USER MOD reduce.3.24.130724 H: found=0, std=0, add=1318, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1314 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 94 LYS NZ :NH3+ 167:sc= 1.25 (180deg=0) USER MOD Set 1.2: A 100 TYR OH : rot 180:sc= -0.202 USER MOD Set 1.3: A 110 GLN : amide:sc= 1.01 K(o=2.1,f=-5.9!) USER MOD Set 2.1: A 22 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 62 TYR OH : rot 180:sc= -2.48! USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.262 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 82:sc= 0.123 USER MOD Single : A 29 GLN : amide:sc= -0.128 X(o=-0.13,f=-0.24) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0.00886 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.322) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -1.27 K(o=-1.3,f=-0.46) USER MOD Single : A 48 GLN : amide:sc= -0.329 X(o=-0.33,f=-0.67) USER MOD Single : A 53 MET CE :methyl -129:sc= -3.2 (180deg=-6.65!) USER MOD Single : A 54 GLN : amide:sc= -2.46 K(o=-2.5,f=-8.6!) USER MOD Single : A 56 HIS : no HE2:sc= -2.55! C(o=-2.6!,f=-3.4!) USER MOD Single : A 57 HIS : no HD1:sc= -4.4! C(o=-4.4!,f=-6.3!) USER MOD Single : A 58 GLN : amide:sc= -0.264 K(o=-0.26,f=-1.5!) USER MOD Single : A 60 SER OG : rot -16:sc= 0.386 USER MOD Single : A 64 TYR OH : rot 30:sc=0.000896 USER MOD Single : A 65 THR OG1 : rot 97:sc= 0.883 USER MOD Single : A 67 TYR OH : rot 165:sc= -0.0311 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0.115 (180deg=0.115) USER MOD Single : A 71 LYS NZ :NH3+ -126:sc= -0.0168 (180deg=-0.274) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 156:sc= 0.75 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ -120:sc=-0.00613 (180deg=-0.0492) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0.0662 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= -1.64 K(o=-1.6,f=-3.1!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -0.181 K(o=-0.18,f=-1.2!) USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= -1.05 USER MOD Single : A 128 GLN : amide:sc= -0.206 K(o=-0.21,f=-2.2!) USER MOD Single : A 135 LYS NZ :NH3+ -113:sc= 0 (180deg=-0.0799) USER MOD Single : A 136 LYS NZ :NH3+ -119:sc= -0.0174 (180deg=-0.304) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.0268 USER MOD Single : A 139 GLN : amide:sc= -0.143 K(o=-0.14,f=-0.67) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 144 GLN : amide:sc= -1.37 K(o=-1.4,f=-2.2!) USER MOD Single : A 147 HIS : no HD1:sc= -1.1 K(o=-1.1,f=-0.51) USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 156 THR OG1 : rot 180:sc= 0.0784 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 -2.626 -35.134 23.223 1.00 0.00 N ATOM 2 CA GLY A -1 -2.525 -33.887 22.411 1.00 0.00 C ATOM 3 C GLY A -1 -3.654 -33.859 21.372 1.00 0.00 C ATOM 4 O GLY A -1 -3.587 -34.536 20.363 1.00 0.00 O ATOM 0 H1 GLY A -1 -1.861 -35.153 23.927 1.00 0.00 H new ATOM 0 H2 GLY A -1 -3.545 -35.158 23.710 1.00 0.00 H new ATOM 0 H3 GLY A -1 -2.543 -35.962 22.599 1.00 0.00 H new ATOM 0 HA2 GLY A -1 -2.591 -33.013 23.058 1.00 0.00 H new ATOM 0 HA3 GLY A -1 -1.557 -33.843 21.913 1.00 0.00 H new ATOM 10 N GLY A 0 -4.694 -33.082 21.604 1.00 0.00 N ATOM 11 CA GLY A 0 -5.817 -33.021 20.623 1.00 0.00 C ATOM 12 C GLY A 0 -5.494 -31.987 19.535 1.00 0.00 C ATOM 13 O GLY A 0 -4.572 -31.205 19.677 1.00 0.00 O ATOM 0 H GLY A 0 -4.807 -32.493 22.429 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -5.974 -34.001 20.173 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -6.743 -32.752 21.131 1.00 0.00 H new ATOM 17 N SER A 1 -6.241 -31.973 18.449 1.00 0.00 N ATOM 18 CA SER A 1 -5.965 -30.984 17.364 1.00 0.00 C ATOM 19 C SER A 1 -7.204 -30.108 17.117 1.00 0.00 C ATOM 20 O SER A 1 -7.962 -30.363 16.201 1.00 0.00 O ATOM 21 CB SER A 1 -5.649 -31.830 16.131 1.00 0.00 C ATOM 22 OG SER A 1 -5.399 -30.972 15.025 1.00 0.00 O ATOM 0 H SER A 1 -7.024 -32.602 18.273 1.00 0.00 H new ATOM 0 HA SER A 1 -5.146 -30.310 17.616 1.00 0.00 H new ATOM 0 HB2 SER A 1 -4.780 -32.460 16.321 1.00 0.00 H new ATOM 0 HB3 SER A 1 -6.483 -32.496 15.909 1.00 0.00 H new ATOM 0 HG SER A 1 -5.194 -31.511 14.233 1.00 0.00 H new ATOM 28 N PRO A 2 -7.379 -29.097 17.940 1.00 0.00 N ATOM 29 CA PRO A 2 -8.547 -28.194 17.782 1.00 0.00 C ATOM 30 C PRO A 2 -8.362 -27.286 16.554 1.00 0.00 C ATOM 31 O PRO A 2 -7.843 -26.191 16.665 1.00 0.00 O ATOM 32 CB PRO A 2 -8.548 -27.373 19.068 1.00 0.00 C ATOM 33 CG PRO A 2 -7.133 -27.399 19.548 1.00 0.00 C ATOM 34 CD PRO A 2 -6.530 -28.697 19.077 1.00 0.00 C ATOM 0 HA PRO A 2 -9.483 -28.731 17.626 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -8.883 -26.352 18.884 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -9.223 -27.801 19.809 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -6.576 -26.550 19.152 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -7.093 -27.328 20.635 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -5.492 -28.567 18.772 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -6.539 -29.450 19.865 1.00 0.00 H new ATOM 42 N ARG A 3 -8.780 -27.729 15.385 1.00 0.00 N ATOM 43 CA ARG A 3 -8.621 -26.883 14.164 1.00 0.00 C ATOM 44 C ARG A 3 -9.998 -26.549 13.567 1.00 0.00 C ATOM 45 O ARG A 3 -10.780 -27.437 13.279 1.00 0.00 O ATOM 46 CB ARG A 3 -7.809 -27.739 13.193 1.00 0.00 C ATOM 47 CG ARG A 3 -6.322 -27.407 13.340 1.00 0.00 C ATOM 48 CD ARG A 3 -5.509 -28.263 12.366 1.00 0.00 C ATOM 49 NE ARG A 3 -4.141 -27.660 12.375 1.00 0.00 N ATOM 50 CZ ARG A 3 -3.884 -26.526 11.740 1.00 0.00 C ATOM 51 NH1 ARG A 3 -4.820 -25.884 11.079 1.00 0.00 N ATOM 52 NH2 ARG A 3 -2.674 -26.030 11.770 1.00 0.00 N ATOM 0 H ARG A 3 -9.221 -28.636 15.230 1.00 0.00 H new ATOM 0 HA ARG A 3 -8.130 -25.934 14.379 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -7.978 -28.797 13.395 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -8.134 -27.554 12.169 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -6.153 -26.349 13.139 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -5.996 -27.593 14.363 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -5.483 -29.306 12.683 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -5.943 -28.244 11.366 1.00 0.00 H new ATOM 0 HE ARG A 3 -3.390 -28.131 12.880 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -5.769 -26.257 11.047 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -4.598 -25.012 10.598 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -1.936 -26.516 12.280 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -2.468 -25.157 11.284 1.00 0.00 H new ATOM 66 N ILE A 4 -10.304 -25.281 13.380 1.00 0.00 N ATOM 67 CA ILE A 4 -11.632 -24.909 12.803 1.00 0.00 C ATOM 68 C ILE A 4 -11.436 -24.181 11.463 1.00 0.00 C ATOM 69 O ILE A 4 -10.710 -23.208 11.384 1.00 0.00 O ATOM 70 CB ILE A 4 -12.270 -23.976 13.840 1.00 0.00 C ATOM 71 CG1 ILE A 4 -12.440 -24.721 15.168 1.00 0.00 C ATOM 72 CG2 ILE A 4 -13.643 -23.515 13.344 1.00 0.00 C ATOM 73 CD1 ILE A 4 -12.263 -23.741 16.329 1.00 0.00 C ATOM 0 H ILE A 4 -9.692 -24.496 13.602 1.00 0.00 H new ATOM 0 HA ILE A 4 -12.258 -25.779 12.604 1.00 0.00 H new ATOM 0 HB ILE A 4 -11.624 -23.110 13.985 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -13.426 -25.182 15.215 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -11.708 -25.525 15.242 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -14.093 -22.852 14.083 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -13.529 -22.982 12.400 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -14.286 -24.382 13.195 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -12.384 -24.271 17.274 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -11.267 -23.301 16.285 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -13.012 -22.952 16.257 1.00 0.00 H new ATOM 85 N LYS A 5 -12.076 -24.643 10.406 1.00 0.00 N ATOM 86 CA LYS A 5 -11.919 -23.970 9.082 1.00 0.00 C ATOM 87 C LYS A 5 -13.289 -23.513 8.555 1.00 0.00 C ATOM 88 O LYS A 5 -13.923 -24.212 7.788 1.00 0.00 O ATOM 89 CB LYS A 5 -11.320 -25.036 8.164 1.00 0.00 C ATOM 90 CG LYS A 5 -10.848 -24.385 6.863 1.00 0.00 C ATOM 91 CD LYS A 5 -9.622 -25.131 6.332 1.00 0.00 C ATOM 92 CE LYS A 5 -8.715 -24.156 5.579 1.00 0.00 C ATOM 93 NZ LYS A 5 -7.484 -24.934 5.271 1.00 0.00 N ATOM 0 H LYS A 5 -12.696 -25.453 10.410 1.00 0.00 H new ATOM 0 HA LYS A 5 -11.288 -23.083 9.141 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -10.484 -25.530 8.660 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -12.062 -25.805 7.950 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -11.648 -24.406 6.123 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -10.602 -23.337 7.037 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -9.076 -25.588 7.157 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -9.934 -25.939 5.670 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -9.193 -23.796 4.668 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -8.487 -23.280 6.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -6.813 -24.331 4.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -7.047 -25.258 6.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -7.731 -25.758 4.686 1.00 0.00 H new ATOM 107 N THR A 6 -13.751 -22.346 8.959 1.00 0.00 N ATOM 108 CA THR A 6 -15.080 -21.859 8.475 1.00 0.00 C ATOM 109 C THR A 6 -15.037 -20.341 8.236 1.00 0.00 C ATOM 110 O THR A 6 -14.019 -19.708 8.445 1.00 0.00 O ATOM 111 CB THR A 6 -16.069 -22.204 9.596 1.00 0.00 C ATOM 112 OG1 THR A 6 -17.363 -21.744 9.236 1.00 0.00 O ATOM 113 CG2 THR A 6 -15.637 -21.537 10.907 1.00 0.00 C ATOM 0 H THR A 6 -13.265 -21.717 9.599 1.00 0.00 H new ATOM 0 HA THR A 6 -15.366 -22.319 7.529 1.00 0.00 H new ATOM 0 HB THR A 6 -16.085 -23.285 9.738 1.00 0.00 H new ATOM 0 HG1 THR A 6 -17.998 -21.964 9.949 1.00 0.00 H new ATOM 0 HG21 THR A 6 -16.347 -21.789 11.695 1.00 0.00 H new ATOM 0 HG22 THR A 6 -14.645 -21.891 11.186 1.00 0.00 H new ATOM 0 HG23 THR A 6 -15.612 -20.455 10.774 1.00 0.00 H new ATOM 121 N ARG A 7 -16.131 -19.751 7.799 1.00 0.00 N ATOM 122 CA ARG A 7 -16.139 -18.277 7.551 1.00 0.00 C ATOM 123 C ARG A 7 -17.307 -17.620 8.303 1.00 0.00 C ATOM 124 O ARG A 7 -18.433 -17.642 7.841 1.00 0.00 O ATOM 125 CB ARG A 7 -16.324 -18.131 6.041 1.00 0.00 C ATOM 126 CG ARG A 7 -14.957 -17.991 5.369 1.00 0.00 C ATOM 127 CD ARG A 7 -15.132 -17.378 3.977 1.00 0.00 C ATOM 128 NE ARG A 7 -14.078 -18.025 3.137 1.00 0.00 N ATOM 129 CZ ARG A 7 -14.165 -19.298 2.782 1.00 0.00 C ATOM 130 NH1 ARG A 7 -15.180 -20.045 3.155 1.00 0.00 N ATOM 131 NH2 ARG A 7 -13.225 -19.829 2.045 1.00 0.00 N ATOM 0 H ARG A 7 -17.012 -20.228 7.606 1.00 0.00 H new ATOM 0 HA ARG A 7 -15.226 -17.794 7.898 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -16.849 -18.999 5.643 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -16.939 -17.258 5.822 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -14.305 -17.362 5.975 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -14.477 -18.966 5.291 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -16.128 -17.574 3.581 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -15.007 -16.296 4.003 1.00 0.00 H new ATOM 0 HE ARG A 7 -13.275 -17.475 2.831 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -15.922 -19.647 3.730 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -15.225 -21.023 2.869 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -12.430 -19.264 1.747 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -13.286 -20.809 1.768 1.00 0.00 H new ATOM 145 N ARG A 8 -17.054 -17.036 9.458 1.00 0.00 N ATOM 146 CA ARG A 8 -18.158 -16.385 10.225 1.00 0.00 C ATOM 147 C ARG A 8 -17.726 -14.986 10.696 1.00 0.00 C ATOM 148 O ARG A 8 -16.555 -14.658 10.671 1.00 0.00 O ATOM 149 CB ARG A 8 -18.401 -17.301 11.424 1.00 0.00 C ATOM 150 CG ARG A 8 -19.451 -18.352 11.061 1.00 0.00 C ATOM 151 CD ARG A 8 -20.849 -17.797 11.337 1.00 0.00 C ATOM 152 NE ARG A 8 -21.706 -18.347 10.243 1.00 0.00 N ATOM 153 CZ ARG A 8 -22.117 -19.607 10.256 1.00 0.00 C ATOM 154 NH1 ARG A 8 -21.789 -20.424 11.232 1.00 0.00 N ATOM 155 NH2 ARG A 8 -22.865 -20.053 9.281 1.00 0.00 N ATOM 0 H ARG A 8 -16.134 -16.986 9.895 1.00 0.00 H new ATOM 0 HA ARG A 8 -19.057 -16.254 9.622 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -17.471 -17.788 11.717 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -18.738 -16.716 12.279 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -19.358 -18.625 10.010 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -19.288 -19.260 11.642 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -21.211 -18.109 12.317 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -20.850 -16.707 11.329 1.00 0.00 H new ATOM 0 HE ARG A 8 -21.980 -17.740 9.470 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -21.206 -20.092 12.001 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -22.117 -21.390 11.221 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -23.129 -19.432 8.516 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -23.184 -21.022 9.285 1.00 0.00 H new ATOM 169 N SER A 9 -18.659 -14.161 11.126 1.00 0.00 N ATOM 170 CA SER A 9 -18.287 -12.791 11.596 1.00 0.00 C ATOM 171 C SER A 9 -18.622 -12.638 13.088 1.00 0.00 C ATOM 172 O SER A 9 -19.634 -13.130 13.550 1.00 0.00 O ATOM 173 CB SER A 9 -19.137 -11.838 10.756 1.00 0.00 C ATOM 174 OG SER A 9 -18.715 -10.501 10.991 1.00 0.00 O ATOM 0 H SER A 9 -19.654 -14.380 11.170 1.00 0.00 H new ATOM 0 HA SER A 9 -17.222 -12.590 11.485 1.00 0.00 H new ATOM 0 HB2 SER A 9 -19.039 -12.082 9.698 1.00 0.00 H new ATOM 0 HB3 SER A 9 -20.190 -11.950 11.013 1.00 0.00 H new ATOM 0 HG SER A 9 -19.257 -9.887 10.452 1.00 0.00 H new ATOM 180 N LYS A 10 -17.781 -11.965 13.848 1.00 0.00 N ATOM 181 CA LYS A 10 -18.065 -11.793 15.305 1.00 0.00 C ATOM 182 C LYS A 10 -17.639 -10.392 15.772 1.00 0.00 C ATOM 183 O LYS A 10 -17.006 -9.667 15.030 1.00 0.00 O ATOM 184 CB LYS A 10 -17.227 -12.868 15.999 1.00 0.00 C ATOM 185 CG LYS A 10 -18.098 -14.093 16.284 1.00 0.00 C ATOM 186 CD LYS A 10 -17.210 -15.259 16.725 1.00 0.00 C ATOM 187 CE LYS A 10 -18.013 -16.199 17.628 1.00 0.00 C ATOM 188 NZ LYS A 10 -16.996 -16.866 18.488 1.00 0.00 N ATOM 0 H LYS A 10 -16.918 -11.532 13.520 1.00 0.00 H new ATOM 0 HA LYS A 10 -19.127 -11.891 15.532 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -16.383 -13.148 15.369 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -16.815 -12.478 16.930 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -18.826 -13.862 17.062 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -18.661 -14.368 15.392 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -16.843 -15.801 15.853 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -16.337 -14.884 17.258 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -18.737 -15.648 18.228 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -18.573 -16.927 17.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -17.469 -17.527 19.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -16.324 -17.388 17.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -16.483 -16.149 19.039 1.00 0.00 H new ATOM 202 N PRO A 11 -17.998 -10.049 16.991 1.00 0.00 N ATOM 203 CA PRO A 11 -17.634 -8.716 17.536 1.00 0.00 C ATOM 204 C PRO A 11 -16.134 -8.651 17.852 1.00 0.00 C ATOM 205 O PRO A 11 -15.480 -9.668 17.986 1.00 0.00 O ATOM 206 CB PRO A 11 -18.463 -8.607 18.814 1.00 0.00 C ATOM 207 CG PRO A 11 -18.728 -10.019 19.225 1.00 0.00 C ATOM 208 CD PRO A 11 -18.762 -10.847 17.967 1.00 0.00 C ATOM 0 HA PRO A 11 -17.831 -7.904 16.836 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -17.922 -8.065 19.590 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -19.393 -8.067 18.636 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -17.950 -10.376 19.900 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -19.674 -10.093 19.761 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -18.310 -11.827 18.122 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -19.784 -11.018 17.629 1.00 0.00 H new ATOM 216 N ALA A 12 -15.588 -7.461 17.980 1.00 0.00 N ATOM 217 CA ALA A 12 -14.122 -7.341 18.298 1.00 0.00 C ATOM 218 C ALA A 12 -13.912 -7.418 19.820 1.00 0.00 C ATOM 219 O ALA A 12 -14.745 -6.952 20.574 1.00 0.00 O ATOM 220 CB ALA A 12 -13.670 -5.976 17.756 1.00 0.00 C ATOM 0 H ALA A 12 -16.086 -6.576 17.880 1.00 0.00 H new ATOM 0 HA ALA A 12 -13.544 -8.147 17.846 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.609 -5.837 17.961 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.840 -5.937 16.680 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.240 -5.185 18.242 1.00 0.00 H new ATOM 226 N PRO A 13 -12.811 -8.007 20.234 1.00 0.00 N ATOM 227 CA PRO A 13 -12.525 -8.135 21.686 1.00 0.00 C ATOM 228 C PRO A 13 -12.180 -6.769 22.295 1.00 0.00 C ATOM 229 O PRO A 13 -11.866 -5.831 21.588 1.00 0.00 O ATOM 230 CB PRO A 13 -11.322 -9.073 21.740 1.00 0.00 C ATOM 231 CG PRO A 13 -10.655 -8.920 20.411 1.00 0.00 C ATOM 232 CD PRO A 13 -11.738 -8.600 19.415 1.00 0.00 C ATOM 0 HA PRO A 13 -13.377 -8.511 22.252 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.648 -8.805 22.554 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.632 -10.104 21.910 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.910 -8.124 20.441 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.132 -9.835 20.133 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.387 -7.904 18.653 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -12.080 -9.495 18.896 1.00 0.00 H new ATOM 240 N ASP A 14 -12.242 -6.651 23.608 1.00 0.00 N ATOM 241 CA ASP A 14 -11.916 -5.329 24.271 1.00 0.00 C ATOM 242 C ASP A 14 -10.591 -4.746 23.742 1.00 0.00 C ATOM 243 O ASP A 14 -10.429 -3.543 23.668 1.00 0.00 O ATOM 244 CB ASP A 14 -11.796 -5.613 25.777 1.00 0.00 C ATOM 245 CG ASP A 14 -11.936 -4.305 26.557 1.00 0.00 C ATOM 246 OD1 ASP A 14 -13.061 -3.887 26.778 1.00 0.00 O ATOM 247 OD2 ASP A 14 -10.916 -3.742 26.918 1.00 0.00 O ATOM 0 H ASP A 14 -12.501 -7.403 24.247 1.00 0.00 H new ATOM 0 HA ASP A 14 -12.695 -4.597 24.057 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -12.567 -6.318 26.087 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -10.834 -6.077 25.995 1.00 0.00 H new ATOM 252 N GLY A 15 -9.639 -5.582 23.370 1.00 0.00 N ATOM 253 CA GLY A 15 -8.333 -5.063 22.845 1.00 0.00 C ATOM 254 C GLY A 15 -8.571 -4.046 21.709 1.00 0.00 C ATOM 255 O GLY A 15 -7.827 -3.093 21.571 1.00 0.00 O ATOM 0 H GLY A 15 -9.714 -6.598 23.409 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.772 -4.591 23.652 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -7.727 -5.891 22.478 1.00 0.00 H new ATOM 259 N PHE A 16 -9.600 -4.229 20.899 1.00 0.00 N ATOM 260 CA PHE A 16 -9.857 -3.245 19.782 1.00 0.00 C ATOM 261 C PHE A 16 -9.974 -1.814 20.338 1.00 0.00 C ATOM 262 O PHE A 16 -9.581 -0.864 19.686 1.00 0.00 O ATOM 263 CB PHE A 16 -11.181 -3.659 19.117 1.00 0.00 C ATOM 264 CG PHE A 16 -11.443 -2.783 17.912 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.456 -2.622 16.929 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.674 -2.130 17.777 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.702 -1.810 15.816 1.00 0.00 C ATOM 268 CE2 PHE A 16 -12.920 -1.319 16.663 1.00 0.00 C ATOM 269 CZ PHE A 16 -11.934 -1.159 15.682 1.00 0.00 C ATOM 0 H PHE A 16 -10.262 -5.003 20.960 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.035 -3.255 19.066 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.136 -4.705 18.815 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -12.001 -3.568 19.830 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.506 -3.125 17.031 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.435 -2.252 18.534 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.941 -1.686 15.060 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.870 -0.817 16.560 1.00 0.00 H new ATOM 0 HZ PHE A 16 -12.124 -0.534 14.822 1.00 0.00 H new ATOM 279 N GLU A 17 -10.503 -1.646 21.536 1.00 0.00 N ATOM 280 CA GLU A 17 -10.625 -0.254 22.114 1.00 0.00 C ATOM 281 C GLU A 17 -9.257 0.449 22.101 1.00 0.00 C ATOM 282 O GLU A 17 -9.171 1.638 21.856 1.00 0.00 O ATOM 283 CB GLU A 17 -11.120 -0.416 23.561 1.00 0.00 C ATOM 284 CG GLU A 17 -11.708 0.908 24.052 1.00 0.00 C ATOM 285 CD GLU A 17 -13.199 0.959 23.716 1.00 0.00 C ATOM 286 OE1 GLU A 17 -13.519 1.185 22.560 1.00 0.00 O ATOM 287 OE2 GLU A 17 -13.997 0.773 24.620 1.00 0.00 O ATOM 0 H GLU A 17 -10.851 -2.398 22.131 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.316 0.352 21.528 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -11.874 -1.202 23.613 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.296 -0.721 24.206 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -11.563 1.006 25.128 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -11.190 1.745 23.583 1.00 0.00 H new ATOM 294 N LYS A 18 -8.185 -0.274 22.355 1.00 0.00 N ATOM 295 CA LYS A 18 -6.822 0.375 22.342 1.00 0.00 C ATOM 296 C LYS A 18 -6.554 1.025 20.973 1.00 0.00 C ATOM 297 O LYS A 18 -5.935 2.071 20.896 1.00 0.00 O ATOM 298 CB LYS A 18 -5.795 -0.739 22.605 1.00 0.00 C ATOM 299 CG LYS A 18 -5.736 -1.034 24.105 1.00 0.00 C ATOM 300 CD LYS A 18 -5.003 0.102 24.821 1.00 0.00 C ATOM 301 CE LYS A 18 -5.608 0.305 26.212 1.00 0.00 C ATOM 302 NZ LYS A 18 -4.449 0.625 27.091 1.00 0.00 N ATOM 0 H LYS A 18 -8.191 -1.271 22.568 1.00 0.00 H new ATOM 0 HA LYS A 18 -6.757 1.156 23.100 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -6.071 -1.640 22.057 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -4.812 -0.435 22.244 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.744 -1.140 24.505 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -5.223 -1.979 24.280 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -3.942 -0.132 24.905 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -5.081 1.022 24.241 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -6.338 1.114 26.211 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -6.126 -0.592 26.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -4.783 0.778 28.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -3.774 -0.166 27.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -3.980 1.487 26.747 1.00 0.00 H new ATOM 316 N ILE A 19 -7.019 0.427 19.894 1.00 0.00 N ATOM 317 CA ILE A 19 -6.787 1.033 18.544 1.00 0.00 C ATOM 318 C ILE A 19 -8.128 1.433 17.895 1.00 0.00 C ATOM 319 O ILE A 19 -8.305 1.296 16.699 1.00 0.00 O ATOM 320 CB ILE A 19 -6.071 -0.051 17.716 1.00 0.00 C ATOM 321 CG1 ILE A 19 -6.959 -1.297 17.562 1.00 0.00 C ATOM 322 CG2 ILE A 19 -4.768 -0.451 18.417 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.769 -1.905 16.165 1.00 0.00 C ATOM 0 H ILE A 19 -7.544 -0.447 19.893 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.188 1.942 18.605 1.00 0.00 H new ATOM 0 HB ILE A 19 -5.859 0.355 16.727 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.705 -2.032 18.326 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.005 -1.030 17.713 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.261 -1.218 17.832 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.122 0.422 18.509 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -4.994 -0.842 19.409 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.401 -2.787 16.063 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.046 -1.171 15.408 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.725 -2.189 16.031 1.00 0.00 H new ATOM 335 N LYS A 20 -9.081 1.912 18.674 1.00 0.00 N ATOM 336 CA LYS A 20 -10.414 2.299 18.085 1.00 0.00 C ATOM 337 C LYS A 20 -10.436 3.734 17.504 1.00 0.00 C ATOM 338 O LYS A 20 -10.998 3.936 16.445 1.00 0.00 O ATOM 339 CB LYS A 20 -11.435 2.182 19.226 1.00 0.00 C ATOM 340 CG LYS A 20 -12.849 2.099 18.643 1.00 0.00 C ATOM 341 CD LYS A 20 -13.482 3.493 18.636 1.00 0.00 C ATOM 342 CE LYS A 20 -14.686 3.504 17.691 1.00 0.00 C ATOM 343 NZ LYS A 20 -15.726 4.297 18.402 1.00 0.00 N ATOM 0 H LYS A 20 -8.995 2.050 19.681 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.641 1.642 17.246 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.225 1.296 19.826 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.354 3.043 19.890 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -12.813 1.699 17.630 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.458 1.415 19.234 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -13.795 3.767 19.644 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -12.750 4.235 18.317 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -14.431 3.956 16.733 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -15.034 2.492 17.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -16.584 4.349 17.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.953 3.839 19.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -15.369 5.257 18.580 1.00 0.00 H new ATOM 357 N PRO A 21 -9.868 4.703 18.204 1.00 0.00 N ATOM 358 CA PRO A 21 -9.907 6.102 17.700 1.00 0.00 C ATOM 359 C PRO A 21 -8.905 6.328 16.554 1.00 0.00 C ATOM 360 O PRO A 21 -9.202 7.042 15.614 1.00 0.00 O ATOM 361 CB PRO A 21 -9.537 6.938 18.920 1.00 0.00 C ATOM 362 CG PRO A 21 -8.746 6.028 19.803 1.00 0.00 C ATOM 363 CD PRO A 21 -9.154 4.610 19.486 1.00 0.00 C ATOM 0 HA PRO A 21 -10.880 6.361 17.283 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -8.953 7.813 18.634 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -10.428 7.303 19.430 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -7.678 6.165 19.634 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -8.935 6.255 20.852 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.285 3.956 19.409 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.794 4.199 20.266 1.00 0.00 H new ATOM 371 N THR A 22 -7.724 5.742 16.614 1.00 0.00 N ATOM 372 CA THR A 22 -6.732 5.966 15.495 1.00 0.00 C ATOM 373 C THR A 22 -7.328 5.490 14.164 1.00 0.00 C ATOM 374 O THR A 22 -7.209 6.161 13.155 1.00 0.00 O ATOM 375 CB THR A 22 -5.470 5.160 15.842 1.00 0.00 C ATOM 376 OG1 THR A 22 -4.964 5.597 17.096 1.00 0.00 O ATOM 377 CG2 THR A 22 -4.405 5.372 14.759 1.00 0.00 C ATOM 0 H THR A 22 -7.407 5.133 17.368 1.00 0.00 H new ATOM 0 HA THR A 22 -6.491 7.024 15.389 1.00 0.00 H new ATOM 0 HB THR A 22 -5.721 4.101 15.896 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.160 5.084 17.321 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.512 4.799 15.009 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.793 5.038 13.797 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.152 6.431 14.700 1.00 0.00 H new ATOM 385 N LEU A 23 -7.979 4.349 14.151 1.00 0.00 N ATOM 386 CA LEU A 23 -8.590 3.861 12.864 1.00 0.00 C ATOM 387 C LEU A 23 -9.712 4.821 12.438 1.00 0.00 C ATOM 388 O LEU A 23 -9.865 5.112 11.267 1.00 0.00 O ATOM 389 CB LEU A 23 -9.151 2.458 13.139 1.00 0.00 C ATOM 390 CG LEU A 23 -7.992 1.504 13.436 1.00 0.00 C ATOM 391 CD1 LEU A 23 -8.521 0.240 14.126 1.00 0.00 C ATOM 392 CD2 LEU A 23 -7.301 1.123 12.124 1.00 0.00 C ATOM 0 H LEU A 23 -8.114 3.741 14.959 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.856 3.824 12.059 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.840 2.487 13.983 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.718 2.104 12.278 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.278 1.997 14.096 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.691 -0.435 14.335 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.010 0.513 15.061 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.238 -0.258 13.473 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.475 0.443 12.332 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.017 0.633 11.465 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.919 2.022 11.640 1.00 0.00 H new ATOM 404 N THR A 24 -10.493 5.328 13.376 1.00 0.00 N ATOM 405 CA THR A 24 -11.592 6.286 12.991 1.00 0.00 C ATOM 406 C THR A 24 -11.004 7.500 12.248 1.00 0.00 C ATOM 407 O THR A 24 -11.621 8.030 11.344 1.00 0.00 O ATOM 408 CB THR A 24 -12.265 6.740 14.298 1.00 0.00 C ATOM 409 OG1 THR A 24 -12.377 5.632 15.180 1.00 0.00 O ATOM 410 CG2 THR A 24 -13.657 7.295 13.993 1.00 0.00 C ATOM 0 H THR A 24 -10.419 5.124 14.373 1.00 0.00 H new ATOM 0 HA THR A 24 -12.311 5.807 12.326 1.00 0.00 H new ATOM 0 HB THR A 24 -11.662 7.518 14.766 1.00 0.00 H new ATOM 0 HG1 THR A 24 -11.524 5.495 15.643 1.00 0.00 H new ATOM 0 HG21 THR A 24 -14.132 7.616 14.920 1.00 0.00 H new ATOM 0 HG22 THR A 24 -13.570 8.145 13.317 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.263 6.520 13.524 1.00 0.00 H new ATOM 418 N ASP A 25 -9.815 7.946 12.614 1.00 0.00 N ATOM 419 CA ASP A 25 -9.207 9.131 11.900 1.00 0.00 C ATOM 420 C ASP A 25 -9.121 8.855 10.389 1.00 0.00 C ATOM 421 O ASP A 25 -9.324 9.746 9.586 1.00 0.00 O ATOM 422 CB ASP A 25 -7.795 9.322 12.483 1.00 0.00 C ATOM 423 CG ASP A 25 -7.146 10.560 11.859 1.00 0.00 C ATOM 424 OD1 ASP A 25 -7.606 11.654 12.143 1.00 0.00 O ATOM 425 OD2 ASP A 25 -6.200 10.392 11.106 1.00 0.00 O ATOM 0 H ASP A 25 -9.247 7.549 13.363 1.00 0.00 H new ATOM 0 HA ASP A 25 -9.815 10.025 12.040 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.850 9.434 13.566 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.186 8.440 12.284 1.00 0.00 H new ATOM 430 N PHE A 26 -8.830 7.630 9.990 1.00 0.00 N ATOM 431 CA PHE A 26 -8.747 7.325 8.512 1.00 0.00 C ATOM 432 C PHE A 26 -10.061 7.715 7.813 1.00 0.00 C ATOM 433 O PHE A 26 -10.050 8.191 6.693 1.00 0.00 O ATOM 434 CB PHE A 26 -8.519 5.813 8.384 1.00 0.00 C ATOM 435 CG PHE A 26 -7.040 5.528 8.431 1.00 0.00 C ATOM 436 CD1 PHE A 26 -6.286 5.560 7.253 1.00 0.00 C ATOM 437 CD2 PHE A 26 -6.424 5.233 9.651 1.00 0.00 C ATOM 438 CE1 PHE A 26 -4.912 5.300 7.298 1.00 0.00 C ATOM 439 CE2 PHE A 26 -5.051 4.971 9.696 1.00 0.00 C ATOM 440 CZ PHE A 26 -4.295 5.005 8.519 1.00 0.00 C ATOM 0 H PHE A 26 -8.649 6.840 10.610 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.939 7.888 8.044 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -9.028 5.287 9.191 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.942 5.447 7.448 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.764 5.785 6.311 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -7.009 5.207 10.559 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.327 5.327 6.390 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.575 4.743 10.638 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.235 4.803 8.553 1.00 0.00 H new ATOM 450 N GLU A 27 -11.193 7.522 8.462 1.00 0.00 N ATOM 451 CA GLU A 27 -12.499 7.895 7.808 1.00 0.00 C ATOM 452 C GLU A 27 -12.510 9.380 7.406 1.00 0.00 C ATOM 453 O GLU A 27 -13.185 9.749 6.465 1.00 0.00 O ATOM 454 CB GLU A 27 -13.608 7.621 8.838 1.00 0.00 C ATOM 455 CG GLU A 27 -13.878 6.117 8.910 1.00 0.00 C ATOM 456 CD GLU A 27 -14.947 5.740 7.882 1.00 0.00 C ATOM 457 OE1 GLU A 27 -16.116 5.785 8.229 1.00 0.00 O ATOM 458 OE2 GLU A 27 -14.578 5.412 6.766 1.00 0.00 O ATOM 0 H GLU A 27 -11.270 7.129 9.400 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.648 7.312 6.899 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.310 7.995 9.817 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.518 8.152 8.558 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.960 5.562 8.716 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -14.209 5.844 9.912 1.00 0.00 H new ATOM 465 N ILE A 28 -11.773 10.235 8.091 1.00 0.00 N ATOM 466 CA ILE A 28 -11.772 11.691 7.697 1.00 0.00 C ATOM 467 C ILE A 28 -10.899 11.881 6.441 1.00 0.00 C ATOM 468 O ILE A 28 -11.239 12.658 5.567 1.00 0.00 O ATOM 469 CB ILE A 28 -11.230 12.483 8.914 1.00 0.00 C ATOM 470 CG1 ILE A 28 -12.321 12.560 9.988 1.00 0.00 C ATOM 471 CG2 ILE A 28 -10.843 13.914 8.509 1.00 0.00 C ATOM 472 CD1 ILE A 28 -12.306 11.290 10.838 1.00 0.00 C ATOM 0 H ILE A 28 -11.184 9.995 8.889 1.00 0.00 H new ATOM 0 HA ILE A 28 -12.769 12.052 7.445 1.00 0.00 H new ATOM 0 HB ILE A 28 -10.347 11.970 9.294 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -12.160 13.433 10.620 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -13.297 12.682 9.519 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -10.466 14.449 9.380 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -10.069 13.878 7.742 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -11.719 14.431 8.117 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -13.084 11.352 11.599 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -12.489 10.424 10.202 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -11.334 11.187 11.320 1.00 0.00 H new ATOM 484 N GLN A 29 -9.798 11.169 6.323 1.00 0.00 N ATOM 485 CA GLN A 29 -8.958 11.320 5.088 1.00 0.00 C ATOM 486 C GLN A 29 -9.600 10.509 3.952 1.00 0.00 C ATOM 487 O GLN A 29 -9.640 10.951 2.819 1.00 0.00 O ATOM 488 CB GLN A 29 -7.562 10.774 5.426 1.00 0.00 C ATOM 489 CG GLN A 29 -6.530 11.392 4.482 1.00 0.00 C ATOM 490 CD GLN A 29 -6.225 12.829 4.925 1.00 0.00 C ATOM 491 OE1 GLN A 29 -5.833 13.053 6.054 1.00 0.00 O ATOM 492 NE2 GLN A 29 -6.386 13.821 4.084 1.00 0.00 N ATOM 0 H GLN A 29 -9.451 10.503 7.013 1.00 0.00 H new ATOM 0 HA GLN A 29 -8.885 12.359 4.768 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.310 11.007 6.460 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.552 9.688 5.332 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.616 10.798 4.486 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -6.909 11.388 3.460 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -6.715 13.638 3.136 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -6.183 14.776 4.377 1.00 0.00 H new ATOM 501 N LEU A 30 -10.119 9.331 4.248 1.00 0.00 N ATOM 502 CA LEU A 30 -10.775 8.517 3.165 1.00 0.00 C ATOM 503 C LEU A 30 -12.096 9.170 2.730 1.00 0.00 C ATOM 504 O LEU A 30 -12.453 9.106 1.567 1.00 0.00 O ATOM 505 CB LEU A 30 -11.040 7.121 3.760 1.00 0.00 C ATOM 506 CG LEU A 30 -10.866 6.056 2.675 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.414 6.044 2.195 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.221 4.684 3.249 1.00 0.00 C ATOM 0 H LEU A 30 -10.117 8.906 5.175 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.137 8.453 2.284 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -10.353 6.930 4.584 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -12.049 7.075 4.169 1.00 0.00 H new ATOM 0 HG LEU A 30 -11.523 6.284 1.836 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.292 5.285 1.422 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -9.158 7.022 1.787 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -8.755 5.817 3.033 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -11.098 3.924 2.478 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -10.563 4.459 4.088 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.256 4.689 3.591 1.00 0.00 H new ATOM 520 N ARG A 31 -12.828 9.807 3.630 1.00 0.00 N ATOM 521 CA ARG A 31 -14.114 10.454 3.192 1.00 0.00 C ATOM 522 C ARG A 31 -13.806 11.703 2.345 1.00 0.00 C ATOM 523 O ARG A 31 -14.508 11.992 1.392 1.00 0.00 O ATOM 524 CB ARG A 31 -14.915 10.813 4.465 1.00 0.00 C ATOM 525 CG ARG A 31 -14.263 11.980 5.218 1.00 0.00 C ATOM 526 CD ARG A 31 -15.043 12.270 6.506 1.00 0.00 C ATOM 527 NE ARG A 31 -16.323 12.906 6.056 1.00 0.00 N ATOM 528 CZ ARG A 31 -17.420 12.194 5.834 1.00 0.00 C ATOM 529 NH1 ARG A 31 -17.435 10.887 5.962 1.00 0.00 N ATOM 530 NH2 ARG A 31 -18.517 12.803 5.466 1.00 0.00 N ATOM 0 H ARG A 31 -12.597 9.904 4.619 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.704 9.780 2.571 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -15.937 11.078 4.193 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -14.974 9.943 5.118 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -13.227 11.737 5.456 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -14.245 12.868 4.586 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -15.234 11.354 7.065 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -14.483 12.935 7.164 1.00 0.00 H new ATOM 0 HE ARG A 31 -16.352 13.916 5.916 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -16.587 10.392 6.239 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -18.294 10.367 5.784 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -18.524 13.817 5.352 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -19.366 12.264 5.293 1.00 0.00 H new ATOM 544 N ASP A 32 -12.760 12.443 2.671 1.00 0.00 N ATOM 545 CA ASP A 32 -12.434 13.660 1.849 1.00 0.00 C ATOM 546 C ASP A 32 -12.088 13.237 0.415 1.00 0.00 C ATOM 547 O ASP A 32 -12.484 13.890 -0.533 1.00 0.00 O ATOM 548 CB ASP A 32 -11.227 14.344 2.512 1.00 0.00 C ATOM 549 CG ASP A 32 -11.714 15.258 3.637 1.00 0.00 C ATOM 550 OD1 ASP A 32 -12.241 14.742 4.608 1.00 0.00 O ATOM 551 OD2 ASP A 32 -11.550 16.461 3.509 1.00 0.00 O ATOM 0 H ASP A 32 -12.132 12.260 3.454 1.00 0.00 H new ATOM 0 HA ASP A 32 -13.282 14.343 1.803 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -10.543 13.594 2.909 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -10.672 14.922 1.773 1.00 0.00 H new ATOM 556 N ALA A 33 -11.369 12.143 0.238 1.00 0.00 N ATOM 557 CA ALA A 33 -11.039 11.701 -1.162 1.00 0.00 C ATOM 558 C ALA A 33 -12.290 11.087 -1.804 1.00 0.00 C ATOM 559 O ALA A 33 -12.576 11.330 -2.962 1.00 0.00 O ATOM 560 CB ALA A 33 -9.925 10.650 -1.053 1.00 0.00 C ATOM 0 H ALA A 33 -11.005 11.551 0.984 1.00 0.00 H new ATOM 0 HA ALA A 33 -10.712 12.538 -1.779 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.655 10.302 -2.050 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.052 11.094 -0.574 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.277 9.808 -0.457 1.00 0.00 H new ATOM 566 N GLN A 34 -13.046 10.303 -1.060 1.00 0.00 N ATOM 567 CA GLN A 34 -14.289 9.694 -1.650 1.00 0.00 C ATOM 568 C GLN A 34 -15.338 10.786 -1.939 1.00 0.00 C ATOM 569 O GLN A 34 -16.128 10.651 -2.855 1.00 0.00 O ATOM 570 CB GLN A 34 -14.835 8.703 -0.608 1.00 0.00 C ATOM 571 CG GLN A 34 -13.950 7.455 -0.576 1.00 0.00 C ATOM 572 CD GLN A 34 -14.672 6.333 0.180 1.00 0.00 C ATOM 573 OE1 GLN A 34 -14.756 6.363 1.392 1.00 0.00 O ATOM 574 NE2 GLN A 34 -15.202 5.333 -0.483 1.00 0.00 N ATOM 0 H GLN A 34 -12.860 10.062 -0.086 1.00 0.00 H new ATOM 0 HA GLN A 34 -14.065 9.193 -2.592 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.858 9.170 0.376 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -15.861 8.428 -0.855 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -13.720 7.134 -1.592 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -13.001 7.682 -0.091 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -15.134 5.303 -1.500 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -15.682 4.586 0.019 1.00 0.00 H new ATOM 583 N LYS A 35 -15.362 11.870 -1.177 1.00 0.00 N ATOM 584 CA LYS A 35 -16.380 12.948 -1.447 1.00 0.00 C ATOM 585 C LYS A 35 -15.856 13.948 -2.492 1.00 0.00 C ATOM 586 O LYS A 35 -16.625 14.489 -3.266 1.00 0.00 O ATOM 587 CB LYS A 35 -16.626 13.659 -0.107 1.00 0.00 C ATOM 588 CG LYS A 35 -17.713 12.917 0.674 1.00 0.00 C ATOM 589 CD LYS A 35 -18.558 13.923 1.457 1.00 0.00 C ATOM 590 CE LYS A 35 -19.486 14.670 0.495 1.00 0.00 C ATOM 591 NZ LYS A 35 -19.496 16.076 0.986 1.00 0.00 N ATOM 0 H LYS A 35 -14.732 12.050 -0.395 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.300 12.521 -1.847 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -15.704 13.692 0.474 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -16.929 14.691 -0.281 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -18.345 12.351 -0.010 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -17.259 12.199 1.357 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -19.144 13.407 2.218 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -17.912 14.630 1.978 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -19.121 14.612 -0.531 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -20.489 14.242 0.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -20.111 16.652 0.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -19.854 16.100 1.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -18.529 16.459 0.962 1.00 0.00 H new ATOM 605 N ASP A 36 -14.562 14.206 -2.530 1.00 0.00 N ATOM 606 CA ASP A 36 -14.023 15.186 -3.547 1.00 0.00 C ATOM 607 C ASP A 36 -14.429 14.760 -4.970 1.00 0.00 C ATOM 608 O ASP A 36 -14.733 15.593 -5.802 1.00 0.00 O ATOM 609 CB ASP A 36 -12.491 15.168 -3.412 1.00 0.00 C ATOM 610 CG ASP A 36 -11.904 16.414 -4.077 1.00 0.00 C ATOM 611 OD1 ASP A 36 -12.096 17.493 -3.541 1.00 0.00 O ATOM 612 OD2 ASP A 36 -11.273 16.269 -5.111 1.00 0.00 O ATOM 0 H ASP A 36 -13.865 13.789 -1.913 1.00 0.00 H new ATOM 0 HA ASP A 36 -14.424 16.185 -3.373 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -12.209 15.138 -2.360 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -12.085 14.270 -3.877 1.00 0.00 H new ATOM 617 N LYS A 37 -14.441 13.471 -5.257 1.00 0.00 N ATOM 618 CA LYS A 37 -14.837 13.019 -6.643 1.00 0.00 C ATOM 619 C LYS A 37 -16.247 13.533 -6.986 1.00 0.00 C ATOM 620 O LYS A 37 -16.506 13.938 -8.103 1.00 0.00 O ATOM 621 CB LYS A 37 -14.825 11.482 -6.628 1.00 0.00 C ATOM 622 CG LYS A 37 -14.582 10.956 -8.045 1.00 0.00 C ATOM 623 CD LYS A 37 -15.921 10.613 -8.704 1.00 0.00 C ATOM 624 CE LYS A 37 -16.451 9.298 -8.126 1.00 0.00 C ATOM 625 NZ LYS A 37 -17.141 8.629 -9.264 1.00 0.00 N ATOM 0 H LYS A 37 -14.199 12.724 -4.606 1.00 0.00 H new ATOM 0 HA LYS A 37 -14.149 13.410 -7.393 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -14.046 11.121 -5.957 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -15.774 11.105 -6.247 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -14.056 11.705 -8.636 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -13.945 10.072 -8.011 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -16.639 11.414 -8.532 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -15.795 10.524 -9.783 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -15.640 8.682 -7.738 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -17.138 9.478 -7.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -17.532 7.719 -8.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -17.912 9.236 -9.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -16.461 8.464 -10.034 1.00 0.00 H new ATOM 639 N SER A 38 -17.164 13.524 -6.034 1.00 0.00 N ATOM 640 CA SER A 38 -18.554 14.017 -6.308 1.00 0.00 C ATOM 641 C SER A 38 -19.154 13.315 -7.542 1.00 0.00 C ATOM 642 O SER A 38 -18.625 12.326 -8.013 1.00 0.00 O ATOM 643 CB SER A 38 -18.410 15.519 -6.564 1.00 0.00 C ATOM 644 OG SER A 38 -19.695 16.082 -6.792 1.00 0.00 O ATOM 0 H SER A 38 -17.005 13.196 -5.082 1.00 0.00 H new ATOM 0 HA SER A 38 -19.224 13.808 -5.474 1.00 0.00 H new ATOM 0 HB2 SER A 38 -17.935 16.001 -5.709 1.00 0.00 H new ATOM 0 HB3 SER A 38 -17.766 15.693 -7.426 1.00 0.00 H new ATOM 0 HG SER A 38 -19.606 17.044 -6.955 1.00 0.00 H new ATOM 650 N SER A 39 -20.253 13.820 -8.068 1.00 0.00 N ATOM 651 CA SER A 39 -20.874 13.173 -9.269 1.00 0.00 C ATOM 652 C SER A 39 -20.686 14.061 -10.511 1.00 0.00 C ATOM 653 O SER A 39 -20.206 13.604 -11.531 1.00 0.00 O ATOM 654 CB SER A 39 -22.359 13.028 -8.933 1.00 0.00 C ATOM 655 OG SER A 39 -22.520 12.024 -7.938 1.00 0.00 O ATOM 0 H SER A 39 -20.740 14.645 -7.718 1.00 0.00 H new ATOM 0 HA SER A 39 -20.416 12.210 -9.494 1.00 0.00 H new ATOM 0 HB2 SER A 39 -22.757 13.978 -8.576 1.00 0.00 H new ATOM 0 HB3 SER A 39 -22.922 12.763 -9.828 1.00 0.00 H new ATOM 0 HG SER A 39 -23.471 11.930 -7.719 1.00 0.00 H new ATOM 661 N LYS A 40 -21.052 15.326 -10.435 1.00 0.00 N ATOM 662 CA LYS A 40 -20.878 16.226 -11.622 1.00 0.00 C ATOM 663 C LYS A 40 -19.628 17.101 -11.433 1.00 0.00 C ATOM 664 O LYS A 40 -19.730 18.292 -11.202 1.00 0.00 O ATOM 665 CB LYS A 40 -22.143 17.092 -11.682 1.00 0.00 C ATOM 666 CG LYS A 40 -23.185 16.415 -12.575 1.00 0.00 C ATOM 667 CD LYS A 40 -23.079 16.970 -13.997 1.00 0.00 C ATOM 668 CE LYS A 40 -24.017 18.170 -14.148 1.00 0.00 C ATOM 669 NZ LYS A 40 -23.312 19.094 -15.081 1.00 0.00 N ATOM 0 H LYS A 40 -21.459 15.767 -9.610 1.00 0.00 H new ATOM 0 HA LYS A 40 -20.743 15.663 -12.546 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -22.546 17.235 -10.679 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -21.901 18.081 -12.073 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -23.027 15.336 -12.582 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -24.186 16.588 -12.180 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -22.052 17.269 -14.206 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -23.340 16.198 -14.721 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -24.985 17.867 -14.548 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -24.205 18.648 -13.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -23.893 19.942 -15.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -22.397 19.371 -14.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -23.153 18.614 -15.990 1.00 0.00 H new ATOM 683 N LEU A 41 -18.448 16.521 -11.526 1.00 0.00 N ATOM 684 CA LEU A 41 -17.199 17.328 -11.344 1.00 0.00 C ATOM 685 C LEU A 41 -15.961 16.524 -11.782 1.00 0.00 C ATOM 686 O LEU A 41 -15.408 15.766 -11.007 1.00 0.00 O ATOM 687 CB LEU A 41 -17.140 17.627 -9.845 1.00 0.00 C ATOM 688 CG LEU A 41 -15.971 18.568 -9.556 1.00 0.00 C ATOM 689 CD1 LEU A 41 -16.359 19.998 -9.939 1.00 0.00 C ATOM 690 CD2 LEU A 41 -15.633 18.515 -8.064 1.00 0.00 C ATOM 0 H LEU A 41 -18.300 15.530 -11.719 1.00 0.00 H new ATOM 0 HA LEU A 41 -17.208 18.236 -11.946 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -18.075 18.081 -9.517 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -17.022 16.700 -9.283 1.00 0.00 H new ATOM 0 HG LEU A 41 -15.103 18.259 -10.138 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -15.525 20.669 -9.733 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -16.602 20.037 -11.001 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -17.227 20.308 -9.357 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -14.799 19.186 -7.856 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -16.502 18.825 -7.483 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -15.357 17.497 -7.789 1.00 0.00 H new ATOM 702 N ALA A 42 -15.523 16.680 -13.014 1.00 0.00 N ATOM 703 CA ALA A 42 -14.320 15.913 -13.481 1.00 0.00 C ATOM 704 C ALA A 42 -13.061 16.789 -13.392 1.00 0.00 C ATOM 705 O ALA A 42 -12.869 17.686 -14.191 1.00 0.00 O ATOM 706 CB ALA A 42 -14.602 15.526 -14.936 1.00 0.00 C ATOM 0 H ALA A 42 -15.942 17.298 -13.708 1.00 0.00 H new ATOM 0 HA ALA A 42 -14.144 15.032 -12.863 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -13.758 14.963 -15.333 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -15.501 14.912 -14.981 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -14.748 16.428 -15.531 1.00 0.00 H new ATOM 712 N ALA A 43 -12.200 16.538 -12.426 1.00 0.00 N ATOM 713 CA ALA A 43 -10.955 17.363 -12.296 1.00 0.00 C ATOM 714 C ALA A 43 -9.976 16.719 -11.296 1.00 0.00 C ATOM 715 O ALA A 43 -10.227 16.701 -10.106 1.00 0.00 O ATOM 716 CB ALA A 43 -11.433 18.719 -11.777 1.00 0.00 C ATOM 0 H ALA A 43 -12.307 15.802 -11.728 1.00 0.00 H new ATOM 0 HA ALA A 43 -10.422 17.448 -13.243 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -10.578 19.384 -11.654 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -12.133 19.155 -12.490 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -11.930 18.586 -10.816 1.00 0.00 H new ATOM 722 N LYS A 44 -8.862 16.185 -11.765 1.00 0.00 N ATOM 723 CA LYS A 44 -7.876 15.539 -10.835 1.00 0.00 C ATOM 724 C LYS A 44 -8.574 14.485 -9.954 1.00 0.00 C ATOM 725 O LYS A 44 -8.714 14.666 -8.759 1.00 0.00 O ATOM 726 CB LYS A 44 -7.315 16.678 -9.976 1.00 0.00 C ATOM 727 CG LYS A 44 -6.064 17.253 -10.643 1.00 0.00 C ATOM 728 CD LYS A 44 -6.466 18.373 -11.605 1.00 0.00 C ATOM 729 CE LYS A 44 -5.294 18.690 -12.537 1.00 0.00 C ATOM 730 NZ LYS A 44 -4.264 19.313 -11.661 1.00 0.00 N ATOM 0 H LYS A 44 -8.598 16.171 -12.750 1.00 0.00 H new ATOM 0 HA LYS A 44 -7.087 15.020 -11.379 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -8.066 17.459 -9.853 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -7.072 16.310 -8.979 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -5.380 17.637 -9.886 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -5.534 16.468 -11.183 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -7.337 18.072 -12.188 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -6.750 19.264 -11.045 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -4.913 17.787 -13.014 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -5.596 19.368 -13.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -3.547 19.784 -12.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -4.715 20.013 -11.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -3.809 18.578 -11.083 1.00 0.00 H new ATOM 744 N SER A 45 -9.017 13.387 -10.534 1.00 0.00 N ATOM 745 CA SER A 45 -9.705 12.333 -9.715 1.00 0.00 C ATOM 746 C SER A 45 -8.726 11.207 -9.352 1.00 0.00 C ATOM 747 O SER A 45 -8.711 10.737 -8.230 1.00 0.00 O ATOM 748 CB SER A 45 -10.844 11.796 -10.587 1.00 0.00 C ATOM 749 OG SER A 45 -11.903 12.743 -10.613 1.00 0.00 O ATOM 0 H SER A 45 -8.932 13.178 -11.529 1.00 0.00 H new ATOM 0 HA SER A 45 -10.081 12.741 -8.777 1.00 0.00 H new ATOM 0 HB2 SER A 45 -10.485 11.607 -11.599 1.00 0.00 H new ATOM 0 HB3 SER A 45 -11.201 10.845 -10.193 1.00 0.00 H new ATOM 0 HG SER A 45 -12.633 12.403 -11.172 1.00 0.00 H new ATOM 755 N ASN A 46 -7.906 10.769 -10.286 1.00 0.00 N ATOM 756 CA ASN A 46 -6.929 9.665 -9.964 1.00 0.00 C ATOM 757 C ASN A 46 -6.010 10.097 -8.809 1.00 0.00 C ATOM 758 O ASN A 46 -5.705 9.310 -7.933 1.00 0.00 O ATOM 759 CB ASN A 46 -6.099 9.419 -11.234 1.00 0.00 C ATOM 760 CG ASN A 46 -6.889 8.519 -12.193 1.00 0.00 C ATOM 761 OD1 ASN A 46 -7.601 9.007 -13.048 1.00 0.00 O ATOM 762 ND2 ASN A 46 -6.794 7.215 -12.094 1.00 0.00 N ATOM 0 H ASN A 46 -7.869 11.120 -11.243 1.00 0.00 H new ATOM 0 HA ASN A 46 -7.450 8.758 -9.657 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.865 10.367 -11.718 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -5.150 8.949 -10.976 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -7.316 6.616 -12.733 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -6.198 6.800 -11.378 1.00 0.00 H new ATOM 769 N GLU A 47 -5.570 11.341 -8.792 1.00 0.00 N ATOM 770 CA GLU A 47 -4.670 11.798 -7.670 1.00 0.00 C ATOM 771 C GLU A 47 -5.396 11.645 -6.325 1.00 0.00 C ATOM 772 O GLU A 47 -4.820 11.178 -5.360 1.00 0.00 O ATOM 773 CB GLU A 47 -4.349 13.279 -7.930 1.00 0.00 C ATOM 774 CG GLU A 47 -3.541 13.405 -9.223 1.00 0.00 C ATOM 775 CD GLU A 47 -2.725 14.698 -9.190 1.00 0.00 C ATOM 776 OE1 GLU A 47 -1.865 14.812 -8.332 1.00 0.00 O ATOM 777 OE2 GLU A 47 -2.973 15.553 -10.024 1.00 0.00 O ATOM 0 H GLU A 47 -5.790 12.049 -9.493 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.758 11.203 -7.631 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -5.272 13.854 -8.007 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.785 13.692 -7.094 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.878 12.547 -9.335 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -4.210 13.406 -10.084 1.00 0.00 H new ATOM 784 N GLN A 48 -6.657 12.025 -6.251 1.00 0.00 N ATOM 785 CA GLN A 48 -7.399 11.878 -4.949 1.00 0.00 C ATOM 786 C GLN A 48 -7.488 10.393 -4.574 1.00 0.00 C ATOM 787 O GLN A 48 -7.253 10.023 -3.437 1.00 0.00 O ATOM 788 CB GLN A 48 -8.809 12.448 -5.170 1.00 0.00 C ATOM 789 CG GLN A 48 -9.396 12.891 -3.830 1.00 0.00 C ATOM 790 CD GLN A 48 -8.577 14.060 -3.268 1.00 0.00 C ATOM 791 OE1 GLN A 48 -8.284 15.002 -3.978 1.00 0.00 O ATOM 792 NE2 GLN A 48 -8.192 14.045 -2.015 1.00 0.00 N ATOM 0 H GLN A 48 -7.196 12.423 -7.020 1.00 0.00 H new ATOM 0 HA GLN A 48 -6.889 12.405 -4.142 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.768 13.293 -5.858 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.450 11.695 -5.628 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -10.436 13.192 -3.959 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -9.390 12.059 -3.126 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -8.436 13.256 -1.416 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -7.649 14.822 -1.639 1.00 0.00 H new ATOM 801 N LEU A 49 -7.821 9.535 -5.518 1.00 0.00 N ATOM 802 CA LEU A 49 -7.914 8.066 -5.190 1.00 0.00 C ATOM 803 C LEU A 49 -6.563 7.547 -4.670 1.00 0.00 C ATOM 804 O LEU A 49 -6.524 6.678 -3.819 1.00 0.00 O ATOM 805 CB LEU A 49 -8.298 7.340 -6.490 1.00 0.00 C ATOM 806 CG LEU A 49 -9.787 7.554 -6.778 1.00 0.00 C ATOM 807 CD1 LEU A 49 -10.147 6.901 -8.113 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.623 6.919 -5.661 1.00 0.00 C ATOM 0 H LEU A 49 -8.029 9.781 -6.486 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.656 7.889 -4.411 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.699 7.717 -7.319 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -8.084 6.275 -6.400 1.00 0.00 H new ATOM 0 HG LEU A 49 -9.996 8.623 -6.826 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.207 7.053 -8.318 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.555 7.351 -8.910 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.937 5.833 -8.064 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.682 7.072 -5.867 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.414 5.850 -5.612 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.368 7.382 -4.708 1.00 0.00 H new ATOM 820 N TRP A 50 -5.448 8.067 -5.161 1.00 0.00 N ATOM 821 CA TRP A 50 -4.113 7.574 -4.656 1.00 0.00 C ATOM 822 C TRP A 50 -4.033 7.772 -3.137 1.00 0.00 C ATOM 823 O TRP A 50 -3.560 6.906 -2.424 1.00 0.00 O ATOM 824 CB TRP A 50 -3.018 8.391 -5.375 1.00 0.00 C ATOM 825 CG TRP A 50 -3.121 8.232 -6.874 1.00 0.00 C ATOM 826 CD1 TRP A 50 -3.876 7.310 -7.534 1.00 0.00 C ATOM 827 CD2 TRP A 50 -2.449 9.009 -7.908 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.712 7.487 -8.895 1.00 0.00 N ATOM 829 CE2 TRP A 50 -2.845 8.519 -9.175 1.00 0.00 C ATOM 830 CE3 TRP A 50 -1.544 10.086 -7.872 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -2.364 9.073 -10.357 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -1.055 10.645 -9.064 1.00 0.00 C ATOM 833 CH2 TRP A 50 -1.468 10.138 -10.305 1.00 0.00 C ATOM 0 H TRP A 50 -5.405 8.795 -5.874 1.00 0.00 H new ATOM 0 HA TRP A 50 -3.981 6.512 -4.861 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -3.112 9.444 -5.110 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -2.034 8.064 -5.038 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.501 6.562 -7.069 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -4.177 6.922 -9.605 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -1.223 10.485 -6.921 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.684 8.679 -11.310 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -0.358 11.469 -9.025 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -1.092 10.573 -11.219 1.00 0.00 H new ATOM 844 N GLU A 51 -4.519 8.887 -2.628 1.00 0.00 N ATOM 845 CA GLU A 51 -4.487 9.088 -1.137 1.00 0.00 C ATOM 846 C GLU A 51 -5.343 8.005 -0.456 1.00 0.00 C ATOM 847 O GLU A 51 -5.029 7.568 0.636 1.00 0.00 O ATOM 848 CB GLU A 51 -5.070 10.483 -0.858 1.00 0.00 C ATOM 849 CG GLU A 51 -4.973 10.786 0.638 1.00 0.00 C ATOM 850 CD GLU A 51 -5.993 11.864 1.009 1.00 0.00 C ATOM 851 OE1 GLU A 51 -7.141 11.514 1.230 1.00 0.00 O ATOM 852 OE2 GLU A 51 -5.610 13.020 1.065 1.00 0.00 O ATOM 0 H GLU A 51 -4.928 9.651 -3.167 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.472 9.013 -0.748 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -4.527 11.237 -1.429 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -6.110 10.526 -1.182 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -5.159 9.881 1.216 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.966 11.122 0.887 1.00 0.00 H new ATOM 859 N ILE A 52 -6.415 7.552 -1.090 1.00 0.00 N ATOM 860 CA ILE A 52 -7.253 6.481 -0.450 1.00 0.00 C ATOM 861 C ILE A 52 -6.476 5.158 -0.473 1.00 0.00 C ATOM 862 O ILE A 52 -6.211 4.587 0.570 1.00 0.00 O ATOM 863 CB ILE A 52 -8.558 6.383 -1.266 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.284 7.741 -1.185 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.448 5.269 -0.688 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.690 7.652 -1.794 1.00 0.00 C ATOM 0 H ILE A 52 -6.736 7.873 -2.003 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.486 6.710 0.590 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.337 6.144 -2.306 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.354 8.058 -0.144 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.704 8.499 -1.711 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.369 5.202 -1.267 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.918 4.318 -0.738 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.688 5.497 0.351 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -11.179 8.623 -1.723 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.615 7.359 -2.841 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.276 6.911 -1.250 1.00 0.00 H new ATOM 878 N MET A 53 -6.082 4.670 -1.637 1.00 0.00 N ATOM 879 CA MET A 53 -5.293 3.385 -1.650 1.00 0.00 C ATOM 880 C MET A 53 -3.964 3.582 -0.894 1.00 0.00 C ATOM 881 O MET A 53 -3.454 2.648 -0.303 1.00 0.00 O ATOM 882 CB MET A 53 -5.047 2.976 -3.119 1.00 0.00 C ATOM 883 CG MET A 53 -4.311 4.078 -3.894 1.00 0.00 C ATOM 884 SD MET A 53 -5.033 4.223 -5.554 1.00 0.00 S ATOM 885 CE MET A 53 -4.473 2.626 -6.187 1.00 0.00 C ATOM 0 H MET A 53 -6.265 5.090 -2.549 1.00 0.00 H new ATOM 0 HA MET A 53 -5.846 2.591 -1.148 1.00 0.00 H new ATOM 0 HB2 MET A 53 -4.463 2.056 -3.149 1.00 0.00 H new ATOM 0 HB3 MET A 53 -6.000 2.764 -3.603 1.00 0.00 H new ATOM 0 HG2 MET A 53 -4.392 5.028 -3.365 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.249 3.842 -3.965 1.00 0.00 H new ATOM 0 HE1 MET A 53 -3.972 2.769 -7.144 1.00 0.00 H new ATOM 0 HE2 MET A 53 -3.778 2.177 -5.477 1.00 0.00 H new ATOM 0 HE3 MET A 53 -5.331 1.967 -6.322 1.00 0.00 H new ATOM 895 N GLN A 54 -3.409 4.786 -0.871 1.00 0.00 N ATOM 896 CA GLN A 54 -2.131 4.993 -0.100 1.00 0.00 C ATOM 897 C GLN A 54 -2.432 4.910 1.406 1.00 0.00 C ATOM 898 O GLN A 54 -1.662 4.348 2.161 1.00 0.00 O ATOM 899 CB GLN A 54 -1.607 6.390 -0.467 1.00 0.00 C ATOM 900 CG GLN A 54 -0.938 6.339 -1.843 1.00 0.00 C ATOM 901 CD GLN A 54 -0.781 7.762 -2.389 1.00 0.00 C ATOM 902 OE1 GLN A 54 -1.587 8.624 -2.100 1.00 0.00 O ATOM 903 NE2 GLN A 54 0.227 8.055 -3.175 1.00 0.00 N ATOM 0 H GLN A 54 -3.778 5.612 -1.342 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.387 4.234 -0.342 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.428 7.107 -0.476 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -0.894 6.731 0.283 1.00 0.00 H new ATOM 0 HG2 GLN A 54 0.037 5.858 -1.767 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -1.537 5.739 -2.528 1.00 0.00 H new ATOM 0 HE21 GLN A 54 0.907 7.336 -3.422 1.00 0.00 H new ATOM 0 HE22 GLN A 54 0.331 9.002 -3.540 1.00 0.00 H new ATOM 912 N LEU A 55 -3.559 5.446 1.853 1.00 0.00 N ATOM 913 CA LEU A 55 -3.898 5.361 3.325 1.00 0.00 C ATOM 914 C LEU A 55 -3.853 3.895 3.798 1.00 0.00 C ATOM 915 O LEU A 55 -3.499 3.622 4.930 1.00 0.00 O ATOM 916 CB LEU A 55 -5.326 5.913 3.492 1.00 0.00 C ATOM 917 CG LEU A 55 -5.278 7.422 3.752 1.00 0.00 C ATOM 918 CD1 LEU A 55 -6.682 8.016 3.589 1.00 0.00 C ATOM 919 CD2 LEU A 55 -4.780 7.678 5.178 1.00 0.00 C ATOM 0 H LEU A 55 -4.246 5.929 1.274 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.182 5.931 3.917 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.911 5.709 2.595 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.825 5.409 4.320 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.600 7.891 3.039 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.647 9.090 3.774 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.039 7.834 2.575 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.360 7.547 4.302 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -4.745 8.751 5.364 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.458 7.208 5.890 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -3.781 7.257 5.296 1.00 0.00 H new ATOM 931 N HIS A 56 -4.202 2.946 2.944 1.00 0.00 N ATOM 932 CA HIS A 56 -4.165 1.501 3.373 1.00 0.00 C ATOM 933 C HIS A 56 -2.760 1.135 3.885 1.00 0.00 C ATOM 934 O HIS A 56 -2.623 0.380 4.829 1.00 0.00 O ATOM 935 CB HIS A 56 -4.513 0.665 2.133 1.00 0.00 C ATOM 936 CG HIS A 56 -5.071 -0.663 2.563 1.00 0.00 C ATOM 937 ND1 HIS A 56 -6.432 -0.878 2.716 1.00 0.00 N ATOM 938 CD2 HIS A 56 -4.465 -1.853 2.876 1.00 0.00 C ATOM 939 CE1 HIS A 56 -6.599 -2.155 3.106 1.00 0.00 C ATOM 940 NE2 HIS A 56 -5.432 -2.795 3.219 1.00 0.00 N ATOM 0 H HIS A 56 -4.506 3.108 1.984 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.870 1.313 4.183 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -5.240 1.194 1.517 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.624 0.516 1.520 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -7.172 -0.193 2.561 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -3.400 -2.032 2.859 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -7.560 -2.607 3.304 1.00 0.00 H new ATOM 948 N HIS A 57 -1.710 1.670 3.281 1.00 0.00 N ATOM 949 CA HIS A 57 -0.321 1.339 3.773 1.00 0.00 C ATOM 950 C HIS A 57 -0.185 1.754 5.242 1.00 0.00 C ATOM 951 O HIS A 57 0.286 0.988 6.064 1.00 0.00 O ATOM 952 CB HIS A 57 0.665 2.146 2.912 1.00 0.00 C ATOM 953 CG HIS A 57 1.067 1.343 1.706 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.181 1.665 0.947 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.520 0.231 1.117 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.267 0.764 -0.047 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.279 -0.133 0.009 1.00 0.00 N ATOM 0 H HIS A 57 -1.753 2.308 2.486 1.00 0.00 H new ATOM 0 HA HIS A 57 -0.121 0.270 3.696 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.205 3.083 2.599 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.547 2.404 3.498 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -0.365 -0.284 1.461 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.041 0.765 -0.800 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.116 -0.916 -0.624 1.00 0.00 H new ATOM 965 N GLN A 58 -0.605 2.956 5.586 1.00 0.00 N ATOM 966 CA GLN A 58 -0.502 3.395 7.022 1.00 0.00 C ATOM 967 C GLN A 58 -1.311 2.441 7.918 1.00 0.00 C ATOM 968 O GLN A 58 -0.900 2.129 9.020 1.00 0.00 O ATOM 969 CB GLN A 58 -1.079 4.818 7.096 1.00 0.00 C ATOM 970 CG GLN A 58 -0.818 5.405 8.486 1.00 0.00 C ATOM 971 CD GLN A 58 0.452 6.264 8.449 1.00 0.00 C ATOM 972 OE1 GLN A 58 0.716 6.927 7.467 1.00 0.00 O ATOM 973 NE2 GLN A 58 1.258 6.283 9.482 1.00 0.00 N ATOM 0 H GLN A 58 -1.008 3.641 4.947 1.00 0.00 H new ATOM 0 HA GLN A 58 0.532 3.380 7.367 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.622 5.447 6.332 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.150 4.798 6.893 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.669 6.008 8.803 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -0.706 4.603 9.216 1.00 0.00 H new ATOM 0 HE21 GLN A 58 1.040 5.727 10.309 1.00 0.00 H new ATOM 0 HE22 GLN A 58 2.103 6.853 9.459 1.00 0.00 H new ATOM 982 N ARG A 59 -2.454 1.962 7.454 1.00 0.00 N ATOM 983 CA ARG A 59 -3.260 1.016 8.304 1.00 0.00 C ATOM 984 C ARG A 59 -2.448 -0.262 8.557 1.00 0.00 C ATOM 985 O ARG A 59 -2.336 -0.711 9.683 1.00 0.00 O ATOM 986 CB ARG A 59 -4.539 0.682 7.520 1.00 0.00 C ATOM 987 CG ARG A 59 -5.411 1.934 7.395 1.00 0.00 C ATOM 988 CD ARG A 59 -6.424 1.980 8.547 1.00 0.00 C ATOM 989 NE ARG A 59 -7.742 2.268 7.899 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.354 1.365 7.150 1.00 0.00 C ATOM 991 NH1 ARG A 59 -7.835 0.176 6.950 1.00 0.00 N ATOM 992 NH2 ARG A 59 -9.503 1.655 6.596 1.00 0.00 N ATOM 0 H ARG A 59 -2.854 2.181 6.542 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.506 1.462 9.268 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.282 0.306 6.530 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.092 -0.109 8.027 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.786 2.827 7.413 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.934 1.930 6.439 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -6.449 1.034 9.087 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -6.163 2.753 9.270 1.00 0.00 H new ATOM 0 HE ARG A 59 -8.178 3.180 8.038 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -6.941 -0.069 7.376 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -8.326 -0.503 6.369 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -9.922 2.573 6.742 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -9.979 0.963 6.018 1.00 0.00 H new ATOM 1006 N SER A 60 -1.869 -0.853 7.525 1.00 0.00 N ATOM 1007 CA SER A 60 -1.059 -2.102 7.749 1.00 0.00 C ATOM 1008 C SER A 60 0.138 -1.775 8.649 1.00 0.00 C ATOM 1009 O SER A 60 0.458 -2.528 9.545 1.00 0.00 O ATOM 1010 CB SER A 60 -0.576 -2.579 6.371 1.00 0.00 C ATOM 1011 OG SER A 60 0.053 -1.498 5.693 1.00 0.00 O ATOM 0 H SER A 60 -1.922 -0.531 6.559 1.00 0.00 H new ATOM 0 HA SER A 60 -1.650 -2.878 8.235 1.00 0.00 H new ATOM 0 HB2 SER A 60 0.123 -3.408 6.485 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.418 -2.950 5.786 1.00 0.00 H new ATOM 0 HG SER A 60 -0.182 -0.655 6.133 1.00 0.00 H new ATOM 1017 N ARG A 61 0.793 -0.651 8.434 1.00 0.00 N ATOM 1018 CA ARG A 61 1.960 -0.296 9.316 1.00 0.00 C ATOM 1019 C ARG A 61 1.471 -0.133 10.764 1.00 0.00 C ATOM 1020 O ARG A 61 2.126 -0.563 11.693 1.00 0.00 O ATOM 1021 CB ARG A 61 2.532 1.032 8.794 1.00 0.00 C ATOM 1022 CG ARG A 61 3.966 1.203 9.299 1.00 0.00 C ATOM 1023 CD ARG A 61 4.762 2.051 8.304 1.00 0.00 C ATOM 1024 NE ARG A 61 5.809 2.731 9.127 1.00 0.00 N ATOM 1025 CZ ARG A 61 6.877 2.078 9.559 1.00 0.00 C ATOM 1026 NH1 ARG A 61 7.062 0.808 9.282 1.00 0.00 N ATOM 1027 NH2 ARG A 61 7.771 2.706 10.278 1.00 0.00 N ATOM 0 H ARG A 61 0.576 0.024 7.701 1.00 0.00 H new ATOM 0 HA ARG A 61 2.724 -1.073 9.298 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.515 1.044 7.704 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.914 1.864 9.132 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.963 1.681 10.279 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.438 0.228 9.421 1.00 0.00 H new ATOM 0 HD2 ARG A 61 5.211 1.431 7.528 1.00 0.00 H new ATOM 0 HD3 ARG A 61 4.121 2.776 7.802 1.00 0.00 H new ATOM 0 HE ARG A 61 5.698 3.718 9.360 1.00 0.00 H new ATOM 0 HH11 ARG A 61 6.375 0.303 8.723 1.00 0.00 H new ATOM 0 HH12 ARG A 61 7.893 0.327 9.626 1.00 0.00 H new ATOM 0 HH21 ARG A 61 7.643 3.693 10.503 1.00 0.00 H new ATOM 0 HH22 ARG A 61 8.596 2.209 10.614 1.00 0.00 H new ATOM 1041 N TYR A 62 0.315 0.476 10.967 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.201 0.642 12.371 1.00 0.00 C ATOM 1043 C TYR A 62 -0.463 -0.742 12.987 1.00 0.00 C ATOM 1044 O TYR A 62 0.011 -1.039 14.069 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.513 1.443 12.264 1.00 0.00 C ATOM 1046 CG TYR A 62 -2.120 1.623 13.636 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -2.924 0.615 14.180 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -1.875 2.793 14.365 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.483 0.775 15.451 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.436 2.955 15.637 1.00 0.00 C ATOM 1051 CZ TYR A 62 -3.240 1.945 16.181 1.00 0.00 C ATOM 1052 OH TYR A 62 -3.792 2.103 17.434 1.00 0.00 O ATOM 0 H TYR A 62 -0.282 0.858 10.234 1.00 0.00 H new ATOM 0 HA TYR A 62 0.517 1.161 13.007 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.319 2.416 11.812 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.215 0.923 11.612 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -3.113 -0.287 13.617 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.253 3.570 13.946 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -4.103 -0.004 15.870 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.249 3.858 16.199 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.523 2.970 17.803 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.203 -1.597 12.306 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.466 -2.965 12.880 1.00 0.00 C ATOM 1064 C ILE A 63 -0.159 -3.781 12.879 1.00 0.00 C ATOM 1065 O ILE A 63 0.097 -4.537 13.798 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.541 -3.624 11.995 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.841 -2.812 12.101 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.794 -5.058 12.472 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.924 -3.421 11.202 1.00 0.00 C ATOM 0 H ILE A 63 -1.628 -1.412 11.397 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.816 -2.912 13.911 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.201 -3.646 10.960 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.184 -2.796 13.135 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.657 -1.778 11.810 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.555 -5.521 11.844 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.870 -5.632 12.406 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.138 -5.042 13.506 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.839 -2.835 11.287 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.584 -3.414 10.166 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.120 -4.447 11.512 1.00 0.00 H new ATOM 1081 N TYR A 64 0.679 -3.626 11.872 1.00 0.00 N ATOM 1082 CA TYR A 64 1.972 -4.393 11.864 1.00 0.00 C ATOM 1083 C TYR A 64 2.866 -3.876 13.000 1.00 0.00 C ATOM 1084 O TYR A 64 3.498 -4.647 13.695 1.00 0.00 O ATOM 1085 CB TYR A 64 2.640 -4.132 10.503 1.00 0.00 C ATOM 1086 CG TYR A 64 3.742 -5.139 10.276 1.00 0.00 C ATOM 1087 CD1 TYR A 64 4.932 -5.056 11.007 1.00 0.00 C ATOM 1088 CD2 TYR A 64 3.572 -6.155 9.330 1.00 0.00 C ATOM 1089 CE1 TYR A 64 5.951 -5.993 10.793 1.00 0.00 C ATOM 1090 CE2 TYR A 64 4.588 -7.091 9.116 1.00 0.00 C ATOM 1091 CZ TYR A 64 5.779 -7.011 9.848 1.00 0.00 C ATOM 1092 OH TYR A 64 6.783 -7.934 9.636 1.00 0.00 O ATOM 0 H TYR A 64 0.527 -3.014 11.071 1.00 0.00 H new ATOM 0 HA TYR A 64 1.808 -5.461 12.010 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.901 -4.201 9.705 1.00 0.00 H new ATOM 0 HB3 TYR A 64 3.046 -3.121 10.474 1.00 0.00 H new ATOM 0 HD1 TYR A 64 5.065 -4.270 11.736 1.00 0.00 H new ATOM 0 HD2 TYR A 64 2.654 -6.217 8.764 1.00 0.00 H new ATOM 0 HE1 TYR A 64 6.870 -5.930 11.357 1.00 0.00 H new ATOM 0 HE2 TYR A 64 4.454 -7.876 8.386 1.00 0.00 H new ATOM 0 HH TYR A 64 7.291 -8.061 10.465 1.00 0.00 H new ATOM 1102 N THR A 65 2.921 -2.574 13.204 1.00 0.00 N ATOM 1103 CA THR A 65 3.785 -2.035 14.312 1.00 0.00 C ATOM 1104 C THR A 65 3.313 -2.586 15.667 1.00 0.00 C ATOM 1105 O THR A 65 4.123 -2.921 16.511 1.00 0.00 O ATOM 1106 CB THR A 65 3.648 -0.502 14.286 1.00 0.00 C ATOM 1107 OG1 THR A 65 4.029 -0.017 13.007 1.00 0.00 O ATOM 1108 CG2 THR A 65 4.559 0.110 15.352 1.00 0.00 C ATOM 0 H THR A 65 2.415 -1.874 12.662 1.00 0.00 H new ATOM 0 HA THR A 65 4.824 -2.334 14.174 1.00 0.00 H new ATOM 0 HB THR A 65 2.613 -0.226 14.489 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.229 0.123 12.459 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.462 1.196 15.334 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.271 -0.264 16.335 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.594 -0.165 15.148 1.00 0.00 H new ATOM 1116 N LEU A 66 2.018 -2.669 15.899 1.00 0.00 N ATOM 1117 CA LEU A 66 1.545 -3.187 17.230 1.00 0.00 C ATOM 1118 C LEU A 66 1.511 -4.732 17.283 1.00 0.00 C ATOM 1119 O LEU A 66 1.798 -5.310 18.316 1.00 0.00 O ATOM 1120 CB LEU A 66 0.151 -2.567 17.491 1.00 0.00 C ATOM 1121 CG LEU A 66 -0.915 -3.158 16.557 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.457 -4.468 17.146 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -2.062 -2.150 16.406 1.00 0.00 C ATOM 0 H LEU A 66 1.284 -2.407 15.241 1.00 0.00 H new ATOM 0 HA LEU A 66 2.244 -2.895 18.014 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.137 -2.741 18.528 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.200 -1.487 17.350 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.472 -3.364 15.583 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.213 -4.882 16.478 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.641 -5.182 17.257 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.903 -4.272 18.121 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.824 -2.562 15.744 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.501 -1.949 17.383 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.677 -1.222 15.983 1.00 0.00 H new ATOM 1135 N TYR A 67 1.160 -5.413 16.206 1.00 0.00 N ATOM 1136 CA TYR A 67 1.115 -6.923 16.265 1.00 0.00 C ATOM 1137 C TYR A 67 2.490 -7.550 15.958 1.00 0.00 C ATOM 1138 O TYR A 67 2.830 -8.579 16.512 1.00 0.00 O ATOM 1139 CB TYR A 67 0.075 -7.380 15.223 1.00 0.00 C ATOM 1140 CG TYR A 67 -0.053 -8.892 15.262 1.00 0.00 C ATOM 1141 CD1 TYR A 67 0.813 -9.684 14.497 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -1.026 -9.502 16.068 1.00 0.00 C ATOM 1143 CE1 TYR A 67 0.707 -11.080 14.538 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -1.133 -10.899 16.108 1.00 0.00 C ATOM 1145 CZ TYR A 67 -0.264 -11.688 15.343 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.367 -13.063 15.382 1.00 0.00 O ATOM 0 H TYR A 67 0.908 -5.001 15.308 1.00 0.00 H new ATOM 0 HA TYR A 67 0.844 -7.248 17.269 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.890 -6.918 15.430 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.376 -7.056 14.227 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.563 -9.218 13.875 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.694 -8.894 16.659 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.376 -11.689 13.947 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -1.884 -11.366 16.728 1.00 0.00 H new ATOM 0 HH TYR A 67 -0.913 -13.328 16.151 1.00 0.00 H new ATOM 1156 N TYR A 68 3.271 -6.970 15.069 1.00 0.00 N ATOM 1157 CA TYR A 68 4.602 -7.594 14.736 1.00 0.00 C ATOM 1158 C TYR A 68 5.786 -6.944 15.490 1.00 0.00 C ATOM 1159 O TYR A 68 6.905 -7.406 15.364 1.00 0.00 O ATOM 1160 CB TYR A 68 4.772 -7.430 13.217 1.00 0.00 C ATOM 1161 CG TYR A 68 4.186 -8.632 12.510 1.00 0.00 C ATOM 1162 CD1 TYR A 68 4.649 -9.917 12.822 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.181 -8.466 11.544 1.00 0.00 C ATOM 1164 CE1 TYR A 68 4.111 -11.033 12.172 1.00 0.00 C ATOM 1165 CE2 TYR A 68 2.644 -9.584 10.895 1.00 0.00 C ATOM 1166 CZ TYR A 68 3.109 -10.867 11.209 1.00 0.00 C ATOM 1167 OH TYR A 68 2.578 -11.969 10.569 1.00 0.00 O ATOM 0 H TYR A 68 3.052 -6.109 14.568 1.00 0.00 H new ATOM 0 HA TYR A 68 4.610 -8.639 15.047 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.275 -6.520 12.881 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.828 -7.328 12.968 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.422 -10.046 13.565 1.00 0.00 H new ATOM 0 HD2 TYR A 68 2.822 -7.476 11.302 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.469 -12.023 12.413 1.00 0.00 H new ATOM 0 HE2 TYR A 68 1.871 -9.457 10.152 1.00 0.00 H new ATOM 0 HH TYR A 68 1.893 -11.678 9.931 1.00 0.00 H new ATOM 1177 N LYS A 69 5.578 -5.899 16.277 1.00 0.00 N ATOM 1178 CA LYS A 69 6.734 -5.288 17.011 1.00 0.00 C ATOM 1179 C LYS A 69 6.333 -4.916 18.449 1.00 0.00 C ATOM 1180 O LYS A 69 6.927 -5.393 19.398 1.00 0.00 O ATOM 1181 CB LYS A 69 7.111 -4.036 16.216 1.00 0.00 C ATOM 1182 CG LYS A 69 7.649 -4.440 14.837 1.00 0.00 C ATOM 1183 CD LYS A 69 6.562 -4.229 13.775 1.00 0.00 C ATOM 1184 CE LYS A 69 6.885 -2.982 12.947 1.00 0.00 C ATOM 1185 NZ LYS A 69 7.941 -3.414 11.990 1.00 0.00 N ATOM 0 H LYS A 69 4.673 -5.455 16.436 1.00 0.00 H new ATOM 0 HA LYS A 69 7.570 -5.983 17.090 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.240 -3.390 16.102 1.00 0.00 H new ATOM 0 HB3 LYS A 69 7.864 -3.463 16.757 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.530 -3.847 14.592 1.00 0.00 H new ATOM 0 HG3 LYS A 69 7.961 -5.484 14.849 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.500 -5.102 13.126 1.00 0.00 H new ATOM 0 HD3 LYS A 69 5.589 -4.118 14.254 1.00 0.00 H new ATOM 0 HE2 LYS A 69 6.002 -2.618 12.422 1.00 0.00 H new ATOM 0 HE3 LYS A 69 7.237 -2.168 13.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 8.214 -2.611 11.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 8.772 -3.749 12.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 7.576 -4.185 11.395 1.00 0.00 H new ATOM 1199 N ARG A 70 5.335 -4.072 18.626 1.00 0.00 N ATOM 1200 CA ARG A 70 4.923 -3.694 20.030 1.00 0.00 C ATOM 1201 C ARG A 70 4.427 -4.930 20.803 1.00 0.00 C ATOM 1202 O ARG A 70 4.548 -4.991 22.010 1.00 0.00 O ATOM 1203 CB ARG A 70 3.788 -2.668 19.902 1.00 0.00 C ATOM 1204 CG ARG A 70 3.794 -1.744 21.120 1.00 0.00 C ATOM 1205 CD ARG A 70 4.913 -0.712 20.975 1.00 0.00 C ATOM 1206 NE ARG A 70 4.747 0.206 22.144 1.00 0.00 N ATOM 1207 CZ ARG A 70 5.110 -0.160 23.363 1.00 0.00 C ATOM 1208 NH1 ARG A 70 5.626 -1.345 23.598 1.00 0.00 N ATOM 1209 NH2 ARG A 70 4.950 0.670 24.362 1.00 0.00 N ATOM 0 H ARG A 70 4.796 -3.635 17.878 1.00 0.00 H new ATOM 0 HA ARG A 70 5.770 -3.281 20.578 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.912 -2.085 18.990 1.00 0.00 H new ATOM 0 HB3 ARG A 70 2.828 -3.179 19.825 1.00 0.00 H new ATOM 0 HG2 ARG A 70 2.831 -1.241 21.212 1.00 0.00 H new ATOM 0 HG3 ARG A 70 3.938 -2.326 22.030 1.00 0.00 H new ATOM 0 HD2 ARG A 70 5.893 -1.189 20.984 1.00 0.00 H new ATOM 0 HD3 ARG A 70 4.830 -0.170 20.033 1.00 0.00 H new ATOM 0 HE ARG A 70 4.346 1.133 21.999 1.00 0.00 H new ATOM 0 HH11 ARG A 70 5.755 -2.006 22.832 1.00 0.00 H new ATOM 0 HH12 ARG A 70 5.898 -1.604 24.546 1.00 0.00 H new ATOM 0 HH21 ARG A 70 4.548 1.593 24.199 1.00 0.00 H new ATOM 0 HH22 ARG A 70 5.228 0.394 25.304 1.00 0.00 H new ATOM 1223 N LYS A 71 3.860 -5.918 20.127 1.00 0.00 N ATOM 1224 CA LYS A 71 3.354 -7.137 20.840 1.00 0.00 C ATOM 1225 C LYS A 71 2.282 -6.740 21.863 1.00 0.00 C ATOM 1226 O LYS A 71 2.277 -7.223 22.980 1.00 0.00 O ATOM 1227 CB LYS A 71 4.569 -7.763 21.537 1.00 0.00 C ATOM 1228 CG LYS A 71 4.310 -9.252 21.776 1.00 0.00 C ATOM 1229 CD LYS A 71 4.988 -9.687 23.077 1.00 0.00 C ATOM 1230 CE LYS A 71 6.375 -10.253 22.766 1.00 0.00 C ATOM 1231 NZ LYS A 71 6.122 -11.627 22.248 1.00 0.00 N ATOM 0 H LYS A 71 3.729 -5.926 19.115 1.00 0.00 H new ATOM 0 HA LYS A 71 2.894 -7.845 20.150 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.461 -7.632 20.924 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.757 -7.259 22.485 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.238 -9.441 21.832 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.694 -9.837 20.940 1.00 0.00 H new ATOM 0 HD2 LYS A 71 5.074 -8.839 23.756 1.00 0.00 H new ATOM 0 HD3 LYS A 71 4.382 -10.439 23.582 1.00 0.00 H new ATOM 0 HE2 LYS A 71 6.894 -9.642 22.028 1.00 0.00 H new ATOM 0 HE3 LYS A 71 7.001 -10.276 23.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 6.678 -12.313 22.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 5.110 -11.851 22.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 6.401 -11.678 21.247 1.00 0.00 H new ATOM 1245 N ALA A 72 1.364 -5.873 21.486 1.00 0.00 N ATOM 1246 CA ALA A 72 0.287 -5.460 22.434 1.00 0.00 C ATOM 1247 C ALA A 72 -1.088 -5.862 21.871 1.00 0.00 C ATOM 1248 O ALA A 72 -2.054 -5.137 22.014 1.00 0.00 O ATOM 1249 CB ALA A 72 0.406 -3.938 22.530 1.00 0.00 C ATOM 0 H ALA A 72 1.319 -5.438 20.564 1.00 0.00 H new ATOM 0 HA ALA A 72 0.385 -5.936 23.410 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.354 -3.556 23.211 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.395 -3.673 22.905 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.263 -3.499 21.543 1.00 0.00 H new ATOM 1255 N ILE A 73 -1.185 -7.012 21.230 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.501 -7.447 20.661 1.00 0.00 C ATOM 1257 C ILE A 73 -2.531 -8.980 20.504 1.00 0.00 C ATOM 1258 O ILE A 73 -1.496 -9.621 20.515 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.590 -6.750 19.294 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -3.913 -7.117 18.614 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.422 -7.184 18.401 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -4.072 -6.307 17.324 1.00 0.00 C ATOM 0 H ILE A 73 -0.412 -7.661 21.080 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.342 -7.184 21.303 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.542 -5.672 19.445 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -3.934 -8.184 18.390 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -4.747 -6.916 19.286 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.497 -6.683 17.436 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.480 -6.914 18.878 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.458 -8.263 18.254 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.014 -6.570 16.843 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.070 -5.243 17.560 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.245 -6.531 16.650 1.00 0.00 H new ATOM 1274 N SER A 74 -3.696 -9.570 20.352 1.00 0.00 N ATOM 1275 CA SER A 74 -3.758 -11.055 20.191 1.00 0.00 C ATOM 1276 C SER A 74 -4.172 -11.415 18.756 1.00 0.00 C ATOM 1277 O SER A 74 -4.925 -10.695 18.131 1.00 0.00 O ATOM 1278 CB SER A 74 -4.817 -11.528 21.190 1.00 0.00 C ATOM 1279 OG SER A 74 -4.338 -11.324 22.513 1.00 0.00 O ATOM 0 H SER A 74 -4.596 -9.091 20.333 1.00 0.00 H new ATOM 0 HA SER A 74 -2.793 -11.527 20.373 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.747 -10.980 21.039 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.039 -12.583 21.030 1.00 0.00 H new ATOM 0 HG SER A 74 -5.014 -11.624 23.156 1.00 0.00 H new ATOM 1285 N LYS A 75 -3.681 -12.524 18.225 1.00 0.00 N ATOM 1286 CA LYS A 75 -4.051 -12.931 16.812 1.00 0.00 C ATOM 1287 C LYS A 75 -5.569 -12.804 16.563 1.00 0.00 C ATOM 1288 O LYS A 75 -5.983 -12.507 15.461 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.624 -14.399 16.657 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.398 -14.711 15.176 1.00 0.00 C ATOM 1291 CD LYS A 75 -3.090 -16.201 15.007 1.00 0.00 C ATOM 1292 CE LYS A 75 -2.117 -16.395 13.841 1.00 0.00 C ATOM 1293 NZ LYS A 75 -2.599 -17.616 13.138 1.00 0.00 N ATOM 0 H LYS A 75 -3.045 -13.162 18.704 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.555 -12.281 16.092 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.711 -14.585 17.222 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.391 -15.057 17.065 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.283 -14.444 14.598 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.573 -14.113 14.790 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -2.658 -16.600 15.925 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -4.011 -16.754 14.822 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -2.119 -15.530 13.177 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.095 -16.522 14.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -1.982 -17.815 12.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -2.580 -18.424 13.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.572 -17.463 12.805 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.400 -13.019 17.568 1.00 0.00 N ATOM 1308 CA ASP A 76 -7.883 -12.887 17.336 1.00 0.00 C ATOM 1309 C ASP A 76 -8.211 -11.446 16.925 1.00 0.00 C ATOM 1310 O ASP A 76 -8.879 -11.223 15.932 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.579 -13.236 18.662 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.784 -14.750 18.748 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -9.642 -15.253 18.042 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -8.079 -15.381 19.518 1.00 0.00 O ATOM 0 H ASP A 76 -6.123 -13.274 18.516 1.00 0.00 H new ATOM 0 HA ASP A 76 -8.221 -13.551 16.540 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -7.977 -12.892 19.503 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.539 -12.724 18.727 1.00 0.00 H new ATOM 1319 N LEU A 77 -7.732 -10.462 17.663 1.00 0.00 N ATOM 1320 CA LEU A 77 -8.019 -9.039 17.264 1.00 0.00 C ATOM 1321 C LEU A 77 -7.289 -8.740 15.948 1.00 0.00 C ATOM 1322 O LEU A 77 -7.851 -8.150 15.045 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.490 -8.131 18.387 1.00 0.00 C ATOM 1324 CG LEU A 77 -7.792 -6.668 18.043 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.289 -6.401 18.220 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -6.993 -5.741 18.966 1.00 0.00 C ATOM 0 H LEU A 77 -7.168 -10.578 18.505 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.086 -8.870 17.119 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.957 -8.397 19.335 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.416 -8.273 18.509 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.507 -6.476 17.009 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.504 -5.361 17.976 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.856 -7.055 17.557 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.574 -6.597 19.254 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.212 -4.703 18.717 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.271 -5.932 20.003 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.927 -5.929 18.836 1.00 0.00 H new ATOM 1338 N TYR A 78 -6.044 -9.159 15.825 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.299 -8.903 14.542 1.00 0.00 C ATOM 1340 C TYR A 78 -6.020 -9.618 13.382 1.00 0.00 C ATOM 1341 O TYR A 78 -6.119 -9.082 12.294 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.872 -9.458 14.738 1.00 0.00 C ATOM 1343 CG TYR A 78 -3.066 -9.311 13.461 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -3.085 -8.105 12.749 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.298 -10.385 12.996 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.337 -7.974 11.573 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.550 -10.253 11.820 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.571 -9.047 11.108 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.833 -8.918 9.949 1.00 0.00 O ATOM 0 H TYR A 78 -5.520 -9.658 16.544 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.258 -7.841 14.300 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.377 -8.927 15.551 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -3.920 -10.508 15.026 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.677 -7.276 13.107 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.283 -11.315 13.544 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.352 -7.044 11.025 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.957 -11.081 11.462 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.358 -9.756 9.769 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.546 -10.810 13.607 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.279 -11.516 12.498 1.00 0.00 C ATOM 1361 C ASP A 79 -8.638 -10.832 12.289 1.00 0.00 C ATOM 1362 O ASP A 79 -9.052 -10.599 11.169 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.475 -12.973 12.949 1.00 0.00 C ATOM 1364 CG ASP A 79 -7.797 -13.845 11.735 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -8.725 -13.509 11.017 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -7.111 -14.836 11.543 1.00 0.00 O ATOM 0 H ASP A 79 -6.500 -11.314 14.493 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.727 -11.481 11.559 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.573 -13.336 13.442 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -8.283 -13.033 13.678 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.328 -10.488 13.361 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.658 -9.792 13.207 1.00 0.00 C ATOM 1373 C TRP A 80 -10.475 -8.495 12.395 1.00 0.00 C ATOM 1374 O TRP A 80 -11.317 -8.144 11.590 1.00 0.00 O ATOM 1375 CB TRP A 80 -11.146 -9.469 14.632 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.488 -8.809 14.583 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.669 -9.455 14.449 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.805 -7.390 14.675 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.691 -8.523 14.453 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.209 -7.236 14.588 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -12.020 -6.233 14.821 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.811 -5.978 14.646 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.622 -4.966 14.879 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -14.015 -4.839 14.791 1.00 0.00 C ATOM 0 H TRP A 80 -9.033 -10.656 14.323 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.380 -10.415 12.679 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.205 -10.385 15.220 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.430 -8.816 15.130 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.793 -10.524 14.354 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.680 -8.758 14.367 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -10.946 -6.319 14.889 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.885 -5.886 14.579 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -12.008 -4.084 14.992 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.473 -3.862 14.835 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.373 -7.790 12.585 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.155 -6.529 11.792 1.00 0.00 C ATOM 1397 C LEU A 81 -8.908 -6.902 10.322 1.00 0.00 C ATOM 1398 O LEU A 81 -9.520 -6.350 9.427 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.911 -5.840 12.380 1.00 0.00 C ATOM 1400 CG LEU A 81 -8.159 -5.481 13.847 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.819 -5.382 14.578 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -8.877 -4.135 13.927 1.00 0.00 C ATOM 0 H LEU A 81 -8.630 -8.029 13.242 1.00 0.00 H new ATOM 0 HA LEU A 81 -10.019 -5.866 11.842 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.047 -6.499 12.299 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.680 -4.940 11.810 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.775 -6.252 14.311 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.993 -5.126 15.623 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.301 -6.339 14.520 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -6.207 -4.610 14.113 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -9.054 -3.879 14.972 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -8.260 -3.365 13.464 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.830 -4.199 13.403 1.00 0.00 H new ATOM 1414 N ILE A 82 -8.025 -7.850 10.062 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.764 -8.260 8.631 1.00 0.00 C ATOM 1416 C ILE A 82 -9.086 -8.706 7.961 1.00 0.00 C ATOM 1417 O ILE A 82 -9.263 -8.526 6.770 1.00 0.00 O ATOM 1418 CB ILE A 82 -6.753 -9.433 8.682 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.391 -8.935 9.204 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -6.563 -10.041 7.284 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -4.833 -7.834 8.291 1.00 0.00 C ATOM 0 H ILE A 82 -7.482 -8.351 10.765 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.364 -7.432 8.046 1.00 0.00 H new ATOM 0 HB ILE A 82 -7.148 -10.195 9.354 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.502 -8.552 10.219 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -4.688 -9.766 9.252 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.850 -10.863 7.339 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.519 -10.414 6.916 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.185 -9.278 6.604 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.871 -7.495 8.676 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.702 -8.229 7.283 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -5.529 -6.996 8.265 1.00 0.00 H new ATOM 1433 N LYS A 83 -10.015 -9.281 8.707 1.00 0.00 N ATOM 1434 CA LYS A 83 -11.310 -9.722 8.076 1.00 0.00 C ATOM 1435 C LYS A 83 -12.345 -8.576 8.041 1.00 0.00 C ATOM 1436 O LYS A 83 -13.256 -8.603 7.235 1.00 0.00 O ATOM 1437 CB LYS A 83 -11.832 -10.882 8.935 1.00 0.00 C ATOM 1438 CG LYS A 83 -10.875 -12.070 8.825 1.00 0.00 C ATOM 1439 CD LYS A 83 -11.650 -13.373 9.031 1.00 0.00 C ATOM 1440 CE LYS A 83 -10.882 -14.532 8.392 1.00 0.00 C ATOM 1441 NZ LYS A 83 -11.208 -15.718 9.232 1.00 0.00 N ATOM 0 H LYS A 83 -9.933 -9.460 9.708 1.00 0.00 H new ATOM 0 HA LYS A 83 -11.147 -10.024 7.041 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -11.920 -10.567 9.975 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -12.829 -11.173 8.605 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -10.393 -12.072 7.847 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.084 -11.983 9.570 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -11.791 -13.560 10.096 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -12.642 -13.292 8.587 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -11.187 -14.685 7.357 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -9.810 -14.338 8.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -10.717 -16.555 8.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -10.900 -15.546 10.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -12.235 -15.883 9.217 1.00 0.00 H new ATOM 1455 N GLU A 84 -12.227 -7.573 8.895 1.00 0.00 N ATOM 1456 CA GLU A 84 -13.233 -6.451 8.866 1.00 0.00 C ATOM 1457 C GLU A 84 -12.704 -5.217 8.095 1.00 0.00 C ATOM 1458 O GLU A 84 -13.204 -4.123 8.273 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.475 -6.089 10.327 1.00 0.00 C ATOM 1460 CG GLU A 84 -14.113 -7.267 11.059 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.505 -7.537 10.485 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -16.246 -6.586 10.307 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -15.805 -8.693 10.233 1.00 0.00 O ATOM 0 H GLU A 84 -11.492 -7.485 9.597 1.00 0.00 H new ATOM 0 HA GLU A 84 -14.143 -6.761 8.353 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.533 -5.821 10.805 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -14.124 -5.216 10.391 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.488 -8.154 10.955 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -14.184 -7.050 12.125 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.708 -5.381 7.236 1.00 0.00 N ATOM 1471 CA LYS A 85 -11.139 -4.238 6.428 1.00 0.00 C ATOM 1472 C LYS A 85 -10.280 -3.312 7.294 1.00 0.00 C ATOM 1473 O LYS A 85 -10.703 -2.239 7.679 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.321 -3.475 5.807 1.00 0.00 C ATOM 1475 CG LYS A 85 -11.930 -2.975 4.415 1.00 0.00 C ATOM 1476 CD LYS A 85 -13.169 -2.947 3.517 1.00 0.00 C ATOM 1477 CE LYS A 85 -13.572 -4.378 3.158 1.00 0.00 C ATOM 1478 NZ LYS A 85 -12.798 -4.700 1.928 1.00 0.00 N ATOM 0 H LYS A 85 -11.258 -6.279 7.059 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.484 -4.624 5.647 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -13.193 -4.126 5.740 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.599 -2.634 6.442 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -11.495 -1.978 4.484 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -11.169 -3.626 3.983 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -13.990 -2.444 4.028 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -12.961 -2.378 2.611 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -13.334 -5.069 3.966 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -14.645 -4.453 2.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -13.022 -5.668 1.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -13.050 -4.030 1.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -11.780 -4.627 2.129 1.00 0.00 H new ATOM 1492 N TYR A 86 -9.067 -3.725 7.601 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.169 -2.882 8.437 1.00 0.00 C ATOM 1494 C TYR A 86 -6.761 -2.871 7.831 1.00 0.00 C ATOM 1495 O TYR A 86 -6.282 -1.847 7.383 1.00 0.00 O ATOM 1496 CB TYR A 86 -8.157 -3.561 9.804 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.405 -3.195 10.564 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.644 -3.752 10.206 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.322 -2.292 11.628 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.795 -3.393 10.923 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.472 -1.941 12.342 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.708 -2.491 11.990 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.843 -2.139 12.689 1.00 0.00 O ATOM 0 H TYR A 86 -8.667 -4.615 7.303 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.502 -1.846 8.500 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -8.097 -4.643 9.683 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.275 -3.254 10.365 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.710 -4.451 9.385 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.368 -1.865 11.899 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.752 -3.814 10.651 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.405 -1.245 13.165 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.594 -1.843 13.589 1.00 0.00 H new ATOM 1513 N ALA A 87 -6.096 -4.004 7.804 1.00 0.00 N ATOM 1514 CA ALA A 87 -4.726 -4.059 7.220 1.00 0.00 C ATOM 1515 C ALA A 87 -4.717 -5.008 6.012 1.00 0.00 C ATOM 1516 O ALA A 87 -5.707 -5.658 5.730 1.00 0.00 O ATOM 1517 CB ALA A 87 -3.838 -4.602 8.338 1.00 0.00 C ATOM 0 H ALA A 87 -6.448 -4.891 8.163 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.381 -3.086 6.869 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -2.809 -4.672 7.984 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -3.882 -3.931 9.196 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.188 -5.591 8.633 1.00 0.00 H new ATOM 1523 N ASP A 88 -3.614 -5.099 5.299 1.00 0.00 N ATOM 1524 CA ASP A 88 -3.565 -6.012 4.119 1.00 0.00 C ATOM 1525 C ASP A 88 -2.563 -7.148 4.376 1.00 0.00 C ATOM 1526 O ASP A 88 -1.366 -6.951 4.280 1.00 0.00 O ATOM 1527 CB ASP A 88 -3.103 -5.134 2.955 1.00 0.00 C ATOM 1528 CG ASP A 88 -3.340 -5.869 1.635 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -2.925 -7.013 1.533 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -3.931 -5.276 0.748 1.00 0.00 O ATOM 0 H ASP A 88 -2.755 -4.582 5.486 1.00 0.00 H new ATOM 0 HA ASP A 88 -4.528 -6.479 3.913 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -3.647 -4.189 2.960 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.046 -4.893 3.065 1.00 0.00 H new ATOM 1535 N LYS A 89 -3.038 -8.334 4.700 1.00 0.00 N ATOM 1536 CA LYS A 89 -2.084 -9.471 4.958 1.00 0.00 C ATOM 1537 C LYS A 89 -1.361 -9.852 3.657 1.00 0.00 C ATOM 1538 O LYS A 89 -0.176 -10.130 3.665 1.00 0.00 O ATOM 1539 CB LYS A 89 -2.926 -10.654 5.461 1.00 0.00 C ATOM 1540 CG LYS A 89 -3.103 -10.546 6.977 1.00 0.00 C ATOM 1541 CD LYS A 89 -3.299 -11.942 7.569 1.00 0.00 C ATOM 1542 CE LYS A 89 -2.805 -11.957 9.017 1.00 0.00 C ATOM 1543 NZ LYS A 89 -3.639 -12.987 9.697 1.00 0.00 N ATOM 0 H LYS A 89 -4.027 -8.562 4.796 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.329 -9.191 5.692 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -3.899 -10.656 4.970 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -2.438 -11.595 5.207 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -2.230 -10.070 7.423 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -3.962 -9.917 7.209 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -4.352 -12.220 7.530 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -2.753 -12.678 6.980 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -1.746 -12.208 9.070 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -2.925 -10.980 9.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -3.359 -13.056 10.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -4.642 -12.717 9.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -3.499 -13.908 9.234 1.00 0.00 H new ATOM 1557 N LEU A 90 -2.058 -9.866 2.538 1.00 0.00 N ATOM 1558 CA LEU A 90 -1.379 -10.233 1.245 1.00 0.00 C ATOM 1559 C LEU A 90 -0.265 -9.218 0.937 1.00 0.00 C ATOM 1560 O LEU A 90 0.806 -9.595 0.494 1.00 0.00 O ATOM 1561 CB LEU A 90 -2.463 -10.209 0.150 1.00 0.00 C ATOM 1562 CG LEU A 90 -1.842 -10.551 -1.206 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -1.325 -11.991 -1.184 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -2.902 -10.409 -2.302 1.00 0.00 C ATOM 0 H LEU A 90 -3.051 -9.643 2.463 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.918 -11.219 1.301 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -3.250 -10.924 0.390 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.928 -9.224 0.109 1.00 0.00 H new ATOM 0 HG LEU A 90 -1.014 -9.871 -1.407 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -0.883 -12.234 -2.150 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.571 -12.095 -0.404 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.152 -12.672 -0.982 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -2.461 -10.652 -3.269 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.729 -11.090 -2.099 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -3.272 -9.384 -2.320 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.492 -7.940 1.176 1.00 0.00 N ATOM 1577 CA LEU A 91 0.593 -6.935 0.897 1.00 0.00 C ATOM 1578 C LEU A 91 1.694 -7.095 1.953 1.00 0.00 C ATOM 1579 O LEU A 91 2.867 -7.107 1.629 1.00 0.00 O ATOM 1580 CB LEU A 91 -0.048 -5.538 0.979 1.00 0.00 C ATOM 1581 CG LEU A 91 1.016 -4.452 0.744 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.670 -4.633 -0.637 1.00 0.00 C ATOM 1583 CD2 LEU A 91 0.348 -3.077 0.822 1.00 0.00 C ATOM 0 H LEU A 91 -1.363 -7.557 1.544 1.00 0.00 H new ATOM 0 HA LEU A 91 1.039 -7.079 -0.087 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.840 -5.449 0.235 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.511 -5.399 1.956 1.00 0.00 H new ATOM 0 HG LEU A 91 1.790 -4.534 1.507 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.421 -3.857 -0.789 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.145 -5.613 -0.689 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.908 -4.558 -1.413 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.094 -2.300 0.657 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.426 -3.005 0.058 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.100 -2.946 1.807 1.00 0.00 H new ATOM 1595 N ILE A 92 1.330 -7.254 3.214 1.00 0.00 N ATOM 1596 CA ILE A 92 2.388 -7.452 4.271 1.00 0.00 C ATOM 1597 C ILE A 92 3.224 -8.702 3.908 1.00 0.00 C ATOM 1598 O ILE A 92 4.422 -8.723 4.112 1.00 0.00 O ATOM 1599 CB ILE A 92 1.645 -7.627 5.619 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.042 -6.274 6.030 1.00 0.00 C ATOM 1601 CG2 ILE A 92 2.618 -8.097 6.709 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.266 -6.413 7.347 1.00 0.00 C ATOM 0 H ILE A 92 0.367 -7.255 3.551 1.00 0.00 H new ATOM 0 HA ILE A 92 3.073 -6.607 4.341 1.00 0.00 H new ATOM 0 HB ILE A 92 0.860 -8.374 5.502 1.00 0.00 H new ATOM 0 HG12 ILE A 92 1.835 -5.535 6.144 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.378 -5.911 5.246 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.081 -8.215 7.650 1.00 0.00 H new ATOM 0 HG22 ILE A 92 3.056 -9.052 6.419 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.409 -7.358 6.834 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -0.155 -5.447 7.625 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.539 -7.137 7.220 1.00 0.00 H new ATOM 0 HD13 ILE A 92 0.940 -6.754 8.132 1.00 0.00 H new ATOM 1614 N ALA A 93 2.607 -9.728 3.342 1.00 0.00 N ATOM 1615 CA ALA A 93 3.405 -10.941 2.945 1.00 0.00 C ATOM 1616 C ALA A 93 4.344 -10.568 1.786 1.00 0.00 C ATOM 1617 O ALA A 93 5.482 -10.993 1.749 1.00 0.00 O ATOM 1618 CB ALA A 93 2.397 -12.011 2.493 1.00 0.00 C ATOM 0 H ALA A 93 1.608 -9.775 3.143 1.00 0.00 H new ATOM 0 HA ALA A 93 4.011 -11.313 3.771 1.00 0.00 H new ATOM 0 HB1 ALA A 93 2.932 -12.912 2.195 1.00 0.00 H new ATOM 0 HB2 ALA A 93 1.722 -12.246 3.316 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.821 -11.634 1.648 1.00 0.00 H new ATOM 1624 N LYS A 94 3.885 -9.759 0.840 1.00 0.00 N ATOM 1625 CA LYS A 94 4.787 -9.357 -0.304 1.00 0.00 C ATOM 1626 C LYS A 94 6.055 -8.689 0.253 1.00 0.00 C ATOM 1627 O LYS A 94 7.151 -8.956 -0.202 1.00 0.00 O ATOM 1628 CB LYS A 94 4.003 -8.346 -1.164 1.00 0.00 C ATOM 1629 CG LYS A 94 3.213 -9.079 -2.253 1.00 0.00 C ATOM 1630 CD LYS A 94 4.177 -9.804 -3.196 1.00 0.00 C ATOM 1631 CE LYS A 94 3.544 -9.912 -4.587 1.00 0.00 C ATOM 1632 NZ LYS A 94 3.015 -11.302 -4.661 1.00 0.00 N ATOM 0 H LYS A 94 2.943 -9.368 0.812 1.00 0.00 H new ATOM 0 HA LYS A 94 5.082 -10.224 -0.895 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.323 -7.772 -0.535 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.691 -7.635 -1.620 1.00 0.00 H new ATOM 0 HG2 LYS A 94 2.528 -9.795 -1.798 1.00 0.00 H new ATOM 0 HG3 LYS A 94 2.606 -8.369 -2.815 1.00 0.00 H new ATOM 0 HD2 LYS A 94 5.121 -9.263 -3.255 1.00 0.00 H new ATOM 0 HD3 LYS A 94 4.403 -10.798 -2.809 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.748 -9.179 -4.717 1.00 0.00 H new ATOM 0 HE3 LYS A 94 4.279 -9.727 -5.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 2.381 -11.389 -5.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 3.806 -11.970 -4.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 2.488 -11.520 -3.791 1.00 0.00 H new ATOM 1646 N TRP A 95 5.914 -7.828 1.243 1.00 0.00 N ATOM 1647 CA TRP A 95 7.132 -7.160 1.827 1.00 0.00 C ATOM 1648 C TRP A 95 8.030 -8.206 2.513 1.00 0.00 C ATOM 1649 O TRP A 95 9.242 -8.108 2.466 1.00 0.00 O ATOM 1650 CB TRP A 95 6.628 -6.130 2.854 1.00 0.00 C ATOM 1651 CG TRP A 95 6.347 -4.825 2.171 1.00 0.00 C ATOM 1652 CD1 TRP A 95 7.162 -4.228 1.270 1.00 0.00 C ATOM 1653 CD2 TRP A 95 5.191 -3.949 2.317 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.582 -3.042 0.858 1.00 0.00 N ATOM 1655 CE2 TRP A 95 5.367 -2.826 1.473 1.00 0.00 C ATOM 1656 CE3 TRP A 95 4.019 -4.017 3.093 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.415 -1.809 1.401 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 3.059 -2.994 3.022 1.00 0.00 C ATOM 1659 CH2 TRP A 95 3.257 -1.892 2.177 1.00 0.00 C ATOM 0 H TRP A 95 5.024 -7.562 1.666 1.00 0.00 H new ATOM 0 HA TRP A 95 7.723 -6.675 1.051 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.724 -6.499 3.339 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.374 -5.988 3.636 1.00 0.00 H new ATOM 0 HD1 TRP A 95 8.111 -4.615 0.928 1.00 0.00 H new ATOM 0 HE1 TRP A 95 7.002 -2.405 0.181 1.00 0.00 H new ATOM 0 HE3 TRP A 95 3.857 -4.861 3.747 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.573 -0.963 0.749 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.163 -3.056 3.622 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.515 -1.109 2.127 1.00 0.00 H new ATOM 1670 N ARG A 96 7.451 -9.212 3.140 1.00 0.00 N ATOM 1671 CA ARG A 96 8.299 -10.263 3.812 1.00 0.00 C ATOM 1672 C ARG A 96 8.821 -11.282 2.780 1.00 0.00 C ATOM 1673 O ARG A 96 9.899 -11.822 2.939 1.00 0.00 O ATOM 1674 CB ARG A 96 7.394 -10.962 4.840 1.00 0.00 C ATOM 1675 CG ARG A 96 7.268 -10.090 6.100 1.00 0.00 C ATOM 1676 CD ARG A 96 5.792 -9.970 6.509 1.00 0.00 C ATOM 1677 NE ARG A 96 5.733 -10.473 7.916 1.00 0.00 N ATOM 1678 CZ ARG A 96 5.767 -11.768 8.186 1.00 0.00 C ATOM 1679 NH1 ARG A 96 5.866 -12.665 7.232 1.00 0.00 N ATOM 1680 NH2 ARG A 96 5.704 -12.170 9.430 1.00 0.00 N ATOM 0 H ARG A 96 6.443 -9.351 3.216 1.00 0.00 H new ATOM 0 HA ARG A 96 9.169 -9.814 4.291 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.409 -11.140 4.409 1.00 0.00 H new ATOM 0 HB3 ARG A 96 7.808 -11.936 5.100 1.00 0.00 H new ATOM 0 HG2 ARG A 96 7.845 -10.527 6.914 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.683 -9.100 5.911 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.448 -8.938 6.445 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.152 -10.560 5.853 1.00 0.00 H new ATOM 0 HE ARG A 96 5.665 -9.804 8.683 1.00 0.00 H new ATOM 0 HH11 ARG A 96 5.919 -12.369 6.257 1.00 0.00 H new ATOM 0 HH12 ARG A 96 5.890 -13.658 7.466 1.00 0.00 H new ATOM 0 HH21 ARG A 96 5.629 -11.487 10.184 1.00 0.00 H new ATOM 0 HH22 ARG A 96 5.730 -13.167 9.646 1.00 0.00 H new ATOM 1694 N LYS A 97 8.071 -11.556 1.726 1.00 0.00 N ATOM 1695 CA LYS A 97 8.553 -12.550 0.692 1.00 0.00 C ATOM 1696 C LYS A 97 9.954 -12.169 0.181 1.00 0.00 C ATOM 1697 O LYS A 97 10.544 -11.206 0.636 1.00 0.00 O ATOM 1698 CB LYS A 97 7.558 -12.481 -0.479 1.00 0.00 C ATOM 1699 CG LYS A 97 6.422 -13.478 -0.278 1.00 0.00 C ATOM 1700 CD LYS A 97 6.980 -14.903 -0.268 1.00 0.00 C ATOM 1701 CE LYS A 97 5.887 -15.883 -0.703 1.00 0.00 C ATOM 1702 NZ LYS A 97 4.964 -15.970 0.462 1.00 0.00 N ATOM 0 H LYS A 97 7.158 -11.141 1.537 1.00 0.00 H new ATOM 0 HA LYS A 97 8.611 -13.549 1.123 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.153 -11.472 -0.560 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.074 -12.694 -1.415 1.00 0.00 H new ATOM 0 HG2 LYS A 97 5.907 -13.272 0.660 1.00 0.00 H new ATOM 0 HG3 LYS A 97 5.686 -13.371 -1.075 1.00 0.00 H new ATOM 0 HD2 LYS A 97 7.836 -14.975 -0.940 1.00 0.00 H new ATOM 0 HD3 LYS A 97 7.336 -15.158 0.730 1.00 0.00 H new ATOM 0 HE2 LYS A 97 5.368 -15.526 -1.592 1.00 0.00 H new ATOM 0 HE3 LYS A 97 6.306 -16.859 -0.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 4.922 -16.953 0.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 5.311 -15.356 1.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 4.013 -15.662 0.175 1.00 0.00 H new ATOM 1716 N THR A 98 10.485 -12.907 -0.774 1.00 0.00 N ATOM 1717 CA THR A 98 11.840 -12.567 -1.315 1.00 0.00 C ATOM 1718 C THR A 98 11.698 -11.910 -2.696 1.00 0.00 C ATOM 1719 O THR A 98 10.931 -12.363 -3.524 1.00 0.00 O ATOM 1720 CB THR A 98 12.593 -13.897 -1.423 1.00 0.00 C ATOM 1721 OG1 THR A 98 11.659 -14.962 -1.546 1.00 0.00 O ATOM 1722 CG2 THR A 98 13.444 -14.104 -0.170 1.00 0.00 C ATOM 0 H THR A 98 10.040 -13.722 -1.196 1.00 0.00 H new ATOM 0 HA THR A 98 12.372 -11.864 -0.674 1.00 0.00 H new ATOM 0 HB THR A 98 13.239 -13.879 -2.301 1.00 0.00 H new ATOM 0 HG1 THR A 98 12.140 -15.813 -1.617 1.00 0.00 H new ATOM 0 HG21 THR A 98 13.980 -15.050 -0.246 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.160 -13.288 -0.078 1.00 0.00 H new ATOM 0 HG23 THR A 98 12.799 -14.122 0.709 1.00 0.00 H new ATOM 1730 N GLY A 99 12.422 -10.839 -2.949 1.00 0.00 N ATOM 1731 CA GLY A 99 12.314 -10.153 -4.270 1.00 0.00 C ATOM 1732 C GLY A 99 11.328 -8.965 -4.198 1.00 0.00 C ATOM 1733 O GLY A 99 10.952 -8.424 -5.221 1.00 0.00 O ATOM 0 H GLY A 99 13.080 -10.416 -2.295 1.00 0.00 H new ATOM 0 HA2 GLY A 99 13.296 -9.797 -4.580 1.00 0.00 H new ATOM 0 HA3 GLY A 99 11.979 -10.863 -5.026 1.00 0.00 H new ATOM 1737 N TYR A 100 10.903 -8.542 -3.016 1.00 0.00 N ATOM 1738 CA TYR A 100 9.956 -7.392 -2.929 1.00 0.00 C ATOM 1739 C TYR A 100 10.588 -6.252 -2.115 1.00 0.00 C ATOM 1740 O TYR A 100 10.193 -5.992 -0.992 1.00 0.00 O ATOM 1741 CB TYR A 100 8.727 -7.946 -2.208 1.00 0.00 C ATOM 1742 CG TYR A 100 7.977 -8.873 -3.130 1.00 0.00 C ATOM 1743 CD1 TYR A 100 7.424 -8.386 -4.319 1.00 0.00 C ATOM 1744 CD2 TYR A 100 7.835 -10.221 -2.792 1.00 0.00 C ATOM 1745 CE1 TYR A 100 6.726 -9.250 -5.169 1.00 0.00 C ATOM 1746 CE2 TYR A 100 7.139 -11.086 -3.638 1.00 0.00 C ATOM 1747 CZ TYR A 100 6.583 -10.602 -4.830 1.00 0.00 C ATOM 1748 OH TYR A 100 5.895 -11.456 -5.668 1.00 0.00 O ATOM 0 H TYR A 100 11.176 -8.948 -2.121 1.00 0.00 H new ATOM 0 HA TYR A 100 9.705 -6.986 -3.909 1.00 0.00 H new ATOM 0 HB2 TYR A 100 9.031 -8.479 -1.307 1.00 0.00 H new ATOM 0 HB3 TYR A 100 8.079 -7.129 -1.891 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.536 -7.344 -4.580 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.265 -10.595 -1.874 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.297 -8.875 -6.087 1.00 0.00 H new ATOM 0 HE2 TYR A 100 7.029 -12.127 -3.374 1.00 0.00 H new ATOM 0 HH TYR A 100 5.890 -12.358 -5.284 1.00 0.00 H new ATOM 1758 N GLU A 101 11.566 -5.565 -2.668 1.00 0.00 N ATOM 1759 CA GLU A 101 12.210 -4.441 -1.908 1.00 0.00 C ATOM 1760 C GLU A 101 11.540 -3.102 -2.257 1.00 0.00 C ATOM 1761 O GLU A 101 11.402 -2.241 -1.407 1.00 0.00 O ATOM 1762 CB GLU A 101 13.685 -4.429 -2.333 1.00 0.00 C ATOM 1763 CG GLU A 101 14.541 -3.874 -1.193 1.00 0.00 C ATOM 1764 CD GLU A 101 15.962 -3.619 -1.698 1.00 0.00 C ATOM 1765 OE1 GLU A 101 16.751 -4.548 -1.681 1.00 0.00 O ATOM 1766 OE2 GLU A 101 16.236 -2.497 -2.094 1.00 0.00 O ATOM 0 H GLU A 101 11.942 -5.732 -3.601 1.00 0.00 H new ATOM 0 HA GLU A 101 12.107 -4.580 -0.832 1.00 0.00 H new ATOM 0 HB2 GLU A 101 14.009 -5.438 -2.587 1.00 0.00 H new ATOM 0 HB3 GLU A 101 13.812 -3.819 -3.227 1.00 0.00 H new ATOM 0 HG2 GLU A 101 14.106 -2.948 -0.815 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.560 -4.579 -0.362 1.00 0.00 H new ATOM 1773 N LYS A 102 11.124 -2.908 -3.494 1.00 0.00 N ATOM 1774 CA LYS A 102 10.475 -1.617 -3.870 1.00 0.00 C ATOM 1775 C LYS A 102 9.081 -1.865 -4.470 1.00 0.00 C ATOM 1776 O LYS A 102 8.913 -1.843 -5.676 1.00 0.00 O ATOM 1777 CB LYS A 102 11.409 -1.001 -4.914 1.00 0.00 C ATOM 1778 CG LYS A 102 12.676 -0.474 -4.229 1.00 0.00 C ATOM 1779 CD LYS A 102 12.582 1.047 -4.058 1.00 0.00 C ATOM 1780 CE LYS A 102 13.404 1.742 -5.147 1.00 0.00 C ATOM 1781 NZ LYS A 102 14.002 2.931 -4.477 1.00 0.00 N ATOM 0 H LYS A 102 11.208 -3.588 -4.250 1.00 0.00 H new ATOM 0 HA LYS A 102 10.330 -0.963 -3.010 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.673 -1.746 -5.664 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.902 -0.189 -5.436 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.800 -0.951 -3.257 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.554 -0.728 -4.823 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.541 1.365 -4.116 1.00 0.00 H new ATOM 0 HD3 LYS A 102 12.949 1.335 -3.073 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.176 1.081 -5.541 1.00 0.00 H new ATOM 0 HE3 LYS A 102 12.776 2.037 -5.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.581 3.460 -5.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.243 3.545 -4.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 14.600 2.619 -3.685 1.00 0.00 H new ATOM 1795 N LEU A 103 8.076 -2.090 -3.646 1.00 0.00 N ATOM 1796 CA LEU A 103 6.704 -2.323 -4.189 1.00 0.00 C ATOM 1797 C LEU A 103 5.711 -1.321 -3.564 1.00 0.00 C ATOM 1798 O LEU A 103 5.863 -0.931 -2.421 1.00 0.00 O ATOM 1799 CB LEU A 103 6.360 -3.783 -3.824 1.00 0.00 C ATOM 1800 CG LEU A 103 6.018 -3.915 -2.333 1.00 0.00 C ATOM 1801 CD1 LEU A 103 4.517 -3.673 -2.131 1.00 0.00 C ATOM 1802 CD2 LEU A 103 6.382 -5.320 -1.850 1.00 0.00 C ATOM 0 H LEU A 103 8.152 -2.121 -2.629 1.00 0.00 H new ATOM 0 HA LEU A 103 6.648 -2.172 -5.267 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.516 -4.122 -4.425 1.00 0.00 H new ATOM 0 HB3 LEU A 103 7.204 -4.430 -4.065 1.00 0.00 H new ATOM 0 HG LEU A 103 6.583 -3.179 -1.762 1.00 0.00 H new ATOM 0 HD11 LEU A 103 4.273 -3.766 -1.073 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.260 -2.671 -2.476 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.950 -4.409 -2.701 1.00 0.00 H new ATOM 0 HD21 LEU A 103 6.140 -5.415 -0.792 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.817 -6.058 -2.419 1.00 0.00 H new ATOM 0 HD23 LEU A 103 7.449 -5.489 -1.995 1.00 0.00 H new ATOM 1814 N CYS A 104 4.709 -0.890 -4.304 1.00 0.00 N ATOM 1815 CA CYS A 104 3.734 0.097 -3.729 1.00 0.00 C ATOM 1816 C CYS A 104 2.338 -0.513 -3.475 1.00 0.00 C ATOM 1817 O CYS A 104 1.658 -0.097 -2.557 1.00 0.00 O ATOM 1818 CB CYS A 104 3.677 1.276 -4.718 1.00 0.00 C ATOM 1819 SG CYS A 104 3.119 0.761 -6.369 1.00 0.00 S ATOM 0 H CYS A 104 4.527 -1.175 -5.266 1.00 0.00 H new ATOM 0 HA CYS A 104 4.068 0.425 -2.744 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.003 2.040 -4.331 1.00 0.00 H new ATOM 0 HB3 CYS A 104 4.664 1.731 -4.796 1.00 0.00 H new ATOM 1824 N CYS A 105 1.889 -1.486 -4.246 1.00 0.00 N ATOM 1825 CA CYS A 105 0.531 -2.081 -3.978 1.00 0.00 C ATOM 1826 C CYS A 105 0.541 -3.587 -4.297 1.00 0.00 C ATOM 1827 O CYS A 105 1.580 -4.163 -4.547 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.470 -1.404 -4.931 1.00 0.00 C ATOM 1829 SG CYS A 105 -0.255 0.396 -5.019 1.00 0.00 S ATOM 0 H CYS A 105 2.394 -1.888 -5.036 1.00 0.00 H new ATOM 0 HA CYS A 105 0.263 -1.932 -2.932 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.357 -1.828 -5.929 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.485 -1.628 -4.603 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.617 -4.222 -4.315 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.669 -5.684 -4.653 1.00 0.00 C ATOM 1836 C LEU A 106 -1.089 -5.877 -6.129 1.00 0.00 C ATOM 1837 O LEU A 106 -0.586 -6.758 -6.801 1.00 0.00 O ATOM 1838 CB LEU A 106 -1.709 -6.298 -3.708 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.051 -6.654 -2.374 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.114 -7.172 -1.404 1.00 0.00 C ATOM 1841 CD2 LEU A 106 0.013 -7.735 -2.593 1.00 0.00 C ATOM 0 H LEU A 106 -1.519 -3.792 -4.111 1.00 0.00 H new ATOM 0 HA LEU A 106 0.304 -6.161 -4.533 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.526 -5.595 -3.545 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.142 -7.190 -4.160 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.579 -5.765 -1.957 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -1.646 -7.426 -0.453 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.867 -6.400 -1.243 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.588 -8.059 -1.824 1.00 0.00 H new ATOM 0 HD21 LEU A 106 0.479 -7.985 -1.640 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.454 -8.626 -3.013 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.772 -7.364 -3.282 1.00 0.00 H new ATOM 1853 N ARG A 107 -1.978 -5.044 -6.654 1.00 0.00 N ATOM 1854 CA ARG A 107 -2.378 -5.179 -8.098 1.00 0.00 C ATOM 1855 C ARG A 107 -1.673 -4.086 -8.938 1.00 0.00 C ATOM 1856 O ARG A 107 -2.214 -3.585 -9.903 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.899 -4.983 -8.128 1.00 0.00 C ATOM 1858 CG ARG A 107 -4.462 -5.548 -9.433 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.669 -4.716 -9.871 1.00 0.00 C ATOM 1860 NE ARG A 107 -5.542 -4.605 -11.357 1.00 0.00 N ATOM 1861 CZ ARG A 107 -5.831 -5.625 -12.150 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -6.241 -6.776 -11.665 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -5.708 -5.491 -13.446 1.00 0.00 N ATOM 0 H ARG A 107 -2.436 -4.287 -6.146 1.00 0.00 H new ATOM 0 HA ARG A 107 -2.095 -6.146 -8.514 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -4.357 -5.484 -7.275 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -4.141 -3.924 -8.044 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -3.696 -5.533 -10.208 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -4.755 -6.589 -9.295 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -6.605 -5.199 -9.590 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.663 -3.733 -9.400 1.00 0.00 H new ATOM 0 HE ARG A 107 -5.227 -3.726 -11.768 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -6.343 -6.898 -10.657 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -6.458 -7.547 -12.296 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -5.391 -4.605 -13.839 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -5.929 -6.273 -14.063 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.463 -3.719 -8.566 1.00 0.00 N ATOM 1878 CA CYS A 108 0.306 -2.671 -9.307 1.00 0.00 C ATOM 1879 C CYS A 108 1.649 -3.344 -9.684 1.00 0.00 C ATOM 1880 O CYS A 108 1.945 -3.541 -10.843 1.00 0.00 O ATOM 1881 CB CYS A 108 0.458 -1.566 -8.244 1.00 0.00 C ATOM 1882 SG CYS A 108 0.513 0.125 -8.902 1.00 0.00 S ATOM 0 H CYS A 108 0.029 -4.113 -7.764 1.00 0.00 H new ATOM 0 HA CYS A 108 -0.132 -2.266 -10.219 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.373 -1.640 -7.542 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.371 -1.750 -7.678 1.00 0.00 H new ATOM 1887 N ILE A 109 2.427 -3.775 -8.700 1.00 0.00 N ATOM 1888 CA ILE A 109 3.710 -4.510 -9.018 1.00 0.00 C ATOM 1889 C ILE A 109 3.410 -5.900 -9.625 1.00 0.00 C ATOM 1890 O ILE A 109 4.252 -6.472 -10.291 1.00 0.00 O ATOM 1891 CB ILE A 109 4.483 -4.680 -7.686 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.631 -5.475 -6.675 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.808 -3.302 -7.103 1.00 0.00 C ATOM 1894 CD1 ILE A 109 4.524 -6.372 -5.815 1.00 0.00 C ATOM 0 H ILE A 109 2.232 -3.651 -7.707 1.00 0.00 H new ATOM 0 HA ILE A 109 4.294 -3.948 -9.746 1.00 0.00 H new ATOM 0 HB ILE A 109 5.407 -5.225 -7.880 1.00 0.00 H new ATOM 0 HG12 ILE A 109 3.074 -4.787 -6.038 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.898 -6.082 -7.206 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.352 -3.422 -6.166 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.422 -2.744 -7.810 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.882 -2.758 -6.918 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.908 -6.926 -5.107 1.00 0.00 H new ATOM 0 HD12 ILE A 109 5.061 -7.072 -6.455 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.240 -5.757 -5.270 1.00 0.00 H new ATOM 1906 N GLN A 110 2.231 -6.457 -9.398 1.00 0.00 N ATOM 1907 CA GLN A 110 1.910 -7.801 -9.961 1.00 0.00 C ATOM 1908 C GLN A 110 0.547 -7.756 -10.667 1.00 0.00 C ATOM 1909 O GLN A 110 -0.309 -6.967 -10.310 1.00 0.00 O ATOM 1910 CB GLN A 110 1.855 -8.733 -8.749 1.00 0.00 C ATOM 1911 CG GLN A 110 1.589 -10.165 -9.217 1.00 0.00 C ATOM 1912 CD GLN A 110 1.105 -11.009 -8.032 1.00 0.00 C ATOM 1913 OE1 GLN A 110 1.545 -10.813 -6.916 1.00 0.00 O ATOM 1914 NE2 GLN A 110 0.211 -11.950 -8.220 1.00 0.00 N ATOM 0 H GLN A 110 1.486 -6.031 -8.847 1.00 0.00 H new ATOM 0 HA GLN A 110 2.643 -8.133 -10.696 1.00 0.00 H new ATOM 0 HB2 GLN A 110 2.795 -8.688 -8.199 1.00 0.00 H new ATOM 0 HB3 GLN A 110 1.070 -8.411 -8.065 1.00 0.00 H new ATOM 0 HG2 GLN A 110 0.840 -10.167 -10.009 1.00 0.00 H new ATOM 0 HG3 GLN A 110 2.498 -10.596 -9.637 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -0.162 -12.120 -9.154 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -0.111 -12.512 -7.432 1.00 0.00 H new ATOM 1923 N LYS A 111 0.331 -8.589 -11.664 1.00 0.00 N ATOM 1924 CA LYS A 111 -0.982 -8.574 -12.375 1.00 0.00 C ATOM 1925 C LYS A 111 -1.709 -9.914 -12.179 1.00 0.00 C ATOM 1926 O LYS A 111 -2.828 -9.947 -11.701 1.00 0.00 O ATOM 1927 CB LYS A 111 -0.635 -8.359 -13.848 1.00 0.00 C ATOM 1928 CG LYS A 111 -1.854 -7.799 -14.589 1.00 0.00 C ATOM 1929 CD LYS A 111 -1.729 -6.277 -14.706 1.00 0.00 C ATOM 1930 CE LYS A 111 -1.861 -5.645 -13.318 1.00 0.00 C ATOM 1931 NZ LYS A 111 -2.049 -4.189 -13.575 1.00 0.00 N ATOM 0 H LYS A 111 1.005 -9.272 -12.010 1.00 0.00 H new ATOM 0 HA LYS A 111 -1.646 -7.797 -11.997 1.00 0.00 H new ATOM 0 HB2 LYS A 111 0.205 -7.670 -13.937 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -0.324 -9.301 -14.300 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -1.926 -8.245 -15.581 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -2.768 -8.059 -14.055 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -0.768 -6.013 -15.147 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -2.502 -5.888 -15.369 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -2.708 -6.062 -12.773 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -0.972 -5.828 -12.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -2.147 -3.687 -12.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -1.225 -3.818 -14.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -2.906 -4.045 -14.146 1.00 0.00 H new ATOM 1945 N ASN A 112 -1.088 -11.018 -12.542 1.00 0.00 N ATOM 1946 CA ASN A 112 -1.756 -12.344 -12.368 1.00 0.00 C ATOM 1947 C ASN A 112 -0.716 -13.427 -12.037 1.00 0.00 C ATOM 1948 O ASN A 112 0.365 -13.440 -12.594 1.00 0.00 O ATOM 1949 CB ASN A 112 -2.418 -12.632 -13.716 1.00 0.00 C ATOM 1950 CG ASN A 112 -3.572 -11.646 -13.942 1.00 0.00 C ATOM 1951 OD1 ASN A 112 -4.349 -11.394 -13.042 1.00 0.00 O ATOM 1952 ND2 ASN A 112 -3.723 -11.073 -15.111 1.00 0.00 N ATOM 0 H ASN A 112 -0.153 -11.053 -12.948 1.00 0.00 H new ATOM 0 HA ASN A 112 -2.477 -12.338 -11.551 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -1.686 -12.542 -14.519 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -2.791 -13.656 -13.738 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -4.490 -10.418 -15.263 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -3.073 -11.282 -15.869 1.00 0.00 H new ATOM 1959 N GLU A 113 -1.027 -14.338 -11.132 1.00 0.00 N ATOM 1960 CA GLU A 113 -0.049 -15.419 -10.768 1.00 0.00 C ATOM 1961 C GLU A 113 1.315 -14.813 -10.390 1.00 0.00 C ATOM 1962 O GLU A 113 1.454 -13.607 -10.301 1.00 0.00 O ATOM 1963 CB GLU A 113 0.075 -16.291 -12.023 1.00 0.00 C ATOM 1964 CG GLU A 113 -0.906 -17.460 -11.931 1.00 0.00 C ATOM 1965 CD GLU A 113 -0.301 -18.691 -12.610 1.00 0.00 C ATOM 1966 OE1 GLU A 113 0.000 -18.604 -13.789 1.00 0.00 O ATOM 1967 OE2 GLU A 113 -0.151 -19.698 -11.939 1.00 0.00 O ATOM 0 H GLU A 113 -1.916 -14.376 -10.633 1.00 0.00 H new ATOM 0 HA GLU A 113 -0.383 -15.995 -9.905 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -0.133 -15.697 -12.913 1.00 0.00 H new ATOM 0 HB3 GLU A 113 1.094 -16.665 -12.120 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -1.128 -17.680 -10.887 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -1.849 -17.195 -12.409 1.00 0.00 H new ATOM 1974 N THR A 114 2.323 -15.634 -10.169 1.00 0.00 N ATOM 1975 CA THR A 114 3.667 -15.083 -9.802 1.00 0.00 C ATOM 1976 C THR A 114 4.635 -15.219 -10.988 1.00 0.00 C ATOM 1977 O THR A 114 5.482 -16.093 -11.005 1.00 0.00 O ATOM 1978 CB THR A 114 4.147 -15.926 -8.615 1.00 0.00 C ATOM 1979 OG1 THR A 114 3.106 -16.018 -7.651 1.00 0.00 O ATOM 1980 CG2 THR A 114 5.374 -15.266 -7.982 1.00 0.00 C ATOM 0 H THR A 114 2.270 -16.651 -10.227 1.00 0.00 H new ATOM 0 HA THR A 114 3.619 -14.024 -9.547 1.00 0.00 H new ATOM 0 HB THR A 114 4.412 -16.925 -8.961 1.00 0.00 H new ATOM 0 HG1 THR A 114 3.410 -16.558 -6.892 1.00 0.00 H new ATOM 0 HG21 THR A 114 5.715 -15.866 -7.138 1.00 0.00 H new ATOM 0 HG22 THR A 114 6.171 -15.195 -8.722 1.00 0.00 H new ATOM 0 HG23 THR A 114 5.111 -14.267 -7.634 1.00 0.00 H new ATOM 1988 N ASN A 115 4.518 -14.362 -11.984 1.00 0.00 N ATOM 1989 CA ASN A 115 5.433 -14.450 -13.161 1.00 0.00 C ATOM 1990 C ASN A 115 5.839 -13.041 -13.620 1.00 0.00 C ATOM 1991 O ASN A 115 5.443 -12.056 -13.025 1.00 0.00 O ATOM 1992 CB ASN A 115 4.615 -15.153 -14.245 1.00 0.00 C ATOM 1993 CG ASN A 115 5.544 -16.012 -15.113 1.00 0.00 C ATOM 1994 OD1 ASN A 115 6.469 -16.616 -14.609 1.00 0.00 O ATOM 1995 ND2 ASN A 115 5.340 -16.095 -16.405 1.00 0.00 N ATOM 0 H ASN A 115 3.829 -13.611 -12.026 1.00 0.00 H new ATOM 0 HA ASN A 115 6.353 -14.988 -12.932 1.00 0.00 H new ATOM 0 HB2 ASN A 115 3.847 -15.777 -13.788 1.00 0.00 H new ATOM 0 HB3 ASN A 115 4.101 -14.416 -14.863 1.00 0.00 H new ATOM 0 HD21 ASN A 115 5.957 -16.665 -16.983 1.00 0.00 H new ATOM 0 HD22 ASN A 115 4.564 -15.589 -16.832 1.00 0.00 H new ATOM 2002 N ASN A 116 6.627 -12.931 -14.672 1.00 0.00 N ATOM 2003 CA ASN A 116 7.047 -11.581 -15.155 1.00 0.00 C ATOM 2004 C ASN A 116 6.625 -11.386 -16.620 1.00 0.00 C ATOM 2005 O ASN A 116 7.392 -11.651 -17.527 1.00 0.00 O ATOM 2006 CB ASN A 116 8.572 -11.573 -15.030 1.00 0.00 C ATOM 2007 CG ASN A 116 8.965 -11.647 -13.549 1.00 0.00 C ATOM 2008 OD1 ASN A 116 9.680 -12.545 -13.147 1.00 0.00 O ATOM 2009 ND2 ASN A 116 8.531 -10.738 -12.709 1.00 0.00 N ATOM 0 H ASN A 116 6.992 -13.717 -15.210 1.00 0.00 H new ATOM 0 HA ASN A 116 6.587 -10.776 -14.583 1.00 0.00 H new ATOM 0 HB2 ASN A 116 8.996 -12.418 -15.572 1.00 0.00 H new ATOM 0 HB3 ASN A 116 8.980 -10.668 -15.480 1.00 0.00 H new ATOM 0 HD21 ASN A 116 8.793 -10.787 -11.725 1.00 0.00 H new ATOM 0 HD22 ASN A 116 7.931 -9.982 -13.040 1.00 0.00 H new ATOM 2016 N GLY A 117 5.414 -10.925 -16.862 1.00 0.00 N ATOM 2017 CA GLY A 117 4.959 -10.718 -18.268 1.00 0.00 C ATOM 2018 C GLY A 117 4.200 -9.387 -18.375 1.00 0.00 C ATOM 2019 O GLY A 117 4.713 -8.422 -18.910 1.00 0.00 O ATOM 0 H GLY A 117 4.729 -10.686 -16.145 1.00 0.00 H new ATOM 0 HA2 GLY A 117 5.816 -10.714 -18.941 1.00 0.00 H new ATOM 0 HA3 GLY A 117 4.315 -11.541 -18.577 1.00 0.00 H new ATOM 2023 N SER A 118 2.983 -9.322 -17.872 1.00 0.00 N ATOM 2024 CA SER A 118 2.206 -8.047 -17.953 1.00 0.00 C ATOM 2025 C SER A 118 1.952 -7.490 -16.544 1.00 0.00 C ATOM 2026 O SER A 118 1.439 -8.184 -15.687 1.00 0.00 O ATOM 2027 CB SER A 118 0.888 -8.425 -18.627 1.00 0.00 C ATOM 2028 OG SER A 118 1.144 -9.355 -19.671 1.00 0.00 O ATOM 0 H SER A 118 2.501 -10.095 -17.413 1.00 0.00 H new ATOM 0 HA SER A 118 2.738 -7.275 -18.508 1.00 0.00 H new ATOM 0 HB2 SER A 118 0.205 -8.859 -17.897 1.00 0.00 H new ATOM 0 HB3 SER A 118 0.403 -7.535 -19.028 1.00 0.00 H new ATOM 0 HG SER A 118 0.300 -9.601 -20.104 1.00 0.00 H new ATOM 2034 N THR A 119 2.306 -6.244 -16.293 1.00 0.00 N ATOM 2035 CA THR A 119 2.080 -5.656 -14.932 1.00 0.00 C ATOM 2036 C THR A 119 2.061 -4.120 -15.004 1.00 0.00 C ATOM 2037 O THR A 119 2.262 -3.549 -16.059 1.00 0.00 O ATOM 2038 CB THR A 119 3.272 -6.130 -14.098 1.00 0.00 C ATOM 2039 OG1 THR A 119 3.719 -7.388 -14.585 1.00 0.00 O ATOM 2040 CG2 THR A 119 2.857 -6.270 -12.631 1.00 0.00 C ATOM 0 H THR A 119 2.739 -5.615 -16.970 1.00 0.00 H new ATOM 0 HA THR A 119 1.125 -5.965 -14.506 1.00 0.00 H new ATOM 0 HB THR A 119 4.078 -5.400 -14.175 1.00 0.00 H new ATOM 0 HG1 THR A 119 4.483 -7.692 -14.052 1.00 0.00 H new ATOM 0 HG21 THR A 119 3.710 -6.608 -12.042 1.00 0.00 H new ATOM 0 HG22 THR A 119 2.516 -5.305 -12.256 1.00 0.00 H new ATOM 0 HG23 THR A 119 2.049 -6.997 -12.549 1.00 0.00 H new ATOM 2048 N CYS A 120 1.830 -3.442 -13.893 1.00 0.00 N ATOM 2049 CA CYS A 120 1.818 -1.935 -13.936 1.00 0.00 C ATOM 2050 C CYS A 120 3.182 -1.425 -14.431 1.00 0.00 C ATOM 2051 O CYS A 120 4.180 -2.110 -14.309 1.00 0.00 O ATOM 2052 CB CYS A 120 1.550 -1.445 -12.505 1.00 0.00 C ATOM 2053 SG CYS A 120 1.254 0.332 -12.538 1.00 0.00 S ATOM 0 H CYS A 120 1.653 -3.857 -12.978 1.00 0.00 H new ATOM 0 HA CYS A 120 1.051 -1.563 -14.616 1.00 0.00 H new ATOM 0 HB2 CYS A 120 0.687 -1.962 -12.085 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.401 -1.673 -11.864 1.00 0.00 H new ATOM 2058 N ILE A 121 3.236 -0.242 -15.007 1.00 0.00 N ATOM 2059 CA ILE A 121 4.553 0.277 -15.523 1.00 0.00 C ATOM 2060 C ILE A 121 5.451 0.792 -14.376 1.00 0.00 C ATOM 2061 O ILE A 121 6.662 0.741 -14.484 1.00 0.00 O ATOM 2062 CB ILE A 121 4.197 1.399 -16.530 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.448 1.809 -17.341 1.00 0.00 C ATOM 2064 CG2 ILE A 121 3.585 2.614 -15.811 1.00 0.00 C ATOM 2065 CD1 ILE A 121 6.455 2.600 -16.489 1.00 0.00 C ATOM 0 H ILE A 121 2.439 0.380 -15.142 1.00 0.00 H new ATOM 0 HA ILE A 121 5.131 -0.512 -16.004 1.00 0.00 H new ATOM 0 HB ILE A 121 3.448 1.013 -17.222 1.00 0.00 H new ATOM 0 HG12 ILE A 121 5.931 0.916 -17.737 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.144 2.413 -18.196 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.345 3.386 -16.542 1.00 0.00 H new ATOM 0 HG22 ILE A 121 2.676 2.310 -15.292 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.300 3.008 -15.089 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.318 2.867 -17.100 1.00 0.00 H new ATOM 0 HD12 ILE A 121 5.981 3.507 -16.114 1.00 0.00 H new ATOM 0 HD13 ILE A 121 6.781 1.987 -15.649 1.00 0.00 H new ATOM 2077 N CYS A 122 4.891 1.298 -13.290 1.00 0.00 N ATOM 2078 CA CYS A 122 5.777 1.820 -12.184 1.00 0.00 C ATOM 2079 C CYS A 122 6.711 0.711 -11.659 1.00 0.00 C ATOM 2080 O CYS A 122 7.852 0.975 -11.328 1.00 0.00 O ATOM 2081 CB CYS A 122 4.850 2.395 -11.081 1.00 0.00 C ATOM 2082 SG CYS A 122 4.077 1.085 -10.078 1.00 0.00 S ATOM 0 H CYS A 122 3.887 1.371 -13.124 1.00 0.00 H new ATOM 0 HA CYS A 122 6.435 2.610 -12.547 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.426 3.054 -10.432 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.072 3.003 -11.543 1.00 0.00 H new ATOM 2087 N ARG A 123 6.257 -0.526 -11.599 1.00 0.00 N ATOM 2088 CA ARG A 123 7.169 -1.627 -11.113 1.00 0.00 C ATOM 2089 C ARG A 123 8.443 -1.686 -11.982 1.00 0.00 C ATOM 2090 O ARG A 123 9.499 -2.061 -11.506 1.00 0.00 O ATOM 2091 CB ARG A 123 6.390 -2.943 -11.246 1.00 0.00 C ATOM 2092 CG ARG A 123 6.945 -3.968 -10.256 1.00 0.00 C ATOM 2093 CD ARG A 123 8.061 -4.780 -10.932 1.00 0.00 C ATOM 2094 NE ARG A 123 9.086 -5.069 -9.865 1.00 0.00 N ATOM 2095 CZ ARG A 123 10.357 -5.290 -10.175 1.00 0.00 C ATOM 2096 NH1 ARG A 123 10.769 -5.306 -11.423 1.00 0.00 N ATOM 2097 NH2 ARG A 123 11.223 -5.516 -9.221 1.00 0.00 N ATOM 0 H ARG A 123 5.315 -0.819 -11.859 1.00 0.00 H new ATOM 0 HA ARG A 123 7.473 -1.450 -10.081 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.331 -2.772 -11.053 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.471 -3.324 -12.264 1.00 0.00 H new ATOM 0 HG2 ARG A 123 7.333 -3.462 -9.372 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.149 -4.633 -9.920 1.00 0.00 H new ATOM 0 HD2 ARG A 123 7.667 -5.705 -11.353 1.00 0.00 H new ATOM 0 HD3 ARG A 123 8.505 -4.219 -11.755 1.00 0.00 H new ATOM 0 HE ARG A 123 8.797 -5.095 -8.887 1.00 0.00 H new ATOM 0 HH11 ARG A 123 10.106 -5.146 -12.181 1.00 0.00 H new ATOM 0 HH12 ARG A 123 11.752 -5.478 -11.633 1.00 0.00 H new ATOM 0 HH21 ARG A 123 10.919 -5.521 -8.247 1.00 0.00 H new ATOM 0 HH22 ARG A 123 12.202 -5.687 -9.451 1.00 0.00 H new ATOM 2111 N VAL A 124 8.359 -1.323 -13.252 1.00 0.00 N ATOM 2112 CA VAL A 124 9.582 -1.369 -14.128 1.00 0.00 C ATOM 2113 C VAL A 124 10.417 -0.084 -13.946 1.00 0.00 C ATOM 2114 O VAL A 124 9.915 1.001 -14.160 1.00 0.00 O ATOM 2115 CB VAL A 124 9.064 -1.464 -15.575 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.245 -1.541 -16.543 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.202 -2.721 -15.725 1.00 0.00 C ATOM 0 H VAL A 124 7.507 -1.002 -13.711 1.00 0.00 H new ATOM 0 HA VAL A 124 10.223 -2.214 -13.875 1.00 0.00 H new ATOM 0 HB VAL A 124 8.468 -0.580 -15.803 1.00 0.00 H new ATOM 0 HG11 VAL A 124 9.874 -1.608 -17.566 1.00 0.00 H new ATOM 0 HG12 VAL A 124 10.860 -0.647 -16.438 1.00 0.00 H new ATOM 0 HG13 VAL A 124 10.844 -2.423 -16.316 1.00 0.00 H new ATOM 0 HG21 VAL A 124 7.834 -2.790 -16.749 1.00 0.00 H new ATOM 0 HG22 VAL A 124 8.800 -3.602 -15.494 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.357 -2.667 -15.039 1.00 0.00 H new ATOM 2127 N PRO A 125 11.672 -0.237 -13.565 1.00 0.00 N ATOM 2128 CA PRO A 125 12.555 0.948 -13.377 1.00 0.00 C ATOM 2129 C PRO A 125 12.814 1.659 -14.717 1.00 0.00 C ATOM 2130 O PRO A 125 12.338 1.232 -15.752 1.00 0.00 O ATOM 2131 CB PRO A 125 13.848 0.353 -12.818 1.00 0.00 C ATOM 2132 CG PRO A 125 13.834 -1.068 -13.272 1.00 0.00 C ATOM 2133 CD PRO A 125 12.391 -1.490 -13.276 1.00 0.00 C ATOM 0 HA PRO A 125 12.117 1.700 -12.720 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.723 0.881 -13.196 1.00 0.00 H new ATOM 0 HB3 PRO A 125 13.879 0.422 -11.731 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.271 -1.164 -14.266 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.422 -1.697 -12.603 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.196 -2.249 -14.033 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.093 -1.913 -12.317 1.00 0.00 H new ATOM 2141 N ARG A 126 13.570 2.741 -14.706 1.00 0.00 N ATOM 2142 CA ARG A 126 13.852 3.471 -15.996 1.00 0.00 C ATOM 2143 C ARG A 126 14.881 2.699 -16.838 1.00 0.00 C ATOM 2144 O ARG A 126 14.780 2.658 -18.050 1.00 0.00 O ATOM 2145 CB ARG A 126 14.413 4.852 -15.615 1.00 0.00 C ATOM 2146 CG ARG A 126 13.262 5.848 -15.470 1.00 0.00 C ATOM 2147 CD ARG A 126 13.039 6.568 -16.803 1.00 0.00 C ATOM 2148 NE ARG A 126 12.757 7.988 -16.433 1.00 0.00 N ATOM 2149 CZ ARG A 126 13.727 8.806 -16.054 1.00 0.00 C ATOM 2150 NH1 ARG A 126 14.975 8.404 -15.991 1.00 0.00 N ATOM 2151 NH2 ARG A 126 13.443 10.043 -15.737 1.00 0.00 N ATOM 0 H ARG A 126 13.998 3.146 -13.873 1.00 0.00 H new ATOM 0 HA ARG A 126 12.944 3.566 -16.591 1.00 0.00 H new ATOM 0 HB2 ARG A 126 14.970 4.785 -14.680 1.00 0.00 H new ATOM 0 HB3 ARG A 126 15.111 5.196 -16.378 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.353 5.328 -15.169 1.00 0.00 H new ATOM 0 HG3 ARG A 126 13.490 6.572 -14.687 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.918 6.494 -17.443 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.206 6.131 -17.353 1.00 0.00 H new ATOM 0 HE ARG A 126 11.798 8.334 -16.473 1.00 0.00 H new ATOM 0 HH11 ARG A 126 15.214 7.443 -16.237 1.00 0.00 H new ATOM 0 HH12 ARG A 126 15.705 9.052 -15.696 1.00 0.00 H new ATOM 0 HH21 ARG A 126 12.479 10.373 -15.782 1.00 0.00 H new ATOM 0 HH22 ARG A 126 14.186 10.678 -15.444 1.00 0.00 H new ATOM 2165 N ALA A 127 15.876 2.091 -16.216 1.00 0.00 N ATOM 2166 CA ALA A 127 16.905 1.331 -17.021 1.00 0.00 C ATOM 2167 C ALA A 127 16.218 0.250 -17.867 1.00 0.00 C ATOM 2168 O ALA A 127 16.565 0.049 -19.016 1.00 0.00 O ATOM 2169 CB ALA A 127 17.869 0.683 -16.015 1.00 0.00 C ATOM 0 H ALA A 127 16.020 2.087 -15.206 1.00 0.00 H new ATOM 0 HA ALA A 127 17.439 1.996 -17.700 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.633 0.121 -16.553 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.345 1.459 -15.415 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.315 0.009 -15.362 1.00 0.00 H new ATOM 2175 N GLN A 128 15.235 -0.437 -17.320 1.00 0.00 N ATOM 2176 CA GLN A 128 14.530 -1.490 -18.132 1.00 0.00 C ATOM 2177 C GLN A 128 13.687 -0.807 -19.217 1.00 0.00 C ATOM 2178 O GLN A 128 13.665 -1.246 -20.352 1.00 0.00 O ATOM 2179 CB GLN A 128 13.628 -2.271 -17.162 1.00 0.00 C ATOM 2180 CG GLN A 128 13.527 -3.728 -17.620 1.00 0.00 C ATOM 2181 CD GLN A 128 13.413 -4.643 -16.395 1.00 0.00 C ATOM 2182 OE1 GLN A 128 13.931 -4.327 -15.342 1.00 0.00 O ATOM 2183 NE2 GLN A 128 12.755 -5.774 -16.482 1.00 0.00 N ATOM 0 H GLN A 128 14.896 -0.318 -16.365 1.00 0.00 H new ATOM 0 HA GLN A 128 15.235 -2.162 -18.621 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.035 -2.224 -16.152 1.00 0.00 H new ATOM 0 HB3 GLN A 128 12.636 -1.820 -17.128 1.00 0.00 H new ATOM 0 HG2 GLN A 128 12.659 -3.858 -18.266 1.00 0.00 H new ATOM 0 HG3 GLN A 128 14.405 -3.997 -18.208 1.00 0.00 H new ATOM 0 HE21 GLN A 128 12.319 -6.044 -17.364 1.00 0.00 H new ATOM 0 HE22 GLN A 128 12.680 -6.384 -15.668 1.00 0.00 H new ATOM 2192 N LEU A 129 13.009 0.275 -18.888 1.00 0.00 N ATOM 2193 CA LEU A 129 12.190 0.983 -19.933 1.00 0.00 C ATOM 2194 C LEU A 129 13.125 1.575 -21.000 1.00 0.00 C ATOM 2195 O LEU A 129 12.817 1.549 -22.177 1.00 0.00 O ATOM 2196 CB LEU A 129 11.423 2.105 -19.217 1.00 0.00 C ATOM 2197 CG LEU A 129 10.124 1.546 -18.638 1.00 0.00 C ATOM 2198 CD1 LEU A 129 9.760 2.314 -17.366 1.00 0.00 C ATOM 2199 CD2 LEU A 129 8.999 1.702 -19.665 1.00 0.00 C ATOM 0 H LEU A 129 12.987 0.692 -17.957 1.00 0.00 H new ATOM 0 HA LEU A 129 11.499 0.300 -20.427 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.036 2.528 -18.421 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.204 2.913 -19.915 1.00 0.00 H new ATOM 0 HG LEU A 129 10.257 0.491 -18.401 1.00 0.00 H new ATOM 0 HD11 LEU A 129 8.833 1.915 -16.953 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.560 2.205 -16.634 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.627 3.369 -17.604 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.072 1.303 -19.253 1.00 0.00 H new ATOM 0 HD22 LEU A 129 8.866 2.758 -19.902 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.257 1.156 -20.573 1.00 0.00 H new ATOM 2211 N GLU A 130 14.270 2.105 -20.605 1.00 0.00 N ATOM 2212 CA GLU A 130 15.213 2.688 -21.627 1.00 0.00 C ATOM 2213 C GLU A 130 15.635 1.602 -22.632 1.00 0.00 C ATOM 2214 O GLU A 130 15.767 1.870 -23.812 1.00 0.00 O ATOM 2215 CB GLU A 130 16.442 3.201 -20.859 1.00 0.00 C ATOM 2216 CG GLU A 130 16.201 4.647 -20.420 1.00 0.00 C ATOM 2217 CD GLU A 130 17.530 5.405 -20.414 1.00 0.00 C ATOM 2218 OE1 GLU A 130 18.530 4.806 -20.053 1.00 0.00 O ATOM 2219 OE2 GLU A 130 17.525 6.572 -20.769 1.00 0.00 O ATOM 0 H GLU A 130 14.587 2.158 -19.637 1.00 0.00 H new ATOM 0 HA GLU A 130 14.736 3.495 -22.184 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.629 2.572 -19.989 1.00 0.00 H new ATOM 0 HB3 GLU A 130 17.329 3.144 -21.490 1.00 0.00 H new ATOM 0 HG2 GLU A 130 15.497 5.131 -21.096 1.00 0.00 H new ATOM 0 HG3 GLU A 130 15.754 4.667 -19.426 1.00 0.00 H new ATOM 2226 N GLU A 131 15.848 0.378 -22.183 1.00 0.00 N ATOM 2227 CA GLU A 131 16.263 -0.706 -23.147 1.00 0.00 C ATOM 2228 C GLU A 131 15.207 -0.874 -24.250 1.00 0.00 C ATOM 2229 O GLU A 131 15.542 -1.103 -25.398 1.00 0.00 O ATOM 2230 CB GLU A 131 16.386 -2.005 -22.332 1.00 0.00 C ATOM 2231 CG GLU A 131 17.088 -3.071 -23.175 1.00 0.00 C ATOM 2232 CD GLU A 131 16.622 -4.460 -22.732 1.00 0.00 C ATOM 2233 OE1 GLU A 131 15.426 -4.640 -22.575 1.00 0.00 O ATOM 2234 OE2 GLU A 131 17.470 -5.318 -22.556 1.00 0.00 O ATOM 0 H GLU A 131 15.755 0.087 -21.210 1.00 0.00 H new ATOM 0 HA GLU A 131 17.207 -0.454 -23.629 1.00 0.00 H new ATOM 0 HB2 GLU A 131 16.949 -1.821 -21.417 1.00 0.00 H new ATOM 0 HB3 GLU A 131 15.398 -2.355 -22.034 1.00 0.00 H new ATOM 0 HG2 GLU A 131 16.864 -2.920 -24.231 1.00 0.00 H new ATOM 0 HG3 GLU A 131 18.169 -2.985 -23.063 1.00 0.00 H new ATOM 2241 N GLU A 132 13.936 -0.759 -23.921 1.00 0.00 N ATOM 2242 CA GLU A 132 12.877 -0.914 -24.984 1.00 0.00 C ATOM 2243 C GLU A 132 13.018 0.205 -26.026 1.00 0.00 C ATOM 2244 O GLU A 132 12.975 -0.047 -27.216 1.00 0.00 O ATOM 2245 CB GLU A 132 11.513 -0.821 -24.287 1.00 0.00 C ATOM 2246 CG GLU A 132 10.537 -1.803 -24.937 1.00 0.00 C ATOM 2247 CD GLU A 132 9.467 -2.208 -23.920 1.00 0.00 C ATOM 2248 OE1 GLU A 132 8.976 -1.334 -23.227 1.00 0.00 O ATOM 2249 OE2 GLU A 132 9.158 -3.387 -23.853 1.00 0.00 O ATOM 0 H GLU A 132 13.589 -0.568 -22.981 1.00 0.00 H new ATOM 0 HA GLU A 132 12.979 -1.870 -25.498 1.00 0.00 H new ATOM 0 HB2 GLU A 132 11.619 -1.047 -23.226 1.00 0.00 H new ATOM 0 HB3 GLU A 132 11.125 0.195 -24.359 1.00 0.00 H new ATOM 0 HG2 GLU A 132 10.070 -1.345 -25.809 1.00 0.00 H new ATOM 0 HG3 GLU A 132 11.072 -2.685 -25.289 1.00 0.00 H new ATOM 2256 N ALA A 133 13.192 1.441 -25.595 1.00 0.00 N ATOM 2257 CA ALA A 133 13.338 2.560 -26.595 1.00 0.00 C ATOM 2258 C ALA A 133 14.582 2.322 -27.463 1.00 0.00 C ATOM 2259 O ALA A 133 14.552 2.536 -28.660 1.00 0.00 O ATOM 2260 CB ALA A 133 13.492 3.860 -25.789 1.00 0.00 C ATOM 0 H ALA A 133 13.239 1.719 -24.615 1.00 0.00 H new ATOM 0 HA ALA A 133 12.473 2.615 -27.256 1.00 0.00 H new ATOM 0 HB1 ALA A 133 13.601 4.701 -26.473 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.609 4.010 -25.168 1.00 0.00 H new ATOM 0 HB3 ALA A 133 14.375 3.792 -25.154 1.00 0.00 H new ATOM 2266 N ARG A 134 15.675 1.875 -26.875 1.00 0.00 N ATOM 2267 CA ARG A 134 16.912 1.623 -27.702 1.00 0.00 C ATOM 2268 C ARG A 134 16.618 0.572 -28.788 1.00 0.00 C ATOM 2269 O ARG A 134 17.130 0.660 -29.888 1.00 0.00 O ATOM 2270 CB ARG A 134 17.991 1.098 -26.740 1.00 0.00 C ATOM 2271 CG ARG A 134 18.481 2.243 -25.849 1.00 0.00 C ATOM 2272 CD ARG A 134 19.958 2.029 -25.508 1.00 0.00 C ATOM 2273 NE ARG A 134 20.364 3.262 -24.768 1.00 0.00 N ATOM 2274 CZ ARG A 134 20.540 4.416 -25.395 1.00 0.00 C ATOM 2275 NH1 ARG A 134 20.364 4.523 -26.693 1.00 0.00 N ATOM 2276 NH2 ARG A 134 20.897 5.473 -24.714 1.00 0.00 N ATOM 0 H ARG A 134 15.766 1.677 -25.879 1.00 0.00 H new ATOM 0 HA ARG A 134 17.241 2.535 -28.200 1.00 0.00 H new ATOM 0 HB2 ARG A 134 17.586 0.293 -26.126 1.00 0.00 H new ATOM 0 HB3 ARG A 134 18.824 0.680 -27.304 1.00 0.00 H new ATOM 0 HG2 ARG A 134 18.349 3.197 -26.359 1.00 0.00 H new ATOM 0 HG3 ARG A 134 17.888 2.286 -24.935 1.00 0.00 H new ATOM 0 HD2 ARG A 134 20.097 1.137 -24.897 1.00 0.00 H new ATOM 0 HD3 ARG A 134 20.556 1.894 -26.409 1.00 0.00 H new ATOM 0 HE ARG A 134 20.509 3.214 -23.759 1.00 0.00 H new ATOM 0 HH11 ARG A 134 20.086 3.707 -27.239 1.00 0.00 H new ATOM 0 HH12 ARG A 134 20.505 5.422 -27.154 1.00 0.00 H new ATOM 0 HH21 ARG A 134 21.038 5.406 -23.706 1.00 0.00 H new ATOM 0 HH22 ARG A 134 21.034 6.364 -25.191 1.00 0.00 H new ATOM 2290 N LYS A 135 15.800 -0.423 -28.495 1.00 0.00 N ATOM 2291 CA LYS A 135 15.492 -1.467 -29.539 1.00 0.00 C ATOM 2292 C LYS A 135 14.613 -0.881 -30.658 1.00 0.00 C ATOM 2293 O LYS A 135 14.731 -1.280 -31.802 1.00 0.00 O ATOM 2294 CB LYS A 135 14.744 -2.602 -28.820 1.00 0.00 C ATOM 2295 CG LYS A 135 15.722 -3.380 -27.938 1.00 0.00 C ATOM 2296 CD LYS A 135 15.312 -4.854 -27.897 1.00 0.00 C ATOM 2297 CE LYS A 135 16.437 -5.680 -27.270 1.00 0.00 C ATOM 2298 NZ LYS A 135 17.386 -5.946 -28.386 1.00 0.00 N ATOM 0 H LYS A 135 15.340 -0.556 -27.595 1.00 0.00 H new ATOM 0 HA LYS A 135 16.410 -1.827 -30.004 1.00 0.00 H new ATOM 0 HB2 LYS A 135 13.937 -2.192 -28.213 1.00 0.00 H new ATOM 0 HB3 LYS A 135 14.286 -3.270 -29.550 1.00 0.00 H new ATOM 0 HG2 LYS A 135 16.735 -3.284 -28.328 1.00 0.00 H new ATOM 0 HG3 LYS A 135 15.728 -2.965 -26.930 1.00 0.00 H new ATOM 0 HD2 LYS A 135 14.395 -4.971 -27.319 1.00 0.00 H new ATOM 0 HD3 LYS A 135 15.102 -5.212 -28.905 1.00 0.00 H new ATOM 0 HE2 LYS A 135 16.922 -5.135 -26.460 1.00 0.00 H new ATOM 0 HE3 LYS A 135 16.056 -6.609 -26.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 17.387 -6.962 -28.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 17.092 -5.410 -29.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 18.343 -5.651 -28.105 1.00 0.00 H new ATOM 2312 N LYS A 136 13.733 0.057 -30.352 1.00 0.00 N ATOM 2313 CA LYS A 136 12.864 0.639 -31.434 1.00 0.00 C ATOM 2314 C LYS A 136 13.390 2.009 -31.914 1.00 0.00 C ATOM 2315 O LYS A 136 12.642 2.789 -32.474 1.00 0.00 O ATOM 2316 CB LYS A 136 11.474 0.796 -30.806 1.00 0.00 C ATOM 2317 CG LYS A 136 10.402 0.534 -31.866 1.00 0.00 C ATOM 2318 CD LYS A 136 9.186 1.423 -31.593 1.00 0.00 C ATOM 2319 CE LYS A 136 8.533 1.007 -30.273 1.00 0.00 C ATOM 2320 NZ LYS A 136 7.763 -0.226 -30.596 1.00 0.00 N ATOM 0 H LYS A 136 13.583 0.437 -29.417 1.00 0.00 H new ATOM 0 HA LYS A 136 12.852 -0.008 -32.311 1.00 0.00 H new ATOM 0 HB2 LYS A 136 11.358 0.099 -29.976 1.00 0.00 H new ATOM 0 HB3 LYS A 136 11.359 1.800 -30.398 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.800 0.739 -32.860 1.00 0.00 H new ATOM 0 HG3 LYS A 136 10.109 -0.516 -31.851 1.00 0.00 H new ATOM 0 HD2 LYS A 136 9.490 2.469 -31.546 1.00 0.00 H new ATOM 0 HD3 LYS A 136 8.468 1.336 -32.409 1.00 0.00 H new ATOM 0 HE2 LYS A 136 9.282 0.815 -29.505 1.00 0.00 H new ATOM 0 HE3 LYS A 136 7.880 1.792 -29.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 6.753 -0.064 -30.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 7.895 -0.465 -31.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 8.103 -1.012 -30.006 1.00 0.00 H new ATOM 2334 N GLY A 137 14.663 2.318 -31.719 1.00 0.00 N ATOM 2335 CA GLY A 137 15.204 3.635 -32.188 1.00 0.00 C ATOM 2336 C GLY A 137 14.336 4.796 -31.668 1.00 0.00 C ATOM 2337 O GLY A 137 13.997 5.696 -32.415 1.00 0.00 O ATOM 0 H GLY A 137 15.342 1.713 -31.257 1.00 0.00 H new ATOM 0 HA2 GLY A 137 16.230 3.757 -31.840 1.00 0.00 H new ATOM 0 HA3 GLY A 137 15.232 3.655 -33.277 1.00 0.00 H new ATOM 2341 N THR A 138 13.976 4.789 -30.402 1.00 0.00 N ATOM 2342 CA THR A 138 13.134 5.898 -29.859 1.00 0.00 C ATOM 2343 C THR A 138 13.563 6.234 -28.421 1.00 0.00 C ATOM 2344 O THR A 138 14.620 5.826 -27.977 1.00 0.00 O ATOM 2345 CB THR A 138 11.695 5.371 -29.893 1.00 0.00 C ATOM 2346 OG1 THR A 138 10.818 6.364 -29.381 1.00 0.00 O ATOM 2347 CG2 THR A 138 11.578 4.101 -29.045 1.00 0.00 C ATOM 0 H THR A 138 14.229 4.066 -29.729 1.00 0.00 H new ATOM 0 HA THR A 138 13.236 6.815 -30.440 1.00 0.00 H new ATOM 0 HB THR A 138 11.426 5.136 -30.923 1.00 0.00 H new ATOM 0 HG1 THR A 138 9.897 6.030 -29.403 1.00 0.00 H new ATOM 0 HG21 THR A 138 10.552 3.736 -29.077 1.00 0.00 H new ATOM 0 HG22 THR A 138 12.247 3.337 -29.440 1.00 0.00 H new ATOM 0 HG23 THR A 138 11.852 4.325 -28.014 1.00 0.00 H new ATOM 2355 N GLN A 139 12.755 6.974 -27.687 1.00 0.00 N ATOM 2356 CA GLN A 139 13.130 7.325 -26.286 1.00 0.00 C ATOM 2357 C GLN A 139 11.933 7.115 -25.345 1.00 0.00 C ATOM 2358 O GLN A 139 10.794 7.263 -25.746 1.00 0.00 O ATOM 2359 CB GLN A 139 13.518 8.803 -26.338 1.00 0.00 C ATOM 2360 CG GLN A 139 15.013 8.931 -26.634 1.00 0.00 C ATOM 2361 CD GLN A 139 15.579 10.153 -25.901 1.00 0.00 C ATOM 2362 OE1 GLN A 139 15.304 10.349 -24.733 1.00 0.00 O ATOM 2363 NE2 GLN A 139 16.362 10.992 -26.533 1.00 0.00 N ATOM 0 H GLN A 139 11.859 7.345 -28.002 1.00 0.00 H new ATOM 0 HA GLN A 139 13.942 6.703 -25.909 1.00 0.00 H new ATOM 0 HB2 GLN A 139 12.940 9.314 -27.107 1.00 0.00 H new ATOM 0 HB3 GLN A 139 13.282 9.285 -25.389 1.00 0.00 H new ATOM 0 HG2 GLN A 139 15.536 8.029 -26.316 1.00 0.00 H new ATOM 0 HG3 GLN A 139 15.174 9.031 -27.707 1.00 0.00 H new ATOM 0 HE21 GLN A 139 16.596 10.832 -27.513 1.00 0.00 H new ATOM 0 HE22 GLN A 139 16.738 11.805 -26.045 1.00 0.00 H new ATOM 2372 N VAL A 140 12.179 6.775 -24.096 1.00 0.00 N ATOM 2373 CA VAL A 140 11.050 6.564 -23.140 1.00 0.00 C ATOM 2374 C VAL A 140 11.313 7.339 -21.838 1.00 0.00 C ATOM 2375 O VAL A 140 12.436 7.716 -21.558 1.00 0.00 O ATOM 2376 CB VAL A 140 11.015 5.050 -22.880 1.00 0.00 C ATOM 2377 CG1 VAL A 140 12.355 4.583 -22.293 1.00 0.00 C ATOM 2378 CG2 VAL A 140 9.885 4.730 -21.896 1.00 0.00 C ATOM 0 H VAL A 140 13.110 6.636 -23.704 1.00 0.00 H new ATOM 0 HA VAL A 140 10.099 6.922 -23.536 1.00 0.00 H new ATOM 0 HB VAL A 140 10.841 4.530 -23.822 1.00 0.00 H new ATOM 0 HG11 VAL A 140 12.319 3.509 -22.113 1.00 0.00 H new ATOM 0 HG12 VAL A 140 13.158 4.806 -22.996 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.541 5.102 -21.353 1.00 0.00 H new ATOM 0 HG21 VAL A 140 9.858 3.656 -21.710 1.00 0.00 H new ATOM 0 HG22 VAL A 140 10.059 5.257 -20.958 1.00 0.00 H new ATOM 0 HG23 VAL A 140 8.933 5.049 -22.319 1.00 0.00 H new ATOM 2388 N SER A 141 10.292 7.583 -21.040 1.00 0.00 N ATOM 2389 CA SER A 141 10.512 8.337 -19.765 1.00 0.00 C ATOM 2390 C SER A 141 9.293 8.219 -18.831 1.00 0.00 C ATOM 2391 O SER A 141 8.306 8.910 -19.006 1.00 0.00 O ATOM 2392 CB SER A 141 10.711 9.781 -20.210 1.00 0.00 C ATOM 2393 OG SER A 141 10.769 10.624 -19.067 1.00 0.00 O ATOM 0 H SER A 141 9.330 7.295 -21.217 1.00 0.00 H new ATOM 0 HA SER A 141 11.361 7.951 -19.201 1.00 0.00 H new ATOM 0 HB2 SER A 141 11.630 9.871 -20.789 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.893 10.088 -20.861 1.00 0.00 H new ATOM 0 HG SER A 141 10.898 11.553 -19.352 1.00 0.00 H new ATOM 2399 N PHE A 142 9.355 7.352 -17.841 1.00 0.00 N ATOM 2400 CA PHE A 142 8.199 7.201 -16.903 1.00 0.00 C ATOM 2401 C PHE A 142 8.478 7.947 -15.583 1.00 0.00 C ATOM 2402 O PHE A 142 9.613 8.230 -15.248 1.00 0.00 O ATOM 2403 CB PHE A 142 8.069 5.687 -16.657 1.00 0.00 C ATOM 2404 CG PHE A 142 7.063 5.416 -15.555 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.689 5.412 -15.829 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.514 5.174 -14.255 1.00 0.00 C ATOM 2407 CE1 PHE A 142 4.774 5.162 -14.796 1.00 0.00 C ATOM 2408 CE2 PHE A 142 6.599 4.927 -13.232 1.00 0.00 C ATOM 2409 CZ PHE A 142 5.233 4.919 -13.498 1.00 0.00 C ATOM 0 H PHE A 142 10.153 6.748 -17.646 1.00 0.00 H new ATOM 0 HA PHE A 142 7.281 7.622 -17.314 1.00 0.00 H new ATOM 0 HB2 PHE A 142 7.756 5.188 -17.574 1.00 0.00 H new ATOM 0 HB3 PHE A 142 9.039 5.272 -16.383 1.00 0.00 H new ATOM 0 HD1 PHE A 142 5.336 5.601 -16.832 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.573 5.178 -14.042 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.714 5.157 -15.003 1.00 0.00 H new ATOM 0 HE2 PHE A 142 6.952 4.741 -12.228 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.528 4.725 -12.703 1.00 0.00 H new ATOM 2419 N HIS A 143 7.444 8.244 -14.828 1.00 0.00 N ATOM 2420 CA HIS A 143 7.629 8.944 -13.522 1.00 0.00 C ATOM 2421 C HIS A 143 6.695 8.308 -12.480 1.00 0.00 C ATOM 2422 O HIS A 143 7.139 7.765 -11.487 1.00 0.00 O ATOM 2423 CB HIS A 143 7.241 10.405 -13.789 1.00 0.00 C ATOM 2424 CG HIS A 143 8.318 11.320 -13.272 1.00 0.00 C ATOM 2425 ND1 HIS A 143 9.533 11.472 -13.922 1.00 0.00 N ATOM 2426 CD2 HIS A 143 8.376 12.139 -12.171 1.00 0.00 C ATOM 2427 CE1 HIS A 143 10.264 12.352 -13.214 1.00 0.00 C ATOM 2428 NE2 HIS A 143 9.606 12.789 -12.135 1.00 0.00 N ATOM 0 H HIS A 143 6.476 8.029 -15.065 1.00 0.00 H new ATOM 0 HA HIS A 143 8.647 8.872 -13.139 1.00 0.00 H new ATOM 0 HB2 HIS A 143 7.098 10.564 -14.858 1.00 0.00 H new ATOM 0 HB3 HIS A 143 6.292 10.634 -13.303 1.00 0.00 H new ATOM 0 HD2 HIS A 143 7.587 12.260 -11.444 1.00 0.00 H new ATOM 0 HE1 HIS A 143 11.261 12.667 -13.484 1.00 0.00 H new ATOM 0 HE2 HIS A 143 9.935 13.455 -11.436 1.00 0.00 H new ATOM 2436 N GLN A 144 5.402 8.358 -12.713 1.00 0.00 N ATOM 2437 CA GLN A 144 4.432 7.745 -11.757 1.00 0.00 C ATOM 2438 C GLN A 144 3.294 7.069 -12.545 1.00 0.00 C ATOM 2439 O GLN A 144 2.949 7.508 -13.626 1.00 0.00 O ATOM 2440 CB GLN A 144 3.891 8.916 -10.922 1.00 0.00 C ATOM 2441 CG GLN A 144 3.245 9.972 -11.836 1.00 0.00 C ATOM 2442 CD GLN A 144 4.092 11.253 -11.838 1.00 0.00 C ATOM 2443 OE1 GLN A 144 4.427 11.765 -12.888 1.00 0.00 O ATOM 2444 NE2 GLN A 144 4.452 11.803 -10.703 1.00 0.00 N ATOM 0 H GLN A 144 4.979 8.800 -13.529 1.00 0.00 H new ATOM 0 HA GLN A 144 4.890 6.984 -11.126 1.00 0.00 H new ATOM 0 HB2 GLN A 144 3.158 8.550 -10.203 1.00 0.00 H new ATOM 0 HB3 GLN A 144 4.701 9.368 -10.349 1.00 0.00 H new ATOM 0 HG2 GLN A 144 3.157 9.582 -12.850 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.235 10.194 -11.492 1.00 0.00 H new ATOM 0 HE21 GLN A 144 4.173 11.377 -9.819 1.00 0.00 H new ATOM 0 HE22 GLN A 144 5.011 12.656 -10.704 1.00 0.00 H new ATOM 2453 N CYS A 145 2.709 6.007 -12.025 1.00 0.00 N ATOM 2454 CA CYS A 145 1.597 5.334 -12.784 1.00 0.00 C ATOM 2455 C CYS A 145 0.230 5.911 -12.375 1.00 0.00 C ATOM 2456 O CYS A 145 0.088 6.485 -11.312 1.00 0.00 O ATOM 2457 CB CYS A 145 1.686 3.822 -12.489 1.00 0.00 C ATOM 2458 SG CYS A 145 1.321 3.450 -10.743 1.00 0.00 S ATOM 0 H CYS A 145 2.947 5.585 -11.127 1.00 0.00 H new ATOM 0 HA CYS A 145 1.699 5.510 -13.855 1.00 0.00 H new ATOM 0 HB2 CYS A 145 0.986 3.285 -13.129 1.00 0.00 H new ATOM 0 HB3 CYS A 145 2.685 3.462 -12.736 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.775 5.773 -13.219 1.00 0.00 N ATOM 2464 CA VAL A 146 -2.129 6.335 -12.870 1.00 0.00 C ATOM 2465 C VAL A 146 -2.889 5.431 -11.875 1.00 0.00 C ATOM 2466 O VAL A 146 -3.767 5.902 -11.179 1.00 0.00 O ATOM 2467 CB VAL A 146 -2.912 6.470 -14.193 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -3.187 5.086 -14.801 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -4.240 7.183 -13.921 1.00 0.00 C ATOM 0 H VAL A 146 -0.718 5.302 -14.122 1.00 0.00 H new ATOM 0 HA VAL A 146 -2.017 7.301 -12.377 1.00 0.00 H new ATOM 0 HB VAL A 146 -2.316 7.048 -14.900 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -3.740 5.201 -15.733 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -2.241 4.582 -15.000 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -3.775 4.492 -14.102 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -4.798 7.281 -14.852 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -4.825 6.603 -13.207 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -4.044 8.173 -13.509 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.574 4.145 -11.791 1.00 0.00 N ATOM 2480 CA HIS A 147 -3.317 3.255 -10.815 1.00 0.00 C ATOM 2481 C HIS A 147 -3.301 3.887 -9.410 1.00 0.00 C ATOM 2482 O HIS A 147 -4.339 4.149 -8.833 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.578 1.902 -10.790 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.633 1.224 -12.143 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.451 1.660 -13.185 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.967 0.123 -12.635 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -3.251 0.835 -14.229 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.360 -0.117 -13.948 1.00 0.00 N ATOM 0 H HIS A 147 -1.852 3.682 -12.342 1.00 0.00 H new ATOM 0 HA HIS A 147 -4.357 3.128 -11.116 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.539 2.057 -10.500 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -3.026 1.254 -10.037 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -1.248 -0.465 -12.084 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.752 0.932 -15.181 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -2.036 -0.862 -14.564 1.00 0.00 H new ATOM 2496 N CYS A 148 -2.130 4.142 -8.862 1.00 0.00 N ATOM 2497 CA CYS A 148 -2.051 4.761 -7.507 1.00 0.00 C ATOM 2498 C CYS A 148 -1.162 6.022 -7.543 1.00 0.00 C ATOM 2499 O CYS A 148 -0.830 6.520 -8.602 1.00 0.00 O ATOM 2500 CB CYS A 148 -1.433 3.666 -6.622 1.00 0.00 C ATOM 2501 SG CYS A 148 0.298 3.353 -7.092 1.00 0.00 S ATOM 0 H CYS A 148 -1.230 3.946 -9.300 1.00 0.00 H new ATOM 0 HA CYS A 148 -3.022 5.086 -7.133 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -1.481 3.968 -5.576 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -2.012 2.747 -6.716 1.00 0.00 H new ATOM 2506 N GLY A 149 -0.750 6.520 -6.395 1.00 0.00 N ATOM 2507 CA GLY A 149 0.142 7.715 -6.371 1.00 0.00 C ATOM 2508 C GLY A 149 1.580 7.226 -6.140 1.00 0.00 C ATOM 2509 O GLY A 149 2.178 7.505 -5.117 1.00 0.00 O ATOM 0 H GLY A 149 -0.996 6.146 -5.479 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.072 8.263 -7.311 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -0.160 8.401 -5.579 1.00 0.00 H new ATOM 2513 N CYS A 150 2.134 6.483 -7.077 1.00 0.00 N ATOM 2514 CA CYS A 150 3.529 5.959 -6.898 1.00 0.00 C ATOM 2515 C CYS A 150 4.512 6.808 -7.714 1.00 0.00 C ATOM 2516 O CYS A 150 4.210 7.213 -8.816 1.00 0.00 O ATOM 2517 CB CYS A 150 3.464 4.510 -7.418 1.00 0.00 C ATOM 2518 SG CYS A 150 5.104 3.742 -7.473 1.00 0.00 S ATOM 0 H CYS A 150 1.682 6.219 -7.952 1.00 0.00 H new ATOM 0 HA CYS A 150 3.875 5.998 -5.865 1.00 0.00 H new ATOM 0 HB2 CYS A 150 2.809 3.922 -6.775 1.00 0.00 H new ATOM 0 HB3 CYS A 150 3.025 4.501 -8.415 1.00 0.00 H new ATOM 2523 N ARG A 151 5.694 7.069 -7.191 1.00 0.00 N ATOM 2524 CA ARG A 151 6.687 7.883 -7.965 1.00 0.00 C ATOM 2525 C ARG A 151 7.722 6.955 -8.620 1.00 0.00 C ATOM 2526 O ARG A 151 8.905 7.233 -8.602 1.00 0.00 O ATOM 2527 CB ARG A 151 7.362 8.806 -6.945 1.00 0.00 C ATOM 2528 CG ARG A 151 6.437 9.983 -6.630 1.00 0.00 C ATOM 2529 CD ARG A 151 7.218 11.055 -5.865 1.00 0.00 C ATOM 2530 NE ARG A 151 7.209 10.596 -4.441 1.00 0.00 N ATOM 2531 CZ ARG A 151 6.115 10.676 -3.699 1.00 0.00 C ATOM 2532 NH1 ARG A 151 4.995 11.165 -4.181 1.00 0.00 N ATOM 2533 NH2 ARG A 151 6.146 10.264 -2.458 1.00 0.00 N ATOM 0 H ARG A 151 6.008 6.756 -6.272 1.00 0.00 H new ATOM 0 HA ARG A 151 6.211 8.456 -8.761 1.00 0.00 H new ATOM 0 HB2 ARG A 151 7.588 8.254 -6.033 1.00 0.00 H new ATOM 0 HB3 ARG A 151 8.310 9.171 -7.340 1.00 0.00 H new ATOM 0 HG2 ARG A 151 6.034 10.400 -7.553 1.00 0.00 H new ATOM 0 HG3 ARG A 151 5.588 9.644 -6.037 1.00 0.00 H new ATOM 0 HD2 ARG A 151 8.236 11.148 -6.244 1.00 0.00 H new ATOM 0 HD3 ARG A 151 6.749 12.034 -5.967 1.00 0.00 H new ATOM 0 HE ARG A 151 8.062 10.214 -4.034 1.00 0.00 H new ATOM 0 HH11 ARG A 151 4.955 11.493 -5.146 1.00 0.00 H new ATOM 0 HH12 ARG A 151 4.165 11.217 -3.590 1.00 0.00 H new ATOM 0 HH21 ARG A 151 7.009 9.884 -2.068 1.00 0.00 H new ATOM 0 HH22 ARG A 151 5.307 10.322 -1.880 1.00 0.00 H new ATOM 2547 N GLY A 152 7.284 5.857 -9.202 1.00 0.00 N ATOM 2548 CA GLY A 152 8.237 4.923 -9.856 1.00 0.00 C ATOM 2549 C GLY A 152 8.899 4.026 -8.802 1.00 0.00 C ATOM 2550 O GLY A 152 9.884 4.403 -8.195 1.00 0.00 O ATOM 0 H GLY A 152 6.305 5.576 -9.247 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.713 4.310 -10.590 1.00 0.00 H new ATOM 0 HA3 GLY A 152 8.998 5.486 -10.396 1.00 0.00 H new ATOM 2554 N CYS A 153 8.376 2.833 -8.584 1.00 0.00 N ATOM 2555 CA CYS A 153 8.996 1.920 -7.575 1.00 0.00 C ATOM 2556 C CYS A 153 9.685 0.736 -8.283 1.00 0.00 C ATOM 2557 O CYS A 153 9.087 0.060 -9.098 1.00 0.00 O ATOM 2558 CB CYS A 153 7.843 1.460 -6.655 1.00 0.00 C ATOM 2559 SG CYS A 153 6.665 0.387 -7.532 1.00 0.00 S ATOM 0 H CYS A 153 7.554 2.461 -9.060 1.00 0.00 H new ATOM 0 HA CYS A 153 9.772 2.414 -6.990 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.253 0.925 -5.798 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.319 2.333 -6.265 1.00 0.00 H new ATOM 2564 N ALA A 154 10.946 0.492 -7.990 1.00 0.00 N ATOM 2565 CA ALA A 154 11.669 -0.636 -8.659 1.00 0.00 C ATOM 2566 C ALA A 154 12.820 -1.136 -7.772 1.00 0.00 C ATOM 2567 O ALA A 154 13.422 -0.367 -7.046 1.00 0.00 O ATOM 2568 CB ALA A 154 12.214 -0.035 -9.952 1.00 0.00 C ATOM 0 H ALA A 154 11.500 1.024 -7.319 1.00 0.00 H new ATOM 0 HA ALA A 154 11.020 -1.492 -8.843 1.00 0.00 H new ATOM 0 HB1 ALA A 154 12.760 -0.798 -10.506 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.387 0.332 -10.560 1.00 0.00 H new ATOM 0 HB3 ALA A 154 12.885 0.791 -9.715 1.00 0.00 H new ATOM 2574 N SER A 155 13.132 -2.414 -7.821 1.00 0.00 N ATOM 2575 CA SER A 155 14.251 -2.940 -6.970 1.00 0.00 C ATOM 2576 C SER A 155 15.528 -3.119 -7.808 1.00 0.00 C ATOM 2577 O SER A 155 16.603 -2.733 -7.385 1.00 0.00 O ATOM 2578 CB SER A 155 13.767 -4.290 -6.433 1.00 0.00 C ATOM 2579 OG SER A 155 12.351 -4.264 -6.304 1.00 0.00 O ATOM 0 H SER A 155 12.666 -3.107 -8.406 1.00 0.00 H new ATOM 0 HA SER A 155 14.497 -2.252 -6.161 1.00 0.00 H new ATOM 0 HB2 SER A 155 14.068 -5.092 -7.108 1.00 0.00 H new ATOM 0 HB3 SER A 155 14.228 -4.497 -5.467 1.00 0.00 H new ATOM 0 HG SER A 155 12.038 -5.127 -5.962 1.00 0.00 H new ATOM 2585 N THR A 156 15.429 -3.695 -8.991 1.00 0.00 N ATOM 2586 CA THR A 156 16.666 -3.885 -9.835 1.00 0.00 C ATOM 2587 C THR A 156 17.343 -2.530 -10.100 1.00 0.00 C ATOM 2588 O THR A 156 18.556 -2.428 -10.084 1.00 0.00 O ATOM 2589 CB THR A 156 16.207 -4.511 -11.163 1.00 0.00 C ATOM 2590 OG1 THR A 156 15.177 -5.456 -10.906 1.00 0.00 O ATOM 2591 CG2 THR A 156 17.390 -5.213 -11.833 1.00 0.00 C ATOM 0 H THR A 156 14.561 -4.037 -9.404 1.00 0.00 H new ATOM 0 HA THR A 156 17.388 -4.524 -9.327 1.00 0.00 H new ATOM 0 HB THR A 156 15.829 -3.730 -11.823 1.00 0.00 H new ATOM 0 HG1 THR A 156 14.881 -5.855 -11.751 1.00 0.00 H new ATOM 0 HG21 THR A 156 17.064 -5.657 -12.774 1.00 0.00 H new ATOM 0 HG22 THR A 156 18.180 -4.488 -12.028 1.00 0.00 H new ATOM 0 HG23 THR A 156 17.769 -5.995 -11.175 1.00 0.00 H new ATOM 2599 N ASP A 157 16.574 -1.491 -10.342 1.00 0.00 N ATOM 2600 CA ASP A 157 17.182 -0.151 -10.604 1.00 0.00 C ATOM 2601 C ASP A 157 16.358 0.946 -9.927 1.00 0.00 C ATOM 2602 O ASP A 157 16.591 2.106 -10.227 1.00 0.00 O ATOM 2603 CB ASP A 157 17.143 0.010 -12.124 1.00 0.00 C ATOM 2604 CG ASP A 157 18.335 -0.720 -12.746 1.00 0.00 C ATOM 2605 OD1 ASP A 157 19.409 -0.141 -12.777 1.00 0.00 O ATOM 2606 OD2 ASP A 157 18.154 -1.846 -13.181 1.00 0.00 O ATOM 2607 OXT ASP A 157 15.508 0.608 -9.119 1.00 0.00 O ATOM 0 H ASP A 157 15.555 -1.517 -10.369 1.00 0.00 H new ATOM 0 HA ASP A 157 18.196 -0.073 -10.211 1.00 0.00 H new ATOM 0 HB2 ASP A 157 16.210 -0.393 -12.519 1.00 0.00 H new ATOM 0 HB3 ASP A 157 17.172 1.067 -12.389 1.00 0.00 H new TER 2612 ASP A 157 HETATM 2613 ZN ZN A1000 0.906 1.149 -6.873 1.00 0.00 ZN HETATM 2614 ZN ZN A1001 4.688 1.510 -7.889 1.00 0.00 ZN HETATM 2615 ZN ZN A1002 1.811 1.200 -10.491 1.00 0.00 ZN