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 20 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 24 LYS NZ :NH3+ -166:sc= 0.886 (180deg=0.758) USER MOD Set 2.1: A2085 GLN : amide:sc= 0.596 K(o=0.96,f=-0.5) USER MOD Set 2.2: A2086 GLN : amide:sc= -0.335 K(o=0.96,f=-0.49) USER MOD Set 2.3: A2089 ASN : amide:sc= 0.696 K(o=0.96,f=-0.98) USER MOD Single : A2064 SER OG : rot 180:sc= 0 USER MOD Single : A2066 SER OG : rot 180:sc= 0.00488 USER MOD Single : A2069 GLN : amide:sc= -0.019 X(o=-0.019,f=-0.019) USER MOD Single : A2074 THR OG1 : rot 75:sc= 1.18 USER MOD Single : A2076 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2077 SER OG : rot 180:sc= 0 USER MOD Single : A2079 SER OG : rot 180:sc= 0 USER MOD Single : A2080 SER OG : rot 180:sc= 0.364 USER MOD Single : A2082 GLN : amide:sc= -0.457 K(o=-0.46,f=-2) USER MOD Single : A2083 GLN : amide:sc= 0.839 K(o=0.84,f=-0.087) USER MOD Single : A2084 GLN : amide:sc= -0.453 X(o=-0.45,f=-0.47) USER MOD Single : A2092 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2093 SER OG : rot 77:sc= 0.791 USER MOD Single : A2094 ASN : amide:sc= 0.714 K(o=0.71,f=-0.0083) USER MOD Single : A2096 GLN : amide:sc= -1.8! C(o=-1.8!,f=-2.4!) USER MOD Single : A2098 MET CE :methyl -167:sc= 0 (180deg=-0.139) USER MOD Single : A2103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2104 GLN : amide:sc= 0 X(o=0,f=-0.47) 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 18 THR OG1 : rot -39:sc= 0.00302 USER MOD Single : B 44 MET CE :methyl 174:sc=-0.00387 (180deg=-0.0549) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 52 GLN : amide:sc= -0.57 X(o=-0.57,f=-0.37) USER MOD Single : B 55 THR OG1 : rot -37:sc=6.44e-05 USER MOD ----------------------------------------------------------------- ATOM 64 N ILE A2063 4.890 -5.611 -15.238 1.00 0.00 N ATOM 65 CA ILE A2063 5.951 -6.404 -15.888 1.00 0.00 C ATOM 66 C ILE A2063 5.381 -7.112 -17.133 1.00 0.00 C ATOM 67 O ILE A2063 4.162 -7.263 -17.258 1.00 0.00 O ATOM 68 CB ILE A2063 6.596 -7.416 -14.906 1.00 0.00 C ATOM 69 CG1 ILE A2063 5.562 -8.389 -14.290 1.00 0.00 C ATOM 70 CG2 ILE A2063 7.384 -6.670 -13.814 1.00 0.00 C ATOM 71 CD1 ILE A2063 6.180 -9.504 -13.435 1.00 0.00 C ATOM 0 HA ILE A2063 6.745 -5.726 -16.202 1.00 0.00 H new ATOM 0 HB ILE A2063 7.289 -8.032 -15.480 1.00 0.00 H new ATOM 0 HG12 ILE A2063 4.865 -7.819 -13.676 1.00 0.00 H new ATOM 0 HG13 ILE A2063 4.982 -8.842 -15.094 1.00 0.00 H new ATOM 0 HG21 ILE A2063 7.832 -7.392 -13.131 1.00 0.00 H new ATOM 0 HG22 ILE A2063 8.169 -6.072 -14.276 1.00 0.00 H new ATOM 0 HG23 ILE A2063 6.709 -6.017 -13.260 1.00 0.00 H new ATOM 0 HD11 ILE A2063 5.388 -10.141 -13.041 1.00 0.00 H new ATOM 0 HD12 ILE A2063 6.855 -10.101 -14.048 1.00 0.00 H new ATOM 0 HD13 ILE A2063 6.736 -9.063 -12.608 1.00 0.00 H new ATOM 83 N SER A2064 6.253 -7.565 -18.040 1.00 0.00 N ATOM 84 CA SER A2064 5.868 -8.249 -19.290 1.00 0.00 C ATOM 85 C SER A2064 6.614 -9.582 -19.450 1.00 0.00 C ATOM 86 O SER A2064 7.816 -9.635 -19.173 1.00 0.00 O ATOM 87 CB SER A2064 6.164 -7.352 -20.501 1.00 0.00 C ATOM 88 OG SER A2064 5.392 -6.160 -20.447 1.00 0.00 O ATOM 0 H SER A2064 7.262 -7.468 -17.929 1.00 0.00 H new ATOM 0 HA SER A2064 4.799 -8.453 -19.238 1.00 0.00 H new ATOM 0 HB2 SER A2064 7.225 -7.103 -20.524 1.00 0.00 H new ATOM 0 HB3 SER A2064 5.943 -7.892 -21.422 1.00 0.00 H new ATOM 0 HG SER A2064 5.597 -5.602 -21.226 1.00 0.00 H new ATOM 94 N PRO A2065 5.949 -10.667 -19.906 1.00 0.00 N ATOM 95 CA PRO A2065 6.574 -11.987 -20.056 1.00 0.00 C ATOM 96 C PRO A2065 7.680 -12.035 -21.120 1.00 0.00 C ATOM 97 O PRO A2065 8.586 -12.867 -21.035 1.00 0.00 O ATOM 98 CB PRO A2065 5.426 -12.953 -20.373 1.00 0.00 C ATOM 99 CG PRO A2065 4.369 -12.061 -21.020 1.00 0.00 C ATOM 100 CD PRO A2065 4.544 -10.731 -20.289 1.00 0.00 C ATOM 0 HA PRO A2065 7.096 -12.261 -19.139 1.00 0.00 H new ATOM 0 HB2 PRO A2065 5.746 -13.748 -21.047 1.00 0.00 H new ATOM 0 HB3 PRO A2065 5.047 -13.434 -19.471 1.00 0.00 H new ATOM 0 HG2 PRO A2065 4.532 -11.956 -22.093 1.00 0.00 H new ATOM 0 HG3 PRO A2065 3.365 -12.465 -20.888 1.00 0.00 H new ATOM 0 HD2 PRO A2065 4.276 -9.893 -20.933 1.00 0.00 H new ATOM 0 HD3 PRO A2065 3.898 -10.679 -19.413 1.00 0.00 H new ATOM 108 N SER A2066 7.638 -11.133 -22.104 1.00 0.00 N ATOM 109 CA SER A2066 8.630 -11.016 -23.179 1.00 0.00 C ATOM 110 C SER A2066 10.033 -10.661 -22.677 1.00 0.00 C ATOM 111 O SER A2066 11.022 -11.158 -23.221 1.00 0.00 O ATOM 112 CB SER A2066 8.158 -9.977 -24.203 1.00 0.00 C ATOM 113 OG SER A2066 7.813 -8.760 -23.553 1.00 0.00 O ATOM 0 H SER A2066 6.891 -10.443 -22.178 1.00 0.00 H new ATOM 0 HA SER A2066 8.710 -11.999 -23.644 1.00 0.00 H new ATOM 0 HB2 SER A2066 8.945 -9.795 -24.935 1.00 0.00 H new ATOM 0 HB3 SER A2066 7.297 -10.361 -24.750 1.00 0.00 H new ATOM 0 HG SER A2066 7.515 -8.106 -24.220 1.00 0.00 H new ATOM 119 N ALA A2067 10.141 -9.860 -21.612 1.00 0.00 N ATOM 120 CA ALA A2067 11.420 -9.499 -20.998 1.00 0.00 C ATOM 121 C ALA A2067 12.177 -10.743 -20.495 1.00 0.00 C ATOM 122 O ALA A2067 13.397 -10.834 -20.633 1.00 0.00 O ATOM 123 CB ALA A2067 11.146 -8.511 -19.859 1.00 0.00 C ATOM 0 H ALA A2067 9.335 -9.441 -21.149 1.00 0.00 H new ATOM 0 HA ALA A2067 12.063 -9.030 -21.743 1.00 0.00 H new ATOM 0 HB1 ALA A2067 12.087 -8.229 -19.388 1.00 0.00 H new ATOM 0 HB2 ALA A2067 10.659 -7.621 -20.258 1.00 0.00 H new ATOM 0 HB3 ALA A2067 10.496 -8.979 -19.120 1.00 0.00 H new ATOM 129 N LEU A2068 11.449 -11.727 -19.955 1.00 0.00 N ATOM 130 CA LEU A2068 12.016 -12.986 -19.472 1.00 0.00 C ATOM 131 C LEU A2068 12.504 -13.875 -20.630 1.00 0.00 C ATOM 132 O LEU A2068 13.519 -14.557 -20.493 1.00 0.00 O ATOM 133 CB LEU A2068 10.990 -13.714 -18.580 1.00 0.00 C ATOM 134 CG LEU A2068 10.595 -13.043 -17.244 1.00 0.00 C ATOM 135 CD1 LEU A2068 11.702 -12.211 -16.591 1.00 0.00 C ATOM 136 CD2 LEU A2068 9.357 -12.164 -17.402 1.00 0.00 C ATOM 0 H LEU A2068 10.437 -11.668 -19.841 1.00 0.00 H new ATOM 0 HA LEU A2068 12.896 -12.760 -18.869 1.00 0.00 H new ATOM 0 HB2 LEU A2068 10.081 -13.859 -19.164 1.00 0.00 H new ATOM 0 HB3 LEU A2068 11.385 -14.704 -18.354 1.00 0.00 H new ATOM 0 HG LEU A2068 10.390 -13.883 -16.581 1.00 0.00 H new ATOM 0 HD11 LEU A2068 11.332 -11.780 -15.660 1.00 0.00 H new ATOM 0 HD12 LEU A2068 12.560 -12.849 -16.380 1.00 0.00 H new ATOM 0 HD13 LEU A2068 12.003 -11.411 -17.267 1.00 0.00 H new ATOM 0 HD21 LEU A2068 9.109 -11.709 -16.443 1.00 0.00 H new ATOM 0 HD22 LEU A2068 9.557 -11.382 -18.134 1.00 0.00 H new ATOM 0 HD23 LEU A2068 8.519 -12.773 -17.742 1.00 0.00 H new ATOM 148 N GLN A2069 11.842 -13.837 -21.794 1.00 0.00 N ATOM 149 CA GLN A2069 12.296 -14.579 -22.980 1.00 0.00 C ATOM 150 C GLN A2069 13.595 -13.964 -23.533 1.00 0.00 C ATOM 151 O GLN A2069 14.525 -14.681 -23.907 1.00 0.00 O ATOM 152 CB GLN A2069 11.214 -14.602 -24.078 1.00 0.00 C ATOM 153 CG GLN A2069 9.809 -15.015 -23.612 1.00 0.00 C ATOM 154 CD GLN A2069 9.785 -16.274 -22.745 1.00 0.00 C ATOM 155 OE1 GLN A2069 10.219 -17.348 -23.138 1.00 0.00 O ATOM 156 NE2 GLN A2069 9.281 -16.186 -21.531 1.00 0.00 N ATOM 0 H GLN A2069 10.988 -13.299 -21.941 1.00 0.00 H new ATOM 0 HA GLN A2069 12.489 -15.607 -22.674 1.00 0.00 H new ATOM 0 HB2 GLN A2069 11.153 -13.610 -24.525 1.00 0.00 H new ATOM 0 HB3 GLN A2069 11.533 -15.286 -24.864 1.00 0.00 H new ATOM 0 HG2 GLN A2069 9.367 -14.192 -23.051 1.00 0.00 H new ATOM 0 HG3 GLN A2069 9.180 -15.177 -24.488 1.00 0.00 H new ATOM 0 HE21 GLN A2069 8.916 -15.295 -21.193 1.00 0.00 H new ATOM 0 HE22 GLN A2069 9.255 -17.009 -20.929 1.00 0.00 H new ATOM 165 N ASP A2070 13.682 -12.629 -23.549 1.00 0.00 N ATOM 166 CA ASP A2070 14.872 -11.894 -23.993 1.00 0.00 C ATOM 167 C ASP A2070 16.060 -12.123 -23.033 1.00 0.00 C ATOM 168 O ASP A2070 17.201 -12.257 -23.479 1.00 0.00 O ATOM 169 CB ASP A2070 14.512 -10.405 -24.140 1.00 0.00 C ATOM 170 CG ASP A2070 15.428 -9.646 -25.116 1.00 0.00 C ATOM 171 OD1 ASP A2070 15.583 -10.099 -26.275 1.00 0.00 O ATOM 172 OD2 ASP A2070 15.932 -8.556 -24.763 1.00 0.00 O ATOM 0 H ASP A2070 12.919 -12.021 -23.250 1.00 0.00 H new ATOM 0 HA ASP A2070 15.195 -12.267 -24.965 1.00 0.00 H new ATOM 0 HB2 ASP A2070 13.481 -10.321 -24.482 1.00 0.00 H new ATOM 0 HB3 ASP A2070 14.563 -9.929 -23.161 1.00 0.00 H new ATOM 177 N LEU A2071 15.796 -12.248 -21.723 1.00 0.00 N ATOM 178 CA LEU A2071 16.796 -12.593 -20.704 1.00 0.00 C ATOM 179 C LEU A2071 17.401 -13.970 -21.023 1.00 0.00 C ATOM 180 O LEU A2071 18.622 -14.094 -21.108 1.00 0.00 O ATOM 181 CB LEU A2071 16.137 -12.529 -19.309 1.00 0.00 C ATOM 182 CG LEU A2071 17.075 -12.698 -18.097 1.00 0.00 C ATOM 183 CD1 LEU A2071 16.351 -12.217 -16.835 1.00 0.00 C ATOM 184 CD2 LEU A2071 17.506 -14.145 -17.828 1.00 0.00 C ATOM 0 H LEU A2071 14.862 -12.109 -21.336 1.00 0.00 H new ATOM 0 HA LEU A2071 17.619 -11.879 -20.707 1.00 0.00 H new ATOM 0 HB2 LEU A2071 15.628 -11.570 -19.216 1.00 0.00 H new ATOM 0 HB3 LEU A2071 15.371 -13.302 -19.258 1.00 0.00 H new ATOM 0 HG LEU A2071 17.967 -12.118 -18.334 1.00 0.00 H new ATOM 0 HD11 LEU A2071 17.007 -12.333 -15.972 1.00 0.00 H new ATOM 0 HD12 LEU A2071 16.082 -11.167 -16.948 1.00 0.00 H new ATOM 0 HD13 LEU A2071 15.448 -12.809 -16.686 1.00 0.00 H new ATOM 0 HD21 LEU A2071 18.164 -14.173 -16.959 1.00 0.00 H new ATOM 0 HD22 LEU A2071 16.625 -14.757 -17.636 1.00 0.00 H new ATOM 0 HD23 LEU A2071 18.036 -14.534 -18.697 1.00 0.00 H new ATOM 196 N LEU A2072 16.564 -14.987 -21.262 1.00 0.00 N ATOM 197 CA LEU A2072 17.002 -16.336 -21.646 1.00 0.00 C ATOM 198 C LEU A2072 17.857 -16.350 -22.919 1.00 0.00 C ATOM 199 O LEU A2072 18.923 -16.972 -22.920 1.00 0.00 O ATOM 200 CB LEU A2072 15.783 -17.274 -21.771 1.00 0.00 C ATOM 201 CG LEU A2072 15.393 -18.034 -20.488 1.00 0.00 C ATOM 202 CD1 LEU A2072 15.483 -17.234 -19.189 1.00 0.00 C ATOM 203 CD2 LEU A2072 13.973 -18.583 -20.640 1.00 0.00 C ATOM 0 H LEU A2072 15.550 -14.896 -21.193 1.00 0.00 H new ATOM 0 HA LEU A2072 17.651 -16.704 -20.851 1.00 0.00 H new ATOM 0 HB2 LEU A2072 14.926 -16.685 -22.098 1.00 0.00 H new ATOM 0 HB3 LEU A2072 15.987 -18.003 -22.556 1.00 0.00 H new ATOM 0 HG LEU A2072 16.135 -18.826 -20.390 1.00 0.00 H new ATOM 0 HD11 LEU A2072 15.187 -17.866 -18.351 1.00 0.00 H new ATOM 0 HD12 LEU A2072 16.508 -16.893 -19.042 1.00 0.00 H new ATOM 0 HD13 LEU A2072 14.819 -16.372 -19.246 1.00 0.00 H new ATOM 0 HD21 LEU A2072 13.692 -19.122 -19.735 1.00 0.00 H new ATOM 0 HD22 LEU A2072 13.279 -17.758 -20.801 1.00 0.00 H new ATOM 0 HD23 LEU A2072 13.934 -19.261 -21.492 1.00 0.00 H new ATOM 215 N ARG A2073 17.450 -15.655 -23.994 1.00 0.00 N ATOM 216 CA ARG A2073 18.266 -15.615 -25.223 1.00 0.00 C ATOM 217 C ARG A2073 19.604 -14.886 -25.018 1.00 0.00 C ATOM 218 O ARG A2073 20.601 -15.262 -25.632 1.00 0.00 O ATOM 219 CB ARG A2073 17.454 -15.154 -26.446 1.00 0.00 C ATOM 220 CG ARG A2073 17.400 -13.648 -26.706 1.00 0.00 C ATOM 221 CD ARG A2073 16.642 -13.392 -28.014 1.00 0.00 C ATOM 222 NE ARG A2073 16.342 -11.963 -28.165 1.00 0.00 N ATOM 223 CZ ARG A2073 16.221 -11.248 -29.262 1.00 0.00 C ATOM 224 NH1 ARG A2073 16.400 -11.736 -30.459 1.00 0.00 N ATOM 225 NH2 ARG A2073 15.902 -9.996 -29.133 1.00 0.00 N ATOM 0 H ARG A2073 16.581 -15.123 -24.040 1.00 0.00 H new ATOM 0 HA ARG A2073 18.555 -16.639 -25.458 1.00 0.00 H new ATOM 0 HB2 ARG A2073 17.868 -15.638 -27.331 1.00 0.00 H new ATOM 0 HB3 ARG A2073 16.432 -15.517 -26.333 1.00 0.00 H new ATOM 0 HG2 ARG A2073 16.904 -13.141 -25.878 1.00 0.00 H new ATOM 0 HG3 ARG A2073 18.409 -13.241 -26.770 1.00 0.00 H new ATOM 0 HD2 ARG A2073 17.238 -13.735 -28.859 1.00 0.00 H new ATOM 0 HD3 ARG A2073 15.716 -13.967 -28.023 1.00 0.00 H new ATOM 0 HE ARG A2073 16.208 -11.451 -27.293 1.00 0.00 H new ATOM 0 HH11 ARG A2073 16.647 -12.719 -30.578 1.00 0.00 H new ATOM 0 HH12 ARG A2073 16.293 -11.135 -31.276 1.00 0.00 H new ATOM 0 HH21 ARG A2073 15.755 -9.600 -28.204 1.00 0.00 H new ATOM 0 HH22 ARG A2073 15.799 -9.408 -29.960 1.00 0.00 H new ATOM 239 N THR A2074 19.649 -13.902 -24.112 1.00 0.00 N ATOM 240 CA THR A2074 20.886 -13.192 -23.727 1.00 0.00 C ATOM 241 C THR A2074 21.808 -14.122 -22.917 1.00 0.00 C ATOM 242 O THR A2074 23.009 -14.196 -23.177 1.00 0.00 O ATOM 243 CB THR A2074 20.574 -11.915 -22.922 1.00 0.00 C ATOM 244 OG1 THR A2074 19.706 -11.073 -23.649 1.00 0.00 O ATOM 245 CG2 THR A2074 21.823 -11.078 -22.644 1.00 0.00 C ATOM 0 H THR A2074 18.822 -13.569 -23.617 1.00 0.00 H new ATOM 0 HA THR A2074 21.398 -12.894 -24.642 1.00 0.00 H new ATOM 0 HB THR A2074 20.132 -12.260 -21.987 1.00 0.00 H new ATOM 0 HG1 THR A2074 18.798 -11.442 -23.627 1.00 0.00 H new ATOM 0 HG21 THR A2074 21.547 -10.191 -22.074 1.00 0.00 H new ATOM 0 HG22 THR A2074 22.537 -11.669 -22.071 1.00 0.00 H new ATOM 0 HG23 THR A2074 22.277 -10.777 -23.588 1.00 0.00 H new ATOM 253 N LEU A2075 21.244 -14.870 -21.957 1.00 0.00 N ATOM 254 CA LEU A2075 21.931 -15.838 -21.088 1.00 0.00 C ATOM 255 C LEU A2075 22.564 -17.014 -21.862 1.00 0.00 C ATOM 256 O LEU A2075 23.643 -17.477 -21.490 1.00 0.00 O ATOM 257 CB LEU A2075 20.909 -16.337 -20.046 1.00 0.00 C ATOM 258 CG LEU A2075 21.363 -17.491 -19.129 1.00 0.00 C ATOM 259 CD1 LEU A2075 22.599 -17.145 -18.295 1.00 0.00 C ATOM 260 CD2 LEU A2075 20.214 -17.858 -18.189 1.00 0.00 C ATOM 0 H LEU A2075 20.246 -14.813 -21.755 1.00 0.00 H new ATOM 0 HA LEU A2075 22.770 -15.340 -20.602 1.00 0.00 H new ATOM 0 HB2 LEU A2075 20.625 -15.494 -19.417 1.00 0.00 H new ATOM 0 HB3 LEU A2075 20.011 -16.656 -20.575 1.00 0.00 H new ATOM 0 HG LEU A2075 21.634 -18.328 -19.773 1.00 0.00 H new ATOM 0 HD11 LEU A2075 22.868 -17.998 -17.671 1.00 0.00 H new ATOM 0 HD12 LEU A2075 23.430 -16.905 -18.958 1.00 0.00 H new ATOM 0 HD13 LEU A2075 22.381 -16.286 -17.660 1.00 0.00 H new ATOM 0 HD21 LEU A2075 20.525 -18.674 -17.536 1.00 0.00 H new ATOM 0 HD22 LEU A2075 19.947 -16.991 -17.585 1.00 0.00 H new ATOM 0 HD23 LEU A2075 19.350 -18.172 -18.775 1.00 0.00 H new ATOM 272 N LYS A2076 21.912 -17.516 -22.922 1.00 0.00 N ATOM 273 CA LYS A2076 22.424 -18.646 -23.730 1.00 0.00 C ATOM 274 C LYS A2076 23.754 -18.368 -24.450 1.00 0.00 C ATOM 275 O LYS A2076 24.498 -19.312 -24.726 1.00 0.00 O ATOM 276 CB LYS A2076 21.342 -19.140 -24.710 1.00 0.00 C ATOM 277 CG LYS A2076 20.266 -20.022 -24.049 1.00 0.00 C ATOM 278 CD LYS A2076 20.810 -21.389 -23.592 1.00 0.00 C ATOM 279 CE LYS A2076 19.673 -22.287 -23.090 1.00 0.00 C ATOM 280 NZ LYS A2076 20.184 -23.609 -22.637 1.00 0.00 N ATOM 0 H LYS A2076 21.016 -17.154 -23.247 1.00 0.00 H new ATOM 0 HA LYS A2076 22.657 -19.439 -23.020 1.00 0.00 H new ATOM 0 HB2 LYS A2076 20.860 -18.278 -25.171 1.00 0.00 H new ATOM 0 HB3 LYS A2076 21.820 -19.704 -25.511 1.00 0.00 H new ATOM 0 HG2 LYS A2076 19.850 -19.496 -23.190 1.00 0.00 H new ATOM 0 HG3 LYS A2076 19.449 -20.179 -24.753 1.00 0.00 H new ATOM 0 HD2 LYS A2076 21.325 -21.876 -24.420 1.00 0.00 H new ATOM 0 HD3 LYS A2076 21.544 -21.247 -22.799 1.00 0.00 H new ATOM 0 HE2 LYS A2076 19.155 -21.794 -22.267 1.00 0.00 H new ATOM 0 HE3 LYS A2076 18.943 -22.431 -23.886 1.00 0.00 H new ATOM 0 HZ1 LYS A2076 19.390 -24.192 -22.304 1.00 0.00 H new ATOM 0 HZ2 LYS A2076 20.657 -24.088 -23.429 1.00 0.00 H new ATOM 0 HZ3 LYS A2076 20.862 -23.472 -21.861 1.00 0.00 H new ATOM 294 N SER A2077 24.083 -17.106 -24.718 1.00 0.00 N ATOM 295 CA SER A2077 25.364 -16.691 -25.316 1.00 0.00 C ATOM 296 C SER A2077 26.482 -16.635 -24.249 1.00 0.00 C ATOM 297 O SER A2077 26.179 -16.481 -23.061 1.00 0.00 O ATOM 298 CB SER A2077 25.183 -15.318 -25.968 1.00 0.00 C ATOM 299 OG SER A2077 24.315 -15.423 -27.086 1.00 0.00 O ATOM 0 H SER A2077 23.459 -16.323 -24.524 1.00 0.00 H new ATOM 0 HA SER A2077 25.661 -17.422 -26.068 1.00 0.00 H new ATOM 0 HB2 SER A2077 24.774 -14.613 -25.244 1.00 0.00 H new ATOM 0 HB3 SER A2077 26.150 -14.925 -26.283 1.00 0.00 H new ATOM 0 HG SER A2077 24.203 -14.540 -27.497 1.00 0.00 H new ATOM 305 N PRO A2078 27.779 -16.748 -24.614 1.00 0.00 N ATOM 306 CA PRO A2078 28.883 -16.732 -23.646 1.00 0.00 C ATOM 307 C PRO A2078 28.978 -15.406 -22.871 1.00 0.00 C ATOM 308 O PRO A2078 28.651 -14.330 -23.380 1.00 0.00 O ATOM 309 CB PRO A2078 30.152 -17.048 -24.441 1.00 0.00 C ATOM 310 CG PRO A2078 29.794 -16.588 -25.849 1.00 0.00 C ATOM 311 CD PRO A2078 28.307 -16.924 -25.959 1.00 0.00 C ATOM 0 HA PRO A2078 28.722 -17.476 -22.866 1.00 0.00 H new ATOM 0 HB2 PRO A2078 31.018 -16.514 -24.049 1.00 0.00 H new ATOM 0 HB3 PRO A2078 30.393 -18.111 -24.412 1.00 0.00 H new ATOM 0 HG2 PRO A2078 29.977 -15.522 -25.983 1.00 0.00 H new ATOM 0 HG3 PRO A2078 30.382 -17.110 -26.605 1.00 0.00 H new ATOM 0 HD2 PRO A2078 27.805 -16.266 -26.669 1.00 0.00 H new ATOM 0 HD3 PRO A2078 28.158 -17.945 -26.311 1.00 0.00 H new ATOM 319 N SER A2079 29.419 -15.505 -21.617 1.00 0.00 N ATOM 320 CA SER A2079 29.508 -14.385 -20.666 1.00 0.00 C ATOM 321 C SER A2079 30.635 -13.383 -20.955 1.00 0.00 C ATOM 322 O SER A2079 31.737 -13.746 -21.381 1.00 0.00 O ATOM 323 CB SER A2079 29.673 -14.931 -19.243 1.00 0.00 C ATOM 324 OG SER A2079 29.506 -13.889 -18.293 1.00 0.00 O ATOM 0 H SER A2079 29.734 -16.389 -21.219 1.00 0.00 H new ATOM 0 HA SER A2079 28.576 -13.831 -20.778 1.00 0.00 H new ATOM 0 HB2 SER A2079 28.942 -15.719 -19.061 1.00 0.00 H new ATOM 0 HB3 SER A2079 30.660 -15.380 -19.131 1.00 0.00 H new ATOM 0 HG SER A2079 29.612 -14.251 -17.388 1.00 0.00 H new ATOM 330 N SER A2080 30.349 -12.114 -20.660 1.00 0.00 N ATOM 331 CA SER A2080 31.225 -10.937 -20.744 1.00 0.00 C ATOM 332 C SER A2080 30.520 -9.743 -20.078 1.00 0.00 C ATOM 333 O SER A2080 29.289 -9.774 -19.943 1.00 0.00 O ATOM 334 CB SER A2080 31.539 -10.589 -22.211 1.00 0.00 C ATOM 335 OG SER A2080 30.380 -10.148 -22.899 1.00 0.00 O ATOM 0 H SER A2080 29.419 -11.858 -20.327 1.00 0.00 H new ATOM 0 HA SER A2080 32.163 -11.159 -20.234 1.00 0.00 H new ATOM 0 HB2 SER A2080 32.302 -9.812 -22.246 1.00 0.00 H new ATOM 0 HB3 SER A2080 31.951 -11.464 -22.714 1.00 0.00 H new ATOM 0 HG SER A2080 30.612 -9.933 -23.827 1.00 0.00 H new ATOM 341 N PRO A2081 31.228 -8.665 -19.682 1.00 0.00 N ATOM 342 CA PRO A2081 30.583 -7.454 -19.159 1.00 0.00 C ATOM 343 C PRO A2081 29.532 -6.898 -20.137 1.00 0.00 C ATOM 344 O PRO A2081 28.491 -6.386 -19.725 1.00 0.00 O ATOM 345 CB PRO A2081 31.713 -6.443 -18.933 1.00 0.00 C ATOM 346 CG PRO A2081 32.965 -7.309 -18.818 1.00 0.00 C ATOM 347 CD PRO A2081 32.671 -8.490 -19.738 1.00 0.00 C ATOM 0 HA PRO A2081 30.043 -7.668 -18.236 1.00 0.00 H new ATOM 0 HB2 PRO A2081 31.790 -5.738 -19.761 1.00 0.00 H new ATOM 0 HB3 PRO A2081 31.549 -5.856 -18.029 1.00 0.00 H new ATOM 0 HG2 PRO A2081 33.857 -6.768 -19.133 1.00 0.00 H new ATOM 0 HG3 PRO A2081 33.135 -7.633 -17.791 1.00 0.00 H new ATOM 0 HD2 PRO A2081 33.004 -8.289 -20.756 1.00 0.00 H new ATOM 0 HD3 PRO A2081 33.190 -9.388 -19.404 1.00 0.00 H new ATOM 355 N GLN A2082 29.780 -7.048 -21.443 1.00 0.00 N ATOM 356 CA GLN A2082 28.870 -6.645 -22.521 1.00 0.00 C ATOM 357 C GLN A2082 27.594 -7.509 -22.525 1.00 0.00 C ATOM 358 O GLN A2082 26.490 -6.974 -22.649 1.00 0.00 O ATOM 359 CB GLN A2082 29.595 -6.728 -23.878 1.00 0.00 C ATOM 360 CG GLN A2082 30.674 -5.647 -24.083 1.00 0.00 C ATOM 361 CD GLN A2082 31.897 -5.785 -23.172 1.00 0.00 C ATOM 362 OE1 GLN A2082 32.390 -6.869 -22.893 1.00 0.00 O ATOM 363 NE2 GLN A2082 32.424 -4.698 -22.648 1.00 0.00 N ATOM 0 H GLN A2082 30.644 -7.465 -21.789 1.00 0.00 H new ATOM 0 HA GLN A2082 28.565 -5.613 -22.349 1.00 0.00 H new ATOM 0 HB2 GLN A2082 30.058 -7.710 -23.971 1.00 0.00 H new ATOM 0 HB3 GLN A2082 28.858 -6.646 -24.677 1.00 0.00 H new ATOM 0 HG2 GLN A2082 31.006 -5.676 -25.121 1.00 0.00 H new ATOM 0 HG3 GLN A2082 30.224 -4.668 -23.919 1.00 0.00 H new ATOM 0 HE21 GLN A2082 32.029 -3.783 -22.867 1.00 0.00 H new ATOM 0 HE22 GLN A2082 33.227 -4.771 -22.023 1.00 0.00 H new ATOM 372 N GLN A2083 27.721 -8.830 -22.334 1.00 0.00 N ATOM 373 CA GLN A2083 26.579 -9.749 -22.235 1.00 0.00 C ATOM 374 C GLN A2083 25.735 -9.430 -20.987 1.00 0.00 C ATOM 375 O GLN A2083 24.506 -9.371 -21.054 1.00 0.00 O ATOM 376 CB GLN A2083 27.082 -11.206 -22.187 1.00 0.00 C ATOM 377 CG GLN A2083 26.036 -12.204 -22.703 1.00 0.00 C ATOM 378 CD GLN A2083 25.930 -12.142 -24.225 1.00 0.00 C ATOM 379 OE1 GLN A2083 25.019 -11.558 -24.798 1.00 0.00 O ATOM 380 NE2 GLN A2083 26.873 -12.720 -24.938 1.00 0.00 N ATOM 0 H GLN A2083 28.625 -9.293 -22.243 1.00 0.00 H new ATOM 0 HA GLN A2083 25.948 -9.622 -23.115 1.00 0.00 H new ATOM 0 HB2 GLN A2083 27.990 -11.294 -22.784 1.00 0.00 H new ATOM 0 HB3 GLN A2083 27.349 -11.462 -21.162 1.00 0.00 H new ATOM 0 HG2 GLN A2083 26.307 -13.214 -22.394 1.00 0.00 H new ATOM 0 HG3 GLN A2083 25.066 -11.984 -22.257 1.00 0.00 H new ATOM 0 HE21 GLN A2083 27.637 -13.209 -24.472 1.00 0.00 H new ATOM 0 HE22 GLN A2083 26.840 -12.679 -25.957 1.00 0.00 H new ATOM 389 N GLN A2084 26.403 -9.174 -19.856 1.00 0.00 N ATOM 390 CA GLN A2084 25.763 -8.790 -18.594 1.00 0.00 C ATOM 391 C GLN A2084 24.996 -7.472 -18.734 1.00 0.00 C ATOM 392 O GLN A2084 23.883 -7.365 -18.221 1.00 0.00 O ATOM 393 CB GLN A2084 26.814 -8.638 -17.486 1.00 0.00 C ATOM 394 CG GLN A2084 27.450 -9.963 -17.049 1.00 0.00 C ATOM 395 CD GLN A2084 28.643 -9.716 -16.129 1.00 0.00 C ATOM 396 OE1 GLN A2084 28.609 -8.910 -15.208 1.00 0.00 O ATOM 397 NE2 GLN A2084 29.749 -10.393 -16.335 1.00 0.00 N ATOM 0 H GLN A2084 27.419 -9.229 -19.792 1.00 0.00 H new ATOM 0 HA GLN A2084 25.060 -9.581 -18.333 1.00 0.00 H new ATOM 0 HB2 GLN A2084 27.599 -7.966 -17.833 1.00 0.00 H new ATOM 0 HB3 GLN A2084 26.350 -8.166 -16.620 1.00 0.00 H new ATOM 0 HG2 GLN A2084 26.709 -10.575 -16.534 1.00 0.00 H new ATOM 0 HG3 GLN A2084 27.772 -10.524 -17.927 1.00 0.00 H new ATOM 0 HE21 GLN A2084 29.799 -11.069 -17.097 1.00 0.00 H new ATOM 0 HE22 GLN A2084 30.559 -10.243 -15.733 1.00 0.00 H new ATOM 406 N GLN A2085 25.556 -6.474 -19.432 1.00 0.00 N ATOM 407 CA GLN A2085 24.905 -5.176 -19.627 1.00 0.00 C ATOM 408 C GLN A2085 23.515 -5.309 -20.263 1.00 0.00 C ATOM 409 O GLN A2085 22.605 -4.601 -19.842 1.00 0.00 O ATOM 410 CB GLN A2085 25.811 -4.217 -20.419 1.00 0.00 C ATOM 411 CG GLN A2085 25.291 -2.767 -20.404 1.00 0.00 C ATOM 412 CD GLN A2085 25.226 -2.170 -18.994 1.00 0.00 C ATOM 413 OE1 GLN A2085 26.222 -2.058 -18.291 1.00 0.00 O ATOM 414 NE2 GLN A2085 24.066 -1.773 -18.518 1.00 0.00 N ATOM 0 H GLN A2085 26.472 -6.546 -19.876 1.00 0.00 H new ATOM 0 HA GLN A2085 24.747 -4.743 -18.639 1.00 0.00 H new ATOM 0 HB2 GLN A2085 26.817 -4.243 -20.000 1.00 0.00 H new ATOM 0 HB3 GLN A2085 25.886 -4.562 -21.450 1.00 0.00 H new ATOM 0 HG2 GLN A2085 25.938 -2.148 -21.025 1.00 0.00 H new ATOM 0 HG3 GLN A2085 24.297 -2.738 -20.851 1.00 0.00 H new ATOM 0 HE21 GLN A2085 23.225 -1.858 -19.088 1.00 0.00 H new ATOM 0 HE22 GLN A2085 24.008 -1.380 -17.579 1.00 0.00 H new ATOM 423 N GLN A2086 23.306 -6.230 -21.213 1.00 0.00 N ATOM 424 CA GLN A2086 21.966 -6.450 -21.771 1.00 0.00 C ATOM 425 C GLN A2086 20.993 -6.982 -20.713 1.00 0.00 C ATOM 426 O GLN A2086 19.880 -6.469 -20.611 1.00 0.00 O ATOM 427 CB GLN A2086 21.999 -7.377 -22.999 1.00 0.00 C ATOM 428 CG GLN A2086 22.064 -6.599 -24.320 1.00 0.00 C ATOM 429 CD GLN A2086 20.851 -5.684 -24.518 1.00 0.00 C ATOM 430 OE1 GLN A2086 20.908 -4.473 -24.330 1.00 0.00 O ATOM 431 NE2 GLN A2086 19.700 -6.224 -24.863 1.00 0.00 N ATOM 0 H GLN A2086 24.035 -6.826 -21.606 1.00 0.00 H new ATOM 0 HA GLN A2086 21.602 -5.477 -22.102 1.00 0.00 H new ATOM 0 HB2 GLN A2086 22.862 -8.039 -22.928 1.00 0.00 H new ATOM 0 HB3 GLN A2086 21.111 -8.010 -22.997 1.00 0.00 H new ATOM 0 HG2 GLN A2086 22.975 -6.001 -24.342 1.00 0.00 H new ATOM 0 HG3 GLN A2086 22.125 -7.302 -25.150 1.00 0.00 H new ATOM 0 HE21 GLN A2086 19.636 -7.229 -25.023 1.00 0.00 H new ATOM 0 HE22 GLN A2086 18.873 -5.637 -24.970 1.00 0.00 H new ATOM 440 N VAL A2087 21.399 -7.944 -19.877 1.00 0.00 N ATOM 441 CA VAL A2087 20.543 -8.445 -18.783 1.00 0.00 C ATOM 442 C VAL A2087 20.236 -7.321 -17.790 1.00 0.00 C ATOM 443 O VAL A2087 19.083 -7.137 -17.406 1.00 0.00 O ATOM 444 CB VAL A2087 21.150 -9.671 -18.074 1.00 0.00 C ATOM 445 CG1 VAL A2087 20.188 -10.206 -17.006 1.00 0.00 C ATOM 446 CG2 VAL A2087 21.425 -10.792 -19.086 1.00 0.00 C ATOM 0 H VAL A2087 22.313 -8.394 -19.933 1.00 0.00 H new ATOM 0 HA VAL A2087 19.607 -8.781 -19.229 1.00 0.00 H new ATOM 0 HB VAL A2087 22.083 -9.357 -17.605 1.00 0.00 H new ATOM 0 HG11 VAL A2087 20.633 -11.072 -16.516 1.00 0.00 H new ATOM 0 HG12 VAL A2087 19.997 -9.429 -16.266 1.00 0.00 H new ATOM 0 HG13 VAL A2087 19.249 -10.498 -17.476 1.00 0.00 H new ATOM 0 HG21 VAL A2087 21.854 -11.651 -18.570 1.00 0.00 H new ATOM 0 HG22 VAL A2087 20.492 -11.086 -19.566 1.00 0.00 H new ATOM 0 HG23 VAL A2087 22.125 -10.436 -19.842 1.00 0.00 H new ATOM 456 N LEU A2088 21.237 -6.515 -17.424 1.00 0.00 N ATOM 457 CA LEU A2088 21.068 -5.351 -16.547 1.00 0.00 C ATOM 458 C LEU A2088 20.094 -4.328 -17.170 1.00 0.00 C ATOM 459 O LEU A2088 19.226 -3.818 -16.464 1.00 0.00 O ATOM 460 CB LEU A2088 22.453 -4.749 -16.230 1.00 0.00 C ATOM 461 CG LEU A2088 23.357 -5.674 -15.381 1.00 0.00 C ATOM 462 CD1 LEU A2088 24.801 -5.168 -15.372 1.00 0.00 C ATOM 463 CD2 LEU A2088 22.879 -5.773 -13.932 1.00 0.00 C ATOM 0 H LEU A2088 22.200 -6.654 -17.732 1.00 0.00 H new ATOM 0 HA LEU A2088 20.616 -5.658 -15.604 1.00 0.00 H new ATOM 0 HB2 LEU A2088 22.962 -4.519 -17.166 1.00 0.00 H new ATOM 0 HB3 LEU A2088 22.316 -3.806 -15.702 1.00 0.00 H new ATOM 0 HG LEU A2088 23.304 -6.660 -15.843 1.00 0.00 H new ATOM 0 HD11 LEU A2088 25.417 -5.835 -14.769 1.00 0.00 H new ATOM 0 HD12 LEU A2088 25.184 -5.144 -16.392 1.00 0.00 H new ATOM 0 HD13 LEU A2088 24.832 -4.164 -14.949 1.00 0.00 H new ATOM 0 HD21 LEU A2088 23.544 -6.433 -13.374 1.00 0.00 H new ATOM 0 HD22 LEU A2088 22.886 -4.782 -13.478 1.00 0.00 H new ATOM 0 HD23 LEU A2088 21.866 -6.175 -13.910 1.00 0.00 H new ATOM 475 N ASN A2089 20.170 -4.070 -18.482 1.00 0.00 N ATOM 476 CA ASN A2089 19.239 -3.183 -19.197 1.00 0.00 C ATOM 477 C ASN A2089 17.798 -3.739 -19.157 1.00 0.00 C ATOM 478 O ASN A2089 16.857 -3.001 -18.859 1.00 0.00 O ATOM 479 CB ASN A2089 19.693 -2.992 -20.662 1.00 0.00 C ATOM 480 CG ASN A2089 20.996 -2.229 -20.857 1.00 0.00 C ATOM 481 OD1 ASN A2089 21.542 -1.595 -19.964 1.00 0.00 O ATOM 482 ND2 ASN A2089 21.539 -2.261 -22.054 1.00 0.00 N ATOM 0 H ASN A2089 20.887 -4.475 -19.085 1.00 0.00 H new ATOM 0 HA ASN A2089 19.246 -2.216 -18.694 1.00 0.00 H new ATOM 0 HB2 ASN A2089 19.797 -3.975 -21.122 1.00 0.00 H new ATOM 0 HB3 ASN A2089 18.903 -2.470 -21.202 1.00 0.00 H new ATOM 0 HD21 ASN A2089 22.409 -1.760 -22.233 1.00 0.00 H new ATOM 0 HD22 ASN A2089 21.090 -2.787 -22.804 1.00 0.00 H new ATOM 489 N ILE A2090 17.624 -5.042 -19.424 1.00 0.00 N ATOM 490 CA ILE A2090 16.329 -5.749 -19.393 1.00 0.00 C ATOM 491 C ILE A2090 15.704 -5.665 -17.989 1.00 0.00 C ATOM 492 O ILE A2090 14.520 -5.340 -17.851 1.00 0.00 O ATOM 493 CB ILE A2090 16.520 -7.218 -19.866 1.00 0.00 C ATOM 494 CG1 ILE A2090 16.882 -7.288 -21.371 1.00 0.00 C ATOM 495 CG2 ILE A2090 15.263 -8.073 -19.613 1.00 0.00 C ATOM 496 CD1 ILE A2090 17.552 -8.610 -21.788 1.00 0.00 C ATOM 0 H ILE A2090 18.401 -5.653 -19.675 1.00 0.00 H new ATOM 0 HA ILE A2090 15.633 -5.268 -20.080 1.00 0.00 H new ATOM 0 HB ILE A2090 17.344 -7.621 -19.278 1.00 0.00 H new ATOM 0 HG12 ILE A2090 15.975 -7.149 -21.960 1.00 0.00 H new ATOM 0 HG13 ILE A2090 17.549 -6.461 -21.614 1.00 0.00 H new ATOM 0 HG21 ILE A2090 15.440 -9.092 -19.958 1.00 0.00 H new ATOM 0 HG22 ILE A2090 15.040 -8.085 -18.546 1.00 0.00 H new ATOM 0 HG23 ILE A2090 14.419 -7.648 -20.155 1.00 0.00 H new ATOM 0 HD11 ILE A2090 17.775 -8.584 -22.855 1.00 0.00 H new ATOM 0 HD12 ILE A2090 18.477 -8.742 -21.227 1.00 0.00 H new ATOM 0 HD13 ILE A2090 16.879 -9.441 -21.579 1.00 0.00 H new ATOM 508 N LEU A2091 16.496 -5.912 -16.939 1.00 0.00 N ATOM 509 CA LEU A2091 16.055 -5.832 -15.543 1.00 0.00 C ATOM 510 C LEU A2091 15.732 -4.386 -15.125 1.00 0.00 C ATOM 511 O LEU A2091 14.682 -4.159 -14.528 1.00 0.00 O ATOM 512 CB LEU A2091 17.106 -6.478 -14.621 1.00 0.00 C ATOM 513 CG LEU A2091 17.260 -8.006 -14.770 1.00 0.00 C ATOM 514 CD1 LEU A2091 18.387 -8.488 -13.853 1.00 0.00 C ATOM 515 CD2 LEU A2091 15.988 -8.776 -14.407 1.00 0.00 C ATOM 0 H LEU A2091 17.476 -6.177 -17.038 1.00 0.00 H new ATOM 0 HA LEU A2091 15.125 -6.392 -15.444 1.00 0.00 H new ATOM 0 HB2 LEU A2091 18.072 -6.011 -14.814 1.00 0.00 H new ATOM 0 HB3 LEU A2091 16.845 -6.254 -13.587 1.00 0.00 H new ATOM 0 HG LEU A2091 17.479 -8.200 -15.820 1.00 0.00 H new ATOM 0 HD11 LEU A2091 18.501 -9.567 -13.953 1.00 0.00 H new ATOM 0 HD12 LEU A2091 19.319 -7.997 -14.133 1.00 0.00 H new ATOM 0 HD13 LEU A2091 18.144 -8.243 -12.819 1.00 0.00 H new ATOM 0 HD21 LEU A2091 16.161 -9.845 -14.533 1.00 0.00 H new ATOM 0 HD22 LEU A2091 15.722 -8.571 -13.370 1.00 0.00 H new ATOM 0 HD23 LEU A2091 15.174 -8.461 -15.060 1.00 0.00 H new ATOM 527 N LYS A2092 16.552 -3.385 -15.487 1.00 0.00 N ATOM 528 CA LYS A2092 16.262 -1.958 -15.212 1.00 0.00 C ATOM 529 C LYS A2092 15.029 -1.430 -15.962 1.00 0.00 C ATOM 530 O LYS A2092 14.469 -0.409 -15.564 1.00 0.00 O ATOM 531 CB LYS A2092 17.491 -1.075 -15.474 1.00 0.00 C ATOM 532 CG LYS A2092 18.529 -1.225 -14.347 1.00 0.00 C ATOM 533 CD LYS A2092 19.595 -0.118 -14.352 1.00 0.00 C ATOM 534 CE LYS A2092 18.990 1.234 -13.938 1.00 0.00 C ATOM 535 NZ LYS A2092 20.030 2.287 -13.797 1.00 0.00 N ATOM 0 H LYS A2092 17.433 -3.536 -15.977 1.00 0.00 H new ATOM 0 HA LYS A2092 16.019 -1.902 -14.151 1.00 0.00 H new ATOM 0 HB2 LYS A2092 17.943 -1.348 -16.428 1.00 0.00 H new ATOM 0 HB3 LYS A2092 17.184 -0.032 -15.554 1.00 0.00 H new ATOM 0 HG2 LYS A2092 18.015 -1.221 -13.386 1.00 0.00 H new ATOM 0 HG3 LYS A2092 19.020 -2.193 -14.441 1.00 0.00 H new ATOM 0 HD2 LYS A2092 20.402 -0.383 -13.669 1.00 0.00 H new ATOM 0 HD3 LYS A2092 20.033 -0.035 -15.347 1.00 0.00 H new ATOM 0 HE2 LYS A2092 18.256 1.546 -14.681 1.00 0.00 H new ATOM 0 HE3 LYS A2092 18.459 1.120 -12.993 1.00 0.00 H new ATOM 0 HZ1 LYS A2092 19.582 3.183 -13.517 1.00 0.00 H new ATOM 0 HZ2 LYS A2092 20.717 2.002 -13.070 1.00 0.00 H new ATOM 0 HZ3 LYS A2092 20.520 2.414 -14.705 1.00 0.00 H new ATOM 549 N SER A2093 14.571 -2.138 -16.996 1.00 0.00 N ATOM 550 CA SER A2093 13.323 -1.850 -17.728 1.00 0.00 C ATOM 551 C SER A2093 12.100 -2.531 -17.076 1.00 0.00 C ATOM 552 O SER A2093 10.959 -2.250 -17.445 1.00 0.00 O ATOM 553 CB SER A2093 13.440 -2.293 -19.193 1.00 0.00 C ATOM 554 OG SER A2093 14.517 -1.631 -19.837 1.00 0.00 O ATOM 0 H SER A2093 15.067 -2.951 -17.362 1.00 0.00 H new ATOM 0 HA SER A2093 13.171 -0.771 -17.686 1.00 0.00 H new ATOM 0 HB2 SER A2093 13.590 -3.372 -19.240 1.00 0.00 H new ATOM 0 HB3 SER A2093 12.509 -2.078 -19.718 1.00 0.00 H new ATOM 0 HG SER A2093 15.364 -2.036 -19.557 1.00 0.00 H new ATOM 560 N ASN A2094 12.328 -3.407 -16.086 1.00 0.00 N ATOM 561 CA ASN A2094 11.343 -4.164 -15.299 1.00 0.00 C ATOM 562 C ASN A2094 11.788 -4.207 -13.807 1.00 0.00 C ATOM 563 O ASN A2094 11.945 -5.297 -13.243 1.00 0.00 O ATOM 564 CB ASN A2094 11.215 -5.578 -15.910 1.00 0.00 C ATOM 565 CG ASN A2094 10.718 -5.587 -17.346 1.00 0.00 C ATOM 566 OD1 ASN A2094 9.526 -5.648 -17.613 1.00 0.00 O ATOM 567 ND2 ASN A2094 11.612 -5.547 -18.311 1.00 0.00 N ATOM 0 H ASN A2094 13.281 -3.621 -15.792 1.00 0.00 H new ATOM 0 HA ASN A2094 10.365 -3.685 -15.330 1.00 0.00 H new ATOM 0 HB2 ASN A2094 12.187 -6.070 -15.869 1.00 0.00 H new ATOM 0 HB3 ASN A2094 10.534 -6.168 -15.297 1.00 0.00 H new ATOM 0 HD21 ASN A2094 11.312 -5.567 -19.286 1.00 0.00 H new ATOM 0 HD22 ASN A2094 12.605 -5.496 -18.084 1.00 0.00 H new ATOM 574 N PRO A2095 12.046 -3.053 -13.147 1.00 0.00 N ATOM 575 CA PRO A2095 12.622 -3.010 -11.795 1.00 0.00 C ATOM 576 C PRO A2095 11.805 -3.704 -10.698 1.00 0.00 C ATOM 577 O PRO A2095 12.365 -4.121 -9.684 1.00 0.00 O ATOM 578 CB PRO A2095 12.878 -1.532 -11.482 1.00 0.00 C ATOM 579 CG PRO A2095 11.994 -0.764 -12.458 1.00 0.00 C ATOM 580 CD PRO A2095 11.877 -1.699 -13.657 1.00 0.00 C ATOM 0 HA PRO A2095 13.541 -3.596 -11.795 1.00 0.00 H new ATOM 0 HB2 PRO A2095 12.622 -1.297 -10.449 1.00 0.00 H new ATOM 0 HB3 PRO A2095 13.929 -1.276 -11.616 1.00 0.00 H new ATOM 0 HG2 PRO A2095 11.018 -0.544 -12.026 1.00 0.00 H new ATOM 0 HG3 PRO A2095 12.441 0.190 -12.737 1.00 0.00 H new ATOM 0 HD2 PRO A2095 10.908 -1.586 -14.143 1.00 0.00 H new ATOM 0 HD3 PRO A2095 12.637 -1.469 -14.404 1.00 0.00 H new ATOM 588 N GLN A2096 10.495 -3.857 -10.913 1.00 0.00 N ATOM 589 CA GLN A2096 9.534 -4.493 -10.005 1.00 0.00 C ATOM 590 C GLN A2096 10.018 -5.861 -9.486 1.00 0.00 C ATOM 591 O GLN A2096 9.947 -6.136 -8.287 1.00 0.00 O ATOM 592 CB GLN A2096 8.191 -4.673 -10.745 1.00 0.00 C ATOM 593 CG GLN A2096 7.388 -3.394 -11.056 1.00 0.00 C ATOM 594 CD GLN A2096 8.121 -2.380 -11.927 1.00 0.00 C ATOM 595 OE1 GLN A2096 8.628 -1.375 -11.458 1.00 0.00 O ATOM 596 NE2 GLN A2096 8.216 -2.593 -13.219 1.00 0.00 N ATOM 0 H GLN A2096 10.053 -3.523 -11.769 1.00 0.00 H new ATOM 0 HA GLN A2096 9.421 -3.843 -9.138 1.00 0.00 H new ATOM 0 HB2 GLN A2096 8.389 -5.187 -11.686 1.00 0.00 H new ATOM 0 HB3 GLN A2096 7.561 -5.332 -10.148 1.00 0.00 H new ATOM 0 HG2 GLN A2096 6.459 -3.676 -11.552 1.00 0.00 H new ATOM 0 HG3 GLN A2096 7.114 -2.915 -10.116 1.00 0.00 H new ATOM 0 HE21 GLN A2096 7.799 -3.428 -13.630 1.00 0.00 H new ATOM 0 HE22 GLN A2096 8.707 -1.924 -13.811 1.00 0.00 H new ATOM 605 N LEU A2097 10.512 -6.718 -10.388 1.00 0.00 N ATOM 606 CA LEU A2097 10.973 -8.071 -10.054 1.00 0.00 C ATOM 607 C LEU A2097 12.419 -8.167 -9.528 1.00 0.00 C ATOM 608 O LEU A2097 12.692 -9.018 -8.680 1.00 0.00 O ATOM 609 CB LEU A2097 10.640 -9.040 -11.212 1.00 0.00 C ATOM 610 CG LEU A2097 11.001 -8.645 -12.663 1.00 0.00 C ATOM 611 CD1 LEU A2097 12.505 -8.618 -12.941 1.00 0.00 C ATOM 612 CD2 LEU A2097 10.382 -9.665 -13.619 1.00 0.00 C ATOM 0 H LEU A2097 10.604 -6.490 -11.378 1.00 0.00 H new ATOM 0 HA LEU A2097 10.410 -8.392 -9.178 1.00 0.00 H new ATOM 0 HB2 LEU A2097 11.136 -9.987 -10.998 1.00 0.00 H new ATOM 0 HB3 LEU A2097 9.567 -9.228 -11.182 1.00 0.00 H new ATOM 0 HG LEU A2097 10.616 -7.636 -12.809 1.00 0.00 H new ATOM 0 HD11 LEU A2097 12.678 -8.333 -13.979 1.00 0.00 H new ATOM 0 HD12 LEU A2097 12.984 -7.895 -12.281 1.00 0.00 H new ATOM 0 HD13 LEU A2097 12.926 -9.607 -12.762 1.00 0.00 H new ATOM 0 HD21 LEU A2097 10.629 -9.398 -14.646 1.00 0.00 H new ATOM 0 HD22 LEU A2097 10.776 -10.657 -13.397 1.00 0.00 H new ATOM 0 HD23 LEU A2097 9.299 -9.669 -13.496 1.00 0.00 H new ATOM 624 N MET A2098 13.339 -7.294 -9.958 1.00 0.00 N ATOM 625 CA MET A2098 14.732 -7.323 -9.479 1.00 0.00 C ATOM 626 C MET A2098 14.902 -6.684 -8.093 1.00 0.00 C ATOM 627 O MET A2098 15.674 -7.195 -7.281 1.00 0.00 O ATOM 628 CB MET A2098 15.707 -6.704 -10.498 1.00 0.00 C ATOM 629 CG MET A2098 15.341 -5.286 -10.953 1.00 0.00 C ATOM 630 SD MET A2098 16.706 -4.284 -11.604 1.00 0.00 S ATOM 631 CE MET A2098 17.613 -3.952 -10.069 1.00 0.00 C ATOM 0 H MET A2098 13.146 -6.558 -10.637 1.00 0.00 H new ATOM 0 HA MET A2098 14.986 -8.378 -9.373 1.00 0.00 H new ATOM 0 HB2 MET A2098 16.705 -6.685 -10.060 1.00 0.00 H new ATOM 0 HB3 MET A2098 15.756 -7.351 -11.374 1.00 0.00 H new ATOM 0 HG2 MET A2098 14.571 -5.359 -11.721 1.00 0.00 H new ATOM 0 HG3 MET A2098 14.899 -4.757 -10.109 1.00 0.00 H new ATOM 0 HE1 MET A2098 18.346 -3.165 -10.243 1.00 0.00 H new ATOM 0 HE2 MET A2098 16.915 -3.633 -9.295 1.00 0.00 H new ATOM 0 HE3 MET A2098 18.124 -4.859 -9.745 1.00 0.00 H new ATOM 641 N ALA A2099 14.178 -5.599 -7.789 1.00 0.00 N ATOM 642 CA ALA A2099 14.261 -4.933 -6.488 1.00 0.00 C ATOM 643 C ALA A2099 13.718 -5.812 -5.344 1.00 0.00 C ATOM 644 O ALA A2099 14.293 -5.833 -4.253 1.00 0.00 O ATOM 645 CB ALA A2099 13.542 -3.589 -6.564 1.00 0.00 C ATOM 0 H ALA A2099 13.522 -5.162 -8.436 1.00 0.00 H new ATOM 0 HA ALA A2099 15.311 -4.761 -6.254 1.00 0.00 H new ATOM 0 HB1 ALA A2099 13.601 -3.089 -5.597 1.00 0.00 H new ATOM 0 HB2 ALA A2099 14.014 -2.966 -7.324 1.00 0.00 H new ATOM 0 HB3 ALA A2099 12.496 -3.750 -6.826 1.00 0.00 H new ATOM 651 N ALA A2100 12.650 -6.577 -5.598 1.00 0.00 N ATOM 652 CA ALA A2100 12.101 -7.518 -4.619 1.00 0.00 C ATOM 653 C ALA A2100 13.101 -8.659 -4.329 1.00 0.00 C ATOM 654 O ALA A2100 13.260 -9.079 -3.181 1.00 0.00 O ATOM 655 CB ALA A2100 10.768 -8.053 -5.158 1.00 0.00 C ATOM 0 H ALA A2100 12.145 -6.561 -6.484 1.00 0.00 H new ATOM 0 HA ALA A2100 11.926 -7.011 -3.670 1.00 0.00 H new ATOM 0 HB1 ALA A2100 10.342 -8.757 -4.443 1.00 0.00 H new ATOM 0 HB2 ALA A2100 10.077 -7.224 -5.307 1.00 0.00 H new ATOM 0 HB3 ALA A2100 10.937 -8.560 -6.108 1.00 0.00 H new ATOM 661 N PHE A2101 13.799 -9.140 -5.367 1.00 0.00 N ATOM 662 CA PHE A2101 14.801 -10.204 -5.281 1.00 0.00 C ATOM 663 C PHE A2101 16.076 -9.787 -4.525 1.00 0.00 C ATOM 664 O PHE A2101 16.478 -10.492 -3.597 1.00 0.00 O ATOM 665 CB PHE A2101 15.126 -10.684 -6.703 1.00 0.00 C ATOM 666 CG PHE A2101 16.285 -11.660 -6.786 1.00 0.00 C ATOM 667 CD1 PHE A2101 16.100 -13.012 -6.438 1.00 0.00 C ATOM 668 CD2 PHE A2101 17.555 -11.210 -7.195 1.00 0.00 C ATOM 669 CE1 PHE A2101 17.180 -13.911 -6.503 1.00 0.00 C ATOM 670 CE2 PHE A2101 18.632 -12.111 -7.268 1.00 0.00 C ATOM 671 CZ PHE A2101 18.445 -13.459 -6.920 1.00 0.00 C ATOM 0 H PHE A2101 13.676 -8.787 -6.316 1.00 0.00 H new ATOM 0 HA PHE A2101 14.378 -11.019 -4.693 1.00 0.00 H new ATOM 0 HB2 PHE A2101 14.239 -11.156 -7.126 1.00 0.00 H new ATOM 0 HB3 PHE A2101 15.352 -9.817 -7.323 1.00 0.00 H new ATOM 0 HD1 PHE A2101 15.128 -13.359 -6.121 1.00 0.00 H new ATOM 0 HD2 PHE A2101 17.702 -10.172 -7.453 1.00 0.00 H new ATOM 0 HE1 PHE A2101 17.038 -14.947 -6.233 1.00 0.00 H new ATOM 0 HE2 PHE A2101 19.603 -11.767 -7.592 1.00 0.00 H new ATOM 0 HZ PHE A2101 19.274 -14.149 -6.973 1.00 0.00 H new ATOM 681 N ILE A2102 16.716 -8.658 -4.875 1.00 0.00 N ATOM 682 CA ILE A2102 17.960 -8.212 -4.210 1.00 0.00 C ATOM 683 C ILE A2102 17.798 -8.054 -2.693 1.00 0.00 C ATOM 684 O ILE A2102 18.695 -8.435 -1.940 1.00 0.00 O ATOM 685 CB ILE A2102 18.578 -6.965 -4.887 1.00 0.00 C ATOM 686 CG1 ILE A2102 20.025 -6.696 -4.395 1.00 0.00 C ATOM 687 CG2 ILE A2102 17.683 -5.716 -4.813 1.00 0.00 C ATOM 688 CD1 ILE A2102 20.213 -5.766 -3.182 1.00 0.00 C ATOM 0 H ILE A2102 16.394 -8.034 -5.615 1.00 0.00 H new ATOM 0 HA ILE A2102 18.684 -9.016 -4.345 1.00 0.00 H new ATOM 0 HB ILE A2102 18.642 -7.203 -5.949 1.00 0.00 H new ATOM 0 HG12 ILE A2102 20.480 -7.657 -4.153 1.00 0.00 H new ATOM 0 HG13 ILE A2102 20.589 -6.277 -5.228 1.00 0.00 H new ATOM 0 HG21 ILE A2102 18.181 -4.882 -5.308 1.00 0.00 H new ATOM 0 HG22 ILE A2102 16.734 -5.918 -5.310 1.00 0.00 H new ATOM 0 HG23 ILE A2102 17.499 -5.461 -3.769 1.00 0.00 H new ATOM 0 HD11 ILE A2102 21.275 -5.674 -2.956 1.00 0.00 H new ATOM 0 HD12 ILE A2102 19.804 -4.782 -3.411 1.00 0.00 H new ATOM 0 HD13 ILE A2102 19.693 -6.183 -2.320 1.00 0.00 H new ATOM 700 N LYS A2103 16.634 -7.574 -2.232 1.00 0.00 N ATOM 701 CA LYS A2103 16.293 -7.427 -0.806 1.00 0.00 C ATOM 702 C LYS A2103 16.428 -8.741 -0.010 1.00 0.00 C ATOM 703 O LYS A2103 16.678 -8.701 1.194 1.00 0.00 O ATOM 704 CB LYS A2103 14.886 -6.815 -0.710 1.00 0.00 C ATOM 705 CG LYS A2103 14.536 -6.344 0.712 1.00 0.00 C ATOM 706 CD LYS A2103 13.198 -5.593 0.775 1.00 0.00 C ATOM 707 CE LYS A2103 12.040 -6.480 0.306 1.00 0.00 C ATOM 708 NZ LYS A2103 10.723 -5.860 0.575 1.00 0.00 N ATOM 0 H LYS A2103 15.885 -7.270 -2.853 1.00 0.00 H new ATOM 0 HA LYS A2103 17.014 -6.758 -0.336 1.00 0.00 H new ATOM 0 HB2 LYS A2103 14.815 -5.970 -1.395 1.00 0.00 H new ATOM 0 HB3 LYS A2103 14.151 -7.552 -1.035 1.00 0.00 H new ATOM 0 HG2 LYS A2103 14.495 -7.207 1.376 1.00 0.00 H new ATOM 0 HG3 LYS A2103 15.330 -5.695 1.081 1.00 0.00 H new ATOM 0 HD2 LYS A2103 13.013 -5.260 1.796 1.00 0.00 H new ATOM 0 HD3 LYS A2103 13.250 -4.700 0.153 1.00 0.00 H new ATOM 0 HE2 LYS A2103 12.139 -6.671 -0.763 1.00 0.00 H new ATOM 0 HE3 LYS A2103 12.096 -7.445 0.809 1.00 0.00 H new ATOM 0 HZ1 LYS A2103 9.967 -6.492 0.243 1.00 0.00 H new ATOM 0 HZ2 LYS A2103 10.617 -5.701 1.597 1.00 0.00 H new ATOM 0 HZ3 LYS A2103 10.659 -4.951 0.074 1.00 0.00 H new ATOM 722 N GLN A2104 16.318 -9.893 -0.680 1.00 0.00 N ATOM 723 CA GLN A2104 16.540 -11.227 -0.106 1.00 0.00 C ATOM 724 C GLN A2104 17.949 -11.747 -0.441 1.00 0.00 C ATOM 725 O GLN A2104 18.652 -12.224 0.449 1.00 0.00 O ATOM 726 CB GLN A2104 15.468 -12.213 -0.610 1.00 0.00 C ATOM 727 CG GLN A2104 14.009 -11.754 -0.426 1.00 0.00 C ATOM 728 CD GLN A2104 13.577 -11.508 1.022 1.00 0.00 C ATOM 729 OE1 GLN A2104 14.219 -11.897 1.991 1.00 0.00 O ATOM 730 NE2 GLN A2104 12.452 -10.857 1.229 1.00 0.00 N ATOM 0 H GLN A2104 16.064 -9.925 -1.667 1.00 0.00 H new ATOM 0 HA GLN A2104 16.460 -11.146 0.978 1.00 0.00 H new ATOM 0 HB2 GLN A2104 15.641 -12.401 -1.670 1.00 0.00 H new ATOM 0 HB3 GLN A2104 15.600 -13.163 -0.092 1.00 0.00 H new ATOM 0 HG2 GLN A2104 13.861 -10.835 -0.993 1.00 0.00 H new ATOM 0 HG3 GLN A2104 13.351 -12.507 -0.861 1.00 0.00 H new ATOM 0 HE21 GLN A2104 11.902 -10.524 0.437 1.00 0.00 H new ATOM 0 HE22 GLN A2104 12.130 -10.685 2.181 1.00 0.00 H new ATOM 739 N ARG A2105 18.398 -11.631 -1.704 1.00 0.00 N ATOM 740 CA ARG A2105 19.733 -12.078 -2.169 1.00 0.00 C ATOM 741 C ARG A2105 20.875 -11.444 -1.372 1.00 0.00 C ATOM 742 O ARG A2105 21.885 -12.099 -1.134 1.00 0.00 O ATOM 743 CB ARG A2105 19.867 -11.826 -3.684 1.00 0.00 C ATOM 744 CG ARG A2105 20.858 -12.742 -4.430 1.00 0.00 C ATOM 745 CD ARG A2105 22.334 -12.614 -4.018 1.00 0.00 C ATOM 746 NE ARG A2105 23.234 -12.862 -5.155 1.00 0.00 N ATOM 747 CZ ARG A2105 24.188 -13.756 -5.318 1.00 0.00 C ATOM 748 NH1 ARG A2105 24.481 -14.665 -4.432 1.00 0.00 N ATOM 749 NH2 ARG A2105 24.876 -13.760 -6.418 1.00 0.00 N ATOM 0 H ARG A2105 17.836 -11.217 -2.448 1.00 0.00 H new ATOM 0 HA ARG A2105 19.815 -13.150 -1.988 1.00 0.00 H new ATOM 0 HB2 ARG A2105 18.884 -11.938 -4.140 1.00 0.00 H new ATOM 0 HB3 ARG A2105 20.173 -10.791 -3.836 1.00 0.00 H new ATOM 0 HG2 ARG A2105 20.548 -13.776 -4.282 1.00 0.00 H new ATOM 0 HG3 ARG A2105 20.780 -12.536 -5.497 1.00 0.00 H new ATOM 0 HD2 ARG A2105 22.516 -11.616 -3.619 1.00 0.00 H new ATOM 0 HD3 ARG A2105 22.552 -13.322 -3.218 1.00 0.00 H new ATOM 0 HE ARG A2105 23.096 -12.238 -5.950 1.00 0.00 H new ATOM 0 HH11 ARG A2105 23.960 -14.710 -3.556 1.00 0.00 H new ATOM 0 HH12 ARG A2105 25.231 -15.332 -4.614 1.00 0.00 H new ATOM 0 HH21 ARG A2105 24.676 -13.075 -7.147 1.00 0.00 H new ATOM 0 HH22 ARG A2105 25.617 -14.448 -6.554 1.00 0.00 H new ATOM 763 N THR A2106 20.720 -10.204 -0.904 1.00 0.00 N ATOM 764 CA THR A2106 21.710 -9.502 -0.059 1.00 0.00 C ATOM 765 C THR A2106 22.142 -10.325 1.172 1.00 0.00 C ATOM 766 O THR A2106 23.299 -10.261 1.589 1.00 0.00 O ATOM 767 CB THR A2106 21.206 -8.098 0.320 1.00 0.00 C ATOM 768 OG1 THR A2106 22.237 -7.360 0.935 1.00 0.00 O ATOM 769 CG2 THR A2106 20.007 -8.110 1.265 1.00 0.00 C ATOM 0 H THR A2106 19.891 -9.643 -1.100 1.00 0.00 H new ATOM 0 HA THR A2106 22.614 -9.381 -0.656 1.00 0.00 H new ATOM 0 HB THR A2106 20.889 -7.639 -0.617 1.00 0.00 H new ATOM 0 HG1 THR A2106 21.905 -6.468 1.170 1.00 0.00 H new ATOM 0 HG21 THR A2106 19.708 -7.085 1.487 1.00 0.00 H new ATOM 0 HG22 THR A2106 19.177 -8.636 0.793 1.00 0.00 H new ATOM 0 HG23 THR A2106 20.278 -8.618 2.191 1.00 0.00 H new ATOM 777 N ALA A2107 21.256 -11.186 1.699 1.00 0.00 N ATOM 778 CA ALA A2107 21.538 -12.114 2.802 1.00 0.00 C ATOM 779 C ALA A2107 22.601 -13.193 2.459 1.00 0.00 C ATOM 780 O ALA A2107 23.177 -13.804 3.363 1.00 0.00 O ATOM 781 CB ALA A2107 20.206 -12.751 3.226 1.00 0.00 C ATOM 0 H ALA A2107 20.297 -11.256 1.358 1.00 0.00 H new ATOM 0 HA ALA A2107 21.980 -11.550 3.623 1.00 0.00 H new ATOM 0 HB1 ALA A2107 20.381 -13.448 4.046 1.00 0.00 H new ATOM 0 HB2 ALA A2107 19.518 -11.972 3.552 1.00 0.00 H new ATOM 0 HB3 ALA A2107 19.773 -13.286 2.381 1.00 0.00 H new ATOM 787 N LYS A2108 22.876 -13.415 1.162 1.00 0.00 N ATOM 788 CA LYS A2108 23.864 -14.362 0.605 1.00 0.00 C ATOM 789 C LYS A2108 24.944 -13.683 -0.258 1.00 0.00 C ATOM 790 O LYS A2108 25.961 -14.307 -0.553 1.00 0.00 O ATOM 791 CB LYS A2108 23.134 -15.480 -0.172 1.00 0.00 C ATOM 792 CG LYS A2108 22.356 -16.466 0.718 1.00 0.00 C ATOM 793 CD LYS A2108 23.278 -17.357 1.573 1.00 0.00 C ATOM 794 CE LYS A2108 22.508 -18.355 2.450 1.00 0.00 C ATOM 795 NZ LYS A2108 21.844 -19.425 1.657 1.00 0.00 N ATOM 0 H LYS A2108 22.385 -12.907 0.426 1.00 0.00 H new ATOM 0 HA LYS A2108 24.403 -14.800 1.445 1.00 0.00 H new ATOM 0 HB2 LYS A2108 22.442 -15.023 -0.879 1.00 0.00 H new ATOM 0 HB3 LYS A2108 23.866 -16.037 -0.757 1.00 0.00 H new ATOM 0 HG2 LYS A2108 21.689 -15.907 1.374 1.00 0.00 H new ATOM 0 HG3 LYS A2108 21.729 -17.098 0.089 1.00 0.00 H new ATOM 0 HD2 LYS A2108 23.954 -17.905 0.917 1.00 0.00 H new ATOM 0 HD3 LYS A2108 23.896 -16.724 2.210 1.00 0.00 H new ATOM 0 HE2 LYS A2108 23.195 -18.811 3.163 1.00 0.00 H new ATOM 0 HE3 LYS A2108 21.756 -17.819 3.029 1.00 0.00 H new ATOM 0 HZ1 LYS A2108 21.339 -20.070 2.298 1.00 0.00 H new ATOM 0 HZ2 LYS A2108 21.167 -18.996 0.994 1.00 0.00 H new ATOM 0 HZ3 LYS A2108 22.561 -19.958 1.124 1.00 0.00 H new ATOM 1019 N THR B 18 10.301 -22.964 -12.405 1.00 0.00 N ATOM 1020 CA THR B 18 11.531 -22.334 -12.929 1.00 0.00 C ATOM 1021 C THR B 18 11.647 -20.873 -12.464 1.00 0.00 C ATOM 1022 O THR B 18 10.858 -20.421 -11.632 1.00 0.00 O ATOM 1023 CB THR B 18 11.569 -22.416 -14.470 1.00 0.00 C ATOM 1024 OG1 THR B 18 10.560 -21.607 -15.039 1.00 0.00 O ATOM 1025 CG2 THR B 18 11.415 -23.835 -15.020 1.00 0.00 C ATOM 0 HA THR B 18 12.385 -22.883 -12.531 1.00 0.00 H new ATOM 0 HB THR B 18 12.561 -22.059 -14.749 1.00 0.00 H new ATOM 0 HG1 THR B 18 9.743 -21.676 -14.501 1.00 0.00 H new ATOM 0 HG21 THR B 18 11.452 -23.809 -16.109 1.00 0.00 H new ATOM 0 HG22 THR B 18 12.225 -24.461 -14.644 1.00 0.00 H new ATOM 0 HG23 THR B 18 10.459 -24.248 -14.699 1.00 0.00 H new ATOM 1033 N PHE B 19 12.613 -20.110 -12.990 1.00 0.00 N ATOM 1034 CA PHE B 19 12.846 -18.691 -12.669 1.00 0.00 C ATOM 1035 C PHE B 19 11.573 -17.817 -12.647 1.00 0.00 C ATOM 1036 O PHE B 19 11.451 -16.937 -11.795 1.00 0.00 O ATOM 1037 CB PHE B 19 13.908 -18.113 -13.622 1.00 0.00 C ATOM 1038 CG PHE B 19 13.437 -17.746 -15.019 1.00 0.00 C ATOM 1039 CD1 PHE B 19 12.872 -18.710 -15.879 1.00 0.00 C ATOM 1040 CD2 PHE B 19 13.587 -16.420 -15.469 1.00 0.00 C ATOM 1041 CE1 PHE B 19 12.432 -18.345 -17.162 1.00 0.00 C ATOM 1042 CE2 PHE B 19 13.176 -16.063 -16.763 1.00 0.00 C ATOM 1043 CZ PHE B 19 12.584 -17.021 -17.604 1.00 0.00 C ATOM 0 H PHE B 19 13.277 -20.473 -13.674 1.00 0.00 H new ATOM 0 HA PHE B 19 13.211 -18.664 -11.642 1.00 0.00 H new ATOM 0 HB2 PHE B 19 14.332 -17.222 -13.160 1.00 0.00 H new ATOM 0 HB3 PHE B 19 14.715 -18.839 -13.714 1.00 0.00 H new ATOM 0 HD1 PHE B 19 12.777 -19.734 -15.550 1.00 0.00 H new ATOM 0 HD2 PHE B 19 14.019 -15.676 -14.817 1.00 0.00 H new ATOM 0 HE1 PHE B 19 11.977 -19.082 -17.808 1.00 0.00 H new ATOM 0 HE2 PHE B 19 13.315 -15.051 -17.113 1.00 0.00 H new ATOM 0 HZ PHE B 19 12.246 -16.739 -18.590 1.00 0.00 H new ATOM 1053 N SER B 20 10.602 -18.088 -13.532 1.00 0.00 N ATOM 1054 CA SER B 20 9.314 -17.379 -13.593 1.00 0.00 C ATOM 1055 C SER B 20 8.474 -17.534 -12.314 1.00 0.00 C ATOM 1056 O SER B 20 7.728 -16.625 -11.943 1.00 0.00 O ATOM 1057 CB SER B 20 8.529 -17.855 -14.820 1.00 0.00 C ATOM 1058 OG SER B 20 7.297 -17.160 -14.947 1.00 0.00 O ATOM 0 H SER B 20 10.691 -18.819 -14.238 1.00 0.00 H new ATOM 0 HA SER B 20 9.532 -16.315 -13.679 1.00 0.00 H new ATOM 0 HB2 SER B 20 9.128 -17.704 -15.718 1.00 0.00 H new ATOM 0 HB3 SER B 20 8.338 -18.925 -14.740 1.00 0.00 H new ATOM 0 HG SER B 20 6.819 -17.484 -15.739 1.00 0.00 H new ATOM 1064 N ASP B 21 8.602 -18.653 -11.598 1.00 0.00 N ATOM 1065 CA ASP B 21 7.913 -18.897 -10.323 1.00 0.00 C ATOM 1066 C ASP B 21 8.657 -18.274 -9.132 1.00 0.00 C ATOM 1067 O ASP B 21 8.039 -17.907 -8.134 1.00 0.00 O ATOM 1068 CB ASP B 21 7.733 -20.405 -10.124 1.00 0.00 C ATOM 1069 CG ASP B 21 6.923 -20.725 -8.854 1.00 0.00 C ATOM 1070 OD1 ASP B 21 5.716 -20.388 -8.811 1.00 0.00 O ATOM 1071 OD2 ASP B 21 7.494 -21.319 -7.907 1.00 0.00 O ATOM 0 H ASP B 21 9.196 -19.429 -11.890 1.00 0.00 H new ATOM 0 HA ASP B 21 6.937 -18.414 -10.367 1.00 0.00 H new ATOM 0 HB2 ASP B 21 7.228 -20.828 -10.993 1.00 0.00 H new ATOM 0 HB3 ASP B 21 8.711 -20.882 -10.060 1.00 0.00 H new ATOM 1076 N LEU B 22 9.975 -18.083 -9.244 1.00 0.00 N ATOM 1077 CA LEU B 22 10.773 -17.441 -8.190 1.00 0.00 C ATOM 1078 C LEU B 22 10.380 -15.965 -8.007 1.00 0.00 C ATOM 1079 O LEU B 22 10.439 -15.457 -6.885 1.00 0.00 O ATOM 1080 CB LEU B 22 12.281 -17.645 -8.426 1.00 0.00 C ATOM 1081 CG LEU B 22 12.723 -19.118 -8.592 1.00 0.00 C ATOM 1082 CD1 LEU B 22 14.247 -19.202 -8.628 1.00 0.00 C ATOM 1083 CD2 LEU B 22 12.244 -20.044 -7.472 1.00 0.00 C ATOM 0 H LEU B 22 10.517 -18.366 -10.060 1.00 0.00 H new ATOM 0 HA LEU B 22 10.545 -17.932 -7.244 1.00 0.00 H new ATOM 0 HB2 LEU B 22 12.572 -17.091 -9.319 1.00 0.00 H new ATOM 0 HB3 LEU B 22 12.827 -17.210 -7.589 1.00 0.00 H new ATOM 0 HG LEU B 22 12.267 -19.452 -9.524 1.00 0.00 H new ATOM 0 HD11 LEU B 22 14.551 -20.242 -8.745 1.00 0.00 H new ATOM 0 HD12 LEU B 22 14.624 -18.617 -9.467 1.00 0.00 H new ATOM 0 HD13 LEU B 22 14.655 -18.807 -7.698 1.00 0.00 H new ATOM 0 HD21 LEU B 22 12.596 -21.058 -7.663 1.00 0.00 H new ATOM 0 HD22 LEU B 22 12.640 -19.696 -6.518 1.00 0.00 H new ATOM 0 HD23 LEU B 22 11.155 -20.038 -7.436 1.00 0.00 H new ATOM 1095 N TRP B 23 9.890 -15.295 -9.061 1.00 0.00 N ATOM 1096 CA TRP B 23 9.327 -13.944 -8.936 1.00 0.00 C ATOM 1097 C TRP B 23 8.023 -13.982 -8.115 1.00 0.00 C ATOM 1098 O TRP B 23 7.788 -13.122 -7.265 1.00 0.00 O ATOM 1099 CB TRP B 23 9.027 -13.339 -10.314 1.00 0.00 C ATOM 1100 CG TRP B 23 10.093 -13.415 -11.364 1.00 0.00 C ATOM 1101 CD1 TRP B 23 9.884 -13.908 -12.602 1.00 0.00 C ATOM 1102 CD2 TRP B 23 11.488 -12.967 -11.345 1.00 0.00 C ATOM 1103 NE1 TRP B 23 11.037 -13.808 -13.354 1.00 0.00 N ATOM 1104 CE2 TRP B 23 12.053 -13.217 -12.636 1.00 0.00 C ATOM 1105 CE3 TRP B 23 12.331 -12.358 -10.387 1.00 0.00 C ATOM 1106 CZ2 TRP B 23 13.370 -12.865 -12.965 1.00 0.00 C ATOM 1107 CZ3 TRP B 23 13.656 -12.001 -10.708 1.00 0.00 C ATOM 1108 CH2 TRP B 23 14.173 -12.247 -11.994 1.00 0.00 C ATOM 0 H TRP B 23 9.873 -15.668 -10.010 1.00 0.00 H new ATOM 0 HA TRP B 23 10.067 -13.325 -8.429 1.00 0.00 H new ATOM 0 HB2 TRP B 23 8.136 -13.829 -10.707 1.00 0.00 H new ATOM 0 HB3 TRP B 23 8.775 -12.288 -10.170 1.00 0.00 H new ATOM 0 HD1 TRP B 23 8.950 -14.321 -12.954 1.00 0.00 H new ATOM 0 HE1 TRP B 23 11.125 -14.130 -14.318 1.00 0.00 H new ATOM 0 HE3 TRP B 23 11.954 -12.163 -9.394 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 13.761 -13.067 -13.951 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 14.280 -11.534 -9.961 1.00 0.00 H new ATOM 0 HH2 TRP B 23 15.186 -11.960 -12.233 1.00 0.00 H new ATOM 1119 N LYS B 24 7.178 -14.998 -8.361 1.00 0.00 N ATOM 1120 CA LYS B 24 5.873 -15.225 -7.706 1.00 0.00 C ATOM 1121 C LYS B 24 5.987 -15.587 -6.220 1.00 0.00 C ATOM 1122 O LYS B 24 5.085 -15.249 -5.453 1.00 0.00 O ATOM 1123 CB LYS B 24 5.061 -16.291 -8.468 1.00 0.00 C ATOM 1124 CG LYS B 24 4.842 -15.919 -9.943 1.00 0.00 C ATOM 1125 CD LYS B 24 3.969 -16.950 -10.674 1.00 0.00 C ATOM 1126 CE LYS B 24 3.867 -16.619 -12.170 1.00 0.00 C ATOM 1127 NZ LYS B 24 5.052 -17.096 -12.929 1.00 0.00 N ATOM 0 H LYS B 24 7.393 -15.717 -9.052 1.00 0.00 H new ATOM 0 HA LYS B 24 5.343 -14.273 -7.745 1.00 0.00 H new ATOM 0 HB2 LYS B 24 5.580 -17.248 -8.411 1.00 0.00 H new ATOM 0 HB3 LYS B 24 4.094 -16.423 -7.982 1.00 0.00 H new ATOM 0 HG2 LYS B 24 4.371 -14.938 -10.003 1.00 0.00 H new ATOM 0 HG3 LYS B 24 5.807 -15.841 -10.444 1.00 0.00 H new ATOM 0 HD2 LYS B 24 4.392 -17.947 -10.546 1.00 0.00 H new ATOM 0 HD3 LYS B 24 2.973 -16.967 -10.232 1.00 0.00 H new ATOM 0 HE2 LYS B 24 2.966 -17.074 -12.581 1.00 0.00 H new ATOM 0 HE3 LYS B 24 3.766 -15.541 -12.296 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 5.062 -16.655 -13.871 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 5.919 -16.838 -12.417 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 5.006 -18.130 -13.031 1.00 0.00 H new ATOM 1141 N LEU B 25 7.091 -16.218 -5.797 1.00 0.00 N ATOM 1142 CA LEU B 25 7.368 -16.529 -4.382 1.00 0.00 C ATOM 1143 C LEU B 25 7.455 -15.259 -3.508 1.00 0.00 C ATOM 1144 O LEU B 25 7.277 -15.337 -2.291 1.00 0.00 O ATOM 1145 CB LEU B 25 8.651 -17.374 -4.254 1.00 0.00 C ATOM 1146 CG LEU B 25 8.498 -18.852 -4.662 1.00 0.00 C ATOM 1147 CD1 LEU B 25 9.866 -19.535 -4.610 1.00 0.00 C ATOM 1148 CD2 LEU B 25 7.565 -19.629 -3.727 1.00 0.00 C ATOM 0 H LEU B 25 7.826 -16.531 -6.431 1.00 0.00 H new ATOM 0 HA LEU B 25 6.526 -17.112 -4.009 1.00 0.00 H new ATOM 0 HB2 LEU B 25 9.429 -16.921 -4.868 1.00 0.00 H new ATOM 0 HB3 LEU B 25 8.995 -17.331 -3.221 1.00 0.00 H new ATOM 0 HG LEU B 25 8.073 -18.858 -5.666 1.00 0.00 H new ATOM 0 HD11 LEU B 25 9.762 -20.581 -4.898 1.00 0.00 H new ATOM 0 HD12 LEU B 25 10.548 -19.036 -5.298 1.00 0.00 H new ATOM 0 HD13 LEU B 25 10.264 -19.476 -3.597 1.00 0.00 H new ATOM 0 HD21 LEU B 25 7.494 -20.664 -4.062 1.00 0.00 H new ATOM 0 HD22 LEU B 25 7.962 -19.602 -2.712 1.00 0.00 H new ATOM 0 HD23 LEU B 25 6.574 -19.174 -3.741 1.00 0.00 H new ATOM 1408 N LEU B 43 26.477 -1.744 -4.897 1.00 0.00 N ATOM 1409 CA LEU B 43 26.468 -3.157 -5.308 1.00 0.00 C ATOM 1410 C LEU B 43 25.443 -3.420 -6.428 1.00 0.00 C ATOM 1411 O LEU B 43 24.410 -2.752 -6.502 1.00 0.00 O ATOM 1412 CB LEU B 43 26.225 -4.070 -4.086 1.00 0.00 C ATOM 1413 CG LEU B 43 25.036 -3.682 -3.180 1.00 0.00 C ATOM 1414 CD1 LEU B 43 24.262 -4.920 -2.723 1.00 0.00 C ATOM 1415 CD2 LEU B 43 25.511 -2.948 -1.921 1.00 0.00 C ATOM 0 HA LEU B 43 27.448 -3.395 -5.721 1.00 0.00 H new ATOM 0 HB2 LEU B 43 26.068 -5.088 -4.443 1.00 0.00 H new ATOM 0 HB3 LEU B 43 27.131 -4.081 -3.479 1.00 0.00 H new ATOM 0 HG LEU B 43 24.395 -3.032 -3.776 1.00 0.00 H new ATOM 0 HD11 LEU B 43 23.431 -4.615 -2.087 1.00 0.00 H new ATOM 0 HD12 LEU B 43 23.877 -5.450 -3.594 1.00 0.00 H new ATOM 0 HD13 LEU B 43 24.926 -5.578 -2.162 1.00 0.00 H new ATOM 0 HD21 LEU B 43 24.650 -2.689 -1.304 1.00 0.00 H new ATOM 0 HD22 LEU B 43 26.182 -3.594 -1.354 1.00 0.00 H new ATOM 0 HD23 LEU B 43 26.039 -2.039 -2.208 1.00 0.00 H new ATOM 1427 N MET B 44 25.727 -4.396 -7.298 1.00 0.00 N ATOM 1428 CA MET B 44 24.895 -4.757 -8.458 1.00 0.00 C ATOM 1429 C MET B 44 25.032 -6.243 -8.836 1.00 0.00 C ATOM 1430 O MET B 44 26.056 -6.870 -8.565 1.00 0.00 O ATOM 1431 CB MET B 44 25.305 -3.856 -9.641 1.00 0.00 C ATOM 1432 CG MET B 44 24.415 -3.981 -10.886 1.00 0.00 C ATOM 1433 SD MET B 44 22.619 -3.869 -10.614 1.00 0.00 S ATOM 1434 CE MET B 44 22.519 -2.306 -9.698 1.00 0.00 C ATOM 0 H MET B 44 26.564 -4.974 -7.215 1.00 0.00 H new ATOM 0 HA MET B 44 23.847 -4.602 -8.202 1.00 0.00 H new ATOM 0 HB2 MET B 44 25.296 -2.818 -9.309 1.00 0.00 H new ATOM 0 HB3 MET B 44 26.332 -4.093 -9.921 1.00 0.00 H new ATOM 0 HG2 MET B 44 24.703 -3.201 -11.591 1.00 0.00 H new ATOM 0 HG3 MET B 44 24.629 -4.937 -11.364 1.00 0.00 H new ATOM 0 HE1 MET B 44 21.473 -2.039 -9.547 1.00 0.00 H new ATOM 0 HE2 MET B 44 23.007 -2.420 -8.730 1.00 0.00 H new ATOM 0 HE3 MET B 44 23.016 -1.519 -10.265 1.00 0.00 H new ATOM 1444 N LEU B 45 23.999 -6.804 -9.477 1.00 0.00 N ATOM 1445 CA LEU B 45 23.954 -8.205 -9.913 1.00 0.00 C ATOM 1446 C LEU B 45 25.135 -8.634 -10.804 1.00 0.00 C ATOM 1447 O LEU B 45 25.730 -7.841 -11.539 1.00 0.00 O ATOM 1448 CB LEU B 45 22.600 -8.509 -10.585 1.00 0.00 C ATOM 1449 CG LEU B 45 21.534 -9.010 -9.595 1.00 0.00 C ATOM 1450 CD1 LEU B 45 21.224 -8.040 -8.455 1.00 0.00 C ATOM 1451 CD2 LEU B 45 20.255 -9.361 -10.347 1.00 0.00 C ATOM 0 H LEU B 45 23.153 -6.285 -9.712 1.00 0.00 H new ATOM 0 HA LEU B 45 24.056 -8.807 -9.010 1.00 0.00 H new ATOM 0 HB2 LEU B 45 22.235 -7.608 -11.077 1.00 0.00 H new ATOM 0 HB3 LEU B 45 22.747 -9.259 -11.362 1.00 0.00 H new ATOM 0 HG LEU B 45 21.957 -9.896 -9.121 1.00 0.00 H new ATOM 0 HD11 LEU B 45 20.463 -8.473 -7.806 1.00 0.00 H new ATOM 0 HD12 LEU B 45 22.130 -7.855 -7.878 1.00 0.00 H new ATOM 0 HD13 LEU B 45 20.857 -7.100 -8.867 1.00 0.00 H new ATOM 0 HD21 LEU B 45 19.504 -9.715 -9.641 1.00 0.00 H new ATOM 0 HD22 LEU B 45 19.881 -8.476 -10.862 1.00 0.00 H new ATOM 0 HD23 LEU B 45 20.465 -10.143 -11.077 1.00 0.00 H new ATOM 1463 N SER B 46 25.432 -9.930 -10.726 1.00 0.00 N ATOM 1464 CA SER B 46 26.530 -10.635 -11.397 1.00 0.00 C ATOM 1465 C SER B 46 26.019 -11.874 -12.152 1.00 0.00 C ATOM 1466 O SER B 46 24.874 -12.282 -11.938 1.00 0.00 O ATOM 1467 CB SER B 46 27.504 -11.056 -10.284 1.00 0.00 C ATOM 1468 OG SER B 46 28.426 -10.012 -10.015 1.00 0.00 O ATOM 0 H SER B 46 24.874 -10.562 -10.152 1.00 0.00 H new ATOM 0 HA SER B 46 27.009 -9.993 -12.137 1.00 0.00 H new ATOM 0 HB2 SER B 46 26.948 -11.302 -9.379 1.00 0.00 H new ATOM 0 HB3 SER B 46 28.041 -11.956 -10.583 1.00 0.00 H new ATOM 0 HG SER B 46 29.039 -10.292 -9.304 1.00 0.00 H new ATOM 1474 N PRO B 47 26.830 -12.529 -13.014 1.00 0.00 N ATOM 1475 CA PRO B 47 26.406 -13.744 -13.722 1.00 0.00 C ATOM 1476 C PRO B 47 25.984 -14.869 -12.759 1.00 0.00 C ATOM 1477 O PRO B 47 25.107 -15.665 -13.090 1.00 0.00 O ATOM 1478 CB PRO B 47 27.572 -14.133 -14.638 1.00 0.00 C ATOM 1479 CG PRO B 47 28.784 -13.456 -14.001 1.00 0.00 C ATOM 1480 CD PRO B 47 28.199 -12.189 -13.380 1.00 0.00 C ATOM 0 HA PRO B 47 25.508 -13.562 -14.313 1.00 0.00 H new ATOM 0 HB2 PRO B 47 27.698 -15.215 -14.686 1.00 0.00 H new ATOM 0 HB3 PRO B 47 27.411 -13.785 -15.658 1.00 0.00 H new ATOM 0 HG2 PRO B 47 29.251 -14.093 -13.249 1.00 0.00 H new ATOM 0 HG3 PRO B 47 29.549 -13.224 -14.742 1.00 0.00 H new ATOM 0 HD2 PRO B 47 28.773 -11.879 -12.507 1.00 0.00 H new ATOM 0 HD3 PRO B 47 28.221 -11.359 -14.087 1.00 0.00 H new ATOM 1488 N ASP B 48 26.545 -14.882 -11.544 1.00 0.00 N ATOM 1489 CA ASP B 48 26.201 -15.800 -10.450 1.00 0.00 C ATOM 1490 C ASP B 48 24.712 -15.720 -10.050 1.00 0.00 C ATOM 1491 O ASP B 48 24.102 -16.730 -9.700 1.00 0.00 O ATOM 1492 CB ASP B 48 27.100 -15.458 -9.254 1.00 0.00 C ATOM 1493 CG ASP B 48 26.911 -16.421 -8.071 1.00 0.00 C ATOM 1494 OD1 ASP B 48 27.277 -17.613 -8.192 1.00 0.00 O ATOM 1495 OD2 ASP B 48 26.433 -15.965 -7.004 1.00 0.00 O ATOM 0 H ASP B 48 27.282 -14.226 -11.285 1.00 0.00 H new ATOM 0 HA ASP B 48 26.366 -16.824 -10.784 1.00 0.00 H new ATOM 0 HB2 ASP B 48 28.143 -15.480 -9.571 1.00 0.00 H new ATOM 0 HB3 ASP B 48 26.888 -14.440 -8.926 1.00 0.00 H new ATOM 1500 N ASP B 49 24.104 -14.530 -10.132 1.00 0.00 N ATOM 1501 CA ASP B 49 22.681 -14.306 -9.856 1.00 0.00 C ATOM 1502 C ASP B 49 21.798 -14.864 -10.982 1.00 0.00 C ATOM 1503 O ASP B 49 20.734 -15.430 -10.722 1.00 0.00 O ATOM 1504 CB ASP B 49 22.392 -12.801 -9.737 1.00 0.00 C ATOM 1505 CG ASP B 49 23.112 -12.153 -8.556 1.00 0.00 C ATOM 1506 OD1 ASP B 49 24.351 -11.971 -8.600 1.00 0.00 O ATOM 1507 OD2 ASP B 49 22.440 -11.843 -7.552 1.00 0.00 O ATOM 0 H ASP B 49 24.599 -13.679 -10.398 1.00 0.00 H new ATOM 0 HA ASP B 49 22.452 -14.819 -8.922 1.00 0.00 H new ATOM 0 HB2 ASP B 49 22.694 -12.303 -10.659 1.00 0.00 H new ATOM 0 HB3 ASP B 49 21.318 -12.649 -9.630 1.00 0.00 H new ATOM 1512 N ILE B 50 22.249 -14.704 -12.230 1.00 0.00 N ATOM 1513 CA ILE B 50 21.534 -15.130 -13.438 1.00 0.00 C ATOM 1514 C ILE B 50 21.559 -16.663 -13.590 1.00 0.00 C ATOM 1515 O ILE B 50 20.539 -17.279 -13.899 1.00 0.00 O ATOM 1516 CB ILE B 50 22.098 -14.425 -14.697 1.00 0.00 C ATOM 1517 CG1 ILE B 50 22.277 -12.894 -14.523 1.00 0.00 C ATOM 1518 CG2 ILE B 50 21.133 -14.683 -15.870 1.00 0.00 C ATOM 1519 CD1 ILE B 50 23.074 -12.231 -15.656 1.00 0.00 C ATOM 0 H ILE B 50 23.146 -14.263 -12.434 1.00 0.00 H new ATOM 0 HA ILE B 50 20.491 -14.830 -13.332 1.00 0.00 H new ATOM 0 HB ILE B 50 23.090 -14.838 -14.882 1.00 0.00 H new ATOM 0 HG12 ILE B 50 21.294 -12.427 -14.461 1.00 0.00 H new ATOM 0 HG13 ILE B 50 22.781 -12.702 -13.576 1.00 0.00 H new ATOM 0 HG21 ILE B 50 21.512 -14.194 -16.767 1.00 0.00 H new ATOM 0 HG22 ILE B 50 21.054 -15.756 -16.047 1.00 0.00 H new ATOM 0 HG23 ILE B 50 20.149 -14.282 -15.627 1.00 0.00 H new ATOM 0 HD11 ILE B 50 23.157 -11.161 -15.464 1.00 0.00 H new ATOM 0 HD12 ILE B 50 24.071 -12.670 -15.705 1.00 0.00 H new ATOM 0 HD13 ILE B 50 22.560 -12.391 -16.604 1.00 0.00 H new ATOM 1531 N GLU B 51 22.704 -17.308 -13.342 1.00 0.00 N ATOM 1532 CA GLU B 51 22.832 -18.774 -13.416 1.00 0.00 C ATOM 1533 C GLU B 51 22.138 -19.513 -12.249 1.00 0.00 C ATOM 1534 O GLU B 51 22.044 -20.741 -12.247 1.00 0.00 O ATOM 1535 CB GLU B 51 24.314 -19.177 -13.547 1.00 0.00 C ATOM 1536 CG GLU B 51 25.124 -19.058 -12.252 1.00 0.00 C ATOM 1537 CD GLU B 51 26.596 -19.451 -12.485 1.00 0.00 C ATOM 1538 OE1 GLU B 51 27.407 -18.593 -12.910 1.00 0.00 O ATOM 1539 OE2 GLU B 51 26.956 -20.630 -12.244 1.00 0.00 O ATOM 0 H GLU B 51 23.569 -16.833 -13.084 1.00 0.00 H new ATOM 0 HA GLU B 51 22.302 -19.092 -14.313 1.00 0.00 H new ATOM 0 HB2 GLU B 51 24.367 -20.207 -13.900 1.00 0.00 H new ATOM 0 HB3 GLU B 51 24.780 -18.554 -14.310 1.00 0.00 H new ATOM 0 HG2 GLU B 51 25.071 -18.035 -11.878 1.00 0.00 H new ATOM 0 HG3 GLU B 51 24.689 -19.700 -11.486 1.00 0.00 H new ATOM 1546 N GLN B 52 21.655 -18.780 -11.241 1.00 0.00 N ATOM 1547 CA GLN B 52 20.987 -19.328 -10.061 1.00 0.00 C ATOM 1548 C GLN B 52 19.498 -19.626 -10.284 1.00 0.00 C ATOM 1549 O GLN B 52 19.055 -20.739 -10.003 1.00 0.00 O ATOM 1550 CB GLN B 52 21.235 -18.353 -8.893 1.00 0.00 C ATOM 1551 CG GLN B 52 20.257 -18.378 -7.697 1.00 0.00 C ATOM 1552 CD GLN B 52 18.980 -17.541 -7.856 1.00 0.00 C ATOM 1553 OE1 GLN B 52 17.924 -17.892 -7.347 1.00 0.00 O ATOM 1554 NE2 GLN B 52 18.989 -16.425 -8.558 1.00 0.00 N ATOM 0 H GLN B 52 21.721 -17.762 -11.225 1.00 0.00 H new ATOM 0 HA GLN B 52 21.411 -20.305 -9.827 1.00 0.00 H new ATOM 0 HB2 GLN B 52 22.236 -18.544 -8.507 1.00 0.00 H new ATOM 0 HB3 GLN B 52 21.238 -17.342 -9.299 1.00 0.00 H new ATOM 0 HG2 GLN B 52 19.969 -19.412 -7.510 1.00 0.00 H new ATOM 0 HG3 GLN B 52 20.788 -18.030 -6.811 1.00 0.00 H new ATOM 0 HE21 GLN B 52 19.853 -16.105 -8.995 1.00 0.00 H new ATOM 0 HE22 GLN B 52 18.132 -15.882 -8.664 1.00 0.00 H new ATOM 1563 N TRP B 53 18.703 -18.659 -10.756 1.00 0.00 N ATOM 1564 CA TRP B 53 17.245 -18.827 -10.858 1.00 0.00 C ATOM 1565 C TRP B 53 16.753 -19.859 -11.885 1.00 0.00 C ATOM 1566 O TRP B 53 15.648 -20.383 -11.736 1.00 0.00 O ATOM 1567 CB TRP B 53 16.551 -17.457 -10.966 1.00 0.00 C ATOM 1568 CG TRP B 53 17.112 -16.417 -11.887 1.00 0.00 C ATOM 1569 CD1 TRP B 53 17.582 -16.633 -13.135 1.00 0.00 C ATOM 1570 CD2 TRP B 53 17.281 -14.983 -11.643 1.00 0.00 C ATOM 1571 NE1 TRP B 53 17.985 -15.438 -13.695 1.00 0.00 N ATOM 1572 CE2 TRP B 53 17.857 -14.391 -12.809 1.00 0.00 C ATOM 1573 CE3 TRP B 53 17.020 -14.124 -10.552 1.00 0.00 C ATOM 1574 CZ2 TRP B 53 18.182 -13.027 -12.881 1.00 0.00 C ATOM 1575 CZ3 TRP B 53 17.346 -12.754 -10.614 1.00 0.00 C ATOM 1576 CH2 TRP B 53 17.929 -12.205 -11.769 1.00 0.00 C ATOM 0 H TRP B 53 19.043 -17.751 -11.074 1.00 0.00 H new ATOM 0 HA TRP B 53 16.937 -19.292 -9.922 1.00 0.00 H new ATOM 0 HB2 TRP B 53 15.519 -17.636 -11.266 1.00 0.00 H new ATOM 0 HB3 TRP B 53 16.522 -17.026 -9.965 1.00 0.00 H new ATOM 0 HD1 TRP B 53 17.634 -17.596 -13.621 1.00 0.00 H new ATOM 0 HE1 TRP B 53 18.335 -15.342 -14.648 1.00 0.00 H new ATOM 0 HE3 TRP B 53 16.564 -14.523 -9.658 1.00 0.00 H new ATOM 0 HZ2 TRP B 53 18.620 -12.615 -13.778 1.00 0.00 H new ATOM 0 HZ3 TRP B 53 17.145 -12.119 -9.764 1.00 0.00 H new ATOM 0 HH2 TRP B 53 18.182 -11.156 -11.802 1.00 0.00 H new ATOM 1587 N PHE B 54 17.560 -20.199 -12.896 1.00 0.00 N ATOM 1588 CA PHE B 54 17.208 -21.203 -13.916 1.00 0.00 C ATOM 1589 C PHE B 54 17.632 -22.650 -13.571 1.00 0.00 C ATOM 1590 O PHE B 54 17.241 -23.586 -14.269 1.00 0.00 O ATOM 1591 CB PHE B 54 17.682 -20.740 -15.312 1.00 0.00 C ATOM 1592 CG PHE B 54 19.093 -21.091 -15.772 1.00 0.00 C ATOM 1593 CD1 PHE B 54 20.173 -21.186 -14.872 1.00 0.00 C ATOM 1594 CD2 PHE B 54 19.327 -21.315 -17.145 1.00 0.00 C ATOM 1595 CE1 PHE B 54 21.456 -21.533 -15.332 1.00 0.00 C ATOM 1596 CE2 PHE B 54 20.614 -21.639 -17.608 1.00 0.00 C ATOM 1597 CZ PHE B 54 21.681 -21.753 -16.701 1.00 0.00 C ATOM 0 H PHE B 54 18.482 -19.785 -13.034 1.00 0.00 H new ATOM 0 HA PHE B 54 16.120 -21.263 -13.932 1.00 0.00 H new ATOM 0 HB2 PHE B 54 16.987 -21.147 -16.046 1.00 0.00 H new ATOM 0 HB3 PHE B 54 17.585 -19.655 -15.348 1.00 0.00 H new ATOM 0 HD1 PHE B 54 20.014 -20.991 -13.822 1.00 0.00 H new ATOM 0 HD2 PHE B 54 18.510 -21.237 -17.847 1.00 0.00 H new ATOM 0 HE1 PHE B 54 22.271 -21.631 -14.630 1.00 0.00 H new ATOM 0 HE2 PHE B 54 20.783 -21.801 -18.662 1.00 0.00 H new ATOM 0 HZ PHE B 54 22.669 -22.008 -17.055 1.00 0.00 H new ATOM 1607 N THR B 55 18.429 -22.853 -12.510 1.00 0.00 N ATOM 1608 CA THR B 55 18.969 -24.172 -12.106 1.00 0.00 C ATOM 1609 C THR B 55 17.917 -25.246 -11.787 1.00 0.00 C ATOM 1610 O THR B 55 18.211 -26.439 -11.860 1.00 0.00 O ATOM 1611 CB THR B 55 19.958 -24.015 -10.933 1.00 0.00 C ATOM 1612 OG1 THR B 55 20.898 -25.072 -10.932 1.00 0.00 O ATOM 1613 CG2 THR B 55 19.313 -23.962 -9.545 1.00 0.00 C ATOM 0 H THR B 55 18.725 -22.095 -11.894 1.00 0.00 H new ATOM 0 HA THR B 55 19.487 -24.545 -12.990 1.00 0.00 H new ATOM 0 HB THR B 55 20.430 -23.048 -11.107 1.00 0.00 H new ATOM 0 HG1 THR B 55 20.457 -25.902 -11.210 1.00 0.00 H new ATOM 0 HG21 THR B 55 20.089 -23.851 -8.787 1.00 0.00 H new ATOM 0 HG22 THR B 55 18.631 -23.114 -9.493 1.00 0.00 H new ATOM 0 HG23 THR B 55 18.760 -24.884 -9.365 1.00 0.00 H new