USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 559 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: B 18 THR OG1 : rot -35:sc= 0.12 USER MOD Set 1.2: B 20 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A2085 GLN : amide:sc= 0.706 K(o=2.4,f=0.78) USER MOD Set 2.2: A2086 GLN : amide:sc= 0.289 K(o=2.4,f=-0.75) USER MOD Set 2.3: A2089 ASN : amide:sc= 1.36 K(o=2.4,f=-0.67) USER MOD Single : A2064 SER OG : rot 180:sc= 0 USER MOD Single : A2066 SER OG : rot 180:sc= 0 USER MOD Single : A2069 GLN : amide:sc= -0.0791 X(o=-0.079,f=-0.079) USER MOD Single : A2074 THR OG1 : rot 90:sc= 1.22 USER MOD Single : A2076 LYS NZ :NH3+ -170:sc= 0.863 (180deg=0.807) USER MOD Single : A2077 SER OG : rot 180:sc= 0 USER MOD Single : A2079 SER OG : rot 180:sc= 0.00394 USER MOD Single : A2080 SER OG : rot 180:sc= 0.375 USER MOD Single : A2082 GLN : amide:sc= -0.621 K(o=-0.62,f=-1.4) USER MOD Single : A2083 GLN : amide:sc= 0.515 K(o=0.52,f=-0.82) USER MOD Single : A2084 GLN : amide:sc= -0.0556 K(o=-0.056,f=-3.8!) USER MOD Single : A2092 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2093 SER OG : rot 180:sc= 0 USER MOD Single : A2094 ASN : amide:sc= 0.761 K(o=0.76,f=-0.036) USER MOD Single : A2096 GLN : amide:sc= -1.33 X(o=-1.3,f=-1.3) USER MOD Single : A2098 MET CE :methyl 163:sc= -0.0108 (180deg=-0.3) USER MOD Single : A2103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2104 GLN : amide:sc= -0.0757 X(o=-0.076,f=-0.076) USER MOD Single : A2106 THR OG1 : rot 180:sc= 0 USER MOD Single : A2108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 LYS NZ :NH3+ 178:sc= 1.22 (180deg=1.08) USER MOD Single : B 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 52 GLN : amide:sc= -0.38 X(o=-0.38,f=-0.57) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 64 N ILE A2063 4.385 -6.393 -14.581 1.00 0.00 N ATOM 65 CA ILE A2063 5.448 -6.801 -15.525 1.00 0.00 C ATOM 66 C ILE A2063 4.863 -7.395 -16.822 1.00 0.00 C ATOM 67 O ILE A2063 3.661 -7.662 -16.908 1.00 0.00 O ATOM 68 CB ILE A2063 6.422 -7.812 -14.857 1.00 0.00 C ATOM 69 CG1 ILE A2063 5.684 -9.035 -14.261 1.00 0.00 C ATOM 70 CG2 ILE A2063 7.292 -7.116 -13.797 1.00 0.00 C ATOM 71 CD1 ILE A2063 6.616 -10.169 -13.819 1.00 0.00 C ATOM 0 HA ILE A2063 6.005 -5.903 -15.793 1.00 0.00 H new ATOM 0 HB ILE A2063 7.076 -8.193 -15.641 1.00 0.00 H new ATOM 0 HG12 ILE A2063 5.094 -8.709 -13.405 1.00 0.00 H new ATOM 0 HG13 ILE A2063 4.984 -9.421 -15.002 1.00 0.00 H new ATOM 0 HG21 ILE A2063 7.965 -7.844 -13.344 1.00 0.00 H new ATOM 0 HG22 ILE A2063 7.876 -6.325 -14.268 1.00 0.00 H new ATOM 0 HG23 ILE A2063 6.652 -6.685 -13.027 1.00 0.00 H new ATOM 0 HD11 ILE A2063 6.024 -10.989 -13.413 1.00 0.00 H new ATOM 0 HD12 ILE A2063 7.188 -10.524 -14.676 1.00 0.00 H new ATOM 0 HD13 ILE A2063 7.299 -9.801 -13.054 1.00 0.00 H new ATOM 83 N SER A2064 5.727 -7.639 -17.812 1.00 0.00 N ATOM 84 CA SER A2064 5.390 -8.241 -19.114 1.00 0.00 C ATOM 85 C SER A2064 6.270 -9.477 -19.365 1.00 0.00 C ATOM 86 O SER A2064 7.462 -9.442 -19.044 1.00 0.00 O ATOM 87 CB SER A2064 5.588 -7.223 -20.247 1.00 0.00 C ATOM 88 OG SER A2064 4.714 -6.115 -20.084 1.00 0.00 O ATOM 0 H SER A2064 6.719 -7.416 -17.730 1.00 0.00 H new ATOM 0 HA SER A2064 4.343 -8.542 -19.095 1.00 0.00 H new ATOM 0 HB2 SER A2064 6.622 -6.879 -20.257 1.00 0.00 H new ATOM 0 HB3 SER A2064 5.402 -7.701 -21.209 1.00 0.00 H new ATOM 0 HG SER A2064 4.856 -5.476 -20.814 1.00 0.00 H new ATOM 94 N PRO A2065 5.732 -10.578 -19.932 1.00 0.00 N ATOM 95 CA PRO A2065 6.480 -11.822 -20.151 1.00 0.00 C ATOM 96 C PRO A2065 7.610 -11.704 -21.183 1.00 0.00 C ATOM 97 O PRO A2065 8.555 -12.490 -21.148 1.00 0.00 O ATOM 98 CB PRO A2065 5.431 -12.857 -20.574 1.00 0.00 C ATOM 99 CG PRO A2065 4.326 -12.015 -21.209 1.00 0.00 C ATOM 100 CD PRO A2065 4.351 -10.735 -20.377 1.00 0.00 C ATOM 0 HA PRO A2065 7.003 -12.107 -19.238 1.00 0.00 H new ATOM 0 HB2 PRO A2065 5.842 -13.577 -21.281 1.00 0.00 H new ATOM 0 HB3 PRO A2065 5.061 -13.424 -19.720 1.00 0.00 H new ATOM 0 HG2 PRO A2065 4.524 -11.816 -22.262 1.00 0.00 H new ATOM 0 HG3 PRO A2065 3.358 -12.513 -21.156 1.00 0.00 H new ATOM 0 HD2 PRO A2065 4.031 -9.877 -20.969 1.00 0.00 H new ATOM 0 HD3 PRO A2065 3.672 -10.807 -19.527 1.00 0.00 H new ATOM 108 N SER A2066 7.556 -10.721 -22.087 1.00 0.00 N ATOM 109 CA SER A2066 8.591 -10.497 -23.107 1.00 0.00 C ATOM 110 C SER A2066 9.980 -10.229 -22.516 1.00 0.00 C ATOM 111 O SER A2066 10.979 -10.700 -23.062 1.00 0.00 O ATOM 112 CB SER A2066 8.171 -9.349 -24.033 1.00 0.00 C ATOM 113 OG SER A2066 7.821 -8.199 -23.273 1.00 0.00 O ATOM 0 H SER A2066 6.788 -10.052 -22.134 1.00 0.00 H new ATOM 0 HA SER A2066 8.677 -11.422 -23.677 1.00 0.00 H new ATOM 0 HB2 SER A2066 8.986 -9.107 -24.715 1.00 0.00 H new ATOM 0 HB3 SER A2066 7.324 -9.659 -24.645 1.00 0.00 H new ATOM 0 HG SER A2066 7.557 -7.475 -23.878 1.00 0.00 H new ATOM 119 N ALA A2067 10.058 -9.532 -21.378 1.00 0.00 N ATOM 120 CA ALA A2067 11.313 -9.264 -20.675 1.00 0.00 C ATOM 121 C ALA A2067 11.998 -10.560 -20.198 1.00 0.00 C ATOM 122 O ALA A2067 13.220 -10.686 -20.268 1.00 0.00 O ATOM 123 CB ALA A2067 11.005 -8.340 -19.494 1.00 0.00 C ATOM 0 H ALA A2067 9.241 -9.134 -20.915 1.00 0.00 H new ATOM 0 HA ALA A2067 12.013 -8.785 -21.359 1.00 0.00 H new ATOM 0 HB1 ALA A2067 11.925 -8.124 -18.952 1.00 0.00 H new ATOM 0 HB2 ALA A2067 10.574 -7.409 -19.863 1.00 0.00 H new ATOM 0 HB3 ALA A2067 10.296 -8.828 -18.825 1.00 0.00 H new ATOM 129 N LEU A2068 11.202 -11.539 -19.750 1.00 0.00 N ATOM 130 CA LEU A2068 11.679 -12.846 -19.294 1.00 0.00 C ATOM 131 C LEU A2068 12.264 -13.622 -20.483 1.00 0.00 C ATOM 132 O LEU A2068 13.376 -14.140 -20.396 1.00 0.00 O ATOM 133 CB LEU A2068 10.531 -13.646 -18.638 1.00 0.00 C ATOM 134 CG LEU A2068 9.986 -13.141 -17.286 1.00 0.00 C ATOM 135 CD1 LEU A2068 9.454 -11.706 -17.302 1.00 0.00 C ATOM 136 CD2 LEU A2068 8.833 -14.050 -16.855 1.00 0.00 C ATOM 0 H LEU A2068 10.188 -11.440 -19.694 1.00 0.00 H new ATOM 0 HA LEU A2068 12.457 -12.698 -18.545 1.00 0.00 H new ATOM 0 HB2 LEU A2068 9.700 -13.680 -19.343 1.00 0.00 H new ATOM 0 HB3 LEU A2068 10.873 -14.672 -18.500 1.00 0.00 H new ATOM 0 HG LEU A2068 10.833 -13.159 -16.600 1.00 0.00 H new ATOM 0 HD11 LEU A2068 9.093 -11.441 -16.308 1.00 0.00 H new ATOM 0 HD12 LEU A2068 10.254 -11.025 -17.591 1.00 0.00 H new ATOM 0 HD13 LEU A2068 8.636 -11.629 -18.018 1.00 0.00 H new ATOM 0 HD21 LEU A2068 8.436 -13.706 -15.900 1.00 0.00 H new ATOM 0 HD22 LEU A2068 8.045 -14.020 -17.607 1.00 0.00 H new ATOM 0 HD23 LEU A2068 9.195 -15.073 -16.750 1.00 0.00 H new ATOM 148 N GLN A2069 11.548 -13.660 -21.615 1.00 0.00 N ATOM 149 CA GLN A2069 12.029 -14.327 -22.833 1.00 0.00 C ATOM 150 C GLN A2069 13.324 -13.685 -23.355 1.00 0.00 C ATOM 151 O GLN A2069 14.239 -14.393 -23.779 1.00 0.00 O ATOM 152 CB GLN A2069 10.950 -14.318 -23.931 1.00 0.00 C ATOM 153 CG GLN A2069 9.610 -14.955 -23.522 1.00 0.00 C ATOM 154 CD GLN A2069 9.759 -16.346 -22.908 1.00 0.00 C ATOM 155 OE1 GLN A2069 10.282 -17.275 -23.509 1.00 0.00 O ATOM 156 NE2 GLN A2069 9.313 -16.545 -21.684 1.00 0.00 N ATOM 0 H GLN A2069 10.627 -13.233 -21.713 1.00 0.00 H new ATOM 0 HA GLN A2069 12.248 -15.362 -22.569 1.00 0.00 H new ATOM 0 HB2 GLN A2069 10.769 -13.287 -24.235 1.00 0.00 H new ATOM 0 HB3 GLN A2069 11.335 -14.844 -24.804 1.00 0.00 H new ATOM 0 HG2 GLN A2069 9.110 -14.302 -22.806 1.00 0.00 H new ATOM 0 HG3 GLN A2069 8.965 -15.020 -24.398 1.00 0.00 H new ATOM 0 HE21 GLN A2069 8.875 -15.781 -21.170 1.00 0.00 H new ATOM 0 HE22 GLN A2069 9.406 -17.464 -21.250 1.00 0.00 H new ATOM 165 N ASP A2070 13.434 -12.353 -23.298 1.00 0.00 N ATOM 166 CA ASP A2070 14.642 -11.642 -23.726 1.00 0.00 C ATOM 167 C ASP A2070 15.839 -11.923 -22.797 1.00 0.00 C ATOM 168 O ASP A2070 16.969 -12.069 -23.266 1.00 0.00 O ATOM 169 CB ASP A2070 14.356 -10.139 -23.866 1.00 0.00 C ATOM 170 CG ASP A2070 15.336 -9.443 -24.826 1.00 0.00 C ATOM 171 OD1 ASP A2070 15.579 -9.985 -25.932 1.00 0.00 O ATOM 172 OD2 ASP A2070 15.796 -8.320 -24.518 1.00 0.00 O ATOM 0 H ASP A2070 12.693 -11.742 -22.956 1.00 0.00 H new ATOM 0 HA ASP A2070 14.927 -12.021 -24.707 1.00 0.00 H new ATOM 0 HB2 ASP A2070 13.337 -9.998 -24.226 1.00 0.00 H new ATOM 0 HB3 ASP A2070 14.416 -9.668 -22.885 1.00 0.00 H new ATOM 177 N LEU A2071 15.602 -12.084 -21.488 1.00 0.00 N ATOM 178 CA LEU A2071 16.642 -12.488 -20.537 1.00 0.00 C ATOM 179 C LEU A2071 17.111 -13.914 -20.868 1.00 0.00 C ATOM 180 O LEU A2071 18.311 -14.141 -21.013 1.00 0.00 O ATOM 181 CB LEU A2071 16.106 -12.338 -19.099 1.00 0.00 C ATOM 182 CG LEU A2071 17.185 -12.457 -18.002 1.00 0.00 C ATOM 183 CD1 LEU A2071 16.681 -11.795 -16.718 1.00 0.00 C ATOM 184 CD2 LEU A2071 17.557 -13.901 -17.642 1.00 0.00 C ATOM 0 H LEU A2071 14.687 -11.938 -21.062 1.00 0.00 H new ATOM 0 HA LEU A2071 17.517 -11.843 -20.617 1.00 0.00 H new ATOM 0 HB2 LEU A2071 15.616 -11.369 -19.006 1.00 0.00 H new ATOM 0 HB3 LEU A2071 15.344 -13.098 -18.927 1.00 0.00 H new ATOM 0 HG LEU A2071 18.071 -11.971 -18.411 1.00 0.00 H new ATOM 0 HD11 LEU A2071 17.442 -11.879 -15.943 1.00 0.00 H new ATOM 0 HD12 LEU A2071 16.472 -10.743 -16.909 1.00 0.00 H new ATOM 0 HD13 LEU A2071 15.769 -12.292 -16.386 1.00 0.00 H new ATOM 0 HD21 LEU A2071 18.321 -13.897 -16.864 1.00 0.00 H new ATOM 0 HD22 LEU A2071 16.673 -14.425 -17.279 1.00 0.00 H new ATOM 0 HD23 LEU A2071 17.942 -14.409 -18.526 1.00 0.00 H new ATOM 196 N LEU A2072 16.182 -14.861 -21.052 1.00 0.00 N ATOM 197 CA LEU A2072 16.486 -16.249 -21.431 1.00 0.00 C ATOM 198 C LEU A2072 17.268 -16.365 -22.753 1.00 0.00 C ATOM 199 O LEU A2072 18.150 -17.223 -22.851 1.00 0.00 O ATOM 200 CB LEU A2072 15.195 -17.098 -21.454 1.00 0.00 C ATOM 201 CG LEU A2072 14.853 -17.795 -20.120 1.00 0.00 C ATOM 202 CD1 LEU A2072 14.639 -16.865 -18.926 1.00 0.00 C ATOM 203 CD2 LEU A2072 13.586 -18.634 -20.296 1.00 0.00 C ATOM 0 H LEU A2072 15.184 -14.683 -20.940 1.00 0.00 H new ATOM 0 HA LEU A2072 17.152 -16.646 -20.665 1.00 0.00 H new ATOM 0 HB2 LEU A2072 14.360 -16.456 -21.737 1.00 0.00 H new ATOM 0 HB3 LEU A2072 15.290 -17.857 -22.230 1.00 0.00 H new ATOM 0 HG LEU A2072 15.731 -18.397 -19.887 1.00 0.00 H new ATOM 0 HD11 LEU A2072 14.404 -17.457 -18.041 1.00 0.00 H new ATOM 0 HD12 LEU A2072 15.546 -16.288 -18.747 1.00 0.00 H new ATOM 0 HD13 LEU A2072 13.813 -16.186 -19.137 1.00 0.00 H new ATOM 0 HD21 LEU A2072 13.343 -19.127 -19.355 1.00 0.00 H new ATOM 0 HD22 LEU A2072 12.760 -17.987 -20.591 1.00 0.00 H new ATOM 0 HD23 LEU A2072 13.752 -19.386 -21.067 1.00 0.00 H new ATOM 215 N ARG A2073 16.994 -15.532 -23.770 1.00 0.00 N ATOM 216 CA ARG A2073 17.763 -15.556 -25.035 1.00 0.00 C ATOM 217 C ARG A2073 19.155 -14.925 -24.880 1.00 0.00 C ATOM 218 O ARG A2073 20.105 -15.368 -25.526 1.00 0.00 O ATOM 219 CB ARG A2073 16.943 -14.995 -26.217 1.00 0.00 C ATOM 220 CG ARG A2073 16.927 -13.468 -26.377 1.00 0.00 C ATOM 221 CD ARG A2073 16.119 -13.000 -27.598 1.00 0.00 C ATOM 222 NE ARG A2073 14.725 -13.497 -27.596 1.00 0.00 N ATOM 223 CZ ARG A2073 13.611 -12.814 -27.390 1.00 0.00 C ATOM 224 NH1 ARG A2073 13.597 -11.558 -27.049 1.00 0.00 N ATOM 225 NH2 ARG A2073 12.456 -13.399 -27.529 1.00 0.00 N ATOM 0 H ARG A2073 16.250 -14.835 -23.746 1.00 0.00 H new ATOM 0 HA ARG A2073 17.954 -16.600 -25.286 1.00 0.00 H new ATOM 0 HB2 ARG A2073 17.331 -15.430 -27.138 1.00 0.00 H new ATOM 0 HB3 ARG A2073 15.914 -15.338 -26.111 1.00 0.00 H new ATOM 0 HG2 ARG A2073 16.508 -13.018 -25.477 1.00 0.00 H new ATOM 0 HG3 ARG A2073 17.952 -13.107 -26.466 1.00 0.00 H new ATOM 0 HD2 ARG A2073 16.110 -11.910 -27.624 1.00 0.00 H new ATOM 0 HD3 ARG A2073 16.617 -13.337 -28.507 1.00 0.00 H new ATOM 0 HE ARG A2073 14.608 -14.494 -27.777 1.00 0.00 H new ATOM 0 HH11 ARG A2073 14.475 -11.053 -26.928 1.00 0.00 H new ATOM 0 HH12 ARG A2073 12.708 -11.079 -26.903 1.00 0.00 H new ATOM 0 HH21 ARG A2073 12.411 -14.382 -27.796 1.00 0.00 H new ATOM 0 HH22 ARG A2073 11.596 -12.874 -27.371 1.00 0.00 H new ATOM 239 N THR A2074 19.290 -13.935 -23.994 1.00 0.00 N ATOM 240 CA THR A2074 20.563 -13.255 -23.681 1.00 0.00 C ATOM 241 C THR A2074 21.495 -14.150 -22.851 1.00 0.00 C ATOM 242 O THR A2074 22.685 -14.247 -23.155 1.00 0.00 O ATOM 243 CB THR A2074 20.288 -11.937 -22.927 1.00 0.00 C ATOM 244 OG1 THR A2074 19.490 -11.089 -23.722 1.00 0.00 O ATOM 245 CG2 THR A2074 21.541 -11.123 -22.602 1.00 0.00 C ATOM 0 H THR A2074 18.502 -13.571 -23.458 1.00 0.00 H new ATOM 0 HA THR A2074 21.063 -13.037 -24.624 1.00 0.00 H new ATOM 0 HB THR A2074 19.810 -12.247 -21.997 1.00 0.00 H new ATOM 0 HG1 THR A2074 18.543 -11.266 -23.541 1.00 0.00 H new ATOM 0 HG21 THR A2074 21.257 -10.214 -22.072 1.00 0.00 H new ATOM 0 HG22 THR A2074 22.207 -11.715 -21.975 1.00 0.00 H new ATOM 0 HG23 THR A2074 22.054 -10.859 -23.527 1.00 0.00 H new ATOM 253 N LEU A2075 20.971 -14.816 -21.816 1.00 0.00 N ATOM 254 CA LEU A2075 21.706 -15.691 -20.890 1.00 0.00 C ATOM 255 C LEU A2075 22.432 -16.871 -21.569 1.00 0.00 C ATOM 256 O LEU A2075 23.520 -17.252 -21.135 1.00 0.00 O ATOM 257 CB LEU A2075 20.696 -16.184 -19.833 1.00 0.00 C ATOM 258 CG LEU A2075 21.235 -17.170 -18.777 1.00 0.00 C ATOM 259 CD1 LEU A2075 22.412 -16.606 -17.979 1.00 0.00 C ATOM 260 CD2 LEU A2075 20.111 -17.520 -17.802 1.00 0.00 C ATOM 0 H LEU A2075 19.978 -14.758 -21.589 1.00 0.00 H new ATOM 0 HA LEU A2075 22.512 -15.114 -20.437 1.00 0.00 H new ATOM 0 HB2 LEU A2075 20.293 -15.314 -19.314 1.00 0.00 H new ATOM 0 HB3 LEU A2075 19.864 -16.660 -20.352 1.00 0.00 H new ATOM 0 HG LEU A2075 21.591 -18.050 -19.313 1.00 0.00 H new ATOM 0 HD11 LEU A2075 22.747 -17.346 -17.252 1.00 0.00 H new ATOM 0 HD12 LEU A2075 23.231 -16.368 -18.658 1.00 0.00 H new ATOM 0 HD13 LEU A2075 22.098 -15.702 -17.458 1.00 0.00 H new ATOM 0 HD21 LEU A2075 20.484 -18.217 -17.052 1.00 0.00 H new ATOM 0 HD22 LEU A2075 19.759 -16.613 -17.311 1.00 0.00 H new ATOM 0 HD23 LEU A2075 19.287 -17.980 -18.347 1.00 0.00 H new ATOM 272 N LYS A2076 21.845 -17.465 -22.620 1.00 0.00 N ATOM 273 CA LYS A2076 22.423 -18.629 -23.325 1.00 0.00 C ATOM 274 C LYS A2076 23.717 -18.362 -24.111 1.00 0.00 C ATOM 275 O LYS A2076 24.451 -19.312 -24.396 1.00 0.00 O ATOM 276 CB LYS A2076 21.366 -19.290 -24.227 1.00 0.00 C ATOM 277 CG LYS A2076 20.354 -20.093 -23.394 1.00 0.00 C ATOM 278 CD LYS A2076 19.461 -20.993 -24.261 1.00 0.00 C ATOM 279 CE LYS A2076 18.537 -20.232 -25.223 1.00 0.00 C ATOM 280 NZ LYS A2076 17.457 -19.511 -24.500 1.00 0.00 N ATOM 0 H LYS A2076 20.955 -17.154 -23.008 1.00 0.00 H new ATOM 0 HA LYS A2076 22.726 -19.310 -22.530 1.00 0.00 H new ATOM 0 HB2 LYS A2076 20.844 -18.525 -24.802 1.00 0.00 H new ATOM 0 HB3 LYS A2076 21.856 -19.949 -24.944 1.00 0.00 H new ATOM 0 HG2 LYS A2076 20.890 -20.707 -22.670 1.00 0.00 H new ATOM 0 HG3 LYS A2076 19.728 -19.405 -22.826 1.00 0.00 H new ATOM 0 HD2 LYS A2076 20.095 -21.664 -24.840 1.00 0.00 H new ATOM 0 HD3 LYS A2076 18.851 -21.617 -23.608 1.00 0.00 H new ATOM 0 HE2 LYS A2076 19.124 -19.520 -25.803 1.00 0.00 H new ATOM 0 HE3 LYS A2076 18.095 -20.932 -25.932 1.00 0.00 H new ATOM 0 HZ1 LYS A2076 16.761 -19.152 -25.184 1.00 0.00 H new ATOM 0 HZ2 LYS A2076 16.988 -20.162 -23.838 1.00 0.00 H new ATOM 0 HZ3 LYS A2076 17.865 -18.714 -23.972 1.00 0.00 H new ATOM 294 N SER A2077 24.023 -17.110 -24.451 1.00 0.00 N ATOM 295 CA SER A2077 25.262 -16.749 -25.166 1.00 0.00 C ATOM 296 C SER A2077 26.484 -16.700 -24.223 1.00 0.00 C ATOM 297 O SER A2077 26.306 -16.619 -23.003 1.00 0.00 O ATOM 298 CB SER A2077 25.101 -15.379 -25.823 1.00 0.00 C ATOM 299 OG SER A2077 24.106 -15.407 -26.835 1.00 0.00 O ATOM 0 H SER A2077 23.423 -16.312 -24.242 1.00 0.00 H new ATOM 0 HA SER A2077 25.436 -17.520 -25.916 1.00 0.00 H new ATOM 0 HB2 SER A2077 24.834 -14.640 -25.068 1.00 0.00 H new ATOM 0 HB3 SER A2077 26.052 -15.065 -26.253 1.00 0.00 H new ATOM 0 HG SER A2077 24.023 -14.517 -27.237 1.00 0.00 H new ATOM 305 N PRO A2078 27.729 -16.729 -24.751 1.00 0.00 N ATOM 306 CA PRO A2078 28.961 -16.648 -23.958 1.00 0.00 C ATOM 307 C PRO A2078 28.993 -15.487 -22.953 1.00 0.00 C ATOM 308 O PRO A2078 28.472 -14.396 -23.206 1.00 0.00 O ATOM 309 CB PRO A2078 30.104 -16.515 -24.967 1.00 0.00 C ATOM 310 CG PRO A2078 29.544 -17.221 -26.193 1.00 0.00 C ATOM 311 CD PRO A2078 28.069 -16.850 -26.163 1.00 0.00 C ATOM 0 HA PRO A2078 29.043 -17.542 -23.339 1.00 0.00 H new ATOM 0 HB2 PRO A2078 30.344 -15.472 -25.173 1.00 0.00 H new ATOM 0 HB3 PRO A2078 31.019 -16.988 -24.609 1.00 0.00 H new ATOM 0 HG2 PRO A2078 30.026 -16.881 -27.109 1.00 0.00 H new ATOM 0 HG3 PRO A2078 29.689 -18.300 -26.138 1.00 0.00 H new ATOM 0 HD2 PRO A2078 27.888 -15.914 -26.692 1.00 0.00 H new ATOM 0 HD3 PRO A2078 27.462 -17.614 -26.649 1.00 0.00 H new ATOM 319 N SER A2079 29.640 -15.725 -21.814 1.00 0.00 N ATOM 320 CA SER A2079 29.793 -14.747 -20.729 1.00 0.00 C ATOM 321 C SER A2079 30.783 -13.620 -21.072 1.00 0.00 C ATOM 322 O SER A2079 31.878 -13.857 -21.592 1.00 0.00 O ATOM 323 CB SER A2079 30.213 -15.454 -19.431 1.00 0.00 C ATOM 324 OG SER A2079 31.331 -16.310 -19.626 1.00 0.00 O ATOM 0 H SER A2079 30.083 -16.621 -21.611 1.00 0.00 H new ATOM 0 HA SER A2079 28.820 -14.276 -20.589 1.00 0.00 H new ATOM 0 HB2 SER A2079 30.456 -14.708 -18.675 1.00 0.00 H new ATOM 0 HB3 SER A2079 29.374 -16.035 -19.048 1.00 0.00 H new ATOM 0 HG SER A2079 31.567 -16.739 -18.777 1.00 0.00 H new ATOM 330 N SER A2080 30.396 -12.379 -20.760 1.00 0.00 N ATOM 331 CA SER A2080 31.194 -11.157 -20.950 1.00 0.00 C ATOM 332 C SER A2080 30.600 -9.988 -20.147 1.00 0.00 C ATOM 333 O SER A2080 29.402 -10.020 -19.829 1.00 0.00 O ATOM 334 CB SER A2080 31.254 -10.764 -22.438 1.00 0.00 C ATOM 335 OG SER A2080 30.004 -10.288 -22.904 1.00 0.00 O ATOM 0 H SER A2080 29.481 -12.187 -20.351 1.00 0.00 H new ATOM 0 HA SER A2080 32.202 -11.367 -20.593 1.00 0.00 H new ATOM 0 HB2 SER A2080 32.013 -9.995 -22.581 1.00 0.00 H new ATOM 0 HB3 SER A2080 31.559 -11.627 -23.030 1.00 0.00 H new ATOM 0 HG SER A2080 30.078 -10.046 -23.851 1.00 0.00 H new ATOM 341 N PRO A2081 31.379 -8.929 -19.840 1.00 0.00 N ATOM 342 CA PRO A2081 30.855 -7.728 -19.181 1.00 0.00 C ATOM 343 C PRO A2081 29.692 -7.105 -19.973 1.00 0.00 C ATOM 344 O PRO A2081 28.745 -6.578 -19.392 1.00 0.00 O ATOM 345 CB PRO A2081 32.035 -6.753 -19.083 1.00 0.00 C ATOM 346 CG PRO A2081 33.269 -7.640 -19.220 1.00 0.00 C ATOM 347 CD PRO A2081 32.797 -8.770 -20.130 1.00 0.00 C ATOM 0 HA PRO A2081 30.450 -7.970 -18.198 1.00 0.00 H new ATOM 0 HB2 PRO A2081 31.996 -6.001 -19.871 1.00 0.00 H new ATOM 0 HB3 PRO A2081 32.032 -6.219 -18.133 1.00 0.00 H new ATOM 0 HG2 PRO A2081 34.107 -7.097 -19.657 1.00 0.00 H new ATOM 0 HG3 PRO A2081 33.602 -8.016 -18.253 1.00 0.00 H new ATOM 0 HD2 PRO A2081 32.959 -8.524 -21.179 1.00 0.00 H new ATOM 0 HD3 PRO A2081 33.345 -9.691 -19.931 1.00 0.00 H new ATOM 355 N GLN A2082 29.738 -7.203 -21.307 1.00 0.00 N ATOM 356 CA GLN A2082 28.693 -6.715 -22.211 1.00 0.00 C ATOM 357 C GLN A2082 27.402 -7.538 -22.071 1.00 0.00 C ATOM 358 O GLN A2082 26.315 -6.962 -22.001 1.00 0.00 O ATOM 359 CB GLN A2082 29.197 -6.747 -23.666 1.00 0.00 C ATOM 360 CG GLN A2082 30.248 -5.669 -23.987 1.00 0.00 C ATOM 361 CD GLN A2082 31.571 -5.836 -23.239 1.00 0.00 C ATOM 362 OE1 GLN A2082 32.144 -6.915 -23.158 1.00 0.00 O ATOM 363 NE2 GLN A2082 32.098 -4.791 -22.634 1.00 0.00 N ATOM 0 H GLN A2082 30.521 -7.634 -21.798 1.00 0.00 H new ATOM 0 HA GLN A2082 28.461 -5.686 -21.937 1.00 0.00 H new ATOM 0 HB2 GLN A2082 29.624 -7.729 -23.871 1.00 0.00 H new ATOM 0 HB3 GLN A2082 28.347 -6.623 -24.337 1.00 0.00 H new ATOM 0 HG2 GLN A2082 30.446 -5.680 -25.059 1.00 0.00 H new ATOM 0 HG3 GLN A2082 29.831 -4.690 -23.750 1.00 0.00 H new ATOM 0 HE21 GLN A2082 31.636 -3.883 -22.689 1.00 0.00 H new ATOM 0 HE22 GLN A2082 32.968 -4.890 -22.110 1.00 0.00 H new ATOM 372 N GLN A2083 27.496 -8.871 -21.982 1.00 0.00 N ATOM 373 CA GLN A2083 26.327 -9.740 -21.793 1.00 0.00 C ATOM 374 C GLN A2083 25.694 -9.527 -20.407 1.00 0.00 C ATOM 375 O GLN A2083 24.471 -9.434 -20.286 1.00 0.00 O ATOM 376 CB GLN A2083 26.722 -11.209 -22.038 1.00 0.00 C ATOM 377 CG GLN A2083 25.555 -12.032 -22.606 1.00 0.00 C ATOM 378 CD GLN A2083 25.164 -11.650 -24.042 1.00 0.00 C ATOM 379 OE1 GLN A2083 25.753 -10.804 -24.703 1.00 0.00 O ATOM 380 NE2 GLN A2083 24.144 -12.266 -24.590 1.00 0.00 N ATOM 0 H GLN A2083 28.381 -9.376 -22.039 1.00 0.00 H new ATOM 0 HA GLN A2083 25.563 -9.474 -22.524 1.00 0.00 H new ATOM 0 HB2 GLN A2083 27.563 -11.248 -22.730 1.00 0.00 H new ATOM 0 HB3 GLN A2083 27.058 -11.655 -21.102 1.00 0.00 H new ATOM 0 HG2 GLN A2083 25.823 -13.088 -22.582 1.00 0.00 H new ATOM 0 HG3 GLN A2083 24.687 -11.908 -21.958 1.00 0.00 H new ATOM 0 HE21 GLN A2083 23.634 -12.975 -24.064 1.00 0.00 H new ATOM 0 HE22 GLN A2083 23.861 -12.036 -25.542 1.00 0.00 H new ATOM 389 N GLN A2084 26.531 -9.365 -19.373 1.00 0.00 N ATOM 390 CA GLN A2084 26.116 -9.017 -18.007 1.00 0.00 C ATOM 391 C GLN A2084 25.349 -7.681 -18.025 1.00 0.00 C ATOM 392 O GLN A2084 24.245 -7.586 -17.484 1.00 0.00 O ATOM 393 CB GLN A2084 27.378 -8.945 -17.125 1.00 0.00 C ATOM 394 CG GLN A2084 27.132 -8.525 -15.666 1.00 0.00 C ATOM 395 CD GLN A2084 28.451 -8.173 -14.975 1.00 0.00 C ATOM 396 OE1 GLN A2084 29.215 -9.027 -14.551 1.00 0.00 O ATOM 397 NE2 GLN A2084 28.793 -6.906 -14.865 1.00 0.00 N ATOM 0 H GLN A2084 27.541 -9.475 -19.466 1.00 0.00 H new ATOM 0 HA GLN A2084 25.444 -9.771 -17.596 1.00 0.00 H new ATOM 0 HB2 GLN A2084 27.861 -9.922 -17.129 1.00 0.00 H new ATOM 0 HB3 GLN A2084 28.078 -8.242 -17.576 1.00 0.00 H new ATOM 0 HG2 GLN A2084 26.461 -7.667 -15.638 1.00 0.00 H new ATOM 0 HG3 GLN A2084 26.638 -9.334 -15.128 1.00 0.00 H new ATOM 0 HE21 GLN A2084 28.169 -6.177 -15.213 1.00 0.00 H new ATOM 0 HE22 GLN A2084 29.681 -6.653 -14.432 1.00 0.00 H new ATOM 406 N GLN A2085 25.905 -6.659 -18.689 1.00 0.00 N ATOM 407 CA GLN A2085 25.268 -5.352 -18.846 1.00 0.00 C ATOM 408 C GLN A2085 23.938 -5.454 -19.606 1.00 0.00 C ATOM 409 O GLN A2085 22.986 -4.784 -19.223 1.00 0.00 O ATOM 410 CB GLN A2085 26.241 -4.365 -19.514 1.00 0.00 C ATOM 411 CG GLN A2085 25.700 -2.925 -19.561 1.00 0.00 C ATOM 412 CD GLN A2085 25.403 -2.354 -18.173 1.00 0.00 C ATOM 413 OE1 GLN A2085 26.274 -2.230 -17.321 1.00 0.00 O ATOM 414 NE2 GLN A2085 24.172 -1.996 -17.882 1.00 0.00 N ATOM 0 H GLN A2085 26.820 -6.721 -19.136 1.00 0.00 H new ATOM 0 HA GLN A2085 25.025 -4.968 -17.855 1.00 0.00 H new ATOM 0 HB2 GLN A2085 27.187 -4.374 -18.973 1.00 0.00 H new ATOM 0 HB3 GLN A2085 26.451 -4.702 -20.529 1.00 0.00 H new ATOM 0 HG2 GLN A2085 26.426 -2.286 -20.063 1.00 0.00 H new ATOM 0 HG3 GLN A2085 24.789 -2.904 -20.159 1.00 0.00 H new ATOM 0 HE21 GLN A2085 23.434 -2.093 -18.580 1.00 0.00 H new ATOM 0 HE22 GLN A2085 23.955 -1.622 -16.958 1.00 0.00 H new ATOM 423 N GLN A2086 23.825 -6.299 -20.640 1.00 0.00 N ATOM 424 CA GLN A2086 22.560 -6.486 -21.361 1.00 0.00 C ATOM 425 C GLN A2086 21.450 -7.011 -20.446 1.00 0.00 C ATOM 426 O GLN A2086 20.343 -6.474 -20.467 1.00 0.00 O ATOM 427 CB GLN A2086 22.735 -7.406 -22.583 1.00 0.00 C ATOM 428 CG GLN A2086 22.726 -6.635 -23.908 1.00 0.00 C ATOM 429 CD GLN A2086 21.430 -5.850 -24.118 1.00 0.00 C ATOM 430 OE1 GLN A2086 21.349 -4.649 -23.887 1.00 0.00 O ATOM 431 NE2 GLN A2086 20.362 -6.501 -24.526 1.00 0.00 N ATOM 0 H GLN A2086 24.596 -6.864 -20.996 1.00 0.00 H new ATOM 0 HA GLN A2086 22.257 -5.502 -21.718 1.00 0.00 H new ATOM 0 HB2 GLN A2086 23.674 -7.952 -22.491 1.00 0.00 H new ATOM 0 HB3 GLN A2086 21.936 -8.147 -22.593 1.00 0.00 H new ATOM 0 HG2 GLN A2086 23.572 -5.948 -23.931 1.00 0.00 H new ATOM 0 HG3 GLN A2086 22.862 -7.334 -24.733 1.00 0.00 H new ATOM 0 HE21 GLN A2086 20.418 -7.501 -24.721 1.00 0.00 H new ATOM 0 HE22 GLN A2086 19.478 -6.006 -24.647 1.00 0.00 H new ATOM 440 N VAL A2087 21.729 -8.009 -19.599 1.00 0.00 N ATOM 441 CA VAL A2087 20.726 -8.493 -18.633 1.00 0.00 C ATOM 442 C VAL A2087 20.380 -7.387 -17.632 1.00 0.00 C ATOM 443 O VAL A2087 19.202 -7.179 -17.350 1.00 0.00 O ATOM 444 CB VAL A2087 21.165 -9.786 -17.936 1.00 0.00 C ATOM 445 CG1 VAL A2087 20.152 -10.198 -16.860 1.00 0.00 C ATOM 446 CG2 VAL A2087 21.266 -10.919 -18.969 1.00 0.00 C ATOM 0 H VAL A2087 22.626 -8.493 -19.559 1.00 0.00 H new ATOM 0 HA VAL A2087 19.822 -8.746 -19.186 1.00 0.00 H new ATOM 0 HB VAL A2087 22.133 -9.607 -17.468 1.00 0.00 H new ATOM 0 HG11 VAL A2087 20.485 -11.118 -16.380 1.00 0.00 H new ATOM 0 HG12 VAL A2087 20.072 -9.407 -16.114 1.00 0.00 H new ATOM 0 HG13 VAL A2087 19.178 -10.362 -17.321 1.00 0.00 H new ATOM 0 HG21 VAL A2087 21.578 -11.838 -18.472 1.00 0.00 H new ATOM 0 HG22 VAL A2087 20.294 -11.072 -19.437 1.00 0.00 H new ATOM 0 HG23 VAL A2087 21.998 -10.652 -19.731 1.00 0.00 H new ATOM 456 N LEU A2088 21.363 -6.620 -17.149 1.00 0.00 N ATOM 457 CA LEU A2088 21.098 -5.466 -16.281 1.00 0.00 C ATOM 458 C LEU A2088 20.224 -4.418 -16.995 1.00 0.00 C ATOM 459 O LEU A2088 19.326 -3.872 -16.366 1.00 0.00 O ATOM 460 CB LEU A2088 22.420 -4.873 -15.757 1.00 0.00 C ATOM 461 CG LEU A2088 23.089 -5.731 -14.664 1.00 0.00 C ATOM 462 CD1 LEU A2088 24.522 -5.255 -14.425 1.00 0.00 C ATOM 463 CD2 LEU A2088 22.340 -5.644 -13.329 1.00 0.00 C ATOM 0 H LEU A2088 22.352 -6.777 -17.345 1.00 0.00 H new ATOM 0 HA LEU A2088 20.528 -5.804 -15.416 1.00 0.00 H new ATOM 0 HB2 LEU A2088 23.112 -4.757 -16.591 1.00 0.00 H new ATOM 0 HB3 LEU A2088 22.229 -3.876 -15.359 1.00 0.00 H new ATOM 0 HG LEU A2088 23.072 -6.761 -15.019 1.00 0.00 H new ATOM 0 HD11 LEU A2088 24.985 -5.868 -13.651 1.00 0.00 H new ATOM 0 HD12 LEU A2088 25.094 -5.344 -15.349 1.00 0.00 H new ATOM 0 HD13 LEU A2088 24.511 -4.213 -14.104 1.00 0.00 H new ATOM 0 HD21 LEU A2088 22.845 -6.263 -12.587 1.00 0.00 H new ATOM 0 HD22 LEU A2088 22.324 -4.609 -12.987 1.00 0.00 H new ATOM 0 HD23 LEU A2088 21.318 -5.998 -13.462 1.00 0.00 H new ATOM 475 N ASN A2089 20.405 -4.172 -18.299 1.00 0.00 N ATOM 476 CA ASN A2089 19.553 -3.255 -19.074 1.00 0.00 C ATOM 477 C ASN A2089 18.093 -3.758 -19.096 1.00 0.00 C ATOM 478 O ASN A2089 17.162 -2.991 -18.846 1.00 0.00 O ATOM 479 CB ASN A2089 20.079 -3.097 -20.520 1.00 0.00 C ATOM 480 CG ASN A2089 21.471 -2.500 -20.658 1.00 0.00 C ATOM 481 OD1 ASN A2089 21.996 -1.826 -19.781 1.00 0.00 O ATOM 482 ND2 ASN A2089 22.117 -2.722 -21.781 1.00 0.00 N ATOM 0 H ASN A2089 21.148 -4.603 -18.849 1.00 0.00 H new ATOM 0 HA ASN A2089 19.584 -2.280 -18.587 1.00 0.00 H new ATOM 0 HB2 ASN A2089 20.076 -4.077 -20.996 1.00 0.00 H new ATOM 0 HB3 ASN A2089 19.380 -2.471 -21.074 1.00 0.00 H new ATOM 0 HD21 ASN A2089 23.050 -2.334 -21.918 1.00 0.00 H new ATOM 0 HD22 ASN A2089 21.685 -3.283 -22.516 1.00 0.00 H new ATOM 489 N ILE A2090 17.898 -5.056 -19.362 1.00 0.00 N ATOM 490 CA ILE A2090 16.586 -5.728 -19.396 1.00 0.00 C ATOM 491 C ILE A2090 15.901 -5.651 -18.017 1.00 0.00 C ATOM 492 O ILE A2090 14.720 -5.301 -17.927 1.00 0.00 O ATOM 493 CB ILE A2090 16.765 -7.185 -19.900 1.00 0.00 C ATOM 494 CG1 ILE A2090 17.244 -7.197 -21.374 1.00 0.00 C ATOM 495 CG2 ILE A2090 15.467 -8.005 -19.772 1.00 0.00 C ATOM 496 CD1 ILE A2090 17.910 -8.511 -21.809 1.00 0.00 C ATOM 0 H ILE A2090 18.671 -5.690 -19.566 1.00 0.00 H new ATOM 0 HA ILE A2090 15.924 -5.217 -20.095 1.00 0.00 H new ATOM 0 HB ILE A2090 17.521 -7.650 -19.267 1.00 0.00 H new ATOM 0 HG12 ILE A2090 16.390 -7.003 -22.023 1.00 0.00 H new ATOM 0 HG13 ILE A2090 17.949 -6.379 -21.522 1.00 0.00 H new ATOM 0 HG21 ILE A2090 15.639 -9.018 -20.136 1.00 0.00 H new ATOM 0 HG22 ILE A2090 15.162 -8.043 -18.726 1.00 0.00 H new ATOM 0 HG23 ILE A2090 14.680 -7.536 -20.363 1.00 0.00 H new ATOM 0 HD11 ILE A2090 18.216 -8.436 -22.853 1.00 0.00 H new ATOM 0 HD12 ILE A2090 18.785 -8.699 -21.187 1.00 0.00 H new ATOM 0 HD13 ILE A2090 17.202 -9.332 -21.696 1.00 0.00 H new ATOM 508 N LEU A2091 16.641 -5.930 -16.939 1.00 0.00 N ATOM 509 CA LEU A2091 16.153 -5.865 -15.556 1.00 0.00 C ATOM 510 C LEU A2091 15.841 -4.426 -15.108 1.00 0.00 C ATOM 511 O LEU A2091 14.783 -4.191 -14.531 1.00 0.00 O ATOM 512 CB LEU A2091 17.184 -6.516 -14.617 1.00 0.00 C ATOM 513 CG LEU A2091 17.331 -8.046 -14.733 1.00 0.00 C ATOM 514 CD1 LEU A2091 18.474 -8.502 -13.826 1.00 0.00 C ATOM 515 CD2 LEU A2091 16.066 -8.792 -14.308 1.00 0.00 C ATOM 0 H LEU A2091 17.619 -6.214 -17.004 1.00 0.00 H new ATOM 0 HA LEU A2091 15.213 -6.415 -15.508 1.00 0.00 H new ATOM 0 HB2 LEU A2091 18.157 -6.062 -14.807 1.00 0.00 H new ATOM 0 HB3 LEU A2091 16.914 -6.274 -13.589 1.00 0.00 H new ATOM 0 HG LEU A2091 17.525 -8.274 -15.781 1.00 0.00 H new ATOM 0 HD11 LEU A2091 18.588 -9.584 -13.900 1.00 0.00 H new ATOM 0 HD12 LEU A2091 19.400 -8.018 -14.136 1.00 0.00 H new ATOM 0 HD13 LEU A2091 18.250 -8.230 -12.794 1.00 0.00 H new ATOM 0 HD21 LEU A2091 16.225 -9.866 -14.410 1.00 0.00 H new ATOM 0 HD22 LEU A2091 15.836 -8.556 -13.269 1.00 0.00 H new ATOM 0 HD23 LEU A2091 15.233 -8.487 -14.942 1.00 0.00 H new ATOM 527 N LYS A2092 16.701 -3.441 -15.405 1.00 0.00 N ATOM 528 CA LYS A2092 16.472 -2.012 -15.091 1.00 0.00 C ATOM 529 C LYS A2092 15.262 -1.423 -15.832 1.00 0.00 C ATOM 530 O LYS A2092 14.679 -0.445 -15.365 1.00 0.00 O ATOM 531 CB LYS A2092 17.741 -1.193 -15.352 1.00 0.00 C ATOM 532 CG LYS A2092 18.787 -1.445 -14.247 1.00 0.00 C ATOM 533 CD LYS A2092 20.006 -0.526 -14.379 1.00 0.00 C ATOM 534 CE LYS A2092 19.612 0.913 -14.020 1.00 0.00 C ATOM 535 NZ LYS A2092 20.759 1.849 -14.149 1.00 0.00 N ATOM 0 H LYS A2092 17.589 -3.611 -15.877 1.00 0.00 H new ATOM 0 HA LYS A2092 16.233 -1.954 -14.029 1.00 0.00 H new ATOM 0 HB2 LYS A2092 18.159 -1.459 -16.323 1.00 0.00 H new ATOM 0 HB3 LYS A2092 17.494 -0.132 -15.391 1.00 0.00 H new ATOM 0 HG2 LYS A2092 18.325 -1.294 -13.271 1.00 0.00 H new ATOM 0 HG3 LYS A2092 19.112 -2.484 -14.288 1.00 0.00 H new ATOM 0 HD2 LYS A2092 20.805 -0.869 -13.721 1.00 0.00 H new ATOM 0 HD3 LYS A2092 20.393 -0.564 -15.397 1.00 0.00 H new ATOM 0 HE2 LYS A2092 18.801 1.241 -14.670 1.00 0.00 H new ATOM 0 HE3 LYS A2092 19.233 0.942 -12.998 1.00 0.00 H new ATOM 0 HZ1 LYS A2092 20.452 2.811 -13.898 1.00 0.00 H new ATOM 0 HZ2 LYS A2092 21.524 1.551 -13.510 1.00 0.00 H new ATOM 0 HZ3 LYS A2092 21.105 1.841 -15.130 1.00 0.00 H new ATOM 549 N SER A2093 14.856 -2.032 -16.951 1.00 0.00 N ATOM 550 CA SER A2093 13.657 -1.667 -17.725 1.00 0.00 C ATOM 551 C SER A2093 12.375 -2.322 -17.156 1.00 0.00 C ATOM 552 O SER A2093 11.257 -1.907 -17.470 1.00 0.00 O ATOM 553 CB SER A2093 13.880 -2.070 -19.190 1.00 0.00 C ATOM 554 OG SER A2093 12.910 -1.485 -20.043 1.00 0.00 O ATOM 0 H SER A2093 15.365 -2.816 -17.358 1.00 0.00 H new ATOM 0 HA SER A2093 13.506 -0.590 -17.655 1.00 0.00 H new ATOM 0 HB2 SER A2093 14.877 -1.762 -19.506 1.00 0.00 H new ATOM 0 HB3 SER A2093 13.838 -3.155 -19.280 1.00 0.00 H new ATOM 0 HG SER A2093 13.080 -1.759 -20.968 1.00 0.00 H new ATOM 560 N ASN A2094 12.527 -3.326 -16.279 1.00 0.00 N ATOM 561 CA ASN A2094 11.463 -4.090 -15.607 1.00 0.00 C ATOM 562 C ASN A2094 11.830 -4.289 -14.111 1.00 0.00 C ATOM 563 O ASN A2094 11.983 -5.427 -13.655 1.00 0.00 O ATOM 564 CB ASN A2094 11.292 -5.428 -16.360 1.00 0.00 C ATOM 565 CG ASN A2094 10.927 -5.247 -17.824 1.00 0.00 C ATOM 566 OD1 ASN A2094 9.765 -5.137 -18.188 1.00 0.00 O ATOM 567 ND2 ASN A2094 11.904 -5.218 -18.705 1.00 0.00 N ATOM 0 H ASN A2094 13.455 -3.647 -16.002 1.00 0.00 H new ATOM 0 HA ASN A2094 10.512 -3.557 -15.629 1.00 0.00 H new ATOM 0 HB2 ASN A2094 12.219 -5.998 -16.291 1.00 0.00 H new ATOM 0 HB3 ASN A2094 10.518 -6.018 -15.869 1.00 0.00 H new ATOM 0 HD21 ASN A2094 11.693 -5.103 -19.696 1.00 0.00 H new ATOM 0 HD22 ASN A2094 12.872 -5.310 -18.396 1.00 0.00 H new ATOM 574 N PRO A2095 12.041 -3.203 -13.335 1.00 0.00 N ATOM 575 CA PRO A2095 12.590 -3.281 -11.979 1.00 0.00 C ATOM 576 C PRO A2095 11.739 -3.995 -10.924 1.00 0.00 C ATOM 577 O PRO A2095 12.277 -4.334 -9.875 1.00 0.00 O ATOM 578 CB PRO A2095 12.925 -1.839 -11.578 1.00 0.00 C ATOM 579 CG PRO A2095 11.985 -0.994 -12.433 1.00 0.00 C ATOM 580 CD PRO A2095 11.870 -1.806 -13.719 1.00 0.00 C ATOM 0 HA PRO A2095 13.465 -3.930 -12.009 1.00 0.00 H new ATOM 0 HB2 PRO A2095 12.758 -1.671 -10.514 1.00 0.00 H new ATOM 0 HB3 PRO A2095 13.970 -1.601 -11.778 1.00 0.00 H new ATOM 0 HG2 PRO A2095 11.016 -0.858 -11.953 1.00 0.00 H new ATOM 0 HG3 PRO A2095 12.392 0.000 -12.618 1.00 0.00 H new ATOM 0 HD2 PRO A2095 10.901 -1.649 -14.193 1.00 0.00 H new ATOM 0 HD3 PRO A2095 12.631 -1.504 -14.439 1.00 0.00 H new ATOM 588 N GLN A2096 10.453 -4.261 -11.159 1.00 0.00 N ATOM 589 CA GLN A2096 9.571 -4.934 -10.188 1.00 0.00 C ATOM 590 C GLN A2096 10.115 -6.302 -9.738 1.00 0.00 C ATOM 591 O GLN A2096 10.119 -6.618 -8.549 1.00 0.00 O ATOM 592 CB GLN A2096 8.172 -5.127 -10.790 1.00 0.00 C ATOM 593 CG GLN A2096 7.349 -3.846 -10.984 1.00 0.00 C ATOM 594 CD GLN A2096 7.950 -2.872 -11.994 1.00 0.00 C ATOM 595 OE1 GLN A2096 8.541 -1.858 -11.652 1.00 0.00 O ATOM 596 NE2 GLN A2096 7.870 -3.164 -13.273 1.00 0.00 N ATOM 0 H GLN A2096 9.986 -4.016 -12.032 1.00 0.00 H new ATOM 0 HA GLN A2096 9.524 -4.289 -9.311 1.00 0.00 H new ATOM 0 HB2 GLN A2096 8.277 -5.619 -11.757 1.00 0.00 H new ATOM 0 HB3 GLN A2096 7.610 -5.804 -10.147 1.00 0.00 H new ATOM 0 HG2 GLN A2096 6.344 -4.117 -11.309 1.00 0.00 H new ATOM 0 HG3 GLN A2096 7.248 -3.342 -10.023 1.00 0.00 H new ATOM 0 HE21 GLN A2096 7.380 -4.007 -13.574 1.00 0.00 H new ATOM 0 HE22 GLN A2096 8.298 -2.548 -13.964 1.00 0.00 H new ATOM 605 N LEU A2097 10.601 -7.111 -10.683 1.00 0.00 N ATOM 606 CA LEU A2097 11.166 -8.432 -10.383 1.00 0.00 C ATOM 607 C LEU A2097 12.626 -8.382 -9.884 1.00 0.00 C ATOM 608 O LEU A2097 13.035 -9.243 -9.104 1.00 0.00 O ATOM 609 CB LEU A2097 10.904 -9.412 -11.548 1.00 0.00 C ATOM 610 CG LEU A2097 11.168 -8.956 -12.999 1.00 0.00 C ATOM 611 CD1 LEU A2097 12.645 -8.704 -13.299 1.00 0.00 C ATOM 612 CD2 LEU A2097 10.694 -10.052 -13.956 1.00 0.00 C ATOM 0 H LEU A2097 10.615 -6.871 -11.674 1.00 0.00 H new ATOM 0 HA LEU A2097 10.635 -8.836 -9.521 1.00 0.00 H new ATOM 0 HB2 LEU A2097 11.509 -10.301 -11.370 1.00 0.00 H new ATOM 0 HB3 LEU A2097 9.860 -9.720 -11.487 1.00 0.00 H new ATOM 0 HG LEU A2097 10.629 -8.017 -13.130 1.00 0.00 H new ATOM 0 HD11 LEU A2097 12.757 -8.387 -14.336 1.00 0.00 H new ATOM 0 HD12 LEU A2097 13.023 -7.924 -12.638 1.00 0.00 H new ATOM 0 HD13 LEU A2097 13.211 -9.622 -13.137 1.00 0.00 H new ATOM 0 HD21 LEU A2097 10.876 -9.740 -14.985 1.00 0.00 H new ATOM 0 HD22 LEU A2097 11.241 -10.973 -13.754 1.00 0.00 H new ATOM 0 HD23 LEU A2097 9.627 -10.224 -13.812 1.00 0.00 H new ATOM 624 N MET A2098 13.401 -7.361 -10.269 1.00 0.00 N ATOM 625 CA MET A2098 14.796 -7.188 -9.836 1.00 0.00 C ATOM 626 C MET A2098 14.897 -6.579 -8.427 1.00 0.00 C ATOM 627 O MET A2098 15.658 -7.068 -7.595 1.00 0.00 O ATOM 628 CB MET A2098 15.530 -6.292 -10.843 1.00 0.00 C ATOM 629 CG MET A2098 17.043 -6.253 -10.569 1.00 0.00 C ATOM 630 SD MET A2098 17.948 -4.928 -11.413 1.00 0.00 S ATOM 631 CE MET A2098 17.314 -3.506 -10.486 1.00 0.00 C ATOM 0 H MET A2098 13.076 -6.624 -10.895 1.00 0.00 H new ATOM 0 HA MET A2098 15.259 -8.174 -9.796 1.00 0.00 H new ATOM 0 HB2 MET A2098 15.352 -6.658 -11.854 1.00 0.00 H new ATOM 0 HB3 MET A2098 15.125 -5.281 -10.794 1.00 0.00 H new ATOM 0 HG2 MET A2098 17.199 -6.150 -9.495 1.00 0.00 H new ATOM 0 HG3 MET A2098 17.474 -7.210 -10.864 1.00 0.00 H new ATOM 0 HE1 MET A2098 17.965 -2.647 -10.648 1.00 0.00 H new ATOM 0 HE2 MET A2098 16.307 -3.268 -10.828 1.00 0.00 H new ATOM 0 HE3 MET A2098 17.289 -3.747 -9.423 1.00 0.00 H new ATOM 641 N ALA A2099 14.126 -5.525 -8.141 1.00 0.00 N ATOM 642 CA ALA A2099 14.110 -4.854 -6.843 1.00 0.00 C ATOM 643 C ALA A2099 13.610 -5.793 -5.729 1.00 0.00 C ATOM 644 O ALA A2099 14.158 -5.795 -4.625 1.00 0.00 O ATOM 645 CB ALA A2099 13.296 -3.565 -6.960 1.00 0.00 C ATOM 0 H ALA A2099 13.486 -5.110 -8.818 1.00 0.00 H new ATOM 0 HA ALA A2099 15.125 -4.583 -6.553 1.00 0.00 H new ATOM 0 HB1 ALA A2099 13.278 -3.057 -5.996 1.00 0.00 H new ATOM 0 HB2 ALA A2099 13.752 -2.913 -7.705 1.00 0.00 H new ATOM 0 HB3 ALA A2099 12.277 -3.805 -7.263 1.00 0.00 H new ATOM 651 N ALA A2100 12.618 -6.642 -6.029 1.00 0.00 N ATOM 652 CA ALA A2100 12.128 -7.654 -5.093 1.00 0.00 C ATOM 653 C ALA A2100 13.208 -8.716 -4.811 1.00 0.00 C ATOM 654 O ALA A2100 13.407 -9.111 -3.661 1.00 0.00 O ATOM 655 CB ALA A2100 10.860 -8.277 -5.679 1.00 0.00 C ATOM 0 H ALA A2100 12.135 -6.644 -6.927 1.00 0.00 H new ATOM 0 HA ALA A2100 11.892 -7.192 -4.134 1.00 0.00 H new ATOM 0 HB1 ALA A2100 10.478 -9.035 -4.996 1.00 0.00 H new ATOM 0 HB2 ALA A2100 10.106 -7.503 -5.820 1.00 0.00 H new ATOM 0 HB3 ALA A2100 11.091 -8.738 -6.639 1.00 0.00 H new ATOM 661 N PHE A2101 13.936 -9.142 -5.852 1.00 0.00 N ATOM 662 CA PHE A2101 15.046 -10.091 -5.741 1.00 0.00 C ATOM 663 C PHE A2101 16.173 -9.535 -4.861 1.00 0.00 C ATOM 664 O PHE A2101 16.553 -10.190 -3.891 1.00 0.00 O ATOM 665 CB PHE A2101 15.540 -10.454 -7.151 1.00 0.00 C ATOM 666 CG PHE A2101 16.903 -11.117 -7.213 1.00 0.00 C ATOM 667 CD1 PHE A2101 17.060 -12.456 -6.803 1.00 0.00 C ATOM 668 CD2 PHE A2101 18.012 -10.401 -7.708 1.00 0.00 C ATOM 669 CE1 PHE A2101 18.316 -13.082 -6.907 1.00 0.00 C ATOM 670 CE2 PHE A2101 19.267 -11.029 -7.808 1.00 0.00 C ATOM 671 CZ PHE A2101 19.416 -12.371 -7.418 1.00 0.00 C ATOM 0 H PHE A2101 13.766 -8.831 -6.808 1.00 0.00 H new ATOM 0 HA PHE A2101 14.697 -10.999 -5.249 1.00 0.00 H new ATOM 0 HB2 PHE A2101 14.810 -11.119 -7.613 1.00 0.00 H new ATOM 0 HB3 PHE A2101 15.569 -9.545 -7.752 1.00 0.00 H new ATOM 0 HD1 PHE A2101 16.216 -13.002 -6.409 1.00 0.00 H new ATOM 0 HD2 PHE A2101 17.898 -9.370 -8.010 1.00 0.00 H new ATOM 0 HE1 PHE A2101 18.435 -14.109 -6.594 1.00 0.00 H new ATOM 0 HE2 PHE A2101 20.117 -10.479 -8.185 1.00 0.00 H new ATOM 0 HZ PHE A2101 20.376 -12.856 -7.511 1.00 0.00 H new ATOM 681 N ILE A2102 16.684 -8.325 -5.136 1.00 0.00 N ATOM 682 CA ILE A2102 17.769 -7.736 -4.330 1.00 0.00 C ATOM 683 C ILE A2102 17.360 -7.490 -2.872 1.00 0.00 C ATOM 684 O ILE A2102 18.171 -7.747 -1.983 1.00 0.00 O ATOM 685 CB ILE A2102 18.417 -6.514 -5.018 1.00 0.00 C ATOM 686 CG1 ILE A2102 19.785 -6.147 -4.394 1.00 0.00 C ATOM 687 CG2 ILE A2102 17.491 -5.301 -5.130 1.00 0.00 C ATOM 688 CD1 ILE A2102 19.766 -5.120 -3.249 1.00 0.00 C ATOM 0 H ILE A2102 16.366 -7.736 -5.906 1.00 0.00 H new ATOM 0 HA ILE A2102 18.560 -8.484 -4.274 1.00 0.00 H new ATOM 0 HB ILE A2102 18.603 -6.830 -6.044 1.00 0.00 H new ATOM 0 HG12 ILE A2102 20.247 -7.062 -4.023 1.00 0.00 H new ATOM 0 HG13 ILE A2102 20.429 -5.763 -5.186 1.00 0.00 H new ATOM 0 HG21 ILE A2102 18.018 -4.485 -5.624 1.00 0.00 H new ATOM 0 HG22 ILE A2102 16.610 -5.569 -5.713 1.00 0.00 H new ATOM 0 HG23 ILE A2102 17.184 -4.984 -4.133 1.00 0.00 H new ATOM 0 HD11 ILE A2102 20.783 -4.948 -2.898 1.00 0.00 H new ATOM 0 HD12 ILE A2102 19.343 -4.182 -3.608 1.00 0.00 H new ATOM 0 HD13 ILE A2102 19.158 -5.501 -2.428 1.00 0.00 H new ATOM 700 N LYS A2103 16.115 -7.073 -2.591 1.00 0.00 N ATOM 701 CA LYS A2103 15.618 -6.862 -1.213 1.00 0.00 C ATOM 702 C LYS A2103 15.767 -8.111 -0.320 1.00 0.00 C ATOM 703 O LYS A2103 15.960 -7.975 0.888 1.00 0.00 O ATOM 704 CB LYS A2103 14.174 -6.316 -1.265 1.00 0.00 C ATOM 705 CG LYS A2103 13.623 -5.941 0.124 1.00 0.00 C ATOM 706 CD LYS A2103 12.226 -5.300 0.101 1.00 0.00 C ATOM 707 CE LYS A2103 12.239 -3.844 -0.391 1.00 0.00 C ATOM 708 NZ LYS A2103 10.937 -3.171 -0.127 1.00 0.00 N ATOM 0 H LYS A2103 15.421 -6.871 -3.310 1.00 0.00 H new ATOM 0 HA LYS A2103 16.246 -6.113 -0.731 1.00 0.00 H new ATOM 0 HB2 LYS A2103 14.146 -5.438 -1.910 1.00 0.00 H new ATOM 0 HB3 LYS A2103 13.524 -7.065 -1.718 1.00 0.00 H new ATOM 0 HG2 LYS A2103 13.588 -6.838 0.742 1.00 0.00 H new ATOM 0 HG3 LYS A2103 14.318 -5.251 0.603 1.00 0.00 H new ATOM 0 HD2 LYS A2103 11.573 -5.889 -0.543 1.00 0.00 H new ATOM 0 HD3 LYS A2103 11.800 -5.335 1.104 1.00 0.00 H new ATOM 0 HE2 LYS A2103 13.040 -3.297 0.106 1.00 0.00 H new ATOM 0 HE3 LYS A2103 12.452 -3.821 -1.460 1.00 0.00 H new ATOM 0 HZ1 LYS A2103 10.977 -2.190 -0.470 1.00 0.00 H new ATOM 0 HZ2 LYS A2103 10.177 -3.680 -0.621 1.00 0.00 H new ATOM 0 HZ3 LYS A2103 10.747 -3.172 0.895 1.00 0.00 H new ATOM 722 N GLN A2104 15.752 -9.314 -0.905 1.00 0.00 N ATOM 723 CA GLN A2104 16.004 -10.583 -0.204 1.00 0.00 C ATOM 724 C GLN A2104 17.468 -11.031 -0.364 1.00 0.00 C ATOM 725 O GLN A2104 18.114 -11.392 0.621 1.00 0.00 O ATOM 726 CB GLN A2104 15.054 -11.668 -0.746 1.00 0.00 C ATOM 727 CG GLN A2104 13.604 -11.509 -0.260 1.00 0.00 C ATOM 728 CD GLN A2104 13.459 -11.768 1.241 1.00 0.00 C ATOM 729 OE1 GLN A2104 13.306 -10.860 2.046 1.00 0.00 O ATOM 730 NE2 GLN A2104 13.513 -13.010 1.680 1.00 0.00 N ATOM 0 H GLN A2104 15.561 -9.438 -1.899 1.00 0.00 H new ATOM 0 HA GLN A2104 15.818 -10.431 0.859 1.00 0.00 H new ATOM 0 HB2 GLN A2104 15.069 -11.642 -1.836 1.00 0.00 H new ATOM 0 HB3 GLN A2104 15.425 -12.648 -0.445 1.00 0.00 H new ATOM 0 HG2 GLN A2104 13.256 -10.501 -0.487 1.00 0.00 H new ATOM 0 HG3 GLN A2104 12.962 -12.199 -0.808 1.00 0.00 H new ATOM 0 HE21 GLN A2104 13.640 -13.779 1.022 1.00 0.00 H new ATOM 0 HE22 GLN A2104 13.428 -13.202 2.678 1.00 0.00 H new ATOM 739 N ARG A2105 18.018 -10.992 -1.587 1.00 0.00 N ATOM 740 CA ARG A2105 19.397 -11.402 -1.917 1.00 0.00 C ATOM 741 C ARG A2105 20.482 -10.602 -1.183 1.00 0.00 C ATOM 742 O ARG A2105 21.553 -11.148 -0.915 1.00 0.00 O ATOM 743 CB ARG A2105 19.545 -11.392 -3.452 1.00 0.00 C ATOM 744 CG ARG A2105 20.785 -12.128 -3.978 1.00 0.00 C ATOM 745 CD ARG A2105 21.970 -11.193 -4.254 1.00 0.00 C ATOM 746 NE ARG A2105 23.139 -11.953 -4.725 1.00 0.00 N ATOM 747 CZ ARG A2105 23.940 -12.709 -4.003 1.00 0.00 C ATOM 748 NH1 ARG A2105 23.820 -12.829 -2.708 1.00 0.00 N ATOM 749 NH2 ARG A2105 24.868 -13.376 -4.616 1.00 0.00 N ATOM 0 H ARG A2105 17.500 -10.664 -2.402 1.00 0.00 H new ATOM 0 HA ARG A2105 19.562 -12.414 -1.548 1.00 0.00 H new ATOM 0 HB2 ARG A2105 18.656 -11.844 -3.893 1.00 0.00 H new ATOM 0 HB3 ARG A2105 19.580 -10.358 -3.794 1.00 0.00 H new ATOM 0 HG2 ARG A2105 21.087 -12.883 -3.252 1.00 0.00 H new ATOM 0 HG3 ARG A2105 20.525 -12.655 -4.896 1.00 0.00 H new ATOM 0 HD2 ARG A2105 21.687 -10.452 -5.002 1.00 0.00 H new ATOM 0 HD3 ARG A2105 22.227 -10.648 -3.346 1.00 0.00 H new ATOM 0 HE ARG A2105 23.352 -11.887 -5.720 1.00 0.00 H new ATOM 0 HH11 ARG A2105 23.082 -12.325 -2.215 1.00 0.00 H new ATOM 0 HH12 ARG A2105 24.464 -13.426 -2.189 1.00 0.00 H new ATOM 0 HH21 ARG A2105 24.962 -13.306 -5.629 1.00 0.00 H new ATOM 0 HH22 ARG A2105 25.504 -13.970 -4.085 1.00 0.00 H new ATOM 763 N THR A2106 20.209 -9.346 -0.814 1.00 0.00 N ATOM 764 CA THR A2106 21.117 -8.479 -0.034 1.00 0.00 C ATOM 765 C THR A2106 21.456 -9.080 1.341 1.00 0.00 C ATOM 766 O THR A2106 22.593 -8.982 1.807 1.00 0.00 O ATOM 767 CB THR A2106 20.554 -7.049 0.099 1.00 0.00 C ATOM 768 OG1 THR A2106 21.542 -6.194 0.627 1.00 0.00 O ATOM 769 CG2 THR A2106 19.320 -6.930 0.994 1.00 0.00 C ATOM 0 H THR A2106 19.330 -8.887 -1.052 1.00 0.00 H new ATOM 0 HA THR A2106 22.052 -8.417 -0.591 1.00 0.00 H new ATOM 0 HB THR A2106 20.255 -6.769 -0.911 1.00 0.00 H new ATOM 0 HG1 THR A2106 21.180 -5.287 0.708 1.00 0.00 H new ATOM 0 HG21 THR A2106 18.994 -5.890 1.028 1.00 0.00 H new ATOM 0 HG22 THR A2106 18.518 -7.548 0.592 1.00 0.00 H new ATOM 0 HG23 THR A2106 19.567 -7.266 2.001 1.00 0.00 H new ATOM 777 N ALA A2107 20.505 -9.789 1.967 1.00 0.00 N ATOM 778 CA ALA A2107 20.691 -10.475 3.251 1.00 0.00 C ATOM 779 C ALA A2107 21.661 -11.681 3.180 1.00 0.00 C ATOM 780 O ALA A2107 22.065 -12.213 4.217 1.00 0.00 O ATOM 781 CB ALA A2107 19.307 -10.901 3.765 1.00 0.00 C ATOM 0 H ALA A2107 19.566 -9.903 1.585 1.00 0.00 H new ATOM 0 HA ALA A2107 21.165 -9.780 3.944 1.00 0.00 H new ATOM 0 HB1 ALA A2107 19.416 -11.414 4.720 1.00 0.00 H new ATOM 0 HB2 ALA A2107 18.680 -10.019 3.897 1.00 0.00 H new ATOM 0 HB3 ALA A2107 18.842 -11.572 3.043 1.00 0.00 H new ATOM 787 N LYS A2108 22.037 -12.107 1.963 1.00 0.00 N ATOM 788 CA LYS A2108 22.932 -13.240 1.651 1.00 0.00 C ATOM 789 C LYS A2108 24.104 -12.842 0.738 1.00 0.00 C ATOM 790 O LYS A2108 24.775 -13.694 0.158 1.00 0.00 O ATOM 791 CB LYS A2108 22.090 -14.358 1.010 1.00 0.00 C ATOM 792 CG LYS A2108 20.958 -14.925 1.889 1.00 0.00 C ATOM 793 CD LYS A2108 21.466 -15.579 3.184 1.00 0.00 C ATOM 794 CE LYS A2108 20.294 -16.166 3.980 1.00 0.00 C ATOM 795 NZ LYS A2108 20.744 -16.724 5.282 1.00 0.00 N ATOM 0 H LYS A2108 21.706 -11.643 1.117 1.00 0.00 H new ATOM 0 HA LYS A2108 23.386 -13.588 2.579 1.00 0.00 H new ATOM 0 HB2 LYS A2108 21.653 -13.976 0.087 1.00 0.00 H new ATOM 0 HB3 LYS A2108 22.755 -15.176 0.733 1.00 0.00 H new ATOM 0 HG2 LYS A2108 20.267 -14.121 2.143 1.00 0.00 H new ATOM 0 HG3 LYS A2108 20.395 -15.661 1.315 1.00 0.00 H new ATOM 0 HD2 LYS A2108 22.182 -16.365 2.945 1.00 0.00 H new ATOM 0 HD3 LYS A2108 21.992 -14.841 3.790 1.00 0.00 H new ATOM 0 HE2 LYS A2108 19.547 -15.392 4.154 1.00 0.00 H new ATOM 0 HE3 LYS A2108 19.811 -16.949 3.395 1.00 0.00 H new ATOM 0 HZ1 LYS A2108 19.927 -17.113 5.794 1.00 0.00 H new ATOM 0 HZ2 LYS A2108 21.439 -17.480 5.114 1.00 0.00 H new ATOM 0 HZ3 LYS A2108 21.182 -15.971 5.850 1.00 0.00 H new ATOM 1019 N THR B 18 11.037 -23.507 -10.698 1.00 0.00 N ATOM 1020 CA THR B 18 11.898 -22.891 -11.720 1.00 0.00 C ATOM 1021 C THR B 18 11.876 -21.353 -11.637 1.00 0.00 C ATOM 1022 O THR B 18 11.176 -20.781 -10.799 1.00 0.00 O ATOM 1023 CB THR B 18 11.404 -23.331 -13.112 1.00 0.00 C ATOM 1024 OG1 THR B 18 10.059 -22.945 -13.281 1.00 0.00 O ATOM 1025 CG2 THR B 18 11.465 -24.848 -13.284 1.00 0.00 C ATOM 0 HA THR B 18 12.923 -23.219 -11.548 1.00 0.00 H new ATOM 0 HB THR B 18 12.054 -22.856 -13.847 1.00 0.00 H new ATOM 0 HG1 THR B 18 9.588 -23.016 -12.425 1.00 0.00 H new ATOM 0 HG21 THR B 18 11.108 -25.116 -14.278 1.00 0.00 H new ATOM 0 HG22 THR B 18 12.494 -25.187 -13.164 1.00 0.00 H new ATOM 0 HG23 THR B 18 10.836 -25.325 -12.532 1.00 0.00 H new ATOM 1033 N PHE B 19 12.636 -20.661 -12.497 1.00 0.00 N ATOM 1034 CA PHE B 19 12.743 -19.190 -12.532 1.00 0.00 C ATOM 1035 C PHE B 19 11.401 -18.436 -12.423 1.00 0.00 C ATOM 1036 O PHE B 19 11.303 -17.464 -11.675 1.00 0.00 O ATOM 1037 CB PHE B 19 13.524 -18.733 -13.780 1.00 0.00 C ATOM 1038 CG PHE B 19 12.735 -18.747 -15.079 1.00 0.00 C ATOM 1039 CD1 PHE B 19 12.374 -19.971 -15.672 1.00 0.00 C ATOM 1040 CD2 PHE B 19 12.316 -17.539 -15.671 1.00 0.00 C ATOM 1041 CE1 PHE B 19 11.595 -19.991 -16.842 1.00 0.00 C ATOM 1042 CE2 PHE B 19 11.539 -17.559 -16.842 1.00 0.00 C ATOM 1043 CZ PHE B 19 11.174 -18.784 -17.426 1.00 0.00 C ATOM 0 H PHE B 19 13.209 -21.117 -13.207 1.00 0.00 H new ATOM 0 HA PHE B 19 13.293 -18.922 -11.630 1.00 0.00 H new ATOM 0 HB2 PHE B 19 13.892 -17.722 -13.608 1.00 0.00 H new ATOM 0 HB3 PHE B 19 14.397 -19.374 -13.897 1.00 0.00 H new ATOM 0 HD1 PHE B 19 12.697 -20.900 -15.226 1.00 0.00 H new ATOM 0 HD2 PHE B 19 12.593 -16.596 -15.224 1.00 0.00 H new ATOM 0 HE1 PHE B 19 11.320 -20.934 -17.292 1.00 0.00 H new ATOM 0 HE2 PHE B 19 11.222 -16.631 -17.294 1.00 0.00 H new ATOM 0 HZ PHE B 19 10.571 -18.798 -18.322 1.00 0.00 H new ATOM 1053 N SER B 20 10.361 -18.892 -13.133 1.00 0.00 N ATOM 1054 CA SER B 20 9.023 -18.284 -13.121 1.00 0.00 C ATOM 1055 C SER B 20 8.304 -18.404 -11.771 1.00 0.00 C ATOM 1056 O SER B 20 7.557 -17.509 -11.372 1.00 0.00 O ATOM 1057 CB SER B 20 8.160 -18.897 -14.227 1.00 0.00 C ATOM 1058 OG SER B 20 8.105 -20.309 -14.114 1.00 0.00 O ATOM 0 H SER B 20 10.426 -19.707 -13.742 1.00 0.00 H new ATOM 0 HA SER B 20 9.169 -17.219 -13.299 1.00 0.00 H new ATOM 0 HB2 SER B 20 7.152 -18.486 -14.174 1.00 0.00 H new ATOM 0 HB3 SER B 20 8.565 -18.623 -15.201 1.00 0.00 H new ATOM 0 HG SER B 20 7.546 -20.673 -14.832 1.00 0.00 H new ATOM 1064 N ASP B 21 8.548 -19.494 -11.047 1.00 0.00 N ATOM 1065 CA ASP B 21 7.992 -19.769 -9.720 1.00 0.00 C ATOM 1066 C ASP B 21 8.745 -19.028 -8.603 1.00 0.00 C ATOM 1067 O ASP B 21 8.149 -18.682 -7.583 1.00 0.00 O ATOM 1068 CB ASP B 21 8.002 -21.287 -9.505 1.00 0.00 C ATOM 1069 CG ASP B 21 7.065 -21.732 -8.378 1.00 0.00 C ATOM 1070 OD1 ASP B 21 5.832 -21.661 -8.584 1.00 0.00 O ATOM 1071 OD2 ASP B 21 7.554 -22.211 -7.331 1.00 0.00 O ATOM 0 H ASP B 21 9.161 -20.239 -11.379 1.00 0.00 H new ATOM 0 HA ASP B 21 6.969 -19.395 -9.674 1.00 0.00 H new ATOM 0 HB2 ASP B 21 7.710 -21.783 -10.431 1.00 0.00 H new ATOM 0 HB3 ASP B 21 9.017 -21.611 -9.276 1.00 0.00 H new ATOM 1076 N LEU B 22 10.030 -18.714 -8.809 1.00 0.00 N ATOM 1077 CA LEU B 22 10.832 -17.941 -7.852 1.00 0.00 C ATOM 1078 C LEU B 22 10.304 -16.502 -7.705 1.00 0.00 C ATOM 1079 O LEU B 22 10.328 -15.956 -6.601 1.00 0.00 O ATOM 1080 CB LEU B 22 12.323 -17.950 -8.247 1.00 0.00 C ATOM 1081 CG LEU B 22 13.022 -19.322 -8.146 1.00 0.00 C ATOM 1082 CD1 LEU B 22 14.472 -19.197 -8.621 1.00 0.00 C ATOM 1083 CD2 LEU B 22 13.034 -19.883 -6.722 1.00 0.00 C ATOM 0 H LEU B 22 10.544 -18.989 -9.646 1.00 0.00 H new ATOM 0 HA LEU B 22 10.739 -18.423 -6.879 1.00 0.00 H new ATOM 0 HB2 LEU B 22 12.413 -17.589 -9.272 1.00 0.00 H new ATOM 0 HB3 LEU B 22 12.855 -17.242 -7.612 1.00 0.00 H new ATOM 0 HG LEU B 22 12.453 -20.007 -8.775 1.00 0.00 H new ATOM 0 HD11 LEU B 22 14.963 -20.167 -8.549 1.00 0.00 H new ATOM 0 HD12 LEU B 22 14.488 -18.859 -9.657 1.00 0.00 H new ATOM 0 HD13 LEU B 22 14.999 -18.476 -7.996 1.00 0.00 H new ATOM 0 HD21 LEU B 22 13.539 -20.849 -6.716 1.00 0.00 H new ATOM 0 HD22 LEU B 22 13.562 -19.193 -6.064 1.00 0.00 H new ATOM 0 HD23 LEU B 22 12.009 -20.007 -6.371 1.00 0.00 H new ATOM 1095 N TRP B 23 9.771 -15.896 -8.778 1.00 0.00 N ATOM 1096 CA TRP B 23 9.182 -14.547 -8.721 1.00 0.00 C ATOM 1097 C TRP B 23 8.010 -14.452 -7.730 1.00 0.00 C ATOM 1098 O TRP B 23 7.830 -13.421 -7.080 1.00 0.00 O ATOM 1099 CB TRP B 23 8.690 -14.104 -10.104 1.00 0.00 C ATOM 1100 CG TRP B 23 9.662 -14.173 -11.242 1.00 0.00 C ATOM 1101 CD1 TRP B 23 9.389 -14.758 -12.426 1.00 0.00 C ATOM 1102 CD2 TRP B 23 11.023 -13.644 -11.366 1.00 0.00 C ATOM 1103 NE1 TRP B 23 10.470 -14.637 -13.276 1.00 0.00 N ATOM 1104 CE2 TRP B 23 11.510 -13.963 -12.672 1.00 0.00 C ATOM 1105 CE3 TRP B 23 11.895 -12.923 -10.520 1.00 0.00 C ATOM 1106 CZ2 TRP B 23 12.791 -13.596 -13.112 1.00 0.00 C ATOM 1107 CZ3 TRP B 23 13.184 -12.550 -10.950 1.00 0.00 C ATOM 1108 CH2 TRP B 23 13.633 -12.885 -12.240 1.00 0.00 C ATOM 0 H TRP B 23 9.736 -16.323 -9.704 1.00 0.00 H new ATOM 0 HA TRP B 23 9.979 -13.888 -8.376 1.00 0.00 H new ATOM 0 HB2 TRP B 23 7.825 -14.714 -10.364 1.00 0.00 H new ATOM 0 HB3 TRP B 23 8.341 -13.075 -10.022 1.00 0.00 H new ATOM 0 HD1 TRP B 23 8.460 -15.250 -12.673 1.00 0.00 H new ATOM 0 HE1 TRP B 23 10.496 -15.000 -14.229 1.00 0.00 H new ATOM 0 HE3 TRP B 23 11.568 -12.653 -9.527 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 13.125 -13.856 -14.106 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 13.833 -12.002 -10.283 1.00 0.00 H new ATOM 0 HH2 TRP B 23 14.623 -12.596 -12.560 1.00 0.00 H new ATOM 1119 N LYS B 24 7.229 -15.536 -7.595 1.00 0.00 N ATOM 1120 CA LYS B 24 6.069 -15.640 -6.691 1.00 0.00 C ATOM 1121 C LYS B 24 6.471 -15.595 -5.213 1.00 0.00 C ATOM 1122 O LYS B 24 5.740 -15.049 -4.386 1.00 0.00 O ATOM 1123 CB LYS B 24 5.310 -16.953 -6.954 1.00 0.00 C ATOM 1124 CG LYS B 24 4.910 -17.198 -8.419 1.00 0.00 C ATOM 1125 CD LYS B 24 4.308 -18.603 -8.534 1.00 0.00 C ATOM 1126 CE LYS B 24 4.110 -19.034 -9.989 1.00 0.00 C ATOM 1127 NZ LYS B 24 3.786 -20.481 -10.041 1.00 0.00 N ATOM 0 H LYS B 24 7.391 -16.391 -8.127 1.00 0.00 H new ATOM 0 HA LYS B 24 5.433 -14.779 -6.897 1.00 0.00 H new ATOM 0 HB2 LYS B 24 5.930 -17.785 -6.620 1.00 0.00 H new ATOM 0 HB3 LYS B 24 4.408 -16.961 -6.342 1.00 0.00 H new ATOM 0 HG2 LYS B 24 4.188 -16.449 -8.744 1.00 0.00 H new ATOM 0 HG3 LYS B 24 5.780 -17.105 -9.069 1.00 0.00 H new ATOM 0 HD2 LYS B 24 4.960 -19.317 -8.032 1.00 0.00 H new ATOM 0 HD3 LYS B 24 3.349 -18.628 -8.016 1.00 0.00 H new ATOM 0 HE2 LYS B 24 3.307 -18.455 -10.444 1.00 0.00 H new ATOM 0 HE3 LYS B 24 5.014 -18.833 -10.564 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 3.619 -20.764 -11.028 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 4.581 -21.029 -9.654 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 2.931 -20.666 -9.478 1.00 0.00 H new ATOM 1141 N LEU B 25 7.626 -16.183 -4.881 1.00 0.00 N ATOM 1142 CA LEU B 25 8.168 -16.235 -3.515 1.00 0.00 C ATOM 1143 C LEU B 25 8.754 -14.885 -3.053 1.00 0.00 C ATOM 1144 O LEU B 25 8.745 -14.582 -1.858 1.00 0.00 O ATOM 1145 CB LEU B 25 9.243 -17.338 -3.430 1.00 0.00 C ATOM 1146 CG LEU B 25 8.755 -18.764 -3.756 1.00 0.00 C ATOM 1147 CD1 LEU B 25 9.926 -19.741 -3.657 1.00 0.00 C ATOM 1148 CD2 LEU B 25 7.654 -19.242 -2.804 1.00 0.00 C ATOM 0 H LEU B 25 8.223 -16.646 -5.567 1.00 0.00 H new ATOM 0 HA LEU B 25 7.340 -16.464 -2.844 1.00 0.00 H new ATOM 0 HB2 LEU B 25 10.054 -17.085 -4.113 1.00 0.00 H new ATOM 0 HB3 LEU B 25 9.662 -17.337 -2.424 1.00 0.00 H new ATOM 0 HG LEU B 25 8.346 -18.734 -4.766 1.00 0.00 H new ATOM 0 HD11 LEU B 25 9.580 -20.748 -3.888 1.00 0.00 H new ATOM 0 HD12 LEU B 25 10.702 -19.453 -4.367 1.00 0.00 H new ATOM 0 HD13 LEU B 25 10.333 -19.720 -2.646 1.00 0.00 H new ATOM 0 HD21 LEU B 25 7.348 -20.251 -3.079 1.00 0.00 H new ATOM 0 HD22 LEU B 25 8.032 -19.244 -1.782 1.00 0.00 H new ATOM 0 HD23 LEU B 25 6.797 -18.572 -2.873 1.00 0.00 H new ATOM 1408 N LEU B 43 29.140 -2.993 -4.412 1.00 0.00 N ATOM 1409 CA LEU B 43 28.777 -4.368 -4.762 1.00 0.00 C ATOM 1410 C LEU B 43 27.676 -4.344 -5.834 1.00 0.00 C ATOM 1411 O LEU B 43 26.697 -3.606 -5.716 1.00 0.00 O ATOM 1412 CB LEU B 43 28.358 -5.190 -3.523 1.00 0.00 C ATOM 1413 CG LEU B 43 27.384 -4.499 -2.541 1.00 0.00 C ATOM 1414 CD1 LEU B 43 26.268 -5.445 -2.082 1.00 0.00 C ATOM 1415 CD2 LEU B 43 28.133 -4.018 -1.294 1.00 0.00 C ATOM 0 HA LEU B 43 29.655 -4.869 -5.170 1.00 0.00 H new ATOM 0 HB2 LEU B 43 27.898 -6.116 -3.867 1.00 0.00 H new ATOM 0 HB3 LEU B 43 29.259 -5.466 -2.975 1.00 0.00 H new ATOM 0 HG LEU B 43 26.945 -3.658 -3.077 1.00 0.00 H new ATOM 0 HD11 LEU B 43 25.606 -4.920 -1.393 1.00 0.00 H new ATOM 0 HD12 LEU B 43 25.698 -5.782 -2.948 1.00 0.00 H new ATOM 0 HD13 LEU B 43 26.706 -6.307 -1.578 1.00 0.00 H new ATOM 0 HD21 LEU B 43 27.433 -3.534 -0.613 1.00 0.00 H new ATOM 0 HD22 LEU B 43 28.594 -4.870 -0.795 1.00 0.00 H new ATOM 0 HD23 LEU B 43 28.906 -3.307 -1.586 1.00 0.00 H new ATOM 1427 N MET B 44 27.852 -5.146 -6.885 1.00 0.00 N ATOM 1428 CA MET B 44 26.925 -5.256 -8.017 1.00 0.00 C ATOM 1429 C MET B 44 26.904 -6.688 -8.569 1.00 0.00 C ATOM 1430 O MET B 44 27.901 -7.415 -8.490 1.00 0.00 O ATOM 1431 CB MET B 44 27.317 -4.230 -9.096 1.00 0.00 C ATOM 1432 CG MET B 44 26.367 -4.193 -10.303 1.00 0.00 C ATOM 1433 SD MET B 44 24.583 -4.114 -9.945 1.00 0.00 S ATOM 1434 CE MET B 44 24.495 -2.604 -8.943 1.00 0.00 C ATOM 0 H MET B 44 28.665 -5.755 -6.977 1.00 0.00 H new ATOM 0 HA MET B 44 25.912 -5.034 -7.682 1.00 0.00 H new ATOM 0 HB2 MET B 44 27.351 -3.239 -8.644 1.00 0.00 H new ATOM 0 HB3 MET B 44 28.324 -4.455 -9.447 1.00 0.00 H new ATOM 0 HG2 MET B 44 26.629 -3.330 -10.915 1.00 0.00 H new ATOM 0 HG3 MET B 44 26.553 -5.080 -10.908 1.00 0.00 H new ATOM 0 HE1 MET B 44 23.462 -2.423 -8.647 1.00 0.00 H new ATOM 0 HE2 MET B 44 25.112 -2.722 -8.052 1.00 0.00 H new ATOM 0 HE3 MET B 44 24.859 -1.758 -9.527 1.00 0.00 H new ATOM 1444 N LEU B 45 25.747 -7.090 -9.098 1.00 0.00 N ATOM 1445 CA LEU B 45 25.472 -8.428 -9.621 1.00 0.00 C ATOM 1446 C LEU B 45 26.418 -8.842 -10.764 1.00 0.00 C ATOM 1447 O LEU B 45 26.895 -8.016 -11.549 1.00 0.00 O ATOM 1448 CB LEU B 45 23.995 -8.505 -10.055 1.00 0.00 C ATOM 1449 CG LEU B 45 22.972 -8.155 -8.951 1.00 0.00 C ATOM 1450 CD1 LEU B 45 21.564 -8.135 -9.546 1.00 0.00 C ATOM 1451 CD2 LEU B 45 22.989 -9.138 -7.778 1.00 0.00 C ATOM 0 H LEU B 45 24.944 -6.466 -9.177 1.00 0.00 H new ATOM 0 HA LEU B 45 25.660 -9.144 -8.821 1.00 0.00 H new ATOM 0 HB2 LEU B 45 23.844 -7.830 -10.897 1.00 0.00 H new ATOM 0 HB3 LEU B 45 23.789 -9.513 -10.414 1.00 0.00 H new ATOM 0 HG LEU B 45 23.256 -7.176 -8.565 1.00 0.00 H new ATOM 0 HD11 LEU B 45 20.843 -7.888 -8.767 1.00 0.00 H new ATOM 0 HD12 LEU B 45 21.514 -7.387 -10.337 1.00 0.00 H new ATOM 0 HD13 LEU B 45 21.330 -9.116 -9.959 1.00 0.00 H new ATOM 0 HD21 LEU B 45 22.248 -8.835 -7.038 1.00 0.00 H new ATOM 0 HD22 LEU B 45 22.753 -10.139 -8.139 1.00 0.00 H new ATOM 0 HD23 LEU B 45 23.978 -9.141 -7.320 1.00 0.00 H new ATOM 1463 N SER B 46 26.646 -10.150 -10.860 1.00 0.00 N ATOM 1464 CA SER B 46 27.519 -10.833 -11.826 1.00 0.00 C ATOM 1465 C SER B 46 26.742 -11.932 -12.574 1.00 0.00 C ATOM 1466 O SER B 46 25.648 -12.293 -12.131 1.00 0.00 O ATOM 1467 CB SER B 46 28.682 -11.455 -11.031 1.00 0.00 C ATOM 1468 OG SER B 46 29.584 -10.452 -10.589 1.00 0.00 O ATOM 0 H SER B 46 26.198 -10.810 -10.224 1.00 0.00 H new ATOM 0 HA SER B 46 27.890 -10.127 -12.569 1.00 0.00 H new ATOM 0 HB2 SER B 46 28.291 -12.002 -10.173 1.00 0.00 H new ATOM 0 HB3 SER B 46 29.210 -12.176 -11.655 1.00 0.00 H new ATOM 0 HG SER B 46 30.314 -10.868 -10.085 1.00 0.00 H new ATOM 1474 N PRO B 47 27.260 -12.517 -13.678 1.00 0.00 N ATOM 1475 CA PRO B 47 26.568 -13.601 -14.389 1.00 0.00 C ATOM 1476 C PRO B 47 26.204 -14.792 -13.485 1.00 0.00 C ATOM 1477 O PRO B 47 25.199 -15.455 -13.732 1.00 0.00 O ATOM 1478 CB PRO B 47 27.465 -13.988 -15.570 1.00 0.00 C ATOM 1479 CG PRO B 47 28.843 -13.460 -15.176 1.00 0.00 C ATOM 1480 CD PRO B 47 28.513 -12.214 -14.358 1.00 0.00 C ATOM 0 HA PRO B 47 25.596 -13.259 -14.745 1.00 0.00 H new ATOM 0 HB2 PRO B 47 27.480 -15.067 -15.723 1.00 0.00 H new ATOM 0 HB3 PRO B 47 27.116 -13.539 -16.500 1.00 0.00 H new ATOM 0 HG2 PRO B 47 29.403 -14.190 -14.591 1.00 0.00 H new ATOM 0 HG3 PRO B 47 29.448 -13.220 -16.050 1.00 0.00 H new ATOM 0 HD2 PRO B 47 29.305 -11.993 -13.642 1.00 0.00 H new ATOM 0 HD3 PRO B 47 28.410 -11.339 -15.000 1.00 0.00 H new ATOM 1488 N ASP B 48 26.955 -15.011 -12.400 1.00 0.00 N ATOM 1489 CA ASP B 48 26.687 -16.026 -11.372 1.00 0.00 C ATOM 1490 C ASP B 48 25.296 -15.865 -10.716 1.00 0.00 C ATOM 1491 O ASP B 48 24.631 -16.853 -10.402 1.00 0.00 O ATOM 1492 CB ASP B 48 27.788 -15.935 -10.308 1.00 0.00 C ATOM 1493 CG ASP B 48 27.658 -17.041 -9.247 1.00 0.00 C ATOM 1494 OD1 ASP B 48 27.937 -18.221 -9.566 1.00 0.00 O ATOM 1495 OD2 ASP B 48 27.309 -16.727 -8.084 1.00 0.00 O ATOM 0 H ASP B 48 27.796 -14.468 -12.206 1.00 0.00 H new ATOM 0 HA ASP B 48 26.686 -17.005 -11.851 1.00 0.00 H new ATOM 0 HB2 ASP B 48 28.764 -16.007 -10.789 1.00 0.00 H new ATOM 0 HB3 ASP B 48 27.743 -14.960 -9.823 1.00 0.00 H new ATOM 1500 N ASP B 49 24.829 -14.623 -10.544 1.00 0.00 N ATOM 1501 CA ASP B 49 23.506 -14.299 -9.998 1.00 0.00 C ATOM 1502 C ASP B 49 22.379 -14.555 -11.019 1.00 0.00 C ATOM 1503 O ASP B 49 21.247 -14.855 -10.630 1.00 0.00 O ATOM 1504 CB ASP B 49 23.453 -12.829 -9.550 1.00 0.00 C ATOM 1505 CG ASP B 49 24.491 -12.488 -8.471 1.00 0.00 C ATOM 1506 OD1 ASP B 49 24.240 -12.786 -7.277 1.00 0.00 O ATOM 1507 OD2 ASP B 49 25.541 -11.895 -8.815 1.00 0.00 O ATOM 0 H ASP B 49 25.374 -13.795 -10.786 1.00 0.00 H new ATOM 0 HA ASP B 49 23.349 -14.955 -9.142 1.00 0.00 H new ATOM 0 HB2 ASP B 49 23.613 -12.186 -10.415 1.00 0.00 H new ATOM 0 HB3 ASP B 49 22.456 -12.608 -9.169 1.00 0.00 H new ATOM 1512 N ILE B 50 22.682 -14.442 -12.320 1.00 0.00 N ATOM 1513 CA ILE B 50 21.740 -14.642 -13.434 1.00 0.00 C ATOM 1514 C ILE B 50 21.586 -16.133 -13.767 1.00 0.00 C ATOM 1515 O ILE B 50 20.474 -16.632 -13.926 1.00 0.00 O ATOM 1516 CB ILE B 50 22.205 -13.895 -14.711 1.00 0.00 C ATOM 1517 CG1 ILE B 50 22.717 -12.455 -14.465 1.00 0.00 C ATOM 1518 CG2 ILE B 50 21.033 -13.873 -15.711 1.00 0.00 C ATOM 1519 CD1 ILE B 50 23.371 -11.829 -15.706 1.00 0.00 C ATOM 0 H ILE B 50 23.621 -14.201 -12.638 1.00 0.00 H new ATOM 0 HA ILE B 50 20.781 -14.238 -13.110 1.00 0.00 H new ATOM 0 HB ILE B 50 23.064 -14.440 -15.103 1.00 0.00 H new ATOM 0 HG12 ILE B 50 21.884 -11.829 -14.146 1.00 0.00 H new ATOM 0 HG13 ILE B 50 23.438 -12.467 -13.648 1.00 0.00 H new ATOM 0 HG21 ILE B 50 21.338 -13.351 -16.618 1.00 0.00 H new ATOM 0 HG22 ILE B 50 20.747 -14.895 -15.959 1.00 0.00 H new ATOM 0 HG23 ILE B 50 20.183 -13.357 -15.264 1.00 0.00 H new ATOM 0 HD11 ILE B 50 23.709 -10.820 -15.469 1.00 0.00 H new ATOM 0 HD12 ILE B 50 24.224 -12.435 -16.013 1.00 0.00 H new ATOM 0 HD13 ILE B 50 22.645 -11.787 -16.518 1.00 0.00 H new ATOM 1531 N GLU B 51 22.690 -16.880 -13.847 1.00 0.00 N ATOM 1532 CA GLU B 51 22.669 -18.324 -14.125 1.00 0.00 C ATOM 1533 C GLU B 51 22.064 -19.153 -12.969 1.00 0.00 C ATOM 1534 O GLU B 51 21.923 -20.370 -13.071 1.00 0.00 O ATOM 1535 CB GLU B 51 24.078 -18.807 -14.518 1.00 0.00 C ATOM 1536 CG GLU B 51 25.059 -18.920 -13.347 1.00 0.00 C ATOM 1537 CD GLU B 51 26.450 -19.366 -13.837 1.00 0.00 C ATOM 1538 OE1 GLU B 51 27.263 -18.508 -14.258 1.00 0.00 O ATOM 1539 OE2 GLU B 51 26.742 -20.587 -13.809 1.00 0.00 O ATOM 0 H GLU B 51 23.629 -16.502 -13.721 1.00 0.00 H new ATOM 0 HA GLU B 51 22.002 -18.488 -14.971 1.00 0.00 H new ATOM 0 HB2 GLU B 51 23.993 -19.781 -15.000 1.00 0.00 H new ATOM 0 HB3 GLU B 51 24.491 -18.120 -15.257 1.00 0.00 H new ATOM 0 HG2 GLU B 51 25.139 -17.958 -12.840 1.00 0.00 H new ATOM 0 HG3 GLU B 51 24.680 -19.635 -12.617 1.00 0.00 H new ATOM 1546 N GLN B 52 21.709 -18.506 -11.858 1.00 0.00 N ATOM 1547 CA GLN B 52 21.146 -19.131 -10.668 1.00 0.00 C ATOM 1548 C GLN B 52 19.642 -19.440 -10.763 1.00 0.00 C ATOM 1549 O GLN B 52 19.241 -20.539 -10.385 1.00 0.00 O ATOM 1550 CB GLN B 52 21.498 -18.215 -9.477 1.00 0.00 C ATOM 1551 CG GLN B 52 20.594 -18.256 -8.229 1.00 0.00 C ATOM 1552 CD GLN B 52 19.301 -17.433 -8.328 1.00 0.00 C ATOM 1553 OE1 GLN B 52 18.243 -17.855 -7.883 1.00 0.00 O ATOM 1554 NE2 GLN B 52 19.304 -16.246 -8.906 1.00 0.00 N ATOM 0 H GLN B 52 21.811 -17.496 -11.762 1.00 0.00 H new ATOM 0 HA GLN B 52 21.584 -20.121 -10.540 1.00 0.00 H new ATOM 0 HB2 GLN B 52 22.512 -18.457 -9.160 1.00 0.00 H new ATOM 0 HB3 GLN B 52 21.514 -17.188 -9.842 1.00 0.00 H new ATOM 0 HG2 GLN B 52 20.330 -19.294 -8.026 1.00 0.00 H new ATOM 0 HG3 GLN B 52 21.167 -17.900 -7.373 1.00 0.00 H new ATOM 0 HE21 GLN B 52 20.171 -15.866 -9.287 1.00 0.00 H new ATOM 0 HE22 GLN B 52 18.440 -15.708 -8.972 1.00 0.00 H new ATOM 1563 N TRP B 53 18.789 -18.516 -11.231 1.00 0.00 N ATOM 1564 CA TRP B 53 17.333 -18.756 -11.220 1.00 0.00 C ATOM 1565 C TRP B 53 16.824 -19.798 -12.228 1.00 0.00 C ATOM 1566 O TRP B 53 15.812 -20.450 -11.968 1.00 0.00 O ATOM 1567 CB TRP B 53 16.536 -17.438 -11.240 1.00 0.00 C ATOM 1568 CG TRP B 53 17.005 -16.302 -12.101 1.00 0.00 C ATOM 1569 CD1 TRP B 53 17.492 -16.398 -13.356 1.00 0.00 C ATOM 1570 CD2 TRP B 53 17.041 -14.873 -11.775 1.00 0.00 C ATOM 1571 NE1 TRP B 53 17.818 -15.144 -13.832 1.00 0.00 N ATOM 1572 CE2 TRP B 53 17.583 -14.166 -12.892 1.00 0.00 C ATOM 1573 CE3 TRP B 53 16.684 -14.103 -10.645 1.00 0.00 C ATOM 1574 CZ2 TRP B 53 17.777 -12.775 -12.884 1.00 0.00 C ATOM 1575 CZ3 TRP B 53 16.870 -12.706 -10.629 1.00 0.00 C ATOM 1576 CH2 TRP B 53 17.417 -12.041 -11.742 1.00 0.00 C ATOM 0 H TRP B 53 19.071 -17.614 -11.614 1.00 0.00 H new ATOM 0 HA TRP B 53 17.138 -19.238 -10.262 1.00 0.00 H new ATOM 0 HB2 TRP B 53 15.517 -17.678 -11.543 1.00 0.00 H new ATOM 0 HB3 TRP B 53 16.486 -17.071 -10.215 1.00 0.00 H new ATOM 0 HD1 TRP B 53 17.609 -17.320 -13.907 1.00 0.00 H new ATOM 0 HE1 TRP B 53 18.188 -14.964 -14.765 1.00 0.00 H new ATOM 0 HE3 TRP B 53 16.262 -14.593 -9.780 1.00 0.00 H new ATOM 0 HZ2 TRP B 53 18.198 -12.276 -13.745 1.00 0.00 H new ATOM 0 HZ3 TRP B 53 16.590 -12.140 -9.753 1.00 0.00 H new ATOM 0 HH2 TRP B 53 17.559 -10.971 -11.718 1.00 0.00 H new ATOM 1587 N PHE B 54 17.518 -20.000 -13.351 1.00 0.00 N ATOM 1588 CA PHE B 54 17.131 -20.983 -14.382 1.00 0.00 C ATOM 1589 C PHE B 54 17.730 -22.394 -14.184 1.00 0.00 C ATOM 1590 O PHE B 54 17.275 -23.348 -14.819 1.00 0.00 O ATOM 1591 CB PHE B 54 17.437 -20.421 -15.789 1.00 0.00 C ATOM 1592 CG PHE B 54 18.789 -20.790 -16.384 1.00 0.00 C ATOM 1593 CD1 PHE B 54 19.970 -20.611 -15.641 1.00 0.00 C ATOM 1594 CD2 PHE B 54 18.867 -21.355 -17.673 1.00 0.00 C ATOM 1595 CE1 PHE B 54 21.207 -21.039 -16.153 1.00 0.00 C ATOM 1596 CE2 PHE B 54 20.109 -21.752 -18.202 1.00 0.00 C ATOM 1597 CZ PHE B 54 21.280 -21.603 -17.438 1.00 0.00 C ATOM 0 H PHE B 54 18.370 -19.486 -13.577 1.00 0.00 H new ATOM 0 HA PHE B 54 16.056 -21.131 -14.276 1.00 0.00 H new ATOM 0 HB2 PHE B 54 16.658 -20.763 -16.471 1.00 0.00 H new ATOM 0 HB3 PHE B 54 17.368 -19.334 -15.746 1.00 0.00 H new ATOM 0 HD1 PHE B 54 19.926 -20.141 -14.670 1.00 0.00 H new ATOM 0 HD2 PHE B 54 17.968 -21.484 -18.258 1.00 0.00 H new ATOM 0 HE1 PHE B 54 22.102 -20.934 -15.558 1.00 0.00 H new ATOM 0 HE2 PHE B 54 20.163 -22.172 -19.196 1.00 0.00 H new ATOM 0 HZ PHE B 54 22.232 -21.921 -17.837 1.00 0.00 H new ATOM 1607 N THR B 55 18.748 -22.547 -13.324 1.00 0.00 N ATOM 1608 CA THR B 55 19.467 -23.823 -13.108 1.00 0.00 C ATOM 1609 C THR B 55 18.596 -24.974 -12.580 1.00 0.00 C ATOM 1610 O THR B 55 18.896 -26.145 -12.814 1.00 0.00 O ATOM 1611 CB THR B 55 20.703 -23.608 -12.210 1.00 0.00 C ATOM 1612 OG1 THR B 55 21.693 -24.568 -12.517 1.00 0.00 O ATOM 1613 CG2 THR B 55 20.436 -23.684 -10.705 1.00 0.00 C ATOM 0 H THR B 55 19.103 -21.783 -12.750 1.00 0.00 H new ATOM 0 HA THR B 55 19.786 -24.144 -14.099 1.00 0.00 H new ATOM 0 HB THR B 55 21.025 -22.589 -12.426 1.00 0.00 H new ATOM 0 HG1 THR B 55 22.476 -24.425 -11.945 1.00 0.00 H new ATOM 0 HG21 THR B 55 21.367 -23.520 -10.162 1.00 0.00 H new ATOM 0 HG22 THR B 55 19.712 -22.919 -10.425 1.00 0.00 H new ATOM 0 HG23 THR B 55 20.039 -24.668 -10.455 1.00 0.00 H new