USER MOD reduce.3.24.130724 H: found=0, std=0, add=1318, rem=0, adj=33 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+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 100 TYR OH : rot 180:sc= 0 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= -2.44! USER MOD Set 3.1: A 45 SER OG : rot 180:sc= 0.0412 USER MOD Set 3.2: A 46 ASN : amide:sc= 0 K(o=0.041,f=-0.86) USER MOD Single : A 1 SER OG : rot 180:sc= -0.308 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= -0.15 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+ 165:sc= 0.696 (180deg=0.564) USER MOD Single : A 20 LYS NZ :NH3+ -130:sc= 0 (180deg=-0.017) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.207 USER MOD Single : A 29 GLN : amide:sc= -0.0657 X(o=-0.066,f=-0.063) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=-0.48) 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 USER MOD Single : A 39 SER OG : rot 17:sc= 0.353 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= -0.358 X(o=-0.36,f=-0.39) USER MOD Single : A 53 MET CE :methyl -133:sc= -3.52 (180deg=-6.8!) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 HIS : no HE2:sc= -3.15! C(o=-3.1!,f=-7.7!) USER MOD Single : A 57 HIS : no HD1:sc= -5.51! C(o=-5.5!,f=-6.5!) USER MOD Single : A 58 GLN : amide:sc=-0.00278 X(o=-0.0028,f=-0.0028) USER MOD Single : A 60 SER OG : rot 1:sc= 0.354 USER MOD Single : A 64 TYR OH : rot 30:sc= 0 USER MOD Single : A 65 THR OG1 : rot 110:sc= 0.929 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0175) USER MOD Single : A 78 TYR OH : rot 150:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.252) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 160:sc= 0.481 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= 0.102 K(o=0.1,f=-1.4!) USER MOD Single : A 116 ASN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 118 SER OG : rot 180:sc= -0.137 USER MOD Single : A 119 THR OG1 : rot -46:sc= -0.719! USER MOD Single : A 128 GLN : amide:sc= -0.144 K(o=-0.14,f=-1.7!) USER MOD Single : A 135 LYS NZ :NH3+ -175:sc= -0.0343 (180deg=-0.054) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.0153 USER MOD Single : A 139 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= -0.366 X(o=-0.37,f=0) USER MOD Single : A 144 GLN : amide:sc= -0.159 X(o=-0.16,f=0) USER MOD Single : A 147 HIS : no HD1:sc= -0.854 X(o=-0.85,f=-0.46) USER MOD Single : A 155 SER OG : rot 150:sc= -1.33! USER MOD Single : A 156 THR OG1 : rot 150:sc= -1.27 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 -31.678 -41.299 13.569 1.00 0.00 N ATOM 2 CA GLY A -1 -30.260 -41.358 13.112 1.00 0.00 C ATOM 3 C GLY A -1 -29.332 -41.479 14.330 1.00 0.00 C ATOM 4 O GLY A -1 -29.579 -42.270 15.221 1.00 0.00 O ATOM 0 H1 GLY A -1 -32.306 -41.217 12.744 1.00 0.00 H new ATOM 0 H2 GLY A -1 -31.909 -42.166 14.095 1.00 0.00 H new ATOM 0 H3 GLY A -1 -31.809 -40.473 14.187 1.00 0.00 H new ATOM 0 HA2 GLY A -1 -30.117 -42.209 12.447 1.00 0.00 H new ATOM 0 HA3 GLY A -1 -30.013 -40.463 12.541 1.00 0.00 H new ATOM 10 N GLY A 0 -28.268 -40.703 14.379 1.00 0.00 N ATOM 11 CA GLY A 0 -27.336 -40.785 15.543 1.00 0.00 C ATOM 12 C GLY A 0 -27.501 -39.537 16.421 1.00 0.00 C ATOM 13 O GLY A 0 -28.391 -39.474 17.249 1.00 0.00 O ATOM 0 H GLY A 0 -28.011 -40.022 13.664 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -27.543 -41.682 16.126 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -26.307 -40.863 15.193 1.00 0.00 H new ATOM 17 N SER A 1 -26.654 -38.541 16.253 1.00 0.00 N ATOM 18 CA SER A 1 -26.774 -37.305 17.083 1.00 0.00 C ATOM 19 C SER A 1 -27.068 -36.090 16.190 1.00 0.00 C ATOM 20 O SER A 1 -26.640 -36.049 15.054 1.00 0.00 O ATOM 21 CB SER A 1 -25.414 -37.153 17.764 1.00 0.00 C ATOM 22 OG SER A 1 -25.343 -35.878 18.389 1.00 0.00 O ATOM 0 H SER A 1 -25.890 -38.536 15.578 1.00 0.00 H new ATOM 0 HA SER A 1 -27.588 -37.371 17.805 1.00 0.00 H new ATOM 0 HB2 SER A 1 -25.274 -37.942 18.503 1.00 0.00 H new ATOM 0 HB3 SER A 1 -24.614 -37.257 17.031 1.00 0.00 H new ATOM 0 HG SER A 1 -24.473 -35.777 18.828 1.00 0.00 H new ATOM 28 N PRO A 2 -27.794 -35.131 16.726 1.00 0.00 N ATOM 29 CA PRO A 2 -28.130 -33.917 15.940 1.00 0.00 C ATOM 30 C PRO A 2 -26.891 -33.023 15.778 1.00 0.00 C ATOM 31 O PRO A 2 -26.128 -32.846 16.710 1.00 0.00 O ATOM 32 CB PRO A 2 -29.196 -33.223 16.783 1.00 0.00 C ATOM 33 CG PRO A 2 -28.954 -33.695 18.181 1.00 0.00 C ATOM 34 CD PRO A 2 -28.362 -35.076 18.084 1.00 0.00 C ATOM 0 HA PRO A 2 -28.475 -34.143 14.931 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -29.110 -32.139 16.712 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -30.199 -33.486 16.446 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -28.276 -33.021 18.704 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -29.885 -33.713 18.748 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -27.596 -35.235 18.843 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -29.120 -35.845 18.230 1.00 0.00 H new ATOM 42 N ARG A 3 -26.681 -32.455 14.607 1.00 0.00 N ATOM 43 CA ARG A 3 -25.490 -31.577 14.403 1.00 0.00 C ATOM 44 C ARG A 3 -25.936 -30.153 14.036 1.00 0.00 C ATOM 45 O ARG A 3 -27.098 -29.917 13.765 1.00 0.00 O ATOM 46 CB ARG A 3 -24.723 -32.214 13.243 1.00 0.00 C ATOM 47 CG ARG A 3 -23.219 -32.100 13.498 1.00 0.00 C ATOM 48 CD ARG A 3 -22.509 -33.335 12.939 1.00 0.00 C ATOM 49 NE ARG A 3 -21.448 -33.656 13.942 1.00 0.00 N ATOM 50 CZ ARG A 3 -21.748 -34.210 15.107 1.00 0.00 C ATOM 51 NH1 ARG A 3 -22.987 -34.500 15.430 1.00 0.00 N ATOM 52 NH2 ARG A 3 -20.792 -34.477 15.960 1.00 0.00 N ATOM 0 H ARG A 3 -27.283 -32.565 13.791 1.00 0.00 H new ATOM 0 HA ARG A 3 -24.878 -31.496 15.301 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -25.006 -33.261 13.138 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -24.982 -31.719 12.307 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -22.827 -31.198 13.027 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -23.027 -32.010 14.567 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -23.202 -34.167 12.817 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -22.078 -33.133 11.959 1.00 0.00 H new ATOM 0 HE ARG A 3 -20.474 -33.444 13.725 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -23.745 -34.299 14.777 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -23.192 -34.926 16.334 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -19.824 -34.258 15.726 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -21.015 -34.904 16.859 1.00 0.00 H new ATOM 66 N ILE A 4 -25.026 -29.199 14.027 1.00 0.00 N ATOM 67 CA ILE A 4 -25.412 -27.798 13.678 1.00 0.00 C ATOM 68 C ILE A 4 -24.292 -27.122 12.869 1.00 0.00 C ATOM 69 O ILE A 4 -23.148 -27.530 12.932 1.00 0.00 O ATOM 70 CB ILE A 4 -25.618 -27.088 15.021 1.00 0.00 C ATOM 71 CG1 ILE A 4 -24.329 -27.154 15.850 1.00 0.00 C ATOM 72 CG2 ILE A 4 -26.749 -27.773 15.791 1.00 0.00 C ATOM 73 CD1 ILE A 4 -24.424 -26.170 17.019 1.00 0.00 C ATOM 0 H ILE A 4 -24.039 -29.335 14.246 1.00 0.00 H new ATOM 0 HA ILE A 4 -26.311 -27.761 13.062 1.00 0.00 H new ATOM 0 HB ILE A 4 -25.876 -26.045 14.838 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -24.176 -28.166 16.224 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -23.469 -26.912 15.225 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -26.896 -27.269 16.746 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -27.669 -27.722 15.208 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -26.489 -28.817 15.968 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -23.508 -26.216 17.609 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -24.557 -25.159 16.634 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -25.274 -26.433 17.648 1.00 0.00 H new ATOM 85 N LYS A 5 -24.608 -26.090 12.111 1.00 0.00 N ATOM 86 CA LYS A 5 -23.554 -25.401 11.308 1.00 0.00 C ATOM 87 C LYS A 5 -23.425 -23.935 11.751 1.00 0.00 C ATOM 88 O LYS A 5 -24.399 -23.313 12.133 1.00 0.00 O ATOM 89 CB LYS A 5 -24.044 -25.481 9.860 1.00 0.00 C ATOM 90 CG LYS A 5 -23.330 -26.628 9.138 1.00 0.00 C ATOM 91 CD LYS A 5 -24.156 -27.063 7.926 1.00 0.00 C ATOM 92 CE LYS A 5 -25.050 -28.243 8.313 1.00 0.00 C ATOM 93 NZ LYS A 5 -24.299 -29.453 7.877 1.00 0.00 N ATOM 0 H LYS A 5 -25.547 -25.702 12.018 1.00 0.00 H new ATOM 0 HA LYS A 5 -22.573 -25.860 11.433 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -25.122 -25.640 9.839 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -23.850 -24.539 9.347 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -22.338 -26.309 8.819 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -23.192 -27.469 9.817 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -24.766 -26.232 7.571 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -23.496 -27.347 7.106 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -25.238 -28.260 9.386 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -26.020 -28.182 7.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -24.849 -30.305 8.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -24.140 -29.412 6.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -23.383 -29.488 8.368 1.00 0.00 H new ATOM 107 N THR A 6 -22.233 -23.375 11.707 1.00 0.00 N ATOM 108 CA THR A 6 -22.057 -21.952 12.129 1.00 0.00 C ATOM 109 C THR A 6 -21.291 -21.169 11.052 1.00 0.00 C ATOM 110 O THR A 6 -20.162 -21.494 10.733 1.00 0.00 O ATOM 111 CB THR A 6 -21.243 -22.021 13.423 1.00 0.00 C ATOM 112 OG1 THR A 6 -21.841 -22.959 14.306 1.00 0.00 O ATOM 113 CG2 THR A 6 -21.211 -20.642 14.083 1.00 0.00 C ATOM 0 H THR A 6 -21.382 -23.844 11.398 1.00 0.00 H new ATOM 0 HA THR A 6 -23.010 -21.443 12.273 1.00 0.00 H new ATOM 0 HB THR A 6 -20.224 -22.334 13.196 1.00 0.00 H new ATOM 0 HG1 THR A 6 -21.320 -23.006 15.135 1.00 0.00 H new ATOM 0 HG21 THR A 6 -20.631 -20.693 15.004 1.00 0.00 H new ATOM 0 HG22 THR A 6 -20.751 -19.924 13.404 1.00 0.00 H new ATOM 0 HG23 THR A 6 -22.228 -20.324 14.312 1.00 0.00 H new ATOM 121 N ARG A 7 -21.890 -20.139 10.488 1.00 0.00 N ATOM 122 CA ARG A 7 -21.186 -19.346 9.436 1.00 0.00 C ATOM 123 C ARG A 7 -21.491 -17.848 9.608 1.00 0.00 C ATOM 124 O ARG A 7 -22.277 -17.285 8.869 1.00 0.00 O ATOM 125 CB ARG A 7 -21.749 -19.862 8.110 1.00 0.00 C ATOM 126 CG ARG A 7 -20.810 -19.466 6.968 1.00 0.00 C ATOM 127 CD ARG A 7 -19.813 -20.598 6.711 1.00 0.00 C ATOM 128 NE ARG A 7 -20.595 -21.645 5.986 1.00 0.00 N ATOM 129 CZ ARG A 7 -20.969 -21.475 4.726 1.00 0.00 C ATOM 130 NH1 ARG A 7 -20.669 -20.381 4.064 1.00 0.00 N ATOM 131 NH2 ARG A 7 -21.652 -22.413 4.124 1.00 0.00 N ATOM 0 H ARG A 7 -22.832 -19.819 10.714 1.00 0.00 H new ATOM 0 HA ARG A 7 -20.103 -19.456 9.489 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -21.858 -20.946 8.146 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -22.742 -19.447 7.939 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -21.385 -19.261 6.065 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -20.278 -18.549 7.222 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -18.969 -20.252 6.115 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -19.406 -20.985 7.645 1.00 0.00 H new ATOM 0 HE ARG A 7 -20.846 -22.507 6.470 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -20.137 -19.639 4.519 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -20.968 -20.273 3.095 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -21.894 -23.269 4.624 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -21.943 -22.289 3.154 1.00 0.00 H new ATOM 145 N ARG A 8 -20.877 -17.197 10.577 1.00 0.00 N ATOM 146 CA ARG A 8 -21.141 -15.740 10.785 1.00 0.00 C ATOM 147 C ARG A 8 -19.853 -15.026 11.227 1.00 0.00 C ATOM 148 O ARG A 8 -18.770 -15.565 11.097 1.00 0.00 O ATOM 149 CB ARG A 8 -22.201 -15.686 11.891 1.00 0.00 C ATOM 150 CG ARG A 8 -23.282 -14.666 11.520 1.00 0.00 C ATOM 151 CD ARG A 8 -24.610 -15.067 12.166 1.00 0.00 C ATOM 152 NE ARG A 8 -24.726 -14.199 13.377 1.00 0.00 N ATOM 153 CZ ARG A 8 -25.059 -12.921 13.277 1.00 0.00 C ATOM 154 NH1 ARG A 8 -25.302 -12.365 12.112 1.00 0.00 N ATOM 155 NH2 ARG A 8 -25.151 -12.191 14.360 1.00 0.00 N ATOM 0 H ARG A 8 -20.210 -17.614 11.226 1.00 0.00 H new ATOM 0 HA ARG A 8 -21.479 -15.243 9.875 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -22.648 -16.671 12.028 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -21.738 -15.411 12.839 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -22.988 -13.671 11.856 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -23.393 -14.617 10.437 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -25.445 -14.907 11.484 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -24.615 -16.123 12.435 1.00 0.00 H new ATOM 0 HE ARG A 8 -24.545 -14.598 14.298 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -25.236 -12.920 11.259 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -25.557 -11.379 12.061 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -24.967 -12.607 15.273 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -25.407 -11.206 14.291 1.00 0.00 H new ATOM 169 N SER A 9 -19.956 -13.820 11.753 1.00 0.00 N ATOM 170 CA SER A 9 -18.728 -13.092 12.199 1.00 0.00 C ATOM 171 C SER A 9 -18.722 -12.952 13.729 1.00 0.00 C ATOM 172 O SER A 9 -19.582 -13.486 14.404 1.00 0.00 O ATOM 173 CB SER A 9 -18.812 -11.715 11.536 1.00 0.00 C ATOM 174 OG SER A 9 -17.690 -10.936 11.927 1.00 0.00 O ATOM 0 H SER A 9 -20.833 -13.317 11.889 1.00 0.00 H new ATOM 0 HA SER A 9 -17.815 -13.620 11.922 1.00 0.00 H new ATOM 0 HB2 SER A 9 -18.835 -11.822 10.451 1.00 0.00 H new ATOM 0 HB3 SER A 9 -19.736 -11.215 11.827 1.00 0.00 H new ATOM 0 HG SER A 9 -17.740 -10.054 11.503 1.00 0.00 H new ATOM 180 N LYS A 10 -17.759 -12.244 14.286 1.00 0.00 N ATOM 181 CA LYS A 10 -17.711 -12.085 15.771 1.00 0.00 C ATOM 182 C LYS A 10 -17.305 -10.648 16.142 1.00 0.00 C ATOM 183 O LYS A 10 -16.663 -9.974 15.363 1.00 0.00 O ATOM 184 CB LYS A 10 -16.650 -13.080 16.242 1.00 0.00 C ATOM 185 CG LYS A 10 -17.276 -14.470 16.373 1.00 0.00 C ATOM 186 CD LYS A 10 -17.867 -14.634 17.774 1.00 0.00 C ATOM 187 CE LYS A 10 -16.736 -14.811 18.789 1.00 0.00 C ATOM 188 NZ LYS A 10 -16.459 -16.274 18.805 1.00 0.00 N ATOM 0 H LYS A 10 -17.012 -11.775 13.775 1.00 0.00 H new ATOM 0 HA LYS A 10 -18.679 -12.270 16.236 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -15.822 -13.108 15.533 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -16.239 -12.763 17.200 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -18.054 -14.602 15.621 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -16.524 -15.238 16.192 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -18.467 -13.761 18.031 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -18.532 -15.497 17.801 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -15.851 -14.245 18.497 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -17.032 -14.454 19.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -15.693 -16.475 19.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -17.317 -16.787 19.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -16.173 -16.584 17.854 1.00 0.00 H new ATOM 202 N PRO A 11 -17.692 -10.221 17.327 1.00 0.00 N ATOM 203 CA PRO A 11 -17.348 -8.850 17.781 1.00 0.00 C ATOM 204 C PRO A 11 -15.856 -8.751 18.122 1.00 0.00 C ATOM 205 O PRO A 11 -15.193 -9.752 18.319 1.00 0.00 O ATOM 206 CB PRO A 11 -18.204 -8.656 19.030 1.00 0.00 C ATOM 207 CG PRO A 11 -18.468 -10.036 19.537 1.00 0.00 C ATOM 208 CD PRO A 11 -18.470 -10.953 18.342 1.00 0.00 C ATOM 0 HA PRO A 11 -17.535 -8.092 17.020 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -17.684 -8.055 19.775 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -19.134 -8.138 18.795 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -17.702 -10.337 20.252 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -19.425 -10.079 20.057 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -18.014 -11.915 18.577 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -19.484 -11.156 17.997 1.00 0.00 H new ATOM 216 N ALA A 12 -15.324 -7.549 18.200 1.00 0.00 N ATOM 217 CA ALA A 12 -13.866 -7.399 18.539 1.00 0.00 C ATOM 218 C ALA A 12 -13.683 -7.438 20.067 1.00 0.00 C ATOM 219 O ALA A 12 -14.519 -6.938 20.793 1.00 0.00 O ATOM 220 CB ALA A 12 -13.420 -6.038 17.974 1.00 0.00 C ATOM 0 H ALA A 12 -15.828 -6.676 18.046 1.00 0.00 H new ATOM 0 HA ALA A 12 -13.270 -8.206 18.113 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.364 -5.881 18.195 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.571 -6.025 16.895 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.009 -5.243 18.432 1.00 0.00 H new ATOM 226 N PRO A 13 -12.598 -8.036 20.517 1.00 0.00 N ATOM 227 CA PRO A 13 -12.342 -8.128 21.977 1.00 0.00 C ATOM 228 C PRO A 13 -11.956 -6.760 22.550 1.00 0.00 C ATOM 229 O PRO A 13 -11.658 -5.836 21.819 1.00 0.00 O ATOM 230 CB PRO A 13 -11.178 -9.109 22.080 1.00 0.00 C ATOM 231 CG PRO A 13 -10.480 -9.024 20.763 1.00 0.00 C ATOM 232 CD PRO A 13 -11.522 -8.672 19.734 1.00 0.00 C ATOM 0 HA PRO A 13 -13.217 -8.452 22.540 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.509 -8.843 22.898 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.532 -10.122 22.274 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.695 -8.268 20.791 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.001 -9.972 20.518 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.124 -7.994 18.979 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.880 -9.558 19.210 1.00 0.00 H new ATOM 240 N ASP A 14 -11.967 -6.625 23.863 1.00 0.00 N ATOM 241 CA ASP A 14 -11.601 -5.299 24.499 1.00 0.00 C ATOM 242 C ASP A 14 -10.298 -4.727 23.905 1.00 0.00 C ATOM 243 O ASP A 14 -10.136 -3.525 23.813 1.00 0.00 O ATOM 244 CB ASP A 14 -11.416 -5.570 26.001 1.00 0.00 C ATOM 245 CG ASP A 14 -10.348 -6.648 26.201 1.00 0.00 C ATOM 246 OD1 ASP A 14 -9.179 -6.297 26.234 1.00 0.00 O ATOM 247 OD2 ASP A 14 -10.716 -7.805 26.319 1.00 0.00 O ATOM 0 H ASP A 14 -12.211 -7.366 24.520 1.00 0.00 H new ATOM 0 HA ASP A 14 -12.384 -4.563 24.313 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -11.122 -4.653 26.513 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -12.359 -5.892 26.441 1.00 0.00 H new ATOM 252 N GLY A 15 -9.368 -5.571 23.497 1.00 0.00 N ATOM 253 CA GLY A 15 -8.085 -5.063 22.909 1.00 0.00 C ATOM 254 C GLY A 15 -8.369 -4.049 21.782 1.00 0.00 C ATOM 255 O GLY A 15 -7.629 -3.099 21.606 1.00 0.00 O ATOM 0 H GLY A 15 -9.446 -6.587 23.548 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.484 -4.592 23.687 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -7.503 -5.897 22.517 1.00 0.00 H new ATOM 259 N PHE A 16 -9.434 -4.232 21.019 1.00 0.00 N ATOM 260 CA PHE A 16 -9.740 -3.249 19.912 1.00 0.00 C ATOM 261 C PHE A 16 -9.840 -1.818 20.472 1.00 0.00 C ATOM 262 O PHE A 16 -9.480 -0.867 19.802 1.00 0.00 O ATOM 263 CB PHE A 16 -11.087 -3.670 19.299 1.00 0.00 C ATOM 264 CG PHE A 16 -11.399 -2.794 18.105 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.449 -2.622 17.089 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.642 -2.157 18.014 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.742 -1.811 15.986 1.00 0.00 C ATOM 268 CE2 PHE A 16 -12.935 -1.347 16.910 1.00 0.00 C ATOM 269 CZ PHE A 16 -11.985 -1.174 15.896 1.00 0.00 C ATOM 0 H PHE A 16 -10.094 -5.005 21.112 1.00 0.00 H new ATOM 0 HA PHE A 16 -8.948 -3.255 19.163 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.048 -4.716 18.995 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -11.879 -3.584 20.043 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.491 -3.115 17.157 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.375 -2.290 18.796 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -10.009 -1.677 15.204 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.894 -0.855 16.841 1.00 0.00 H new ATOM 0 HZ PHE A 16 -12.211 -0.549 15.045 1.00 0.00 H new ATOM 279 N GLU A 17 -10.318 -1.650 21.691 1.00 0.00 N ATOM 280 CA GLU A 17 -10.423 -0.258 22.271 1.00 0.00 C ATOM 281 C GLU A 17 -9.058 0.450 22.202 1.00 0.00 C ATOM 282 O GLU A 17 -8.986 1.635 21.936 1.00 0.00 O ATOM 283 CB GLU A 17 -10.860 -0.417 23.737 1.00 0.00 C ATOM 284 CG GLU A 17 -11.276 0.944 24.296 1.00 0.00 C ATOM 285 CD GLU A 17 -12.180 0.741 25.514 1.00 0.00 C ATOM 286 OE1 GLU A 17 -13.234 0.149 25.353 1.00 0.00 O ATOM 287 OE2 GLU A 17 -11.802 1.182 26.587 1.00 0.00 O ATOM 0 H GLU A 17 -10.636 -2.402 22.302 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.140 0.344 21.712 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -11.691 -1.119 23.806 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.043 -0.831 24.328 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -10.393 1.519 24.577 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -11.801 1.518 23.532 1.00 0.00 H new ATOM 294 N LYS A 18 -7.976 -0.268 22.428 1.00 0.00 N ATOM 295 CA LYS A 18 -6.616 0.386 22.358 1.00 0.00 C ATOM 296 C LYS A 18 -6.407 1.026 20.974 1.00 0.00 C ATOM 297 O LYS A 18 -5.812 2.081 20.861 1.00 0.00 O ATOM 298 CB LYS A 18 -5.578 -0.726 22.588 1.00 0.00 C ATOM 299 CG LYS A 18 -5.521 -1.075 24.079 1.00 0.00 C ATOM 300 CD LYS A 18 -5.379 -2.589 24.250 1.00 0.00 C ATOM 301 CE LYS A 18 -4.028 -3.043 23.692 1.00 0.00 C ATOM 302 NZ LYS A 18 -4.102 -4.531 23.671 1.00 0.00 N ATOM 0 H LYS A 18 -7.971 -1.263 22.655 1.00 0.00 H new ATOM 0 HA LYS A 18 -6.521 1.173 23.106 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -5.842 -1.610 22.007 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -4.597 -0.399 22.243 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -4.680 -0.566 24.549 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -6.425 -0.726 24.579 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -5.457 -2.855 25.304 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -6.189 -3.102 23.731 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -3.858 -2.642 22.693 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -3.206 -2.697 24.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -3.336 -4.908 23.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -4.002 -4.897 24.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -5.020 -4.827 23.282 1.00 0.00 H new ATOM 316 N ILE A 19 -6.899 0.403 19.921 1.00 0.00 N ATOM 317 CA ILE A 19 -6.731 0.994 18.555 1.00 0.00 C ATOM 318 C ILE A 19 -8.108 1.299 17.928 1.00 0.00 C ATOM 319 O ILE A 19 -8.292 1.151 16.734 1.00 0.00 O ATOM 320 CB ILE A 19 -5.973 -0.070 17.736 1.00 0.00 C ATOM 321 CG1 ILE A 19 -6.799 -1.365 17.634 1.00 0.00 C ATOM 322 CG2 ILE A 19 -4.628 -0.380 18.408 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.670 -1.949 16.225 1.00 0.00 C ATOM 0 H ILE A 19 -7.405 -0.482 19.952 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.186 1.937 18.582 1.00 0.00 H new ATOM 0 HB ILE A 19 -5.804 0.322 16.733 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.451 -2.089 18.371 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.846 -1.159 17.858 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.095 -1.132 17.826 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.029 0.529 18.460 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -4.803 -0.757 19.415 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.256 -2.866 16.156 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.039 -1.227 15.497 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.623 -2.171 16.018 1.00 0.00 H new ATOM 335 N LYS A 20 -9.083 1.709 18.721 1.00 0.00 N ATOM 336 CA LYS A 20 -10.448 1.997 18.148 1.00 0.00 C ATOM 337 C LYS A 20 -10.567 3.419 17.547 1.00 0.00 C ATOM 338 O LYS A 20 -11.150 3.568 16.491 1.00 0.00 O ATOM 339 CB LYS A 20 -11.447 1.828 19.303 1.00 0.00 C ATOM 340 CG LYS A 20 -12.874 1.810 18.748 1.00 0.00 C ATOM 341 CD LYS A 20 -13.476 3.214 18.836 1.00 0.00 C ATOM 342 CE LYS A 20 -14.479 3.412 17.698 1.00 0.00 C ATOM 343 NZ LYS A 20 -15.707 2.693 18.139 1.00 0.00 N ATOM 0 H LYS A 20 -8.994 1.855 19.727 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.645 1.312 17.323 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.243 0.902 19.841 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.334 2.643 20.017 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -12.868 1.470 17.712 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.485 1.105 19.311 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -13.970 3.350 19.798 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -12.687 3.964 18.774 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -14.680 4.470 17.528 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.098 3.006 16.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -16.033 2.063 17.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.494 2.130 18.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -16.453 3.383 18.360 1.00 0.00 H new ATOM 357 N PRO A 21 -10.049 4.430 18.223 1.00 0.00 N ATOM 358 CA PRO A 21 -10.174 5.814 17.694 1.00 0.00 C ATOM 359 C PRO A 21 -9.193 6.066 16.537 1.00 0.00 C ATOM 360 O PRO A 21 -9.519 6.767 15.598 1.00 0.00 O ATOM 361 CB PRO A 21 -9.842 6.695 18.894 1.00 0.00 C ATOM 362 CG PRO A 21 -8.990 5.849 19.784 1.00 0.00 C ATOM 363 CD PRO A 21 -9.316 4.405 19.499 1.00 0.00 C ATOM 0 HA PRO A 21 -11.164 6.013 17.283 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -9.313 7.597 18.585 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -10.748 7.017 19.408 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -7.934 6.045 19.601 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.181 6.084 20.831 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.411 3.803 19.423 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.922 3.972 20.295 1.00 0.00 H new ATOM 371 N THR A 22 -7.996 5.512 16.589 1.00 0.00 N ATOM 372 CA THR A 22 -7.020 5.755 15.463 1.00 0.00 C ATOM 373 C THR A 22 -7.608 5.252 14.138 1.00 0.00 C ATOM 374 O THR A 22 -7.509 5.917 13.123 1.00 0.00 O ATOM 375 CB THR A 22 -5.738 4.977 15.806 1.00 0.00 C ATOM 376 OG1 THR A 22 -5.252 5.404 17.072 1.00 0.00 O ATOM 377 CG2 THR A 22 -4.677 5.238 14.735 1.00 0.00 C ATOM 0 H THR A 22 -7.657 4.915 17.344 1.00 0.00 H new ATOM 0 HA THR A 22 -6.810 6.819 15.350 1.00 0.00 H new ATOM 0 HB THR A 22 -5.959 3.910 15.842 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.436 4.908 17.293 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.770 4.686 14.980 1.00 0.00 H new ATOM 0 HG22 THR A 22 -5.051 4.910 13.765 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.454 6.304 14.696 1.00 0.00 H new ATOM 385 N LEU A 23 -8.226 4.092 14.137 1.00 0.00 N ATOM 386 CA LEU A 23 -8.823 3.572 12.856 1.00 0.00 C ATOM 387 C LEU A 23 -9.954 4.504 12.397 1.00 0.00 C ATOM 388 O LEU A 23 -10.088 4.783 11.220 1.00 0.00 O ATOM 389 CB LEU A 23 -9.373 2.169 13.157 1.00 0.00 C ATOM 390 CG LEU A 23 -8.244 1.142 13.021 1.00 0.00 C ATOM 391 CD1 LEU A 23 -8.429 0.024 14.057 1.00 0.00 C ATOM 392 CD2 LEU A 23 -8.270 0.549 11.610 1.00 0.00 C ATOM 0 H LEU A 23 -8.343 3.490 14.952 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.080 3.530 12.060 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.789 2.137 14.164 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.184 1.928 12.469 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.285 1.630 13.195 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.623 -0.703 13.955 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.409 0.450 15.060 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.387 -0.470 13.892 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -7.468 -0.183 11.508 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.230 0.062 11.438 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -8.130 1.345 10.878 1.00 0.00 H new ATOM 404 N THR A 24 -10.764 5.003 13.313 1.00 0.00 N ATOM 405 CA THR A 24 -11.875 5.934 12.895 1.00 0.00 C ATOM 406 C THR A 24 -11.297 7.155 12.158 1.00 0.00 C ATOM 407 O THR A 24 -11.900 7.660 11.230 1.00 0.00 O ATOM 408 CB THR A 24 -12.590 6.382 14.181 1.00 0.00 C ATOM 409 OG1 THR A 24 -12.574 5.319 15.124 1.00 0.00 O ATOM 410 CG2 THR A 24 -14.037 6.759 13.857 1.00 0.00 C ATOM 0 H THR A 24 -10.707 4.811 14.313 1.00 0.00 H new ATOM 0 HA THR A 24 -12.567 5.434 12.217 1.00 0.00 H new ATOM 0 HB THR A 24 -12.077 7.248 14.601 1.00 0.00 H new ATOM 0 HG1 THR A 24 -13.028 5.603 15.945 1.00 0.00 H new ATOM 0 HG21 THR A 24 -14.543 7.076 14.769 1.00 0.00 H new ATOM 0 HG22 THR A 24 -14.047 7.574 13.134 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.553 5.895 13.438 1.00 0.00 H new ATOM 418 N ASP A 25 -10.131 7.632 12.555 1.00 0.00 N ATOM 419 CA ASP A 25 -9.532 8.826 11.848 1.00 0.00 C ATOM 420 C ASP A 25 -9.391 8.546 10.340 1.00 0.00 C ATOM 421 O ASP A 25 -9.539 9.440 9.529 1.00 0.00 O ATOM 422 CB ASP A 25 -8.143 9.055 12.469 1.00 0.00 C ATOM 423 CG ASP A 25 -7.575 10.386 11.973 1.00 0.00 C ATOM 424 OD1 ASP A 25 -8.027 11.415 12.448 1.00 0.00 O ATOM 425 OD2 ASP A 25 -6.699 10.353 11.124 1.00 0.00 O ATOM 0 H ASP A 25 -9.576 7.255 13.323 1.00 0.00 H new ATOM 0 HA ASP A 25 -10.169 9.703 11.963 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -8.216 9.061 13.557 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.473 8.239 12.199 1.00 0.00 H new ATOM 430 N PHE A 26 -9.102 7.316 9.953 1.00 0.00 N ATOM 431 CA PHE A 26 -8.952 7.012 8.483 1.00 0.00 C ATOM 432 C PHE A 26 -10.240 7.361 7.724 1.00 0.00 C ATOM 433 O PHE A 26 -10.190 7.875 6.621 1.00 0.00 O ATOM 434 CB PHE A 26 -8.691 5.504 8.368 1.00 0.00 C ATOM 435 CG PHE A 26 -7.211 5.240 8.449 1.00 0.00 C ATOM 436 CD1 PHE A 26 -6.437 5.250 7.284 1.00 0.00 C ATOM 437 CD2 PHE A 26 -6.614 4.980 9.687 1.00 0.00 C ATOM 438 CE1 PHE A 26 -5.063 5.000 7.358 1.00 0.00 C ATOM 439 CE2 PHE A 26 -5.241 4.730 9.760 1.00 0.00 C ATOM 440 CZ PHE A 26 -4.466 4.740 8.596 1.00 0.00 C ATOM 0 H PHE A 26 -8.966 6.523 10.579 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.139 7.598 8.054 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -9.210 4.973 9.166 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -9.087 5.127 7.425 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.900 5.450 6.329 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -7.213 4.972 10.585 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.463 5.008 6.460 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.779 4.529 10.715 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.405 4.547 8.653 1.00 0.00 H new ATOM 450 N GLU A 27 -11.392 7.072 8.292 1.00 0.00 N ATOM 451 CA GLU A 27 -12.675 7.383 7.565 1.00 0.00 C ATOM 452 C GLU A 27 -12.788 8.885 7.287 1.00 0.00 C ATOM 453 O GLU A 27 -13.224 9.283 6.223 1.00 0.00 O ATOM 454 CB GLU A 27 -13.827 6.925 8.474 1.00 0.00 C ATOM 455 CG GLU A 27 -13.843 5.397 8.550 1.00 0.00 C ATOM 456 CD GLU A 27 -14.700 4.838 7.414 1.00 0.00 C ATOM 457 OE1 GLU A 27 -14.217 4.807 6.293 1.00 0.00 O ATOM 458 OE2 GLU A 27 -15.825 4.451 7.682 1.00 0.00 O ATOM 0 H GLU A 27 -11.501 6.642 9.210 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.705 6.870 6.604 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.707 7.348 9.471 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.778 7.290 8.085 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.827 5.008 8.478 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -14.241 5.074 9.512 1.00 0.00 H new ATOM 465 N ILE A 28 -12.398 9.726 8.219 1.00 0.00 N ATOM 466 CA ILE A 28 -12.498 11.207 7.961 1.00 0.00 C ATOM 467 C ILE A 28 -11.525 11.589 6.830 1.00 0.00 C ATOM 468 O ILE A 28 -11.862 12.382 5.970 1.00 0.00 O ATOM 469 CB ILE A 28 -12.151 11.924 9.288 1.00 0.00 C ATOM 470 CG1 ILE A 28 -13.284 11.689 10.301 1.00 0.00 C ATOM 471 CG2 ILE A 28 -12.009 13.433 9.047 1.00 0.00 C ATOM 472 CD1 ILE A 28 -12.892 10.573 11.270 1.00 0.00 C ATOM 0 H ILE A 28 -12.022 9.462 9.130 1.00 0.00 H new ATOM 0 HA ILE A 28 -13.498 11.502 7.642 1.00 0.00 H new ATOM 0 HB ILE A 28 -11.212 11.527 9.673 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -13.487 12.607 10.853 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -14.202 11.422 9.778 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -11.765 13.930 9.986 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -11.214 13.613 8.324 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -12.948 13.830 8.660 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -13.699 10.412 11.985 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -12.712 9.654 10.713 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -11.985 10.857 11.804 1.00 0.00 H new ATOM 484 N GLN A 29 -10.334 11.021 6.804 1.00 0.00 N ATOM 485 CA GLN A 29 -9.379 11.362 5.690 1.00 0.00 C ATOM 486 C GLN A 29 -9.905 10.750 4.388 1.00 0.00 C ATOM 487 O GLN A 29 -10.018 11.429 3.385 1.00 0.00 O ATOM 488 CB GLN A 29 -8.016 10.759 6.062 1.00 0.00 C ATOM 489 CG GLN A 29 -6.909 11.498 5.309 1.00 0.00 C ATOM 490 CD GLN A 29 -6.609 12.828 6.012 1.00 0.00 C ATOM 491 OE1 GLN A 29 -5.974 12.845 7.048 1.00 0.00 O ATOM 492 NE2 GLN A 29 -7.039 13.952 5.495 1.00 0.00 N ATOM 0 H GLN A 29 -9.988 10.350 7.490 1.00 0.00 H new ATOM 0 HA GLN A 29 -9.284 12.439 5.551 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.853 10.836 7.137 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.995 9.698 5.812 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.009 10.884 5.270 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.215 11.680 4.279 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -7.572 13.942 4.626 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -6.840 14.837 5.962 1.00 0.00 H new ATOM 501 N LEU A 30 -10.263 9.479 4.399 1.00 0.00 N ATOM 502 CA LEU A 30 -10.823 8.861 3.143 1.00 0.00 C ATOM 503 C LEU A 30 -12.139 9.577 2.777 1.00 0.00 C ATOM 504 O LEU A 30 -12.458 9.727 1.613 1.00 0.00 O ATOM 505 CB LEU A 30 -11.085 7.370 3.444 1.00 0.00 C ATOM 506 CG LEU A 30 -10.608 6.511 2.261 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.787 5.326 2.780 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.821 5.987 1.485 1.00 0.00 C ATOM 0 H LEU A 30 -10.194 8.856 5.203 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.133 8.958 2.305 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -10.562 7.075 4.354 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -12.148 7.206 3.620 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.989 7.120 1.603 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.451 4.720 1.939 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.921 5.696 3.329 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -10.404 4.718 3.442 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -11.482 5.378 0.647 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.441 5.381 2.145 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.404 6.828 1.110 1.00 0.00 H new ATOM 520 N ARG A 31 -12.905 10.033 3.760 1.00 0.00 N ATOM 521 CA ARG A 31 -14.193 10.751 3.440 1.00 0.00 C ATOM 522 C ARG A 31 -13.911 11.957 2.533 1.00 0.00 C ATOM 523 O ARG A 31 -14.661 12.230 1.614 1.00 0.00 O ATOM 524 CB ARG A 31 -14.772 11.245 4.778 1.00 0.00 C ATOM 525 CG ARG A 31 -15.675 10.173 5.388 1.00 0.00 C ATOM 526 CD ARG A 31 -15.832 10.440 6.896 1.00 0.00 C ATOM 527 NE ARG A 31 -17.071 9.699 7.335 1.00 0.00 N ATOM 528 CZ ARG A 31 -17.746 10.073 8.412 1.00 0.00 C ATOM 529 NH1 ARG A 31 -17.352 11.079 9.160 1.00 0.00 N ATOM 530 NH2 ARG A 31 -18.826 9.418 8.756 1.00 0.00 N ATOM 0 H ARG A 31 -12.695 9.939 4.754 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.888 10.088 2.924 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -13.962 11.484 5.467 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -15.339 12.163 4.621 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -16.650 10.183 4.902 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -15.247 9.184 5.224 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -14.957 10.092 7.445 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -15.928 11.508 7.093 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.394 8.897 6.794 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -16.506 11.595 8.917 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -17.892 11.344 9.984 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.142 8.626 8.196 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -19.351 9.700 9.584 1.00 0.00 H new ATOM 544 N ASP A 32 -12.838 12.688 2.781 1.00 0.00 N ATOM 545 CA ASP A 32 -12.540 13.878 1.907 1.00 0.00 C ATOM 546 C ASP A 32 -12.287 13.405 0.471 1.00 0.00 C ATOM 547 O ASP A 32 -12.894 13.901 -0.461 1.00 0.00 O ATOM 548 CB ASP A 32 -11.283 14.553 2.477 1.00 0.00 C ATOM 549 CG ASP A 32 -11.680 15.484 3.623 1.00 0.00 C ATOM 550 OD1 ASP A 32 -12.544 15.107 4.396 1.00 0.00 O ATOM 551 OD2 ASP A 32 -11.112 16.561 3.710 1.00 0.00 O ATOM 0 H ASP A 32 -12.171 12.516 3.533 1.00 0.00 H new ATOM 0 HA ASP A 32 -13.375 14.579 1.892 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -10.582 13.798 2.833 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -10.774 15.117 1.696 1.00 0.00 H new ATOM 556 N ALA A 33 -11.414 12.437 0.283 1.00 0.00 N ATOM 557 CA ALA A 33 -11.161 11.937 -1.113 1.00 0.00 C ATOM 558 C ALA A 33 -12.433 11.266 -1.644 1.00 0.00 C ATOM 559 O ALA A 33 -12.791 11.437 -2.795 1.00 0.00 O ATOM 560 CB ALA A 33 -10.019 10.915 -1.023 1.00 0.00 C ATOM 0 H ALA A 33 -10.876 11.980 1.019 1.00 0.00 H new ATOM 0 HA ALA A 33 -10.893 12.750 -1.788 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.801 10.525 -2.017 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.129 11.398 -0.620 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.315 10.095 -0.368 1.00 0.00 H new ATOM 566 N GLN A 34 -13.131 10.510 -0.816 1.00 0.00 N ATOM 567 CA GLN A 34 -14.391 9.848 -1.300 1.00 0.00 C ATOM 568 C GLN A 34 -15.418 10.921 -1.700 1.00 0.00 C ATOM 569 O GLN A 34 -16.127 10.764 -2.676 1.00 0.00 O ATOM 570 CB GLN A 34 -14.932 9.006 -0.132 1.00 0.00 C ATOM 571 CG GLN A 34 -14.304 7.612 -0.173 1.00 0.00 C ATOM 572 CD GLN A 34 -15.107 6.716 -1.125 1.00 0.00 C ATOM 573 OE1 GLN A 34 -14.890 6.740 -2.320 1.00 0.00 O ATOM 574 NE2 GLN A 34 -16.034 5.920 -0.649 1.00 0.00 N ATOM 0 H GLN A 34 -12.886 10.327 0.157 1.00 0.00 H new ATOM 0 HA GLN A 34 -14.199 9.222 -2.171 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.703 9.492 0.817 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -16.017 8.929 -0.197 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -13.268 7.678 -0.506 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -14.290 7.178 0.827 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -16.220 5.896 0.354 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -16.569 5.325 -1.281 1.00 0.00 H new ATOM 583 N LYS A 35 -15.506 12.014 -0.959 1.00 0.00 N ATOM 584 CA LYS A 35 -16.502 13.084 -1.330 1.00 0.00 C ATOM 585 C LYS A 35 -16.194 13.625 -2.734 1.00 0.00 C ATOM 586 O LYS A 35 -17.096 13.889 -3.509 1.00 0.00 O ATOM 587 CB LYS A 35 -16.363 14.205 -0.288 1.00 0.00 C ATOM 588 CG LYS A 35 -16.969 13.745 1.039 1.00 0.00 C ATOM 589 CD LYS A 35 -18.428 14.199 1.121 1.00 0.00 C ATOM 590 CE LYS A 35 -18.865 14.255 2.587 1.00 0.00 C ATOM 591 NZ LYS A 35 -19.485 12.928 2.854 1.00 0.00 N ATOM 0 H LYS A 35 -14.943 12.207 -0.131 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.517 12.687 -1.341 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -15.312 14.461 -0.151 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -16.867 15.106 -0.638 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -16.910 12.660 1.121 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -16.401 14.159 1.873 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -18.541 15.180 0.659 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -19.066 13.510 0.567 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -18.015 14.434 3.246 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -19.575 15.064 2.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -19.810 12.889 3.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -20.295 12.789 2.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -18.783 12.178 2.691 1.00 0.00 H new ATOM 605 N ASP A 36 -14.931 13.792 -3.075 1.00 0.00 N ATOM 606 CA ASP A 36 -14.590 14.319 -4.448 1.00 0.00 C ATOM 607 C ASP A 36 -15.179 13.397 -5.530 1.00 0.00 C ATOM 608 O ASP A 36 -15.658 13.862 -6.547 1.00 0.00 O ATOM 609 CB ASP A 36 -13.056 14.333 -4.548 1.00 0.00 C ATOM 610 CG ASP A 36 -12.523 15.668 -4.025 1.00 0.00 C ATOM 611 OD1 ASP A 36 -13.087 16.690 -4.382 1.00 0.00 O ATOM 612 OD2 ASP A 36 -11.560 15.646 -3.276 1.00 0.00 O ATOM 0 H ASP A 36 -14.132 13.590 -2.474 1.00 0.00 H new ATOM 0 HA ASP A 36 -15.003 15.316 -4.598 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -12.636 13.510 -3.970 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -12.747 14.186 -5.583 1.00 0.00 H new ATOM 617 N LYS A 37 -15.152 12.092 -5.322 1.00 0.00 N ATOM 618 CA LYS A 37 -15.723 11.157 -6.361 1.00 0.00 C ATOM 619 C LYS A 37 -17.192 11.514 -6.656 1.00 0.00 C ATOM 620 O LYS A 37 -17.631 11.434 -7.788 1.00 0.00 O ATOM 621 CB LYS A 37 -15.635 9.738 -5.778 1.00 0.00 C ATOM 622 CG LYS A 37 -15.993 8.718 -6.860 1.00 0.00 C ATOM 623 CD LYS A 37 -15.935 7.307 -6.271 1.00 0.00 C ATOM 624 CE LYS A 37 -15.998 6.278 -7.402 1.00 0.00 C ATOM 625 NZ LYS A 37 -17.443 5.939 -7.533 1.00 0.00 N ATOM 0 H LYS A 37 -14.766 11.640 -4.493 1.00 0.00 H new ATOM 0 HA LYS A 37 -15.169 11.234 -7.297 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -14.629 9.549 -5.404 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -16.314 9.639 -4.931 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -16.991 8.920 -7.249 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -15.301 8.803 -7.698 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -15.016 7.178 -5.699 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -16.765 7.155 -5.581 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -15.603 6.688 -8.331 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -15.405 5.395 -7.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -17.568 5.237 -8.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -17.790 5.545 -6.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -17.981 6.798 -7.765 1.00 0.00 H new ATOM 639 N SER A 38 -17.953 11.909 -5.654 1.00 0.00 N ATOM 640 CA SER A 38 -19.385 12.268 -5.904 1.00 0.00 C ATOM 641 C SER A 38 -19.588 13.786 -5.755 1.00 0.00 C ATOM 642 O SER A 38 -20.588 14.230 -5.224 1.00 0.00 O ATOM 643 CB SER A 38 -20.185 11.514 -4.839 1.00 0.00 C ATOM 644 OG SER A 38 -19.774 11.944 -3.548 1.00 0.00 O ATOM 0 H SER A 38 -17.644 11.996 -4.686 1.00 0.00 H new ATOM 0 HA SER A 38 -19.702 12.001 -6.912 1.00 0.00 H new ATOM 0 HB2 SER A 38 -21.251 11.696 -4.973 1.00 0.00 H new ATOM 0 HB3 SER A 38 -20.029 10.440 -4.944 1.00 0.00 H new ATOM 0 HG SER A 38 -20.286 11.463 -2.865 1.00 0.00 H new ATOM 650 N SER A 39 -18.649 14.586 -6.221 1.00 0.00 N ATOM 651 CA SER A 39 -18.801 16.069 -6.104 1.00 0.00 C ATOM 652 C SER A 39 -18.115 16.769 -7.290 1.00 0.00 C ATOM 653 O SER A 39 -18.752 17.480 -8.044 1.00 0.00 O ATOM 654 CB SER A 39 -18.106 16.436 -4.793 1.00 0.00 C ATOM 655 OG SER A 39 -19.006 16.229 -3.711 1.00 0.00 O ATOM 0 H SER A 39 -17.790 14.273 -6.674 1.00 0.00 H new ATOM 0 HA SER A 39 -19.846 16.378 -6.113 1.00 0.00 H new ATOM 0 HB2 SER A 39 -17.212 15.827 -4.659 1.00 0.00 H new ATOM 0 HB3 SER A 39 -17.782 17.477 -4.818 1.00 0.00 H new ATOM 0 HG SER A 39 -19.751 15.665 -4.008 1.00 0.00 H new ATOM 661 N LYS A 40 -16.824 16.570 -7.464 1.00 0.00 N ATOM 662 CA LYS A 40 -16.111 17.219 -8.602 1.00 0.00 C ATOM 663 C LYS A 40 -15.141 16.219 -9.251 1.00 0.00 C ATOM 664 O LYS A 40 -14.067 15.974 -8.736 1.00 0.00 O ATOM 665 CB LYS A 40 -15.343 18.385 -7.977 1.00 0.00 C ATOM 666 CG LYS A 40 -15.232 19.526 -8.991 1.00 0.00 C ATOM 667 CD LYS A 40 -15.282 20.867 -8.257 1.00 0.00 C ATOM 668 CE LYS A 40 -13.885 21.221 -7.743 1.00 0.00 C ATOM 669 NZ LYS A 40 -14.103 22.323 -6.765 1.00 0.00 N ATOM 0 H LYS A 40 -16.241 15.986 -6.865 1.00 0.00 H new ATOM 0 HA LYS A 40 -16.793 17.556 -9.382 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -15.854 18.731 -7.079 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -14.349 18.058 -7.672 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -14.301 19.440 -9.551 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -16.045 19.465 -9.714 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -15.643 21.647 -8.927 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -15.984 20.812 -7.425 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -13.409 20.362 -7.270 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -13.233 21.539 -8.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -13.189 22.621 -6.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -14.551 23.129 -7.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -14.721 21.989 -5.998 1.00 0.00 H new ATOM 683 N LEU A 41 -15.508 15.637 -10.376 1.00 0.00 N ATOM 684 CA LEU A 41 -14.598 14.654 -11.040 1.00 0.00 C ATOM 685 C LEU A 41 -14.104 15.211 -12.386 1.00 0.00 C ATOM 686 O LEU A 41 -14.179 14.543 -13.400 1.00 0.00 O ATOM 687 CB LEU A 41 -15.450 13.401 -11.256 1.00 0.00 C ATOM 688 CG LEU A 41 -14.537 12.183 -11.408 1.00 0.00 C ATOM 689 CD1 LEU A 41 -14.166 11.647 -10.025 1.00 0.00 C ATOM 690 CD2 LEU A 41 -15.268 11.094 -12.196 1.00 0.00 C ATOM 0 H LEU A 41 -16.393 15.802 -10.856 1.00 0.00 H new ATOM 0 HA LEU A 41 -13.713 14.443 -10.440 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -16.127 13.259 -10.413 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -16.069 13.518 -12.146 1.00 0.00 H new ATOM 0 HG LEU A 41 -13.631 12.473 -11.940 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -13.516 10.779 -10.134 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -13.646 12.422 -9.462 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -15.072 11.357 -9.492 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -14.618 10.226 -12.305 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -16.174 10.805 -11.663 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -15.533 11.475 -13.182 1.00 0.00 H new ATOM 702 N ALA A 42 -13.598 16.429 -12.405 1.00 0.00 N ATOM 703 CA ALA A 42 -13.103 17.014 -13.686 1.00 0.00 C ATOM 704 C ALA A 42 -11.600 17.314 -13.586 1.00 0.00 C ATOM 705 O ALA A 42 -10.814 16.820 -14.374 1.00 0.00 O ATOM 706 CB ALA A 42 -13.898 18.308 -13.865 1.00 0.00 C ATOM 0 H ALA A 42 -13.510 17.035 -11.589 1.00 0.00 H new ATOM 0 HA ALA A 42 -13.236 16.335 -14.528 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -13.591 18.799 -14.788 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -14.962 18.077 -13.913 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -13.709 18.971 -13.021 1.00 0.00 H new ATOM 712 N ALA A 43 -11.188 18.117 -12.625 1.00 0.00 N ATOM 713 CA ALA A 43 -9.736 18.438 -12.486 1.00 0.00 C ATOM 714 C ALA A 43 -9.234 18.030 -11.092 1.00 0.00 C ATOM 715 O ALA A 43 -9.981 18.045 -10.133 1.00 0.00 O ATOM 716 CB ALA A 43 -9.646 19.953 -12.667 1.00 0.00 C ATOM 0 H ALA A 43 -11.797 18.559 -11.937 1.00 0.00 H new ATOM 0 HA ALA A 43 -9.123 17.904 -13.213 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.607 20.269 -12.578 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -10.025 20.225 -13.652 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -10.242 20.447 -11.900 1.00 0.00 H new ATOM 722 N LYS A 44 -7.970 17.662 -10.965 1.00 0.00 N ATOM 723 CA LYS A 44 -7.424 17.252 -9.628 1.00 0.00 C ATOM 724 C LYS A 44 -8.303 16.163 -8.989 1.00 0.00 C ATOM 725 O LYS A 44 -8.679 16.265 -7.835 1.00 0.00 O ATOM 726 CB LYS A 44 -7.438 18.525 -8.775 1.00 0.00 C ATOM 727 CG LYS A 44 -6.076 19.217 -8.864 1.00 0.00 C ATOM 728 CD LYS A 44 -5.775 19.924 -7.541 1.00 0.00 C ATOM 729 CE LYS A 44 -6.285 21.365 -7.604 1.00 0.00 C ATOM 730 NZ LYS A 44 -5.295 22.157 -6.822 1.00 0.00 N ATOM 0 H LYS A 44 -7.298 17.630 -11.732 1.00 0.00 H new ATOM 0 HA LYS A 44 -6.422 16.832 -9.714 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -8.223 19.198 -9.121 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -7.665 18.278 -7.738 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -5.298 18.485 -9.083 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -6.075 19.937 -9.682 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -6.252 19.394 -6.717 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -4.702 19.915 -7.348 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -6.348 21.717 -8.634 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -7.284 21.449 -7.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -5.576 23.158 -6.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -5.262 21.803 -5.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -4.355 22.063 -7.256 1.00 0.00 H new ATOM 744 N SER A 45 -8.635 15.121 -9.726 1.00 0.00 N ATOM 745 CA SER A 45 -9.490 14.036 -9.146 1.00 0.00 C ATOM 746 C SER A 45 -8.678 12.745 -8.972 1.00 0.00 C ATOM 747 O SER A 45 -8.644 12.174 -7.898 1.00 0.00 O ATOM 748 CB SER A 45 -10.620 13.829 -10.155 1.00 0.00 C ATOM 749 OG SER A 45 -10.115 14.014 -11.471 1.00 0.00 O ATOM 0 H SER A 45 -8.352 14.979 -10.696 1.00 0.00 H new ATOM 0 HA SER A 45 -9.871 14.302 -8.160 1.00 0.00 H new ATOM 0 HB2 SER A 45 -11.037 12.827 -10.051 1.00 0.00 H new ATOM 0 HB3 SER A 45 -11.429 14.533 -9.961 1.00 0.00 H new ATOM 0 HG SER A 45 -10.837 13.880 -12.120 1.00 0.00 H new ATOM 755 N ASN A 46 -8.021 12.278 -10.013 1.00 0.00 N ATOM 756 CA ASN A 46 -7.208 11.010 -9.881 1.00 0.00 C ATOM 757 C ASN A 46 -6.183 11.154 -8.743 1.00 0.00 C ATOM 758 O ASN A 46 -5.935 10.215 -8.010 1.00 0.00 O ATOM 759 CB ASN A 46 -6.481 10.808 -11.220 1.00 0.00 C ATOM 760 CG ASN A 46 -7.450 10.201 -12.242 1.00 0.00 C ATOM 761 OD1 ASN A 46 -8.454 10.802 -12.571 1.00 0.00 O ATOM 762 ND2 ASN A 46 -7.197 9.026 -12.766 1.00 0.00 N ATOM 0 H ASN A 46 -8.009 12.709 -10.937 1.00 0.00 H new ATOM 0 HA ASN A 46 -7.848 10.159 -9.648 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -6.100 11.761 -11.586 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -5.621 10.152 -11.084 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -7.841 8.621 -13.446 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -6.356 8.517 -12.494 1.00 0.00 H new ATOM 769 N GLU A 47 -5.589 12.322 -8.582 1.00 0.00 N ATOM 770 CA GLU A 47 -4.584 12.498 -7.472 1.00 0.00 C ATOM 771 C GLU A 47 -5.260 12.256 -6.114 1.00 0.00 C ATOM 772 O GLU A 47 -4.688 11.629 -5.240 1.00 0.00 O ATOM 773 CB GLU A 47 -4.072 13.945 -7.557 1.00 0.00 C ATOM 774 CG GLU A 47 -3.228 14.115 -8.822 1.00 0.00 C ATOM 775 CD GLU A 47 -2.167 15.192 -8.588 1.00 0.00 C ATOM 776 OE1 GLU A 47 -2.545 16.317 -8.308 1.00 0.00 O ATOM 777 OE2 GLU A 47 -0.994 14.871 -8.691 1.00 0.00 O ATOM 0 H GLU A 47 -5.752 13.147 -9.160 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.762 11.789 -7.570 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.912 14.639 -7.572 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.477 14.184 -6.675 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.751 13.170 -9.083 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.865 14.393 -9.662 1.00 0.00 H new ATOM 784 N GLN A 48 -6.474 12.739 -5.926 1.00 0.00 N ATOM 785 CA GLN A 48 -7.165 12.510 -4.606 1.00 0.00 C ATOM 786 C GLN A 48 -7.378 11.006 -4.384 1.00 0.00 C ATOM 787 O GLN A 48 -7.211 10.512 -3.285 1.00 0.00 O ATOM 788 CB GLN A 48 -8.520 13.232 -4.679 1.00 0.00 C ATOM 789 CG GLN A 48 -9.040 13.496 -3.263 1.00 0.00 C ATOM 790 CD GLN A 48 -8.090 14.456 -2.535 1.00 0.00 C ATOM 791 OE1 GLN A 48 -7.825 15.540 -3.014 1.00 0.00 O ATOM 792 NE2 GLN A 48 -7.561 14.105 -1.388 1.00 0.00 N ATOM 0 H GLN A 48 -7.007 13.271 -6.614 1.00 0.00 H new ATOM 0 HA GLN A 48 -6.567 12.891 -3.778 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.413 14.173 -5.219 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.237 12.626 -5.233 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -10.042 13.924 -3.307 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -9.117 12.558 -2.713 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -7.781 13.195 -0.982 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -6.930 14.741 -0.902 1.00 0.00 H new ATOM 801 N LEU A 49 -7.744 10.269 -5.417 1.00 0.00 N ATOM 802 CA LEU A 49 -7.960 8.788 -5.234 1.00 0.00 C ATOM 803 C LEU A 49 -6.670 8.120 -4.735 1.00 0.00 C ATOM 804 O LEU A 49 -6.718 7.223 -3.913 1.00 0.00 O ATOM 805 CB LEU A 49 -8.352 8.220 -6.608 1.00 0.00 C ATOM 806 CG LEU A 49 -9.873 8.269 -6.766 1.00 0.00 C ATOM 807 CD1 LEU A 49 -10.254 7.822 -8.178 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.522 7.333 -5.743 1.00 0.00 C ATOM 0 H LEU A 49 -7.900 10.621 -6.362 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.739 8.598 -4.496 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.875 8.796 -7.401 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -7.999 7.193 -6.703 1.00 0.00 H new ATOM 0 HG LEU A 49 -10.223 9.288 -6.601 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.338 7.857 -8.291 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.792 8.487 -8.907 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.905 6.803 -8.344 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.606 7.367 -5.855 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.172 6.314 -5.909 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.251 7.650 -4.736 1.00 0.00 H new ATOM 820 N TRP A 50 -5.514 8.543 -5.215 1.00 0.00 N ATOM 821 CA TRP A 50 -4.234 7.902 -4.736 1.00 0.00 C ATOM 822 C TRP A 50 -4.110 8.044 -3.211 1.00 0.00 C ATOM 823 O TRP A 50 -3.645 7.137 -2.545 1.00 0.00 O ATOM 824 CB TRP A 50 -3.071 8.620 -5.451 1.00 0.00 C ATOM 825 CG TRP A 50 -3.134 8.391 -6.942 1.00 0.00 C ATOM 826 CD1 TRP A 50 -3.861 7.431 -7.577 1.00 0.00 C ATOM 827 CD2 TRP A 50 -2.436 9.123 -7.993 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.659 7.543 -8.941 1.00 0.00 N ATOM 829 CE2 TRP A 50 -2.792 8.567 -9.244 1.00 0.00 C ATOM 830 CE3 TRP A 50 -1.541 10.209 -7.985 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -2.282 9.066 -10.439 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -1.021 10.711 -9.191 1.00 0.00 C ATOM 833 CH2 TRP A 50 -1.395 10.139 -10.416 1.00 0.00 C ATOM 0 H TRP A 50 -5.401 9.288 -5.903 1.00 0.00 H new ATOM 0 HA TRP A 50 -4.220 6.837 -4.965 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -3.113 9.689 -5.241 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -2.120 8.256 -5.063 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.493 6.700 -7.094 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -4.099 6.940 -9.636 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -1.252 10.659 -7.047 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.573 8.623 -11.380 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -0.330 11.541 -9.174 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -0.996 10.530 -11.340 1.00 0.00 H new ATOM 844 N GLU A 51 -4.538 9.153 -2.646 1.00 0.00 N ATOM 845 CA GLU A 51 -4.449 9.297 -1.150 1.00 0.00 C ATOM 846 C GLU A 51 -5.315 8.222 -0.465 1.00 0.00 C ATOM 847 O GLU A 51 -4.999 7.780 0.623 1.00 0.00 O ATOM 848 CB GLU A 51 -4.967 10.701 -0.802 1.00 0.00 C ATOM 849 CG GLU A 51 -4.517 11.076 0.612 1.00 0.00 C ATOM 850 CD GLU A 51 -4.869 12.538 0.890 1.00 0.00 C ATOM 851 OE1 GLU A 51 -4.129 13.401 0.445 1.00 0.00 O ATOM 852 OE2 GLU A 51 -5.874 12.772 1.542 1.00 0.00 O ATOM 0 H GLU A 51 -4.937 9.950 -3.142 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.423 9.168 -0.805 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -4.588 11.428 -1.520 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -6.055 10.725 -0.867 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -5.002 10.429 1.343 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.443 10.924 0.715 1.00 0.00 H new ATOM 859 N ILE A 52 -6.401 7.786 -1.088 1.00 0.00 N ATOM 860 CA ILE A 52 -7.250 6.729 -0.436 1.00 0.00 C ATOM 861 C ILE A 52 -6.513 5.383 -0.478 1.00 0.00 C ATOM 862 O ILE A 52 -6.266 4.791 0.556 1.00 0.00 O ATOM 863 CB ILE A 52 -8.577 6.676 -1.214 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.277 8.033 -1.065 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.472 5.569 -0.640 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.600 8.050 -1.838 1.00 0.00 C ATOM 0 H ILE A 52 -6.726 8.111 -1.999 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.448 6.955 0.612 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.386 6.463 -2.266 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.464 8.237 -0.011 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.625 8.826 -1.433 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.410 5.536 -1.194 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.964 4.608 -0.728 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.678 5.776 0.410 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -11.079 9.022 -1.718 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.406 7.869 -2.895 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.257 7.271 -1.451 1.00 0.00 H new ATOM 878 N MET A 53 -6.133 4.895 -1.647 1.00 0.00 N ATOM 879 CA MET A 53 -5.383 3.586 -1.669 1.00 0.00 C ATOM 880 C MET A 53 -4.065 3.729 -0.883 1.00 0.00 C ATOM 881 O MET A 53 -3.598 2.773 -0.290 1.00 0.00 O ATOM 882 CB MET A 53 -5.120 3.194 -3.139 1.00 0.00 C ATOM 883 CG MET A 53 -4.329 4.280 -3.875 1.00 0.00 C ATOM 884 SD MET A 53 -4.939 4.407 -5.578 1.00 0.00 S ATOM 885 CE MET A 53 -4.372 2.787 -6.145 1.00 0.00 C ATOM 0 H MET A 53 -6.302 5.328 -2.555 1.00 0.00 H new ATOM 0 HA MET A 53 -5.971 2.801 -1.194 1.00 0.00 H new ATOM 0 HB2 MET A 53 -4.569 2.254 -3.173 1.00 0.00 H new ATOM 0 HB3 MET A 53 -6.069 3.026 -3.648 1.00 0.00 H new ATOM 0 HG2 MET A 53 -4.439 5.237 -3.364 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.266 4.038 -3.873 1.00 0.00 H new ATOM 0 HE1 MET A 53 -3.869 2.893 -7.106 1.00 0.00 H new ATOM 0 HE2 MET A 53 -3.677 2.369 -5.416 1.00 0.00 H new ATOM 0 HE3 MET A 53 -5.227 2.120 -6.255 1.00 0.00 H new ATOM 895 N GLN A 54 -3.473 4.915 -0.834 1.00 0.00 N ATOM 896 CA GLN A 54 -2.207 5.075 -0.032 1.00 0.00 C ATOM 897 C GLN A 54 -2.535 4.917 1.463 1.00 0.00 C ATOM 898 O GLN A 54 -1.767 4.335 2.206 1.00 0.00 O ATOM 899 CB GLN A 54 -1.670 6.487 -0.318 1.00 0.00 C ATOM 900 CG GLN A 54 -0.831 6.466 -1.597 1.00 0.00 C ATOM 901 CD GLN A 54 0.052 7.719 -1.653 1.00 0.00 C ATOM 902 OE1 GLN A 54 1.024 7.818 -0.932 1.00 0.00 O ATOM 903 NE2 GLN A 54 -0.243 8.690 -2.483 1.00 0.00 N ATOM 0 H GLN A 54 -3.805 5.757 -1.304 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.463 4.325 -0.300 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.498 7.187 -0.425 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -1.066 6.834 0.520 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -0.211 5.570 -1.622 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -1.482 6.428 -2.470 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -1.058 8.611 -3.091 1.00 0.00 H new ATOM 0 HE22 GLN A 54 0.343 9.524 -2.521 1.00 0.00 H new ATOM 912 N LEU A 55 -3.680 5.412 1.916 1.00 0.00 N ATOM 913 CA LEU A 55 -4.042 5.252 3.375 1.00 0.00 C ATOM 914 C LEU A 55 -3.954 3.768 3.785 1.00 0.00 C ATOM 915 O LEU A 55 -3.627 3.458 4.915 1.00 0.00 O ATOM 916 CB LEU A 55 -5.487 5.754 3.541 1.00 0.00 C ATOM 917 CG LEU A 55 -5.480 7.250 3.866 1.00 0.00 C ATOM 918 CD1 LEU A 55 -6.894 7.818 3.696 1.00 0.00 C ATOM 919 CD2 LEU A 55 -5.019 7.453 5.314 1.00 0.00 C ATOM 0 H LEU A 55 -4.366 5.910 1.349 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.356 5.818 4.006 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.052 5.573 2.627 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.985 5.201 4.338 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.799 7.766 3.190 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.889 8.883 3.928 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.224 7.672 2.667 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.577 7.303 4.372 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.013 8.518 5.548 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.702 6.937 5.989 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -4.014 7.049 5.436 1.00 0.00 H new ATOM 931 N HIS A 56 -4.235 2.844 2.877 1.00 0.00 N ATOM 932 CA HIS A 56 -4.149 1.382 3.245 1.00 0.00 C ATOM 933 C HIS A 56 -2.754 1.068 3.813 1.00 0.00 C ATOM 934 O HIS A 56 -2.626 0.319 4.764 1.00 0.00 O ATOM 935 CB HIS A 56 -4.383 0.584 1.953 1.00 0.00 C ATOM 936 CG HIS A 56 -4.424 -0.884 2.274 1.00 0.00 C ATOM 937 ND1 HIS A 56 -5.569 -1.506 2.745 1.00 0.00 N ATOM 938 CD2 HIS A 56 -3.467 -1.865 2.201 1.00 0.00 C ATOM 939 CE1 HIS A 56 -5.275 -2.805 2.937 1.00 0.00 C ATOM 940 NE2 HIS A 56 -4.006 -3.077 2.621 1.00 0.00 N ATOM 0 H HIS A 56 -4.515 3.036 1.915 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.888 1.123 4.003 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -5.319 0.892 1.487 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.587 0.789 1.237 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -6.471 -1.060 2.915 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -2.450 -1.718 1.868 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -5.979 -3.538 3.302 1.00 0.00 H new ATOM 948 N HIS A 57 -1.706 1.645 3.251 1.00 0.00 N ATOM 949 CA HIS A 57 -0.326 1.372 3.798 1.00 0.00 C ATOM 950 C HIS A 57 -0.266 1.804 5.267 1.00 0.00 C ATOM 951 O HIS A 57 0.204 1.066 6.113 1.00 0.00 O ATOM 952 CB HIS A 57 0.663 2.198 2.961 1.00 0.00 C ATOM 953 CG HIS A 57 1.134 1.381 1.791 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.303 1.677 1.109 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.613 0.269 1.179 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.447 0.759 0.137 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.444 -0.124 0.136 1.00 0.00 N ATOM 0 H HIS A 57 -1.744 2.280 2.454 1.00 0.00 H new ATOM 0 HA HIS A 57 -0.081 0.311 3.743 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.184 3.112 2.610 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.513 2.498 3.574 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -0.304 -0.226 1.464 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.273 0.738 -0.558 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.316 -0.916 -0.494 1.00 0.00 H new ATOM 965 N GLN A 58 -0.759 2.985 5.585 1.00 0.00 N ATOM 966 CA GLN A 58 -0.741 3.432 7.023 1.00 0.00 C ATOM 967 C GLN A 58 -1.539 2.431 7.883 1.00 0.00 C ATOM 968 O GLN A 58 -1.179 2.163 9.014 1.00 0.00 O ATOM 969 CB GLN A 58 -1.397 4.822 7.065 1.00 0.00 C ATOM 970 CG GLN A 58 -1.113 5.482 8.417 1.00 0.00 C ATOM 971 CD GLN A 58 0.262 6.158 8.378 1.00 0.00 C ATOM 972 OE1 GLN A 58 1.218 5.635 8.917 1.00 0.00 O ATOM 973 NE2 GLN A 58 0.410 7.306 7.764 1.00 0.00 N ATOM 0 H GLN A 58 -1.166 3.648 4.925 1.00 0.00 H new ATOM 0 HA GLN A 58 0.275 3.476 7.416 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -1.010 5.443 6.257 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.472 4.733 6.911 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.885 6.217 8.644 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -1.141 4.736 9.211 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -0.389 7.748 7.310 1.00 0.00 H new ATOM 0 HE22 GLN A 58 1.324 7.757 7.740 1.00 0.00 H new ATOM 982 N ARG A 59 -2.608 1.856 7.352 1.00 0.00 N ATOM 983 CA ARG A 59 -3.394 0.858 8.161 1.00 0.00 C ATOM 984 C ARG A 59 -2.521 -0.375 8.427 1.00 0.00 C ATOM 985 O ARG A 59 -2.346 -0.776 9.563 1.00 0.00 O ATOM 986 CB ARG A 59 -4.619 0.462 7.322 1.00 0.00 C ATOM 987 CG ARG A 59 -5.679 1.560 7.412 1.00 0.00 C ATOM 988 CD ARG A 59 -6.302 1.556 8.811 1.00 0.00 C ATOM 989 NE ARG A 59 -7.583 0.797 8.664 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.606 1.293 7.984 1.00 0.00 C ATOM 991 NH1 ARG A 59 -8.536 2.466 7.399 1.00 0.00 N ATOM 992 NH2 ARG A 59 -9.714 0.603 7.888 1.00 0.00 N ATOM 0 H ARG A 59 -2.962 2.033 6.412 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.703 1.278 9.118 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.327 0.309 6.283 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.028 -0.483 7.681 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -5.230 2.531 7.205 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -6.450 1.398 6.659 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -5.642 1.079 9.535 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -6.483 2.571 9.165 1.00 0.00 H new ATOM 0 HE ARG A 59 -7.671 -0.122 9.097 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -7.680 3.017 7.462 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -9.337 2.826 6.881 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -9.786 -0.311 8.335 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -10.505 0.979 7.366 1.00 0.00 H new ATOM 1006 N SER A 60 -1.957 -0.975 7.393 1.00 0.00 N ATOM 1007 CA SER A 60 -1.084 -2.178 7.626 1.00 0.00 C ATOM 1008 C SER A 60 0.114 -1.776 8.494 1.00 0.00 C ATOM 1009 O SER A 60 0.520 -2.521 9.360 1.00 0.00 O ATOM 1010 CB SER A 60 -0.607 -2.662 6.248 1.00 0.00 C ATOM 1011 OG SER A 60 -0.132 -1.551 5.498 1.00 0.00 O ATOM 0 H SER A 60 -2.061 -0.690 6.419 1.00 0.00 H new ATOM 0 HA SER A 60 -1.627 -2.970 8.141 1.00 0.00 H new ATOM 0 HB2 SER A 60 0.185 -3.402 6.364 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.425 -3.150 5.718 1.00 0.00 H new ATOM 0 HG SER A 60 -0.212 -0.735 6.035 1.00 0.00 H new ATOM 1017 N ARG A 61 0.676 -0.600 8.287 1.00 0.00 N ATOM 1018 CA ARG A 61 1.839 -0.181 9.144 1.00 0.00 C ATOM 1019 C ARG A 61 1.365 -0.020 10.596 1.00 0.00 C ATOM 1020 O ARG A 61 2.045 -0.427 11.518 1.00 0.00 O ATOM 1021 CB ARG A 61 2.339 1.165 8.593 1.00 0.00 C ATOM 1022 CG ARG A 61 3.762 1.425 9.092 1.00 0.00 C ATOM 1023 CD ARG A 61 4.526 2.247 8.052 1.00 0.00 C ATOM 1024 NE ARG A 61 5.554 2.999 8.833 1.00 0.00 N ATOM 1025 CZ ARG A 61 6.635 2.396 9.307 1.00 0.00 C ATOM 1026 NH1 ARG A 61 6.845 1.115 9.112 1.00 0.00 N ATOM 1027 NH2 ARG A 61 7.515 3.088 9.986 1.00 0.00 N ATOM 0 H ARG A 61 0.387 0.073 7.578 1.00 0.00 H new ATOM 0 HA ARG A 61 2.638 -0.922 9.126 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.321 1.153 7.503 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.677 1.970 8.914 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.734 1.958 10.043 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.274 0.480 9.271 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.991 1.604 7.304 1.00 0.00 H new ATOM 0 HD3 ARG A 61 3.860 2.926 7.519 1.00 0.00 H new ATOM 0 HE ARG A 61 5.421 3.996 9.005 1.00 0.00 H new ATOM 0 HH11 ARG A 61 6.169 0.562 8.586 1.00 0.00 H new ATOM 0 HH12 ARG A 61 7.684 0.673 9.487 1.00 0.00 H new ATOM 0 HH21 ARG A 61 7.366 4.084 10.147 1.00 0.00 H new ATOM 0 HH22 ARG A 61 8.349 2.631 10.354 1.00 0.00 H new ATOM 1041 N TYR A 62 0.198 0.558 10.811 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.302 0.720 12.223 1.00 0.00 C ATOM 1043 C TYR A 62 -0.502 -0.665 12.860 1.00 0.00 C ATOM 1044 O TYR A 62 -0.030 -0.921 13.955 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.643 1.467 12.132 1.00 0.00 C ATOM 1046 CG TYR A 62 -2.219 1.665 13.515 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -2.948 0.635 14.121 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -2.024 2.876 14.191 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.482 0.814 15.401 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.558 3.056 15.473 1.00 0.00 C ATOM 1051 CZ TYR A 62 -3.287 2.025 16.078 1.00 0.00 C ATOM 1052 OH TYR A 62 -3.813 2.203 17.342 1.00 0.00 O ATOM 0 H TYR A 62 -0.420 0.919 10.084 1.00 0.00 H new ATOM 0 HA TYR A 62 0.407 1.273 12.839 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.499 2.433 11.648 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.342 0.902 11.515 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -3.098 -0.299 13.600 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.462 3.671 13.724 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -4.045 0.019 15.868 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.408 3.990 15.995 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.585 3.098 17.668 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.187 -1.567 12.183 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.392 -2.936 12.775 1.00 0.00 C ATOM 1064 C ILE A 63 -0.064 -3.712 12.743 1.00 0.00 C ATOM 1065 O ILE A 63 0.263 -4.417 13.679 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.464 -3.634 11.917 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.781 -2.856 12.029 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.678 -5.063 12.419 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.831 -3.471 11.099 1.00 0.00 C ATOM 0 H ILE A 63 -1.605 -1.419 11.265 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.717 -2.884 13.814 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.136 -3.662 10.878 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.138 -2.876 13.059 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.619 -1.810 11.768 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.437 -5.553 11.809 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.742 -5.617 12.348 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.007 -5.038 13.458 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.764 -2.913 11.184 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.475 -3.428 10.070 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.003 -4.510 11.381 1.00 0.00 H new ATOM 1081 N TYR A 64 0.714 -3.577 11.688 1.00 0.00 N ATOM 1082 CA TYR A 64 2.028 -4.304 11.639 1.00 0.00 C ATOM 1083 C TYR A 64 2.948 -3.737 12.726 1.00 0.00 C ATOM 1084 O TYR A 64 3.629 -4.473 13.410 1.00 0.00 O ATOM 1085 CB TYR A 64 2.634 -4.045 10.248 1.00 0.00 C ATOM 1086 CG TYR A 64 3.833 -4.939 10.030 1.00 0.00 C ATOM 1087 CD1 TYR A 64 5.014 -4.732 10.755 1.00 0.00 C ATOM 1088 CD2 TYR A 64 3.758 -5.979 9.099 1.00 0.00 C ATOM 1089 CE1 TYR A 64 6.118 -5.568 10.546 1.00 0.00 C ATOM 1090 CE2 TYR A 64 4.860 -6.814 8.889 1.00 0.00 C ATOM 1091 CZ TYR A 64 6.041 -6.609 9.613 1.00 0.00 C ATOM 1092 OH TYR A 64 7.128 -7.433 9.407 1.00 0.00 O ATOM 0 H TYR A 64 0.500 -3.004 10.872 1.00 0.00 H new ATOM 0 HA TYR A 64 1.903 -5.373 11.808 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.887 -4.231 9.477 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.929 -2.999 10.160 1.00 0.00 H new ATOM 0 HD1 TYR A 64 5.073 -3.929 11.474 1.00 0.00 H new ATOM 0 HD2 TYR A 64 2.847 -6.138 8.541 1.00 0.00 H new ATOM 0 HE1 TYR A 64 7.029 -5.410 11.105 1.00 0.00 H new ATOM 0 HE2 TYR A 64 4.800 -7.617 8.169 1.00 0.00 H new ATOM 0 HH TYR A 64 7.648 -7.501 10.235 1.00 0.00 H new ATOM 1102 N THR A 65 2.974 -2.430 12.896 1.00 0.00 N ATOM 1103 CA THR A 65 3.870 -1.844 13.952 1.00 0.00 C ATOM 1104 C THR A 65 3.470 -2.371 15.338 1.00 0.00 C ATOM 1105 O THR A 65 4.324 -2.681 16.148 1.00 0.00 O ATOM 1106 CB THR A 65 3.706 -0.314 13.888 1.00 0.00 C ATOM 1107 OG1 THR A 65 4.071 0.144 12.594 1.00 0.00 O ATOM 1108 CG2 THR A 65 4.608 0.356 14.931 1.00 0.00 C ATOM 0 H THR A 65 2.426 -1.757 12.361 1.00 0.00 H new ATOM 0 HA THR A 65 4.909 -2.125 13.781 1.00 0.00 H new ATOM 0 HB THR A 65 2.667 -0.059 14.095 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.270 0.441 12.114 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.485 1.438 14.878 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.333 0.008 15.927 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.648 0.099 14.731 1.00 0.00 H new ATOM 1116 N LEU A 66 2.189 -2.456 15.637 1.00 0.00 N ATOM 1117 CA LEU A 66 1.790 -2.949 17.001 1.00 0.00 C ATOM 1118 C LEU A 66 1.773 -4.493 17.090 1.00 0.00 C ATOM 1119 O LEU A 66 2.056 -5.046 18.137 1.00 0.00 O ATOM 1120 CB LEU A 66 0.405 -2.339 17.315 1.00 0.00 C ATOM 1121 CG LEU A 66 -0.696 -2.979 16.456 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.213 -4.252 17.139 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -1.850 -1.981 16.290 1.00 0.00 C ATOM 0 H LEU A 66 1.420 -2.212 15.013 1.00 0.00 H new ATOM 0 HA LEU A 66 2.525 -2.633 17.741 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.174 -2.481 18.371 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.430 -1.264 17.136 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.290 -3.238 15.478 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.994 -4.702 16.526 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.392 -4.959 17.259 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.621 -4.000 18.118 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.635 -2.430 15.681 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.253 -1.725 17.270 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.483 -1.078 15.801 1.00 0.00 H new ATOM 1135 N TYR A 67 1.435 -5.201 16.026 1.00 0.00 N ATOM 1136 CA TYR A 67 1.400 -6.709 16.119 1.00 0.00 C ATOM 1137 C TYR A 67 2.784 -7.335 15.844 1.00 0.00 C ATOM 1138 O TYR A 67 3.103 -8.372 16.398 1.00 0.00 O ATOM 1139 CB TYR A 67 0.373 -7.197 15.078 1.00 0.00 C ATOM 1140 CG TYR A 67 0.263 -8.711 15.139 1.00 0.00 C ATOM 1141 CD1 TYR A 67 1.213 -9.504 14.484 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -0.779 -9.321 15.856 1.00 0.00 C ATOM 1143 CE1 TYR A 67 1.124 -10.901 14.545 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -0.868 -10.718 15.915 1.00 0.00 C ATOM 1145 CZ TYR A 67 0.084 -11.507 15.260 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.002 -12.883 15.318 1.00 0.00 O ATOM 0 H TYR A 67 1.187 -4.811 15.117 1.00 0.00 H new ATOM 0 HA TYR A 67 1.120 -7.013 17.128 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.599 -6.744 15.272 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.677 -6.885 14.079 1.00 0.00 H new ATOM 0 HD1 TYR A 67 2.015 -9.038 13.931 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.513 -8.712 16.363 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.858 -11.511 14.040 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -1.671 -11.186 16.466 1.00 0.00 H new ATOM 0 HH TYR A 67 -0.781 -13.140 15.855 1.00 0.00 H new ATOM 1156 N TYR A 68 3.596 -6.748 14.988 1.00 0.00 N ATOM 1157 CA TYR A 68 4.935 -7.374 14.698 1.00 0.00 C ATOM 1158 C TYR A 68 6.076 -6.738 15.521 1.00 0.00 C ATOM 1159 O TYR A 68 7.110 -7.357 15.698 1.00 0.00 O ATOM 1160 CB TYR A 68 5.174 -7.188 13.189 1.00 0.00 C ATOM 1161 CG TYR A 68 4.614 -8.376 12.438 1.00 0.00 C ATOM 1162 CD1 TYR A 68 5.074 -9.665 12.735 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.635 -8.193 11.447 1.00 0.00 C ATOM 1164 CE1 TYR A 68 4.560 -10.770 12.046 1.00 0.00 C ATOM 1165 CE2 TYR A 68 3.123 -9.299 10.759 1.00 0.00 C ATOM 1166 CZ TYR A 68 3.586 -10.587 11.058 1.00 0.00 C ATOM 1167 OH TYR A 68 3.079 -11.676 10.378 1.00 0.00 O ATOM 0 H TYR A 68 3.397 -5.882 14.487 1.00 0.00 H new ATOM 0 HA TYR A 68 4.929 -8.427 14.981 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.698 -6.270 12.845 1.00 0.00 H new ATOM 0 HB3 TYR A 68 6.241 -7.088 12.989 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.826 -9.807 13.497 1.00 0.00 H new ATOM 0 HD2 TYR A 68 3.278 -7.200 11.216 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.915 -11.763 12.277 1.00 0.00 H new ATOM 0 HE2 TYR A 68 2.370 -9.159 9.997 1.00 0.00 H new ATOM 0 HH TYR A 68 2.411 -11.374 9.727 1.00 0.00 H new ATOM 1177 N LYS A 69 5.922 -5.528 16.029 1.00 0.00 N ATOM 1178 CA LYS A 69 7.033 -4.918 16.832 1.00 0.00 C ATOM 1179 C LYS A 69 6.576 -4.640 18.274 1.00 0.00 C ATOM 1180 O LYS A 69 7.151 -5.157 19.214 1.00 0.00 O ATOM 1181 CB LYS A 69 7.384 -3.603 16.131 1.00 0.00 C ATOM 1182 CG LYS A 69 7.789 -3.866 14.679 1.00 0.00 C ATOM 1183 CD LYS A 69 7.292 -2.716 13.792 1.00 0.00 C ATOM 1184 CE LYS A 69 8.483 -2.016 13.125 1.00 0.00 C ATOM 1185 NZ LYS A 69 7.978 -1.584 11.793 1.00 0.00 N ATOM 0 H LYS A 69 5.089 -4.949 15.923 1.00 0.00 H new ATOM 0 HA LYS A 69 7.890 -5.589 16.891 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.529 -2.928 16.160 1.00 0.00 H new ATOM 0 HB3 LYS A 69 8.199 -3.108 16.659 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.873 -3.956 14.603 1.00 0.00 H new ATOM 0 HG3 LYS A 69 7.366 -4.811 14.338 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.613 -3.100 13.031 1.00 0.00 H new ATOM 0 HD3 LYS A 69 6.728 -2.001 14.391 1.00 0.00 H new ATOM 0 HE2 LYS A 69 8.821 -1.164 13.715 1.00 0.00 H new ATOM 0 HE3 LYS A 69 9.333 -2.691 13.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 8.737 -1.096 11.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 7.670 -2.417 11.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 7.174 -0.937 11.920 1.00 0.00 H new ATOM 1199 N ARG A 70 5.554 -3.827 18.463 1.00 0.00 N ATOM 1200 CA ARG A 70 5.088 -3.532 19.868 1.00 0.00 C ATOM 1201 C ARG A 70 4.602 -4.815 20.565 1.00 0.00 C ATOM 1202 O ARG A 70 4.687 -4.928 21.772 1.00 0.00 O ATOM 1203 CB ARG A 70 3.931 -2.529 19.750 1.00 0.00 C ATOM 1204 CG ARG A 70 3.829 -1.712 21.041 1.00 0.00 C ATOM 1205 CD ARG A 70 2.514 -0.928 21.046 1.00 0.00 C ATOM 1206 NE ARG A 70 2.159 -0.781 22.491 1.00 0.00 N ATOM 1207 CZ ARG A 70 2.778 0.098 23.265 1.00 0.00 C ATOM 1208 NH1 ARG A 70 3.728 0.875 22.797 1.00 0.00 N ATOM 1209 NH2 ARG A 70 2.439 0.199 24.524 1.00 0.00 N ATOM 0 H ARG A 70 5.030 -3.362 17.721 1.00 0.00 H new ATOM 0 HA ARG A 70 5.906 -3.128 20.465 1.00 0.00 H new ATOM 0 HB2 ARG A 70 4.095 -1.867 18.900 1.00 0.00 H new ATOM 0 HB3 ARG A 70 2.995 -3.057 19.566 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.874 -2.373 21.907 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.673 -1.027 21.118 1.00 0.00 H new ATOM 0 HD2 ARG A 70 2.632 0.044 20.567 1.00 0.00 H new ATOM 0 HD3 ARG A 70 1.735 -1.460 20.500 1.00 0.00 H new ATOM 0 HE ARG A 70 1.426 -1.369 22.888 1.00 0.00 H new ATOM 0 HH11 ARG A 70 4.004 0.809 21.817 1.00 0.00 H new ATOM 0 HH12 ARG A 70 4.190 1.544 23.413 1.00 0.00 H new ATOM 0 HH21 ARG A 70 1.703 -0.397 24.903 1.00 0.00 H new ATOM 0 HH22 ARG A 70 2.911 0.873 25.127 1.00 0.00 H new ATOM 1223 N LYS A 71 4.080 -5.783 19.825 1.00 0.00 N ATOM 1224 CA LYS A 71 3.583 -7.045 20.461 1.00 0.00 C ATOM 1225 C LYS A 71 2.530 -6.720 21.530 1.00 0.00 C ATOM 1226 O LYS A 71 2.522 -7.303 22.598 1.00 0.00 O ATOM 1227 CB LYS A 71 4.811 -7.722 21.087 1.00 0.00 C ATOM 1228 CG LYS A 71 5.850 -8.009 19.999 1.00 0.00 C ATOM 1229 CD LYS A 71 7.256 -7.794 20.565 1.00 0.00 C ATOM 1230 CE LYS A 71 7.537 -8.837 21.650 1.00 0.00 C ATOM 1231 NZ LYS A 71 8.281 -8.100 22.708 1.00 0.00 N ATOM 0 H LYS A 71 3.981 -5.745 18.811 1.00 0.00 H new ATOM 0 HA LYS A 71 3.106 -7.702 19.734 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.242 -7.079 21.855 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.517 -8.650 21.577 1.00 0.00 H new ATOM 0 HG2 LYS A 71 5.743 -9.033 19.641 1.00 0.00 H new ATOM 0 HG3 LYS A 71 5.687 -7.353 19.144 1.00 0.00 H new ATOM 0 HD2 LYS A 71 7.996 -7.874 19.769 1.00 0.00 H new ATOM 0 HD3 LYS A 71 7.342 -6.790 20.980 1.00 0.00 H new ATOM 0 HE2 LYS A 71 6.611 -9.260 22.040 1.00 0.00 H new ATOM 0 HE3 LYS A 71 8.126 -9.666 21.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 8.510 -8.749 23.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 9.161 -7.714 22.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 7.693 -7.321 23.067 1.00 0.00 H new ATOM 1245 N ALA A 72 1.633 -5.800 21.243 1.00 0.00 N ATOM 1246 CA ALA A 72 0.573 -5.449 22.237 1.00 0.00 C ATOM 1247 C ALA A 72 -0.809 -5.870 21.704 1.00 0.00 C ATOM 1248 O ALA A 72 -1.795 -5.198 21.936 1.00 0.00 O ATOM 1249 CB ALA A 72 0.651 -3.928 22.385 1.00 0.00 C ATOM 0 H ALA A 72 1.593 -5.281 20.366 1.00 0.00 H new ATOM 0 HA ALA A 72 0.716 -5.956 23.191 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.099 -3.593 23.101 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.642 -3.647 22.741 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.466 -3.458 21.419 1.00 0.00 H new ATOM 1255 N ILE A 73 -0.889 -6.979 20.991 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.209 -7.432 20.450 1.00 0.00 C ATOM 1257 C ILE A 73 -2.201 -8.960 20.254 1.00 0.00 C ATOM 1258 O ILE A 73 -1.148 -9.570 20.210 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.363 -6.702 19.106 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -3.688 -7.105 18.451 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.204 -7.066 18.171 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -3.914 -6.269 17.187 1.00 0.00 C ATOM 0 H ILE A 73 -0.098 -7.582 20.765 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.036 -7.207 21.123 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.353 -5.627 19.286 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -3.673 -8.165 18.199 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -4.511 -6.955 19.150 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.324 -6.543 17.222 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.260 -6.773 18.630 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.203 -8.142 17.995 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -4.857 -6.558 16.723 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -3.948 -5.212 17.451 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.097 -6.441 16.486 1.00 0.00 H new ATOM 1274 N SER A 74 -3.353 -9.581 20.130 1.00 0.00 N ATOM 1275 CA SER A 74 -3.377 -11.063 19.934 1.00 0.00 C ATOM 1276 C SER A 74 -3.829 -11.400 18.506 1.00 0.00 C ATOM 1277 O SER A 74 -4.610 -10.678 17.918 1.00 0.00 O ATOM 1278 CB SER A 74 -4.386 -11.592 20.956 1.00 0.00 C ATOM 1279 OG SER A 74 -3.958 -11.240 22.265 1.00 0.00 O ATOM 0 H SER A 74 -4.267 -9.129 20.156 1.00 0.00 H new ATOM 0 HA SER A 74 -2.393 -11.510 20.072 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.373 -11.174 20.759 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.475 -12.675 20.869 1.00 0.00 H new ATOM 0 HG SER A 74 -4.603 -11.576 22.922 1.00 0.00 H new ATOM 1285 N LYS A 75 -3.339 -12.489 17.938 1.00 0.00 N ATOM 1286 CA LYS A 75 -3.747 -12.870 16.530 1.00 0.00 C ATOM 1287 C LYS A 75 -5.275 -12.777 16.338 1.00 0.00 C ATOM 1288 O LYS A 75 -5.738 -12.473 15.256 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.288 -14.322 16.319 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.098 -14.586 14.825 1.00 0.00 C ATOM 1291 CD LYS A 75 -3.089 -16.095 14.569 1.00 0.00 C ATOM 1292 CE LYS A 75 -2.126 -16.415 13.422 1.00 0.00 C ATOM 1293 NZ LYS A 75 -2.871 -16.056 12.183 1.00 0.00 N ATOM 0 H LYS A 75 -2.679 -13.127 18.383 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.292 -12.189 15.811 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.354 -14.500 16.852 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.026 -15.011 16.730 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -3.900 -14.115 14.257 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.163 -14.143 14.483 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -2.785 -16.625 15.471 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -4.093 -16.438 14.321 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -1.204 -15.840 13.509 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.846 -17.469 13.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -2.310 -16.326 11.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.780 -16.560 12.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.044 -15.031 12.167 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.066 -13.029 17.367 1.00 0.00 N ATOM 1308 CA ASP A 76 -7.559 -12.931 17.191 1.00 0.00 C ATOM 1309 C ASP A 76 -7.933 -11.486 16.836 1.00 0.00 C ATOM 1310 O ASP A 76 -8.607 -11.246 15.850 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.198 -13.336 18.529 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.321 -14.860 18.594 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -8.925 -15.425 17.698 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -7.808 -15.436 19.540 1.00 0.00 O ATOM 0 H ASP A 76 -5.750 -13.292 18.300 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.910 -13.581 16.390 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -7.591 -12.974 19.359 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.181 -12.876 18.629 1.00 0.00 H new ATOM 1319 N LEU A 77 -7.488 -10.514 17.612 1.00 0.00 N ATOM 1320 CA LEU A 77 -7.821 -9.087 17.267 1.00 0.00 C ATOM 1321 C LEU A 77 -7.151 -8.741 15.932 1.00 0.00 C ATOM 1322 O LEU A 77 -7.768 -8.172 15.052 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.260 -8.199 18.392 1.00 0.00 C ATOM 1324 CG LEU A 77 -7.592 -6.731 18.098 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.072 -6.474 18.393 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -6.727 -5.814 18.976 1.00 0.00 C ATOM 0 H LEU A 77 -6.922 -10.644 18.450 1.00 0.00 H new ATOM 0 HA LEU A 77 -8.896 -8.934 17.173 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.687 -8.495 19.350 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.181 -8.330 18.470 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.386 -6.520 17.049 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.309 -5.431 18.184 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.686 -7.118 17.763 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.277 -6.690 19.442 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.968 -4.773 18.762 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.925 -6.024 20.027 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.673 -5.994 18.763 1.00 0.00 H new ATOM 1338 N TYR A 78 -5.890 -9.099 15.766 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.192 -8.799 14.466 1.00 0.00 C ATOM 1340 C TYR A 78 -5.946 -9.483 13.310 1.00 0.00 C ATOM 1341 O TYR A 78 -6.133 -8.897 12.257 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.755 -9.353 14.600 1.00 0.00 C ATOM 1343 CG TYR A 78 -2.990 -9.196 13.299 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -3.116 -8.026 12.538 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.147 -10.224 12.859 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.404 -7.884 11.343 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.432 -10.082 11.663 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.560 -8.912 10.905 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.856 -8.773 9.727 1.00 0.00 O ATOM 0 H TYR A 78 -5.323 -9.579 16.465 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.167 -7.730 14.253 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.232 -8.828 15.400 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -3.792 -10.406 14.880 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.765 -7.232 12.876 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.048 -11.127 13.443 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.505 -6.982 10.758 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.782 -10.875 11.325 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.017 -9.276 9.786 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.406 -10.706 13.503 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.172 -11.389 12.402 1.00 0.00 C ATOM 1361 C ASP A 79 -8.544 -10.720 12.277 1.00 0.00 C ATOM 1362 O ASP A 79 -9.000 -10.436 11.186 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.324 -12.864 12.806 1.00 0.00 C ATOM 1364 CG ASP A 79 -7.894 -13.659 11.631 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -7.446 -13.438 10.518 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -8.769 -14.477 11.864 1.00 0.00 O ATOM 0 H ASP A 79 -6.287 -11.250 14.358 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.661 -11.316 11.442 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.357 -13.273 13.101 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -7.983 -12.949 13.670 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.199 -10.433 13.390 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.537 -9.742 13.311 1.00 0.00 C ATOM 1373 C TRP A 80 -10.382 -8.415 12.542 1.00 0.00 C ATOM 1374 O TRP A 80 -11.270 -8.016 11.812 1.00 0.00 O ATOM 1375 CB TRP A 80 -10.986 -9.473 14.760 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.328 -8.811 14.760 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.513 -9.455 14.654 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.643 -7.392 14.866 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.534 -8.521 14.688 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.047 -7.236 14.818 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -11.851 -6.237 15.000 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.646 -5.977 14.898 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.450 -4.970 15.080 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -13.844 -4.840 15.029 1.00 0.00 C ATOM 0 H TRP A 80 -8.871 -10.644 14.333 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.274 -10.352 12.788 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.032 -10.409 15.316 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.257 -8.838 15.264 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.641 -10.523 14.558 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.525 -8.754 14.625 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -10.775 -6.326 15.042 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.721 -5.883 14.859 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -11.832 -4.090 15.182 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.298 -3.862 15.091 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.255 -7.735 12.683 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.070 -6.450 11.927 1.00 0.00 C ATOM 1397 C LEU A 81 -8.985 -6.763 10.431 1.00 0.00 C ATOM 1398 O LEU A 81 -9.794 -6.300 9.655 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.742 -5.835 12.403 1.00 0.00 C ATOM 1400 CG LEU A 81 -7.858 -5.415 13.869 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.479 -5.495 14.536 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -8.377 -3.978 13.940 1.00 0.00 C ATOM 0 H LEU A 81 -8.473 -8.011 13.277 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.898 -5.762 12.099 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.934 -6.557 12.286 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.490 -4.972 11.787 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.548 -6.081 14.387 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.562 -5.196 15.581 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.107 -6.518 14.480 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.787 -4.828 14.022 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -8.462 -3.673 14.983 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -7.683 -3.315 13.423 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.356 -3.921 13.465 1.00 0.00 H new ATOM 1414 N ILE A 82 -8.018 -7.557 10.010 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.925 -7.881 8.538 1.00 0.00 C ATOM 1416 C ILE A 82 -9.244 -8.536 8.054 1.00 0.00 C ATOM 1417 O ILE A 82 -9.597 -8.416 6.896 1.00 0.00 O ATOM 1418 CB ILE A 82 -6.684 -8.797 8.366 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.436 -7.906 8.328 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -6.757 -9.601 7.058 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -4.258 -8.620 8.988 1.00 0.00 C ATOM 0 H ILE A 82 -7.307 -7.985 10.602 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.799 -6.990 7.922 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.648 -9.501 9.197 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.188 -7.658 7.296 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -5.636 -6.966 8.842 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.873 -10.232 6.969 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.650 -10.226 7.065 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.800 -8.916 6.212 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.378 -7.977 8.955 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.504 -8.845 10.026 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -4.050 -9.548 8.455 1.00 0.00 H new ATOM 1433 N LYS A 83 -9.988 -9.196 8.925 1.00 0.00 N ATOM 1434 CA LYS A 83 -11.290 -9.804 8.475 1.00 0.00 C ATOM 1435 C LYS A 83 -12.406 -8.733 8.413 1.00 0.00 C ATOM 1436 O LYS A 83 -13.410 -8.935 7.758 1.00 0.00 O ATOM 1437 CB LYS A 83 -11.647 -10.885 9.507 1.00 0.00 C ATOM 1438 CG LYS A 83 -12.494 -11.970 8.839 1.00 0.00 C ATOM 1439 CD LYS A 83 -13.191 -12.808 9.912 1.00 0.00 C ATOM 1440 CE LYS A 83 -14.354 -13.579 9.285 1.00 0.00 C ATOM 1441 NZ LYS A 83 -13.712 -14.608 8.420 1.00 0.00 N ATOM 0 H LYS A 83 -9.755 -9.337 9.908 1.00 0.00 H new ATOM 0 HA LYS A 83 -11.195 -10.226 7.474 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -10.738 -11.322 9.921 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -12.195 -10.442 10.339 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -13.234 -11.515 8.181 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -11.864 -12.607 8.218 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -12.482 -13.502 10.363 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -13.557 -12.163 10.711 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -14.980 -14.040 10.049 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -14.997 -12.919 8.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -14.414 -15.329 8.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -13.343 -14.156 7.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -12.930 -15.058 8.938 1.00 0.00 H new ATOM 1455 N GLU A 84 -12.249 -7.598 9.081 1.00 0.00 N ATOM 1456 CA GLU A 84 -13.322 -6.544 9.031 1.00 0.00 C ATOM 1457 C GLU A 84 -12.888 -5.314 8.196 1.00 0.00 C ATOM 1458 O GLU A 84 -13.416 -4.235 8.378 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.535 -6.131 10.481 1.00 0.00 C ATOM 1460 CG GLU A 84 -14.068 -7.310 11.288 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.471 -7.675 10.801 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -15.568 -8.351 9.790 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -16.425 -7.273 11.447 1.00 0.00 O ATOM 0 H GLU A 84 -11.435 -7.364 9.649 1.00 0.00 H new ATOM 0 HA GLU A 84 -14.225 -6.930 8.559 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.596 -5.782 10.910 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -14.237 -5.299 10.531 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.402 -8.166 11.183 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -14.095 -7.056 12.348 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.938 -5.468 7.282 1.00 0.00 N ATOM 1471 CA LYS A 85 -11.453 -4.332 6.405 1.00 0.00 C ATOM 1472 C LYS A 85 -10.517 -3.382 7.165 1.00 0.00 C ATOM 1473 O LYS A 85 -10.860 -2.250 7.444 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.692 -3.584 5.880 1.00 0.00 C ATOM 1475 CG LYS A 85 -12.467 -3.179 4.421 1.00 0.00 C ATOM 1476 CD LYS A 85 -11.852 -1.779 4.368 1.00 0.00 C ATOM 1477 CE LYS A 85 -12.076 -1.175 2.981 1.00 0.00 C ATOM 1478 NZ LYS A 85 -12.050 0.299 3.194 1.00 0.00 N ATOM 0 H LYS A 85 -11.469 -6.356 7.105 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.870 -4.733 5.576 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -13.574 -4.220 5.960 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.880 -2.700 6.489 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -11.808 -3.896 3.931 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -13.412 -3.193 3.879 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -12.303 -1.143 5.130 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -10.785 -1.830 4.586 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -11.298 -1.487 2.284 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -13.029 -1.496 2.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -12.197 0.784 2.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -12.806 0.567 3.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -11.129 0.576 3.589 1.00 0.00 H new ATOM 1492 N TYR A 86 -9.324 -3.840 7.490 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.348 -2.976 8.217 1.00 0.00 C ATOM 1494 C TYR A 86 -6.989 -3.038 7.504 1.00 0.00 C ATOM 1495 O TYR A 86 -6.493 -2.044 7.010 1.00 0.00 O ATOM 1496 CB TYR A 86 -8.231 -3.591 9.611 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.442 -3.242 10.445 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.707 -3.766 10.128 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.292 -2.398 11.551 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.812 -3.435 10.925 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.399 -2.072 12.341 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.657 -2.590 12.028 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.749 -2.267 12.809 1.00 0.00 O ATOM 0 H TYR A 86 -8.990 -4.780 7.279 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.662 -1.933 8.257 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -8.137 -4.674 9.531 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.327 -3.228 10.101 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.827 -4.419 9.276 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.319 -1.997 11.795 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.787 -3.834 10.686 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.281 -1.419 13.193 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.443 -1.960 13.688 1.00 0.00 H new ATOM 1513 N ALA A 87 -6.387 -4.209 7.445 1.00 0.00 N ATOM 1514 CA ALA A 87 -5.065 -4.349 6.763 1.00 0.00 C ATOM 1515 C ALA A 87 -5.129 -5.485 5.732 1.00 0.00 C ATOM 1516 O ALA A 87 -6.058 -6.272 5.734 1.00 0.00 O ATOM 1517 CB ALA A 87 -4.076 -4.698 7.876 1.00 0.00 C ATOM 0 H ALA A 87 -6.760 -5.071 7.842 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.775 -3.443 6.231 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -3.079 -4.817 7.452 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -4.063 -3.897 8.615 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.381 -5.629 8.355 1.00 0.00 H new ATOM 1523 N ASP A 88 -4.150 -5.586 4.856 1.00 0.00 N ATOM 1524 CA ASP A 88 -4.170 -6.680 3.840 1.00 0.00 C ATOM 1525 C ASP A 88 -2.988 -7.635 4.067 1.00 0.00 C ATOM 1526 O ASP A 88 -1.848 -7.281 3.826 1.00 0.00 O ATOM 1527 CB ASP A 88 -4.040 -5.974 2.490 1.00 0.00 C ATOM 1528 CG ASP A 88 -4.247 -6.986 1.362 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.671 -8.059 1.442 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -4.976 -6.673 0.437 1.00 0.00 O ATOM 0 H ASP A 88 -3.346 -4.960 4.805 1.00 0.00 H new ATOM 0 HA ASP A 88 -5.078 -7.280 3.897 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -4.776 -5.174 2.414 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -3.057 -5.512 2.402 1.00 0.00 H new ATOM 1535 N LYS A 89 -3.246 -8.846 4.526 1.00 0.00 N ATOM 1536 CA LYS A 89 -2.111 -9.813 4.757 1.00 0.00 C ATOM 1537 C LYS A 89 -1.321 -10.024 3.455 1.00 0.00 C ATOM 1538 O LYS A 89 -0.109 -10.136 3.477 1.00 0.00 O ATOM 1539 CB LYS A 89 -2.745 -11.143 5.208 1.00 0.00 C ATOM 1540 CG LYS A 89 -2.874 -11.166 6.738 1.00 0.00 C ATOM 1541 CD LYS A 89 -1.952 -12.242 7.323 1.00 0.00 C ATOM 1542 CE LYS A 89 -1.460 -11.799 8.702 1.00 0.00 C ATOM 1543 NZ LYS A 89 -1.385 -13.052 9.503 1.00 0.00 N ATOM 0 H LYS A 89 -4.176 -9.202 4.747 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.420 -9.431 5.509 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -3.727 -11.262 4.749 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -2.133 -11.980 4.873 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -2.615 -10.190 7.148 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -3.907 -11.367 7.022 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -2.486 -13.189 7.403 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -1.104 -12.409 6.659 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -0.487 -11.313 8.637 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -2.145 -11.082 9.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -1.054 -12.831 10.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -2.327 -13.489 9.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -0.721 -13.713 9.052 1.00 0.00 H new ATOM 1557 N LEU A 90 -1.992 -10.078 2.319 1.00 0.00 N ATOM 1558 CA LEU A 90 -1.247 -10.282 1.024 1.00 0.00 C ATOM 1559 C LEU A 90 -0.237 -9.145 0.809 1.00 0.00 C ATOM 1560 O LEU A 90 0.864 -9.379 0.342 1.00 0.00 O ATOM 1561 CB LEU A 90 -2.296 -10.277 -0.099 1.00 0.00 C ATOM 1562 CG LEU A 90 -1.723 -10.972 -1.336 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -1.696 -12.484 -1.104 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -2.604 -10.659 -2.547 1.00 0.00 C ATOM 0 H LEU A 90 -3.005 -9.991 2.232 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.693 -11.220 1.037 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -3.201 -10.787 0.232 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.579 -9.253 -0.342 1.00 0.00 H new ATOM 0 HG LEU A 90 -0.710 -10.614 -1.519 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -1.288 -12.980 -1.985 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -1.072 -12.708 -0.239 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.709 -12.842 -0.923 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -2.198 -11.153 -3.430 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.616 -11.019 -2.363 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.626 -9.582 -2.712 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.587 -7.918 1.150 1.00 0.00 N ATOM 1577 CA LEU A 91 0.395 -6.794 0.955 1.00 0.00 C ATOM 1578 C LEU A 91 1.563 -6.971 1.932 1.00 0.00 C ATOM 1579 O LEU A 91 2.713 -6.943 1.531 1.00 0.00 O ATOM 1580 CB LEU A 91 -0.353 -5.478 1.232 1.00 0.00 C ATOM 1581 CG LEU A 91 0.596 -4.287 1.031 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.141 -4.274 -0.409 1.00 0.00 C ATOM 1583 CD2 LEU A 91 -0.166 -2.987 1.305 1.00 0.00 C ATOM 0 H LEU A 91 -1.489 -7.652 1.546 1.00 0.00 H new ATOM 0 HA LEU A 91 0.798 -6.787 -0.058 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -1.210 -5.389 0.564 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.741 -5.477 2.250 1.00 0.00 H new ATOM 0 HG LEU A 91 1.435 -4.377 1.721 1.00 0.00 H new ATOM 0 HD11 LEU A 91 1.812 -3.424 -0.536 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.686 -5.199 -0.600 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.312 -4.190 -1.111 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.502 -2.137 1.164 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.007 -2.906 0.616 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.536 -2.991 2.330 1.00 0.00 H new ATOM 1595 N ILE A 92 1.289 -7.179 3.209 1.00 0.00 N ATOM 1596 CA ILE A 92 2.425 -7.386 4.179 1.00 0.00 C ATOM 1597 C ILE A 92 3.219 -8.637 3.755 1.00 0.00 C ATOM 1598 O ILE A 92 4.434 -8.655 3.836 1.00 0.00 O ATOM 1599 CB ILE A 92 1.797 -7.560 5.581 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.149 -6.233 6.005 1.00 0.00 C ATOM 1601 CG2 ILE A 92 2.881 -7.942 6.599 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.476 -6.382 7.377 1.00 0.00 C ATOM 0 H ILE A 92 0.353 -7.214 3.612 1.00 0.00 H new ATOM 0 HA ILE A 92 3.115 -6.543 4.191 1.00 0.00 H new ATOM 0 HB ILE A 92 1.047 -8.350 5.546 1.00 0.00 H new ATOM 0 HG12 ILE A 92 1.905 -5.449 6.047 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.412 -5.927 5.262 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.429 -8.062 7.584 1.00 0.00 H new ATOM 0 HG22 ILE A 92 3.349 -8.879 6.298 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.635 -7.156 6.640 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.021 -5.434 7.664 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.294 -7.152 7.323 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.222 -6.666 8.119 1.00 0.00 H new ATOM 1614 N ALA A 93 2.551 -9.673 3.274 1.00 0.00 N ATOM 1615 CA ALA A 93 3.307 -10.893 2.820 1.00 0.00 C ATOM 1616 C ALA A 93 4.143 -10.534 1.579 1.00 0.00 C ATOM 1617 O ALA A 93 5.266 -10.980 1.437 1.00 0.00 O ATOM 1618 CB ALA A 93 2.261 -11.963 2.467 1.00 0.00 C ATOM 0 H ALA A 93 1.537 -9.724 3.179 1.00 0.00 H new ATOM 0 HA ALA A 93 3.981 -11.260 3.594 1.00 0.00 H new ATOM 0 HB1 ALA A 93 2.766 -12.869 2.131 1.00 0.00 H new ATOM 0 HB2 ALA A 93 1.659 -12.188 3.348 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.615 -11.592 1.671 1.00 0.00 H new ATOM 1624 N LYS A 94 3.611 -9.718 0.679 1.00 0.00 N ATOM 1625 CA LYS A 94 4.408 -9.332 -0.544 1.00 0.00 C ATOM 1626 C LYS A 94 5.720 -8.660 -0.112 1.00 0.00 C ATOM 1627 O LYS A 94 6.777 -8.966 -0.633 1.00 0.00 O ATOM 1628 CB LYS A 94 3.550 -8.331 -1.337 1.00 0.00 C ATOM 1629 CG LYS A 94 2.631 -9.081 -2.302 1.00 0.00 C ATOM 1630 CD LYS A 94 3.473 -9.804 -3.356 1.00 0.00 C ATOM 1631 CE LYS A 94 2.645 -9.994 -4.632 1.00 0.00 C ATOM 1632 NZ LYS A 94 2.233 -11.425 -4.615 1.00 0.00 N ATOM 0 H LYS A 94 2.678 -9.311 0.738 1.00 0.00 H new ATOM 0 HA LYS A 94 4.651 -10.206 -1.148 1.00 0.00 H new ATOM 0 HB2 LYS A 94 2.956 -7.726 -0.652 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.193 -7.647 -1.891 1.00 0.00 H new ATOM 0 HG2 LYS A 94 2.020 -9.799 -1.755 1.00 0.00 H new ATOM 0 HG3 LYS A 94 1.947 -8.383 -2.785 1.00 0.00 H new ATOM 0 HD2 LYS A 94 4.372 -9.228 -3.576 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.800 -10.771 -2.975 1.00 0.00 H new ATOM 0 HE2 LYS A 94 1.778 -9.334 -4.642 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.232 -9.763 -5.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.661 -11.632 -5.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 3.079 -12.030 -4.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 1.670 -11.614 -3.761 1.00 0.00 H new ATOM 1646 N TRP A 95 5.664 -7.752 0.844 1.00 0.00 N ATOM 1647 CA TRP A 95 6.931 -7.077 1.303 1.00 0.00 C ATOM 1648 C TRP A 95 7.913 -8.122 1.862 1.00 0.00 C ATOM 1649 O TRP A 95 9.110 -8.006 1.681 1.00 0.00 O ATOM 1650 CB TRP A 95 6.531 -6.076 2.405 1.00 0.00 C ATOM 1651 CG TRP A 95 6.174 -4.753 1.793 1.00 0.00 C ATOM 1652 CD1 TRP A 95 6.850 -4.146 0.788 1.00 0.00 C ATOM 1653 CD2 TRP A 95 5.070 -3.862 2.133 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.235 -2.944 0.493 1.00 0.00 N ATOM 1655 CE2 TRP A 95 5.133 -2.725 1.292 1.00 0.00 C ATOM 1656 CE3 TRP A 95 4.030 -3.929 3.078 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.201 -1.692 1.386 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 3.089 -2.890 3.175 1.00 0.00 C ATOM 1659 CH2 TRP A 95 3.175 -1.775 2.330 1.00 0.00 C ATOM 0 H TRP A 95 4.812 -7.453 1.319 1.00 0.00 H new ATOM 0 HA TRP A 95 7.425 -6.567 0.476 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.684 -6.465 2.970 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.354 -5.950 3.109 1.00 0.00 H new ATOM 0 HD1 TRP A 95 7.728 -4.538 0.297 1.00 0.00 H new ATOM 0 HE1 TRP A 95 6.557 -2.298 -0.228 1.00 0.00 H new ATOM 0 HE3 TRP A 95 3.954 -4.784 3.733 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.272 -0.834 0.734 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.295 -2.951 3.905 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.448 -0.980 2.409 1.00 0.00 H new ATOM 1670 N ARG A 96 7.421 -9.148 2.529 1.00 0.00 N ATOM 1671 CA ARG A 96 8.350 -10.198 3.081 1.00 0.00 C ATOM 1672 C ARG A 96 8.772 -11.182 1.972 1.00 0.00 C ATOM 1673 O ARG A 96 9.876 -11.693 1.989 1.00 0.00 O ATOM 1674 CB ARG A 96 7.573 -10.936 4.182 1.00 0.00 C ATOM 1675 CG ARG A 96 7.377 -10.007 5.385 1.00 0.00 C ATOM 1676 CD ARG A 96 5.968 -10.194 5.963 1.00 0.00 C ATOM 1677 NE ARG A 96 6.171 -10.375 7.433 1.00 0.00 N ATOM 1678 CZ ARG A 96 6.637 -11.511 7.929 1.00 0.00 C ATOM 1679 NH1 ARG A 96 6.941 -12.525 7.150 1.00 0.00 N ATOM 1680 NH2 ARG A 96 6.800 -11.634 9.221 1.00 0.00 N ATOM 0 H ARG A 96 6.430 -9.303 2.713 1.00 0.00 H new ATOM 0 HA ARG A 96 9.259 -9.746 3.477 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.606 -11.263 3.801 1.00 0.00 H new ATOM 0 HB3 ARG A 96 8.115 -11.831 4.486 1.00 0.00 H new ATOM 0 HG2 ARG A 96 8.125 -10.223 6.148 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.521 -8.970 5.082 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.339 -9.328 5.756 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.473 -11.060 5.524 1.00 0.00 H new ATOM 0 HE ARG A 96 5.946 -9.608 8.067 1.00 0.00 H new ATOM 0 HH11 ARG A 96 6.820 -12.447 6.140 1.00 0.00 H new ATOM 0 HH12 ARG A 96 7.298 -13.390 7.555 1.00 0.00 H new ATOM 0 HH21 ARG A 96 6.569 -10.857 9.840 1.00 0.00 H new ATOM 0 HH22 ARG A 96 7.159 -12.507 9.609 1.00 0.00 H new ATOM 1694 N LYS A 97 7.910 -11.458 1.009 1.00 0.00 N ATOM 1695 CA LYS A 97 8.290 -12.420 -0.096 1.00 0.00 C ATOM 1696 C LYS A 97 9.634 -12.022 -0.730 1.00 0.00 C ATOM 1697 O LYS A 97 10.219 -11.017 -0.372 1.00 0.00 O ATOM 1698 CB LYS A 97 7.184 -12.327 -1.162 1.00 0.00 C ATOM 1699 CG LYS A 97 6.079 -13.342 -0.866 1.00 0.00 C ATOM 1700 CD LYS A 97 6.644 -14.763 -0.961 1.00 0.00 C ATOM 1701 CE LYS A 97 5.514 -15.741 -1.288 1.00 0.00 C ATOM 1702 NZ LYS A 97 5.424 -15.742 -2.775 1.00 0.00 N ATOM 0 H LYS A 97 6.971 -11.065 0.939 1.00 0.00 H new ATOM 0 HA LYS A 97 8.392 -13.430 0.301 1.00 0.00 H new ATOM 0 HB2 LYS A 97 6.768 -11.320 -1.178 1.00 0.00 H new ATOM 0 HB3 LYS A 97 7.604 -12.514 -2.150 1.00 0.00 H new ATOM 0 HG2 LYS A 97 5.670 -13.169 0.129 1.00 0.00 H new ATOM 0 HG3 LYS A 97 5.259 -13.218 -1.574 1.00 0.00 H new ATOM 0 HD2 LYS A 97 7.413 -14.809 -1.732 1.00 0.00 H new ATOM 0 HD3 LYS A 97 7.119 -15.041 -0.020 1.00 0.00 H new ATOM 0 HE2 LYS A 97 5.732 -16.738 -0.905 1.00 0.00 H new ATOM 0 HE3 LYS A 97 4.574 -15.424 -0.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 4.669 -16.391 -3.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 5.209 -14.781 -3.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 6.331 -16.055 -3.177 1.00 0.00 H new ATOM 1716 N THR A 98 10.120 -12.793 -1.684 1.00 0.00 N ATOM 1717 CA THR A 98 11.413 -12.438 -2.346 1.00 0.00 C ATOM 1718 C THR A 98 11.132 -11.885 -3.748 1.00 0.00 C ATOM 1719 O THR A 98 10.239 -12.354 -4.431 1.00 0.00 O ATOM 1720 CB THR A 98 12.214 -13.742 -2.425 1.00 0.00 C ATOM 1721 OG1 THR A 98 12.056 -14.466 -1.213 1.00 0.00 O ATOM 1722 CG2 THR A 98 13.693 -13.423 -2.644 1.00 0.00 C ATOM 0 H THR A 98 9.676 -13.645 -2.026 1.00 0.00 H new ATOM 0 HA THR A 98 11.964 -11.675 -1.797 1.00 0.00 H new ATOM 0 HB THR A 98 11.849 -14.343 -3.258 1.00 0.00 H new ATOM 0 HG1 THR A 98 12.566 -15.301 -1.262 1.00 0.00 H new ATOM 0 HG21 THR A 98 14.261 -14.352 -2.700 1.00 0.00 H new ATOM 0 HG22 THR A 98 13.812 -12.868 -3.575 1.00 0.00 H new ATOM 0 HG23 THR A 98 14.062 -12.821 -1.814 1.00 0.00 H new ATOM 1730 N GLY A 99 11.868 -10.883 -4.182 1.00 0.00 N ATOM 1731 CA GLY A 99 11.610 -10.304 -5.533 1.00 0.00 C ATOM 1732 C GLY A 99 10.864 -8.963 -5.395 1.00 0.00 C ATOM 1733 O GLY A 99 11.011 -8.089 -6.230 1.00 0.00 O ATOM 0 H GLY A 99 12.629 -10.448 -3.660 1.00 0.00 H new ATOM 0 HA2 GLY A 99 12.552 -10.153 -6.060 1.00 0.00 H new ATOM 0 HA3 GLY A 99 11.019 -10.999 -6.129 1.00 0.00 H new ATOM 1737 N TYR A 100 10.069 -8.780 -4.351 1.00 0.00 N ATOM 1738 CA TYR A 100 9.337 -7.477 -4.192 1.00 0.00 C ATOM 1739 C TYR A 100 10.161 -6.514 -3.320 1.00 0.00 C ATOM 1740 O TYR A 100 9.698 -6.049 -2.294 1.00 0.00 O ATOM 1741 CB TYR A 100 8.006 -7.808 -3.498 1.00 0.00 C ATOM 1742 CG TYR A 100 7.224 -8.808 -4.316 1.00 0.00 C ATOM 1743 CD1 TYR A 100 6.786 -8.473 -5.601 1.00 0.00 C ATOM 1744 CD2 TYR A 100 6.927 -10.066 -3.778 1.00 0.00 C ATOM 1745 CE1 TYR A 100 6.053 -9.400 -6.353 1.00 0.00 C ATOM 1746 CE2 TYR A 100 6.192 -10.992 -4.526 1.00 0.00 C ATOM 1747 CZ TYR A 100 5.755 -10.659 -5.816 1.00 0.00 C ATOM 1748 OH TYR A 100 5.030 -11.571 -6.556 1.00 0.00 O ATOM 0 H TYR A 100 9.901 -9.468 -3.617 1.00 0.00 H new ATOM 0 HA TYR A 100 9.171 -6.995 -5.156 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.197 -8.211 -2.503 1.00 0.00 H new ATOM 0 HB3 TYR A 100 7.420 -6.898 -3.366 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.013 -7.501 -6.013 1.00 0.00 H new ATOM 0 HD2 TYR A 100 7.266 -10.322 -2.785 1.00 0.00 H new ATOM 0 HE1 TYR A 100 5.717 -9.144 -7.347 1.00 0.00 H new ATOM 0 HE2 TYR A 100 5.962 -11.962 -4.110 1.00 0.00 H new ATOM 0 HH TYR A 100 4.912 -12.394 -6.037 1.00 0.00 H new ATOM 1758 N GLU A 101 11.382 -6.207 -3.714 1.00 0.00 N ATOM 1759 CA GLU A 101 12.215 -5.267 -2.881 1.00 0.00 C ATOM 1760 C GLU A 101 11.554 -3.881 -2.820 1.00 0.00 C ATOM 1761 O GLU A 101 11.587 -3.225 -1.796 1.00 0.00 O ATOM 1762 CB GLU A 101 13.589 -5.166 -3.562 1.00 0.00 C ATOM 1763 CG GLU A 101 14.509 -6.264 -3.025 1.00 0.00 C ATOM 1764 CD GLU A 101 15.956 -5.771 -3.036 1.00 0.00 C ATOM 1765 OE1 GLU A 101 16.389 -5.288 -4.070 1.00 0.00 O ATOM 1766 OE2 GLU A 101 16.608 -5.883 -2.011 1.00 0.00 O ATOM 0 H GLU A 101 11.831 -6.559 -4.560 1.00 0.00 H new ATOM 0 HA GLU A 101 12.310 -5.635 -1.859 1.00 0.00 H new ATOM 0 HB2 GLU A 101 13.479 -5.265 -4.642 1.00 0.00 H new ATOM 0 HB3 GLU A 101 14.028 -4.186 -3.375 1.00 0.00 H new ATOM 0 HG2 GLU A 101 14.214 -6.536 -2.011 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.415 -7.162 -3.636 1.00 0.00 H new ATOM 1773 N LYS A 102 10.956 -3.423 -3.903 1.00 0.00 N ATOM 1774 CA LYS A 102 10.306 -2.077 -3.884 1.00 0.00 C ATOM 1775 C LYS A 102 8.889 -2.151 -4.477 1.00 0.00 C ATOM 1776 O LYS A 102 8.690 -1.852 -5.640 1.00 0.00 O ATOM 1777 CB LYS A 102 11.203 -1.196 -4.756 1.00 0.00 C ATOM 1778 CG LYS A 102 12.335 -0.608 -3.905 1.00 0.00 C ATOM 1779 CD LYS A 102 11.996 0.837 -3.503 1.00 0.00 C ATOM 1780 CE LYS A 102 13.050 1.796 -4.064 1.00 0.00 C ATOM 1781 NZ LYS A 102 13.124 2.908 -3.075 1.00 0.00 N ATOM 0 H LYS A 102 10.893 -3.923 -4.790 1.00 0.00 H new ATOM 0 HA LYS A 102 10.202 -1.687 -2.871 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.618 -1.782 -5.576 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.617 -0.393 -5.203 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.484 -1.217 -3.013 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.270 -0.628 -4.465 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.009 1.106 -3.880 1.00 0.00 H new ATOM 0 HD3 LYS A 102 11.956 0.922 -2.417 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.015 1.301 -4.175 1.00 0.00 H new ATOM 0 HE3 LYS A 102 12.765 2.163 -5.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 13.827 3.607 -3.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 12.193 3.365 -2.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 13.404 2.530 -2.148 1.00 0.00 H new ATOM 1795 N LEU A 103 7.902 -2.536 -3.691 1.00 0.00 N ATOM 1796 CA LEU A 103 6.511 -2.608 -4.230 1.00 0.00 C ATOM 1797 C LEU A 103 5.617 -1.563 -3.524 1.00 0.00 C ATOM 1798 O LEU A 103 5.823 -1.255 -2.365 1.00 0.00 O ATOM 1799 CB LEU A 103 6.048 -4.062 -3.972 1.00 0.00 C ATOM 1800 CG LEU A 103 5.505 -4.239 -2.545 1.00 0.00 C ATOM 1801 CD1 LEU A 103 4.012 -3.891 -2.526 1.00 0.00 C ATOM 1802 CD2 LEU A 103 5.698 -5.689 -2.097 1.00 0.00 C ATOM 0 H LEU A 103 8.004 -2.799 -2.711 1.00 0.00 H new ATOM 0 HA LEU A 103 6.453 -2.375 -5.293 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.275 -4.331 -4.692 1.00 0.00 H new ATOM 0 HB3 LEU A 103 6.883 -4.744 -4.131 1.00 0.00 H new ATOM 0 HG LEU A 103 6.044 -3.579 -1.866 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.622 -4.015 -1.516 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.875 -2.857 -2.843 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.475 -4.553 -3.206 1.00 0.00 H new ATOM 0 HD21 LEU A 103 5.312 -5.812 -1.085 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.160 -6.353 -2.773 1.00 0.00 H new ATOM 0 HD23 LEU A 103 6.759 -5.937 -2.113 1.00 0.00 H new ATOM 1814 N CYS A 104 4.640 -1.012 -4.213 1.00 0.00 N ATOM 1815 CA CYS A 104 3.760 0.019 -3.560 1.00 0.00 C ATOM 1816 C CYS A 104 2.329 -0.494 -3.288 1.00 0.00 C ATOM 1817 O CYS A 104 1.691 -0.031 -2.363 1.00 0.00 O ATOM 1818 CB CYS A 104 3.769 1.249 -4.487 1.00 0.00 C ATOM 1819 SG CYS A 104 3.167 0.858 -6.154 1.00 0.00 S ATOM 0 H CYS A 104 4.415 -1.227 -5.185 1.00 0.00 H new ATOM 0 HA CYS A 104 4.146 0.270 -2.572 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.148 2.033 -4.053 1.00 0.00 H new ATOM 0 HB3 CYS A 104 4.783 1.645 -4.552 1.00 0.00 H new ATOM 1824 N CYS A 105 1.806 -1.438 -4.049 1.00 0.00 N ATOM 1825 CA CYS A 105 0.416 -1.942 -3.758 1.00 0.00 C ATOM 1826 C CYS A 105 0.340 -3.455 -4.040 1.00 0.00 C ATOM 1827 O CYS A 105 1.353 -4.100 -4.239 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.550 -1.215 -4.710 1.00 0.00 C ATOM 1829 SG CYS A 105 -0.228 0.571 -4.803 1.00 0.00 S ATOM 0 H CYS A 105 2.272 -1.874 -4.845 1.00 0.00 H new ATOM 0 HA CYS A 105 0.159 -1.759 -2.715 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.466 -1.648 -5.707 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.575 -1.379 -4.377 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.853 -4.025 -4.080 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.971 -5.494 -4.376 1.00 0.00 C ATOM 1836 C LEU A 106 -1.254 -5.711 -5.875 1.00 0.00 C ATOM 1837 O LEU A 106 -0.714 -6.619 -6.479 1.00 0.00 O ATOM 1838 CB LEU A 106 -2.137 -6.010 -3.522 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.625 -6.442 -2.145 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.807 -6.888 -1.283 1.00 0.00 C ATOM 1841 CD2 LEU A 106 -0.636 -7.605 -2.297 1.00 0.00 C ATOM 0 H LEU A 106 -1.737 -3.540 -3.922 1.00 0.00 H new ATOM 0 HA LEU A 106 -0.049 -6.027 -4.142 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.890 -5.230 -3.411 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.620 -6.851 -4.020 1.00 0.00 H new ATOM 0 HG LEU A 106 -1.119 -5.602 -1.669 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.446 -7.196 -0.302 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.507 -6.060 -1.169 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -3.312 -7.726 -1.763 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -0.276 -7.907 -1.314 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -1.136 -8.447 -2.775 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.207 -7.288 -2.911 1.00 0.00 H new ATOM 1853 N ARG A 107 -2.067 -4.870 -6.494 1.00 0.00 N ATOM 1854 CA ARG A 107 -2.335 -5.030 -7.965 1.00 0.00 C ATOM 1855 C ARG A 107 -1.535 -3.972 -8.764 1.00 0.00 C ATOM 1856 O ARG A 107 -1.969 -3.510 -9.800 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.842 -4.809 -8.138 1.00 0.00 C ATOM 1858 CG ARG A 107 -4.231 -5.061 -9.596 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.685 -5.556 -9.662 1.00 0.00 C ATOM 1860 NE ARG A 107 -5.881 -6.121 -11.046 1.00 0.00 N ATOM 1861 CZ ARG A 107 -7.084 -6.177 -11.600 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -8.159 -5.784 -10.955 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -7.214 -6.651 -12.812 1.00 0.00 N ATOM 0 H ARG A 107 -2.549 -4.090 -6.047 1.00 0.00 H new ATOM 0 HA ARG A 107 -2.032 -6.011 -8.332 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -4.396 -5.480 -7.482 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -4.106 -3.791 -7.851 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -4.121 -4.145 -10.176 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -3.564 -5.800 -10.039 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -5.871 -6.316 -8.903 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -6.382 -4.739 -9.474 1.00 0.00 H new ATOM 0 HE ARG A 107 -5.074 -6.466 -11.565 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -8.080 -5.425 -10.004 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -9.072 -5.838 -11.406 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -6.393 -6.974 -13.324 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -8.136 -6.697 -13.245 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.374 -3.586 -8.277 1.00 0.00 N ATOM 1878 CA CYS A 108 0.468 -2.561 -8.975 1.00 0.00 C ATOM 1879 C CYS A 108 1.907 -3.127 -9.143 1.00 0.00 C ATOM 1880 O CYS A 108 2.847 -2.381 -9.333 1.00 0.00 O ATOM 1881 CB CYS A 108 0.441 -1.415 -7.955 1.00 0.00 C ATOM 1882 SG CYS A 108 0.556 0.247 -8.661 1.00 0.00 S ATOM 0 H CYS A 108 0.029 -3.945 -7.412 1.00 0.00 H new ATOM 0 HA CYS A 108 0.132 -2.268 -9.970 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.481 -1.485 -7.379 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.265 -1.553 -7.255 1.00 0.00 H new ATOM 1887 N ILE A 109 2.085 -4.449 -9.053 1.00 0.00 N ATOM 1888 CA ILE A 109 3.453 -5.066 -9.178 1.00 0.00 C ATOM 1889 C ILE A 109 3.329 -6.555 -9.577 1.00 0.00 C ATOM 1890 O ILE A 109 4.060 -7.389 -9.073 1.00 0.00 O ATOM 1891 CB ILE A 109 4.070 -4.985 -7.765 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.125 -5.652 -6.742 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.304 -3.528 -7.362 1.00 0.00 C ATOM 1894 CD1 ILE A 109 3.921 -6.586 -5.824 1.00 0.00 C ATOM 0 H ILE A 109 1.331 -5.118 -8.898 1.00 0.00 H new ATOM 0 HA ILE A 109 4.053 -4.556 -9.932 1.00 0.00 H new ATOM 0 HB ILE A 109 5.027 -5.507 -7.777 1.00 0.00 H new ATOM 0 HG12 ILE A 109 2.621 -4.889 -6.149 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.350 -6.214 -7.263 1.00 0.00 H new ATOM 0 HG21 ILE A 109 4.739 -3.492 -6.363 1.00 0.00 H new ATOM 0 HG22 ILE A 109 4.985 -3.059 -8.072 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.354 -2.993 -7.363 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.246 -7.052 -5.106 1.00 0.00 H new ATOM 0 HD12 ILE A 109 4.404 -7.359 -6.422 1.00 0.00 H new ATOM 0 HD13 ILE A 109 4.679 -6.013 -5.291 1.00 0.00 H new ATOM 1906 N GLN A 110 2.403 -6.903 -10.449 1.00 0.00 N ATOM 1907 CA GLN A 110 2.246 -8.352 -10.827 1.00 0.00 C ATOM 1908 C GLN A 110 3.068 -8.686 -12.079 1.00 0.00 C ATOM 1909 O GLN A 110 2.654 -8.403 -13.186 1.00 0.00 O ATOM 1910 CB GLN A 110 0.748 -8.559 -11.100 1.00 0.00 C ATOM 1911 CG GLN A 110 0.284 -9.875 -10.469 1.00 0.00 C ATOM 1912 CD GLN A 110 -0.350 -9.596 -9.101 1.00 0.00 C ATOM 1913 OE1 GLN A 110 -1.553 -9.678 -8.952 1.00 0.00 O ATOM 1914 NE2 GLN A 110 0.409 -9.266 -8.083 1.00 0.00 N ATOM 0 H GLN A 110 1.759 -6.259 -10.908 1.00 0.00 H new ATOM 0 HA GLN A 110 2.605 -9.005 -10.032 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.176 -7.727 -10.690 1.00 0.00 H new ATOM 0 HB3 GLN A 110 0.563 -8.575 -12.174 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -0.437 -10.368 -11.121 1.00 0.00 H new ATOM 0 HG3 GLN A 110 1.129 -10.554 -10.357 1.00 0.00 H new ATOM 0 HE21 GLN A 110 1.420 -9.196 -8.202 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -0.012 -9.080 -7.173 1.00 0.00 H new ATOM 1923 N LYS A 111 4.222 -9.302 -11.916 1.00 0.00 N ATOM 1924 CA LYS A 111 5.055 -9.662 -13.111 1.00 0.00 C ATOM 1925 C LYS A 111 4.925 -11.163 -13.410 1.00 0.00 C ATOM 1926 O LYS A 111 4.655 -11.550 -14.532 1.00 0.00 O ATOM 1927 CB LYS A 111 6.498 -9.309 -12.732 1.00 0.00 C ATOM 1928 CG LYS A 111 7.415 -9.554 -13.932 1.00 0.00 C ATOM 1929 CD LYS A 111 8.708 -8.754 -13.758 1.00 0.00 C ATOM 1930 CE LYS A 111 8.465 -7.297 -14.157 1.00 0.00 C ATOM 1931 NZ LYS A 111 9.799 -6.789 -14.583 1.00 0.00 N ATOM 0 H LYS A 111 4.618 -9.568 -11.014 1.00 0.00 H new ATOM 0 HA LYS A 111 4.737 -9.127 -14.006 1.00 0.00 H new ATOM 0 HB2 LYS A 111 6.559 -8.266 -12.421 1.00 0.00 H new ATOM 0 HB3 LYS A 111 6.821 -9.914 -11.884 1.00 0.00 H new ATOM 0 HG2 LYS A 111 7.641 -10.617 -14.019 1.00 0.00 H new ATOM 0 HG3 LYS A 111 6.913 -9.258 -14.853 1.00 0.00 H new ATOM 0 HD2 LYS A 111 9.044 -8.807 -12.723 1.00 0.00 H new ATOM 0 HD3 LYS A 111 9.499 -9.183 -14.373 1.00 0.00 H new ATOM 0 HE2 LYS A 111 7.738 -7.225 -14.966 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.070 -6.719 -13.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 9.715 -5.794 -14.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 10.468 -6.864 -13.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 10.146 -7.354 -15.384 1.00 0.00 H new ATOM 1945 N ASN A 112 5.113 -12.014 -12.421 1.00 0.00 N ATOM 1946 CA ASN A 112 4.992 -13.482 -12.664 1.00 0.00 C ATOM 1947 C ASN A 112 3.892 -14.078 -11.772 1.00 0.00 C ATOM 1948 O ASN A 112 3.982 -14.031 -10.559 1.00 0.00 O ATOM 1949 CB ASN A 112 6.356 -14.061 -12.289 1.00 0.00 C ATOM 1950 CG ASN A 112 7.423 -13.527 -13.254 1.00 0.00 C ATOM 1951 OD1 ASN A 112 7.116 -13.186 -14.379 1.00 0.00 O ATOM 1952 ND2 ASN A 112 8.671 -13.436 -12.865 1.00 0.00 N ATOM 0 H ASN A 112 5.344 -11.751 -11.463 1.00 0.00 H new ATOM 0 HA ASN A 112 4.723 -13.708 -13.696 1.00 0.00 H new ATOM 0 HB2 ASN A 112 6.609 -13.789 -11.264 1.00 0.00 H new ATOM 0 HB3 ASN A 112 6.325 -15.150 -12.331 1.00 0.00 H new ATOM 0 HD21 ASN A 112 9.380 -13.080 -13.506 1.00 0.00 H new ATOM 0 HD22 ASN A 112 8.933 -13.721 -11.921 1.00 0.00 H new ATOM 1959 N GLU A 113 2.852 -14.637 -12.359 1.00 0.00 N ATOM 1960 CA GLU A 113 1.753 -15.227 -11.530 1.00 0.00 C ATOM 1961 C GLU A 113 1.032 -16.349 -12.300 1.00 0.00 C ATOM 1962 O GLU A 113 1.454 -16.732 -13.376 1.00 0.00 O ATOM 1963 CB GLU A 113 0.795 -14.064 -11.245 1.00 0.00 C ATOM 1964 CG GLU A 113 0.286 -13.467 -12.562 1.00 0.00 C ATOM 1965 CD GLU A 113 -0.977 -12.645 -12.296 1.00 0.00 C ATOM 1966 OE1 GLU A 113 -1.778 -13.074 -11.481 1.00 0.00 O ATOM 1967 OE2 GLU A 113 -1.121 -11.602 -12.911 1.00 0.00 O ATOM 0 H GLU A 113 2.721 -14.708 -13.368 1.00 0.00 H new ATOM 0 HA GLU A 113 2.133 -15.675 -10.612 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -0.046 -14.414 -10.646 1.00 0.00 H new ATOM 0 HB3 GLU A 113 1.305 -13.297 -10.662 1.00 0.00 H new ATOM 0 HG2 GLU A 113 1.055 -12.837 -13.009 1.00 0.00 H new ATOM 0 HG3 GLU A 113 0.071 -14.263 -13.275 1.00 0.00 H new ATOM 1974 N THR A 114 -0.050 -16.876 -11.764 1.00 0.00 N ATOM 1975 CA THR A 114 -0.784 -17.966 -12.475 1.00 0.00 C ATOM 1976 C THR A 114 -2.196 -17.494 -12.854 1.00 0.00 C ATOM 1977 O THR A 114 -3.160 -18.218 -12.687 1.00 0.00 O ATOM 1978 CB THR A 114 -0.856 -19.120 -11.472 1.00 0.00 C ATOM 1979 OG1 THR A 114 -1.517 -18.679 -10.294 1.00 0.00 O ATOM 1980 CG2 THR A 114 0.558 -19.585 -11.123 1.00 0.00 C ATOM 0 H THR A 114 -0.451 -16.596 -10.869 1.00 0.00 H new ATOM 0 HA THR A 114 -0.288 -18.262 -13.399 1.00 0.00 H new ATOM 0 HB THR A 114 -1.409 -19.950 -11.911 1.00 0.00 H new ATOM 0 HG1 THR A 114 -1.566 -19.417 -9.651 1.00 0.00 H new ATOM 0 HG21 THR A 114 0.505 -20.407 -10.409 1.00 0.00 H new ATOM 0 HG22 THR A 114 1.064 -19.923 -12.028 1.00 0.00 H new ATOM 0 HG23 THR A 114 1.115 -18.758 -10.683 1.00 0.00 H new ATOM 1988 N ASN A 115 -2.330 -16.285 -13.364 1.00 0.00 N ATOM 1989 CA ASN A 115 -3.681 -15.779 -13.748 1.00 0.00 C ATOM 1990 C ASN A 115 -3.630 -15.141 -15.146 1.00 0.00 C ATOM 1991 O ASN A 115 -2.677 -15.333 -15.879 1.00 0.00 O ATOM 1992 CB ASN A 115 -4.024 -14.729 -12.690 1.00 0.00 C ATOM 1993 CG ASN A 115 -5.509 -14.837 -12.321 1.00 0.00 C ATOM 1994 OD1 ASN A 115 -6.340 -14.179 -12.916 1.00 0.00 O ATOM 1995 ND2 ASN A 115 -5.887 -15.643 -11.358 1.00 0.00 N ATOM 0 H ASN A 115 -1.561 -15.635 -13.528 1.00 0.00 H new ATOM 0 HA ASN A 115 -4.425 -16.574 -13.789 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -3.407 -14.876 -11.804 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -3.805 -13.731 -13.069 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -6.874 -15.715 -11.112 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -5.194 -16.197 -10.855 1.00 0.00 H new ATOM 2002 N ASN A 116 -4.640 -14.385 -15.524 1.00 0.00 N ATOM 2003 CA ASN A 116 -4.632 -13.743 -16.873 1.00 0.00 C ATOM 2004 C ASN A 116 -4.596 -12.212 -16.732 1.00 0.00 C ATOM 2005 O ASN A 116 -5.529 -11.529 -17.113 1.00 0.00 O ATOM 2006 CB ASN A 116 -5.935 -14.198 -17.536 1.00 0.00 C ATOM 2007 CG ASN A 116 -5.733 -14.288 -19.054 1.00 0.00 C ATOM 2008 OD1 ASN A 116 -5.052 -13.466 -19.633 1.00 0.00 O ATOM 2009 ND2 ASN A 116 -6.299 -15.258 -19.732 1.00 0.00 N ATOM 0 H ASN A 116 -5.464 -14.189 -14.955 1.00 0.00 H new ATOM 0 HA ASN A 116 -3.759 -14.025 -17.462 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -6.237 -15.168 -17.141 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -6.737 -13.496 -17.306 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -6.166 -15.320 -20.741 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -6.872 -15.951 -19.250 1.00 0.00 H new ATOM 2016 N GLY A 117 -3.527 -11.665 -16.187 1.00 0.00 N ATOM 2017 CA GLY A 117 -3.444 -10.183 -16.028 1.00 0.00 C ATOM 2018 C GLY A 117 -2.067 -9.692 -16.497 1.00 0.00 C ATOM 2019 O GLY A 117 -1.421 -10.334 -17.305 1.00 0.00 O ATOM 0 H GLY A 117 -2.716 -12.184 -15.849 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -4.231 -9.700 -16.608 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -3.603 -9.909 -14.985 1.00 0.00 H new ATOM 2023 N SER A 118 -1.609 -8.559 -16.003 1.00 0.00 N ATOM 2024 CA SER A 118 -0.275 -8.040 -16.432 1.00 0.00 C ATOM 2025 C SER A 118 0.436 -7.358 -15.250 1.00 0.00 C ATOM 2026 O SER A 118 0.044 -7.526 -14.111 1.00 0.00 O ATOM 2027 CB SER A 118 -0.586 -7.024 -17.531 1.00 0.00 C ATOM 2028 OG SER A 118 -1.488 -7.603 -18.464 1.00 0.00 O ATOM 0 H SER A 118 -2.103 -7.978 -15.325 1.00 0.00 H new ATOM 0 HA SER A 118 0.386 -8.833 -16.783 1.00 0.00 H new ATOM 0 HB2 SER A 118 -1.021 -6.124 -17.097 1.00 0.00 H new ATOM 0 HB3 SER A 118 0.333 -6.723 -18.035 1.00 0.00 H new ATOM 0 HG SER A 118 -1.691 -6.954 -19.169 1.00 0.00 H new ATOM 2034 N THR A 119 1.476 -6.591 -15.509 1.00 0.00 N ATOM 2035 CA THR A 119 2.199 -5.906 -14.392 1.00 0.00 C ATOM 2036 C THR A 119 2.039 -4.387 -14.512 1.00 0.00 C ATOM 2037 O THR A 119 1.784 -3.875 -15.586 1.00 0.00 O ATOM 2038 CB THR A 119 3.672 -6.286 -14.572 1.00 0.00 C ATOM 2039 OG1 THR A 119 3.759 -7.590 -15.131 1.00 0.00 O ATOM 2040 CG2 THR A 119 4.388 -6.254 -13.217 1.00 0.00 C ATOM 0 H THR A 119 1.850 -6.413 -16.441 1.00 0.00 H new ATOM 0 HA THR A 119 1.812 -6.202 -13.417 1.00 0.00 H new ATOM 0 HB THR A 119 4.150 -5.571 -15.242 1.00 0.00 H new ATOM 0 HG1 THR A 119 3.144 -8.190 -14.659 1.00 0.00 H new ATOM 0 HG21 THR A 119 5.435 -6.525 -13.352 1.00 0.00 H new ATOM 0 HG22 THR A 119 4.325 -5.251 -12.796 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.914 -6.963 -12.538 1.00 0.00 H new ATOM 2048 N CYS A 120 2.211 -3.654 -13.429 1.00 0.00 N ATOM 2049 CA CYS A 120 2.091 -2.163 -13.528 1.00 0.00 C ATOM 2050 C CYS A 120 3.424 -1.594 -14.042 1.00 0.00 C ATOM 2051 O CYS A 120 4.461 -2.207 -13.875 1.00 0.00 O ATOM 2052 CB CYS A 120 1.779 -1.639 -12.123 1.00 0.00 C ATOM 2053 SG CYS A 120 1.439 0.128 -12.241 1.00 0.00 S ATOM 0 H CYS A 120 2.425 -4.018 -12.500 1.00 0.00 H new ATOM 0 HA CYS A 120 1.302 -1.863 -14.217 1.00 0.00 H new ATOM 0 HB2 CYS A 120 0.920 -2.164 -11.704 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.621 -1.820 -11.455 1.00 0.00 H new ATOM 2058 N ILE A 121 3.410 -0.446 -14.686 1.00 0.00 N ATOM 2059 CA ILE A 121 4.700 0.121 -15.227 1.00 0.00 C ATOM 2060 C ILE A 121 5.574 0.727 -14.106 1.00 0.00 C ATOM 2061 O ILE A 121 6.787 0.726 -14.214 1.00 0.00 O ATOM 2062 CB ILE A 121 4.290 1.178 -16.283 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.513 1.586 -17.136 1.00 0.00 C ATOM 2064 CG2 ILE A 121 3.650 2.408 -15.620 1.00 0.00 C ATOM 2065 CD1 ILE A 121 6.513 2.437 -16.334 1.00 0.00 C ATOM 0 H ILE A 121 2.578 0.117 -14.860 1.00 0.00 H new ATOM 0 HA ILE A 121 5.317 -0.658 -15.675 1.00 0.00 H new ATOM 0 HB ILE A 121 3.543 0.731 -16.939 1.00 0.00 H new ATOM 0 HG12 ILE A 121 6.013 0.691 -17.506 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.177 2.147 -18.008 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.373 3.132 -16.387 1.00 0.00 H new ATOM 0 HG22 ILE A 121 2.760 2.103 -15.070 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.363 2.863 -14.932 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.357 2.702 -16.970 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.021 3.345 -15.986 1.00 0.00 H new ATOM 0 HD13 ILE A 121 6.870 1.867 -15.476 1.00 0.00 H new ATOM 2077 N CYS A 122 4.992 1.255 -13.044 1.00 0.00 N ATOM 2078 CA CYS A 122 5.854 1.865 -11.963 1.00 0.00 C ATOM 2079 C CYS A 122 6.831 0.822 -11.386 1.00 0.00 C ATOM 2080 O CYS A 122 7.957 1.150 -11.058 1.00 0.00 O ATOM 2081 CB CYS A 122 4.901 2.448 -10.886 1.00 0.00 C ATOM 2082 SG CYS A 122 4.168 1.145 -9.842 1.00 0.00 S ATOM 0 H CYS A 122 3.986 1.291 -12.880 1.00 0.00 H new ATOM 0 HA CYS A 122 6.478 2.664 -12.363 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.450 3.149 -10.258 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.106 3.012 -11.373 1.00 0.00 H new ATOM 2087 N ARG A 123 6.430 -0.431 -11.275 1.00 0.00 N ATOM 2088 CA ARG A 123 7.383 -1.469 -10.732 1.00 0.00 C ATOM 2089 C ARG A 123 8.670 -1.511 -11.584 1.00 0.00 C ATOM 2090 O ARG A 123 9.734 -1.816 -11.080 1.00 0.00 O ATOM 2091 CB ARG A 123 6.662 -2.823 -10.812 1.00 0.00 C ATOM 2092 CG ARG A 123 7.170 -3.739 -9.696 1.00 0.00 C ATOM 2093 CD ARG A 123 7.116 -5.195 -10.165 1.00 0.00 C ATOM 2094 NE ARG A 123 8.377 -5.812 -9.651 1.00 0.00 N ATOM 2095 CZ ARG A 123 9.554 -5.514 -10.181 1.00 0.00 C ATOM 2096 NH1 ARG A 123 9.661 -4.664 -11.178 1.00 0.00 N ATOM 2097 NH2 ARG A 123 10.637 -6.073 -9.706 1.00 0.00 N ATOM 0 H ARG A 123 5.505 -0.776 -11.531 1.00 0.00 H new ATOM 0 HA ARG A 123 7.667 -1.233 -9.706 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.586 -2.680 -10.718 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.838 -3.284 -11.784 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.192 -3.470 -9.427 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.561 -3.611 -8.801 1.00 0.00 H new ATOM 0 HD2 ARG A 123 6.237 -5.705 -9.770 1.00 0.00 H new ATOM 0 HD3 ARG A 123 7.060 -5.258 -11.252 1.00 0.00 H new ATOM 0 HE ARG A 123 8.330 -6.475 -8.877 1.00 0.00 H new ATOM 0 HH11 ARG A 123 8.827 -4.218 -11.560 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.578 -4.450 -11.570 1.00 0.00 H new ATOM 0 HH21 ARG A 123 10.572 -6.734 -8.932 1.00 0.00 H new ATOM 0 HH22 ARG A 123 11.546 -5.848 -10.110 1.00 0.00 H new ATOM 2111 N VAL A 124 8.585 -1.210 -12.869 1.00 0.00 N ATOM 2112 CA VAL A 124 9.821 -1.242 -13.727 1.00 0.00 C ATOM 2113 C VAL A 124 10.601 0.080 -13.584 1.00 0.00 C ATOM 2114 O VAL A 124 10.051 1.138 -13.818 1.00 0.00 O ATOM 2115 CB VAL A 124 9.328 -1.414 -15.177 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.526 -1.465 -16.130 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.534 -2.718 -15.294 1.00 0.00 C ATOM 0 H VAL A 124 7.726 -0.948 -13.352 1.00 0.00 H new ATOM 0 HA VAL A 124 10.491 -2.051 -13.434 1.00 0.00 H new ATOM 0 HB VAL A 124 8.691 -0.570 -15.441 1.00 0.00 H new ATOM 0 HG11 VAL A 124 10.172 -1.587 -17.154 1.00 0.00 H new ATOM 0 HG12 VAL A 124 11.094 -0.538 -16.050 1.00 0.00 H new ATOM 0 HG13 VAL A 124 11.166 -2.307 -15.865 1.00 0.00 H new ATOM 0 HG21 VAL A 124 8.185 -2.841 -16.319 1.00 0.00 H new ATOM 0 HG22 VAL A 124 9.174 -3.559 -15.025 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.678 -2.684 -14.621 1.00 0.00 H new ATOM 2127 N PRO A 125 11.866 -0.010 -13.214 1.00 0.00 N ATOM 2128 CA PRO A 125 12.697 1.217 -13.063 1.00 0.00 C ATOM 2129 C PRO A 125 12.909 1.903 -14.423 1.00 0.00 C ATOM 2130 O PRO A 125 12.508 1.388 -15.450 1.00 0.00 O ATOM 2131 CB PRO A 125 14.021 0.692 -12.508 1.00 0.00 C ATOM 2132 CG PRO A 125 14.065 -0.739 -12.928 1.00 0.00 C ATOM 2133 CD PRO A 125 12.641 -1.222 -12.904 1.00 0.00 C ATOM 0 HA PRO A 125 12.235 1.964 -12.418 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.868 1.249 -12.909 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.062 0.788 -11.423 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.495 -0.840 -13.925 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.687 -1.325 -12.252 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.470 -2.008 -13.640 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.372 -1.633 -11.931 1.00 0.00 H new ATOM 2141 N ARG A 126 13.539 3.063 -14.440 1.00 0.00 N ATOM 2142 CA ARG A 126 13.772 3.768 -15.750 1.00 0.00 C ATOM 2143 C ARG A 126 14.900 3.083 -16.539 1.00 0.00 C ATOM 2144 O ARG A 126 14.839 2.992 -17.751 1.00 0.00 O ATOM 2145 CB ARG A 126 14.166 5.213 -15.409 1.00 0.00 C ATOM 2146 CG ARG A 126 12.918 6.002 -15.009 1.00 0.00 C ATOM 2147 CD ARG A 126 12.180 6.465 -16.267 1.00 0.00 C ATOM 2148 NE ARG A 126 12.974 7.627 -16.773 1.00 0.00 N ATOM 2149 CZ ARG A 126 12.923 8.808 -16.175 1.00 0.00 C ATOM 2150 NH1 ARG A 126 12.172 9.007 -15.116 1.00 0.00 N ATOM 2151 NH2 ARG A 126 13.633 9.801 -16.645 1.00 0.00 N ATOM 0 H ARG A 126 13.897 3.545 -13.616 1.00 0.00 H new ATOM 0 HA ARG A 126 12.876 3.739 -16.371 1.00 0.00 H new ATOM 0 HB2 ARG A 126 14.891 5.221 -14.595 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.646 5.682 -16.268 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.263 5.381 -14.398 1.00 0.00 H new ATOM 0 HG3 ARG A 126 13.198 6.863 -14.402 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.127 5.669 -17.010 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.155 6.756 -16.039 1.00 0.00 H new ATOM 0 HE ARG A 126 13.566 7.508 -17.595 1.00 0.00 H new ATOM 0 HH11 ARG A 126 11.612 8.243 -14.737 1.00 0.00 H new ATOM 0 HH12 ARG A 126 12.149 9.925 -14.672 1.00 0.00 H new ATOM 0 HH21 ARG A 126 14.221 9.663 -17.467 1.00 0.00 H new ATOM 0 HH22 ARG A 126 13.599 10.713 -16.190 1.00 0.00 H new ATOM 2165 N ALA A 127 15.934 2.600 -15.871 1.00 0.00 N ATOM 2166 CA ALA A 127 17.057 1.925 -16.620 1.00 0.00 C ATOM 2167 C ALA A 127 16.509 0.751 -17.444 1.00 0.00 C ATOM 2168 O ALA A 127 16.910 0.547 -18.576 1.00 0.00 O ATOM 2169 CB ALA A 127 18.053 1.414 -15.568 1.00 0.00 C ATOM 0 H ALA A 127 16.048 2.643 -14.858 1.00 0.00 H new ATOM 0 HA ALA A 127 17.540 2.619 -17.308 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.885 0.917 -16.066 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.429 2.254 -14.985 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.552 0.708 -14.906 1.00 0.00 H new ATOM 2175 N GLN A 128 15.586 -0.016 -16.898 1.00 0.00 N ATOM 2176 CA GLN A 128 15.019 -1.165 -17.689 1.00 0.00 C ATOM 2177 C GLN A 128 14.165 -0.612 -18.837 1.00 0.00 C ATOM 2178 O GLN A 128 14.236 -1.094 -19.951 1.00 0.00 O ATOM 2179 CB GLN A 128 14.151 -1.989 -16.723 1.00 0.00 C ATOM 2180 CG GLN A 128 13.618 -3.227 -17.446 1.00 0.00 C ATOM 2181 CD GLN A 128 14.680 -4.335 -17.416 1.00 0.00 C ATOM 2182 OE1 GLN A 128 15.414 -4.456 -16.455 1.00 0.00 O ATOM 2183 NE2 GLN A 128 14.797 -5.157 -18.431 1.00 0.00 N ATOM 0 H GLN A 128 15.207 0.100 -15.958 1.00 0.00 H new ATOM 0 HA GLN A 128 15.806 -1.786 -18.117 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.738 -2.287 -15.854 1.00 0.00 H new ATOM 0 HB3 GLN A 128 13.322 -1.384 -16.356 1.00 0.00 H new ATOM 0 HG2 GLN A 128 12.702 -3.574 -16.968 1.00 0.00 H new ATOM 0 HG3 GLN A 128 13.365 -2.979 -18.477 1.00 0.00 H new ATOM 0 HE21 GLN A 128 14.183 -5.059 -19.240 1.00 0.00 H new ATOM 0 HE22 GLN A 128 15.502 -5.894 -18.412 1.00 0.00 H new ATOM 2192 N LEU A 129 13.370 0.411 -18.582 1.00 0.00 N ATOM 2193 CA LEU A 129 12.534 0.993 -19.690 1.00 0.00 C ATOM 2194 C LEU A 129 13.455 1.615 -20.752 1.00 0.00 C ATOM 2195 O LEU A 129 13.205 1.496 -21.937 1.00 0.00 O ATOM 2196 CB LEU A 129 11.645 2.077 -19.059 1.00 0.00 C ATOM 2197 CG LEU A 129 10.349 1.442 -18.552 1.00 0.00 C ATOM 2198 CD1 LEU A 129 9.737 2.329 -17.464 1.00 0.00 C ATOM 2199 CD2 LEU A 129 9.361 1.306 -19.714 1.00 0.00 C ATOM 0 H LEU A 129 13.266 0.860 -17.672 1.00 0.00 H new ATOM 0 HA LEU A 129 11.925 0.228 -20.172 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.172 2.561 -18.236 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.420 2.851 -19.793 1.00 0.00 H new ATOM 0 HG LEU A 129 10.564 0.457 -18.139 1.00 0.00 H new ATOM 0 HD11 LEU A 129 8.813 1.877 -17.103 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.440 2.428 -16.637 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.521 3.314 -17.877 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.437 0.854 -19.355 1.00 0.00 H new ATOM 0 HD22 LEU A 129 9.146 2.292 -20.126 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.796 0.675 -20.489 1.00 0.00 H new ATOM 2211 N GLU A 130 14.525 2.275 -20.341 1.00 0.00 N ATOM 2212 CA GLU A 130 15.454 2.892 -21.357 1.00 0.00 C ATOM 2213 C GLU A 130 16.021 1.802 -22.281 1.00 0.00 C ATOM 2214 O GLU A 130 16.161 2.012 -23.471 1.00 0.00 O ATOM 2215 CB GLU A 130 16.593 3.561 -20.571 1.00 0.00 C ATOM 2216 CG GLU A 130 16.122 4.916 -20.041 1.00 0.00 C ATOM 2217 CD GLU A 130 16.357 5.990 -21.104 1.00 0.00 C ATOM 2218 OE1 GLU A 130 17.449 6.028 -21.647 1.00 0.00 O ATOM 2219 OE2 GLU A 130 15.443 6.757 -21.355 1.00 0.00 O ATOM 0 H GLU A 130 14.791 2.411 -19.366 1.00 0.00 H new ATOM 0 HA GLU A 130 14.929 3.618 -21.978 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.901 2.922 -19.743 1.00 0.00 H new ATOM 0 HB3 GLU A 130 17.464 3.693 -21.213 1.00 0.00 H new ATOM 0 HG2 GLU A 130 15.064 4.870 -19.784 1.00 0.00 H new ATOM 0 HG3 GLU A 130 16.661 5.169 -19.128 1.00 0.00 H new ATOM 2226 N GLU A 131 16.345 0.635 -21.750 1.00 0.00 N ATOM 2227 CA GLU A 131 16.901 -0.453 -22.635 1.00 0.00 C ATOM 2228 C GLU A 131 15.886 -0.810 -23.732 1.00 0.00 C ATOM 2229 O GLU A 131 16.254 -1.033 -24.870 1.00 0.00 O ATOM 2230 CB GLU A 131 17.157 -1.672 -21.733 1.00 0.00 C ATOM 2231 CG GLU A 131 18.268 -2.532 -22.342 1.00 0.00 C ATOM 2232 CD GLU A 131 19.101 -3.157 -21.221 1.00 0.00 C ATOM 2233 OE1 GLU A 131 18.673 -4.166 -20.685 1.00 0.00 O ATOM 2234 OE2 GLU A 131 20.152 -2.616 -20.919 1.00 0.00 O ATOM 0 H GLU A 131 16.251 0.393 -20.764 1.00 0.00 H new ATOM 0 HA GLU A 131 17.820 -0.129 -23.124 1.00 0.00 H new ATOM 0 HB2 GLU A 131 17.442 -1.345 -20.733 1.00 0.00 H new ATOM 0 HB3 GLU A 131 16.244 -2.259 -21.628 1.00 0.00 H new ATOM 0 HG2 GLU A 131 17.836 -3.313 -22.968 1.00 0.00 H new ATOM 0 HG3 GLU A 131 18.903 -1.923 -22.985 1.00 0.00 H new ATOM 2241 N GLU A 132 14.611 -0.865 -23.404 1.00 0.00 N ATOM 2242 CA GLU A 132 13.586 -1.207 -24.453 1.00 0.00 C ATOM 2243 C GLU A 132 13.605 -0.147 -25.565 1.00 0.00 C ATOM 2244 O GLU A 132 13.570 -0.476 -26.736 1.00 0.00 O ATOM 2245 CB GLU A 132 12.217 -1.217 -23.754 1.00 0.00 C ATOM 2246 CG GLU A 132 12.010 -2.560 -23.052 1.00 0.00 C ATOM 2247 CD GLU A 132 11.180 -2.352 -21.785 1.00 0.00 C ATOM 2248 OE1 GLU A 132 10.224 -1.596 -21.844 1.00 0.00 O ATOM 2249 OE2 GLU A 132 11.514 -2.952 -20.776 1.00 0.00 O ATOM 0 H GLU A 132 14.239 -0.691 -22.470 1.00 0.00 H new ATOM 0 HA GLU A 132 13.796 -2.175 -24.908 1.00 0.00 H new ATOM 0 HB2 GLU A 132 12.161 -0.404 -23.030 1.00 0.00 H new ATOM 0 HB3 GLU A 132 11.424 -1.050 -24.483 1.00 0.00 H new ATOM 0 HG2 GLU A 132 11.504 -3.257 -23.720 1.00 0.00 H new ATOM 0 HG3 GLU A 132 12.974 -3.002 -22.799 1.00 0.00 H new ATOM 2256 N ALA A 133 13.662 1.124 -25.213 1.00 0.00 N ATOM 2257 CA ALA A 133 13.683 2.189 -26.280 1.00 0.00 C ATOM 2258 C ALA A 133 14.922 2.014 -27.171 1.00 0.00 C ATOM 2259 O ALA A 133 14.843 2.146 -28.378 1.00 0.00 O ATOM 2260 CB ALA A 133 13.740 3.545 -25.557 1.00 0.00 C ATOM 0 H ALA A 133 13.694 1.465 -24.252 1.00 0.00 H new ATOM 0 HA ALA A 133 12.800 2.124 -26.916 1.00 0.00 H new ATOM 0 HB1 ALA A 133 13.757 4.349 -26.293 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.863 3.655 -24.920 1.00 0.00 H new ATOM 0 HB3 ALA A 133 14.641 3.594 -24.946 1.00 0.00 H new ATOM 2266 N ARG A 134 16.068 1.712 -26.592 1.00 0.00 N ATOM 2267 CA ARG A 134 17.305 1.527 -27.436 1.00 0.00 C ATOM 2268 C ARG A 134 17.133 0.329 -28.390 1.00 0.00 C ATOM 2269 O ARG A 134 17.653 0.338 -29.489 1.00 0.00 O ATOM 2270 CB ARG A 134 18.468 1.264 -26.466 1.00 0.00 C ATOM 2271 CG ARG A 134 19.797 1.509 -27.184 1.00 0.00 C ATOM 2272 CD ARG A 134 20.823 2.056 -26.189 1.00 0.00 C ATOM 2273 NE ARG A 134 22.088 2.192 -26.974 1.00 0.00 N ATOM 2274 CZ ARG A 134 22.808 1.132 -27.309 1.00 0.00 C ATOM 2275 NH1 ARG A 134 22.439 -0.082 -26.967 1.00 0.00 N ATOM 2276 NH2 ARG A 134 23.909 1.290 -27.996 1.00 0.00 N ATOM 0 H ARG A 134 16.201 1.587 -25.588 1.00 0.00 H new ATOM 0 HA ARG A 134 17.492 2.410 -28.047 1.00 0.00 H new ATOM 0 HB2 ARG A 134 18.386 1.917 -25.597 1.00 0.00 H new ATOM 0 HB3 ARG A 134 18.424 0.239 -26.099 1.00 0.00 H new ATOM 0 HG2 ARG A 134 20.161 0.581 -27.624 1.00 0.00 H new ATOM 0 HG3 ARG A 134 19.656 2.216 -28.002 1.00 0.00 H new ATOM 0 HD2 ARG A 134 20.506 3.016 -25.782 1.00 0.00 H new ATOM 0 HD3 ARG A 134 20.953 1.380 -25.344 1.00 0.00 H new ATOM 0 HE ARG A 134 22.403 3.120 -27.257 1.00 0.00 H new ATOM 0 HH11 ARG A 134 21.582 -0.223 -26.432 1.00 0.00 H new ATOM 0 HH12 ARG A 134 23.010 -0.883 -27.236 1.00 0.00 H new ATOM 0 HH21 ARG A 134 24.209 2.225 -28.271 1.00 0.00 H new ATOM 0 HH22 ARG A 134 24.468 0.478 -28.257 1.00 0.00 H new ATOM 2290 N LYS A 135 16.414 -0.704 -27.985 1.00 0.00 N ATOM 2291 CA LYS A 135 16.233 -1.889 -28.898 1.00 0.00 C ATOM 2292 C LYS A 135 15.144 -1.618 -29.953 1.00 0.00 C ATOM 2293 O LYS A 135 15.213 -2.138 -31.051 1.00 0.00 O ATOM 2294 CB LYS A 135 15.823 -3.071 -28.005 1.00 0.00 C ATOM 2295 CG LYS A 135 17.076 -3.722 -27.413 1.00 0.00 C ATOM 2296 CD LYS A 135 16.665 -4.839 -26.451 1.00 0.00 C ATOM 2297 CE LYS A 135 16.597 -4.287 -25.026 1.00 0.00 C ATOM 2298 NZ LYS A 135 16.849 -5.463 -24.146 1.00 0.00 N ATOM 0 H LYS A 135 15.953 -0.776 -27.078 1.00 0.00 H new ATOM 0 HA LYS A 135 17.155 -2.098 -29.440 1.00 0.00 H new ATOM 0 HB2 LYS A 135 15.167 -2.726 -27.206 1.00 0.00 H new ATOM 0 HB3 LYS A 135 15.261 -3.802 -28.586 1.00 0.00 H new ATOM 0 HG2 LYS A 135 17.700 -4.126 -28.210 1.00 0.00 H new ATOM 0 HG3 LYS A 135 17.673 -2.976 -26.888 1.00 0.00 H new ATOM 0 HD2 LYS A 135 15.696 -5.245 -26.741 1.00 0.00 H new ATOM 0 HD3 LYS A 135 17.382 -5.658 -26.501 1.00 0.00 H new ATOM 0 HE2 LYS A 135 17.343 -3.508 -24.868 1.00 0.00 H new ATOM 0 HE3 LYS A 135 15.623 -3.842 -24.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 16.735 -5.183 -23.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 16.171 -6.218 -24.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 17.817 -5.810 -24.299 1.00 0.00 H new ATOM 2312 N LYS A 136 14.136 -0.820 -29.643 1.00 0.00 N ATOM 2313 CA LYS A 136 13.065 -0.551 -30.665 1.00 0.00 C ATOM 2314 C LYS A 136 13.295 0.790 -31.395 1.00 0.00 C ATOM 2315 O LYS A 136 12.364 1.364 -31.927 1.00 0.00 O ATOM 2316 CB LYS A 136 11.745 -0.508 -29.881 1.00 0.00 C ATOM 2317 CG LYS A 136 10.637 -1.209 -30.684 1.00 0.00 C ATOM 2318 CD LYS A 136 10.163 -2.459 -29.936 1.00 0.00 C ATOM 2319 CE LYS A 136 9.454 -2.044 -28.645 1.00 0.00 C ATOM 2320 NZ LYS A 136 8.018 -1.910 -29.021 1.00 0.00 N ATOM 0 H LYS A 136 14.012 -0.353 -28.744 1.00 0.00 H new ATOM 0 HA LYS A 136 13.064 -1.322 -31.435 1.00 0.00 H new ATOM 0 HB2 LYS A 136 11.870 -0.996 -28.914 1.00 0.00 H new ATOM 0 HB3 LYS A 136 11.463 0.526 -29.682 1.00 0.00 H new ATOM 0 HG2 LYS A 136 9.800 -0.527 -30.838 1.00 0.00 H new ATOM 0 HG3 LYS A 136 11.009 -1.484 -31.671 1.00 0.00 H new ATOM 0 HD2 LYS A 136 9.486 -3.037 -30.565 1.00 0.00 H new ATOM 0 HD3 LYS A 136 11.013 -3.102 -29.706 1.00 0.00 H new ATOM 0 HE2 LYS A 136 9.589 -2.791 -27.863 1.00 0.00 H new ATOM 0 HE3 LYS A 136 9.851 -1.104 -28.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 7.466 -1.627 -28.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 7.919 -1.188 -29.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 7.666 -2.822 -29.377 1.00 0.00 H new ATOM 2334 N GLY A 137 14.519 1.297 -31.445 1.00 0.00 N ATOM 2335 CA GLY A 137 14.779 2.589 -32.161 1.00 0.00 C ATOM 2336 C GLY A 137 13.800 3.682 -31.694 1.00 0.00 C ATOM 2337 O GLY A 137 13.227 4.384 -32.506 1.00 0.00 O ATOM 0 H GLY A 137 15.341 0.867 -31.020 1.00 0.00 H new ATOM 0 HA2 GLY A 137 15.804 2.911 -31.978 1.00 0.00 H new ATOM 0 HA3 GLY A 137 14.679 2.440 -33.236 1.00 0.00 H new ATOM 2341 N THR A 138 13.601 3.835 -30.400 1.00 0.00 N ATOM 2342 CA THR A 138 12.658 4.889 -29.912 1.00 0.00 C ATOM 2343 C THR A 138 13.128 5.442 -28.554 1.00 0.00 C ATOM 2344 O THR A 138 14.265 5.247 -28.167 1.00 0.00 O ATOM 2345 CB THR A 138 11.303 4.183 -29.780 1.00 0.00 C ATOM 2346 OG1 THR A 138 10.332 5.113 -29.324 1.00 0.00 O ATOM 2347 CG2 THR A 138 11.406 3.025 -28.783 1.00 0.00 C ATOM 0 H THR A 138 14.048 3.279 -29.671 1.00 0.00 H new ATOM 0 HA THR A 138 12.603 5.740 -30.590 1.00 0.00 H new ATOM 0 HB THR A 138 11.010 3.788 -30.753 1.00 0.00 H new ATOM 0 HG1 THR A 138 9.464 4.665 -29.240 1.00 0.00 H new ATOM 0 HG21 THR A 138 10.438 2.531 -28.698 1.00 0.00 H new ATOM 0 HG22 THR A 138 12.149 2.309 -29.133 1.00 0.00 H new ATOM 0 HG23 THR A 138 11.704 3.410 -27.808 1.00 0.00 H new ATOM 2355 N GLN A 139 12.270 6.133 -27.829 1.00 0.00 N ATOM 2356 CA GLN A 139 12.684 6.689 -26.507 1.00 0.00 C ATOM 2357 C GLN A 139 11.582 6.453 -25.463 1.00 0.00 C ATOM 2358 O GLN A 139 10.414 6.382 -25.798 1.00 0.00 O ATOM 2359 CB GLN A 139 12.882 8.186 -26.751 1.00 0.00 C ATOM 2360 CG GLN A 139 14.011 8.395 -27.762 1.00 0.00 C ATOM 2361 CD GLN A 139 14.693 9.743 -27.497 1.00 0.00 C ATOM 2362 OE1 GLN A 139 14.059 10.672 -27.038 1.00 0.00 O ATOM 2363 NE2 GLN A 139 15.967 9.895 -27.765 1.00 0.00 N ATOM 0 H GLN A 139 11.307 6.331 -28.100 1.00 0.00 H new ATOM 0 HA GLN A 139 13.589 6.216 -26.125 1.00 0.00 H new ATOM 0 HB2 GLN A 139 11.959 8.629 -27.124 1.00 0.00 H new ATOM 0 HB3 GLN A 139 13.121 8.689 -25.814 1.00 0.00 H new ATOM 0 HG2 GLN A 139 14.738 7.586 -27.684 1.00 0.00 H new ATOM 0 HG3 GLN A 139 13.614 8.370 -28.777 1.00 0.00 H new ATOM 0 HE21 GLN A 139 16.503 9.118 -28.150 1.00 0.00 H new ATOM 0 HE22 GLN A 139 16.422 10.791 -27.588 1.00 0.00 H new ATOM 2372 N VAL A 140 11.937 6.332 -24.199 1.00 0.00 N ATOM 2373 CA VAL A 140 10.901 6.103 -23.147 1.00 0.00 C ATOM 2374 C VAL A 140 11.122 7.063 -21.965 1.00 0.00 C ATOM 2375 O VAL A 140 12.196 7.610 -21.803 1.00 0.00 O ATOM 2376 CB VAL A 140 11.088 4.643 -22.708 1.00 0.00 C ATOM 2377 CG1 VAL A 140 12.510 4.433 -22.165 1.00 0.00 C ATOM 2378 CG2 VAL A 140 10.066 4.307 -21.616 1.00 0.00 C ATOM 0 H VAL A 140 12.897 6.383 -23.858 1.00 0.00 H new ATOM 0 HA VAL A 140 9.892 6.286 -23.515 1.00 0.00 H new ATOM 0 HB VAL A 140 10.937 3.988 -23.566 1.00 0.00 H new ATOM 0 HG11 VAL A 140 12.632 3.395 -21.857 1.00 0.00 H new ATOM 0 HG12 VAL A 140 13.235 4.668 -22.944 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.673 5.087 -21.309 1.00 0.00 H new ATOM 0 HG21 VAL A 140 10.196 3.271 -21.302 1.00 0.00 H new ATOM 0 HG22 VAL A 140 10.216 4.967 -20.761 1.00 0.00 H new ATOM 0 HG23 VAL A 140 9.058 4.444 -22.007 1.00 0.00 H new ATOM 2388 N SER A 141 10.115 7.273 -21.138 1.00 0.00 N ATOM 2389 CA SER A 141 10.289 8.200 -19.974 1.00 0.00 C ATOM 2390 C SER A 141 9.110 8.078 -18.990 1.00 0.00 C ATOM 2391 O SER A 141 8.100 8.738 -19.143 1.00 0.00 O ATOM 2392 CB SER A 141 10.325 9.592 -20.595 1.00 0.00 C ATOM 2393 OG SER A 141 10.385 10.569 -19.564 1.00 0.00 O ATOM 0 H SER A 141 9.193 6.846 -21.221 1.00 0.00 H new ATOM 0 HA SER A 141 11.189 7.974 -19.402 1.00 0.00 H new ATOM 0 HB2 SER A 141 11.190 9.687 -21.251 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.439 9.751 -21.210 1.00 0.00 H new ATOM 0 HG SER A 141 10.410 11.464 -19.962 1.00 0.00 H new ATOM 2399 N PHE A 142 9.230 7.238 -17.980 1.00 0.00 N ATOM 2400 CA PHE A 142 8.109 7.083 -16.996 1.00 0.00 C ATOM 2401 C PHE A 142 8.401 7.885 -15.711 1.00 0.00 C ATOM 2402 O PHE A 142 9.533 8.209 -15.411 1.00 0.00 O ATOM 2403 CB PHE A 142 8.038 5.576 -16.690 1.00 0.00 C ATOM 2404 CG PHE A 142 7.062 5.317 -15.557 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.685 5.259 -15.803 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.543 5.152 -14.254 1.00 0.00 C ATOM 2407 CE1 PHE A 142 4.797 5.028 -14.743 1.00 0.00 C ATOM 2408 CE2 PHE A 142 6.657 4.926 -13.205 1.00 0.00 C ATOM 2409 CZ PHE A 142 5.286 4.860 -13.443 1.00 0.00 C ATOM 0 H PHE A 142 10.050 6.659 -17.799 1.00 0.00 H new ATOM 0 HA PHE A 142 7.166 7.459 -17.393 1.00 0.00 H new ATOM 0 HB2 PHE A 142 7.726 5.031 -17.581 1.00 0.00 H new ATOM 0 HB3 PHE A 142 9.027 5.205 -16.420 1.00 0.00 H new ATOM 0 HD1 PHE A 142 5.308 5.392 -16.806 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.605 5.200 -14.062 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.734 4.980 -14.930 1.00 0.00 H new ATOM 0 HE2 PHE A 142 7.034 4.801 -12.201 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.603 4.680 -12.626 1.00 0.00 H new ATOM 2419 N HIS A 143 7.373 8.180 -14.943 1.00 0.00 N ATOM 2420 CA HIS A 143 7.562 8.930 -13.665 1.00 0.00 C ATOM 2421 C HIS A 143 6.670 8.301 -12.583 1.00 0.00 C ATOM 2422 O HIS A 143 7.152 7.799 -11.586 1.00 0.00 O ATOM 2423 CB HIS A 143 7.118 10.361 -13.971 1.00 0.00 C ATOM 2424 CG HIS A 143 8.270 11.129 -14.559 1.00 0.00 C ATOM 2425 ND1 HIS A 143 8.980 12.070 -13.831 1.00 0.00 N ATOM 2426 CD2 HIS A 143 8.846 11.105 -15.805 1.00 0.00 C ATOM 2427 CE1 HIS A 143 9.936 12.569 -14.637 1.00 0.00 C ATOM 2428 NE2 HIS A 143 9.898 12.016 -15.851 1.00 0.00 N ATOM 0 H HIS A 143 6.407 7.929 -15.153 1.00 0.00 H new ATOM 0 HA HIS A 143 8.590 8.905 -13.303 1.00 0.00 H new ATOM 0 HB2 HIS A 143 6.280 10.352 -14.668 1.00 0.00 H new ATOM 0 HB3 HIS A 143 6.770 10.848 -13.060 1.00 0.00 H new ATOM 0 HD2 HIS A 143 8.531 10.476 -16.624 1.00 0.00 H new ATOM 0 HE1 HIS A 143 10.647 13.325 -14.338 1.00 0.00 H new ATOM 0 HE2 HIS A 143 10.509 12.217 -16.643 1.00 0.00 H new ATOM 2436 N GLN A 144 5.373 8.304 -12.791 1.00 0.00 N ATOM 2437 CA GLN A 144 4.440 7.685 -11.800 1.00 0.00 C ATOM 2438 C GLN A 144 3.295 6.987 -12.555 1.00 0.00 C ATOM 2439 O GLN A 144 2.927 7.408 -13.636 1.00 0.00 O ATOM 2440 CB GLN A 144 3.912 8.849 -10.949 1.00 0.00 C ATOM 2441 CG GLN A 144 3.201 9.880 -11.835 1.00 0.00 C ATOM 2442 CD GLN A 144 2.793 11.088 -10.982 1.00 0.00 C ATOM 2443 OE1 GLN A 144 3.124 12.210 -11.310 1.00 0.00 O ATOM 2444 NE2 GLN A 144 2.083 10.912 -9.894 1.00 0.00 N ATOM 0 H GLN A 144 4.921 8.711 -13.610 1.00 0.00 H new ATOM 0 HA GLN A 144 4.924 6.935 -11.175 1.00 0.00 H new ATOM 0 HB2 GLN A 144 3.222 8.472 -10.194 1.00 0.00 H new ATOM 0 HB3 GLN A 144 4.737 9.324 -10.418 1.00 0.00 H new ATOM 0 HG2 GLN A 144 3.860 10.197 -12.643 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.321 9.433 -12.298 1.00 0.00 H new ATOM 0 HE21 GLN A 144 1.803 9.972 -9.614 1.00 0.00 H new ATOM 0 HE22 GLN A 144 1.811 11.715 -9.327 1.00 0.00 H new ATOM 2453 N CYS A 145 2.735 5.925 -12.013 1.00 0.00 N ATOM 2454 CA CYS A 145 1.622 5.227 -12.750 1.00 0.00 C ATOM 2455 C CYS A 145 0.251 5.804 -12.362 1.00 0.00 C ATOM 2456 O CYS A 145 0.080 6.338 -11.283 1.00 0.00 O ATOM 2457 CB CYS A 145 1.717 3.724 -12.413 1.00 0.00 C ATOM 2458 SG CYS A 145 1.357 3.405 -10.658 1.00 0.00 S ATOM 0 H CYS A 145 2.992 5.518 -11.114 1.00 0.00 H new ATOM 0 HA CYS A 145 1.724 5.378 -13.825 1.00 0.00 H new ATOM 0 HB2 CYS A 145 1.017 3.166 -13.035 1.00 0.00 H new ATOM 0 HB3 CYS A 145 2.716 3.360 -12.652 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.726 5.704 -13.243 1.00 0.00 N ATOM 2464 CA VAL A 146 -2.089 6.259 -12.915 1.00 0.00 C ATOM 2465 C VAL A 146 -2.810 5.394 -11.862 1.00 0.00 C ATOM 2466 O VAL A 146 -3.671 5.888 -11.159 1.00 0.00 O ATOM 2467 CB VAL A 146 -2.898 6.294 -14.229 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -2.162 7.155 -15.259 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -3.075 4.874 -14.789 1.00 0.00 C ATOM 0 H VAL A 146 -0.642 5.269 -14.162 1.00 0.00 H new ATOM 0 HA VAL A 146 -1.992 7.258 -12.490 1.00 0.00 H new ATOM 0 HB VAL A 146 -3.881 6.719 -14.024 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -2.733 7.180 -16.187 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -2.052 8.169 -14.874 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -1.177 6.730 -15.451 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -3.648 4.917 -15.715 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -2.097 4.436 -14.987 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -3.607 4.260 -14.062 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.483 4.113 -11.739 1.00 0.00 N ATOM 2480 CA HIS A 147 -3.184 3.251 -10.709 1.00 0.00 C ATOM 2481 C HIS A 147 -3.167 3.951 -9.334 1.00 0.00 C ATOM 2482 O HIS A 147 -4.207 4.268 -8.789 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.409 1.919 -10.640 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.487 1.175 -11.961 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.321 1.565 -13.009 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.831 0.049 -12.415 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -3.141 0.692 -14.018 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.247 -0.248 -13.708 1.00 0.00 N ATOM 0 H HIS A 147 -1.775 3.636 -12.297 1.00 0.00 H new ATOM 0 HA HIS A 147 -4.225 3.081 -10.982 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.366 2.113 -10.389 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.818 1.297 -9.844 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -1.104 -0.516 -11.851 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.658 0.746 -14.965 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -1.935 -1.021 -14.295 1.00 0.00 H new ATOM 2496 N CYS A 148 -1.999 4.208 -8.781 1.00 0.00 N ATOM 2497 CA CYS A 148 -1.931 4.897 -7.459 1.00 0.00 C ATOM 2498 C CYS A 148 -1.031 6.147 -7.548 1.00 0.00 C ATOM 2499 O CYS A 148 -0.672 6.581 -8.627 1.00 0.00 O ATOM 2500 CB CYS A 148 -1.339 3.848 -6.503 1.00 0.00 C ATOM 2501 SG CYS A 148 0.399 3.499 -6.921 1.00 0.00 S ATOM 0 H CYS A 148 -1.096 3.969 -9.192 1.00 0.00 H new ATOM 0 HA CYS A 148 -2.905 5.249 -7.119 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -1.406 4.207 -5.476 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -1.922 2.929 -6.558 1.00 0.00 H new ATOM 2506 N GLY A 149 -0.640 6.708 -6.421 1.00 0.00 N ATOM 2507 CA GLY A 149 0.259 7.898 -6.447 1.00 0.00 C ATOM 2508 C GLY A 149 1.693 7.415 -6.183 1.00 0.00 C ATOM 2509 O GLY A 149 2.287 7.748 -5.176 1.00 0.00 O ATOM 0 H GLY A 149 -0.908 6.389 -5.490 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.198 8.401 -7.412 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -0.045 8.622 -5.691 1.00 0.00 H new ATOM 2513 N CYS A 150 2.247 6.617 -7.074 1.00 0.00 N ATOM 2514 CA CYS A 150 3.635 6.097 -6.861 1.00 0.00 C ATOM 2515 C CYS A 150 4.620 6.840 -7.774 1.00 0.00 C ATOM 2516 O CYS A 150 4.344 7.052 -8.937 1.00 0.00 O ATOM 2517 CB CYS A 150 3.541 4.604 -7.227 1.00 0.00 C ATOM 2518 SG CYS A 150 5.172 3.813 -7.242 1.00 0.00 S ATOM 0 H CYS A 150 1.796 6.307 -7.935 1.00 0.00 H new ATOM 0 HA CYS A 150 3.997 6.241 -5.843 1.00 0.00 H new ATOM 0 HB2 CYS A 150 2.896 4.094 -6.512 1.00 0.00 H new ATOM 0 HB3 CYS A 150 3.076 4.498 -8.207 1.00 0.00 H new ATOM 2523 N ARG A 151 5.777 7.213 -7.266 1.00 0.00 N ATOM 2524 CA ARG A 151 6.776 7.920 -8.133 1.00 0.00 C ATOM 2525 C ARG A 151 7.774 6.899 -8.699 1.00 0.00 C ATOM 2526 O ARG A 151 8.973 7.052 -8.557 1.00 0.00 O ATOM 2527 CB ARG A 151 7.489 8.932 -7.226 1.00 0.00 C ATOM 2528 CG ARG A 151 8.244 9.946 -8.087 1.00 0.00 C ATOM 2529 CD ARG A 151 9.022 10.906 -7.184 1.00 0.00 C ATOM 2530 NE ARG A 151 10.210 11.320 -7.992 1.00 0.00 N ATOM 2531 CZ ARG A 151 10.090 12.160 -9.010 1.00 0.00 C ATOM 2532 NH1 ARG A 151 8.926 12.665 -9.349 1.00 0.00 N ATOM 2533 NH2 ARG A 151 11.151 12.498 -9.695 1.00 0.00 N ATOM 0 H ARG A 151 6.068 7.060 -6.300 1.00 0.00 H new ATOM 0 HA ARG A 151 6.303 8.423 -8.977 1.00 0.00 H new ATOM 0 HB2 ARG A 151 6.763 9.444 -6.594 1.00 0.00 H new ATOM 0 HB3 ARG A 151 8.182 8.416 -6.562 1.00 0.00 H new ATOM 0 HG2 ARG A 151 8.928 9.429 -8.760 1.00 0.00 H new ATOM 0 HG3 ARG A 151 7.544 10.503 -8.710 1.00 0.00 H new ATOM 0 HD2 ARG A 151 8.414 11.767 -6.907 1.00 0.00 H new ATOM 0 HD3 ARG A 151 9.325 10.418 -6.258 1.00 0.00 H new ATOM 0 HE ARG A 151 11.130 10.949 -7.755 1.00 0.00 H new ATOM 0 HH11 ARG A 151 8.088 12.413 -8.825 1.00 0.00 H new ATOM 0 HH12 ARG A 151 8.860 13.310 -10.137 1.00 0.00 H new ATOM 0 HH21 ARG A 151 12.063 12.116 -9.445 1.00 0.00 H new ATOM 0 HH22 ARG A 151 11.067 13.144 -10.480 1.00 0.00 H new ATOM 2547 N GLY A 152 7.287 5.855 -9.340 1.00 0.00 N ATOM 2548 CA GLY A 152 8.201 4.830 -9.910 1.00 0.00 C ATOM 2549 C GLY A 152 8.883 4.047 -8.778 1.00 0.00 C ATOM 2550 O GLY A 152 9.867 4.493 -8.220 1.00 0.00 O ATOM 0 H GLY A 152 6.294 5.677 -9.488 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.642 4.147 -10.550 1.00 0.00 H new ATOM 0 HA3 GLY A 152 8.953 5.310 -10.536 1.00 0.00 H new ATOM 2554 N CYS A 153 8.376 2.877 -8.441 1.00 0.00 N ATOM 2555 CA CYS A 153 9.014 2.070 -7.352 1.00 0.00 C ATOM 2556 C CYS A 153 9.789 0.882 -7.953 1.00 0.00 C ATOM 2557 O CYS A 153 9.228 0.036 -8.625 1.00 0.00 O ATOM 2558 CB CYS A 153 7.871 1.614 -6.418 1.00 0.00 C ATOM 2559 SG CYS A 153 6.734 0.462 -7.245 1.00 0.00 S ATOM 0 H CYS A 153 7.555 2.453 -8.872 1.00 0.00 H new ATOM 0 HA CYS A 153 9.744 2.651 -6.788 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.294 1.135 -5.535 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.316 2.486 -6.072 1.00 0.00 H new ATOM 2564 N ALA A 154 11.086 0.827 -7.733 1.00 0.00 N ATOM 2565 CA ALA A 154 11.903 -0.287 -8.300 1.00 0.00 C ATOM 2566 C ALA A 154 13.038 -0.651 -7.335 1.00 0.00 C ATOM 2567 O ALA A 154 13.469 0.171 -6.548 1.00 0.00 O ATOM 2568 CB ALA A 154 12.467 0.268 -9.605 1.00 0.00 C ATOM 0 H ALA A 154 11.609 1.509 -7.184 1.00 0.00 H new ATOM 0 HA ALA A 154 11.319 -1.193 -8.460 1.00 0.00 H new ATOM 0 HB1 ALA A 154 13.083 -0.491 -10.087 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.647 0.545 -10.267 1.00 0.00 H new ATOM 0 HB3 ALA A 154 13.075 1.148 -9.394 1.00 0.00 H new ATOM 2574 N SER A 155 13.528 -1.870 -7.386 1.00 0.00 N ATOM 2575 CA SER A 155 14.641 -2.265 -6.453 1.00 0.00 C ATOM 2576 C SER A 155 16.005 -1.831 -7.019 1.00 0.00 C ATOM 2577 O SER A 155 16.889 -1.454 -6.273 1.00 0.00 O ATOM 2578 CB SER A 155 14.578 -3.790 -6.324 1.00 0.00 C ATOM 2579 OG SER A 155 13.231 -4.218 -6.483 1.00 0.00 O ATOM 0 H SER A 155 13.212 -2.601 -8.023 1.00 0.00 H new ATOM 0 HA SER A 155 14.528 -1.781 -5.483 1.00 0.00 H new ATOM 0 HB2 SER A 155 15.212 -4.257 -7.078 1.00 0.00 H new ATOM 0 HB3 SER A 155 14.958 -4.101 -5.351 1.00 0.00 H new ATOM 0 HG SER A 155 13.217 -5.117 -6.874 1.00 0.00 H new ATOM 2585 N THR A 156 16.190 -1.872 -8.326 1.00 0.00 N ATOM 2586 CA THR A 156 17.517 -1.447 -8.900 1.00 0.00 C ATOM 2587 C THR A 156 17.598 0.085 -8.966 1.00 0.00 C ATOM 2588 O THR A 156 18.637 0.664 -8.704 1.00 0.00 O ATOM 2589 CB THR A 156 17.603 -2.049 -10.311 1.00 0.00 C ATOM 2590 OG1 THR A 156 16.542 -1.540 -11.108 1.00 0.00 O ATOM 2591 CG2 THR A 156 17.495 -3.573 -10.227 1.00 0.00 C ATOM 0 H THR A 156 15.494 -2.175 -9.007 1.00 0.00 H new ATOM 0 HA THR A 156 18.343 -1.794 -8.279 1.00 0.00 H new ATOM 0 HB THR A 156 18.558 -1.780 -10.762 1.00 0.00 H new ATOM 0 HG1 THR A 156 16.825 -1.504 -12.045 1.00 0.00 H new ATOM 0 HG21 THR A 156 17.556 -3.998 -11.229 1.00 0.00 H new ATOM 0 HG22 THR A 156 18.310 -3.962 -9.617 1.00 0.00 H new ATOM 0 HG23 THR A 156 16.541 -3.846 -9.775 1.00 0.00 H new ATOM 2599 N ASP A 157 16.517 0.750 -9.314 1.00 0.00 N ATOM 2600 CA ASP A 157 16.546 2.241 -9.390 1.00 0.00 C ATOM 2601 C ASP A 157 15.311 2.830 -8.703 1.00 0.00 C ATOM 2602 O ASP A 157 14.736 2.145 -7.874 1.00 0.00 O ATOM 2603 CB ASP A 157 16.532 2.562 -10.884 1.00 0.00 C ATOM 2604 CG ASP A 157 17.968 2.641 -11.404 1.00 0.00 C ATOM 2605 OD1 ASP A 157 18.732 3.421 -10.859 1.00 0.00 O ATOM 2606 OD2 ASP A 157 18.279 1.921 -12.338 1.00 0.00 O ATOM 2607 OXT ASP A 157 14.962 3.956 -9.017 1.00 0.00 O ATOM 0 H ASP A 157 15.621 0.322 -9.547 1.00 0.00 H new ATOM 0 HA ASP A 157 17.418 2.663 -8.891 1.00 0.00 H new ATOM 0 HB2 ASP A 157 15.980 1.795 -11.426 1.00 0.00 H new ATOM 0 HB3 ASP A 157 16.019 3.508 -11.059 1.00 0.00 H new TER 2612 ASP A 157 HETATM 2613 ZN ZN A1000 0.962 1.291 -6.649 1.00 0.00 ZN HETATM 2614 ZN ZN A1001 4.763 1.581 -7.653 1.00 0.00 ZN HETATM 2615 ZN ZN A1002 1.906 1.195 -10.275 1.00 0.00 ZN