 -7.729 -8.687 1.00 0.00 C ATOM 61 CG PHE A 4 3.128 -6.370 -9.107 1.00 0.00 C ATOM 62 CD1 PHE A 4 1.745 -6.179 -9.290 1.00 0.00 C ATOM 63 CD2 PHE A 4 4.013 -5.292 -9.304 1.00 0.00 C ATOM 64 CE1 PHE A 4 1.249 -4.917 -9.661 1.00 0.00 C ATOM 65 CE2 PHE A 4 3.516 -4.032 -9.684 1.00 0.00 C ATOM 66 CZ PHE A 4 2.134 -3.842 -9.856 1.00 0.00 C ATOM 0 H PHE A 4 4.581 -6.920 -6.337 1.00 0.00 H new ATOM 0 HA PHE A 4 2.132 -8.285 -7.279 1.00 0.00 H new ATOM 0 HB2 PHE A 4 4.747 -7.708 -8.722 1.00 0.00 H new ATOM 0 HB3 PHE A 4 3.330 -8.474 -9.412 1.00 0.00 H new ATOM 0 HD1 PHE A 4 1.063 -7.004 -9.145 1.00 0.00 H new ATOM 0 HD2 PHE A 4 5.074 -5.433 -9.163 1.00 0.00 H new ATOM 0 HE1 PHE A 4 0.187 -4.773 -9.796 1.00 0.00 H new ATOM 0 HE2 PHE A 4 4.197 -3.209 -9.844 1.00 0.00 H new ATOM 0 HZ PHE A 4 1.752 -2.872 -10.138 1.00 0.00 H new ATOM 76 N VAL A 5 3.111 -10.621 -7.273 1.00 0.00 N ATOM 77 CA VAL A 5 3.590 -12.004 -7.113 1.00 0.00 C ATOM 78 C VAL A 5 3.337 -12.781 -8.406 1.00 0.00 C ATOM 79 O VAL A 5 2.192 -12.881 -8.843 1.00 0.00 O ATOM 80 CB VAL A 5 2.927 -12.704 -5.906 1.00 0.00 C ATOM 81 CG1 VAL A 5 3.595 -14.057 -5.637 1.00 0.00 C ATOM 82 CG2 VAL A 5 3.015 -11.876 -4.617 1.00 0.00 C ATOM 0 H VAL A 5 2.179 -10.564 -7.683 1.00 0.00 H new ATOM 0 HA VAL A 5 4.661 -11.979 -6.912 1.00 0.00 H new ATOM 0 HB VAL A 5 1.877 -12.829 -6.172 1.00 0.00 H new ATOM 0 HG11 VAL A 5 3.115 -14.536 -4.783 1.00 0.00 H new ATOM 0 HG12 VAL A 5 3.493 -14.694 -6.515 1.00 0.00 H new ATOM 0 HG13 VAL A 5 4.652 -13.904 -5.420 1.00 0.00 H new ATOM 0 HG21 VAL A 5 2.533 -12.417 -3.803 1.00 0.00 H new ATOM 0 HG22 VAL A 5 4.062 -11.702 -4.367 1.00 0.00 H new ATOM 0 HG23 VAL A 5 2.513 -10.920 -4.764 1.00 0.00 H new ATOM 92 N LYS A 6 4.387 -13.333 -9.023 1.00 0.00 N ATOM 93 CA LYS A 6 4.293 -14.175 -10.230 1.00 0.00 C ATOM 94 C LYS A 6 4.257 -15.664 -9.883 1.00 0.00 C ATOM 95 O LYS A 6 5.054 -16.128 -9.068 1.00 0.00 O ATOM 96 CB LYS A 6 5.434 -13.841 -11.209 1.00 0.00 C ATOM 97 CG LYS A 6 5.009 -12.732 -12.184 1.00 0.00 C ATOM 98 CD LYS A 6 6.156 -12.353 -13.135 1.00 0.00 C ATOM 99 CE LYS A 6 5.694 -11.563 -14.372 1.00 0.00 C ATOM 100 NZ LYS A 6 4.995 -10.289 -14.038 1.00 0.00 N1+ ATOM 0 H LYS A 6 5.345 -13.208 -8.695 1.00 0.00 H new ATOM 0 HA LYS A 6 3.348 -13.950 -10.725 1.00 0.00 H new ATOM 0 HB2 LYS A 6 6.316 -13.524 -10.652 1.00 0.00 H new ATOM 0 HB3 LYS A 6 5.714 -14.735 -11.767 1.00 0.00 H new ATOM 0 HG2 LYS A 6 4.148 -13.065 -12.764 1.00 0.00 H new ATOM 0 HG3 LYS A 6 4.694 -11.853 -11.622 1.00 0.00 H new ATOM 0 HD2 LYS A 6 6.889 -11.760 -12.588 1.00 0.00 H new ATOM 0 HD3 LYS A 6 6.661 -13.262 -13.462 1.00 0.00 H new ATOM 0 HE2 LYS A 6 6.560 -11.340 -14.995 1.00 0.00 H new ATOM 0 HE3 LYS A 6 5.027 -12.189 -14.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 4.877 -9.721 -14.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 4.061 -10.501 -13.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 5.559 -9.755 -13.346 1.00 0.00 H new ATOM 114 N THR A 7 3.351 -16.408 -10.513 1.00 0.00 N ATOM 115 CA THR A 7 3.199 -17.869 -10.359 1.00 0.00 C ATOM 116 C THR A 7 4.102 -18.650 -11.329 1.00 0.00 C ATOM 117 O THR A 7 4.624 -18.096 -12.299 1.00 0.00 O ATOM 118 CB THR A 7 1.736 -18.299 -10.580 1.00 0.00 C ATOM 119 OG1 THR A 7 1.404 -18.109 -11.934 1.00 0.00 O ATOM 120 CG2 THR A 7 0.727 -17.524 -9.734 1.00 0.00 C ATOM 0 H THR A 7 2.678 -16.007 -11.166 1.00 0.00 H new ATOM 0 HA THR A 7 3.501 -18.104 -9.338 1.00 0.00 H new ATOM 0 HB THR A 7 1.676 -19.345 -10.279 1.00 0.00 H new ATOM 0 HG1 THR A 7 1.030 -18.938 -12.299 1.00 0.00 H new ATOM 0 HG21 THR A 7 -0.279 -17.885 -9.947 1.00 0.00 H new ATOM 0 HG22 THR A 7 0.949 -17.671 -8.677 1.00 0.00 H new ATOM 0 HG23 THR A 7 0.790 -16.463 -9.974 1.00 0.00 H new ATOM 128 N LEU A 8 4.217 -19.972 -11.132 1.00 0.00 N ATOM 129 CA LEU A 8 4.871 -20.875 -12.100 1.00 0.00 C ATOM 130 C LEU A 8 4.093 -20.996 -13.428 1.00 0.00 C ATOM 131 O LEU A 8 4.685 -21.287 -14.469 1.00 0.00 O ATOM 132 CB LEU A 8 5.075 -22.264 -11.465 1.00 0.00 C ATOM 133 CG LEU A 8 5.899 -22.286 -10.164 1.00 0.00 C ATOM 134 CD1 LEU A 8 6.123 -23.734 -9.729 1.00 0.00 C ATOM 135 CD2 LEU A 8 7.253 -21.593 -10.310 1.00 0.00 C ATOM 0 H LEU A 8 3.862 -20.447 -10.302 1.00 0.00 H new ATOM 0 HA LEU A 8 5.838 -20.438 -12.347 1.00 0.00 H new ATOM 0 HB2 LEU A 8 4.096 -22.698 -11.261 1.00 0.00 H new ATOM 0 HB3 LEU A 8 5.564 -22.909 -12.195 1.00 0.00 H new ATOM 0 HG LEU A 8 5.330 -21.737 -9.414 1.00 0.00 H new ATOM 0 HD11 LEU A 8 6.706 -23.751 -8.808 1.00 0.00 H new ATOM 0 HD12 LEU A 8 5.160 -24.216 -9.558 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.663 -24.269 -10.510 1.00 0.00 H new ATOM 0 HD21 LEU A 8 7.790 -21.639 -9.362 1.00 0.00 H new ATOM 0 HD22 LEU A 8 7.837 -22.094 -11.082 1.00 0.00 H new ATOM 0 HD23 LEU A 8 7.100 -20.551 -10.590 1.00 0.00 H new ATOM 147 N THR A 9 2.782 -20.726 -13.407 1.00 0.00 N ATOM 148 CA THR A 9 1.904 -20.648 -14.593 1.00 0.00 C ATOM 149 C THR A 9 1.989 -19.305 -15.340 1.00 0.00 C ATOM 150 O THR A 9 1.340 -19.133 -16.374 1.00 0.00 O ATOM 151 CB THR A 9 0.443 -20.959 -14.213 1.00 0.00 C ATOM 152 OG1 THR A 9 0.019 -20.139 -13.143 1.00 0.00 O ATOM 153 CG2 THR A 9 0.274 -22.407 -13.754 1.00 0.00 C ATOM 0 H THR A 9 2.281 -20.549 -12.536 1.00 0.00 H new ATOM 0 HA THR A 9 2.270 -21.406 -15.285 1.00 0.00 H new ATOM 0 HB THR A 9 -0.151 -20.776 -15.109 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.911 -20.350 -12.918 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.769 -22.587 -13.495 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.570 -23.081 -14.558 1.00 0.00 H new ATOM 0 HG23 THR A 9 0.901 -22.587 -12.881 1.00 0.00 H new ATOM 161 N GLY A 10 2.793 -18.349 -14.852 1.00 0.00 N ATOM 162 CA GLY A 10 3.015 -17.039 -15.482 1.00 0.00 C ATOM 163 C GLY A 10 1.931 -15.987 -15.201 1.00 0.00 C ATOM 164 O GLY A 10 1.936 -14.922 -15.824 1.00 0.00 O ATOM 0 H GLY A 10 3.320 -18.468 -13.987 1.00 0.00 H new ATOM 0 HA2 GLY A 10 3.975 -16.648 -15.143 1.00 0.00 H new ATOM 0 HA3 GLY A 10 3.091 -17.180 -16.560 1.00 0.00 H new ATOM 168 N LYS A 11 1.010 -16.259 -14.265 1.00 0.00 N ATOM 169 CA LYS A 11 -0.002 -15.306 -13.778 1.00 0.00 C ATOM 170 C LYS A 11 0.648 -14.303 -12.820 1.00 0.00 C ATOM 171 O LYS A 11 1.497 -14.688 -12.019 1.00 0.00 O ATOM 172 CB LYS A 11 -1.147 -16.097 -13.114 1.00 0.00 C ATOM 173 CG LYS A 11 -2.333 -15.224 -12.671 1.00 0.00 C ATOM 174 CD LYS A 11 -3.419 -16.087 -12.010 1.00 0.00 C ATOM 175 CE LYS A 11 -4.605 -15.261 -11.488 1.00 0.00 C ATOM 176 NZ LYS A 11 -5.452 -14.715 -12.588 1.00 0.00 N1+ ATOM 0 H LYS A 11 0.945 -17.171 -13.813 1.00 0.00 H new ATOM 0 HA LYS A 11 -0.422 -14.731 -14.603 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -1.506 -16.853 -13.813 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -0.754 -16.626 -12.246 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -1.990 -14.462 -11.971 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -2.749 -14.702 -13.532 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -3.782 -16.819 -12.731 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -2.979 -16.645 -11.183 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.218 -15.884 -10.837 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -4.230 -14.438 -10.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -6.237 -14.167 -12.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -4.876 -14.098 -13.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -5.834 -15.499 -13.154 1.00 0.00 H new ATOM 190 N THR A 12 0.230 -13.037 -12.867 1.00 0.00 N ATOM 191 CA THR A 12 0.642 -12.003 -11.896 1.00 0.00 C ATOM 192 C THR A 12 -0.522 -11.647 -10.969 1.00 0.00 C ATOM 193 O THR A 12 -1.578 -11.199 -11.418 1.00 0.00 O ATOM 194 CB THR A 12 1.206 -10.751 -12.585 1.00 0.00 C ATOM 195 OG1 THR A 12 2.265 -11.120 -13.442 1.00 0.00 O ATOM 196 CG2 THR A 12 1.804 -9.762 -11.586 1.00 0.00 C ATOM 0 H THR A 12 -0.409 -12.690 -13.583 1.00 0.00 H new ATOM 0 HA THR A 12 1.450 -12.421 -11.295 1.00 0.00 H new ATOM 0 HB THR A 12 0.374 -10.290 -13.117 1.00 0.00 H new ATOM 0 HG1 THR A 12 2.308 -10.496 -14.196 1.00 0.00 H new ATOM 0 HG21 THR A 12 2.190 -8.894 -12.120 1.00 0.00 H new ATOM 0 HG22 THR A 12 1.034 -9.443 -10.884 1.00 0.00 H new ATOM 0 HG23 THR A 12 2.616 -10.242 -11.040 1.00 0.00 H new ATOM 204 N ILE A 13 -0.312 -11.834 -9.666 1.00 0.00 N ATOM 205 CA ILE A 13 -1.221 -11.467 -8.572 1.00 0.00 C ATOM 206 C ILE A 13 -0.782 -10.100 -8.026 1.00 0.00 C ATOM 207 O ILE A 13 0.418 -9.863 -7.886 1.00 0.00 O ATOM 208 CB ILE A 13 -1.188 -12.558 -7.468 1.00 0.00 C ATOM 209 CG1 ILE A 13 -1.451 -13.983 -8.019 1.00 0.00 C ATOM 210 CG2 ILE A 13 -2.201 -12.233 -6.352 1.00 0.00 C ATOM 211 CD1 ILE A 13 -1.025 -15.094 -7.050 1.00 0.00 C ATOM 0 H ILE A 13 0.544 -12.270 -9.323 1.00 0.00 H new ATOM 0 HA ILE A 13 -2.248 -11.397 -8.929 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.177 -12.551 -7.060 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -2.513 -14.090 -8.240 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.916 -14.106 -8.961 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -2.162 -13.010 -5.588 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -1.953 -11.271 -5.904 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -3.205 -12.189 -6.774 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.236 -16.066 -7.496 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.043 -15.011 -6.848 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -1.579 -14.995 -6.117 1.00 0.00 H new ATOM 223 N THR A 14 -1.722 -9.218 -7.674 1.00 0.00 N ATOM 224 CA THR A 14 -1.429 -7.955 -6.960 1.00 0.00 C ATOM 225 C THR A 14 -1.917 -8.052 -5.514 1.00 0.00 C ATOM 226 O THR A 14 -3.052 -8.474 -5.280 1.00 0.00 O ATOM 227 CB THR A 14 -2.054 -6.738 -7.666 1.00 0.00 C ATOM 228 OG1 THR A 14 -1.707 -6.733 -9.036 1.00 0.00 O ATOM 229 CG2 THR A 14 -1.563 -5.410 -7.083 1.00 0.00 C ATOM 0 H THR A 14 -2.713 -9.353 -7.873 1.00 0.00 H new ATOM 0 HA THR A 14 -0.349 -7.807 -6.965 1.00 0.00 H new ATOM 0 HB THR A 14 -3.131 -6.827 -7.522 1.00 0.00 H new ATOM 0 HG1 THR A 14 -0.808 -6.359 -9.144 1.00 0.00 H new ATOM 0 HG21 THR A 14 -2.033 -4.583 -7.615 1.00 0.00 H new ATOM 0 HG22 THR A 14 -1.825 -5.357 -6.026 1.00 0.00 H new ATOM 0 HG23 THR A 14 -0.481 -5.343 -7.192 1.00 0.00 H new ATOM 237 N LEU A 15 -1.080 -7.674 -4.547 1.00 0.00 N ATOM 238 CA LEU A 15 -1.372 -7.734 -3.108 1.00 0.00 C ATOM 239 C LEU A 15 -1.171 -6.361 -2.449 1.00 0.00 C ATOM 240 O LEU A 15 -0.138 -5.717 -2.645 1.00 0.00 O ATOM 241 CB LEU A 15 -0.469 -8.782 -2.423 1.00 0.00 C ATOM 242 CG LEU A 15 -0.518 -10.212 -2.989 1.00 0.00 C ATOM 243 CD1 LEU A 15 0.457 -11.087 -2.206 1.00 0.00 C ATOM 244 CD2 LEU A 15 -1.904 -10.849 -2.880 1.00 0.00 C ATOM 0 H LEU A 15 -0.150 -7.306 -4.746 1.00 0.00 H new ATOM 0 HA LEU A 15 -2.415 -8.026 -2.987 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.561 -8.430 -2.476 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.737 -8.824 -1.367 1.00 0.00 H new ATOM 0 HG LEU A 15 -0.257 -10.145 -4.045 1.00 0.00 H new ATOM 0 HD11 LEU A 15 0.430 -12.103 -2.599 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.466 -10.686 -2.305 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.172 -11.097 -1.154 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.875 -11.856 -3.295 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.201 -10.897 -1.832 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.625 -10.248 -3.434 1.00 0.00 H new ATOM 256 N GLU A 16 -2.128 -5.949 -1.614 1.00 0.00 N ATOM 257 CA GLU A 16 -2.032 -4.732 -0.800 1.00 0.00 C ATOM 258 C GLU A 16 -1.411 -5.063 0.562 1.00 0.00 C ATOM 259 O GLU A 16 -1.923 -5.911 1.298 1.00 0.00 O ATOM 260 CB GLU A 16 -3.415 -4.081 -0.684 1.00 0.00 C ATOM 261 CG GLU A 16 -3.341 -2.691 -0.045 1.00 0.00 C ATOM 262 CD GLU A 16 -4.687 -1.961 -0.192 1.00 0.00 C ATOM 263 OE1 GLU A 16 -5.015 -1.531 -1.328 1.00 0.00 O1- ATOM 264 OE2 GLU A 16 -5.418 -1.810 0.818 1.00 0.00 O ATOM 0 H GLU A 16 -3.003 -6.457 -1.482 1.00 0.00 H new ATOM 0 HA GLU A 16 -1.374 -4.006 -1.279 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.863 -4.002 -1.675 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -4.068 -4.720 -0.089 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -3.083 -2.782 1.010 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -2.550 -2.108 -0.518 1.00 0.00 H new ATOM 271 N VAL A 17 -0.291 -4.415 0.886 1.00 0.00 N ATOM 272 CA VAL A 17 0.574 -4.733 2.037 1.00 0.00 C ATOM 273 C VAL A 17 1.253 -3.478 2.587 1.00 0.00 C ATOM 274 O VAL A 17 1.358 -2.467 1.896 1.00 0.00 O ATOM 275 CB VAL A 17 1.681 -5.746 1.647 1.00 0.00 C ATOM 276 CG1 VAL A 17 1.127 -7.105 1.201 1.00 0.00 C ATOM 277 CG2 VAL A 17 2.596 -5.221 0.532 1.00 0.00 C ATOM 0 H VAL A 17 0.056 -3.627 0.340 1.00 0.00 H new ATOM 0 HA VAL A 17 -0.073 -5.167 2.799 1.00 0.00 H new ATOM 0 HB VAL A 17 2.255 -5.877 2.564 1.00 0.00 H new ATOM 0 HG11 VAL A 17 1.953 -7.767 0.942 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.549 -7.546 2.013 1.00 0.00 H new ATOM 0 HG13 VAL A 17 0.485 -6.968 0.331 1.00 0.00 H new ATOM 0 HG21 VAL A 17 3.352 -5.970 0.299 1.00 0.00 H new ATOM 0 HG22 VAL A 17 2.003 -5.015 -0.359 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.084 -4.304 0.863 1.00 0.00 H new ATOM 287 N GLU A 18 1.772 -3.547 3.807 1.00 0.00 N ATOM 288 CA GLU A 18 2.648 -2.534 4.409 1.00 0.00 C ATOM 289 C GLU A 18 4.058 -3.128 4.607 1.00 0.00 C ATOM 290 O GLU A 18 4.186 -4.346 4.741 1.00 0.00 O ATOM 291 CB GLU A 18 2.057 -2.041 5.742 1.00 0.00 C ATOM 292 CG GLU A 18 0.808 -1.162 5.567 1.00 0.00 C ATOM 293 CD GLU A 18 1.152 0.214 4.960 1.00 0.00 C ATOM 294 OE1 GLU A 18 1.526 1.137 5.725 1.00 0.00 O ATOM 295 OE2 GLU A 18 1.052 0.383 3.721 1.00 0.00 O1- ATOM 0 H GLU A 18 1.592 -4.334 4.430 1.00 0.00 H new ATOM 0 HA GLU A 18 2.724 -1.674 3.743 1.00 0.00 H new ATOM 0 HB2 GLU A 18 1.802 -2.903 6.359 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.817 -1.476 6.281 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.092 -1.673 4.924 1.00 0.00 H new ATOM 0 HG3 GLU A 18 0.325 -1.021 6.534 1.00 0.00 H new ATOM 302 N PRO A 19 5.140 -2.323 4.670 1.00 0.00 N ATOM 303 CA PRO A 19 6.499 -2.842 4.896 1.00 0.00 C ATOM 304 C PRO A 19 6.645 -3.677 6.186 1.00 0.00 C ATOM 305 O PRO A 19 7.495 -4.564 6.259 1.00 0.00 O ATOM 306 CB PRO A 19 7.403 -1.604 4.916 1.00 0.00 C ATOM 307 CG PRO A 19 6.640 -0.590 4.067 1.00 0.00 C ATOM 308 CD PRO A 19 5.184 -0.891 4.407 1.00 0.00 C ATOM 0 HA PRO A 19 6.770 -3.544 4.108 1.00 0.00 H new ATOM 0 HB2 PRO A 19 7.561 -1.239 5.931 1.00 0.00 H new ATOM 0 HB3 PRO A 19 8.386 -1.819 4.497 1.00 0.00 H new ATOM 0 HG2 PRO A 19 6.911 0.435 4.321 1.00 0.00 H new ATOM 0 HG3 PRO A 19 6.842 -0.719 3.004 1.00 0.00 H new ATOM 0 HD2 PRO A 19 4.857 -0.321 5.277 1.00 0.00 H new ATOM 0 HD3 PRO A 19 4.524 -0.622 3.583 1.00 0.00 H new ATOM 316 N SER A 20 5.788 -3.429 7.180 1.00 0.00 N ATOM 317 CA SER A 20 5.705 -4.168 8.445 1.00 0.00 C ATOM 318 C SER A 20 4.939 -5.503 8.372 1.00 0.00 C ATOM 319 O SER A 20 4.939 -6.243 9.359 1.00 0.00 O ATOM 320 CB SER A 20 5.081 -3.262 9.514 1.00 0.00 C ATOM 321 OG SER A 20 3.816 -2.780 9.084 1.00 0.00 O ATOM 0 H SER A 20 5.103 -2.675 7.124 1.00 0.00 H new ATOM 0 HA SER A 20 6.728 -4.443 8.702 1.00 0.00 H new ATOM 0 HB2 SER A 20 4.968 -3.815 10.446 1.00 0.00 H new ATOM 0 HB3 SER A 20 5.745 -2.423 9.720 1.00 0.00 H new ATOM 0 HG SER A 20 3.432 -2.205 9.779 1.00 0.00 H new ATOM 327 N ASP A 21 4.305 -5.856 7.243 1.00 0.00 N ATOM 328 CA ASP A 21 3.671 -7.173 7.076 1.00 0.00 C ATOM 329 C ASP A 21 4.706 -8.305 7.106 1.00 0.00 C ATOM 330 O ASP A 21 5.769 -8.220 6.481 1.00 0.00 O ATOM 331 CB ASP A 21 2.844 -7.274 5.783 1.00 0.00 C ATOM 332 CG ASP A 21 1.397 -6.805 5.980 1.00 0.00 C ATOM 333 OD1 ASP A 21 0.694 -7.416 6.822 1.00 0.00 O ATOM 334 OD2 ASP A 21 0.952 -5.877 5.267 1.00 0.00 O1- ATOM 0 H ASP A 21 4.218 -5.246 6.430 1.00 0.00 H new ATOM 0 HA ASP A 21 2.992 -7.283 7.922 1.00 0.00 H new ATOM 0 HB2 ASP A 21 3.315 -6.674 5.005 1.00 0.00 H new ATOM 0 HB3 ASP A 21 2.845 -8.306 5.433 1.00 0.00 H new ATOM 339 N THR A 22 4.370 -9.390 7.807 1.00 0.00 N ATOM 340 CA THR A 22 5.156 -10.628 7.818 1.00 0.00 C ATOM 341 C THR A 22 5.005 -11.396 6.505 1.00 0.00 C ATOM 342 O THR A 22 3.993 -11.281 5.811 1.00 0.00 O ATOM 343 CB THR A 22 4.763 -11.544 8.985 1.00 0.00 C ATOM 344 OG1 THR A 22 3.385 -11.830 8.913 1.00 0.00 O ATOM 345 CG2 THR A 22 5.053 -10.918 10.347 1.00 0.00 C ATOM 0 H THR A 22 3.535 -9.435 8.390 1.00 0.00 H new ATOM 0 HA THR A 22 6.197 -10.330 7.942 1.00 0.00 H new ATOM 0 HB THR A 22 5.362 -12.450 8.894 1.00 0.00 H new ATOM 0 HG1 THR A 22 3.133 -12.416 9.657 1.00 0.00 H new ATOM 0 HG21 THR A 22 4.756 -11.609 11.136 1.00 0.00 H new ATOM 0 HG22 THR A 22 6.119 -10.708 10.431 1.00 0.00 H new ATOM 0 HG23 THR A 22 4.491 -9.989 10.448 1.00 0.00 H new ATOM 353 N ILE A 23 5.970 -12.259 6.178 1.00 0.00 N ATOM 354 CA ILE A 23 5.817 -13.199 5.054 1.00 0.00 C ATOM 355 C ILE A 23 4.642 -14.159 5.309 1.00 0.00 C ATOM 356 O ILE A 23 3.933 -14.509 4.371 1.00 0.00 O ATOM 357 CB ILE A 23 7.138 -13.946 4.782 1.00 0.00 C ATOM 358 CG1 ILE A 23 8.343 -12.995 4.598 1.00 0.00 C ATOM 359 CG2 ILE A 23 7.020 -14.874 3.558 1.00 0.00 C ATOM 360 CD1 ILE A 23 8.202 -11.935 3.494 1.00 0.00 C ATOM 0 H ILE A 23 6.861 -12.330 6.669 1.00 0.00 H new ATOM 0 HA ILE A 23 5.581 -12.635 4.152 1.00 0.00 H new ATOM 0 HB ILE A 23 7.324 -14.547 5.672 1.00 0.00 H new ATOM 0 HG12 ILE A 23 8.525 -12.484 5.544 1.00 0.00 H new ATOM 0 HG13 ILE A 23 9.227 -13.597 4.386 1.00 0.00 H new ATOM 0 HG21 ILE A 23 7.969 -15.384 3.396 1.00 0.00 H new ATOM 0 HG22 ILE A 23 6.237 -15.611 3.735 1.00 0.00 H new ATOM 0 HG23 ILE A 23 6.770 -14.284 2.677 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.105 -11.326 3.456 1.00 0.00 H new ATOM 0 HD12 ILE A 23 8.056 -12.428 2.533 1.00 0.00 H new ATOM 0 HD13 ILE A 23 7.344 -11.298 3.709 1.00 0.00 H new ATOM 372 N GLU A 24 4.350 -14.502 6.568 1.00 0.00 N ATOM 373 CA GLU A 24 3.138 -15.248 6.944 1.00 0.00 C ATOM 374 C GLU A 24 1.843 -14.515 6.529 1.00 0.00 C ATOM 375 O GLU A 24 0.941 -15.143 5.970 1.00 0.00 O ATOM 376 CB GLU A 24 3.174 -15.524 8.455 1.00 0.00 C ATOM 377 CG GLU A 24 2.036 -16.439 8.919 1.00 0.00 C ATOM 378 CD GLU A 24 2.161 -16.749 10.422 1.00 0.00 C ATOM 379 OE1 GLU A 24 1.731 -15.914 11.256 1.00 0.00 O ATOM 380 OE2 GLU A 24 2.680 -17.834 10.786 1.00 0.00 O1- ATOM 0 H GLU A 24 4.949 -14.270 7.361 1.00 0.00 H new ATOM 0 HA GLU A 24 3.128 -16.194 6.402 1.00 0.00 H new ATOM 0 HB2 GLU A 24 4.129 -15.980 8.714 1.00 0.00 H new ATOM 0 HB3 GLU A 24 3.116 -14.578 8.994 1.00 0.00 H new ATOM 0 HG2 GLU A 24 1.076 -15.962 8.720 1.00 0.00 H new ATOM 0 HG3 GLU A 24 2.055 -17.368 8.349 1.00 0.00 H new ATOM 387 N ASN A 25 1.764 -13.186 6.700 1.00 0.00 N ATOM 388 CA ASN A 25 0.637 -12.388 6.198 1.00 0.00 C ATOM 389 C ASN A 25 0.567 -12.411 4.662 1.00 0.00 C ATOM 390 O ASN A 25 -0.525 -12.522 4.106 1.00 0.00 O ATOM 391 CB ASN A 25 0.712 -10.938 6.720 1.00 0.00 C ATOM 392 CG ASN A 25 0.391 -10.763 8.198 1.00 0.00 C ATOM 393 OD1 ASN A 25 0.113 -11.694 8.942 1.00 0.00 O ATOM 394 ND2 ASN A 25 0.383 -9.532 8.659 1.00 0.00 N ATOM 0 H ASN A 25 2.474 -12.639 7.186 1.00 0.00 H new ATOM 0 HA ASN A 25 -0.279 -12.842 6.577 1.00 0.00 H new ATOM 0 HB2 ASN A 25 1.715 -10.554 6.535 1.00 0.00 H new ATOM 0 HB3 ASN A 25 0.023 -10.324 6.140 1.00 0.00 H new ATOM 0 HD21 ASN A 25 0.145 -9.354 9.635 1.00 0.00 H new ATOM 0 HD22 ASN A 25 0.614 -8.754 8.041 1.00 0.00 H new ATOM 401 N VAL A 26 1.705 -12.374 3.955 1.00 0.00 N ATOM 402 CA VAL A 26 1.731 -12.491 2.481 1.00 0.00 C ATOM 403 C VAL A 26 1.236 -13.873 2.030 1.00 0.00 C ATOM 404 O VAL A 26 0.392 -13.948 1.137 1.00 0.00 O ATOM 405 CB VAL A 26 3.120 -12.155 1.895 1.00 0.00 C ATOM 406 CG1 VAL A 26 3.115 -12.184 0.361 1.00 0.00 C ATOM 407 CG2 VAL A 26 3.564 -10.744 2.299 1.00 0.00 C ATOM 0 H VAL A 26 2.627 -12.264 4.378 1.00 0.00 H new ATOM 0 HA VAL A 26 1.041 -11.747 2.082 1.00 0.00 H new ATOM 0 HB VAL A 26 3.798 -12.911 2.290 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.111 -11.942 -0.011 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.831 -13.178 0.017 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.400 -11.452 -0.014 1.00 0.00 H new ATOM 0 HG21 VAL A 26 4.545 -10.535 1.872 1.00 0.00 H new ATOM 0 HG22 VAL A 26 2.844 -10.015 1.927 1.00 0.00 H new ATOM 0 HG23 VAL A 26 3.619 -10.677 3.386 1.00 0.00 H new ATOM 417 N LYS A 27 1.645 -14.964 2.697 1.00 0.00 N ATOM 418 CA LYS A 27 1.113 -16.315 2.427 1.00 0.00 C ATOM 419 C LYS A 27 -0.401 -16.395 2.648 1.00 0.00 C ATOM 420 O LYS A 27 -1.102 -16.980 1.824 1.00 0.00 O ATOM 421 CB LYS A 27 1.805 -17.387 3.287 1.00 0.00 C ATOM 422 CG LYS A 27 3.293 -17.626 2.981 1.00 0.00 C ATOM 423 CD LYS A 27 3.803 -18.758 3.894 1.00 0.00 C ATOM 424 CE LYS A 27 5.329 -18.897 3.971 1.00 0.00 C ATOM 425 NZ LYS A 27 5.939 -19.448 2.728 1.00 0.00 N1+ ATOM 0 H LYS A 27 2.349 -14.938 3.435 1.00 0.00 H new ATOM 0 HA LYS A 27 1.324 -16.512 1.376 1.00 0.00 H new ATOM 0 HB2 LYS A 27 1.709 -17.104 4.335 1.00 0.00 H new ATOM 0 HB3 LYS A 27 1.271 -18.329 3.161 1.00 0.00 H new ATOM 0 HG2 LYS A 27 3.426 -17.895 1.933 1.00 0.00 H new ATOM 0 HG3 LYS A 27 3.866 -16.715 3.151 1.00 0.00 H new ATOM 0 HD2 LYS A 27 3.418 -18.593 4.900 1.00 0.00 H new ATOM 0 HD3 LYS A 27 3.385 -19.702 3.544 1.00 0.00 H new ATOM 0 HE2 LYS A 27 5.765 -17.920 4.178 1.00 0.00 H new ATOM 0 HE3 LYS A 27 5.585 -19.544 4.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 6.902 -19.784 2.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 5.362 -20.241 2.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 5.979 -18.704 2.002 1.00 0.00 H new ATOM 439 N ALA A 28 -0.915 -15.772 3.710 1.00 0.00 N ATOM 440 CA ALA A 28 -2.351 -15.713 4.006 1.00 0.00 C ATOM 441 C ALA A 28 -3.137 -14.889 2.964 1.00 0.00 C ATOM 442 O ALA A 28 -4.210 -15.310 2.531 1.00 0.00 O ATOM 443 CB ALA A 28 -2.530 -15.164 5.426 1.00 0.00 C ATOM 0 H ALA A 28 -0.340 -15.287 4.399 1.00 0.00 H new ATOM 0 HA ALA A 28 -2.767 -16.719 3.948 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -3.592 -15.112 5.665 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -2.030 -15.822 6.136 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -2.095 -14.166 5.488 1.00 0.00 H new ATOM 449 N LYS A 29 -2.581 -13.769 2.480 1.00 0.00 N ATOM 450 CA LYS A 29 -3.165 -12.963 1.386 1.00 0.00 C ATOM 451 C LYS A 29 -3.218 -13.738 0.059 1.00 0.00 C ATOM 452 O LYS A 29 -4.213 -13.662 -0.656 1.00 0.00 O ATOM 453 CB LYS A 29 -2.382 -11.644 1.249 1.00 0.00 C ATOM 454 CG LYS A 29 -2.671 -10.674 2.408 1.00 0.00 C ATOM 455 CD LYS A 29 -1.646 -9.528 2.444 1.00 0.00 C ATOM 456 CE LYS A 29 -1.909 -8.554 3.607 1.00 0.00 C ATOM 457 NZ LYS A 29 -3.011 -7.596 3.308 1.00 0.00 N1+ ATOM 0 H LYS A 29 -1.704 -13.389 2.837 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.200 -12.734 1.639 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -1.314 -11.859 1.215 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -2.641 -11.166 0.304 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -3.675 -10.264 2.300 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -2.648 -11.216 3.353 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -0.642 -9.942 2.538 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -1.678 -8.983 1.501 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -2.158 -9.122 4.503 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.997 -7.998 3.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -3.241 -7.053 4.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -2.710 -6.944 2.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -3.852 -8.121 2.994 1.00 0.00 H new ATOM 471 N ILE A 30 -2.199 -14.555 -0.233 1.00 0.00 N ATOM 472 CA ILE A 30 -2.199 -15.482 -1.384 1.00 0.00 C ATOM 473 C ILE A 30 -3.216 -16.616 -1.178 1.00 0.00 C ATOM 474 O ILE A 30 -3.959 -16.935 -2.103 1.00 0.00 O ATOM 475 CB ILE A 30 -0.772 -16.013 -1.653 1.00 0.00 C ATOM 476 CG1 ILE A 30 0.146 -14.855 -2.104 1.00 0.00 C ATOM 477 CG2 ILE A 30 -0.765 -17.129 -2.720 1.00 0.00 C ATOM 478 CD1 ILE A 30 1.638 -15.197 -2.061 1.00 0.00 C ATOM 0 H ILE A 30 -1.344 -14.596 0.322 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.513 -14.936 -2.273 1.00 0.00 H new ATOM 0 HB ILE A 30 -0.399 -16.439 -0.722 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -0.122 -14.566 -3.120 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -0.037 -13.989 -1.468 1.00 0.00 H new ATOM 0 HG21 ILE A 30 0.257 -17.474 -2.879 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -1.380 -17.962 -2.380 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -1.166 -16.740 -3.656 1.00 0.00 H new ATOM 0 HD11 ILE A 30 2.218 -14.336 -2.391 1.00 0.00 H new ATOM 0 HD12 ILE A 30 1.922 -15.457 -1.041 1.00 0.00 H new ATOM 0 HD13 ILE A 30 1.837 -16.042 -2.720 1.00 0.00 H new ATOM 490 N GLN A 31 -3.320 -17.188 0.027 1.00 0.00 N ATOM 491 CA GLN A 31 -4.318 -18.219 0.351 1.00 0.00 C ATOM 492 C GLN A 31 -5.755 -17.696 0.159 1.00 0.00 C ATOM 493 O GLN A 31 -6.596 -18.405 -0.390 1.00 0.00 O ATOM 494 CB GLN A 31 -4.092 -18.716 1.792 1.00 0.00 C ATOM 495 CG GLN A 31 -4.996 -19.905 2.168 1.00 0.00 C ATOM 496 CD GLN A 31 -4.879 -20.324 3.636 1.00 0.00 C ATOM 497 OE1 GLN A 31 -4.279 -19.664 4.476 1.00 0.00 O ATOM 498 NE2 GLN A 31 -5.460 -21.446 4.009 1.00 0.00 N ATOM 0 H GLN A 31 -2.712 -16.949 0.810 1.00 0.00 H new ATOM 0 HA GLN A 31 -4.193 -19.055 -0.337 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -3.049 -19.009 1.910 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -4.273 -17.895 2.486 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -6.033 -19.644 1.955 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -4.745 -20.756 1.535 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -5.965 -22.011 3.326 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -5.405 -21.750 4.981 1.00 0.00 H new ATOM 507 N ASP A 32 -6.033 -16.448 0.545 1.00 0.00 N ATOM 508 CA ASP A 32 -7.351 -15.821 0.389 1.00 0.00 C ATOM 509 C ASP A 32 -7.767 -15.620 -1.085 1.00 0.00 C ATOM 510 O ASP A 32 -8.954 -15.745 -1.405 1.00 0.00 O ATOM 511 CB ASP A 32 -7.354 -14.487 1.147 1.00 0.00 C ATOM 512 CG ASP A 32 -8.745 -13.834 1.149 1.00 0.00 C ATOM 513 OD1 ASP A 32 -9.653 -14.347 1.847 1.00 0.00 O ATOM 514 OD2 ASP A 32 -8.931 -12.793 0.472 1.00 0.00 O1- ATOM 0 H ASP A 32 -5.342 -15.836 0.980 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.094 -16.500 0.809 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.029 -14.652 2.174 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.634 -13.808 0.690 1.00 0.00 H new ATOM 519 N LYS A 33 -6.807 -15.357 -1.988 1.00 0.00 N ATOM 520 CA LYS A 33 -7.063 -15.157 -3.430 1.00 0.00 C ATOM 521 C LYS A 33 -6.999 -16.444 -4.265 1.00 0.00 C ATOM 522 O LYS A 33 -7.845 -16.647 -5.137 1.00 0.00 O ATOM 523 CB LYS A 33 -6.116 -14.083 -3.997 1.00 0.00 C ATOM 524 CG LYS A 33 -6.416 -12.689 -3.422 1.00 0.00 C ATOM 525 CD LYS A 33 -5.724 -11.579 -4.228 1.00 0.00 C ATOM 526 CE LYS A 33 -6.101 -10.209 -3.642 1.00 0.00 C ATOM 527 NZ LYS A 33 -5.747 -9.088 -4.560 1.00 0.00 N1+ ATOM 0 H LYS A 33 -5.821 -15.276 -1.738 1.00 0.00 H new ATOM 0 HA LYS A 33 -8.095 -14.814 -3.509 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.084 -14.354 -3.772 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.208 -14.055 -5.083 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -7.493 -12.520 -3.421 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -6.085 -12.645 -2.384 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -4.643 -11.714 -4.199 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -6.024 -11.634 -5.274 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -7.171 -10.185 -3.438 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.591 -10.071 -2.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.080 -8.190 -4.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.715 -9.052 -4.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -6.199 -9.240 -5.484 1.00 0.00 H new ATOM 541 N GLU A 34 -6.024 -17.317 -4.000 1.00 0.00 N ATOM 542 CA GLU A 34 -5.699 -18.486 -4.839 1.00 0.00 C ATOM 543 C GLU A 34 -6.066 -19.846 -4.212 1.00 0.00 C ATOM 544 O GLU A 34 -6.059 -20.865 -4.905 1.00 0.00 O ATOM 545 CB GLU A 34 -4.197 -18.470 -5.183 1.00 0.00 C ATOM 546 CG GLU A 34 -3.709 -17.198 -5.890 1.00 0.00 C ATOM 547 CD GLU A 34 -4.459 -16.928 -7.211 1.00 0.00 C ATOM 548 OE1 GLU A 34 -4.433 -17.795 -8.119 1.00 0.00 O ATOM 549 OE2 GLU A 34 -5.072 -15.842 -7.355 1.00 0.00 O1- ATOM 0 H GLU A 34 -5.423 -17.234 -3.180 1.00 0.00 H new ATOM 0 HA GLU A 34 -6.314 -18.392 -5.734 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -3.627 -18.598 -4.263 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -3.975 -19.328 -5.817 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -3.836 -16.345 -5.224 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -2.642 -17.287 -6.094 1.00 0.00 H new ATOM 556 N GLY A 35 -6.372 -19.892 -2.908 1.00 0.00 N ATOM 557 CA GLY A 35 -6.701 -21.123 -2.173 1.00 0.00 C ATOM 558 C GLY A 35 -5.507 -22.031 -1.827 1.00 0.00 C ATOM 559 O GLY A 35 -5.714 -23.125 -1.301 1.00 0.00 O ATOM 0 H GLY A 35 -6.398 -19.058 -2.322 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -7.205 -20.848 -1.247 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -7.413 -21.699 -2.765 1.00 0.00 H new ATOM 563 N ILE A 36 -4.265 -21.606 -2.107 1.00 0.00 N ATOM 564 CA ILE A 36 -3.046 -22.413 -1.900 1.00 0.00 C ATOM 565 C ILE A 36 -2.666 -22.411 -0.404 1.00 0.00 C ATOM 566 O ILE A 36 -2.434 -21.327 0.139 1.00 0.00 O ATOM 567 CB ILE A 36 -1.869 -21.901 -2.775 1.00 0.00 C ATOM 568 CG1 ILE A 36 -2.253 -21.796 -4.272 1.00 0.00 C ATOM 569 CG2 ILE A 36 -0.656 -22.841 -2.616 1.00 0.00 C ATOM 570 CD1 ILE A 36 -1.207 -21.081 -5.138 1.00 0.00 C ATOM 0 H ILE A 36 -4.074 -20.680 -2.489 1.00 0.00 H new ATOM 0 HA ILE A 36 -3.254 -23.437 -2.210 1.00 0.00 H new ATOM 0 HB ILE A 36 -1.617 -20.898 -2.430 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.411 -22.800 -4.667 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.202 -21.267 -4.356 1.00 0.00 H new ATOM 0 HG21 ILE A 36 0.168 -22.479 -3.231 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -0.347 -22.862 -1.571 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -0.931 -23.847 -2.933 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -1.551 -21.049 -6.172 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -1.065 -20.064 -4.771 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.262 -21.621 -5.087 1.00 0.00 H new ATOM 582 N PRO A 37 -2.539 -23.570 0.277 1.00 0.00 N ATOM 583 CA PRO A 37 -2.152 -23.626 1.691 1.00 0.00 C ATOM 584 C PRO A 37 -0.757 -23.020 1.948 1.00 0.00 C ATOM 585 O PRO A 37 0.159 -23.301 1.174 1.00 0.00 O ATOM 586 CB PRO A 37 -2.188 -25.112 2.075 1.00 0.00 C ATOM 587 CG PRO A 37 -3.169 -25.714 1.072 1.00 0.00 C ATOM 588 CD PRO A 37 -2.890 -24.904 -0.190 1.00 0.00 C ATOM 0 HA PRO A 37 -2.836 -23.031 2.297 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -1.202 -25.571 1.998 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -2.526 -25.253 3.102 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -2.991 -26.778 0.919 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -4.203 -25.608 1.402 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -2.078 -25.344 -0.768 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -3.765 -24.875 -0.840 1.00 0.00 H new ATOM 596 N PRO A 38 -0.535 -22.249 3.032 1.00 0.00 N ATOM 597 CA PRO A 38 0.763 -21.633 3.344 1.00 0.00 C ATOM 598 C PRO A 38 1.946 -22.614 3.394 1.00 0.00 C ATOM 599 O PRO A 38 3.046 -22.266 2.969 1.00 0.00 O ATOM 600 CB PRO A 38 0.558 -20.937 4.694 1.00 0.00 C ATOM 601 CG PRO A 38 -0.914 -20.541 4.647 1.00 0.00 C ATOM 602 CD PRO A 38 -1.548 -21.742 3.950 1.00 0.00 C ATOM 0 HA PRO A 38 1.045 -20.946 2.546 1.00 0.00 H new ATOM 0 HB2 PRO A 38 0.772 -21.603 5.530 1.00 0.00 H new ATOM 0 HB3 PRO A 38 1.208 -20.069 4.805 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -1.326 -20.385 5.644 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -1.070 -19.617 4.089 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -1.838 -22.505 4.672 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -2.451 -21.451 3.414 1.00 0.00 H new ATOM 610 N ASP A 39 1.715 -23.859 3.827 1.00 0.00 N ATOM 611 CA ASP A 39 2.730 -24.926 3.857 1.00 0.00 C ATOM 612 C ASP A 39 3.208 -25.362 2.455 1.00 0.00 C ATOM 613 O ASP A 39 4.318 -25.876 2.313 1.00 0.00 O ATOM 614 CB ASP A 39 2.161 -26.140 4.606 1.00 0.00 C ATOM 615 CG ASP A 39 1.879 -25.829 6.084 1.00 0.00 C ATOM 616 OD1 ASP A 39 2.835 -25.836 6.897 1.00 0.00 O ATOM 617 OD2 ASP A 39 0.699 -25.586 6.438 1.00 0.00 O1- ATOM 0 H ASP A 39 0.804 -24.161 4.172 1.00 0.00 H new ATOM 0 HA ASP A 39 3.602 -24.521 4.370 1.00 0.00 H new ATOM 0 HB2 ASP A 39 1.240 -26.464 4.122 1.00 0.00 H new ATOM 0 HB3 ASP A 39 2.865 -26.969 4.539 1.00 0.00 H new ATOM 622 N GLN A 40 2.389 -25.142 1.415 1.00 0.00 N ATOM 623 CA GLN A 40 2.704 -25.458 0.014 1.00 0.00 C ATOM 624 C GLN A 40 3.311 -24.265 -0.754 1.00 0.00 C ATOM 625 O GLN A 40 3.780 -24.442 -1.878 1.00 0.00 O ATOM 626 CB GLN A 40 1.438 -25.980 -0.692 1.00 0.00 C ATOM 627 CG GLN A 40 0.880 -27.266 -0.052 1.00 0.00 C ATOM 628 CD GLN A 40 -0.333 -27.844 -0.789 1.00 0.00 C ATOM 629 OE1 GLN A 40 -0.720 -27.429 -1.875 1.00 0.00 O ATOM 630 NE2 GLN A 40 -0.984 -28.840 -0.225 1.00 0.00 N ATOM 0 H GLN A 40 1.464 -24.728 1.529 1.00 0.00 H new ATOM 0 HA GLN A 40 3.471 -26.233 0.018 1.00 0.00 H new ATOM 0 HB2 GLN A 40 0.670 -25.206 -0.669 1.00 0.00 H new ATOM 0 HB3 GLN A 40 1.666 -26.172 -1.741 1.00 0.00 H new ATOM 0 HG2 GLN A 40 1.668 -28.018 -0.022 1.00 0.00 H new ATOM 0 HG3 GLN A 40 0.601 -27.056 0.980 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -0.679 -29.201 0.679 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -1.793 -29.250 -0.692 1.00 0.00 H new ATOM 639 N GLN A 41 3.316 -23.059 -0.170 1.00 0.00 N ATOM 640 CA GLN A 41 3.841 -21.837 -0.792 1.00 0.00 C ATOM 641 C GLN A 41 5.305 -21.565 -0.408 1.00 0.00 C ATOM 642 O GLN A 41 5.635 -21.490 0.777 1.00 0.00 O ATOM 643 CB GLN A 41 3.012 -20.614 -0.358 1.00 0.00 C ATOM 644 CG GLN A 41 1.521 -20.611 -0.740 1.00 0.00 C ATOM 645 CD GLN A 41 0.851 -19.327 -0.248 1.00 0.00 C ATOM 646 OE1 GLN A 41 1.440 -18.260 -0.259 1.00 0.00 O ATOM 647 NE2 GLN A 41 -0.374 -19.356 0.234 1.00 0.00 N ATOM 0 H GLN A 41 2.947 -22.903 0.768 1.00 0.00 H new ATOM 0 HA GLN A 41 3.778 -21.993 -1.869 1.00 0.00 H new ATOM 0 HB2 GLN A 41 3.084 -20.523 0.726 1.00 0.00 H new ATOM 0 HB3 GLN A 41 3.473 -19.723 -0.785 1.00 0.00 H new ATOM 0 HG2 GLN A 41 1.415 -20.693 -1.822 1.00 0.00 H new ATOM 0 HG3 GLN A 41 1.025 -21.478 -0.304 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -0.893 -20.234 0.257 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -0.804 -18.500 0.585 1.00 0.00 H new ATOM 656 N ARG A 42 6.162 -21.284 -1.396 1.00 0.00 N ATOM 657 CA ARG A 42 7.540 -20.781 -1.218 1.00 0.00 C ATOM 658 C ARG A 42 7.673 -19.452 -1.962 1.00 0.00 C ATOM 659 O ARG A 42 7.460 -19.411 -3.168 1.00 0.00 O ATOM 660 CB ARG A 42 8.544 -21.829 -1.736 1.00 0.00 C ATOM 661 CG ARG A 42 8.685 -23.028 -0.788 1.00 0.00 C ATOM 662 CD ARG A 42 9.614 -24.080 -1.405 1.00 0.00 C ATOM 663 NE ARG A 42 9.836 -25.208 -0.476 1.00 0.00 N ATOM 664 CZ ARG A 42 10.983 -25.613 0.044 1.00 0.00 C ATOM 665 NH1 ARG A 42 12.090 -24.939 -0.092 1.00 0.00 N1+ ATOM 666 NH2 ARG A 42 11.038 -26.721 0.726 1.00 0.00 N ATOM 0 H ARG A 42 5.912 -21.403 -2.378 1.00 0.00 H new ATOM 0 HA ARG A 42 7.757 -20.612 -0.163 1.00 0.00 H new ATOM 0 HB2 ARG A 42 8.223 -22.181 -2.716 1.00 0.00 H new ATOM 0 HB3 ARG A 42 9.518 -21.359 -1.869 1.00 0.00 H new ATOM 0 HG2 ARG A 42 9.083 -22.698 0.172 1.00 0.00 H new ATOM 0 HG3 ARG A 42 7.706 -23.465 -0.594 1.00 0.00 H new ATOM 0 HD2 ARG A 42 9.181 -24.451 -2.334 1.00 0.00 H new ATOM 0 HD3 ARG A 42 10.570 -23.621 -1.659 1.00 0.00 H new ATOM 0 HE ARG A 42 9.007 -25.736 -0.204 1.00 0.00 H new ATOM 0 HH11 ARG A 42 12.093 -24.064 -0.616 1.00 0.00 H new ATOM 0 HH12 ARG A 42 12.953 -25.287 0.325 1.00 0.00 H new ATOM 0 HH21 ARG A 42 10.195 -27.279 0.861 1.00 0.00 H new ATOM 0 HH22 ARG A 42 11.924 -27.030 1.126 1.00 0.00 H new ATOM 680 N LEU A 43 8.003 -18.366 -1.264 1.00 0.00 N ATOM 681 CA LEU A 43 8.174 -17.032 -1.863 1.00 0.00 C ATOM 682 C LEU A 43 9.660 -16.705 -2.000 1.00 0.00 C ATOM 683 O LEU A 43 10.419 -16.875 -1.049 1.00 0.00 O ATOM 684 CB LEU A 43 7.423 -15.975 -1.027 1.00 0.00 C ATOM 685 CG LEU A 43 5.892 -16.020 -1.196 1.00 0.00 C ATOM 686 CD1 LEU A 43 5.229 -15.161 -0.120 1.00 0.00 C ATOM 687 CD2 LEU A 43 5.458 -15.486 -2.564 1.00 0.00 C ATOM 0 H LEU A 43 8.162 -18.382 -0.257 1.00 0.00 H new ATOM 0 HA LEU A 43 7.743 -17.024 -2.864 1.00 0.00 H new ATOM 0 HB2 LEU A 43 7.667 -16.118 0.026 1.00 0.00 H new ATOM 0 HB3 LEU A 43 7.781 -14.984 -1.306 1.00 0.00 H new ATOM 0 HG LEU A 43 5.586 -17.062 -1.108 1.00 0.00 H new ATOM 0 HD11 LEU A 43 4.146 -15.195 -0.243 1.00 0.00 H new ATOM 0 HD12 LEU A 43 5.495 -15.543 0.866 1.00 0.00 H new ATOM 0 HD13 LEU A 43 5.572 -14.131 -0.214 1.00 0.00 H new ATOM 0 HD21 LEU A 43 4.372 -15.534 -2.645 1.00 0.00 H new ATOM 0 HD22 LEU A 43 5.785 -14.452 -2.671 1.00 0.00 H new ATOM 0 HD23 LEU A 43 5.908 -16.092 -3.351 1.00 0.00 H new ATOM 699 N ILE A 44 10.070 -16.256 -3.184 1.00 0.00 N ATOM 700 CA ILE A 44 11.448 -15.891 -3.527 1.00 0.00 C ATOM 701 C ILE A 44 11.478 -14.412 -3.950 1.00 0.00 C ATOM 702 O ILE A 44 10.610 -13.957 -4.697 1.00 0.00 O ATOM 703 CB ILE A 44 12.020 -16.837 -4.621 1.00 0.00 C ATOM 704 CG1 ILE A 44 12.154 -18.328 -4.220 1.00 0.00 C ATOM 705 CG2 ILE A 44 13.437 -16.392 -5.044 1.00 0.00 C ATOM 706 CD1 ILE A 44 10.865 -19.126 -3.992 1.00 0.00 C ATOM 0 H ILE A 44 9.426 -16.130 -3.965 1.00 0.00 H new ATOM 0 HA ILE A 44 12.094 -16.013 -2.657 1.00 0.00 H new ATOM 0 HB ILE A 44 11.282 -16.761 -5.419 1.00 0.00 H new ATOM 0 HG12 ILE A 44 12.728 -18.833 -4.997 1.00 0.00 H new ATOM 0 HG13 ILE A 44 12.744 -18.377 -3.305 1.00 0.00 H new ATOM 0 HG21 ILE A 44 13.817 -17.068 -5.810 1.00 0.00 H new ATOM 0 HG22 ILE A 44 13.396 -15.378 -5.443 1.00 0.00 H new ATOM 0 HG23 ILE A 44 14.099 -16.415 -4.178 1.00 0.00 H new ATOM 0 HD11 ILE A 44 11.115 -20.151 -3.718 1.00 0.00 H new ATOM 0 HD12 ILE A 44 10.289 -18.666 -3.189 1.00 0.00 H new ATOM 0 HD13 ILE A 44 10.273 -19.129 -4.907 1.00 0.00 H new ATOM 718 N PHE A 45 12.489 -13.664 -3.498 1.00 0.00 N ATOM 719 CA PHE A 45 12.794 -12.299 -3.955 1.00 0.00 C ATOM 720 C PHE A 45 14.313 -12.089 -4.015 1.00 0.00 C ATOM 721 O PHE A 45 15.027 -12.528 -3.117 1.00 0.00 O ATOM 722 CB PHE A 45 12.128 -11.282 -3.016 1.00 0.00 C ATOM 723 CG PHE A 45 12.400 -9.830 -3.359 1.00 0.00 C ATOM 724 CD1 PHE A 45 11.720 -9.218 -4.429 1.00 0.00 C ATOM 725 CD2 PHE A 45 13.341 -9.090 -2.615 1.00 0.00 C ATOM 726 CE1 PHE A 45 11.984 -7.877 -4.758 1.00 0.00 C ATOM 727 CE2 PHE A 45 13.599 -7.746 -2.940 1.00 0.00 C ATOM 728 CZ PHE A 45 12.920 -7.140 -4.012 1.00 0.00 C ATOM 0 H PHE A 45 13.137 -13.998 -2.785 1.00 0.00 H new ATOM 0 HA PHE A 45 12.397 -12.152 -4.959 1.00 0.00 H new ATOM 0 HB2 PHE A 45 11.051 -11.448 -3.028 1.00 0.00 H new ATOM 0 HB3 PHE A 45 12.469 -11.471 -1.998 1.00 0.00 H new ATOM 0 HD1 PHE A 45 10.994 -9.780 -4.998 1.00 0.00 H new ATOM 0 HD2 PHE A 45 13.865 -9.556 -1.794 1.00 0.00 H new ATOM 0 HE1 PHE A 45 11.467 -7.413 -5.585 1.00 0.00 H new ATOM 0 HE2 PHE A 45 14.318 -7.180 -2.367 1.00 0.00 H new ATOM 0 HZ PHE A 45 13.118 -6.108 -4.262 1.00 0.00 H new ATOM 738 N ALA A 46 14.821 -11.456 -5.080 1.00 0.00 N ATOM 739 CA ALA A 46 16.250 -11.151 -5.280 1.00 0.00 C ATOM 740 C ALA A 46 17.220 -12.346 -5.052 1.00 0.00 C ATOM 741 O ALA A 46 18.356 -12.166 -4.608 1.00 0.00 O ATOM 742 CB ALA A 46 16.594 -9.887 -4.478 1.00 0.00 C ATOM 0 H ALA A 46 14.236 -11.131 -5.850 1.00 0.00 H new ATOM 0 HA ALA A 46 16.410 -10.951 -6.339 1.00 0.00 H new ATOM 0 HB1 ALA A 46 17.648 -9.646 -4.614 1.00 0.00 H new ATOM 0 HB2 ALA A 46 15.983 -9.056 -4.830 1.00 0.00 H new ATOM 0 HB3 ALA A 46 16.395 -10.062 -3.421 1.00 0.00 H new ATOM 748 N GLY A 47 16.764 -13.579 -5.329 1.00 0.00 N ATOM 749 CA GLY A 47 17.531 -14.824 -5.142 1.00 0.00 C ATOM 750 C GLY A 47 17.478 -15.442 -3.736 1.00 0.00 C ATOM 751 O GLY A 47 18.223 -16.384 -3.464 1.00 0.00 O ATOM 0 H GLY A 47 15.828 -13.743 -5.699 1.00 0.00 H new ATOM 0 HA2 GLY A 47 17.167 -15.563 -5.856 1.00 0.00 H new ATOM 0 HA3 GLY A 47 18.573 -14.626 -5.392 1.00 0.00 H new ATOM 755 N LYS A 48 16.616 -14.933 -2.847 1.00 0.00 N ATOM 756 CA LYS A 48 16.466 -15.370 -1.448 1.00 0.00 C ATOM 757 C LYS A 48 15.057 -15.910 -1.208 1.00 0.00 C ATOM 758 O LYS A 48 14.082 -15.265 -1.589 1.00 0.00 O ATOM 759 CB LYS A 48 16.772 -14.184 -0.510 1.00 0.00 C ATOM 760 CG LYS A 48 18.234 -13.712 -0.628 1.00 0.00 C ATOM 761 CD LYS A 48 18.538 -12.458 0.205 1.00 0.00 C ATOM 762 CE LYS A 48 17.837 -11.211 -0.360 1.00 0.00 C ATOM 763 NZ LYS A 48 18.298 -9.970 0.323 1.00 0.00 N1+ ATOM 0 H LYS A 48 15.977 -14.175 -3.089 1.00 0.00 H new ATOM 0 HA LYS A 48 17.170 -16.176 -1.239 1.00 0.00 H new ATOM 0 HB2 LYS A 48 16.104 -13.355 -0.745 1.00 0.00 H new ATOM 0 HB3 LYS A 48 16.568 -14.476 0.520 1.00 0.00 H new ATOM 0 HG2 LYS A 48 18.895 -14.519 -0.312 1.00 0.00 H new ATOM 0 HG3 LYS A 48 18.459 -13.507 -1.675 1.00 0.00 H new ATOM 0 HD2 LYS A 48 18.218 -12.619 1.234 1.00 0.00 H new ATOM 0 HD3 LYS A 48 19.615 -12.290 0.229 1.00 0.00 H new ATOM 0 HE2 LYS A 48 18.035 -11.134 -1.429 1.00 0.00 H new ATOM 0 HE3 LYS A 48 16.758 -11.314 -0.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 17.806 -9.148 -0.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 18.087 -10.034 1.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 19.323 -9.860 0.189 1.00 0.00 H new ATOM 777 N GLN A 49 14.939 -17.075 -0.568 1.00 0.00 N ATOM 778 CA GLN A 49 13.653 -17.608 -0.105 1.00 0.00 C ATOM 779 C GLN A 49 13.242 -16.904 1.202 1.00 0.00 C ATOM 780 O GLN A 49 14.059 -16.748 2.114 1.00 0.00 O ATOM 781 CB GLN A 49 13.743 -19.137 0.039 1.00 0.00 C ATOM 782 CG GLN A 49 12.367 -19.789 0.266 1.00 0.00 C ATOM 783 CD GLN A 49 12.478 -21.297 0.487 1.00 0.00 C ATOM 784 OE1 GLN A 49 12.213 -22.109 -0.390 1.00 0.00 O ATOM 785 NE2 GLN A 49 12.875 -21.733 1.664 1.00 0.00 N ATOM 0 H GLN A 49 15.734 -17.678 -0.355 1.00 0.00 H new ATOM 0 HA GLN A 49 12.872 -17.405 -0.837 1.00 0.00 H new ATOM 0 HB2 GLN A 49 14.197 -19.557 -0.858 1.00 0.00 H new ATOM 0 HB3 GLN A 49 14.400 -19.382 0.874 1.00 0.00 H new ATOM 0 HG2 GLN A 49 11.887 -19.330 1.130 1.00 0.00 H new ATOM 0 HG3 GLN A 49 11.727 -19.595 -0.595 1.00 0.00 H new ATOM 0 HE21 GLN A 49 13.099 -21.069 2.405 1.00 0.00 H new ATOM 0 HE22 GLN A 49 12.958 -22.735 1.835 1.00 0.00 H new ATOM 794 N LEU A 50 11.986 -16.463 1.286 1.00 0.00 N ATOM 795 CA LEU A 50 11.483 -15.592 2.354 1.00 0.00 C ATOM 796 C LEU A 50 10.865 -16.402 3.511 1.00 0.00 C ATOM 797 O LEU A 50 10.194 -17.411 3.284 1.00 0.00 O ATOM 798 CB LEU A 50 10.522 -14.548 1.748 1.00 0.00 C ATOM 799 CG LEU A 50 11.039 -13.790 0.505 1.00 0.00 C ATOM 800 CD1 LEU A 50 10.020 -12.723 0.100 1.00 0.00 C ATOM 801 CD2 LEU A 50 12.383 -13.107 0.746 1.00 0.00 C ATOM 0 H LEU A 50 11.273 -16.706 0.599 1.00 0.00 H new ATOM 0 HA LEU A 50 12.315 -15.052 2.806 1.00 0.00 H new ATOM 0 HB2 LEU A 50 9.593 -15.051 1.481 1.00 0.00 H new ATOM 0 HB3 LEU A 50 10.279 -13.817 2.519 1.00 0.00 H new ATOM 0 HG LEU A 50 11.175 -14.530 -0.284 1.00 0.00 H new ATOM 0 HD11 LEU A 50 10.383 -12.187 -0.777 1.00 0.00 H new ATOM 0 HD12 LEU A 50 9.068 -13.199 -0.134 1.00 0.00 H new ATOM 0 HD13 LEU A 50 9.882 -12.021 0.922 1.00 0.00 H new ATOM 0 HD21 LEU A 50 12.697 -12.590 -0.161 1.00 0.00 H new ATOM 0 HD22 LEU A 50 12.285 -12.387 1.558 1.00 0.00 H new ATOM 0 HD23 LEU A 50 13.129 -13.856 1.013 1.00 0.00 H new ATOM 813 N GLU A 51 11.088 -15.962 4.752 1.00 0.00 N ATOM 814 CA GLU A 51 10.767 -16.708 5.984 1.00 0.00 C ATOM 815 C GLU A 51 9.581 -16.114 6.761 1.00 0.00 C ATOM 816 O GLU A 51 9.493 -14.901 6.944 1.00 0.00 O ATOM 817 CB GLU A 51 12.008 -16.771 6.893 1.00 0.00 C ATOM 818 CG GLU A 51 13.189 -17.512 6.254 1.00 0.00 C ATOM 819 CD GLU A 51 14.385 -17.573 7.221 1.00 0.00 C ATOM 820 OE1 GLU A 51 14.452 -18.515 8.050 1.00 0.00 O1- ATOM 821 OE2 GLU A 51 15.274 -16.689 7.155 1.00 0.00 O ATOM 0 H GLU A 51 11.509 -15.052 4.939 1.00 0.00 H new ATOM 0 HA GLU A 51 10.470 -17.711 5.677 1.00 0.00 H new ATOM 0 HB2 GLU A 51 12.317 -15.757 7.145 1.00 0.00 H new ATOM 0 HB3 GLU A 51 11.741 -17.264 7.828 1.00 0.00 H new ATOM 0 HG2 GLU A 51 12.885 -18.522 5.981 1.00 0.00 H new ATOM 0 HG3 GLU A 51 13.485 -17.008 5.334 1.00 0.00 H new ATOM 828 N ASP A 52 8.690 -16.971 7.273 1.00 0.00 N ATOM 829 CA ASP A 52 7.405 -16.603 7.897 1.00 0.00 C ATOM 830 C ASP A 52 7.509 -15.530 8.994 1.00 0.00 C ATOM 831 O ASP A 52 6.675 -14.624 9.049 1.00 0.00 O ATOM 832 CB ASP A 52 6.773 -17.863 8.508 1.00 0.00 C ATOM 833 CG ASP A 52 6.231 -18.813 7.436 1.00 0.00 C ATOM 834 OD1 ASP A 52 7.018 -19.621 6.885 1.00 0.00 O ATOM 835 OD2 ASP A 52 5.015 -18.745 7.139 1.00 0.00 O1- ATOM 0 H ASP A 52 8.846 -17.979 7.266 1.00 0.00 H new ATOM 0 HA ASP A 52 6.796 -16.173 7.102 1.00 0.00 H new ATOM 0 HB2 ASP A 52 7.516 -18.384 9.112 1.00 0.00 H new ATOM 0 HB3 ASP A 52 5.964 -17.574 9.178 1.00 0.00 H new ATOM 840 N GLY A 53 8.531 -15.628 9.853 1.00 0.00 N ATOM 841 CA GLY A 53 8.759 -14.726 10.991 1.00 0.00 C ATOM 842 C GLY A 53 9.439 -13.393 10.645 1.00 0.00 C ATOM 843 O GLY A 53 9.619 -12.557 11.535 1.00 0.00 O ATOM 0 H GLY A 53 9.241 -16.356 9.775 1.00 0.00 H new ATOM 0 HA2 GLY A 53 7.800 -14.514 11.463 1.00 0.00 H new ATOM 0 HA3 GLY A 53 9.370 -15.246 11.729 1.00 0.00 H new ATOM 847 N ARG A 54 9.831 -13.181 9.381 1.00 0.00 N ATOM 848 CA ARG A 54 10.409 -11.924 8.869 1.00 0.00 C ATOM 849 C ARG A 54 9.338 -11.061 8.199 1.00 0.00 C ATOM 850 O ARG A 54 8.257 -11.543 7.860 1.00 0.00 O ATOM 851 CB ARG A 54 11.572 -12.237 7.907 1.00 0.00 C ATOM 852 CG ARG A 54 12.753 -12.985 8.548 1.00 0.00 C ATOM 853 CD ARG A 54 13.464 -12.169 9.636 1.00 0.00 C ATOM 854 NE ARG A 54 14.648 -12.889 10.151 1.00 0.00 N ATOM 855 CZ ARG A 54 14.691 -13.775 11.132 1.00 0.00 C ATOM 856 NH1 ARG A 54 13.633 -14.114 11.816 1.00 0.00 N1+ ATOM 857 NH2 ARG A 54 15.818 -14.346 11.448 1.00 0.00 N ATOM 0 H ARG A 54 9.753 -13.900 8.662 1.00 0.00 H new ATOM 0 HA ARG A 54 10.804 -11.349 9.706 1.00 0.00 H new ATOM 0 HB2 ARG A 54 11.189 -12.832 7.078 1.00 0.00 H new ATOM 0 HB3 ARG A 54 11.938 -11.301 7.485 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.393 -13.919 8.980 1.00 0.00 H new ATOM 0 HG3 ARG A 54 13.472 -13.249 7.772 1.00 0.00 H new ATOM 0 HD2 ARG A 54 13.769 -11.204 9.231 1.00 0.00 H new ATOM 0 HD3 ARG A 54 12.773 -11.967 10.454 1.00 0.00 H new ATOM 0 HE ARG A 54 15.536 -12.678 9.696 1.00 0.00 H new ATOM 0 HH11 ARG A 54 12.730 -13.691 11.601 1.00 0.00 H new ATOM 0 HH12 ARG A 54 13.709 -14.802 12.565 1.00 0.00 H new ATOM 0 HH21 ARG A 54 16.670 -14.110 10.939 1.00 0.00 H new ATOM 0 HH22 ARG A 54 15.849 -15.029 12.205 1.00 0.00 H new ATOM 871 N THR A 55 9.637 -9.781 8.007 1.00 0.00 N ATOM 872 CA THR A 55 8.755 -8.780 7.385 1.00 0.00 C ATOM 873 C THR A 55 9.308 -8.260 6.061 1.00 0.00 C ATOM 874 O THR A 55 10.497 -8.399 5.775 1.00 0.00 O ATOM 875 CB THR A 55 8.474 -7.603 8.332 1.00 0.00 C ATOM 876 OG1 THR A 55 9.654 -6.896 8.630 1.00 0.00 O ATOM 877 CG2 THR A 55 7.837 -8.040 9.652 1.00 0.00 C ATOM 0 H THR A 55 10.535 -9.389 8.289 1.00 0.00 H new ATOM 0 HA THR A 55 7.816 -9.294 7.178 1.00 0.00 H new ATOM 0 HB THR A 55 7.770 -6.964 7.799 1.00 0.00 H new ATOM 0 HG1 THR A 55 10.294 -7.497 9.066 1.00 0.00 H new ATOM 0 HG21 THR A 55 7.662 -7.166 10.279 1.00 0.00 H new ATOM 0 HG22 THR A 55 6.888 -8.538 9.451 1.00 0.00 H new ATOM 0 HG23 THR A 55 8.506 -8.729 10.168 1.00 0.00 H new ATOM 885 N LEU A 56 8.458 -7.639 5.238 1.00 0.00 N ATOM 886 CA LEU A 56 8.860 -7.098 3.932 1.00 0.00 C ATOM 887 C LEU A 56 10.014 -6.078 4.037 1.00 0.00 C ATOM 888 O LEU A 56 10.916 -6.091 3.197 1.00 0.00 O ATOM 889 CB LEU A 56 7.620 -6.498 3.237 1.00 0.00 C ATOM 890 CG LEU A 56 6.550 -7.528 2.821 1.00 0.00 C ATOM 891 CD1 LEU A 56 5.368 -6.805 2.180 1.00 0.00 C ATOM 892 CD2 LEU A 56 7.081 -8.538 1.801 1.00 0.00 C ATOM 0 H LEU A 56 7.472 -7.496 5.456 1.00 0.00 H new ATOM 0 HA LEU A 56 9.255 -7.914 3.326 1.00 0.00 H new ATOM 0 HB2 LEU A 56 7.162 -5.770 3.907 1.00 0.00 H new ATOM 0 HB3 LEU A 56 7.945 -5.955 2.350 1.00 0.00 H new ATOM 0 HG LEU A 56 6.255 -8.061 3.725 1.00 0.00 H new ATOM 0 HD11 LEU A 56 4.612 -7.533 1.886 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.938 -6.105 2.896 1.00 0.00 H new ATOM 0 HD13 LEU A 56 5.709 -6.260 1.299 1.00 0.00 H new ATOM 0 HD21 LEU A 56 6.290 -9.242 1.540 1.00 0.00 H new ATOM 0 HD22 LEU A 56 7.409 -8.012 0.905 1.00 0.00 H new ATOM 0 HD23 LEU A 56 7.923 -9.081 2.231 1.00 0.00 H new ATOM 904 N SER A 57 10.055 -5.258 5.093 1.00 0.00 N ATOM 905 CA SER A 57 11.154 -4.313 5.345 1.00 0.00 C ATOM 906 C SER A 57 12.476 -4.984 5.755 1.00 0.00 C ATOM 907 O SER A 57 13.537 -4.420 5.478 1.00 0.00 O ATOM 908 CB SER A 57 10.746 -3.264 6.386 1.00 0.00 C ATOM 909 OG SER A 57 10.507 -3.857 7.650 1.00 0.00 O ATOM 0 H SER A 57 9.323 -5.230 5.803 1.00 0.00 H new ATOM 0 HA SER A 57 11.344 -3.826 4.389 1.00 0.00 H new ATOM 0 HB2 SER A 57 11.532 -2.514 6.477 1.00 0.00 H new ATOM 0 HB3 SER A 57 9.848 -2.745 6.050 1.00 0.00 H new ATOM 0 HG SER A 57 10.250 -3.164 8.293 1.00 0.00 H new ATOM 915 N ASP A 58 12.465 -6.200 6.322 1.00 0.00 N ATOM 916 CA ASP A 58 13.697 -6.960 6.610 1.00 0.00 C ATOM 917 C ASP A 58 14.426 -7.378 5.318 1.00 0.00 C ATOM 918 O ASP A 58 15.657 -7.454 5.290 1.00 0.00 O ATOM 919 CB ASP A 58 13.404 -8.209 7.459 1.00 0.00 C ATOM 920 CG ASP A 58 12.839 -7.883 8.849 1.00 0.00 C ATOM 921 OD1 ASP A 58 13.503 -7.148 9.619 1.00 0.00 O ATOM 922 OD2 ASP A 58 11.746 -8.400 9.186 1.00 0.00 O1- ATOM 0 H ASP A 58 11.609 -6.684 6.593 1.00 0.00 H new ATOM 0 HA ASP A 58 14.346 -6.292 7.176 1.00 0.00 H new ATOM 0 HB2 ASP A 58 12.695 -8.843 6.926 1.00 0.00 H new ATOM 0 HB3 ASP A 58 14.322 -8.785 7.574 1.00 0.00 H new ATOM 927 N TYR A 59 13.668 -7.585 4.234 1.00 0.00 N ATOM 928 CA TYR A 59 14.169 -7.867 2.883 1.00 0.00 C ATOM 929 C TYR A 59 14.288 -6.609 1.995 1.00 0.00 C ATOM 930 O TYR A 59 14.614 -6.718 0.812 1.00 0.00 O ATOM 931 CB TYR A 59 13.275 -8.943 2.248 1.00 0.00 C ATOM 932 CG TYR A 59 13.252 -10.254 3.013 1.00 0.00 C ATOM 933 CD1 TYR A 59 14.396 -11.078 3.025 1.00 0.00 C ATOM 934 CD2 TYR A 59 12.092 -10.654 3.703 1.00 0.00 C ATOM 935 CE1 TYR A 59 14.384 -12.300 3.725 1.00 0.00 C ATOM 936 CE2 TYR A 59 12.070 -11.883 4.389 1.00 0.00 C ATOM 937 CZ TYR A 59 13.216 -12.704 4.408 1.00 0.00 C ATOM 938 OH TYR A 59 13.193 -13.889 5.075 1.00 0.00 O ATOM 0 H TYR A 59 12.649 -7.560 4.276 1.00 0.00 H new ATOM 0 HA TYR A 59 15.191 -8.237 2.965 1.00 0.00 H new ATOM 0 HB2 TYR A 59 12.258 -8.559 2.174 1.00 0.00 H new ATOM 0 HB3 TYR A 59 13.618 -9.133 1.231 1.00 0.00 H new ATOM 0 HD1 TYR A 59 15.285 -10.771 2.495 1.00 0.00 H new ATOM 0 HD2 TYR A 59 11.219 -10.018 3.706 1.00 0.00 H new ATOM 0 HE1 TYR A 59 15.264 -12.925 3.739 1.00 0.00 H new ATOM 0 HE2 TYR A 59 11.173 -12.198 4.902 1.00 0.00 H new ATOM 0 HH TYR A 59 13.979 -13.952 5.657 1.00 0.00 H new ATOM 948 N ASN A 60 14.029 -5.416 2.551 1.00 0.00 N ATOM 949 CA ASN A 60 13.958 -4.123 1.848 1.00 0.00 C ATOM 950 C ASN A 60 12.969 -4.105 0.653 1.00 0.00 C ATOM 951 O ASN A 60 13.155 -3.356 -0.310 1.00 0.00 O ATOM 952 CB ASN A 60 15.374 -3.608 1.509 1.00 0.00 C ATOM 953 CG ASN A 60 16.243 -3.410 2.740 1.00 0.00 C ATOM 954 OD1 ASN A 60 16.112 -2.436 3.469 1.00 0.00 O ATOM 955 ND2 ASN A 60 17.158 -4.315 3.017 1.00 0.00 N ATOM 0 H ASN A 60 13.855 -5.320 3.551 1.00 0.00 H new ATOM 0 HA ASN A 60 13.516 -3.405 2.539 1.00 0.00 H new ATOM 0 HB2 ASN A 60 15.861 -4.315 0.837 1.00 0.00 H new ATOM 0 HB3 ASN A 60 15.292 -2.663 0.973 1.00 0.00 H new ATOM 0 HD21 ASN A 60 17.755 -4.203 3.837 1.00 0.00 H new ATOM 0 HD22 ASN A 60 17.270 -5.128 2.412 1.00 0.00 H new ATOM 962 N ILE A 61 11.903 -4.914 0.715 1.00 0.00 N ATOM 963 CA ILE A 61 10.837 -4.957 -0.297 1.00 0.00 C ATOM 964 C ILE A 61 9.996 -3.673 -0.205 1.00 0.00 C ATOM 965 O ILE A 61 9.615 -3.233 0.881 1.00 0.00 O ATOM 966 CB ILE A 61 10.001 -6.255 -0.169 1.00 0.00 C ATOM 967 CG1 ILE A 61 10.881 -7.485 -0.498 1.00 0.00 C ATOM 968 CG2 ILE A 61 8.778 -6.220 -1.109 1.00 0.00 C ATOM 969 CD1 ILE A 61 10.263 -8.838 -0.121 1.00 0.00 C ATOM 0 H ILE A 61 11.754 -5.569 1.483 1.00 0.00 H new ATOM 0 HA ILE A 61 11.272 -4.989 -1.296 1.00 0.00 H new ATOM 0 HB ILE A 61 9.643 -6.330 0.858 1.00 0.00 H new ATOM 0 HG12 ILE A 61 11.096 -7.485 -1.567 1.00 0.00 H new ATOM 0 HG13 ILE A 61 11.835 -7.380 0.019 1.00 0.00 H new ATOM 0 HG21 ILE A 61 8.208 -7.143 -0.999 1.00 0.00 H new ATOM 0 HG22 ILE A 61 8.145 -5.370 -0.852 1.00 0.00 H new ATOM 0 HG23 ILE A 61 9.115 -6.122 -2.141 1.00 0.00 H new ATOM 0 HD11 ILE A 61 10.951 -9.640 -0.389 1.00 0.00 H new ATOM 0 HD12 ILE A 61 10.074 -8.865 0.952 1.00 0.00 H new ATOM 0 HD13 ILE A 61 9.324 -8.971 -0.658 1.00 0.00 H new ATOM 981 N GLN A 62 9.737 -3.067 -1.366 1.00 0.00 N ATOM 982 CA GLN A 62 9.138 -1.732 -1.537 1.00 0.00 C ATOM 983 C GLN A 62 7.960 -1.765 -2.531 1.00 0.00 C ATOM 984 O GLN A 62 7.690 -2.799 -3.151 1.00 0.00 O ATOM 985 CB GLN A 62 10.259 -0.785 -2.011 1.00 0.00 C ATOM 986 CG GLN A 62 11.254 -0.434 -0.892 1.00 0.00 C ATOM 987 CD GLN A 62 12.580 0.070 -1.454 1.00 0.00 C ATOM 988 OE1 GLN A 62 12.733 1.226 -1.827 1.00 0.00 O ATOM 989 NE2 GLN A 62 13.580 -0.782 -1.561 1.00 0.00 N ATOM 0 H GLN A 62 9.948 -3.512 -2.259 1.00 0.00 H new ATOM 0 HA GLN A 62 8.721 -1.378 -0.594 1.00 0.00 H new ATOM 0 HB2 GLN A 62 10.797 -1.251 -2.837 1.00 0.00 H new ATOM 0 HB3 GLN A 62 9.815 0.132 -2.397 1.00 0.00 H new ATOM 0 HG2 GLN A 62 10.820 0.328 -0.245 1.00 0.00 H new ATOM 0 HG3 GLN A 62 11.432 -1.314 -0.274 1.00 0.00 H new ATOM 0 HE21 GLN A 62 13.463 -1.747 -1.253 1.00 0.00 H new ATOM 0 HE22 GLN A 62 14.471 -0.476 -1.952 1.00 0.00 H new ATOM 998 N LYS A 63 7.264 -0.635 -2.719 1.00 0.00 N ATOM 999 CA LYS A 63 6.141 -0.517 -3.668 1.00 0.00 C ATOM 1000 C LYS A 63 6.509 -1.005 -5.082 1.00 0.00 C ATOM 1001 O LYS A 63 7.622 -0.785 -5.560 1.00 0.00 O ATOM 1002 CB LYS A 63 5.589 0.924 -3.679 1.00 0.00 C ATOM 1003 CG LYS A 63 6.562 1.967 -4.259 1.00 0.00 C ATOM 1004 CD LYS A 63 5.980 3.384 -4.176 1.00 0.00 C ATOM 1005 CE LYS A 63 6.969 4.389 -4.784 1.00 0.00 C ATOM 1006 NZ LYS A 63 6.443 5.780 -4.730 1.00 0.00 N1+ ATOM 0 H LYS A 63 7.463 0.229 -2.215 1.00 0.00 H new ATOM 0 HA LYS A 63 5.348 -1.180 -3.321 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.666 0.943 -4.258 1.00 0.00 H new ATOM 0 HB3 LYS A 63 5.332 1.211 -2.659 1.00 0.00 H new ATOM 0 HG2 LYS A 63 7.506 1.928 -3.716 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.782 1.723 -5.298 1.00 0.00 H new ATOM 0 HD2 LYS A 63 5.029 3.428 -4.708 1.00 0.00 H new ATOM 0 HD3 LYS A 63 5.777 3.643 -3.137 1.00 0.00 H new ATOM 0 HE2 LYS A 63 7.916 4.337 -4.248 1.00 0.00 H new ATOM 0 HE3 LYS A 63 7.174 4.117 -5.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 7.138 6.430 -5.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 5.552 5.835 -5.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 6.271 6.048 -3.740 1.00 0.00 H new ATOM 1020 N GLU A 64 5.558 -1.670 -5.738 1.00 0.00 N ATOM 1021 CA GLU A 64 5.681 -2.243 -7.091 1.00 0.00 C ATOM 1022 C GLU A 64 6.806 -3.296 -7.259 1.00 0.00 C ATOM 1023 O GLU A 64 7.211 -3.601 -8.383 1.00 0.00 O ATOM 1024 CB GLU A 64 5.719 -1.127 -8.157 1.00 0.00 C ATOM 1025 CG GLU A 64 4.493 -0.204 -8.107 1.00 0.00 C ATOM 1026 CD GLU A 64 4.556 0.847 -9.231 1.00 0.00 C ATOM 1027 OE1 GLU A 64 5.127 1.944 -9.012 1.00 0.00 O ATOM 1028 OE2 GLU A 64 4.030 0.589 -10.341 1.00 0.00 O1- ATOM 0 H GLU A 64 4.638 -1.835 -5.329 1.00 0.00 H new ATOM 0 HA GLU A 64 4.776 -2.829 -7.252 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.621 -0.531 -8.018 1.00 0.00 H new ATOM 0 HB3 GLU A 64 5.785 -1.580 -9.146 1.00 0.00 H new ATOM 0 HG2 GLU A 64 3.582 -0.795 -8.206 1.00 0.00 H new ATOM 0 HG3 GLU A 64 4.446 0.294 -7.139 1.00 0.00 H new ATOM 1035 N SER A 65 7.298 -3.891 -6.161 1.00 0.00 N ATOM 1036 CA SER A 65 8.232 -5.035 -6.212 1.00 0.00 C ATOM 1037 C SER A 65 7.533 -6.309 -6.699 1.00 0.00 C ATOM 1038 O SER A 65 6.368 -6.532 -6.368 1.00 0.00 O ATOM 1039 CB SER A 65 8.846 -5.331 -4.840 1.00 0.00 C ATOM 1040 OG SER A 65 9.565 -4.218 -4.348 1.00 0.00 O ATOM 0 H SER A 65 7.062 -3.596 -5.213 1.00 0.00 H new ATOM 0 HA SER A 65 9.017 -4.749 -6.912 1.00 0.00 H new ATOM 0 HB2 SER A 65 8.057 -5.597 -4.136 1.00 0.00 H new ATOM 0 HB3 SER A 65 9.511 -6.192 -4.915 1.00 0.00 H new ATOM 0 HG SER A 65 8.937 -3.515 -4.080 1.00 0.00 H new ATOM 1046 N THR A 66 8.258 -7.179 -7.413 1.00 0.00 N ATOM 1047 CA THR A 66 7.743 -8.475 -7.897 1.00 0.00 C ATOM 1048 C THR A 66 8.435 -9.643 -7.192 1.00 0.00 C ATOM 1049 O THR A 66 9.651 -9.807 -7.296 1.00 0.00 O ATOM 1050 CB THR A 66 7.876 -8.608 -9.423 1.00 0.00 C ATOM 1051 OG1 THR A 66 7.231 -7.525 -10.057 1.00 0.00 O ATOM 1052 CG2 THR A 66 7.216 -9.883 -9.956 1.00 0.00 C ATOM 0 H THR A 66 9.228 -7.006 -7.676 1.00 0.00 H new ATOM 0 HA THR A 66 6.681 -8.508 -7.653 1.00 0.00 H new ATOM 0 HB THR A 66 8.945 -8.632 -9.637 1.00 0.00 H new ATOM 0 HG1 THR A 66 7.321 -7.614 -11.029 1.00 0.00 H new ATOM 0 HG21 THR A 66 7.337 -9.930 -11.038 1.00 0.00 H new ATOM 0 HG22 THR A 66 7.686 -10.754 -9.500 1.00 0.00 H new ATOM 0 HG23 THR A 66 6.154 -9.873 -9.710 1.00 0.00 H new ATOM 1060 N LEU A 67 7.648 -10.463 -6.493 1.00 0.00 N ATOM 1061 CA LEU A 67 8.063 -11.717 -5.858 1.00 0.00 C ATOM 1062 C LEU A 67 7.738 -12.907 -6.783 1.00 0.00 C ATOM 1063 O LEU A 67 6.824 -12.832 -7.606 1.00 0.00 O ATOM 1064 CB LEU A 67 7.351 -11.877 -4.495 1.00 0.00 C ATOM 1065 CG LEU A 67 7.782 -10.935 -3.349 1.00 0.00 C ATOM 1066 CD1 LEU A 67 7.489 -9.451 -3.592 1.00 0.00 C ATOM 1067 CD2 LEU A 67 7.040 -11.344 -2.074 1.00 0.00 C ATOM 0 H LEU A 67 6.659 -10.263 -6.347 1.00 0.00 H new ATOM 0 HA LEU A 67 9.139 -11.695 -5.687 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.282 -11.742 -4.657 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.496 -12.904 -4.159 1.00 0.00 H new ATOM 0 HG LEU A 67 8.864 -11.039 -3.272 1.00 0.00 H new ATOM 0 HD11 LEU A 67 7.826 -8.868 -2.735 1.00 0.00 H new ATOM 0 HD12 LEU A 67 8.015 -9.118 -4.487 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.417 -9.309 -3.728 1.00 0.00 H new ATOM 0 HD21 LEU A 67 7.334 -10.687 -1.255 1.00 0.00 H new ATOM 0 HD22 LEU A 67 5.965 -11.262 -2.236 1.00 0.00 H new ATOM 0 HD23 LEU A 67 7.291 -12.374 -1.821 1.00 0.00 H new ATOM 1079 N HIS A 68 8.431 -14.031 -6.603 1.00 0.00 N ATOM 1080 CA HIS A 68 8.195 -15.284 -7.333 1.00 0.00 C ATOM 1081 C HIS A 68 7.642 -16.354 -6.390 1.00 0.00 C ATOM 1082 O HIS A 68 8.245 -16.643 -5.356 1.00 0.00 O ATOM 1083 CB HIS A 68 9.496 -15.718 -8.032 1.00 0.00 C ATOM 1084 CG HIS A 68 9.851 -14.824 -9.198 1.00 0.00 C ATOM 1085 ND1 HIS A 68 10.500 -13.586 -9.115 1.00 0.00 N ATOM 1086 CD2 HIS A 68 9.549 -15.074 -10.506 1.00 0.00 C ATOM 1087 CE1 HIS A 68 10.582 -13.127 -10.375 1.00 0.00 C ATOM 1088 NE2 HIS A 68 10.019 -13.999 -11.230 1.00 0.00 N ATOM 0 H HIS A 68 9.193 -14.101 -5.928 1.00 0.00 H new ATOM 0 HA HIS A 68 7.440 -15.133 -8.105 1.00 0.00 H new ATOM 0 HB2 HIS A 68 10.313 -15.710 -7.310 1.00 0.00 H new ATOM 0 HB3 HIS A 68 9.391 -16.744 -8.384 1.00 0.00 H new ATOM 0 HD2 HIS A 68 9.041 -15.943 -10.897 1.00 0.00 H new ATOM 0 HE1 HIS A 68 11.036 -12.190 -10.661 1.00 0.00 H new ATOM 0 HE2 HIS A 68 9.951 -13.885 -12.241 1.00 0.00 H new ATOM 1096 N LEU A 69 6.494 -16.942 -6.737 1.00 0.00 N ATOM 1097 CA LEU A 69 5.826 -17.997 -5.973 1.00 0.00 C ATOM 1098 C LEU A 69 6.140 -19.375 -6.570 1.00 0.00 C ATOM 1099 O LEU A 69 5.675 -19.723 -7.655 1.00 0.00 O ATOM 1100 CB LEU A 69 4.314 -17.697 -5.917 1.00 0.00 C ATOM 1101 CG LEU A 69 3.451 -18.772 -5.228 1.00 0.00 C ATOM 1102 CD1 LEU A 69 3.814 -18.961 -3.754 1.00 0.00 C ATOM 1103 CD2 LEU A 69 1.980 -18.369 -5.304 1.00 0.00 C ATOM 0 H LEU A 69 5.988 -16.688 -7.585 1.00 0.00 H new ATOM 0 HA LEU A 69 6.200 -18.017 -4.949 1.00 0.00 H new ATOM 0 HB2 LEU A 69 4.168 -16.750 -5.397 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.950 -17.561 -6.935 1.00 0.00 H new ATOM 0 HG LEU A 69 3.637 -19.710 -5.751 1.00 0.00 H new ATOM 0 HD11 LEU A 69 3.176 -19.729 -3.318 1.00 0.00 H new ATOM 0 HD12 LEU A 69 4.857 -19.266 -3.672 1.00 0.00 H new ATOM 0 HD13 LEU A 69 3.668 -18.022 -3.220 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.369 -19.129 -4.817 1.00 0.00 H new ATOM 0 HD22 LEU A 69 1.838 -17.412 -4.801 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.681 -18.278 -6.348 1.00 0.00 H new ATOM 1115 N VAL A 70 6.903 -20.166 -5.817 1.00 0.00 N ATOM 1116 CA VAL A 70 7.175 -21.589 -6.057 1.00 0.00 C ATOM 1117 C VAL A 70 6.181 -22.437 -5.247 1.00 0.00 C ATOM 1118 O VAL A 70 5.779 -22.069 -4.143 1.00 0.00 O ATOM 1119 CB VAL A 70 8.654 -21.908 -5.740 1.00 0.00 C ATOM 1120 CG1 VAL A 70 8.963 -23.410 -5.778 1.00 0.00 C ATOM 1121 CG2 VAL A 70 9.593 -21.216 -6.737 1.00 0.00 C ATOM 0 H VAL A 70 7.373 -19.818 -4.981 1.00 0.00 H new ATOM 0 HA VAL A 70 7.028 -21.837 -7.108 1.00 0.00 H new ATOM 0 HB VAL A 70 8.819 -21.538 -4.728 1.00 0.00 H new ATOM 0 HG11 VAL A 70 10.016 -23.571 -5.547 1.00 0.00 H new ATOM 0 HG12 VAL A 70 8.347 -23.927 -5.042 1.00 0.00 H new ATOM 0 HG13 VAL A 70 8.745 -23.801 -6.772 1.00 0.00 H new ATOM 0 HG21 VAL A 70 10.627 -21.457 -6.491 1.00 0.00 H new ATOM 0 HG22 VAL A 70 9.370 -21.561 -7.747 1.00 0.00 H new ATOM 0 HG23 VAL A 70 9.450 -20.137 -6.683 1.00 0.00 H new ATOM 1131 N LEU A 71 5.781 -23.579 -5.809 1.00 0.00 N ATOM 1132 CA LEU A 71 4.886 -24.574 -5.203 1.00 0.00 C ATOM 1133 C LEU A 71 5.280 -25.996 -5.667 1.00 0.00 C ATOM 1134 O LEU A 71 6.340 -26.170 -6.267 1.00 0.00 O ATOM 1135 CB LEU A 71 3.412 -24.196 -5.493 1.00 0.00 C ATOM 1136 CG LEU A 71 2.996 -24.137 -6.980 1.00 0.00 C ATOM 1137 CD1 LEU A 71 1.544 -24.585 -7.149 1.00 0.00 C ATOM 1138 CD2 LEU A 71 3.099 -22.718 -7.551 1.00 0.00 C ATOM 0 H LEU A 71 6.085 -23.851 -6.744 1.00 0.00 H new ATOM 0 HA LEU A 71 4.992 -24.576 -4.118 1.00 0.00 H new ATOM 0 HB2 LEU A 71 2.769 -24.916 -4.987 1.00 0.00 H new ATOM 0 HB3 LEU A 71 3.215 -23.222 -5.044 1.00 0.00 H new ATOM 0 HG LEU A 71 3.679 -24.799 -7.513 1.00 0.00 H new ATOM 0 HD11 LEU A 71 1.269 -24.537 -8.203 1.00 0.00 H new ATOM 0 HD12 LEU A 71 1.435 -25.609 -6.792 1.00 0.00 H new ATOM 0 HD13 LEU A 71 0.891 -23.929 -6.573 1.00 0.00 H new ATOM 0 HD21 LEU A 71 2.797 -22.724 -8.598 1.00 0.00 H new ATOM 0 HD22 LEU A 71 2.445 -22.051 -6.989 1.00 0.00 H new ATOM 0 HD23 LEU A 71 4.128 -22.368 -7.472 1.00 0.00 H new ATOM 1150 N ARG A 72 4.448 -27.013 -5.385 1.00 0.00 N ATOM 1151 CA ARG A 72 4.648 -28.447 -5.732 1.00 0.00 C ATOM 1152 C ARG A 72 5.752 -29.185 -4.943 1.00 0.00 C ATOM 1153 O ARG A 72 5.896 -30.396 -5.082 1.00 0.00 O ATOM 1154 CB ARG A 72 4.761 -28.587 -7.271 1.00 0.00 C ATOM 1155 CG ARG A 72 4.356 -29.960 -7.834 1.00 0.00 C ATOM 1156 CD ARG A 72 4.416 -29.932 -9.366 1.00 0.00 C ATOM 1157 NE ARG A 72 3.964 -31.208 -9.957 1.00 0.00 N ATOM 1158 CZ ARG A 72 4.654 -32.033 -10.727 1.00 0.00 C ATOM 1159 NH1 ARG A 72 5.930 -31.903 -10.946 1.00 0.00 N1+ ATOM 1160 NH2 ARG A 72 4.050 -33.030 -11.313 1.00 0.00 N ATOM 0 H ARG A 72 3.573 -26.859 -4.885 1.00 0.00 H new ATOM 0 HA ARG A 72 3.761 -28.983 -5.394 1.00 0.00 H new ATOM 0 HB2 ARG A 72 4.138 -27.823 -7.736 1.00 0.00 H new ATOM 0 HB3 ARG A 72 5.790 -28.381 -7.564 1.00 0.00 H new ATOM 0 HG2 ARG A 72 5.022 -30.732 -7.449 1.00 0.00 H new ATOM 0 HG3 ARG A 72 3.349 -30.215 -7.505 1.00 0.00 H new ATOM 0 HD2 ARG A 72 3.794 -29.118 -9.739 1.00 0.00 H new ATOM 0 HD3 ARG A 72 5.437 -29.725 -9.686 1.00 0.00 H new ATOM 0 HE ARG A 72 3.006 -31.486 -9.746 1.00 0.00 H new ATOM 0 HH11 ARG A 72 6.446 -31.136 -10.515 1.00 0.00 H new ATOM 0 HH12 ARG A 72 6.414 -32.568 -11.549 1.00 0.00 H new ATOM 0 HH21 ARG A 72 3.049 -33.171 -11.177 1.00 0.00 H new ATOM 0 HH22 ARG A 72 4.579 -33.668 -11.908 1.00 0.00 H new ATOM 1174 N LEU A 73 6.444 -28.503 -4.021 1.00 0.00 N ATOM 1175 CA LEU A 73 7.441 -29.089 -3.095 1.00 0.00 C ATOM 1176 C LEU A 73 6.820 -29.930 -1.945 1.00 0.00 C ATOM 1177 O LEU A 73 7.561 -30.521 -1.156 1.00 0.00 O ATOM 1178 CB LEU A 73 8.369 -27.966 -2.557 1.00 0.00 C ATOM 1179 CG LEU A 73 9.612 -27.602 -3.402 1.00 0.00 C ATOM 1180 CD1 LEU A 73 10.626 -28.745 -3.467 1.00 0.00 C ATOM 1181 CD2 LEU A 73 9.272 -27.160 -4.823 1.00 0.00 C ATOM 0 H LEU A 73 6.327 -27.498 -3.889 1.00 0.00 H new ATOM 0 HA LEU A 73 8.030 -29.805 -3.667 1.00 0.00 H new ATOM 0 HB2 LEU A 73 7.769 -27.064 -2.434 1.00 0.00 H new ATOM 0 HB3 LEU A 73 8.711 -28.259 -1.564 1.00 0.00 H new ATOM 0 HG LEU A 73 10.056 -26.755 -2.880 1.00 0.00 H new ATOM 0 HD11 LEU A 73 11.480 -28.440 -4.072 1.00 0.00 H new ATOM 0 HD12 LEU A 73 10.963 -28.990 -2.460 1.00 0.00 H new ATOM 0 HD13 LEU A 73 10.158 -29.621 -3.916 1.00 0.00 H new ATOM 0 HD21 LEU A 73 10.190 -26.920 -5.359 1.00 0.00 H new ATOM 0 HD22 LEU A 73 8.750 -27.966 -5.340 1.00 0.00 H new ATOM 0 HD23 LEU A 73 8.632 -26.278 -4.787 1.00 0.00 H new ATOM 1193 N ARG A 74 5.477 -30.020 -1.890 1.00 0.00 N ATOM 1194 CA ARG A 74 4.624 -30.697 -0.880 1.00 0.00 C ATOM 1195 C ARG A 74 4.649 -30.043 0.515 1.00 0.00 C ATOM 1196 O ARG A 74 5.666 -29.511 0.960 1.00 0.00 O ATOM 1197 CB ARG A 74 4.880 -32.224 -0.820 1.00 0.00 C ATOM 1198 CG ARG A 74 5.030 -32.894 -2.200 1.00 0.00 C ATOM 1199 CD ARG A 74 5.055 -34.427 -2.105 1.00 0.00 C ATOM 1200 NE ARG A 74 3.698 -35.014 -2.148 1.00 0.00 N ATOM 1201 CZ ARG A 74 2.987 -35.288 -3.229 1.00 0.00 C ATOM 1202 NH1 ARG A 74 3.411 -35.022 -4.434 1.00 0.00 N1+ ATOM 1203 NH2 ARG A 74 1.819 -35.844 -3.116 1.00 0.00 N ATOM 0 H ARG A 74 4.906 -29.584 -2.613 1.00 0.00 H new ATOM 0 HA ARG A 74 3.604 -30.555 -1.236 1.00 0.00 H new ATOM 0 HB2 ARG A 74 5.784 -32.407 -0.240 1.00 0.00 H new ATOM 0 HB3 ARG A 74 4.057 -32.698 -0.286 1.00 0.00 H new ATOM 0 HG2 ARG A 74 4.205 -32.586 -2.843 1.00 0.00 H new ATOM 0 HG3 ARG A 74 5.949 -32.547 -2.672 1.00 0.00 H new ATOM 0 HD2 ARG A 74 5.649 -34.830 -2.925 1.00 0.00 H new ATOM 0 HD3 ARG A 74 5.548 -34.724 -1.179 1.00 0.00 H new ATOM 0 HE ARG A 74 3.265 -35.230 -1.250 1.00 0.00 H new ATOM 0 HH11 ARG A 74 4.323 -34.586 -4.569 1.00 0.00 H new ATOM 0 HH12 ARG A 74 2.830 -35.250 -5.241 1.00 0.00 H new ATOM 0 HH21 ARG A 74 1.449 -36.070 -2.193 1.00 0.00 H new ATOM 0 HH22 ARG A 74 1.272 -36.055 -3.950 1.00 0.00 H new ATOM 1217 N GLY A 75 3.499 -30.072 1.199 1.00 0.00 N ATOM 1218 CA GLY A 75 3.312 -29.462 2.525 1.00 0.00 C ATOM 1219 C GLY A 75 3.757 -30.379 3.672 1.00 0.00 C ATOM 1220 O GLY A 75 4.658 -30.033 4.438 1.00 0.00 O ATOM 0 H GLY A 75 2.658 -30.526 0.843 1.00 0.00 H new ATOM 0 HA2 GLY A 75 3.874 -28.529 2.573 1.00 0.00 H new ATOM 0 HA3 GLY A 75 2.260 -29.207 2.657 1.00 0.00 H new ATOM 1224 N GLY A 76 3.131 -31.557 3.774 1.00 0.00 N ATOM 1225 CA GLY A 76 3.454 -32.596 4.764 1.00 0.00 C ATOM 1226 C GLY A 76 4.640 -33.477 4.336 1.00 0.00 C ATOM 1227 O GLY A 76 5.755 -33.299 4.826 1.00 0.00 O ATOM 0 H GLY A 76 2.365 -31.823 3.155 1.00 0.00 H new ATOM 0 HA2 GLY A 76 3.684 -32.123 5.719 1.00 0.00 H new ATOM 0 HA3 GLY A 76 2.578 -33.225 4.923 1.00 0.00 H new TER 1231 GLY A 76 ATOM 1232 N MET B 1 0.727 -40.334 9.908 1.00 0.00 N ATOM 1233 CA MET B 1 0.682 -40.243 8.414 1.00 0.00 C ATOM 1234 C MET B 1 -0.177 -41.362 7.796 1.00 0.00 C ATOM 1235 O MET B 1 -0.554 -42.305 8.485 1.00 0.00 O ATOM 1236 CB MET B 1 2.101 -40.171 7.780 1.00 0.00 C ATOM 1237 CG MET B 1 2.954 -41.451 7.862 1.00 0.00 C ATOM 1238 SD MET B 1 4.543 -41.339 6.994 1.00 0.00 S ATOM 1239 CE MET B 1 5.135 -43.043 7.190 1.00 0.00 C ATOM 0 H1 MET B 1 1.369 -39.606 10.281 1.00 0.00 H new ATOM 0 H2 MET B 1 -0.227 -40.185 10.294 1.00 0.00 H new ATOM 0 H3 MET B 1 1.071 -41.275 10.188 1.00 0.00 H new ATOM 0 HA MET B 1 0.193 -39.299 8.173 1.00 0.00 H new ATOM 0 HB2 MET B 1 1.993 -39.900 6.730 1.00 0.00 H new ATOM 0 HB3 MET B 1 2.650 -39.363 8.263 1.00 0.00 H new ATOM 0 HG2 MET B 1 3.141 -41.684 8.910 1.00 0.00 H new ATOM 0 HG3 MET B 1 2.384 -42.282 7.447 1.00 0.00 H new ATOM 0 HE1 MET B 1 6.108 -43.148 6.710 1.00 0.00 H new ATOM 0 HE2 MET B 1 5.227 -43.277 8.251 1.00 0.00 H new ATOM 0 HE3 MET B 1 4.426 -43.730 6.727 1.00 0.00 H new ATOM 1251 N GLN B 2 -0.484 -41.275 6.496 1.00 0.00 N ATOM 1252 CA GLN B 2 -1.188 -42.324 5.734 1.00 0.00 C ATOM 1253 C GLN B 2 -0.268 -42.912 4.651 1.00 0.00 C ATOM 1254 O GLN B 2 0.423 -42.160 3.963 1.00 0.00 O ATOM 1255 CB GLN B 2 -2.467 -41.751 5.086 1.00 0.00 C ATOM 1256 CG GLN B 2 -3.451 -41.052 6.044 1.00 0.00 C ATOM 1257 CD GLN B 2 -4.092 -41.950 7.106 1.00 0.00 C ATOM 1258 OE1 GLN B 2 -4.124 -43.169 7.016 1.00 0.00 O ATOM 1259 NE2 GLN B 2 -4.647 -41.364 8.148 1.00 0.00 N ATOM 0 H GLN B 2 -0.247 -40.460 5.930 1.00 0.00 H new ATOM 0 HA GLN B 2 -1.469 -43.119 6.424 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -2.173 -41.039 4.315 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -2.993 -42.564 4.585 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -2.925 -40.242 6.549 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -4.245 -40.597 5.452 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -4.626 -40.348 8.233 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -5.098 -41.927 8.870 1.00 0.00 H new ATOM 1268 N ILE B 3 -0.293 -44.235 4.466 1.00 0.00 N ATOM 1269 CA ILE B 3 0.357 -44.941 3.344 1.00 0.00 C ATOM 1270 C ILE B 3 -0.650 -45.834 2.607 1.00 0.00 C ATOM 1271 O ILE B 3 -1.681 -46.221 3.162 1.00 0.00 O ATOM 1272 CB ILE B 3 1.609 -45.742 3.784 1.00 0.00 C ATOM 1273 CG1 ILE B 3 1.265 -46.901 4.750 1.00 0.00 C ATOM 1274 CG2 ILE B 3 2.669 -44.788 4.366 1.00 0.00 C ATOM 1275 CD1 ILE B 3 2.438 -47.844 5.050 1.00 0.00 C ATOM 0 H ILE B 3 -0.776 -44.866 5.105 1.00 0.00 H new ATOM 0 HA ILE B 3 0.712 -44.178 2.651 1.00 0.00 H new ATOM 0 HB ILE B 3 2.030 -46.219 2.899 1.00 0.00 H new ATOM 0 HG12 ILE B 3 0.903 -46.481 5.688 1.00 0.00 H new ATOM 0 HG13 ILE B 3 0.447 -47.482 4.324 1.00 0.00 H new ATOM 0 HG21 ILE B 3 3.545 -45.360 4.672 1.00 0.00 H new ATOM 0 HG22 ILE B 3 2.958 -44.060 3.608 1.00 0.00 H new ATOM 0 HG23 ILE B 3 2.255 -44.268 5.230 1.00 0.00 H new ATOM 0 HD11 ILE B 3 2.110 -48.626 5.734 1.00 0.00 H new ATOM 0 HD12 ILE B 3 2.788 -48.297 4.122 1.00 0.00 H new ATOM 0 HD13 ILE B 3 3.251 -47.280 5.507 1.00 0.00 H new ATOM 1287 N PHE B 4 -0.329 -46.191 1.364 1.00 0.00 N ATOM 1288 CA PHE B 4 -1.123 -47.086 0.523 1.00 0.00 C ATOM 1289 C PHE B 4 -0.411 -48.427 0.325 1.00 0.00 C ATOM 1290 O PHE B 4 0.812 -48.474 0.198 1.00 0.00 O ATOM 1291 CB PHE B 4 -1.411 -46.402 -0.821 1.00 0.00 C ATOM 1292 CG PHE B 4 -2.111 -45.060 -0.698 1.00 0.00 C ATOM 1293 CD1 PHE B 4 -3.415 -44.993 -0.172 1.00 0.00 C ATOM 1294 CD2 PHE B 4 -1.456 -43.878 -1.094 1.00 0.00 C ATOM 1295 CE1 PHE B 4 -4.058 -43.750 -0.035 1.00 0.00 C ATOM 1296 CE2 PHE B 4 -2.103 -42.635 -0.964 1.00 0.00 C ATOM 1297 CZ PHE B 4 -3.403 -42.571 -0.430 1.00 0.00 C ATOM 0 H PHE B 4 0.516 -45.856 0.901 1.00 0.00 H new ATOM 0 HA PHE B 4 -2.071 -47.296 1.019 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -0.470 -46.261 -1.353 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -2.026 -47.065 -1.429 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -3.923 -45.898 0.127 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -0.456 -43.925 -1.498 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -5.056 -43.701 0.374 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -1.602 -41.730 -1.274 1.00 0.00 H new ATOM 0 HZ PHE B 4 -3.897 -41.617 -0.324 1.00 0.00 H new ATOM 1307 N VAL B 5 -1.171 -49.521 0.253 1.00 0.00 N ATOM 1308 CA VAL B 5 -0.659 -50.868 -0.040 1.00 0.00 C ATOM 1309 C VAL B 5 -1.490 -51.491 -1.162 1.00 0.00 C ATOM 1310 O VAL B 5 -2.690 -51.698 -0.992 1.00 0.00 O ATOM 1311 CB VAL B 5 -0.650 -51.771 1.214 1.00 0.00 C ATOM 1312 CG1 VAL B 5 0.103 -53.075 0.926 1.00 0.00 C ATOM 1313 CG2 VAL B 5 0.014 -51.101 2.424 1.00 0.00 C ATOM 0 H VAL B 5 -2.180 -49.499 0.399 1.00 0.00 H new ATOM 0 HA VAL B 5 0.378 -50.779 -0.364 1.00 0.00 H new ATOM 0 HB VAL B 5 -1.695 -51.965 1.454 1.00 0.00 H new ATOM 0 HG11 VAL B 5 0.101 -53.701 1.818 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -0.387 -53.605 0.110 1.00 0.00 H new ATOM 0 HG13 VAL B 5 1.131 -52.847 0.645 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -0.009 -51.782 3.275 1.00 0.00 H new ATOM 0 HG22 VAL B 5 1.048 -50.857 2.182 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -0.525 -50.188 2.676 1.00 0.00 H new ATOM 1323 N LYS B 6 -0.868 -51.792 -2.306 1.00 0.00 N ATOM 1324 CA LYS B 6 -1.514 -52.486 -3.435 1.00 0.00 C ATOM 1325 C LYS B 6 -1.356 -54.002 -3.322 1.00 0.00 C ATOM 1326 O LYS B 6 -0.254 -54.490 -3.079 1.00 0.00 O ATOM 1327 CB LYS B 6 -0.986 -51.945 -4.777 1.00 0.00 C ATOM 1328 CG LYS B 6 -1.838 -50.757 -5.247 1.00 0.00 C ATOM 1329 CD LYS B 6 -1.298 -50.161 -6.558 1.00 0.00 C ATOM 1330 CE LYS B 6 -2.306 -49.241 -7.271 1.00 0.00 C ATOM 1331 NZ LYS B 6 -2.754 -48.089 -6.436 1.00 0.00 N1+ ATOM 0 H LYS B 6 0.110 -51.560 -2.481 1.00 0.00 H new ATOM 0 HA LYS B 6 -2.584 -52.280 -3.397 1.00 0.00 H new ATOM 0 HB2 LYS B 6 0.053 -51.635 -4.668 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -1.006 -52.735 -5.528 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -2.869 -51.081 -5.391 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -1.850 -49.988 -4.474 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.390 -49.597 -6.345 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -1.019 -50.973 -7.230 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -1.854 -48.861 -8.187 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -3.177 -49.827 -7.564 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -3.234 -47.390 -7.038 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -3.412 -48.426 -5.704 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -1.929 -47.647 -5.983 1.00 0.00 H new ATOM 1345 N THR B 7 -2.447 -54.741 -3.510 1.00 0.00 N ATOM 1346 CA THR B 7 -2.482 -56.216 -3.501 1.00 0.00 C ATOM 1347 C THR B 7 -2.160 -56.808 -4.883 1.00 0.00 C ATOM 1348 O THR B 7 -2.194 -56.109 -5.898 1.00 0.00 O ATOM 1349 CB THR B 7 -3.862 -56.731 -3.047 1.00 0.00 C ATOM 1350 OG1 THR B 7 -4.811 -56.406 -4.033 1.00 0.00 O ATOM 1351 CG2 THR B 7 -4.340 -56.141 -1.722 1.00 0.00 C ATOM 0 H THR B 7 -3.363 -54.325 -3.679 1.00 0.00 H new ATOM 0 HA THR B 7 -1.717 -56.540 -2.796 1.00 0.00 H new ATOM 0 HB THR B 7 -3.758 -57.806 -2.902 1.00 0.00 H new ATOM 0 HG1 THR B 7 -5.470 -57.128 -4.103 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.318 -56.553 -1.472 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.629 -56.391 -0.935 1.00 0.00 H new ATOM 0 HG23 THR B 7 -4.415 -55.057 -1.812 1.00 0.00 H new ATOM 1359 N LEU B 8 -1.943 -58.130 -4.951 1.00 0.00 N ATOM 1360 CA LEU B 8 -1.843 -58.857 -6.230 1.00 0.00 C ATOM 1361 C LEU B 8 -3.168 -58.855 -7.023 1.00 0.00 C ATOM 1362 O LEU B 8 -3.150 -58.928 -8.252 1.00 0.00 O ATOM 1363 CB LEU B 8 -1.363 -60.299 -5.967 1.00 0.00 C ATOM 1364 CG LEU B 8 0.062 -60.428 -5.394 1.00 0.00 C ATOM 1365 CD1 LEU B 8 0.446 -61.905 -5.324 1.00 0.00 C ATOM 1366 CD2 LEU B 8 1.101 -59.670 -6.222 1.00 0.00 C ATOM 0 H LEU B 8 -1.832 -58.724 -4.129 1.00 0.00 H new ATOM 0 HA LEU B 8 -1.115 -58.335 -6.851 1.00 0.00 H new ATOM 0 HB2 LEU B 8 -2.059 -60.775 -5.276 1.00 0.00 H new ATOM 0 HB3 LEU B 8 -1.412 -60.856 -6.902 1.00 0.00 H new ATOM 0 HG LEU B 8 0.055 -59.983 -4.399 1.00 0.00 H new ATOM 0 HD11 LEU B 8 1.454 -62.000 -4.919 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -0.256 -62.433 -4.679 1.00 0.00 H new ATOM 0 HD13 LEU B 8 0.415 -62.337 -6.324 1.00 0.00 H new ATOM 0 HD21 LEU B 8 2.086 -59.795 -5.773 1.00 0.00 H new ATOM 0 HD22 LEU B 8 1.113 -60.063 -7.239 1.00 0.00 H new ATOM 0 HD23 LEU B 8 0.845 -58.611 -6.245 1.00 0.00 H new ATOM 1378 N THR B 9 -4.308 -58.712 -6.338 1.00 0.00 N ATOM 1379 CA THR B 9 -5.648 -58.549 -6.941 1.00 0.00 C ATOM 1380 C THR B 9 -5.936 -57.123 -7.443 1.00 0.00 C ATOM 1381 O THR B 9 -7.002 -56.873 -8.010 1.00 0.00 O ATOM 1382 CB THR B 9 -6.746 -59.006 -5.963 1.00 0.00 C ATOM 1383 OG1 THR B 9 -6.601 -58.359 -4.714 1.00 0.00 O ATOM 1384 CG2 THR B 9 -6.674 -60.506 -5.691 1.00 0.00 C ATOM 0 H THR B 9 -4.331 -58.705 -5.318 1.00 0.00 H new ATOM 0 HA THR B 9 -5.656 -59.189 -7.824 1.00 0.00 H new ATOM 0 HB THR B 9 -7.697 -58.754 -6.433 1.00 0.00 H new ATOM 0 HG1 THR B 9 -7.308 -58.660 -4.106 1.00 0.00 H new ATOM 0 HG21 THR B 9 -7.465 -60.788 -4.997 1.00 0.00 H new ATOM 0 HG22 THR B 9 -6.800 -61.052 -6.626 1.00 0.00 H new ATOM 0 HG23 THR B 9 -5.705 -60.751 -5.256 1.00 0.00 H new ATOM 1392 N GLY B 10 -5.001 -56.178 -7.268 1.00 0.00 N ATOM 1393 CA GLY B 10 -5.117 -54.788 -7.732 1.00 0.00 C ATOM 1394 C GLY B 10 -5.943 -53.867 -6.822 1.00 0.00 C ATOM 1395 O GLY B 10 -6.244 -52.733 -7.208 1.00 0.00 O ATOM 0 H GLY B 10 -4.121 -56.364 -6.788 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -4.115 -54.370 -7.834 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -5.565 -54.789 -8.726 1.00 0.00 H new ATOM 1399 N LYS B 11 -6.303 -54.326 -5.615 1.00 0.00 N ATOM 1400 CA LYS B 11 -6.970 -53.526 -4.574 1.00 0.00 C ATOM 1401 C LYS B 11 -5.948 -52.606 -3.897 1.00 0.00 C ATOM 1402 O LYS B 11 -4.823 -53.029 -3.645 1.00 0.00 O ATOM 1403 CB LYS B 11 -7.648 -54.486 -3.576 1.00 0.00 C ATOM 1404 CG LYS B 11 -8.496 -53.777 -2.506 1.00 0.00 C ATOM 1405 CD LYS B 11 -9.118 -54.807 -1.549 1.00 0.00 C ATOM 1406 CE LYS B 11 -9.938 -54.158 -0.423 1.00 0.00 C ATOM 1407 NZ LYS B 11 -11.221 -53.575 -0.910 1.00 0.00 N1+ ATOM 0 H LYS B 11 -6.134 -55.290 -5.327 1.00 0.00 H new ATOM 0 HA LYS B 11 -7.739 -52.886 -5.006 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -8.283 -55.179 -4.128 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -6.881 -55.081 -3.081 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -7.876 -53.078 -1.945 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -9.283 -53.193 -2.984 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -9.759 -55.482 -2.116 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -8.325 -55.414 -1.111 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -10.150 -54.904 0.343 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -9.344 -53.376 0.049 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -11.735 -53.151 -0.112 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -11.022 -52.843 -1.622 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -11.803 -54.324 -1.337 1.00 0.00 H new ATOM 1421 N THR B 12 -6.339 -51.373 -3.568 1.00 0.00 N ATOM 1422 CA THR B 12 -5.514 -50.446 -2.770 1.00 0.00 C ATOM 1423 C THR B 12 -6.080 -50.317 -1.355 1.00 0.00 C ATOM 1424 O THR B 12 -7.187 -49.815 -1.157 1.00 0.00 O ATOM 1425 CB THR B 12 -5.372 -49.073 -3.445 1.00 0.00 C ATOM 1426 OG1 THR B 12 -4.848 -49.236 -4.745 1.00 0.00 O ATOM 1427 CG2 THR B 12 -4.379 -48.173 -2.709 1.00 0.00 C ATOM 0 H THR B 12 -7.239 -50.982 -3.846 1.00 0.00 H new ATOM 0 HA THR B 12 -4.510 -50.865 -2.704 1.00 0.00 H new ATOM 0 HB THR B 12 -6.365 -48.623 -3.444 1.00 0.00 H new ATOM 0 HG1 THR B 12 -5.292 -48.612 -5.357 1.00 0.00 H new ATOM 0 HG21 THR B 12 -4.310 -47.213 -3.220 1.00 0.00 H new ATOM 0 HG22 THR B 12 -4.720 -48.015 -1.686 1.00 0.00 H new ATOM 0 HG23 THR B 12 -3.398 -48.648 -2.695 1.00 0.00 H new ATOM 1435 N ILE B 13 -5.303 -50.763 -0.368 1.00 0.00 N ATOM 1436 CA ILE B 13 -5.568 -50.621 1.070 1.00 0.00 C ATOM 1437 C ILE B 13 -4.937 -49.303 1.544 1.00 0.00 C ATOM 1438 O ILE B 13 -3.825 -48.980 1.128 1.00 0.00 O ATOM 1439 CB ILE B 13 -4.992 -51.842 1.838 1.00 0.00 C ATOM 1440 CG1 ILE B 13 -5.486 -53.197 1.269 1.00 0.00 C ATOM 1441 CG2 ILE B 13 -5.329 -51.750 3.340 1.00 0.00 C ATOM 1442 CD1 ILE B 13 -4.651 -54.395 1.742 1.00 0.00 C ATOM 0 H ILE B 13 -4.430 -51.257 -0.554 1.00 0.00 H new ATOM 0 HA ILE B 13 -6.640 -50.593 1.266 1.00 0.00 H new ATOM 0 HB ILE B 13 -3.911 -51.808 1.704 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -6.525 -53.349 1.562 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -5.464 -53.155 0.180 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -4.916 -52.615 3.859 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -4.898 -50.839 3.754 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -6.411 -51.731 3.470 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -5.050 -55.311 1.307 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -3.616 -54.265 1.426 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -4.693 -54.461 2.829 1.00 0.00 H new ATOM 1454 N THR B 14 -5.599 -48.562 2.437 1.00 0.00 N ATOM 1455 CA THR B 14 -5.008 -47.384 3.113 1.00 0.00 C ATOM 1456 C THR B 14 -4.722 -47.721 4.576 1.00 0.00 C ATOM 1457 O THR B 14 -5.594 -48.266 5.258 1.00 0.00 O ATOM 1458 CB THR B 14 -5.913 -46.144 3.001 1.00 0.00 C ATOM 1459 OG1 THR B 14 -6.278 -45.925 1.654 1.00 0.00 O ATOM 1460 CG2 THR B 14 -5.216 -44.869 3.482 1.00 0.00 C ATOM 0 H THR B 14 -6.560 -48.755 2.718 1.00 0.00 H new ATOM 0 HA THR B 14 -4.072 -47.138 2.612 1.00 0.00 H new ATOM 0 HB THR B 14 -6.782 -46.346 3.628 1.00 0.00 H new ATOM 0 HG1 THR B 14 -5.524 -45.527 1.171 1.00 0.00 H new ATOM 0 HG21 THR B 14 -5.896 -44.023 3.383 1.00 0.00 H new ATOM 0 HG22 THR B 14 -4.929 -44.983 4.527 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.326 -44.691 2.879 1.00 0.00 H new ATOM 1468 N LEU B 15 -3.519 -47.412 5.065 1.00 0.00 N ATOM 1469 CA LEU B 15 -3.076 -47.689 6.438 1.00 0.00 C ATOM 1470 C LEU B 15 -2.599 -46.407 7.134 1.00 0.00 C ATOM 1471 O LEU B 15 -1.790 -45.657 6.582 1.00 0.00 O ATOM 1472 CB LEU B 15 -1.940 -48.734 6.436 1.00 0.00 C ATOM 1473 CG LEU B 15 -2.247 -50.084 5.763 1.00 0.00 C ATOM 1474 CD1 LEU B 15 -1.007 -50.968 5.855 1.00 0.00 C ATOM 1475 CD2 LEU B 15 -3.403 -50.832 6.427 1.00 0.00 C ATOM 0 H LEU B 15 -2.804 -46.949 4.503 1.00 0.00 H new ATOM 0 HA LEU B 15 -3.928 -48.086 6.990 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -1.074 -48.295 5.940 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -1.652 -48.926 7.470 1.00 0.00 H new ATOM 0 HG LEU B 15 -2.530 -49.872 4.732 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -1.209 -51.929 5.382 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -0.175 -50.481 5.347 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -0.750 -51.126 6.902 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -3.572 -51.776 5.908 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -3.157 -51.030 7.470 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -4.306 -50.224 6.377 1.00 0.00 H new ATOM 1487 N GLU B 16 -3.045 -46.201 8.373 1.00 0.00 N ATOM 1488 CA GLU B 16 -2.578 -45.112 9.237 1.00 0.00 C ATOM 1489 C GLU B 16 -1.373 -45.582 10.061 1.00 0.00 C ATOM 1490 O GLU B 16 -1.459 -46.568 10.800 1.00 0.00 O ATOM 1491 CB GLU B 16 -3.737 -44.618 10.111 1.00 0.00 C ATOM 1492 CG GLU B 16 -3.374 -43.343 10.877 1.00 0.00 C ATOM 1493 CD GLU B 16 -4.628 -42.742 11.535 1.00 0.00 C ATOM 1494 OE1 GLU B 16 -5.479 -42.179 10.804 1.00 0.00 O1- ATOM 1495 OE2 GLU B 16 -4.772 -42.831 12.779 1.00 0.00 O ATOM 0 H GLU B 16 -3.750 -46.793 8.813 1.00 0.00 H new ATOM 0 HA GLU B 16 -2.243 -44.267 8.635 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -4.609 -44.429 9.484 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -4.016 -45.399 10.818 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -2.627 -43.568 11.639 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -2.928 -42.617 10.198 1.00 0.00 H new ATOM 1502 N VAL B 17 -0.241 -44.895 9.909 1.00 0.00 N ATOM 1503 CA VAL B 17 1.077 -45.297 10.435 1.00 0.00 C ATOM 1504 C VAL B 17 1.923 -44.075 10.795 1.00 0.00 C ATOM 1505 O VAL B 17 1.669 -42.973 10.312 1.00 0.00 O ATOM 1506 CB VAL B 17 1.863 -46.142 9.402 1.00 0.00 C ATOM 1507 CG1 VAL B 17 1.172 -47.467 9.057 1.00 0.00 C ATOM 1508 CG2 VAL B 17 2.114 -45.386 8.090 1.00 0.00 C ATOM 0 H VAL B 17 -0.208 -44.012 9.400 1.00 0.00 H new ATOM 0 HA VAL B 17 0.888 -45.893 11.328 1.00 0.00 H new ATOM 0 HB VAL B 17 2.812 -46.350 9.895 1.00 0.00 H new ATOM 0 HG11 VAL B 17 1.773 -48.012 8.329 1.00 0.00 H new ATOM 0 HG12 VAL B 17 1.064 -48.067 9.960 1.00 0.00 H new ATOM 0 HG13 VAL B 17 0.187 -47.265 8.636 1.00 0.00 H new ATOM 0 HG21 VAL B 17 2.668 -46.025 7.402 1.00 0.00 H new ATOM 0 HG22 VAL B 17 1.160 -45.111 7.640 1.00 0.00 H new ATOM 0 HG23 VAL B 17 2.692 -44.485 8.294 1.00 0.00 H new ATOM 1518 N GLU B 18 2.964 -44.264 11.594 1.00 0.00 N ATOM 1519 CA GLU B 18 4.009 -43.268 11.865 1.00 0.00 C ATOM 1520 C GLU B 18 5.345 -43.749 11.263 1.00 0.00 C ATOM 1521 O GLU B 18 5.541 -44.957 11.116 1.00 0.00 O ATOM 1522 CB GLU B 18 4.131 -43.022 13.380 1.00 0.00 C ATOM 1523 CG GLU B 18 2.936 -42.258 13.972 1.00 0.00 C ATOM 1524 CD GLU B 18 2.908 -40.786 13.510 1.00 0.00 C ATOM 1525 OE1 GLU B 18 3.588 -39.939 14.142 1.00 0.00 O ATOM 1526 OE2 GLU B 18 2.209 -40.463 12.519 1.00 0.00 O1- ATOM 0 H GLU B 18 3.116 -45.142 12.091 1.00 0.00 H new ATOM 0 HA GLU B 18 3.742 -42.320 11.398 1.00 0.00 H new ATOM 0 HB2 GLU B 18 4.229 -43.981 13.890 1.00 0.00 H new ATOM 0 HB3 GLU B 18 5.045 -42.462 13.577 1.00 0.00 H new ATOM 0 HG2 GLU B 18 2.009 -42.749 13.676 1.00 0.00 H new ATOM 0 HG3 GLU B 18 2.984 -42.296 15.060 1.00 0.00 H new ATOM 1533 N PRO B 19 6.308 -42.861 10.936 1.00 0.00 N ATOM 1534 CA PRO B 19 7.612 -43.275 10.395 1.00 0.00 C ATOM 1535 C PRO B 19 8.381 -44.263 11.297 1.00 0.00 C ATOM 1536 O PRO B 19 9.172 -45.068 10.808 1.00 0.00 O ATOM 1537 CB PRO B 19 8.393 -41.972 10.186 1.00 0.00 C ATOM 1538 CG PRO B 19 7.297 -40.927 9.986 1.00 0.00 C ATOM 1539 CD PRO B 19 6.195 -41.409 10.926 1.00 0.00 C ATOM 0 HA PRO B 19 7.474 -43.832 9.468 1.00 0.00 H new ATOM 0 HB2 PRO B 19 9.019 -41.737 11.047 1.00 0.00 H new ATOM 0 HB3 PRO B 19 9.052 -42.033 9.320 1.00 0.00 H new ATOM 0 HG2 PRO B 19 7.641 -39.926 10.245 1.00 0.00 H new ATOM 0 HG3 PRO B 19 6.958 -40.889 8.951 1.00 0.00 H new ATOM 0 HD2 PRO B 19 6.324 -40.997 11.927 1.00 0.00 H new ATOM 0 HD3 PRO B 19 5.212 -41.093 10.575 1.00 0.00 H new ATOM 1547 N SER B 20 8.113 -44.236 12.606 1.00 0.00 N ATOM 1548 CA SER B 20 8.669 -45.146 13.614 1.00 0.00 C ATOM 1549 C SER B 20 7.988 -46.527 13.692 1.00 0.00 C ATOM 1550 O SER B 20 8.483 -47.393 14.418 1.00 0.00 O ATOM 1551 CB SER B 20 8.630 -44.461 14.985 1.00 0.00 C ATOM 1552 OG SER B 20 7.307 -44.051 15.298 1.00 0.00 O ATOM 0 H SER B 20 7.475 -43.550 13.010 1.00 0.00 H new ATOM 0 HA SER B 20 9.693 -45.353 13.302 1.00 0.00 H new ATOM 0 HB2 SER B 20 8.996 -45.145 15.751 1.00 0.00 H new ATOM 0 HB3 SER B 20 9.295 -43.597 14.986 1.00 0.00 H new ATOM 0 HG SER B 20 7.298 -43.617 16.177 1.00 0.00 H new ATOM 1558 N ASP B 21 6.890 -46.779 12.963 1.00 0.00 N ATOM 1559 CA ASP B 21 6.278 -48.114 12.901 1.00 0.00 C ATOM 1560 C ASP B 21 7.216 -49.133 12.238 1.00 0.00 C ATOM 1561 O ASP B 21 7.838 -48.857 11.206 1.00 0.00 O ATOM 1562 CB ASP B 21 4.926 -48.115 12.166 1.00 0.00 C ATOM 1563 CG ASP B 21 3.753 -47.814 13.107 1.00 0.00 C ATOM 1564 OD1 ASP B 21 3.564 -48.591 14.073 1.00 0.00 O ATOM 1565 OD2 ASP B 21 2.999 -46.846 12.853 1.00 0.00 O1- ATOM 0 H ASP B 21 6.407 -46.073 12.407 1.00 0.00 H new ATOM 0 HA ASP B 21 6.101 -48.405 13.936 1.00 0.00 H new ATOM 0 HB2 ASP B 21 4.948 -47.373 11.368 1.00 0.00 H new ATOM 0 HB3 ASP B 21 4.771 -49.086 11.695 1.00 0.00 H new ATOM 1570 N THR B 22 7.282 -50.334 12.817 1.00 0.00 N ATOM 1571 CA THR B 22 7.992 -51.479 12.238 1.00 0.00 C ATOM 1572 C THR B 22 7.232 -52.067 11.051 1.00 0.00 C ATOM 1573 O THR B 22 6.007 -51.951 10.957 1.00 0.00 O ATOM 1574 CB THR B 22 8.237 -52.583 13.277 1.00 0.00 C ATOM 1575 OG1 THR B 22 7.006 -52.983 13.833 1.00 0.00 O ATOM 1576 CG2 THR B 22 9.151 -52.128 14.413 1.00 0.00 C ATOM 0 H THR B 22 6.839 -50.542 13.712 1.00 0.00 H new ATOM 0 HA THR B 22 8.955 -51.101 11.894 1.00 0.00 H new ATOM 0 HB THR B 22 8.726 -53.407 12.758 1.00 0.00 H new ATOM 0 HG1 THR B 22 7.160 -53.689 14.495 1.00 0.00 H new ATOM 0 HG21 THR B 22 9.290 -52.947 15.118 1.00 0.00 H new ATOM 0 HG22 THR B 22 10.118 -51.832 14.006 1.00 0.00 H new ATOM 0 HG23 THR B 22 8.698 -51.280 14.927 1.00 0.00 H new ATOM 1584 N ILE B 23 7.925 -52.782 10.161 1.00 0.00 N ATOM 1585 CA ILE B 23 7.255 -53.567 9.110 1.00 0.00 C ATOM 1586 C ILE B 23 6.371 -54.660 9.735 1.00 0.00 C ATOM 1587 O ILE B 23 5.297 -54.941 9.215 1.00 0.00 O ATOM 1588 CB ILE B 23 8.285 -54.138 8.113 1.00 0.00 C ATOM 1589 CG1 ILE B 23 9.225 -53.058 7.529 1.00 0.00 C ATOM 1590 CG2 ILE B 23 7.599 -54.902 6.965 1.00 0.00 C ATOM 1591 CD1 ILE B 23 8.536 -51.879 6.825 1.00 0.00 C ATOM 0 H ILE B 23 8.943 -52.836 10.143 1.00 0.00 H new ATOM 0 HA ILE B 23 6.597 -52.910 8.541 1.00 0.00 H new ATOM 0 HB ILE B 23 8.897 -54.831 8.691 1.00 0.00 H new ATOM 0 HG12 ILE B 23 9.841 -52.664 8.338 1.00 0.00 H new ATOM 0 HG13 ILE B 23 9.900 -53.536 6.819 1.00 0.00 H new ATOM 0 HG21 ILE B 23 8.356 -55.290 6.283 1.00 0.00 H new ATOM 0 HG22 ILE B 23 7.020 -55.730 7.374 1.00 0.00 H new ATOM 0 HG23 ILE B 23 6.935 -54.227 6.425 1.00 0.00 H new ATOM 0 HD11 ILE B 23 9.291 -51.185 6.455 1.00 0.00 H new ATOM 0 HD12 ILE B 23 7.944 -52.250 5.989 1.00 0.00 H new ATOM 0 HD13 ILE B 23 7.884 -51.364 7.531 1.00 0.00 H new ATOM 1603 N GLU B 24 6.740 -55.202 10.901 1.00 0.00 N ATOM 1604 CA GLU B 24 5.878 -56.100 11.685 1.00 0.00 C ATOM 1605 C GLU B 24 4.538 -55.440 12.077 1.00 0.00 C ATOM 1606 O GLU B 24 3.485 -56.065 11.927 1.00 0.00 O ATOM 1607 CB GLU B 24 6.657 -56.581 12.921 1.00 0.00 C ATOM 1608 CG GLU B 24 5.901 -57.648 13.720 1.00 0.00 C ATOM 1609 CD GLU B 24 6.754 -58.155 14.898 1.00 0.00 C ATOM 1610 OE1 GLU B 24 6.783 -57.488 15.962 1.00 0.00 O ATOM 1611 OE2 GLU B 24 7.395 -59.229 14.778 1.00 0.00 O1- ATOM 0 H GLU B 24 7.649 -55.031 11.331 1.00 0.00 H new ATOM 0 HA GLU B 24 5.613 -56.957 11.065 1.00 0.00 H new ATOM 0 HB2 GLU B 24 7.619 -56.984 12.605 1.00 0.00 H new ATOM 0 HB3 GLU B 24 6.866 -55.729 13.568 1.00 0.00 H new ATOM 0 HG2 GLU B 24 4.965 -57.233 14.095 1.00 0.00 H new ATOM 0 HG3 GLU B 24 5.642 -58.482 13.068 1.00 0.00 H new ATOM 1618 N ASN B 25 4.535 -54.162 12.486 1.00 0.00 N ATOM 1619 CA ASN B 25 3.295 -53.412 12.734 1.00 0.00 C ATOM 1620 C ASN B 25 2.477 -53.224 11.444 1.00 0.00 C ATOM 1621 O ASN B 25 1.256 -53.357 11.475 1.00 0.00 O ATOM 1622 CB ASN B 25 3.597 -52.047 13.388 1.00 0.00 C ATOM 1623 CG ASN B 25 4.036 -52.109 14.844 1.00 0.00 C ATOM 1624 OD1 ASN B 25 4.174 -53.157 15.464 1.00 0.00 O ATOM 1625 ND2 ASN B 25 4.232 -50.960 15.452 1.00 0.00 N ATOM 0 H ASN B 25 5.385 -53.623 12.653 1.00 0.00 H new ATOM 0 HA ASN B 25 2.693 -54.001 13.426 1.00 0.00 H new ATOM 0 HB2 ASN B 25 4.377 -51.550 12.811 1.00 0.00 H new ATOM 0 HB3 ASN B 25 2.705 -51.424 13.320 1.00 0.00 H new ATOM 0 HD21 ASN B 25 4.498 -50.943 16.437 1.00 0.00 H new ATOM 0 HD22 ASN B 25 4.118 -50.086 14.939 1.00 0.00 H new ATOM 1632 N VAL B 26 3.120 -52.985 10.293 1.00 0.00 N ATOM 1633 CA VAL B 26 2.421 -52.896 8.992 1.00 0.00 C ATOM 1634 C VAL B 26 1.784 -54.241 8.619 1.00 0.00 C ATOM 1635 O VAL B 26 0.610 -54.270 8.248 1.00 0.00 O ATOM 1636 CB VAL B 26 3.343 -52.361 7.875 1.00 0.00 C ATOM 1637 CG1 VAL B 26 2.596 -52.199 6.544 1.00 0.00 C ATOM 1638 CG2 VAL B 26 3.896 -50.975 8.233 1.00 0.00 C ATOM 0 H VAL B 26 4.129 -52.848 10.231 1.00 0.00 H new ATOM 0 HA VAL B 26 1.616 -52.169 9.099 1.00 0.00 H new ATOM 0 HB VAL B 26 4.144 -53.094 7.776 1.00 0.00 H new ATOM 0 HG11 VAL B 26 3.281 -51.820 5.786 1.00 0.00 H new ATOM 0 HG12 VAL B 26 2.203 -53.165 6.228 1.00 0.00 H new ATOM 0 HG13 VAL B 26 1.773 -51.496 6.672 1.00 0.00 H new ATOM 0 HG21 VAL B 26 4.542 -50.622 7.429 1.00 0.00 H new ATOM 0 HG22 VAL B 26 3.070 -50.277 8.367 1.00 0.00 H new ATOM 0 HG23 VAL B 26 4.470 -51.040 9.157 1.00 0.00 H new ATOM 1648 N LYS B 27 2.483 -55.371 8.816 1.00 0.00 N ATOM 1649 CA LYS B 27 1.901 -56.714 8.618 1.00 0.00 C ATOM 1650 C LYS B 27 0.696 -56.963 9.530 1.00 0.00 C ATOM 1651 O LYS B 27 -0.313 -57.492 9.067 1.00 0.00 O ATOM 1652 CB LYS B 27 2.940 -57.828 8.837 1.00 0.00 C ATOM 1653 CG LYS B 27 4.092 -57.875 7.818 1.00 0.00 C ATOM 1654 CD LYS B 27 4.997 -59.074 8.156 1.00 0.00 C ATOM 1655 CE LYS B 27 6.378 -59.059 7.486 1.00 0.00 C ATOM 1656 NZ LYS B 27 6.332 -59.316 6.020 1.00 0.00 N1+ ATOM 0 H LYS B 27 3.458 -55.383 9.114 1.00 0.00 H new ATOM 0 HA LYS B 27 1.565 -56.741 7.581 1.00 0.00 H new ATOM 0 HB2 LYS B 27 3.366 -57.712 9.834 1.00 0.00 H new ATOM 0 HB3 LYS B 27 2.425 -58.788 8.820 1.00 0.00 H new ATOM 0 HG2 LYS B 27 3.698 -57.971 6.806 1.00 0.00 H new ATOM 0 HG3 LYS B 27 4.664 -56.948 7.851 1.00 0.00 H new ATOM 0 HD2 LYS B 27 5.135 -59.111 9.237 1.00 0.00 H new ATOM 0 HD3 LYS B 27 4.481 -59.990 7.869 1.00 0.00 H new ATOM 0 HE2 LYS B 27 6.848 -58.091 7.662 1.00 0.00 H new ATOM 0 HE3 LYS B 27 7.010 -59.811 7.959 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 7.290 -59.527 5.674 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 5.709 -60.126 5.829 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 5.965 -58.474 5.531 1.00 0.00 H new ATOM 1670 N ALA B 28 0.766 -56.543 10.794 1.00 0.00 N ATOM 1671 CA ALA B 28 -0.336 -56.659 11.754 1.00 0.00 C ATOM 1672 C ALA B 28 -1.549 -55.779 11.379 1.00 0.00 C ATOM 1673 O ALA B 28 -2.688 -56.235 11.465 1.00 0.00 O ATOM 1674 CB ALA B 28 0.201 -56.328 13.152 1.00 0.00 C ATOM 0 H ALA B 28 1.600 -56.107 11.186 1.00 0.00 H new ATOM 0 HA ALA B 28 -0.711 -57.682 11.737 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -0.606 -56.409 13.880 1.00 0.00 H new ATOM 0 HB2 ALA B 28 0.996 -57.027 13.411 1.00 0.00 H new ATOM 0 HB3 ALA B 28 0.595 -55.312 13.159 1.00 0.00 H new ATOM 1680 N LYS B 29 -1.323 -54.559 10.872 1.00 0.00 N ATOM 1681 CA LYS B 29 -2.386 -53.674 10.347 1.00 0.00 C ATOM 1682 C LYS B 29 -3.074 -54.269 9.109 1.00 0.00 C ATOM 1683 O LYS B 29 -4.296 -54.204 8.996 1.00 0.00 O ATOM 1684 CB LYS B 29 -1.795 -52.281 10.060 1.00 0.00 C ATOM 1685 CG LYS B 29 -1.488 -51.503 11.351 1.00 0.00 C ATOM 1686 CD LYS B 29 -0.601 -50.279 11.069 1.00 0.00 C ATOM 1687 CE LYS B 29 -0.275 -49.493 12.352 1.00 0.00 C ATOM 1688 NZ LYS B 29 -1.397 -48.607 12.776 1.00 0.00 N1+ ATOM 0 H LYS B 29 -0.391 -54.150 10.812 1.00 0.00 H new ATOM 0 HA LYS B 29 -3.164 -53.578 11.105 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -0.880 -52.389 9.477 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -2.495 -51.709 9.451 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -2.421 -51.180 11.814 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -0.989 -52.160 12.064 1.00 0.00 H new ATOM 0 HD2 LYS B 29 0.327 -50.605 10.598 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -1.105 -49.622 10.360 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -0.045 -50.193 13.155 1.00 0.00 H new ATOM 0 HE3 LYS B 29 0.618 -48.890 12.189 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -1.187 -48.204 13.711 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -1.512 -47.838 12.085 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -2.276 -49.160 12.828 1.00 0.00 H new ATOM 1702 N ILE B 30 -2.318 -54.931 8.226 1.00 0.00 N ATOM 1703 CA ILE B 30 -2.868 -55.688 7.083 1.00 0.00 C ATOM 1704 C ILE B 30 -3.633 -56.933 7.563 1.00 0.00 C ATOM 1705 O ILE B 30 -4.725 -57.199 7.067 1.00 0.00 O ATOM 1706 CB ILE B 30 -1.746 -56.035 6.076 1.00 0.00 C ATOM 1707 CG1 ILE B 30 -1.191 -54.741 5.439 1.00 0.00 C ATOM 1708 CG2 ILE B 30 -2.242 -56.990 4.971 1.00 0.00 C ATOM 1709 CD1 ILE B 30 0.142 -54.934 4.708 1.00 0.00 C ATOM 0 H ILE B 30 -1.300 -54.960 8.280 1.00 0.00 H new ATOM 0 HA ILE B 30 -3.590 -55.061 6.560 1.00 0.00 H new ATOM 0 HB ILE B 30 -0.954 -56.544 6.626 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -1.926 -54.349 4.737 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -1.062 -53.990 6.218 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -1.424 -57.209 4.285 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -2.594 -57.917 5.423 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -3.059 -56.520 4.423 1.00 0.00 H new ATOM 0 HD11 ILE B 30 0.468 -53.982 4.288 1.00 0.00 H new ATOM 0 HD12 ILE B 30 0.893 -55.296 5.410 1.00 0.00 H new ATOM 0 HD13 ILE B 30 0.015 -55.661 3.905 1.00 0.00 H new ATOM 1721 N GLN B 31 -3.125 -57.664 8.562 1.00 0.00 N ATOM 1722 CA GLN B 31 -3.822 -58.813 9.160 1.00 0.00 C ATOM 1723 C GLN B 31 -5.172 -58.395 9.778 1.00 0.00 C ATOM 1724 O GLN B 31 -6.168 -59.092 9.598 1.00 0.00 O ATOM 1725 CB GLN B 31 -2.911 -59.476 10.209 1.00 0.00 C ATOM 1726 CG GLN B 31 -3.502 -60.781 10.778 1.00 0.00 C ATOM 1727 CD GLN B 31 -2.675 -61.384 11.918 1.00 0.00 C ATOM 1728 OE1 GLN B 31 -1.748 -60.793 12.458 1.00 0.00 O ATOM 1729 NE2 GLN B 31 -2.985 -62.594 12.335 1.00 0.00 N ATOM 0 H GLN B 31 -2.215 -57.476 8.982 1.00 0.00 H new ATOM 0 HA GLN B 31 -4.043 -59.536 8.375 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -1.941 -59.688 9.759 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -2.736 -58.776 11.026 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -4.512 -60.586 11.137 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -3.585 -61.513 9.974 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -3.754 -63.103 11.898 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -2.456 -63.023 13.095 1.00 0.00 H new ATOM 1738 N ASP B 32 -5.235 -57.242 10.448 1.00 0.00 N ATOM 1739 CA ASP B 32 -6.467 -56.722 11.056 1.00 0.00 C ATOM 1740 C ASP B 32 -7.555 -56.357 10.022 1.00 0.00 C ATOM 1741 O ASP B 32 -8.742 -56.570 10.285 1.00 0.00 O ATOM 1742 CB ASP B 32 -6.114 -55.514 11.932 1.00 0.00 C ATOM 1743 CG ASP B 32 -7.336 -54.998 12.708 1.00 0.00 C ATOM 1744 OD1 ASP B 32 -7.776 -55.681 13.665 1.00 0.00 O ATOM 1745 OD2 ASP B 32 -7.848 -53.899 12.382 1.00 0.00 O1- ATOM 0 H ASP B 32 -4.426 -56.636 10.586 1.00 0.00 H new ATOM 0 HA ASP B 32 -6.900 -57.517 11.663 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -5.328 -55.791 12.634 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -5.716 -54.715 11.307 1.00 0.00 H new ATOM 1750 N LYS B 33 -7.165 -55.855 8.836 1.00 0.00 N ATOM 1751 CA LYS B 33 -8.099 -55.480 7.756 1.00 0.00 C ATOM 1752 C LYS B 33 -8.456 -56.629 6.802 1.00 0.00 C ATOM 1753 O LYS B 33 -9.622 -56.772 6.430 1.00 0.00 O ATOM 1754 CB LYS B 33 -7.559 -54.267 6.976 1.00 0.00 C ATOM 1755 CG LYS B 33 -7.550 -52.989 7.832 1.00 0.00 C ATOM 1756 CD LYS B 33 -7.359 -51.730 6.972 1.00 0.00 C ATOM 1757 CE LYS B 33 -7.415 -50.483 7.867 1.00 0.00 C ATOM 1758 NZ LYS B 33 -7.577 -49.229 7.077 1.00 0.00 N1+ ATOM 0 H LYS B 33 -6.186 -55.697 8.598 1.00 0.00 H new ATOM 0 HA LYS B 33 -9.034 -55.213 8.249 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -6.547 -54.479 6.631 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -8.171 -54.105 6.089 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -8.487 -52.914 8.384 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -6.750 -53.051 8.570 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -6.402 -51.774 6.452 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -8.135 -51.677 6.208 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -8.244 -50.578 8.568 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -6.502 -50.422 8.459 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -7.661 -48.419 7.724 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -6.749 -49.097 6.462 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -8.435 -49.295 6.493 1.00 0.00 H new ATOM 1772 N GLU B 34 -7.479 -57.453 6.417 1.00 0.00 N ATOM 1773 CA GLU B 34 -7.614 -58.462 5.350 1.00 0.00 C ATOM 1774 C GLU B 34 -7.604 -59.925 5.841 1.00 0.00 C ATOM 1775 O GLU B 34 -7.930 -60.832 5.072 1.00 0.00 O ATOM 1776 CB GLU B 34 -6.491 -58.265 4.315 1.00 0.00 C ATOM 1777 CG GLU B 34 -6.430 -56.871 3.675 1.00 0.00 C ATOM 1778 CD GLU B 34 -7.741 -56.490 2.955 1.00 0.00 C ATOM 1779 OE1 GLU B 34 -8.169 -57.227 2.034 1.00 0.00 O ATOM 1780 OE2 GLU B 34 -8.346 -55.445 3.297 1.00 0.00 O1- ATOM 0 H GLU B 34 -6.552 -57.442 6.843 1.00 0.00 H new ATOM 0 HA GLU B 34 -8.598 -58.300 4.910 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -5.535 -58.468 4.797 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -6.613 -59.005 3.524 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -6.215 -56.131 4.446 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -5.606 -56.838 2.962 1.00 0.00 H new ATOM 1787 N GLY B 35 -7.218 -60.180 7.097 1.00 0.00 N ATOM 1788 CA GLY B 35 -7.109 -61.529 7.675 1.00 0.00 C ATOM 1789 C GLY B 35 -5.879 -62.341 7.234 1.00 0.00 C ATOM 1790 O GLY B 35 -5.777 -63.519 7.579 1.00 0.00 O ATOM 0 H GLY B 35 -6.967 -59.441 7.754 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -7.093 -61.440 8.761 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -8.006 -62.091 7.414 1.00 0.00 H new ATOM 1794 N ILE B 36 -4.945 -61.742 6.478 1.00 0.00 N ATOM 1795 CA ILE B 36 -3.767 -62.431 5.913 1.00 0.00 C ATOM 1796 C ILE B 36 -2.705 -62.636 7.016 1.00 0.00 C ATOM 1797 O ILE B 36 -2.246 -61.636 7.577 1.00 0.00 O ATOM 1798 CB ILE B 36 -3.168 -61.640 4.718 1.00 0.00 C ATOM 1799 CG1 ILE B 36 -4.211 -61.289 3.627 1.00 0.00 C ATOM 1800 CG2 ILE B 36 -2.034 -62.465 4.072 1.00 0.00 C ATOM 1801 CD1 ILE B 36 -3.764 -60.130 2.722 1.00 0.00 C ATOM 0 H ILE B 36 -4.985 -60.752 6.237 1.00 0.00 H new ATOM 0 HA ILE B 36 -4.085 -63.403 5.536 1.00 0.00 H new ATOM 0 HB ILE B 36 -2.795 -60.700 5.124 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -4.398 -62.170 3.014 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -5.155 -61.027 4.105 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -1.613 -61.911 3.233 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -1.255 -62.653 4.810 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -2.433 -63.415 3.716 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -4.535 -59.931 1.978 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -3.604 -59.237 3.327 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -2.835 -60.399 2.218 1.00 0.00 H new ATOM 1813 N PRO B 37 -2.250 -63.869 7.318 1.00 0.00 N ATOM 1814 CA PRO B 37 -1.219 -64.111 8.333 1.00 0.00 C ATOM 1815 C PRO B 37 0.113 -63.413 7.995 1.00 0.00 C ATOM 1816 O PRO B 37 0.541 -63.490 6.842 1.00 0.00 O ATOM 1817 CB PRO B 37 -1.044 -65.635 8.397 1.00 0.00 C ATOM 1818 CG PRO B 37 -2.378 -66.169 7.881 1.00 0.00 C ATOM 1819 CD PRO B 37 -2.762 -65.140 6.823 1.00 0.00 C ATOM 0 HA PRO B 37 -1.523 -63.697 9.294 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -0.211 -65.970 7.778 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -0.842 -65.974 9.413 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -2.278 -67.168 7.457 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -3.123 -66.232 8.674 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -2.326 -65.389 5.856 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -3.843 -65.102 6.686 1.00 0.00 H new ATOM 1827 N PRO B 38 0.822 -62.781 8.953 1.00 0.00 N ATOM 1828 CA PRO B 38 2.100 -62.098 8.703 1.00 0.00 C ATOM 1829 C PRO B 38 3.171 -62.970 8.027 1.00 0.00 C ATOM 1830 O PRO B 38 3.916 -62.481 7.180 1.00 0.00 O ATOM 1831 CB PRO B 38 2.564 -61.611 10.081 1.00 0.00 C ATOM 1832 CG PRO B 38 1.247 -61.346 10.804 1.00 0.00 C ATOM 1833 CD PRO B 38 0.371 -62.495 10.308 1.00 0.00 C ATOM 0 HA PRO B 38 1.952 -61.288 7.989 1.00 0.00 H new ATOM 0 HB2 PRO B 38 3.164 -62.362 10.595 1.00 0.00 H new ATOM 0 HB3 PRO B 38 3.174 -60.711 10.008 1.00 0.00 H new ATOM 0 HG2 PRO B 38 1.366 -61.363 11.887 1.00 0.00 H new ATOM 0 HG3 PRO B 38 0.829 -60.373 10.545 1.00 0.00 H new ATOM 0 HD2 PRO B 38 0.476 -63.371 10.948 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -0.683 -62.216 10.319 1.00 0.00 H new ATOM 1841 N ASP B 39 3.197 -64.274 8.323 1.00 0.00 N ATOM 1842 CA ASP B 39 4.106 -65.251 7.698 1.00 0.00 C ATOM 1843 C ASP B 39 3.842 -65.469 6.191 1.00 0.00 C ATOM 1844 O ASP B 39 4.730 -65.926 5.468 1.00 0.00 O ATOM 1845 CB ASP B 39 3.991 -66.589 8.443 1.00 0.00 C ATOM 1846 CG ASP B 39 4.482 -66.490 9.895 1.00 0.00 C ATOM 1847 OD1 ASP B 39 5.716 -66.536 10.121 1.00 0.00 O ATOM 1848 OD2 ASP B 39 3.636 -66.381 10.815 1.00 0.00 O1- ATOM 0 H ASP B 39 2.576 -64.691 9.016 1.00 0.00 H new ATOM 0 HA ASP B 39 5.114 -64.843 7.775 1.00 0.00 H new ATOM 0 HB2 ASP B 39 2.952 -66.919 8.434 1.00 0.00 H new ATOM 0 HB3 ASP B 39 4.571 -67.347 7.916 1.00 0.00 H new ATOM 1853 N GLN B 40 2.640 -65.126 5.707 1.00 0.00 N ATOM 1854 CA GLN B 40 2.229 -65.220 4.298 1.00 0.00 C ATOM 1855 C GLN B 40 2.334 -63.878 3.543 1.00 0.00 C ATOM 1856 O GLN B 40 2.100 -63.838 2.335 1.00 0.00 O ATOM 1857 CB GLN B 40 0.801 -65.794 4.217 1.00 0.00 C ATOM 1858 CG GLN B 40 0.693 -67.210 4.817 1.00 0.00 C ATOM 1859 CD GLN B 40 -0.695 -67.840 4.669 1.00 0.00 C ATOM 1860 OE1 GLN B 40 -1.614 -67.307 4.060 1.00 0.00 O ATOM 1861 NE2 GLN B 40 -0.901 -69.016 5.226 1.00 0.00 N ATOM 0 H GLN B 40 1.900 -64.762 6.307 1.00 0.00 H new ATOM 0 HA GLN B 40 2.925 -65.894 3.798 1.00 0.00 H new ATOM 0 HB2 GLN B 40 0.116 -65.128 4.742 1.00 0.00 H new ATOM 0 HB3 GLN B 40 0.483 -65.820 3.175 1.00 0.00 H new ATOM 0 HG2 GLN B 40 1.428 -67.855 4.336 1.00 0.00 H new ATOM 0 HG3 GLN B 40 0.951 -67.167 5.875 1.00 0.00 H new ATOM 0 HE21 GLN B 40 -0.149 -69.477 5.738 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -1.813 -69.466 5.146 1.00 0.00 H new ATOM 1870 N GLN B 41 2.688 -62.782 4.228 1.00 0.00 N ATOM 1871 CA GLN B 41 2.816 -61.440 3.645 1.00 0.00 C ATOM 1872 C GLN B 41 4.273 -61.085 3.311 1.00 0.00 C ATOM 1873 O GLN B 41 5.134 -61.101 4.194 1.00 0.00 O ATOM 1874 CB GLN B 41 2.287 -60.378 4.625 1.00 0.00 C ATOM 1875 CG GLN B 41 0.797 -60.458 4.994 1.00 0.00 C ATOM 1876 CD GLN B 41 0.423 -59.324 5.948 1.00 0.00 C ATOM 1877 OE1 GLN B 41 0.896 -58.209 5.820 1.00 0.00 O ATOM 1878 NE2 GLN B 41 -0.401 -59.541 6.951 1.00 0.00 N ATOM 0 H GLN B 41 2.898 -62.805 5.226 1.00 0.00 H new ATOM 0 HA GLN B 41 2.232 -61.448 2.724 1.00 0.00 H new ATOM 0 HB2 GLN B 41 2.869 -60.444 5.544 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.479 -59.394 4.196 1.00 0.00 H new ATOM 0 HG2 GLN B 41 0.189 -60.398 4.092 1.00 0.00 H new ATOM 0 HG3 GLN B 41 0.582 -61.420 5.460 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -0.812 -60.465 7.083 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -0.629 -58.785 7.597 1.00 0.00 H new ATOM 1887 N ARG B 42 4.538 -60.644 2.077 1.00 0.00 N ATOM 1888 CA ARG B 42 5.819 -60.050 1.642 1.00 0.00 C ATOM 1889 C ARG B 42 5.555 -58.622 1.159 1.00 0.00 C ATOM 1890 O ARG B 42 4.754 -58.425 0.252 1.00 0.00 O ATOM 1891 CB ARG B 42 6.457 -60.919 0.541 1.00 0.00 C ATOM 1892 CG ARG B 42 7.009 -62.245 1.084 1.00 0.00 C ATOM 1893 CD ARG B 42 7.670 -63.043 -0.045 1.00 0.00 C ATOM 1894 NE ARG B 42 8.281 -64.290 0.460 1.00 0.00 N ATOM 1895 CZ ARG B 42 9.177 -65.039 -0.159 1.00 0.00 C ATOM 1896 NH1 ARG B 42 9.631 -64.740 -1.345 1.00 0.00 N1+ ATOM 1897 NH2 ARG B 42 9.640 -66.118 0.406 1.00 0.00 N ATOM 0 H ARG B 42 3.850 -60.689 1.326 1.00 0.00 H new ATOM 0 HA ARG B 42 6.525 -60.013 2.472 1.00 0.00 H new ATOM 0 HB2 ARG B 42 5.714 -61.127 -0.229 1.00 0.00 H new ATOM 0 HB3 ARG B 42 7.263 -60.362 0.064 1.00 0.00 H new ATOM 0 HG2 ARG B 42 7.734 -62.050 1.874 1.00 0.00 H new ATOM 0 HG3 ARG B 42 6.203 -62.829 1.528 1.00 0.00 H new ATOM 0 HD2 ARG B 42 6.927 -63.283 -0.806 1.00 0.00 H new ATOM 0 HD3 ARG B 42 8.433 -62.431 -0.526 1.00 0.00 H new ATOM 0 HE ARG B 42 7.980 -64.606 1.382 1.00 0.00 H new ATOM 0 HH11 ARG B 42 9.294 -63.905 -1.824 1.00 0.00 H new ATOM 0 HH12 ARG B 42 10.323 -65.341 -1.793 1.00 0.00 H new ATOM 0 HH21 ARG B 42 9.311 -66.390 1.332 1.00 0.00 H new ATOM 0 HH22 ARG B 42 10.331 -66.691 -0.078 1.00 0.00 H new ATOM 1911 N LEU B 43 6.191 -57.624 1.774 1.00 0.00 N ATOM 1912 CA LEU B 43 6.008 -56.204 1.439 1.00 0.00 C ATOM 1913 C LEU B 43 7.220 -55.675 0.674 1.00 0.00 C ATOM 1914 O LEU B 43 8.360 -55.890 1.083 1.00 0.00 O ATOM 1915 CB LEU B 43 5.738 -55.384 2.718 1.00 0.00 C ATOM 1916 CG LEU B 43 4.314 -55.548 3.282 1.00 0.00 C ATOM 1917 CD1 LEU B 43 4.247 -54.957 4.690 1.00 0.00 C ATOM 1918 CD2 LEU B 43 3.280 -54.826 2.416 1.00 0.00 C ATOM 0 H LEU B 43 6.858 -57.778 2.530 1.00 0.00 H new ATOM 0 HA LEU B 43 5.139 -56.101 0.789 1.00 0.00 H new ATOM 0 HB2 LEU B 43 6.456 -55.678 3.483 1.00 0.00 H new ATOM 0 HB3 LEU B 43 5.913 -54.330 2.504 1.00 0.00 H new ATOM 0 HG LEU B 43 4.088 -56.614 3.294 1.00 0.00 H new ATOM 0 HD11 LEU B 43 3.238 -55.074 5.086 1.00 0.00 H new ATOM 0 HD12 LEU B 43 4.954 -55.477 5.337 1.00 0.00 H new ATOM 0 HD13 LEU B 43 4.501 -53.898 4.652 1.00 0.00 H new ATOM 0 HD21 LEU B 43 2.287 -54.963 2.844 1.00 0.00 H new ATOM 0 HD22 LEU B 43 3.515 -53.762 2.379 1.00 0.00 H new ATOM 0 HD23 LEU B 43 3.300 -55.237 1.407 1.00 0.00 H new ATOM 1930 N ILE B 44 6.963 -54.989 -0.436 1.00 0.00 N ATOM 1931 CA ILE B 44 7.961 -54.375 -1.314 1.00 0.00 C ATOM 1932 C ILE B 44 7.703 -52.858 -1.387 1.00 0.00 C ATOM 1933 O ILE B 44 6.555 -52.419 -1.413 1.00 0.00 O ATOM 1934 CB ILE B 44 7.950 -55.068 -2.706 1.00 0.00 C ATOM 1935 CG1 ILE B 44 8.477 -56.526 -2.695 1.00 0.00 C ATOM 1936 CG2 ILE B 44 8.810 -54.301 -3.729 1.00 0.00 C ATOM 1937 CD1 ILE B 44 7.522 -57.592 -2.140 1.00 0.00 C ATOM 0 H ILE B 44 6.010 -54.838 -0.765 1.00 0.00 H new ATOM 0 HA ILE B 44 8.964 -54.515 -0.912 1.00 0.00 H new ATOM 0 HB ILE B 44 6.896 -55.071 -2.984 1.00 0.00 H new ATOM 0 HG12 ILE B 44 8.741 -56.802 -3.716 1.00 0.00 H new ATOM 0 HG13 ILE B 44 9.396 -56.553 -2.110 1.00 0.00 H new ATOM 0 HG21 ILE B 44 8.778 -54.815 -4.690 1.00 0.00 H new ATOM 0 HG22 ILE B 44 8.421 -53.290 -3.846 1.00 0.00 H new ATOM 0 HG23 ILE B 44 9.840 -54.255 -3.376 1.00 0.00 H new ATOM 0 HD11 ILE B 44 8.002 -58.569 -2.185 1.00 0.00 H new ATOM 0 HD12 ILE B 44 7.275 -57.356 -1.105 1.00 0.00 H new ATOM 0 HD13 ILE B 44 6.609 -57.609 -2.736 1.00 0.00 H new ATOM 1949 N PHE B 45 8.767 -52.055 -1.441 1.00 0.00 N ATOM 1950 CA PHE B 45 8.724 -50.615 -1.728 1.00 0.00 C ATOM 1951 C PHE B 45 9.904 -50.231 -2.630 1.00 0.00 C ATOM 1952 O PHE B 45 11.030 -50.673 -2.401 1.00 0.00 O ATOM 1953 CB PHE B 45 8.747 -49.808 -0.423 1.00 0.00 C ATOM 1954 CG PHE B 45 8.825 -48.307 -0.618 1.00 0.00 C ATOM 1955 CD1 PHE B 45 7.698 -47.597 -1.070 1.00 0.00 C ATOM 1956 CD2 PHE B 45 10.033 -47.621 -0.379 1.00 0.00 C ATOM 1957 CE1 PHE B 45 7.779 -46.210 -1.291 1.00 0.00 C ATOM 1958 CE2 PHE B 45 10.110 -46.233 -0.586 1.00 0.00 C ATOM 1959 CZ PHE B 45 8.983 -45.527 -1.044 1.00 0.00 C ATOM 0 H PHE B 45 9.714 -52.398 -1.281 1.00 0.00 H new ATOM 0 HA PHE B 45 7.796 -50.382 -2.250 1.00 0.00 H new ATOM 0 HB2 PHE B 45 7.850 -50.042 0.151 1.00 0.00 H new ATOM 0 HB3 PHE B 45 9.600 -50.130 0.174 1.00 0.00 H new ATOM 0 HD1 PHE B 45 6.769 -48.118 -1.248 1.00 0.00 H new ATOM 0 HD2 PHE B 45 10.902 -48.163 -0.036 1.00 0.00 H new ATOM 0 HE1 PHE B 45 6.916 -45.669 -1.651 1.00 0.00 H new ATOM 0 HE2 PHE B 45 11.034 -45.709 -0.393 1.00 0.00 H new ATOM 0 HZ PHE B 45 9.042 -44.461 -1.206 1.00 0.00 H new ATOM 1969 N ALA B 46 9.652 -49.434 -3.674 1.00 0.00 N ATOM 1970 CA ALA B 46 10.641 -49.049 -4.687 1.00 0.00 C ATOM 1971 C ALA B 46 11.438 -50.240 -5.286 1.00 0.00 C ATOM 1972 O ALA B 46 12.622 -50.119 -5.609 1.00 0.00 O ATOM 1973 CB ALA B 46 11.509 -47.911 -4.122 1.00 0.00 C ATOM 0 H ALA B 46 8.731 -49.029 -3.842 1.00 0.00 H new ATOM 0 HA ALA B 46 10.115 -48.671 -5.564 1.00 0.00 H new ATOM 0 HB1 ALA B 46 12.249 -47.615 -4.865 1.00 0.00 H new ATOM 0 HB2 ALA B 46 10.876 -47.057 -3.879 1.00 0.00 H new ATOM 0 HB3 ALA B 46 12.017 -48.254 -3.221 1.00 0.00 H new ATOM 1979 N GLY B 47 10.796 -51.412 -5.399 1.00 0.00 N ATOM 1980 CA GLY B 47 11.405 -52.666 -5.871 1.00 0.00 C ATOM 1981 C GLY B 47 12.252 -53.439 -4.839 1.00 0.00 C ATOM 1982 O GLY B 47 12.773 -54.504 -5.174 1.00 0.00 O ATOM 0 H GLY B 47 9.811 -51.517 -5.158 1.00 0.00 H new ATOM 0 HA2 GLY B 47 10.609 -53.323 -6.223 1.00 0.00 H new ATOM 0 HA3 GLY B 47 12.035 -52.439 -6.731 1.00 0.00 H new ATOM 1986 N LYS B 48 12.378 -52.948 -3.596 1.00 0.00 N ATOM 1987 CA LYS B 48 13.120 -53.584 -2.484 1.00 0.00 C ATOM 1988 C LYS B 48 12.166 -54.249 -1.486 1.00 0.00 C ATOM 1989 O LYS B 48 11.155 -53.655 -1.119 1.00 0.00 O ATOM 1990 CB LYS B 48 13.991 -52.533 -1.768 1.00 0.00 C ATOM 1991 CG LYS B 48 15.042 -51.896 -2.695 1.00 0.00 C ATOM 1992 CD LYS B 48 15.946 -50.888 -1.968 1.00 0.00 C ATOM 1993 CE LYS B 48 15.171 -49.650 -1.490 1.00 0.00 C ATOM 1994 NZ LYS B 48 16.080 -48.641 -0.877 1.00 0.00 N1+ ATOM 0 H LYS B 48 11.951 -52.063 -3.322 1.00 0.00 H new ATOM 0 HA LYS B 48 13.760 -54.361 -2.902 1.00 0.00 H new ATOM 0 HB2 LYS B 48 13.349 -51.751 -1.363 1.00 0.00 H new ATOM 0 HB3 LYS B 48 14.495 -53.001 -0.922 1.00 0.00 H new ATOM 0 HG2 LYS B 48 15.659 -52.682 -3.131 1.00 0.00 H new ATOM 0 HG3 LYS B 48 14.536 -51.394 -3.520 1.00 0.00 H new ATOM 0 HD2 LYS B 48 16.414 -51.374 -1.112 1.00 0.00 H new ATOM 0 HD3 LYS B 48 16.749 -50.576 -2.636 1.00 0.00 H new ATOM 0 HE2 LYS B 48 14.643 -49.202 -2.332 1.00 0.00 H new ATOM 0 HE3 LYS B 48 14.416 -49.950 -0.764 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 15.525 -47.818 -0.565 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 16.565 -49.062 -0.059 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 16.785 -48.337 -1.579 1.00 0.00 H new ATOM 2008 N GLN B 49 12.482 -55.460 -1.020 1.00 0.00 N ATOM 2009 CA GLN B 49 11.681 -56.174 -0.013 1.00 0.00 C ATOM 2010 C GLN B 49 11.989 -55.677 1.413 1.00 0.00 C ATOM 2011 O GLN B 49 13.141 -55.390 1.747 1.00 0.00 O ATOM 2012 CB GLN B 49 11.882 -57.690 -0.175 1.00 0.00 C ATOM 2013 CG GLN B 49 10.871 -58.513 0.641 1.00 0.00 C ATOM 2014 CD GLN B 49 11.013 -60.011 0.374 1.00 0.00 C ATOM 2015 OE1 GLN B 49 10.296 -60.596 -0.425 1.00 0.00 O ATOM 2016 NE2 GLN B 49 11.943 -60.687 1.018 1.00 0.00 N ATOM 0 H GLN B 49 13.304 -55.978 -1.330 1.00 0.00 H new ATOM 0 HA GLN B 49 10.625 -55.959 -0.177 1.00 0.00 H new ATOM 0 HB2 GLN B 49 11.793 -57.954 -1.229 1.00 0.00 H new ATOM 0 HB3 GLN B 49 12.893 -57.954 0.135 1.00 0.00 H new ATOM 0 HG2 GLN B 49 11.016 -58.318 1.703 1.00 0.00 H new ATOM 0 HG3 GLN B 49 9.858 -58.194 0.394 1.00 0.00 H new ATOM 0 HE21 GLN B 49 12.548 -60.211 1.687 1.00 0.00 H new ATOM 0 HE22 GLN B 49 12.058 -61.686 0.847 1.00 0.00 H new ATOM 2025 N LEU B 50 10.952 -55.575 2.251 1.00 0.00 N ATOM 2026 CA LEU B 50 10.996 -54.963 3.585 1.00 0.00 C ATOM 2027 C LEU B 50 11.036 -56.023 4.707 1.00 0.00 C ATOM 2028 O LEU B 50 10.434 -57.091 4.582 1.00 0.00 O ATOM 2029 CB LEU B 50 9.813 -53.983 3.730 1.00 0.00 C ATOM 2030 CG LEU B 50 9.616 -52.982 2.571 1.00 0.00 C ATOM 2031 CD1 LEU B 50 8.462 -52.034 2.905 1.00 0.00 C ATOM 2032 CD2 LEU B 50 10.862 -52.144 2.302 1.00 0.00 C ATOM 0 H LEU B 50 10.026 -55.929 2.011 1.00 0.00 H new ATOM 0 HA LEU B 50 11.923 -54.400 3.691 1.00 0.00 H new ATOM 0 HB2 LEU B 50 8.897 -54.564 3.841 1.00 0.00 H new ATOM 0 HB3 LEU B 50 9.946 -53.418 4.653 1.00 0.00 H new ATOM 0 HG LEU B 50 9.402 -53.569 1.678 1.00 0.00 H new ATOM 0 HD11 LEU B 50 8.323 -51.327 2.087 1.00 0.00 H new ATOM 0 HD12 LEU B 50 7.547 -52.610 3.046 1.00 0.00 H new ATOM 0 HD13 LEU B 50 8.692 -51.489 3.820 1.00 0.00 H new ATOM 0 HD21 LEU B 50 10.668 -51.458 1.478 1.00 0.00 H new ATOM 0 HD22 LEU B 50 11.118 -51.575 3.196 1.00 0.00 H new ATOM 0 HD23 LEU B 50 11.692 -52.800 2.040 1.00 0.00 H new ATOM 2044 N GLU B 51 11.736 -55.728 5.807 1.00 0.00 N ATOM 2045 CA GLU B 51 12.062 -56.685 6.883 1.00 0.00 C ATOM 2046 C GLU B 51 11.412 -56.322 8.232 1.00 0.00 C ATOM 2047 O GLU B 51 11.421 -55.164 8.643 1.00 0.00 O ATOM 2048 CB GLU B 51 13.588 -56.783 7.053 1.00 0.00 C ATOM 2049 CG GLU B 51 14.304 -57.304 5.799 1.00 0.00 C ATOM 2050 CD GLU B 51 15.820 -57.420 6.043 1.00 0.00 C ATOM 2051 OE1 GLU B 51 16.278 -58.476 6.546 1.00 0.00 O1- ATOM 2052 OE2 GLU B 51 16.567 -56.462 5.725 1.00 0.00 O ATOM 0 H GLU B 51 12.104 -54.793 5.984 1.00 0.00 H new ATOM 0 HA GLU B 51 11.652 -57.649 6.581 1.00 0.00 H new ATOM 0 HB2 GLU B 51 13.983 -55.799 7.306 1.00 0.00 H new ATOM 0 HB3 GLU B 51 13.812 -57.442 7.892 1.00 0.00 H new ATOM 0 HG2 GLU B 51 13.900 -58.278 5.522 1.00 0.00 H new ATOM 0 HG3 GLU B 51 14.116 -56.632 4.962 1.00 0.00 H new ATOM 2059 N ASP B 52 10.892 -57.324 8.951 1.00 0.00 N ATOM 2060 CA ASP B 52 10.063 -57.177 10.164 1.00 0.00 C ATOM 2061 C ASP B 52 10.653 -56.249 11.239 1.00 0.00 C ATOM 2062 O ASP B 52 9.928 -55.434 11.813 1.00 0.00 O ATOM 2063 CB ASP B 52 9.849 -58.565 10.790 1.00 0.00 C ATOM 2064 CG ASP B 52 8.874 -59.423 9.977 1.00 0.00 C ATOM 2065 OD1 ASP B 52 9.300 -60.033 8.967 1.00 0.00 O ATOM 2066 OD2 ASP B 52 7.678 -59.478 10.347 1.00 0.00 O1- ATOM 0 H ASP B 52 11.040 -58.301 8.697 1.00 0.00 H new ATOM 0 HA ASP B 52 9.132 -56.716 9.835 1.00 0.00 H new ATOM 0 HB2 ASP B 52 10.807 -59.079 10.865 1.00 0.00 H new ATOM 0 HB3 ASP B 52 9.469 -58.449 11.805 1.00 0.00 H new ATOM 2071 N GLY B 53 11.960 -56.370 11.503 1.00 0.00 N ATOM 2072 CA GLY B 53 12.676 -55.623 12.545 1.00 0.00 C ATOM 2073 C GLY B 53 13.090 -54.195 12.161 1.00 0.00 C ATOM 2074 O GLY B 53 13.636 -53.476 13.003 1.00 0.00 O ATOM 0 H GLY B 53 12.565 -57.007 10.984 1.00 0.00 H new ATOM 0 HA2 GLY B 53 12.045 -55.575 13.433 1.00 0.00 H new ATOM 0 HA3 GLY B 53 13.571 -56.182 12.820 1.00 0.00 H new ATOM 2078 N ARG B 54 12.853 -53.772 10.911 1.00 0.00 N ATOM 2079 CA ARG B 54 13.101 -52.405 10.417 1.00 0.00 C ATOM 2080 C ARG B 54 11.830 -51.557 10.492 1.00 0.00 C ATOM 2081 O ARG B 54 10.724 -52.084 10.621 1.00 0.00 O ATOM 2082 CB ARG B 54 13.665 -52.464 8.984 1.00 0.00 C ATOM 2083 CG ARG B 54 15.017 -53.183 8.855 1.00 0.00 C ATOM 2084 CD ARG B 54 16.152 -52.477 9.609 1.00 0.00 C ATOM 2085 NE ARG B 54 17.447 -53.151 9.375 1.00 0.00 N ATOM 2086 CZ ARG B 54 17.964 -54.164 10.051 1.00 0.00 C ATOM 2087 NH1 ARG B 54 17.364 -54.699 11.079 1.00 0.00 N1+ ATOM 2088 NH2 ARG B 54 19.114 -54.666 9.700 1.00 0.00 N ATOM 0 H ARG B 54 12.472 -54.388 10.193 1.00 0.00 H new ATOM 0 HA ARG B 54 13.842 -51.924 11.056 1.00 0.00 H new ATOM 0 HB2 ARG B 54 12.940 -52.965 8.343 1.00 0.00 H new ATOM 0 HB3 ARG B 54 13.773 -51.446 8.608 1.00 0.00 H new ATOM 0 HG2 ARG B 54 14.917 -54.201 9.232 1.00 0.00 H new ATOM 0 HG3 ARG B 54 15.282 -53.258 7.800 1.00 0.00 H new ATOM 0 HD2 ARG B 54 16.216 -51.438 9.286 1.00 0.00 H new ATOM 0 HD3 ARG B 54 15.932 -52.466 10.676 1.00 0.00 H new ATOM 0 HE ARG B 54 18.008 -52.793 8.602 1.00 0.00 H new ATOM 0 HH11 ARG B 54 16.462 -54.337 11.388 1.00 0.00 H new ATOM 0 HH12 ARG B 54 17.797 -55.479 11.573 1.00 0.00 H new ATOM 0 HH21 ARG B 54 19.618 -54.278 8.902 1.00 0.00 H new ATOM 0 HH22 ARG B 54 19.510 -55.447 10.223 1.00 0.00 H new ATOM 2102 N THR B 55 11.983 -50.239 10.412 1.00 0.00 N ATOM 2103 CA THR B 55 10.897 -49.248 10.468 1.00 0.00 C ATOM 2104 C THR B 55 10.727 -48.496 9.151 1.00 0.00 C ATOM 2105 O THR B 55 11.630 -48.477 8.314 1.00 0.00 O ATOM 2106 CB THR B 55 11.094 -48.248 11.618 1.00 0.00 C ATOM 2107 OG1 THR B 55 12.262 -47.483 11.432 1.00 0.00 O ATOM 2108 CG2 THR B 55 11.186 -48.927 12.985 1.00 0.00 C ATOM 0 H THR B 55 12.901 -49.808 10.302 1.00 0.00 H new ATOM 0 HA THR B 55 9.985 -49.816 10.652 1.00 0.00 H new ATOM 0 HB THR B 55 10.212 -47.608 11.602 1.00 0.00 H new ATOM 0 HG1 THR B 55 13.048 -48.065 11.495 1.00 0.00 H new ATOM 0 HG21 THR B 55 11.325 -48.171 13.758 1.00 0.00 H new ATOM 0 HG22 THR B 55 10.267 -49.480 13.179 1.00 0.00 H new ATOM 0 HG23 THR B 55 12.032 -49.614 12.994 1.00 0.00 H new ATOM 2116 N LEU B 56 9.573 -47.853 8.950 1.00 0.00 N ATOM 2117 CA LEU B 56 9.280 -47.101 7.721 1.00 0.00 C ATOM 2118 C LEU B 56 10.323 -45.999 7.433 1.00 0.00 C ATOM 2119 O LEU B 56 10.705 -45.811 6.276 1.00 0.00 O ATOM 2120 CB LEU B 56 7.847 -46.536 7.811 1.00 0.00 C ATOM 2121 CG LEU B 56 6.730 -47.599 7.803 1.00 0.00 C ATOM 2122 CD1 LEU B 56 5.371 -46.914 7.928 1.00 0.00 C ATOM 2123 CD2 LEU B 56 6.717 -48.418 6.511 1.00 0.00 C ATOM 0 H LEU B 56 8.815 -47.838 9.632 1.00 0.00 H new ATOM 0 HA LEU B 56 9.345 -47.782 6.873 1.00 0.00 H new ATOM 0 HB2 LEU B 56 7.761 -45.946 8.724 1.00 0.00 H new ATOM 0 HB3 LEU B 56 7.687 -45.855 6.975 1.00 0.00 H new ATOM 0 HG LEU B 56 6.923 -48.267 8.643 1.00 0.00 H new ATOM 0 HD11 LEU B 56 4.582 -47.666 7.922 1.00 0.00 H new ATOM 0 HD12 LEU B 56 5.331 -46.353 8.862 1.00 0.00 H new ATOM 0 HD13 LEU B 56 5.228 -46.233 7.089 1.00 0.00 H new ATOM 0 HD21 LEU B 56 5.913 -49.153 6.554 1.00 0.00 H new ATOM 0 HD22 LEU B 56 6.557 -47.754 5.661 1.00 0.00 H new ATOM 0 HD23 LEU B 56 7.672 -48.931 6.396 1.00 0.00 H new ATOM 2135 N SER B 57 10.856 -45.332 8.461 1.00 0.00 N ATOM 2136 CA SER B 57 11.922 -44.330 8.314 1.00 0.00 C ATOM 2137 C SER B 57 13.290 -44.920 7.924 1.00 0.00 C ATOM 2138 O SER B 57 14.070 -44.224 7.272 1.00 0.00 O ATOM 2139 CB SER B 57 12.054 -43.483 9.586 1.00 0.00 C ATOM 2140 OG SER B 57 12.465 -44.269 10.690 1.00 0.00 O ATOM 0 H SER B 57 10.559 -45.472 9.427 1.00 0.00 H new ATOM 0 HA SER B 57 11.615 -43.698 7.481 1.00 0.00 H new ATOM 0 HB2 SER B 57 12.775 -42.683 9.419 1.00 0.00 H new ATOM 0 HB3 SER B 57 11.098 -43.009 9.810 1.00 0.00 H new ATOM 0 HG SER B 57 12.542 -43.701 11.485 1.00 0.00 H new ATOM 2146 N ASP B 58 13.577 -46.198 8.215 1.00 0.00 N ATOM 2147 CA ASP B 58 14.805 -46.870 7.748 1.00 0.00 C ATOM 2148 C ASP B 58 14.820 -47.036 6.215 1.00 0.00 C ATOM 2149 O ASP B 58 15.885 -47.007 5.593 1.00 0.00 O ATOM 2150 CB ASP B 58 14.982 -48.248 8.409 1.00 0.00 C ATOM 2151 CG ASP B 58 15.159 -48.179 9.932 1.00 0.00 C ATOM 2152 OD1 ASP B 58 16.103 -47.500 10.404 1.00 0.00 O ATOM 2153 OD2 ASP B 58 14.379 -48.844 10.656 1.00 0.00 O1- ATOM 0 H ASP B 58 12.970 -46.794 8.777 1.00 0.00 H new ATOM 0 HA ASP B 58 15.635 -46.227 8.039 1.00 0.00 H new ATOM 0 HB2 ASP B 58 14.114 -48.866 8.180 1.00 0.00 H new ATOM 0 HB3 ASP B 58 15.850 -48.743 7.972 1.00 0.00 H new ATOM 2158 N TYR B 59 13.633 -47.145 5.604 1.00 0.00 N ATOM 2159 CA TYR B 59 13.420 -47.196 4.153 1.00 0.00 C ATOM 2160 C TYR B 59 13.077 -45.822 3.536 1.00 0.00 C ATOM 2161 O TYR B 59 12.782 -45.739 2.343 1.00 0.00 O ATOM 2162 CB TYR B 59 12.343 -48.247 3.856 1.00 0.00 C ATOM 2163 CG TYR B 59 12.712 -49.645 4.314 1.00 0.00 C ATOM 2164 CD1 TYR B 59 13.730 -50.353 3.646 1.00 0.00 C ATOM 2165 CD2 TYR B 59 12.036 -50.239 5.399 1.00 0.00 C ATOM 2166 CE1 TYR B 59 14.074 -51.655 4.056 1.00 0.00 C ATOM 2167 CE2 TYR B 59 12.365 -51.549 5.799 1.00 0.00 C ATOM 2168 CZ TYR B 59 13.387 -52.257 5.133 1.00 0.00 C ATOM 2169 OH TYR B 59 13.703 -53.519 5.522 1.00 0.00 O ATOM 0 H TYR B 59 12.760 -47.202 6.129 1.00 0.00 H new ATOM 0 HA TYR B 59 14.357 -47.484 3.677 1.00 0.00 H new ATOM 0 HB2 TYR B 59 11.414 -47.949 4.341 1.00 0.00 H new ATOM 0 HB3 TYR B 59 12.151 -48.265 2.783 1.00 0.00 H new ATOM 0 HD1 TYR B 59 14.248 -49.895 2.816 1.00 0.00 H new ATOM 0 HD2 TYR B 59 11.267 -49.691 5.923 1.00 0.00 H new ATOM 0 HE1 TYR B 59 14.861 -52.192 3.548 1.00 0.00 H new ATOM 0 HE2 TYR B 59 11.834 -52.012 6.617 1.00 0.00 H new ATOM 0 HH TYR B 59 14.673 -53.591 5.641 1.00 0.00 H new ATOM 2179 N ASN B 60 13.107 -44.746 4.336 1.00 0.00 N ATOM 2180 CA ASN B 60 12.678 -43.385 3.972 1.00 0.00 C ATOM 2181 C ASN B 60 11.234 -43.300 3.416 1.00 0.00 C ATOM 2182 O ASN B 60 10.916 -42.418 2.612 1.00 0.00 O ATOM 2183 CB ASN B 60 13.742 -42.705 3.083 1.00 0.00 C ATOM 2184 CG ASN B 60 15.101 -42.604 3.758 1.00 0.00 C ATOM 2185 OD1 ASN B 60 15.334 -41.753 4.606 1.00 0.00 O ATOM 2186 ND2 ASN B 60 16.041 -43.460 3.415 1.00 0.00 N ATOM 0 H ASN B 60 13.446 -44.802 5.297 1.00 0.00 H new ATOM 0 HA ASN B 60 12.613 -42.809 4.895 1.00 0.00 H new ATOM 0 HB2 ASN B 60 13.844 -43.266 2.154 1.00 0.00 H new ATOM 0 HB3 ASN B 60 13.400 -41.705 2.816 1.00 0.00 H new ATOM 0 HD21 ASN B 60 16.960 -43.412 3.856 1.00 0.00 H new ATOM 0 HD22 ASN B 60 15.850 -44.171 2.709 1.00 0.00 H new ATOM 2193 N ILE B 61 10.348 -44.203 3.854 1.00 0.00 N ATOM 2194 CA ILE B 61 8.923 -44.209 3.496 1.00 0.00 C ATOM 2195 C ILE B 61 8.214 -43.039 4.201 1.00 0.00 C ATOM 2196 O ILE B 61 8.424 -42.780 5.388 1.00 0.00 O ATOM 2197 CB ILE B 61 8.282 -45.590 3.790 1.00 0.00 C ATOM 2198 CG1 ILE B 61 8.895 -46.678 2.876 1.00 0.00 C ATOM 2199 CG2 ILE B 61 6.754 -45.549 3.596 1.00 0.00 C ATOM 2200 CD1 ILE B 61 8.566 -48.124 3.278 1.00 0.00 C ATOM 0 H ILE B 61 10.606 -44.966 4.480 1.00 0.00 H new ATOM 0 HA ILE B 61 8.808 -44.057 2.423 1.00 0.00 H new ATOM 0 HB ILE B 61 8.491 -45.836 4.831 1.00 0.00 H new ATOM 0 HG12 ILE B 61 8.548 -46.512 1.856 1.00 0.00 H new ATOM 0 HG13 ILE B 61 9.978 -46.556 2.868 1.00 0.00 H new ATOM 0 HG21 ILE B 61 6.334 -46.532 3.809 1.00 0.00 H new ATOM 0 HG22 ILE B 61 6.321 -44.814 4.274 1.00 0.00 H new ATOM 0 HG23 ILE B 61 6.525 -45.272 2.567 1.00 0.00 H new ATOM 0 HD11 ILE B 61 9.040 -48.813 2.578 1.00 0.00 H new ATOM 0 HD12 ILE B 61 8.939 -48.316 4.284 1.00 0.00 H new ATOM 0 HD13 ILE B 61 7.486 -48.271 3.257 1.00 0.00 H new ATOM 2212 N GLN B 62 7.390 -42.323 3.434 1.00 0.00 N ATOM 2213 CA GLN B 62 6.753 -41.047 3.795 1.00 0.00 C ATOM 2214 C GLN B 62 5.237 -41.088 3.518 1.00 0.00 C ATOM 2215 O GLN B 62 4.721 -42.080 2.996 1.00 0.00 O ATOM 2216 CB GLN B 62 7.462 -39.927 3.001 1.00 0.00 C ATOM 2217 CG GLN B 62 8.878 -39.629 3.524 1.00 0.00 C ATOM 2218 CD GLN B 62 9.720 -38.917 2.470 1.00 0.00 C ATOM 2219 OE1 GLN B 62 9.623 -37.713 2.264 1.00 0.00 O ATOM 2220 NE2 GLN B 62 10.556 -39.634 1.746 1.00 0.00 N ATOM 0 H GLN B 62 7.133 -42.630 2.496 1.00 0.00 H new ATOM 0 HA GLN B 62 6.857 -40.855 4.863 1.00 0.00 H new ATOM 0 HB2 GLN B 62 7.520 -40.214 1.951 1.00 0.00 H new ATOM 0 HB3 GLN B 62 6.863 -39.018 3.050 1.00 0.00 H new ATOM 0 HG2 GLN B 62 8.815 -39.011 4.420 1.00 0.00 H new ATOM 0 HG3 GLN B 62 9.365 -40.561 3.813 1.00 0.00 H new ATOM 0 HE21 GLN B 62 10.643 -40.637 1.911 1.00 0.00 H new ATOM 0 HE22 GLN B 62 11.116 -39.186 1.021 1.00 0.00 H new ATOM 2229 N LYS B 63 4.519 -40.004 3.831 1.00 0.00 N ATOM 2230 CA LYS B 63 3.094 -39.866 3.500 1.00 0.00 C ATOM 2231 C LYS B 63 2.802 -40.152 2.011 1.00 0.00 C ATOM 2232 O LYS B 63 3.614 -39.852 1.132 1.00 0.00 O ATOM 2233 CB LYS B 63 2.565 -38.475 3.906 1.00 0.00 C ATOM 2234 CG LYS B 63 3.233 -37.291 3.179 1.00 0.00 C ATOM 2235 CD LYS B 63 2.521 -35.968 3.501 1.00 0.00 C ATOM 2236 CE LYS B 63 3.185 -34.786 2.784 1.00 0.00 C ATOM 2237 NZ LYS B 63 4.451 -34.435 3.423 1.00 0.00 N ATOM 0 H LYS B 63 4.907 -39.198 4.320 1.00 0.00 H new ATOM 0 HA LYS B 63 2.562 -40.622 4.078 1.00 0.00 H new ATOM 0 HB2 LYS B 63 1.492 -38.441 3.717 1.00 0.00 H new ATOM 0 HB3 LYS B 63 2.703 -38.348 4.980 1.00 0.00 H new ATOM 0 HG2 LYS B 63 4.280 -37.224 3.473 1.00 0.00 H new ATOM 0 HG3 LYS B 63 3.215 -37.464 2.103 1.00 0.00 H new ATOM 0 HD2 LYS B 63 1.474 -36.035 3.204 1.00 0.00 H new ATOM 0 HD3 LYS B 63 2.536 -35.798 4.577 1.00 0.00 H new ATOM 0 HE2 LYS B 63 3.359 -35.040 1.738 1.00 0.00 H new ATOM 0 HE3 LYS B 63 2.516 -33.926 2.796 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 4.883 -33.633 2.921 1.00 0.00 H new ATOM 2249 N GLU B 64 1.628 -40.727 1.734 1.00 0.00 N ATOM 2250 CA GLU B 64 1.133 -41.058 0.384 1.00 0.00 C ATOM 2251 C GLU B 64 1.986 -42.090 -0.396 1.00 0.00 C ATOM 2252 O GLU B 64 1.781 -42.279 -1.599 1.00 0.00 O ATOM 2253 CB GLU B 64 0.862 -39.780 -0.442 1.00 0.00 C ATOM 2254 CG GLU B 64 0.027 -38.712 0.277 1.00 0.00 C ATOM 2255 CD GLU B 64 -0.128 -37.470 -0.617 1.00 0.00 C ATOM 2256 OE1 GLU B 64 0.813 -36.638 -0.674 1.00 0.00 O ATOM 2257 OE2 GLU B 64 -1.179 -37.323 -1.286 1.00 0.00 O1- ATOM 0 H GLU B 64 0.968 -40.986 2.467 1.00 0.00 H new ATOM 0 HA GLU B 64 0.186 -41.571 0.548 1.00 0.00 H new ATOM 0 HB2 GLU B 64 1.817 -39.341 -0.729 1.00 0.00 H new ATOM 0 HB3 GLU B 64 0.351 -40.061 -1.363 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -0.955 -39.114 0.527 1.00 0.00 H new ATOM 0 HG3 GLU B 64 0.507 -38.436 1.216 1.00 0.00 H new ATOM 2264 N SER B 65 2.928 -42.783 0.261 1.00 0.00 N ATOM 2265 CA SER B 65 3.769 -43.816 -0.373 1.00 0.00 C ATOM 2266 C SER B 65 2.962 -45.058 -0.762 1.00 0.00 C ATOM 2267 O SER B 65 2.098 -45.491 0.002 1.00 0.00 O ATOM 2268 CB SER B 65 4.904 -44.265 0.553 1.00 0.00 C ATOM 2269 OG SER B 65 5.766 -43.188 0.855 1.00 0.00 O ATOM 0 H SER B 65 3.131 -42.644 1.251 1.00 0.00 H new ATOM 0 HA SER B 65 4.179 -43.352 -1.270 1.00 0.00 H new ATOM 0 HB2 SER B 65 4.487 -44.671 1.475 1.00 0.00 H new ATOM 0 HB3 SER B 65 5.470 -45.067 0.078 1.00 0.00 H new ATOM 0 HG SER B 65 5.403 -42.681 1.611 1.00 0.00 H new ATOM 2275 N THR B 66 3.292 -45.676 -1.901 1.00 0.00 N ATOM 2276 CA THR B 66 2.683 -46.939 -2.356 1.00 0.00 C ATOM 2277 C THR B 66 3.619 -48.117 -2.099 1.00 0.00 C ATOM 2278 O THR B 66 4.684 -48.214 -2.712 1.00 0.00 O ATOM 2279 CB THR B 66 2.334 -46.914 -3.855 1.00 0.00 C ATOM 2280 OG1 THR B 66 1.661 -45.736 -4.229 1.00 0.00 O ATOM 2281 CG2 THR B 66 1.438 -48.092 -4.251 1.00 0.00 C ATOM 0 H THR B 66 3.997 -45.313 -2.543 1.00 0.00 H new ATOM 0 HA THR B 66 1.762 -47.056 -1.784 1.00 0.00 H new ATOM 0 HB THR B 66 3.293 -46.974 -4.370 1.00 0.00 H new ATOM 0 HG1 THR B 66 1.721 -45.619 -5.200 1.00 0.00 H new ATOM 0 HG21 THR B 66 1.215 -48.037 -5.317 1.00 0.00 H new ATOM 0 HG22 THR B 66 1.952 -49.029 -4.035 1.00 0.00 H new ATOM 0 HG23 THR B 66 0.509 -48.049 -3.683 1.00 0.00 H new ATOM 2289 N LEU B 67 3.210 -49.024 -1.214 1.00 0.00 N ATOM 2290 CA LEU B 67 3.846 -50.322 -0.985 1.00 0.00 C ATOM 2291 C LEU B 67 3.120 -51.392 -1.816 1.00 0.00 C ATOM 2292 O LEU B 67 1.942 -51.249 -2.147 1.00 0.00 O ATOM 2293 CB LEU B 67 3.823 -50.676 0.517 1.00 0.00 C ATOM 2294 CG LEU B 67 4.783 -49.893 1.435 1.00 0.00 C ATOM 2295 CD1 LEU B 67 4.462 -48.400 1.549 1.00 0.00 C ATOM 2296 CD2 LEU B 67 4.723 -50.494 2.842 1.00 0.00 C ATOM 0 H LEU B 67 2.398 -48.871 -0.615 1.00 0.00 H new ATOM 0 HA LEU B 67 4.889 -50.278 -1.297 1.00 0.00 H new ATOM 0 HB2 LEU B 67 2.807 -50.529 0.884 1.00 0.00 H new ATOM 0 HB3 LEU B 67 4.048 -51.738 0.618 1.00 0.00 H new ATOM 0 HG LEU B 67 5.771 -49.978 0.984 1.00 0.00 H new ATOM 0 HD11 LEU B 67 5.183 -47.922 2.212 1.00 0.00 H new ATOM 0 HD12 LEU B 67 4.516 -47.940 0.562 1.00 0.00 H new ATOM 0 HD13 LEU B 67 3.458 -48.274 1.954 1.00 0.00 H new ATOM 0 HD21 LEU B 67 5.399 -49.948 3.500 1.00 0.00 H new ATOM 0 HD22 LEU B 67 3.705 -50.422 3.226 1.00 0.00 H new ATOM 0 HD23 LEU B 67 5.022 -51.541 2.803 1.00 0.00 H new ATOM 2308 N HIS B 68 3.804 -52.491 -2.114 1.00 0.00 N ATOM 2309 CA HIS B 68 3.301 -53.586 -2.947 1.00 0.00 C ATOM 2310 C HIS B 68 3.326 -54.890 -2.144 1.00 0.00 C ATOM 2311 O HIS B 68 4.383 -55.320 -1.684 1.00 0.00 O ATOM 2312 CB HIS B 68 4.124 -53.634 -4.248 1.00 0.00 C ATOM 2313 CG HIS B 68 4.086 -52.324 -5.001 1.00 0.00 C ATOM 2314 ND1 HIS B 68 4.937 -51.237 -4.775 1.00 0.00 N ATOM 2315 CD2 HIS B 68 3.119 -51.950 -5.889 1.00 0.00 C ATOM 2316 CE1 HIS B 68 4.441 -50.226 -5.507 1.00 0.00 C ATOM 2317 NE2 HIS B 68 3.367 -50.631 -6.205 1.00 0.00 N ATOM 0 H HIS B 68 4.752 -52.653 -1.774 1.00 0.00 H new ATOM 0 HA HIS B 68 2.262 -53.429 -3.236 1.00 0.00 H new ATOM 0 HB2 HIS B 68 5.158 -53.885 -4.012 1.00 0.00 H new ATOM 0 HB3 HIS B 68 3.742 -54.429 -4.888 1.00 0.00 H new ATOM 0 HD2 HIS B 68 2.317 -52.566 -6.269 1.00 0.00 H new ATOM 0 HE1 HIS B 68 4.849 -49.226 -5.531 1.00 0.00 H new ATOM 0 HE2 HIS B 68 2.828 -50.061 -6.857 1.00 0.00 H new ATOM 2325 N LEU B 69 2.156 -55.497 -1.936 1.00 0.00 N ATOM 2326 CA LEU B 69 1.966 -56.709 -1.137 1.00 0.00 C ATOM 2327 C LEU B 69 1.922 -57.948 -2.039 1.00 0.00 C ATOM 2328 O LEU B 69 1.014 -58.109 -2.855 1.00 0.00 O ATOM 2329 CB LEU B 69 0.695 -56.548 -0.278 1.00 0.00 C ATOM 2330 CG LEU B 69 0.298 -57.783 0.553 1.00 0.00 C ATOM 2331 CD1 LEU B 69 1.329 -58.128 1.627 1.00 0.00 C ATOM 2332 CD2 LEU B 69 -1.039 -57.526 1.244 1.00 0.00 C ATOM 0 H LEU B 69 1.285 -55.146 -2.333 1.00 0.00 H new ATOM 0 HA LEU B 69 2.810 -56.854 -0.463 1.00 0.00 H new ATOM 0 HB2 LEU B 69 0.839 -55.706 0.399 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -0.136 -56.290 -0.934 1.00 0.00 H new ATOM 0 HG LEU B 69 0.234 -58.621 -0.141 1.00 0.00 H new ATOM 0 HD11 LEU B 69 0.997 -59.006 2.181 1.00 0.00 H new ATOM 0 HD12 LEU B 69 2.289 -58.338 1.156 1.00 0.00 H new ATOM 0 HD13 LEU B 69 1.437 -57.286 2.311 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -1.319 -58.400 1.832 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -0.949 -56.661 1.901 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -1.805 -57.333 0.493 1.00 0.00 H new ATOM 2344 N VAL B 70 2.886 -58.841 -1.835 1.00 0.00 N ATOM 2345 CA VAL B 70 2.998 -60.166 -2.457 1.00 0.00 C ATOM 2346 C VAL B 70 2.563 -61.227 -1.434 1.00 0.00 C ATOM 2347 O VAL B 70 2.905 -61.137 -0.254 1.00 0.00 O ATOM 2348 CB VAL B 70 4.437 -60.377 -2.975 1.00 0.00 C ATOM 2349 CG1 VAL B 70 4.666 -61.786 -3.536 1.00 0.00 C ATOM 2350 CG2 VAL B 70 4.787 -59.365 -4.079 1.00 0.00 C ATOM 0 H VAL B 70 3.657 -58.653 -1.195 1.00 0.00 H new ATOM 0 HA VAL B 70 2.341 -60.253 -3.322 1.00 0.00 H new ATOM 0 HB VAL B 70 5.081 -60.233 -2.107 1.00 0.00 H new ATOM 0 HG11 VAL B 70 5.695 -61.876 -3.885 1.00 0.00 H new ATOM 0 HG12 VAL B 70 4.482 -62.523 -2.754 1.00 0.00 H new ATOM 0 HG13 VAL B 70 3.984 -61.962 -4.368 1.00 0.00 H new ATOM 0 HG21 VAL B 70 5.807 -59.540 -4.423 1.00 0.00 H new ATOM 0 HG22 VAL B 70 4.097 -59.485 -4.914 1.00 0.00 H new ATOM 0 HG23 VAL B 70 4.706 -58.353 -3.683 1.00 0.00 H new ATOM 2360 N LEU B 71 1.787 -62.219 -1.878 1.00 0.00 N ATOM 2361 CA LEU B 71 1.268 -63.326 -1.062 1.00 0.00 C ATOM 2362 C LEU B 71 0.957 -64.568 -1.927 1.00 0.00 C ATOM 2363 O LEU B 71 0.950 -64.471 -3.156 1.00 0.00 O ATOM 2364 CB LEU B 71 0.029 -62.865 -0.250 1.00 0.00 C ATOM 2365 CG LEU B 71 -1.261 -62.548 -1.043 1.00 0.00 C ATOM 2366 CD1 LEU B 71 -2.479 -62.700 -0.130 1.00 0.00 C ATOM 2367 CD2 LEU B 71 -1.295 -61.118 -1.591 1.00 0.00 C ATOM 0 H LEU B 71 1.490 -62.278 -2.852 1.00 0.00 H new ATOM 0 HA LEU B 71 2.042 -63.621 -0.354 1.00 0.00 H new ATOM 0 HB2 LEU B 71 -0.205 -63.641 0.478 1.00 0.00 H new ATOM 0 HB3 LEU B 71 0.307 -61.974 0.312 1.00 0.00 H new ATOM 0 HG LEU B 71 -1.278 -63.248 -1.879 1.00 0.00 H new ATOM 0 HD11 LEU B 71 -3.385 -62.476 -0.692 1.00 0.00 H new ATOM 0 HD12 LEU B 71 -2.528 -63.723 0.244 1.00 0.00 H new ATOM 0 HD13 LEU B 71 -2.393 -62.010 0.709 1.00 0.00 H new ATOM 0 HD21 LEU B 71 -2.225 -60.960 -2.137 1.00 0.00 H new ATOM 0 HD22 LEU B 71 -1.234 -60.410 -0.764 1.00 0.00 H new ATOM 0 HD23 LEU B 71 -0.450 -60.965 -2.262 1.00 0.00 H new ATOM 2379 N ARG B 72 0.626 -65.691 -1.267 1.00 0.00 N ATOM 2380 CA ARG B 72 0.229 -67.000 -1.847 1.00 0.00 C ATOM 2381 C ARG B 72 1.335 -67.715 -2.651 1.00 0.00 C ATOM 2382 O ARG B 72 2.318 -67.114 -3.082 1.00 0.00 O ATOM 2383 CB ARG B 72 -1.085 -66.867 -2.656 1.00 0.00 C ATOM 2384 CG ARG B 72 -2.270 -66.358 -1.816 1.00 0.00 C ATOM 2385 CD ARG B 72 -3.429 -65.926 -2.721 1.00 0.00 C ATOM 2386 NE ARG B 72 -4.538 -65.349 -1.936 1.00 0.00 N ATOM 2387 CZ ARG B 72 -5.546 -64.633 -2.405 1.00 0.00 C ATOM 2388 NH1 ARG B 72 -5.688 -64.388 -3.678 1.00 0.00 N1+ ATOM 2389 NH2 ARG B 72 -6.436 -64.138 -1.594 1.00 0.00 N ATOM 0 H ARG B 72 0.626 -65.718 -0.247 1.00 0.00 H new ATOM 0 HA ARG B 72 0.052 -67.657 -0.995 1.00 0.00 H new ATOM 0 HB2 ARG B 72 -0.922 -66.186 -3.491 1.00 0.00 H new ATOM 0 HB3 ARG B 72 -1.341 -67.837 -3.082 1.00 0.00 H new ATOM 0 HG2 ARG B 72 -2.605 -67.143 -1.137 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -1.951 -65.518 -1.199 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -3.074 -65.193 -3.445 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -3.790 -66.784 -3.287 1.00 0.00 H new ATOM 0 HE ARG B 72 -4.526 -65.520 -0.930 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -5.009 -64.753 -4.346 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -6.478 -63.832 -4.005 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -6.358 -64.302 -0.590 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -7.211 -63.587 -1.962 1.00 0.00 H new ATOM 2403 N LEU B 73 1.160 -69.031 -2.823 1.00 0.00 N ATOM 2404 CA LEU B 73 2.069 -69.910 -3.583 1.00 0.00 C ATOM 2405 C LEU B 73 1.365 -71.175 -4.112 1.00 0.00 C ATOM 2406 O LEU B 73 1.432 -71.471 -5.304 1.00 0.00 O ATOM 2407 CB LEU B 73 3.261 -70.280 -2.671 1.00 0.00 C ATOM 2408 CG LEU B 73 4.301 -71.233 -3.296 1.00 0.00 C ATOM 2409 CD1 LEU B 73 4.952 -70.650 -4.551 1.00 0.00 C ATOM 2410 CD2 LEU B 73 5.401 -71.526 -2.275 1.00 0.00 C ATOM 0 H LEU B 73 0.363 -69.531 -2.429 1.00 0.00 H new ATOM 0 HA LEU B 73 2.418 -69.373 -4.465 1.00 0.00 H new ATOM 0 HB2 LEU B 73 3.767 -69.362 -2.373 1.00 0.00 H new ATOM 0 HB3 LEU B 73 2.872 -70.739 -1.762 1.00 0.00 H new ATOM 0 HG LEU B 73 3.771 -72.142 -3.580 1.00 0.00 H new ATOM 0 HD11 LEU B 73 5.675 -71.361 -4.950 1.00 0.00 H new ATOM 0 HD12 LEU B 73 4.185 -70.453 -5.300 1.00 0.00 H new ATOM 0 HD13 LEU B 73 5.460 -69.719 -4.298 1.00 0.00 H new ATOM 0 HD21 LEU B 73 6.136 -72.199 -2.716 1.00 0.00 H new ATOM 0 HD22 LEU B 73 5.888 -70.594 -1.988 1.00 0.00 H new ATOM 0 HD23 LEU B 73 4.964 -71.994 -1.393 1.00 0.00 H new ATOM 2422 N ARG B 74 0.673 -71.915 -3.231 1.00 0.00 N ATOM 2423 CA ARG B 74 0.113 -73.259 -3.497 1.00 0.00 C ATOM 2424 C ARG B 74 -1.296 -73.229 -4.120 1.00 0.00 C ATOM 2425 O ARG B 74 -2.198 -73.952 -3.695 1.00 0.00 O ATOM 2426 CB ARG B 74 0.230 -74.102 -2.207 1.00 0.00 C ATOM 2427 CG ARG B 74 0.316 -75.610 -2.487 1.00 0.00 C ATOM 2428 CD ARG B 74 0.380 -76.403 -1.175 1.00 0.00 C ATOM 2429 NE ARG B 74 0.708 -77.825 -1.406 1.00 0.00 N ATOM 2430 CZ ARG B 74 -0.113 -78.800 -1.761 1.00 0.00 C ATOM 2431 NH1 ARG B 74 -1.383 -78.601 -1.979 1.00 0.00 N1+ ATOM 2432 NH2 ARG B 74 0.341 -80.013 -1.910 1.00 0.00 N ATOM 0 H ARG B 74 0.479 -71.589 -2.284 1.00 0.00 H new ATOM 0 HA ARG B 74 0.700 -73.746 -4.275 1.00 0.00 H new ATOM 0 HB2 ARG B 74 1.115 -73.789 -1.653 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -0.632 -73.904 -1.570 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -0.550 -75.927 -3.067 1.00 0.00 H new ATOM 0 HG3 ARG B 74 1.199 -75.823 -3.090 1.00 0.00 H new ATOM 0 HD2 ARG B 74 1.129 -75.960 -0.519 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -0.578 -76.330 -0.660 1.00 0.00 H new ATOM 0 HE ARG B 74 1.685 -78.087 -1.276 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -1.778 -77.666 -1.877 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -1.982 -79.380 -2.251 1.00 0.00 H new ATOM 0 HH21 ARG B 74 1.329 -80.211 -1.753 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -0.292 -80.764 -2.184 1.00 0.00 H new ATOM 2446 N GLY B 75 -1.496 -72.359 -5.114 1.00 0.00 N ATOM 2447 CA GLY B 75 -2.764 -72.221 -5.849 1.00 0.00 C ATOM 2448 C GLY B 75 -3.903 -71.552 -5.060 1.00 0.00 C ATOM 2449 O GLY B 75 -5.072 -71.884 -5.281 1.00 0.00 O ATOM 0 H GLY B 75 -0.772 -71.719 -5.439 1.00 0.00 H new ATOM 0 HA2 GLY B 75 -2.581 -71.642 -6.754 1.00 0.00 H new ATOM 0 HA3 GLY B 75 -3.093 -73.211 -6.165 1.00 0.00 H new ATOM 2453 N GLY B 76 -3.569 -70.649 -4.125 1.00 0.00 N ATOM 2454 CA GLY B 76 -4.518 -69.932 -3.251 1.00 0.00 C ATOM 2455 C GLY B 76 -5.561 -69.092 -3.999 1.00 0.00 C ATOM 2456 O GLY B 76 -5.183 -68.334 -4.920 1.00 0.00 O ATOM 2457 OXT GLY B 76 -6.754 -69.177 -3.628 1.00 0.00 O1- ATOM 0 H GLY B 76 -2.599 -70.387 -3.949 1.00 0.00 H new ATOM 0 HA2 GLY B 76 -5.036 -70.659 -2.625 1.00 0.00 H new ATOM 0 HA3 GLY B 76 -3.956 -69.280 -2.583 1.00 0.00 H new TER 2461 GLY B 76 ATOM 2462 N MET C 79 -3.920 -70.044 -11.406 1.00 0.00 N ATOM 2463 CA MET C 79 -3.123 -69.202 -10.463 1.00 0.00 C ATOM 2464 C MET C 79 -1.632 -69.215 -10.841 1.00 0.00 C ATOM 2465 O MET C 79 -1.112 -70.242 -11.278 1.00 0.00 O ATOM 2466 CB MET C 79 -3.367 -69.631 -8.993 1.00 0.00 C ATOM 2467 CG MET C 79 -2.714 -68.731 -7.927 1.00 0.00 C ATOM 2468 SD MET C 79 -0.976 -69.096 -7.527 1.00 0.00 S ATOM 2469 CE MET C 79 -0.554 -67.592 -6.603 1.00 0.00 C ATOM 0 HA MET C 79 -3.462 -68.170 -10.550 1.00 0.00 H new ATOM 0 HB2 MET C 79 -4.442 -69.658 -8.813 1.00 0.00 H new ATOM 0 HB3 MET C 79 -2.997 -70.648 -8.862 1.00 0.00 H new ATOM 0 HG2 MET C 79 -2.778 -67.697 -8.265 1.00 0.00 H new ATOM 0 HG3 MET C 79 -3.300 -68.804 -7.011 1.00 0.00 H new ATOM 0 HE1 MET C 79 0.485 -67.644 -6.278 1.00 0.00 H new ATOM 0 HE2 MET C 79 -0.690 -66.721 -7.244 1.00 0.00 H new ATOM 0 HE3 MET C 79 -1.203 -67.506 -5.732 1.00 0.00 H new ATOM 2481 N THR C 80 -0.938 -68.082 -10.675 1.00 0.00 N ATOM 2482 CA THR C 80 0.521 -67.940 -10.882 1.00 0.00 C ATOM 2483 C THR C 80 1.144 -67.004 -9.838 1.00 0.00 C ATOM 2484 O THR C 80 0.553 -65.992 -9.464 1.00 0.00 O ATOM 2485 CB THR C 80 0.838 -67.495 -12.323 1.00 0.00 C ATOM 2486 OG1 THR C 80 2.228 -67.312 -12.486 1.00 0.00 O ATOM 2487 CG2 THR C 80 0.154 -66.192 -12.734 1.00 0.00 C ATOM 0 H THR C 80 -1.382 -67.211 -10.385 1.00 0.00 H new ATOM 0 HA THR C 80 0.977 -68.920 -10.742 1.00 0.00 H new ATOM 0 HB THR C 80 0.456 -68.295 -12.958 1.00 0.00 H new ATOM 0 HG1 THR C 80 2.415 -67.031 -13.406 1.00 0.00 H new ATOM 0 HG21 THR C 80 0.427 -65.946 -13.760 1.00 0.00 H new ATOM 0 HG22 THR C 80 -0.927 -66.311 -12.664 1.00 0.00 H new ATOM 0 HG23 THR C 80 0.474 -65.388 -12.071 1.00 0.00 H new ATOM 2495 N GLU C 81 2.333 -67.358 -9.343 1.00 0.00 N ATOM 2496 CA GLU C 81 3.121 -66.571 -8.392 1.00 0.00 C ATOM 2497 C GLU C 81 4.130 -65.690 -9.130 1.00 0.00 C ATOM 2498 O GLU C 81 4.195 -64.496 -8.862 1.00 0.00 O ATOM 2499 CB GLU C 81 3.774 -67.509 -7.361 1.00 0.00 C ATOM 2500 CG GLU C 81 4.521 -66.771 -6.235 1.00 0.00 C ATOM 2501 CD GLU C 81 6.056 -66.935 -6.309 1.00 0.00 C ATOM 2502 OE1 GLU C 81 6.668 -66.664 -7.371 1.00 0.00 O1- ATOM 2503 OE2 GLU C 81 6.673 -67.324 -5.285 1.00 0.00 O ATOM 0 H GLU C 81 2.789 -68.232 -9.603 1.00 0.00 H new ATOM 0 HA GLU C 81 2.471 -65.891 -7.842 1.00 0.00 H new ATOM 0 HB2 GLU C 81 3.004 -68.141 -6.920 1.00 0.00 H new ATOM 0 HB3 GLU C 81 4.472 -68.169 -7.875 1.00 0.00 H new ATOM 0 HG2 GLU C 81 4.273 -65.710 -6.279 1.00 0.00 H new ATOM 0 HG3 GLU C 81 4.169 -67.141 -5.272 1.00 0.00 H new ATOM 2510 N GLU C 82 4.864 -66.245 -10.101 1.00 0.00 N ATOM 2511 CA GLU C 82 6.005 -65.562 -10.731 1.00 0.00 C ATOM 2512 C GLU C 82 5.606 -64.336 -11.559 1.00 0.00 C ATOM 2513 O GLU C 82 6.278 -63.304 -11.497 1.00 0.00 O ATOM 2514 CB GLU C 82 6.832 -66.541 -11.579 1.00 0.00 C ATOM 2515 CG GLU C 82 6.117 -67.129 -12.805 1.00 0.00 C ATOM 2516 CD GLU C 82 6.988 -68.198 -13.489 1.00 0.00 C ATOM 2517 OE1 GLU C 82 7.918 -67.838 -14.253 1.00 0.00 O ATOM 2518 OE2 GLU C 82 6.750 -69.412 -13.271 1.00 0.00 O1- ATOM 0 H GLU C 82 4.686 -67.178 -10.473 1.00 0.00 H new ATOM 0 HA GLU C 82 6.619 -65.190 -9.911 1.00 0.00 H new ATOM 0 HB2 GLU C 82 7.732 -66.028 -11.918 1.00 0.00 H new ATOM 0 HB3 GLU C 82 7.154 -67.363 -10.940 1.00 0.00 H new ATOM 0 HG2 GLU C 82 5.167 -67.568 -12.501 1.00 0.00 H new ATOM 0 HG3 GLU C 82 5.888 -66.333 -13.514 1.00 0.00 H new ATOM 2525 N GLU C 83 4.496 -64.425 -12.300 1.00 0.00 N ATOM 2526 CA GLU C 83 3.999 -63.305 -13.109 1.00 0.00 C ATOM 2527 C GLU C 83 3.490 -62.182 -12.195 1.00 0.00 C ATOM 2528 O GLU C 83 3.915 -61.038 -12.306 1.00 0.00 O ATOM 2529 CB GLU C 83 2.882 -63.759 -14.065 1.00 0.00 C ATOM 2530 CG GLU C 83 3.338 -64.736 -15.157 1.00 0.00 C ATOM 2531 CD GLU C 83 4.264 -64.060 -16.184 1.00 0.00 C ATOM 2532 OE1 GLU C 83 3.755 -63.369 -17.101 1.00 0.00 O1- ATOM 2533 OE2 GLU C 83 5.506 -64.215 -16.094 1.00 0.00 O ATOM 0 H GLU C 83 3.921 -65.266 -12.356 1.00 0.00 H new ATOM 0 HA GLU C 83 4.826 -62.930 -13.713 1.00 0.00 H new ATOM 0 HB2 GLU C 83 2.091 -64.229 -13.482 1.00 0.00 H new ATOM 0 HB3 GLU C 83 2.448 -62.879 -14.540 1.00 0.00 H new ATOM 0 HG2 GLU C 83 3.858 -65.576 -14.698 1.00 0.00 H new ATOM 0 HG3 GLU C 83 2.465 -65.142 -15.668 1.00 0.00 H new ATOM 2540 N GLN C 84 2.632 -62.525 -11.229 1.00 0.00 N ATOM 2541 CA GLN C 84 2.100 -61.602 -10.221 1.00 0.00 C ATOM 2542 C GLN C 84 3.204 -60.933 -9.389 1.00 0.00 C ATOM 2543 O GLN C 84 3.180 -59.720 -9.177 1.00 0.00 O ATOM 2544 CB GLN C 84 1.146 -62.381 -9.301 1.00 0.00 C ATOM 2545 CG GLN C 84 -0.160 -62.810 -9.988 1.00 0.00 C ATOM 2546 CD GLN C 84 -0.954 -61.645 -10.582 1.00 0.00 C ATOM 2547 OE1 GLN C 84 -1.465 -61.701 -11.692 1.00 0.00 O ATOM 2548 NE2 GLN C 84 -1.082 -60.548 -9.865 1.00 0.00 N ATOM 0 H GLN C 84 2.279 -63.476 -11.124 1.00 0.00 H new ATOM 0 HA GLN C 84 1.573 -60.801 -10.739 1.00 0.00 H new ATOM 0 HB2 GLN C 84 1.658 -63.268 -8.928 1.00 0.00 H new ATOM 0 HB3 GLN C 84 0.905 -61.764 -8.435 1.00 0.00 H new ATOM 0 HG2 GLN C 84 0.073 -63.521 -10.781 1.00 0.00 H new ATOM 0 HG3 GLN C 84 -0.786 -63.333 -9.265 1.00 0.00 H new ATOM 0 HE21 GLN C 84 -0.659 -60.492 -8.938 1.00 0.00 H new ATOM 0 HE22 GLN C 84 -1.604 -59.754 -10.236 1.00 0.00 H new ATOM 2557 N PHE C 85 4.201 -61.709 -8.967 1.00 0.00 N ATOM 2558 CA PHE C 85 5.401 -61.205 -8.291 1.00 0.00 C ATOM 2559 C PHE C 85 6.173 -60.192 -9.153 1.00 0.00 C ATOM 2560 O PHE C 85 6.384 -59.050 -8.733 1.00 0.00 O ATOM 2561 CB PHE C 85 6.283 -62.403 -7.915 1.00 0.00 C ATOM 2562 CG PHE C 85 7.617 -62.060 -7.289 1.00 0.00 C ATOM 2563 CD1 PHE C 85 7.657 -61.310 -6.103 1.00 0.00 C ATOM 2564 CD2 PHE C 85 8.814 -62.522 -7.867 1.00 0.00 C ATOM 2565 CE1 PHE C 85 8.884 -61.066 -5.459 1.00 0.00 C ATOM 2566 CE2 PHE C 85 10.044 -62.273 -7.229 1.00 0.00 C ATOM 2567 CZ PHE C 85 10.077 -61.559 -6.017 1.00 0.00 C ATOM 0 H PHE C 85 4.200 -62.722 -9.086 1.00 0.00 H new ATOM 0 HA PHE C 85 5.102 -60.666 -7.392 1.00 0.00 H new ATOM 0 HB2 PHE C 85 5.729 -63.037 -7.222 1.00 0.00 H new ATOM 0 HB3 PHE C 85 6.464 -62.994 -8.813 1.00 0.00 H new ATOM 0 HD1 PHE C 85 6.742 -60.919 -5.683 1.00 0.00 H new ATOM 0 HD2 PHE C 85 8.789 -63.067 -8.799 1.00 0.00 H new ATOM 0 HE1 PHE C 85 8.910 -60.502 -4.539 1.00 0.00 H new ATOM 0 HE2 PHE C 85 10.963 -62.630 -7.670 1.00 0.00 H new ATOM 0 HZ PHE C 85 11.018 -61.390 -5.515 1.00 0.00 H new ATOM 2577 N ALA C 86 6.513 -60.556 -10.393 1.00 0.00 N ATOM 2578 CA ALA C 86 7.153 -59.651 -11.346 1.00 0.00 C ATOM 2579 C ALA C 86 6.330 -58.376 -11.590 1.00 0.00 C ATOM 2580 O ALA C 86 6.896 -57.294 -11.743 1.00 0.00 O ATOM 2581 CB ALA C 86 7.338 -60.397 -12.668 1.00 0.00 C ATOM 0 H ALA C 86 6.350 -61.492 -10.764 1.00 0.00 H new ATOM 0 HA ALA C 86 8.111 -59.339 -10.929 1.00 0.00 H new ATOM 0 HB1 ALA C 86 7.815 -59.738 -13.394 1.00 0.00 H new ATOM 0 HB2 ALA C 86 7.965 -61.274 -12.506 1.00 0.00 H new ATOM 0 HB3 ALA C 86 6.366 -60.712 -13.047 1.00 0.00 H new ATOM 2587 N LEU C 87 4.997 -58.487 -11.577 1.00 0.00 N ATOM 2588 CA LEU C 87 4.073 -57.372 -11.772 1.00 0.00 C ATOM 2589 C LEU C 87 4.165 -56.393 -10.598 1.00 0.00 C ATOM 2590 O LEU C 87 4.278 -55.186 -10.808 1.00 0.00 O ATOM 2591 CB LEU C 87 2.618 -57.888 -11.938 1.00 0.00 C ATOM 2592 CG LEU C 87 1.997 -57.837 -13.345 1.00 0.00 C ATOM 2593 CD1 LEU C 87 2.150 -56.461 -13.997 1.00 0.00 C ATOM 2594 CD2 LEU C 87 2.569 -58.904 -14.272 1.00 0.00 C ATOM 0 H LEU C 87 4.523 -59.377 -11.427 1.00 0.00 H new ATOM 0 HA LEU C 87 4.355 -56.847 -12.685 1.00 0.00 H new ATOM 0 HB2 LEU C 87 2.588 -58.922 -11.595 1.00 0.00 H new ATOM 0 HB3 LEU C 87 1.979 -57.312 -11.268 1.00 0.00 H new ATOM 0 HG LEU C 87 0.935 -58.038 -13.200 1.00 0.00 H new ATOM 0 HD11 LEU C 87 1.696 -56.475 -14.988 1.00 0.00 H new ATOM 0 HD12 LEU C 87 1.655 -55.710 -13.382 1.00 0.00 H new ATOM 0 HD13 LEU C 87 3.208 -56.216 -14.086 1.00 0.00 H new ATOM 0 HD21 LEU C 87 2.098 -58.825 -15.252 1.00 0.00 H new ATOM 0 HD22 LEU C 87 3.645 -58.759 -14.374 1.00 0.00 H new ATOM 0 HD23 LEU C 87 2.374 -59.892 -13.854 1.00 0.00 H new ATOM 2606 N ALA C 88 4.160 -56.917 -9.371 1.00 0.00 N ATOM 2607 CA ALA C 88 4.276 -56.121 -8.147 1.00 0.00 C ATOM 2608 C ALA C 88 5.600 -55.339 -8.127 1.00 0.00 C ATOM 2609 O ALA C 88 5.607 -54.117 -7.964 1.00 0.00 O ATOM 2610 CB ALA C 88 4.123 -57.055 -6.937 1.00 0.00 C ATOM 0 H ALA C 88 4.074 -57.918 -9.197 1.00 0.00 H new ATOM 0 HA ALA C 88 3.483 -55.374 -8.106 1.00 0.00 H new ATOM 0 HB1 ALA C 88 4.207 -56.476 -6.017 1.00 0.00 H new ATOM 0 HB2 ALA C 88 3.147 -57.540 -6.973 1.00 0.00 H new ATOM 0 HB3 ALA C 88 4.906 -57.813 -6.961 1.00 0.00 H new ATOM 2616 N LEU C 89 6.708 -56.033 -8.407 1.00 0.00 N ATOM 2617 CA LEU C 89 8.043 -55.438 -8.536 1.00 0.00 C ATOM 2618 C LEU C 89 8.081 -54.347 -9.619 1.00 0.00 C ATOM 2619 O LEU C 89 8.541 -53.240 -9.353 1.00 0.00 O ATOM 2620 CB LEU C 89 9.043 -56.561 -8.857 1.00 0.00 C ATOM 2621 CG LEU C 89 9.583 -57.353 -7.648 1.00 0.00 C ATOM 2622 CD1 LEU C 89 8.588 -57.642 -6.520 1.00 0.00 C ATOM 2623 CD2 LEU C 89 10.105 -58.698 -8.148 1.00 0.00 C ATOM 0 H LEU C 89 6.702 -57.042 -8.553 1.00 0.00 H new ATOM 0 HA LEU C 89 8.310 -54.953 -7.597 1.00 0.00 H new ATOM 0 HB2 LEU C 89 8.564 -57.262 -9.541 1.00 0.00 H new ATOM 0 HB3 LEU C 89 9.889 -56.126 -9.388 1.00 0.00 H new ATOM 0 HG LEU C 89 10.346 -56.708 -7.213 1.00 0.00 H new ATOM 0 HD11 LEU C 89 9.087 -58.203 -5.730 1.00 0.00 H new ATOM 0 HD12 LEU C 89 8.213 -56.702 -6.116 1.00 0.00 H new ATOM 0 HD13 LEU C 89 7.755 -58.227 -6.910 1.00 0.00 H new ATOM 0 HD21 LEU C 89 10.492 -59.274 -7.307 1.00 0.00 H new ATOM 0 HD22 LEU C 89 9.293 -59.250 -8.623 1.00 0.00 H new ATOM 0 HD23 LEU C 89 10.903 -58.532 -8.872 1.00 0.00 H new ATOM 2635 N LYS C 90 7.522 -54.613 -10.804 1.00 0.00 N ATOM 2636 CA LYS C 90 7.463 -53.670 -11.935 1.00 0.00 C ATOM 2637 C LYS C 90 6.682 -52.401 -11.604 1.00 0.00 C ATOM 2638 O LYS C 90 7.166 -51.302 -11.859 1.00 0.00 O ATOM 2639 CB LYS C 90 6.893 -54.439 -13.135 1.00 0.00 C ATOM 2640 CG LYS C 90 6.833 -53.665 -14.465 1.00 0.00 C ATOM 2641 CD LYS C 90 5.541 -52.871 -14.732 1.00 0.00 C ATOM 2642 CE LYS C 90 4.294 -53.772 -14.694 1.00 0.00 C ATOM 2643 NZ LYS C 90 3.126 -53.145 -15.384 1.00 0.00 N1+ ATOM 0 H LYS C 90 7.086 -55.511 -11.012 1.00 0.00 H new ATOM 0 HA LYS C 90 8.461 -53.304 -12.175 1.00 0.00 H new ATOM 0 HB2 LYS C 90 7.494 -55.335 -13.286 1.00 0.00 H new ATOM 0 HB3 LYS C 90 5.885 -54.770 -12.884 1.00 0.00 H new ATOM 0 HG2 LYS C 90 7.674 -52.972 -14.496 1.00 0.00 H new ATOM 0 HG3 LYS C 90 6.974 -54.374 -15.281 1.00 0.00 H new ATOM 0 HD2 LYS C 90 5.440 -52.081 -13.988 1.00 0.00 H new ATOM 0 HD3 LYS C 90 5.608 -52.385 -15.706 1.00 0.00 H new ATOM 0 HE2 LYS C 90 4.523 -54.727 -15.166 1.00 0.00 H new ATOM 0 HE3 LYS C 90 4.031 -53.983 -13.657 1.00 0.00 H new ATOM 0 HZ1 LYS C 90 2.308 -53.786 -15.334 1.00 0.00 H new ATOM 0 HZ2 LYS C 90 2.890 -52.246 -14.918 1.00 0.00 H new ATOM 0 HZ3 LYS C 90 3.366 -52.967 -16.380 1.00 0.00 H new ATOM 2657 N MET C 91 5.508 -52.520 -10.982 1.00 0.00 N ATOM 2658 CA MET C 91 4.737 -51.355 -10.503 1.00 0.00 C ATOM 2659 C MET C 91 5.514 -50.542 -9.459 1.00 0.00 C ATOM 2660 O MET C 91 5.547 -49.313 -9.521 1.00 0.00 O ATOM 2661 CB MET C 91 3.379 -51.821 -9.957 1.00 0.00 C ATOM 2662 CG MET C 91 2.518 -52.285 -11.135 1.00 0.00 C ATOM 2663 SD MET C 91 0.851 -52.867 -10.713 1.00 0.00 S ATOM 2664 CE MET C 91 1.238 -54.542 -10.141 1.00 0.00 C ATOM 0 H MET C 91 5.061 -53.417 -10.793 1.00 0.00 H new ATOM 0 HA MET C 91 4.566 -50.687 -11.347 1.00 0.00 H new ATOM 0 HB2 MET C 91 3.516 -52.634 -9.244 1.00 0.00 H new ATOM 0 HB3 MET C 91 2.886 -51.009 -9.424 1.00 0.00 H new ATOM 0 HG2 MET C 91 2.426 -51.460 -11.841 1.00 0.00 H new ATOM 0 HG3 MET C 91 3.044 -53.089 -11.651 1.00 0.00 H new ATOM 0 HE1 MET C 91 0.321 -55.039 -9.824 1.00 0.00 H new ATOM 0 HE2 MET C 91 1.695 -55.107 -10.953 1.00 0.00 H new ATOM 0 HE3 MET C 91 1.931 -54.489 -9.301 1.00 0.00 H new ATOM 2674 N SER C 92 6.225 -51.239 -8.578 1.00 0.00 N ATOM 2675 CA SER C 92 7.133 -50.633 -7.590 1.00 0.00 C ATOM 2676 C SER C 92 8.306 -49.876 -8.235 1.00 0.00 C ATOM 2677 O SER C 92 8.674 -48.785 -7.790 1.00 0.00 O ATOM 2678 CB SER C 92 7.643 -51.737 -6.660 1.00 0.00 C ATOM 2679 OG SER C 92 7.793 -51.236 -5.346 1.00 0.00 O ATOM 0 H SER C 92 6.191 -52.257 -8.524 1.00 0.00 H new ATOM 0 HA SER C 92 6.574 -49.886 -7.027 1.00 0.00 H new ATOM 0 HB2 SER C 92 6.945 -52.575 -6.661 1.00 0.00 H new ATOM 0 HB3 SER C 92 8.598 -52.117 -7.024 1.00 0.00 H new ATOM 0 HG SER C 92 6.910 -51.129 -4.934 1.00 0.00 H new ATOM 2685 N GLU C 93 8.858 -50.405 -9.330 1.00 0.00 N ATOM 2686 CA GLU C 93 9.965 -49.766 -10.063 1.00 0.00 C ATOM 2687 C GLU C 93 9.497 -48.529 -10.845 1.00 0.00 C ATOM 2688 O GLU C 93 10.168 -47.493 -10.819 1.00 0.00 O ATOM 2689 CB GLU C 93 10.644 -50.780 -11.000 1.00 0.00 C ATOM 2690 CG GLU C 93 11.542 -51.764 -10.238 1.00 0.00 C ATOM 2691 CD GLU C 93 12.199 -52.767 -11.206 1.00 0.00 C ATOM 2692 OE1 GLU C 93 13.257 -52.436 -11.797 1.00 0.00 O ATOM 2693 OE2 GLU C 93 11.671 -53.893 -11.383 1.00 0.00 O1- ATOM 0 H GLU C 93 8.553 -51.289 -9.737 1.00 0.00 H new ATOM 0 HA GLU C 93 10.694 -49.425 -9.327 1.00 0.00 H new ATOM 0 HB2 GLU C 93 9.881 -51.335 -11.546 1.00 0.00 H new ATOM 0 HB3 GLU C 93 11.240 -50.246 -11.740 1.00 0.00 H new ATOM 0 HG2 GLU C 93 12.313 -51.216 -9.697 1.00 0.00 H new ATOM 0 HG3 GLU C 93 10.952 -52.301 -9.495 1.00 0.00 H new ATOM 2700 N GLN C 94 8.318 -48.595 -11.477 1.00 0.00 N ATOM 2701 CA GLN C 94 7.709 -47.429 -12.129 1.00 0.00 C ATOM 2702 C GLN C 94 7.456 -46.303 -11.121 1.00 0.00 C ATOM 2703 O GLN C 94 7.902 -45.181 -11.363 1.00 0.00 O ATOM 2704 CB GLN C 94 6.391 -47.797 -12.818 1.00 0.00 C ATOM 2705 CG GLN C 94 6.555 -48.705 -14.046 1.00 0.00 C ATOM 2706 CD GLN C 94 5.205 -48.972 -14.706 1.00 0.00 C ATOM 2707 OE1 GLN C 94 4.262 -49.564 -13.996 1.00 0.00 O flip ATOM 2708 NE2 GLN C 94 4.964 -48.640 -15.859 1.00 0.00 N flip ATOM 0 H GLN C 94 7.765 -49.449 -11.550 1.00 0.00 H new ATOM 0 HA GLN C 94 8.415 -47.083 -12.883 1.00 0.00 H new ATOM 0 HB2 GLN C 94 5.743 -48.294 -12.096 1.00 0.00 H new ATOM 0 HB3 GLN C 94 5.885 -46.881 -13.122 1.00 0.00 H new ATOM 0 HG2 GLN C 94 7.229 -48.237 -14.763 1.00 0.00 H new ATOM 0 HG3 GLN C 94 7.012 -49.649 -13.748 1.00 0.00 H new ATOM 0 HE21 GLN C 94 5.683 -48.182 -16.419 1.00 0.00 H new ATOM 0 HE22 GLN C 94 4.044 -48.821 -16.260 1.00 0.00 H new ATOM 2717 N GLU C 95 6.823 -46.612 -9.978 1.00 0.00 N ATOM 2718 CA GLU C 95 6.600 -45.653 -8.886 1.00 0.00 C ATOM 2719 C GLU C 95 7.920 -45.009 -8.434 1.00 0.00 C ATOM 2720 O GLU C 95 8.018 -43.784 -8.365 1.00 0.00 O ATOM 2721 CB GLU C 95 5.913 -46.341 -7.691 1.00 0.00 C ATOM 2722 CG GLU C 95 4.420 -46.633 -7.902 1.00 0.00 C ATOM 2723 CD GLU C 95 3.537 -45.400 -7.614 1.00 0.00 C ATOM 2724 OE1 GLU C 95 3.575 -44.420 -8.395 1.00 0.00 O ATOM 2725 OE2 GLU C 95 2.790 -45.413 -6.605 1.00 0.00 O1- ATOM 0 H GLU C 95 6.449 -47.541 -9.785 1.00 0.00 H new ATOM 0 HA GLU C 95 5.947 -44.867 -9.264 1.00 0.00 H new ATOM 0 HB2 GLU C 95 6.428 -47.278 -7.481 1.00 0.00 H new ATOM 0 HB3 GLU C 95 6.027 -45.710 -6.809 1.00 0.00 H new ATOM 0 HG2 GLU C 95 4.258 -46.962 -8.928 1.00 0.00 H new ATOM 0 HG3 GLU C 95 4.117 -47.454 -7.252 1.00 0.00 H new ATOM 2732 N ALA C 96 8.971 -45.806 -8.210 1.00 0.00 N ATOM 2733 CA ALA C 96 10.287 -45.277 -7.841 1.00 0.00 C ATOM 2734 C ALA C 96 10.846 -44.298 -8.890 1.00 0.00 C ATOM 2735 O ALA C 96 11.360 -43.231 -8.537 1.00 0.00 O ATOM 2736 CB ALA C 96 11.241 -46.454 -7.613 1.00 0.00 C ATOM 0 H ALA C 96 8.934 -46.823 -8.278 1.00 0.00 H new ATOM 0 HA ALA C 96 10.184 -44.699 -6.923 1.00 0.00 H new ATOM 0 HB1 ALA C 96 12.226 -46.076 -7.337 1.00 0.00 H new ATOM 0 HB2 ALA C 96 10.856 -47.084 -6.811 1.00 0.00 H new ATOM 0 HB3 ALA C 96 11.321 -47.040 -8.528 1.00 0.00 H new ATOM 2742 N ARG C 97 10.712 -44.627 -10.180 1.00 0.00 N ATOM 2743 CA ARG C 97 11.270 -43.833 -11.284 1.00 0.00 C ATOM 2744 C ARG C 97 10.575 -42.485 -11.435 1.00 0.00 C ATOM 2745 O ARG C 97 11.241 -41.455 -11.532 1.00 0.00 O ATOM 2746 CB ARG C 97 11.207 -44.655 -12.583 1.00 0.00 C ATOM 2747 CG ARG C 97 12.153 -44.066 -13.645 1.00 0.00 C ATOM 2748 CD ARG C 97 12.355 -44.989 -14.853 1.00 0.00 C ATOM 2749 NE ARG C 97 11.184 -45.018 -15.753 1.00 0.00 N ATOM 2750 CZ ARG C 97 11.124 -45.622 -16.929 1.00 0.00 C ATOM 2751 NH1 ARG C 97 12.116 -46.332 -17.391 1.00 0.00 N1+ ATOM 2752 NH2 ARG C 97 10.059 -45.522 -17.672 1.00 0.00 N ATOM 0 H ARG C 97 10.209 -45.458 -10.491 1.00 0.00 H new ATOM 0 HA ARG C 97 12.312 -43.607 -11.055 1.00 0.00 H new ATOM 0 HB2 ARG C 97 11.481 -45.690 -12.378 1.00 0.00 H new ATOM 0 HB3 ARG C 97 10.186 -44.665 -12.964 1.00 0.00 H new ATOM 0 HG2 ARG C 97 11.754 -43.111 -13.988 1.00 0.00 H new ATOM 0 HG3 ARG C 97 13.121 -43.861 -13.187 1.00 0.00 H new ATOM 0 HD2 ARG C 97 13.230 -44.660 -15.413 1.00 0.00 H new ATOM 0 HD3 ARG C 97 12.563 -46.000 -14.502 1.00 0.00 H new ATOM 0 HE ARG C 97 10.346 -44.528 -15.440 1.00 0.00 H new ATOM 0 HH11 ARG C 97 12.969 -46.434 -16.842 1.00 0.00 H new ATOM 0 HH12 ARG C 97 12.038 -46.785 -18.302 1.00 0.00 H new ATOM 0 HH21 ARG C 97 9.261 -44.974 -17.349 1.00 0.00 H new ATOM 0 HH22 ARG C 97 10.023 -45.991 -18.577 1.00 0.00 H new ATOM 2766 N GLU C 98 9.244 -42.467 -11.393 1.00 0.00 N ATOM 2767 CA GLU C 98 8.475 -41.218 -11.492 1.00 0.00 C ATOM 2768 C GLU C 98 8.610 -40.345 -10.234 1.00 0.00 C ATOM 2769 O GLU C 98 8.669 -39.121 -10.353 1.00 0.00 O ATOM 2770 CB GLU C 98 7.010 -41.492 -11.850 1.00 0.00 C ATOM 2771 CG GLU C 98 6.245 -42.269 -10.778 1.00 0.00 C ATOM 2772 CD GLU C 98 4.802 -42.520 -11.253 1.00 0.00 C ATOM 2773 OE1 GLU C 98 4.542 -43.548 -11.927 1.00 0.00 O ATOM 2774 OE2 GLU C 98 3.923 -41.656 -11.003 1.00 0.00 O1- ATOM 0 H GLU C 98 8.670 -43.304 -11.291 1.00 0.00 H new ATOM 0 HA GLU C 98 8.907 -40.641 -12.309 1.00 0.00 H new ATOM 0 HB2 GLU C 98 6.505 -40.542 -12.026 1.00 0.00 H new ATOM 0 HB3 GLU C 98 6.973 -42.050 -12.785 1.00 0.00 H new ATOM 0 HG2 GLU C 98 6.743 -43.218 -10.577 1.00 0.00 H new ATOM 0 HG3 GLU C 98 6.239 -41.708 -9.843 1.00 0.00 H new ATOM 2781 N VAL C 99 8.754 -40.947 -9.044 1.00 0.00 N ATOM 2782 CA VAL C 99 9.041 -40.206 -7.804 1.00 0.00 C ATOM 2783 C VAL C 99 10.406 -39.513 -7.887 1.00 0.00 C ATOM 2784 O VAL C 99 10.501 -38.312 -7.629 1.00 0.00 O ATOM 2785 CB VAL C 99 8.932 -41.129 -6.576 1.00 0.00 C ATOM 2786 CG1 VAL C 99 9.428 -40.445 -5.302 1.00 0.00 C ATOM 2787 CG2 VAL C 99 7.469 -41.519 -6.324 1.00 0.00 C ATOM 0 H VAL C 99 8.676 -41.955 -8.913 1.00 0.00 H new ATOM 0 HA VAL C 99 8.290 -39.425 -7.685 1.00 0.00 H new ATOM 0 HB VAL C 99 9.546 -42.002 -6.796 1.00 0.00 H new ATOM 0 HG11 VAL C 99 9.333 -41.131 -4.460 1.00 0.00 H new ATOM 0 HG12 VAL C 99 10.474 -40.162 -5.424 1.00 0.00 H new ATOM 0 HG13 VAL C 99 8.831 -39.553 -5.112 1.00 0.00 H new ATOM 0 HG21 VAL C 99 7.411 -42.171 -5.453 1.00 0.00 H new ATOM 0 HG22 VAL C 99 6.879 -40.620 -6.144 1.00 0.00 H new ATOM 0 HG23 VAL C 99 7.077 -42.043 -7.196 1.00 0.00 H new ATOM 2797 N ASN C 100 11.453 -40.221 -8.326 1.00 0.00 N ATOM 2798 CA ASN C 100 12.768 -39.608 -8.548 1.00 0.00 C ATOM 2799 C ASN C 100 12.708 -38.487 -9.608 1.00 0.00 C ATOM 2800 O ASN C 100 13.269 -37.407 -9.401 1.00 0.00 O ATOM 2801 CB ASN C 100 13.784 -40.704 -8.921 1.00 0.00 C ATOM 2802 CG ASN C 100 14.349 -41.394 -7.689 1.00 0.00 C ATOM 2803 OD1 ASN C 100 15.365 -40.994 -7.137 1.00 0.00 O ATOM 2804 ND2 ASN C 100 13.705 -42.428 -7.199 1.00 0.00 N ATOM 0 H ASN C 100 11.415 -41.219 -8.535 1.00 0.00 H new ATOM 0 HA ASN C 100 13.095 -39.129 -7.625 1.00 0.00 H new ATOM 0 HB2 ASN C 100 13.303 -41.442 -9.562 1.00 0.00 H new ATOM 0 HB3 ASN C 100 14.598 -40.264 -9.497 1.00 0.00 H new ATOM 0 HD21 ASN C 100 14.052 -42.895 -6.361 1.00 0.00 H new ATOM 0 HD22 ASN C 100 12.858 -42.765 -7.656 1.00 0.00 H new ATOM 2811 N SER C 101 11.964 -38.716 -10.697 1.00 0.00 N ATOM 2812 CA SER C 101 11.793 -37.749 -11.787 1.00 0.00 C ATOM 2813 C SER C 101 11.105 -36.455 -11.328 1.00 0.00 C ATOM 2814 O SER C 101 11.583 -35.362 -11.641 1.00 0.00 O ATOM 2815 CB SER C 101 11.018 -38.396 -12.941 1.00 0.00 C ATOM 2816 OG SER C 101 10.992 -37.537 -14.069 1.00 0.00 O ATOM 0 H SER C 101 11.458 -39.589 -10.847 1.00 0.00 H new ATOM 0 HA SER C 101 12.788 -37.466 -12.131 1.00 0.00 H new ATOM 0 HB2 SER C 101 11.482 -39.345 -13.211 1.00 0.00 H new ATOM 0 HB3 SER C 101 9.999 -38.618 -12.623 1.00 0.00 H new ATOM 0 HG SER C 101 10.495 -37.967 -14.796 1.00 0.00 H new ATOM 2822 N GLN C 102 10.028 -36.538 -10.534 1.00 0.00 N ATOM 2823 CA GLN C 102 9.360 -35.330 -10.031 1.00 0.00 C ATOM 2824 C GLN C 102 10.196 -34.615 -8.951 1.00 0.00 C ATOM 2825 O GLN C 102 10.261 -33.386 -8.953 1.00 0.00 O ATOM 2826 CB GLN C 102 7.910 -35.620 -9.601 1.00 0.00 C ATOM 2827 CG GLN C 102 7.777 -36.416 -8.294 1.00 0.00 C ATOM 2828 CD GLN C 102 6.336 -36.774 -7.924 1.00 0.00 C ATOM 2829 OE1 GLN C 102 5.378 -36.554 -8.654 1.00 0.00 O ATOM 2830 NE2 GLN C 102 6.126 -37.356 -6.760 1.00 0.00 N ATOM 0 H GLN C 102 9.606 -37.415 -10.230 1.00 0.00 H new ATOM 0 HA GLN C 102 9.288 -34.622 -10.857 1.00 0.00 H new ATOM 0 HB2 GLN C 102 7.382 -34.673 -9.490 1.00 0.00 H new ATOM 0 HB3 GLN C 102 7.412 -36.171 -10.399 1.00 0.00 H new ATOM 0 HG2 GLN C 102 8.358 -37.335 -8.380 1.00 0.00 H new ATOM 0 HG3 GLN C 102 8.216 -35.836 -7.482 1.00 0.00 H new ATOM 0 HE21 GLN C 102 6.910 -37.548 -6.137 1.00 0.00 H new ATOM 0 HE22 GLN C 102 5.179 -37.614 -6.482 1.00 0.00 H new ATOM 2839 N GLU C 103 10.904 -35.354 -8.084 1.00 0.00 N ATOM 2840 CA GLU C 103 11.797 -34.752 -7.082 1.00 0.00 C ATOM 2841 C GLU C 103 12.935 -33.930 -7.721 1.00 0.00 C ATOM 2842 O GLU C 103 13.163 -32.788 -7.307 1.00 0.00 O ATOM 2843 CB GLU C 103 12.377 -35.836 -6.158 1.00 0.00 C ATOM 2844 CG GLU C 103 11.368 -36.359 -5.125 1.00 0.00 C ATOM 2845 CD GLU C 103 11.091 -35.318 -4.024 1.00 0.00 C ATOM 2846 OE1 GLU C 103 11.906 -35.204 -3.076 1.00 0.00 O1- ATOM 2847 OE2 GLU C 103 10.054 -34.614 -4.093 1.00 0.00 O ATOM 0 H GLU C 103 10.875 -36.373 -8.057 1.00 0.00 H new ATOM 0 HA GLU C 103 11.193 -34.061 -6.494 1.00 0.00 H new ATOM 0 HB2 GLU C 103 12.730 -36.670 -6.765 1.00 0.00 H new ATOM 0 HB3 GLU C 103 13.244 -35.432 -5.636 1.00 0.00 H new ATOM 0 HG2 GLU C 103 10.435 -36.617 -5.626 1.00 0.00 H new ATOM 0 HG3 GLU C 103 11.751 -37.274 -4.673 1.00 0.00 H new ATOM 2854 N GLU C 104 13.625 -34.459 -8.745 1.00 0.00 N ATOM 2855 CA GLU C 104 14.696 -33.698 -9.407 1.00 0.00 C ATOM 2856 C GLU C 104 14.164 -32.491 -10.207 1.00 0.00 C ATOM 2857 O GLU C 104 14.805 -31.438 -10.224 1.00 0.00 O ATOM 2858 CB GLU C 104 15.619 -34.604 -10.244 1.00 0.00 C ATOM 2859 CG GLU C 104 15.004 -35.166 -11.531 1.00 0.00 C ATOM 2860 CD GLU C 104 16.018 -36.041 -12.290 1.00 0.00 C ATOM 2861 OE1 GLU C 104 16.843 -35.490 -13.061 1.00 0.00 O ATOM 2862 OE2 GLU C 104 16.001 -37.288 -12.131 1.00 0.00 O1- ATOM 0 H GLU C 104 13.465 -35.392 -9.126 1.00 0.00 H new ATOM 0 HA GLU C 104 15.312 -33.278 -8.612 1.00 0.00 H new ATOM 0 HB2 GLU C 104 16.513 -34.039 -10.506 1.00 0.00 H new ATOM 0 HB3 GLU C 104 15.941 -35.439 -9.622 1.00 0.00 H new ATOM 0 HG2 GLU C 104 14.119 -35.755 -11.289 1.00 0.00 H new ATOM 0 HG3 GLU C 104 14.676 -34.346 -12.170 1.00 0.00 H new ATOM 2869 N GLU C 105 12.972 -32.596 -10.809 1.00 0.00 N ATOM 2870 CA GLU C 105 12.321 -31.480 -11.505 1.00 0.00 C ATOM 2871 C GLU C 105 11.900 -30.354 -10.545 1.00 0.00 C ATOM 2872 O GLU C 105 12.148 -29.186 -10.848 1.00 0.00 O ATOM 2873 CB GLU C 105 11.109 -31.979 -12.309 1.00 0.00 C ATOM 2874 CG GLU C 105 11.506 -32.739 -13.583 1.00 0.00 C ATOM 2875 CD GLU C 105 11.996 -31.783 -14.687 1.00 0.00 C ATOM 2876 OE1 GLU C 105 11.150 -31.238 -15.439 1.00 0.00 O ATOM 2877 OE2 GLU C 105 13.226 -31.573 -14.821 1.00 0.00 O1- ATOM 0 H GLU C 105 12.431 -33.460 -10.827 1.00 0.00 H new ATOM 0 HA GLU C 105 13.057 -31.060 -12.190 1.00 0.00 H new ATOM 0 HB2 GLU C 105 10.504 -32.630 -11.678 1.00 0.00 H new ATOM 0 HB3 GLU C 105 10.484 -31.128 -12.580 1.00 0.00 H new ATOM 0 HG2 GLU C 105 12.292 -33.457 -13.348 1.00 0.00 H new ATOM 0 HG3 GLU C 105 10.652 -33.309 -13.948 1.00 0.00 H new ATOM 2884 N GLU C 106 11.325 -30.668 -9.379 1.00 0.00 N ATOM 2885 CA GLU C 106 10.988 -29.669 -8.355 1.00 0.00 C ATOM 2886 C GLU C 106 12.236 -29.001 -7.745 1.00 0.00 C ATOM 2887 O GLU C 106 12.248 -27.781 -7.547 1.00 0.00 O ATOM 2888 CB GLU C 106 10.139 -30.301 -7.237 1.00 0.00 C ATOM 2889 CG GLU C 106 8.636 -30.044 -7.382 1.00 0.00 C ATOM 2890 CD GLU C 106 7.969 -30.860 -8.505 1.00 0.00 C ATOM 2891 OE1 GLU C 106 7.460 -31.973 -8.234 1.00 0.00 O ATOM 2892 OE2 GLU C 106 7.852 -30.350 -9.647 1.00 0.00 O1- ATOM 0 H GLU C 106 11.079 -31.623 -9.117 1.00 0.00 H new ATOM 0 HA GLU C 106 10.412 -28.892 -8.858 1.00 0.00 H new ATOM 0 HB2 GLU C 106 10.315 -31.377 -7.224 1.00 0.00 H new ATOM 0 HB3 GLU C 106 10.474 -29.912 -6.275 1.00 0.00 H new ATOM 0 HG2 GLU C 106 8.145 -30.276 -6.437 1.00 0.00 H new ATOM 0 HG3 GLU C 106 8.475 -28.983 -7.573 1.00 0.00 H new ATOM 2899 N GLU C 107 13.301 -29.767 -7.471 1.00 0.00 N ATOM 2900 CA GLU C 107 14.561 -29.206 -6.969 1.00 0.00 C ATOM 2901 C GLU C 107 15.232 -28.270 -7.996 1.00 0.00 C ATOM 2902 O GLU C 107 15.668 -27.164 -7.643 1.00 0.00 O ATOM 2903 CB GLU C 107 15.500 -30.353 -6.559 1.00 0.00 C ATOM 2904 CG GLU C 107 16.784 -29.845 -5.893 1.00 0.00 C ATOM 2905 CD GLU C 107 17.642 -31.018 -5.386 1.00 0.00 C ATOM 2906 OE1 GLU C 107 18.437 -31.583 -6.178 1.00 0.00 O ATOM 2907 OE2 GLU C 107 17.541 -31.376 -4.187 1.00 0.00 O1- ATOM 0 H GLU C 107 13.314 -30.780 -7.589 1.00 0.00 H new ATOM 0 HA GLU C 107 14.341 -28.592 -6.096 1.00 0.00 H new ATOM 0 HB2 GLU C 107 14.977 -31.020 -5.873 1.00 0.00 H new ATOM 0 HB3 GLU C 107 15.758 -30.940 -7.440 1.00 0.00 H new ATOM 0 HG2 GLU C 107 17.357 -29.251 -6.605 1.00 0.00 H new ATOM 0 HG3 GLU C 107 16.531 -29.188 -5.061 1.00 0.00 H new ATOM 2914 N GLU C 108 15.274 -28.666 -9.277 1.00 0.00 N ATOM 2915 CA GLU C 108 15.861 -27.841 -10.321 1.00 0.00 C ATOM 2916 C GLU C 108 14.989 -26.604 -10.549 1.00 0.00 C ATOM 2917 O GLU C 108 15.534 -25.512 -10.654 1.00 0.00 O ATOM 2918 CB GLU C 108 16.065 -28.662 -11.606 1.00 0.00 C ATOM 2919 CG GLU C 108 17.133 -28.071 -12.536 1.00 0.00 C ATOM 2920 CD GLU C 108 18.561 -28.338 -12.018 1.00 0.00 C ATOM 2921 OE1 GLU C 108 19.149 -29.390 -12.368 1.00 0.00 O1- ATOM 2922 OE2 GLU C 108 19.112 -27.491 -11.274 1.00 0.00 O ATOM 0 H GLU C 108 14.904 -29.558 -9.607 1.00 0.00 H new ATOM 0 HA GLU C 108 16.847 -27.498 -10.009 1.00 0.00 H new ATOM 0 HB2 GLU C 108 16.348 -29.680 -11.338 1.00 0.00 H new ATOM 0 HB3 GLU C 108 15.119 -28.725 -12.143 1.00 0.00 H new ATOM 0 HG2 GLU C 108 17.023 -28.499 -13.533 1.00 0.00 H new ATOM 0 HG3 GLU C 108 16.977 -26.996 -12.631 1.00 0.00 H new ATOM 2929 N LEU C 109 13.654 -26.726 -10.537 1.00 0.00 N ATOM 2930 CA LEU C 109 12.726 -25.593 -10.598 1.00 0.00 C ATOM 2931 C LEU C 109 13.025 -24.557 -9.511 1.00 0.00 C ATOM 2932 O LEU C 109 13.191 -23.381 -9.830 1.00 0.00 O ATOM 2933 CB LEU C 109 11.276 -26.118 -10.519 1.00 0.00 C ATOM 2934 CG LEU C 109 10.145 -25.071 -10.554 1.00 0.00 C ATOM 2935 CD1 LEU C 109 9.958 -24.292 -9.245 1.00 0.00 C ATOM 2936 CD2 LEU C 109 10.348 -24.089 -11.705 1.00 0.00 C ATOM 0 H LEU C 109 13.184 -27.630 -10.484 1.00 0.00 H new ATOM 0 HA LEU C 109 12.857 -25.076 -11.549 1.00 0.00 H new ATOM 0 HB2 LEU C 109 11.122 -26.810 -11.347 1.00 0.00 H new ATOM 0 HB3 LEU C 109 11.175 -26.694 -9.599 1.00 0.00 H new ATOM 0 HG LEU C 109 9.233 -25.649 -10.703 1.00 0.00 H new ATOM 0 HD11 LEU C 109 9.142 -23.578 -9.360 1.00 0.00 H new ATOM 0 HD12 LEU C 109 9.722 -24.987 -8.439 1.00 0.00 H new ATOM 0 HD13 LEU C 109 10.877 -23.757 -9.005 1.00 0.00 H new ATOM 0 HD21 LEU C 109 9.537 -23.360 -11.709 1.00 0.00 H new ATOM 0 HD22 LEU C 109 11.300 -23.573 -11.579 1.00 0.00 H new ATOM 0 HD23 LEU C 109 10.352 -24.632 -12.650 1.00 0.00 H new ATOM 2948 N LEU C 110 13.132 -24.975 -8.247 1.00 0.00 N ATOM 2949 CA LEU C 110 13.481 -24.070 -7.148 1.00 0.00 C ATOM 2950 C LEU C 110 14.819 -23.357 -7.431 1.00 0.00 C ATOM 2951 O LEU C 110 14.876 -22.124 -7.395 1.00 0.00 O ATOM 2952 CB LEU C 110 13.473 -24.862 -5.826 1.00 0.00 C ATOM 2953 CG LEU C 110 13.804 -24.033 -4.568 1.00 0.00 C ATOM 2954 CD1 LEU C 110 12.799 -22.908 -4.308 1.00 0.00 C ATOM 2955 CD2 LEU C 110 13.807 -24.947 -3.343 1.00 0.00 C ATOM 0 H LEU C 110 12.981 -25.941 -7.958 1.00 0.00 H new ATOM 0 HA LEU C 110 12.740 -23.276 -7.058 1.00 0.00 H new ATOM 0 HB2 LEU C 110 12.490 -25.314 -5.697 1.00 0.00 H new ATOM 0 HB3 LEU C 110 14.191 -25.678 -5.904 1.00 0.00 H new ATOM 0 HG LEU C 110 14.781 -23.583 -4.743 1.00 0.00 H new ATOM 0 HD11 LEU C 110 13.088 -22.363 -3.410 1.00 0.00 H new ATOM 0 HD12 LEU C 110 12.788 -22.226 -5.158 1.00 0.00 H new ATOM 0 HD13 LEU C 110 11.805 -23.333 -4.171 1.00 0.00 H new ATOM 0 HD21 LEU C 110 14.041 -24.362 -2.453 1.00 0.00 H new ATOM 0 HD22 LEU C 110 12.825 -25.405 -3.228 1.00 0.00 H new ATOM 0 HD23 LEU C 110 14.558 -25.727 -3.472 1.00 0.00 H new ATOM 2967 N ARG C 111 15.862 -24.101 -7.830 1.00 0.00 N ATOM 2968 CA ARG C 111 17.159 -23.522 -8.241 1.00 0.00 C ATOM 2969 C ARG C 111 17.002 -22.496 -9.380 1.00 0.00 C ATOM 2970 O ARG C 111 17.465 -21.366 -9.244 1.00 0.00 O ATOM 2971 CB ARG C 111 18.127 -24.672 -8.597 1.00 0.00 C ATOM 2972 CG ARG C 111 19.623 -24.310 -8.598 1.00 0.00 C ATOM 2973 CD ARG C 111 20.000 -23.157 -9.539 1.00 0.00 C ATOM 2974 NE ARG C 111 21.446 -23.170 -9.843 1.00 0.00 N ATOM 2975 CZ ARG C 111 22.051 -22.757 -10.945 1.00 0.00 C ATOM 2976 NH1 ARG C 111 21.397 -22.278 -11.967 1.00 0.00 N1+ ATOM 2977 NH2 ARG C 111 23.348 -22.816 -11.038 1.00 0.00 N ATOM 0 H ARG C 111 15.835 -25.119 -7.878 1.00 0.00 H new ATOM 0 HA ARG C 111 17.582 -22.957 -7.410 1.00 0.00 H new ATOM 0 HB2 ARG C 111 17.970 -25.486 -7.890 1.00 0.00 H new ATOM 0 HB3 ARG C 111 17.863 -25.052 -9.584 1.00 0.00 H new ATOM 0 HG2 ARG C 111 19.920 -24.046 -7.583 1.00 0.00 H new ATOM 0 HG3 ARG C 111 20.197 -25.193 -8.878 1.00 0.00 H new ATOM 0 HD2 ARG C 111 19.430 -23.238 -10.465 1.00 0.00 H new ATOM 0 HD3 ARG C 111 19.730 -22.206 -9.080 1.00 0.00 H new ATOM 0 HE ARG C 111 22.053 -23.544 -9.113 1.00 0.00 H new ATOM 0 HH11 ARG C 111 20.380 -22.211 -11.935 1.00 0.00 H new ATOM 0 HH12 ARG C 111 21.903 -21.971 -12.798 1.00 0.00 H new ATOM 0 HH21 ARG C 111 23.899 -23.181 -10.261 1.00 0.00 H new ATOM 0 HH22 ARG C 111 23.813 -22.497 -11.888 1.00 0.00 H new ATOM 2991 N LYS C 112 16.318 -22.848 -10.473 1.00 0.00 N ATOM 2992 CA LYS C 112 16.010 -21.979 -11.632 1.00 0.00 C ATOM 2993 C LYS C 112 15.300 -20.700 -11.199 1.00 0.00 C ATOM 2994 O LYS C 112 15.685 -19.619 -11.626 1.00 0.00 O ATOM 2995 CB LYS C 112 15.129 -22.752 -12.639 1.00 0.00 C ATOM 2996 CG LYS C 112 15.940 -23.628 -13.612 1.00 0.00 C ATOM 2997 CD LYS C 112 15.294 -24.992 -13.918 1.00 0.00 C ATOM 2998 CE LYS C 112 13.817 -25.032 -14.329 1.00 0.00 C ATOM 2999 NZ LYS C 112 13.604 -24.563 -15.728 1.00 0.00 N1+ ATOM 0 H LYS C 112 15.943 -23.790 -10.587 1.00 0.00 H new ATOM 0 HA LYS C 112 16.951 -21.696 -12.104 1.00 0.00 H new ATOM 0 HB2 LYS C 112 14.430 -23.383 -12.090 1.00 0.00 H new ATOM 0 HB3 LYS C 112 14.534 -22.040 -13.212 1.00 0.00 H new ATOM 0 HG2 LYS C 112 16.075 -23.084 -14.547 1.00 0.00 H new ATOM 0 HG3 LYS C 112 16.933 -23.794 -13.193 1.00 0.00 H new ATOM 0 HD2 LYS C 112 15.872 -25.460 -14.715 1.00 0.00 H new ATOM 0 HD3 LYS C 112 15.408 -25.618 -13.033 1.00 0.00 H new ATOM 0 HE2 LYS C 112 13.442 -26.051 -14.229 1.00 0.00 H new ATOM 0 HE3 LYS C 112 13.236 -24.410 -13.648 1.00 0.00 H new ATOM 0 HZ1 LYS C 112 12.591 -24.608 -15.959 1.00 0.00 H new ATOM 0 HZ2 LYS C 112 13.936 -23.582 -15.820 1.00 0.00 H new ATOM 0 HZ3 LYS C 112 14.136 -25.171 -16.383 1.00 0.00 H new ATOM 3013 N ALA C 113 14.327 -20.808 -10.298 1.00 0.00 N ATOM 3014 CA ALA C 113 13.578 -19.654 -9.783 1.00 0.00 C ATOM 3015 C ALA C 113 14.494 -18.690 -9.008 1.00 0.00 C ATOM 3016 O ALA C 113 14.478 -17.482 -9.265 1.00 0.00 O ATOM 3017 CB ALA C 113 12.388 -20.134 -8.938 1.00 0.00 C ATOM 0 H ALA C 113 14.031 -21.699 -9.900 1.00 0.00 H new ATOM 0 HA ALA C 113 13.182 -19.088 -10.626 1.00 0.00 H new ATOM 0 HB1 ALA C 113 11.839 -19.272 -8.560 1.00 0.00 H new ATOM 0 HB2 ALA C 113 11.727 -20.744 -9.554 1.00 0.00 H new ATOM 0 HB3 ALA C 113 12.753 -20.727 -8.100 1.00 0.00 H new ATOM 3023 N ILE C 114 15.365 -19.211 -8.132 1.00 0.00 N ATOM 3024 CA ILE C 114 16.390 -18.399 -7.450 1.00 0.00 C ATOM 3025 C ILE C 114 17.338 -17.750 -8.472 1.00 0.00 C ATOM 3026 O ILE C 114 17.506 -16.532 -8.451 1.00 0.00 O ATOM 3027 CB ILE C 114 17.132 -19.228 -6.365 1.00 0.00 C ATOM 3028 CG1 ILE C 114 16.349 -19.257 -5.030 1.00 0.00 C ATOM 3029 CG2 ILE C 114 18.540 -18.674 -6.072 1.00 0.00 C ATOM 3030 CD1 ILE C 114 15.153 -20.214 -5.015 1.00 0.00 C ATOM 0 H ILE C 114 15.382 -20.198 -7.876 1.00 0.00 H new ATOM 0 HA ILE C 114 15.898 -17.583 -6.921 1.00 0.00 H new ATOM 0 HB ILE C 114 17.212 -20.235 -6.773 1.00 0.00 H new ATOM 0 HG12 ILE C 114 17.033 -19.538 -4.229 1.00 0.00 H new ATOM 0 HG13 ILE C 114 15.995 -18.250 -4.809 1.00 0.00 H new ATOM 0 HG21 ILE C 114 19.020 -19.285 -5.308 1.00 0.00 H new ATOM 0 HG22 ILE C 114 19.137 -18.698 -6.983 1.00 0.00 H new ATOM 0 HG23 ILE C 114 18.460 -17.646 -5.717 1.00 0.00 H new ATOM 0 HD11 ILE C 114 14.664 -20.170 -4.042 1.00 0.00 H new ATOM 0 HD12 ILE C 114 14.445 -19.923 -5.791 1.00 0.00 H new ATOM 0 HD13 ILE C 114 15.498 -21.231 -5.201 1.00 0.00 H new ATOM 3042 N ALA C 115 17.899 -18.528 -9.404 1.00 0.00 N ATOM 3043 CA ALA C 115 18.854 -18.053 -10.411 1.00 0.00 C ATOM 3044 C ALA C 115 18.266 -16.948 -11.301 1.00 0.00 C ATOM 3045 O ALA C 115 18.913 -15.943 -11.579 1.00 0.00 O ATOM 3046 CB ALA C 115 19.301 -19.256 -11.248 1.00 0.00 C ATOM 0 H ALA C 115 17.698 -19.525 -9.481 1.00 0.00 H new ATOM 0 HA ALA C 115 19.709 -17.604 -9.905 1.00 0.00 H new ATOM 0 HB1 ALA C 115 20.013 -18.928 -12.005 1.00 0.00 H new ATOM 0 HB2 ALA C 115 19.774 -19.994 -10.600 1.00 0.00 H new ATOM 0 HB3 ALA C 115 18.434 -19.703 -11.734 1.00 0.00 H new ATOM 3052 N GLU C 116 17.010 -17.090 -11.696 1.00 0.00 N ATOM 3053 CA GLU C 116 16.278 -16.137 -12.540 1.00 0.00 C ATOM 3054 C GLU C 116 15.842 -14.896 -11.753 1.00 0.00 C ATOM 3055 O GLU C 116 15.834 -13.793 -12.297 1.00 0.00 O ATOM 3056 CB GLU C 116 15.098 -16.845 -13.218 1.00 0.00 C ATOM 3057 CG GLU C 116 15.576 -17.810 -14.318 1.00 0.00 C ATOM 3058 CD GLU C 116 15.984 -17.061 -15.602 1.00 0.00 C ATOM 3059 OE1 GLU C 116 15.105 -16.809 -16.463 1.00 0.00 O ATOM 3060 OE2 GLU C 116 17.185 -16.736 -15.766 1.00 0.00 O1- ATOM 0 H GLU C 116 16.446 -17.898 -11.432 1.00 0.00 H new ATOM 0 HA GLU C 116 16.948 -15.774 -13.320 1.00 0.00 H new ATOM 0 HB2 GLU C 116 14.526 -17.397 -12.472 1.00 0.00 H new ATOM 0 HB3 GLU C 116 14.427 -16.103 -13.650 1.00 0.00 H new ATOM 0 HG2 GLU C 116 16.424 -18.388 -13.950 1.00 0.00 H new ATOM 0 HG3 GLU C 116 14.782 -18.520 -14.549 1.00 0.00 H new ATOM 3067 N SER C 117 15.601 -15.039 -10.444 1.00 0.00 N ATOM 3068 CA SER C 117 15.388 -13.899 -9.534 1.00 0.00 C ATOM 3069 C SER C 117 16.659 -13.056 -9.322 1.00 0.00 C ATOM 3070 O SER C 117 16.563 -11.917 -8.868 1.00 0.00 O ATOM 3071 CB SER C 117 14.883 -14.371 -8.168 1.00 0.00 C ATOM 3072 OG SER C 117 13.687 -15.116 -8.271 1.00 0.00 O ATOM 0 H SER C 117 15.547 -15.947 -9.983 1.00 0.00 H new ATOM 0 HA SER C 117 14.638 -13.273 -10.018 1.00 0.00 H new ATOM 0 HB2 SER C 117 15.649 -14.981 -7.690 1.00 0.00 H new ATOM 0 HB3 SER C 117 14.717 -13.507 -7.525 1.00 0.00 H new ATOM 0 HG SER C 117 13.902 -16.059 -8.431 1.00 0.00 H new ATOM 3078 N LEU C 118 17.842 -13.596 -9.649 1.00 0.00 N ATOM 3079 CA LEU C 118 19.127 -12.881 -9.657 1.00 0.00 C ATOM 3080 C LEU C 118 19.445 -12.311 -11.052 1.00 0.00 C ATOM 3081 O LEU C 118 19.848 -11.155 -11.181 1.00 0.00 O ATOM 3082 CB LEU C 118 20.240 -13.851 -9.209 1.00 0.00 C ATOM 3083 CG LEU C 118 20.090 -14.337 -7.756 1.00 0.00 C ATOM 3084 CD1 LEU C 118 20.631 -15.758 -7.613 1.00 0.00 C ATOM 3085 CD2 LEU C 118 20.825 -13.410 -6.790 1.00 0.00 C ATOM 0 H LEU C 118 17.934 -14.574 -9.924 1.00 0.00 H new ATOM 0 HA LEU C 118 19.066 -12.039 -8.967 1.00 0.00 H new ATOM 0 HB2 LEU C 118 20.245 -14.715 -9.873 1.00 0.00 H new ATOM 0 HB3 LEU C 118 21.206 -13.358 -9.320 1.00 0.00 H new ATOM 0 HG LEU C 118 19.029 -14.328 -7.508 1.00 0.00 H new ATOM 0 HD11 LEU C 118 20.518 -16.088 -6.580 1.00 0.00 H new ATOM 0 HD12 LEU C 118 20.075 -16.427 -8.270 1.00 0.00 H new ATOM 0 HD13 LEU C 118 21.686 -15.775 -7.886 1.00 0.00 H new ATOM 0 HD21 LEU C 118 20.703 -13.776 -5.771 1.00 0.00 H new ATOM 0 HD22 LEU C 118 21.885 -13.387 -7.043 1.00 0.00 H new ATOM 0 HD23 LEU C 118 20.412 -12.404 -6.866 1.00 0.00 H new ATOM 3097 N ASN C 119 19.228 -13.119 -12.095 1.00 0.00 N ATOM 3098 CA ASN C 119 19.509 -12.791 -13.499 1.00 0.00 C ATOM 3099 C ASN C 119 18.578 -11.701 -14.073 1.00 0.00 C ATOM 3100 O ASN C 119 19.011 -10.904 -14.909 1.00 0.00 O ATOM 3101 CB ASN C 119 19.397 -14.088 -14.328 1.00 0.00 C ATOM 3102 CG ASN C 119 20.702 -14.858 -14.426 1.00 0.00 C ATOM 3103 OD1 ASN C 119 21.528 -14.623 -15.298 1.00 0.00 O ATOM 3104 ND2 ASN C 119 20.932 -15.802 -13.543 1.00 0.00 N ATOM 0 H ASN C 119 18.837 -14.054 -11.982 1.00 0.00 H new ATOM 0 HA ASN C 119 20.515 -12.376 -13.553 1.00 0.00 H new ATOM 0 HB2 ASN C 119 18.638 -14.730 -13.882 1.00 0.00 H new ATOM 0 HB3 ASN C 119 19.054 -13.839 -15.333 1.00 0.00 H new ATOM 0 HD21 ASN C 119 21.798 -16.339 -13.584 1.00 0.00 H new ATOM 0 HD22 ASN C 119 20.244 -15.999 -12.816 1.00 0.00 H new ATOM 3111 N SER C 120 17.314 -11.663 -13.632 1.00 0.00 N ATOM 3112 CA SER C 120 16.244 -10.817 -14.192 1.00 0.00 C ATOM 3113 C SER C 120 15.448 -10.083 -13.099 1.00 0.00 C ATOM 3114 O SER C 120 14.218 -10.000 -13.146 1.00 0.00 O ATOM 3115 CB SER C 120 15.334 -11.654 -15.111 1.00 0.00 C ATOM 3116 OG SER C 120 16.075 -12.280 -16.150 1.00 0.00 O ATOM 0 H SER C 120 16.995 -12.237 -12.852 1.00 0.00 H new ATOM 0 HA SER C 120 16.710 -10.037 -14.794 1.00 0.00 H new ATOM 0 HB2 SER C 120 14.820 -12.413 -14.522 1.00 0.00 H new ATOM 0 HB3 SER C 120 14.566 -11.014 -15.545 1.00 0.00 H new ATOM 0 HG SER C 120 15.469 -12.804 -16.714 1.00 0.00 H new ATOM 3122 N CYS C 121 16.151 -9.552 -12.089 1.00 0.00 N ATOM 3123 CA CYS C 121 15.544 -8.791 -10.986 1.00 0.00 C ATOM 3124 C CYS C 121 14.946 -7.446 -11.460 1.00 0.00 C ATOM 3125 O CYS C 121 13.866 -7.043 -11.015 1.00 0.00 O ATOM 3126 CB CYS C 121 16.615 -8.595 -9.901 1.00 0.00 C ATOM 3127 SG CYS C 121 15.857 -7.971 -8.372 1.00 0.00 S ATOM 0 H CYS C 121 17.164 -9.639 -12.013 1.00 0.00 H new ATOM 0 HA CYS C 121 14.702 -9.350 -10.578 1.00 0.00 H new ATOM 0 HB2 CYS C 121 17.121 -9.540 -9.705 1.00 0.00 H new ATOM 0 HB3 CYS C 121 17.373 -7.895 -10.251 1.00 0.00 H new ATOM 0 HG CYS C 121 16.775 -7.813 -7.466 1.00 0.00 H new ATOM 3133 N ARG C 122 15.622 -6.771 -12.404 1.00 0.00 N ATOM 3134 CA ARG C 122 15.151 -5.539 -13.070 1.00 0.00 C ATOM 3135 C ARG C 122 14.147 -5.849 -14.200 1.00 0.00 C ATOM 3136 O ARG C 122 14.273 -6.898 -14.841 1.00 0.00 O ATOM 3137 CB ARG C 122 16.357 -4.748 -13.622 1.00 0.00 C ATOM 3138 CG ARG C 122 17.319 -4.210 -12.548 1.00 0.00 C ATOM 3139 CD ARG C 122 16.690 -3.107 -11.684 1.00 0.00 C ATOM 3140 NE ARG C 122 17.649 -2.582 -10.691 1.00 0.00 N ATOM 3141 CZ ARG C 122 18.577 -1.656 -10.872 1.00 0.00 C ATOM 3142 NH1 ARG C 122 18.771 -1.074 -12.023 1.00 0.00 N1+ ATOM 3143 NH2 ARG C 122 19.343 -1.294 -9.881 1.00 0.00 N ATOM 0 H ARG C 122 16.538 -7.073 -12.736 1.00 0.00 H new ATOM 0 HA ARG C 122 14.630 -4.933 -12.329 1.00 0.00 H new ATOM 0 HB2 ARG C 122 16.916 -5.391 -14.302 1.00 0.00 H new ATOM 0 HB3 ARG C 122 15.985 -3.909 -14.211 1.00 0.00 H new ATOM 0 HG2 ARG C 122 17.636 -5.032 -11.906 1.00 0.00 H new ATOM 0 HG3 ARG C 122 18.215 -3.820 -13.032 1.00 0.00 H new ATOM 0 HD2 ARG C 122 16.346 -2.294 -12.324 1.00 0.00 H new ATOM 0 HD3 ARG C 122 15.813 -3.501 -11.171 1.00 0.00 H new ATOM 0 HE ARG C 122 17.589 -2.981 -9.754 1.00 0.00 H new ATOM 0 HH11 ARG C 122 18.196 -1.328 -12.826 1.00 0.00 H new ATOM 0 HH12 ARG C 122 19.498 -0.365 -12.120 1.00 0.00 H new ATOM 0 HH21 ARG C 122 19.228 -1.725 -8.964 1.00 0.00 H new ATOM 0 HH22 ARG C 122 20.058 -0.580 -10.023 1.00 0.00 H new ATOM 3157 N PRO C 123 13.183 -4.951 -14.490 1.00 0.00 N ATOM 3158 CA PRO C 123 12.232 -5.123 -15.589 1.00 0.00 C ATOM 3159 C PRO C 123 12.925 -5.055 -16.963 1.00 0.00 C ATOM 3160 O PRO C 123 13.882 -4.299 -17.167 1.00 0.00 O ATOM 3161 CB PRO C 123 11.194 -4.009 -15.413 1.00 0.00 C ATOM 3162 CG PRO C 123 11.984 -2.902 -14.716 1.00 0.00 C ATOM 3163 CD PRO C 123 12.935 -3.684 -13.811 1.00 0.00 C ATOM 0 HA PRO C 123 11.764 -6.107 -15.560 1.00 0.00 H new ATOM 0 HB2 PRO C 123 10.794 -3.676 -16.371 1.00 0.00 H new ATOM 0 HB3 PRO C 123 10.347 -4.339 -14.811 1.00 0.00 H new ATOM 0 HG2 PRO C 123 12.524 -2.280 -15.429 1.00 0.00 H new ATOM 0 HG3 PRO C 123 11.334 -2.240 -14.144 1.00 0.00 H new ATOM 0 HD2 PRO C 123 13.864 -3.136 -13.655 1.00 0.00 H new ATOM 0 HD3 PRO C 123 12.493 -3.848 -12.828 1.00 0.00 H new ATOM 3171 N SER C 124 12.446 -5.860 -17.917 1.00 0.00 N ATOM 3172 CA SER C 124 12.896 -5.914 -19.327 1.00 0.00 C ATOM 3173 C SER C 124 11.835 -6.538 -20.243 1.00 0.00 C ATOM 3174 O SER C 124 11.284 -7.607 -19.893 1.00 0.00 O ATOM 3175 CB SER C 124 14.195 -6.713 -19.455 1.00 0.00 C ATOM 3176 OG SER C 124 15.212 -5.951 -18.840 1.00 0.00 O ATOM 3177 OXT SER C 124 11.557 -5.949 -21.312 1.00 0.00 O1- ATOM 0 H SER C 124 11.698 -6.527 -17.726 1.00 0.00 H new ATOM 0 HA SER C 124 13.065 -4.884 -19.640 1.00 0.00 H new ATOM 0 HB2 SER C 124 14.098 -7.686 -18.974 1.00 0.00 H new ATOM 0 HB3 SER C 124 14.432 -6.898 -20.503 1.00 0.00 H new ATOM 0 HG SER C 124 14.808 -5.224 -18.322 1.00 0.00 H new TER 3183 SER C 124