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: A2085 GLN : amide:sc= 0.633 K(o=2.3,f=0.74) USER MOD Set 1.2: A2086 GLN : amide:sc= 0.251 K(o=2.3,f=-1.1) USER MOD Set 1.3: A2089 ASN : amide:sc= 1.4 K(o=2.3,f=-0.98) 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= -0.132 X(o=-0.13,f=-0.31) USER MOD Single : A2074 THR OG1 : rot 82:sc= 1.15 USER MOD Single : A2076 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00593) 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= 0.336 USER MOD Single : A2082 GLN : amide:sc= -0.0172 X(o=-0.017,f=-0.017) USER MOD Single : A2083 GLN : amide:sc= 0.889 K(o=0.89,f=-0.81) USER MOD Single : A2084 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A2092 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2093 SER OG : rot 74:sc= 0.943 USER MOD Single : A2094 ASN : amide:sc= 0.643 K(o=0.64,f=-0.32) USER MOD Single : A2096 GLN : amide:sc= -1.79! C(o=-1.8!,f=-1.8!) USER MOD Single : A2098 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A2103 LYS NZ :NH3+ -147:sc= 0 (180deg=-0.646) USER MOD Single : A2104 GLN : amide:sc=-0.00954 K(o=-0.0095,f=-0.66) 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 -25:sc= 0.0628 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 44 MET CE :methyl 154:sc= -0.0173 (180deg=-0.112) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 52 GLN : amide:sc= -0.0708 X(o=-0.071,f=-0.35) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 64 N ILE A2063 4.591 -6.349 -14.857 1.00 0.00 N ATOM 65 CA ILE A2063 5.812 -6.942 -15.424 1.00 0.00 C ATOM 66 C ILE A2063 5.502 -7.584 -16.786 1.00 0.00 C ATOM 67 O ILE A2063 4.494 -8.278 -16.941 1.00 0.00 O ATOM 68 CB ILE A2063 6.424 -7.956 -14.419 1.00 0.00 C ATOM 69 CG1 ILE A2063 5.383 -8.961 -13.866 1.00 0.00 C ATOM 70 CG2 ILE A2063 7.077 -7.175 -13.264 1.00 0.00 C ATOM 71 CD1 ILE A2063 5.960 -10.068 -12.975 1.00 0.00 C ATOM 0 HA ILE A2063 6.556 -6.164 -15.595 1.00 0.00 H new ATOM 0 HB ILE A2063 7.168 -8.548 -14.952 1.00 0.00 H new ATOM 0 HG12 ILE A2063 4.635 -8.410 -13.296 1.00 0.00 H new ATOM 0 HG13 ILE A2063 4.866 -9.424 -14.706 1.00 0.00 H new ATOM 0 HG21 ILE A2063 7.511 -7.876 -12.551 1.00 0.00 H new ATOM 0 HG22 ILE A2063 7.860 -6.528 -13.659 1.00 0.00 H new ATOM 0 HG23 ILE A2063 6.323 -6.568 -12.763 1.00 0.00 H new ATOM 0 HD11 ILE A2063 5.155 -10.720 -12.637 1.00 0.00 H new ATOM 0 HD12 ILE A2063 6.685 -10.651 -13.543 1.00 0.00 H new ATOM 0 HD13 ILE A2063 6.451 -9.621 -12.111 1.00 0.00 H new ATOM 83 N SER A2064 6.345 -7.330 -17.791 1.00 0.00 N ATOM 84 CA SER A2064 6.144 -7.831 -19.162 1.00 0.00 C ATOM 85 C SER A2064 6.684 -9.259 -19.344 1.00 0.00 C ATOM 86 O SER A2064 7.813 -9.533 -18.923 1.00 0.00 O ATOM 87 CB SER A2064 6.846 -6.908 -20.167 1.00 0.00 C ATOM 88 OG SER A2064 6.309 -5.595 -20.089 1.00 0.00 O ATOM 0 H SER A2064 7.190 -6.770 -17.681 1.00 0.00 H new ATOM 0 HA SER A2064 5.069 -7.845 -19.341 1.00 0.00 H new ATOM 0 HB2 SER A2064 7.916 -6.883 -19.962 1.00 0.00 H new ATOM 0 HB3 SER A2064 6.724 -7.299 -21.177 1.00 0.00 H new ATOM 0 HG SER A2064 6.766 -5.016 -20.734 1.00 0.00 H new ATOM 94 N PRO A2065 5.943 -10.185 -19.992 1.00 0.00 N ATOM 95 CA PRO A2065 6.410 -11.555 -20.222 1.00 0.00 C ATOM 96 C PRO A2065 7.582 -11.622 -21.214 1.00 0.00 C ATOM 97 O PRO A2065 8.398 -12.536 -21.125 1.00 0.00 O ATOM 98 CB PRO A2065 5.193 -12.325 -20.742 1.00 0.00 C ATOM 99 CG PRO A2065 4.343 -11.244 -21.409 1.00 0.00 C ATOM 100 CD PRO A2065 4.611 -10.004 -20.556 1.00 0.00 C ATOM 0 HA PRO A2065 6.800 -11.987 -19.301 1.00 0.00 H new ATOM 0 HB2 PRO A2065 5.482 -13.102 -21.450 1.00 0.00 H new ATOM 0 HB3 PRO A2065 4.654 -12.817 -19.932 1.00 0.00 H new ATOM 0 HG2 PRO A2065 4.635 -11.088 -22.448 1.00 0.00 H new ATOM 0 HG3 PRO A2065 3.286 -11.509 -21.411 1.00 0.00 H new ATOM 0 HD2 PRO A2065 4.563 -9.097 -21.159 1.00 0.00 H new ATOM 0 HD3 PRO A2065 3.864 -9.903 -19.769 1.00 0.00 H new ATOM 108 N SER A2066 7.715 -10.648 -22.122 1.00 0.00 N ATOM 109 CA SER A2066 8.822 -10.555 -23.087 1.00 0.00 C ATOM 110 C SER A2066 10.201 -10.539 -22.414 1.00 0.00 C ATOM 111 O SER A2066 11.158 -11.115 -22.937 1.00 0.00 O ATOM 112 CB SER A2066 8.646 -9.301 -23.951 1.00 0.00 C ATOM 113 OG SER A2066 8.456 -8.154 -23.133 1.00 0.00 O ATOM 0 H SER A2066 7.043 -9.886 -22.210 1.00 0.00 H new ATOM 0 HA SER A2066 8.785 -11.450 -23.708 1.00 0.00 H new ATOM 0 HB2 SER A2066 9.523 -9.162 -24.584 1.00 0.00 H new ATOM 0 HB3 SER A2066 7.791 -9.427 -24.615 1.00 0.00 H new ATOM 0 HG SER A2066 8.347 -7.362 -23.700 1.00 0.00 H new ATOM 119 N ALA A2067 10.300 -9.932 -21.225 1.00 0.00 N ATOM 120 CA ALA A2067 11.521 -9.867 -20.425 1.00 0.00 C ATOM 121 C ALA A2067 12.056 -11.257 -20.032 1.00 0.00 C ATOM 122 O ALA A2067 13.267 -11.440 -19.924 1.00 0.00 O ATOM 123 CB ALA A2067 11.225 -9.028 -19.178 1.00 0.00 C ATOM 0 H ALA A2067 9.510 -9.461 -20.784 1.00 0.00 H new ATOM 0 HA ALA A2067 12.306 -9.407 -21.026 1.00 0.00 H new ATOM 0 HB1 ALA A2067 12.122 -8.963 -18.562 1.00 0.00 H new ATOM 0 HB2 ALA A2067 10.918 -8.026 -19.478 1.00 0.00 H new ATOM 0 HB3 ALA A2067 10.425 -9.497 -18.606 1.00 0.00 H new ATOM 129 N LEU A2068 11.169 -12.242 -19.846 1.00 0.00 N ATOM 130 CA LEU A2068 11.529 -13.615 -19.483 1.00 0.00 C ATOM 131 C LEU A2068 12.299 -14.276 -20.639 1.00 0.00 C ATOM 132 O LEU A2068 13.388 -14.818 -20.435 1.00 0.00 O ATOM 133 CB LEU A2068 10.256 -14.415 -19.121 1.00 0.00 C ATOM 134 CG LEU A2068 9.559 -14.093 -17.780 1.00 0.00 C ATOM 135 CD1 LEU A2068 9.318 -12.612 -17.475 1.00 0.00 C ATOM 136 CD2 LEU A2068 8.199 -14.792 -17.755 1.00 0.00 C ATOM 0 H LEU A2068 10.163 -12.103 -19.946 1.00 0.00 H new ATOM 0 HA LEU A2068 12.179 -13.604 -18.608 1.00 0.00 H new ATOM 0 HB2 LEU A2068 9.529 -14.267 -19.920 1.00 0.00 H new ATOM 0 HB3 LEU A2068 10.515 -15.474 -19.118 1.00 0.00 H new ATOM 0 HG LEU A2068 10.255 -14.445 -17.018 1.00 0.00 H new ATOM 0 HD11 LEU A2068 8.824 -12.515 -16.508 1.00 0.00 H new ATOM 0 HD12 LEU A2068 10.272 -12.086 -17.449 1.00 0.00 H new ATOM 0 HD13 LEU A2068 8.686 -12.179 -18.251 1.00 0.00 H new ATOM 0 HD21 LEU A2068 7.695 -14.574 -16.814 1.00 0.00 H new ATOM 0 HD22 LEU A2068 7.590 -14.433 -18.585 1.00 0.00 H new ATOM 0 HD23 LEU A2068 8.341 -15.869 -17.849 1.00 0.00 H new ATOM 148 N GLN A2069 11.767 -14.186 -21.865 1.00 0.00 N ATOM 149 CA GLN A2069 12.437 -14.716 -23.061 1.00 0.00 C ATOM 150 C GLN A2069 13.755 -13.974 -23.341 1.00 0.00 C ATOM 151 O GLN A2069 14.762 -14.601 -23.670 1.00 0.00 O ATOM 152 CB GLN A2069 11.525 -14.630 -24.301 1.00 0.00 C ATOM 153 CG GLN A2069 10.298 -15.557 -24.259 1.00 0.00 C ATOM 154 CD GLN A2069 9.111 -14.941 -23.524 1.00 0.00 C ATOM 155 OE1 GLN A2069 8.483 -13.999 -23.988 1.00 0.00 O ATOM 156 NE2 GLN A2069 8.739 -15.450 -22.370 1.00 0.00 N ATOM 0 H GLN A2069 10.866 -13.747 -22.056 1.00 0.00 H new ATOM 0 HA GLN A2069 12.659 -15.764 -22.860 1.00 0.00 H new ATOM 0 HB2 GLN A2069 11.183 -13.601 -24.414 1.00 0.00 H new ATOM 0 HB3 GLN A2069 12.114 -14.869 -25.186 1.00 0.00 H new ATOM 0 HG2 GLN A2069 10.000 -15.802 -25.278 1.00 0.00 H new ATOM 0 HG3 GLN A2069 10.573 -16.493 -23.773 1.00 0.00 H new ATOM 0 HE21 GLN A2069 9.252 -16.235 -21.970 1.00 0.00 H new ATOM 0 HE22 GLN A2069 7.937 -15.059 -21.875 1.00 0.00 H new ATOM 165 N ASP A2070 13.765 -12.644 -23.197 1.00 0.00 N ATOM 166 CA ASP A2070 14.949 -11.806 -23.431 1.00 0.00 C ATOM 167 C ASP A2070 16.084 -12.107 -22.429 1.00 0.00 C ATOM 168 O ASP A2070 17.257 -12.167 -22.806 1.00 0.00 O ATOM 169 CB ASP A2070 14.513 -10.326 -23.390 1.00 0.00 C ATOM 170 CG ASP A2070 15.429 -9.348 -24.146 1.00 0.00 C ATOM 171 OD1 ASP A2070 16.385 -9.777 -24.832 1.00 0.00 O ATOM 172 OD2 ASP A2070 15.128 -8.133 -24.142 1.00 0.00 O ATOM 0 H ASP A2070 12.943 -12.112 -22.912 1.00 0.00 H new ATOM 0 HA ASP A2070 15.364 -12.034 -24.413 1.00 0.00 H new ATOM 0 HB2 ASP A2070 13.507 -10.249 -23.804 1.00 0.00 H new ATOM 0 HB3 ASP A2070 14.454 -10.011 -22.348 1.00 0.00 H new ATOM 177 N LEU A2071 15.752 -12.362 -21.156 1.00 0.00 N ATOM 178 CA LEU A2071 16.731 -12.751 -20.139 1.00 0.00 C ATOM 179 C LEU A2071 17.365 -14.098 -20.509 1.00 0.00 C ATOM 180 O LEU A2071 18.592 -14.198 -20.550 1.00 0.00 O ATOM 181 CB LEU A2071 16.046 -12.763 -18.757 1.00 0.00 C ATOM 182 CG LEU A2071 16.982 -13.003 -17.553 1.00 0.00 C ATOM 183 CD1 LEU A2071 16.274 -12.544 -16.278 1.00 0.00 C ATOM 184 CD2 LEU A2071 17.370 -14.471 -17.342 1.00 0.00 C ATOM 0 H LEU A2071 14.796 -12.304 -20.805 1.00 0.00 H new ATOM 0 HA LEU A2071 17.546 -12.028 -20.093 1.00 0.00 H new ATOM 0 HB2 LEU A2071 15.537 -11.810 -18.615 1.00 0.00 H new ATOM 0 HB3 LEU A2071 15.278 -13.537 -18.758 1.00 0.00 H new ATOM 0 HG LEU A2071 17.892 -12.443 -17.767 1.00 0.00 H new ATOM 0 HD11 LEU A2071 16.926 -12.709 -15.420 1.00 0.00 H new ATOM 0 HD12 LEU A2071 16.037 -11.483 -16.355 1.00 0.00 H new ATOM 0 HD13 LEU A2071 15.353 -13.113 -16.148 1.00 0.00 H new ATOM 0 HD21 LEU A2071 18.028 -14.553 -16.477 1.00 0.00 H new ATOM 0 HD22 LEU A2071 16.471 -15.064 -17.171 1.00 0.00 H new ATOM 0 HD23 LEU A2071 17.887 -14.842 -18.227 1.00 0.00 H new ATOM 196 N LEU A2072 16.558 -15.122 -20.817 1.00 0.00 N ATOM 197 CA LEU A2072 17.074 -16.441 -21.202 1.00 0.00 C ATOM 198 C LEU A2072 17.915 -16.397 -22.485 1.00 0.00 C ATOM 199 O LEU A2072 19.005 -16.973 -22.502 1.00 0.00 O ATOM 200 CB LEU A2072 15.930 -17.462 -21.331 1.00 0.00 C ATOM 201 CG LEU A2072 15.311 -17.917 -19.996 1.00 0.00 C ATOM 202 CD1 LEU A2072 14.193 -18.918 -20.295 1.00 0.00 C ATOM 203 CD2 LEU A2072 16.315 -18.602 -19.061 1.00 0.00 C ATOM 0 H LEU A2072 15.540 -15.061 -20.807 1.00 0.00 H new ATOM 0 HA LEU A2072 17.740 -16.762 -20.401 1.00 0.00 H new ATOM 0 HB2 LEU A2072 15.144 -17.029 -21.950 1.00 0.00 H new ATOM 0 HB3 LEU A2072 16.304 -18.339 -21.859 1.00 0.00 H new ATOM 0 HG LEU A2072 14.948 -17.021 -19.493 1.00 0.00 H new ATOM 0 HD11 LEU A2072 13.743 -19.251 -19.360 1.00 0.00 H new ATOM 0 HD12 LEU A2072 13.433 -18.441 -20.913 1.00 0.00 H new ATOM 0 HD13 LEU A2072 14.605 -19.776 -20.825 1.00 0.00 H new ATOM 0 HD21 LEU A2072 15.812 -18.897 -18.140 1.00 0.00 H new ATOM 0 HD22 LEU A2072 16.723 -19.486 -19.550 1.00 0.00 H new ATOM 0 HD23 LEU A2072 17.125 -17.911 -18.827 1.00 0.00 H new ATOM 215 N ARG A2073 17.468 -15.701 -23.544 1.00 0.00 N ATOM 216 CA ARG A2073 18.254 -15.589 -24.791 1.00 0.00 C ATOM 217 C ARG A2073 19.615 -14.918 -24.550 1.00 0.00 C ATOM 218 O ARG A2073 20.597 -15.281 -25.196 1.00 0.00 O ATOM 219 CB ARG A2073 17.440 -14.971 -25.947 1.00 0.00 C ATOM 220 CG ARG A2073 17.457 -13.442 -26.008 1.00 0.00 C ATOM 221 CD ARG A2073 16.575 -12.912 -27.143 1.00 0.00 C ATOM 222 NE ARG A2073 16.438 -11.452 -27.032 1.00 0.00 N ATOM 223 CZ ARG A2073 16.060 -10.581 -27.944 1.00 0.00 C ATOM 224 NH1 ARG A2073 15.759 -10.913 -29.167 1.00 0.00 N ATOM 225 NH2 ARG A2073 15.980 -9.333 -27.593 1.00 0.00 N ATOM 0 H ARG A2073 16.574 -15.210 -23.565 1.00 0.00 H new ATOM 0 HA ARG A2073 18.484 -16.601 -25.125 1.00 0.00 H new ATOM 0 HB2 ARG A2073 17.823 -15.361 -26.890 1.00 0.00 H new ATOM 0 HB3 ARG A2073 16.406 -15.304 -25.861 1.00 0.00 H new ATOM 0 HG2 ARG A2073 17.111 -13.036 -25.058 1.00 0.00 H new ATOM 0 HG3 ARG A2073 18.480 -13.094 -26.149 1.00 0.00 H new ATOM 0 HD2 ARG A2073 17.012 -13.172 -28.107 1.00 0.00 H new ATOM 0 HD3 ARG A2073 15.593 -13.382 -27.101 1.00 0.00 H new ATOM 0 HE ARG A2073 16.668 -11.059 -26.120 1.00 0.00 H new ATOM 0 HH11 ARG A2073 15.811 -11.889 -29.458 1.00 0.00 H new ATOM 0 HH12 ARG A2073 15.472 -10.197 -29.834 1.00 0.00 H new ATOM 0 HH21 ARG A2073 16.207 -9.056 -26.638 1.00 0.00 H new ATOM 0 HH22 ARG A2073 15.691 -8.630 -28.273 1.00 0.00 H new ATOM 239 N THR A2074 19.682 -13.992 -23.587 1.00 0.00 N ATOM 240 CA THR A2074 20.921 -13.317 -23.169 1.00 0.00 C ATOM 241 C THR A2074 21.796 -14.243 -22.315 1.00 0.00 C ATOM 242 O THR A2074 23.004 -14.313 -22.531 1.00 0.00 O ATOM 243 CB THR A2074 20.609 -12.022 -22.396 1.00 0.00 C ATOM 244 OG1 THR A2074 19.818 -11.159 -23.183 1.00 0.00 O ATOM 245 CG2 THR A2074 21.867 -11.230 -22.040 1.00 0.00 C ATOM 0 H THR A2074 18.862 -13.683 -23.065 1.00 0.00 H new ATOM 0 HA THR A2074 21.474 -13.059 -24.072 1.00 0.00 H new ATOM 0 HB THR A2074 20.098 -12.340 -21.487 1.00 0.00 H new ATOM 0 HG1 THR A2074 18.878 -11.430 -23.123 1.00 0.00 H new ATOM 0 HG21 THR A2074 21.587 -10.328 -21.496 1.00 0.00 H new ATOM 0 HG22 THR A2074 22.518 -11.842 -21.416 1.00 0.00 H new ATOM 0 HG23 THR A2074 22.394 -10.954 -22.953 1.00 0.00 H new ATOM 253 N LEU A2075 21.225 -14.989 -21.360 1.00 0.00 N ATOM 254 CA LEU A2075 21.948 -15.930 -20.485 1.00 0.00 C ATOM 255 C LEU A2075 22.698 -17.015 -21.284 1.00 0.00 C ATOM 256 O LEU A2075 23.822 -17.378 -20.934 1.00 0.00 O ATOM 257 CB LEU A2075 20.939 -16.504 -19.466 1.00 0.00 C ATOM 258 CG LEU A2075 21.448 -17.447 -18.352 1.00 0.00 C ATOM 259 CD1 LEU A2075 21.541 -18.908 -18.795 1.00 0.00 C ATOM 260 CD2 LEU A2075 22.788 -17.030 -17.736 1.00 0.00 C ATOM 0 H LEU A2075 20.224 -14.956 -21.167 1.00 0.00 H new ATOM 0 HA LEU A2075 22.736 -15.406 -19.943 1.00 0.00 H new ATOM 0 HB2 LEU A2075 20.445 -15.661 -18.982 1.00 0.00 H new ATOM 0 HB3 LEU A2075 20.175 -17.042 -20.028 1.00 0.00 H new ATOM 0 HG LEU A2075 20.682 -17.355 -17.582 1.00 0.00 H new ATOM 0 HD11 LEU A2075 21.904 -19.517 -17.967 1.00 0.00 H new ATOM 0 HD12 LEU A2075 20.555 -19.260 -19.098 1.00 0.00 H new ATOM 0 HD13 LEU A2075 22.230 -18.990 -19.636 1.00 0.00 H new ATOM 0 HD21 LEU A2075 23.072 -17.745 -16.964 1.00 0.00 H new ATOM 0 HD22 LEU A2075 23.554 -17.010 -18.511 1.00 0.00 H new ATOM 0 HD23 LEU A2075 22.692 -16.038 -17.295 1.00 0.00 H new ATOM 272 N LYS A2076 22.113 -17.512 -22.384 1.00 0.00 N ATOM 273 CA LYS A2076 22.741 -18.525 -23.261 1.00 0.00 C ATOM 274 C LYS A2076 24.003 -18.049 -24.011 1.00 0.00 C ATOM 275 O LYS A2076 24.770 -18.889 -24.486 1.00 0.00 O ATOM 276 CB LYS A2076 21.695 -19.094 -24.239 1.00 0.00 C ATOM 277 CG LYS A2076 20.575 -19.917 -23.572 1.00 0.00 C ATOM 278 CD LYS A2076 21.083 -21.180 -22.851 1.00 0.00 C ATOM 279 CE LYS A2076 19.944 -22.040 -22.285 1.00 0.00 C ATOM 280 NZ LYS A2076 19.160 -22.724 -23.350 1.00 0.00 N ATOM 0 H LYS A2076 21.186 -17.224 -22.696 1.00 0.00 H new ATOM 0 HA LYS A2076 23.100 -19.310 -22.596 1.00 0.00 H new ATOM 0 HB2 LYS A2076 21.243 -18.268 -24.788 1.00 0.00 H new ATOM 0 HB3 LYS A2076 22.204 -19.722 -24.970 1.00 0.00 H new ATOM 0 HG2 LYS A2076 20.050 -19.286 -22.855 1.00 0.00 H new ATOM 0 HG3 LYS A2076 19.849 -20.209 -24.331 1.00 0.00 H new ATOM 0 HD2 LYS A2076 21.672 -21.778 -23.546 1.00 0.00 H new ATOM 0 HD3 LYS A2076 21.749 -20.887 -22.039 1.00 0.00 H new ATOM 0 HE2 LYS A2076 20.359 -22.787 -21.608 1.00 0.00 H new ATOM 0 HE3 LYS A2076 19.277 -21.411 -21.695 1.00 0.00 H new ATOM 0 HZ1 LYS A2076 18.437 -23.331 -22.913 1.00 0.00 H new ATOM 0 HZ2 LYS A2076 18.698 -22.013 -23.952 1.00 0.00 H new ATOM 0 HZ3 LYS A2076 19.797 -23.307 -23.930 1.00 0.00 H new ATOM 294 N SER A2077 24.249 -16.739 -24.113 1.00 0.00 N ATOM 295 CA SER A2077 25.447 -16.154 -24.748 1.00 0.00 C ATOM 296 C SER A2077 26.738 -16.434 -23.938 1.00 0.00 C ATOM 297 O SER A2077 26.654 -16.761 -22.748 1.00 0.00 O ATOM 298 CB SER A2077 25.252 -14.631 -24.864 1.00 0.00 C ATOM 299 OG SER A2077 24.106 -14.317 -25.641 1.00 0.00 O ATOM 0 H SER A2077 23.608 -16.034 -23.749 1.00 0.00 H new ATOM 0 HA SER A2077 25.564 -16.615 -25.729 1.00 0.00 H new ATOM 0 HB2 SER A2077 25.149 -14.198 -23.869 1.00 0.00 H new ATOM 0 HB3 SER A2077 26.136 -14.182 -25.317 1.00 0.00 H new ATOM 0 HG SER A2077 24.005 -13.344 -25.697 1.00 0.00 H new ATOM 305 N PRO A2078 27.948 -16.294 -24.522 1.00 0.00 N ATOM 306 CA PRO A2078 29.198 -16.457 -23.773 1.00 0.00 C ATOM 307 C PRO A2078 29.395 -15.309 -22.760 1.00 0.00 C ATOM 308 O PRO A2078 28.900 -14.195 -22.956 1.00 0.00 O ATOM 309 CB PRO A2078 30.307 -16.482 -24.831 1.00 0.00 C ATOM 310 CG PRO A2078 29.731 -15.637 -25.964 1.00 0.00 C ATOM 311 CD PRO A2078 28.236 -15.953 -25.912 1.00 0.00 C ATOM 0 HA PRO A2078 29.200 -17.371 -23.179 1.00 0.00 H new ATOM 0 HB2 PRO A2078 31.237 -16.062 -24.449 1.00 0.00 H new ATOM 0 HB3 PRO A2078 30.527 -17.498 -25.159 1.00 0.00 H new ATOM 0 HG2 PRO A2078 29.923 -14.575 -25.812 1.00 0.00 H new ATOM 0 HG3 PRO A2078 30.166 -15.905 -26.927 1.00 0.00 H new ATOM 0 HD2 PRO A2078 27.644 -15.097 -26.235 1.00 0.00 H new ATOM 0 HD3 PRO A2078 27.988 -16.781 -26.577 1.00 0.00 H new ATOM 319 N SER A2079 30.128 -15.579 -21.675 1.00 0.00 N ATOM 320 CA SER A2079 30.413 -14.623 -20.590 1.00 0.00 C ATOM 321 C SER A2079 31.130 -13.356 -21.075 1.00 0.00 C ATOM 322 O SER A2079 32.236 -13.435 -21.619 1.00 0.00 O ATOM 323 CB SER A2079 31.263 -15.296 -19.502 1.00 0.00 C ATOM 324 OG SER A2079 30.618 -16.462 -19.009 1.00 0.00 O ATOM 0 H SER A2079 30.553 -16.493 -21.519 1.00 0.00 H new ATOM 0 HA SER A2079 29.447 -14.318 -20.188 1.00 0.00 H new ATOM 0 HB2 SER A2079 32.240 -15.559 -19.908 1.00 0.00 H new ATOM 0 HB3 SER A2079 31.435 -14.597 -18.684 1.00 0.00 H new ATOM 0 HG SER A2079 31.176 -16.877 -18.318 1.00 0.00 H new ATOM 330 N SER A2080 30.522 -12.180 -20.870 1.00 0.00 N ATOM 331 CA SER A2080 31.089 -10.877 -21.261 1.00 0.00 C ATOM 332 C SER A2080 30.457 -9.691 -20.508 1.00 0.00 C ATOM 333 O SER A2080 29.321 -9.803 -20.028 1.00 0.00 O ATOM 334 CB SER A2080 30.895 -10.660 -22.772 1.00 0.00 C ATOM 335 OG SER A2080 29.537 -10.404 -23.091 1.00 0.00 O ATOM 0 H SER A2080 29.609 -12.103 -20.422 1.00 0.00 H new ATOM 0 HA SER A2080 32.147 -10.908 -20.999 1.00 0.00 H new ATOM 0 HB2 SER A2080 31.511 -9.824 -23.102 1.00 0.00 H new ATOM 0 HB3 SER A2080 31.237 -11.542 -23.314 1.00 0.00 H new ATOM 0 HG SER A2080 29.448 -10.269 -24.058 1.00 0.00 H new ATOM 341 N PRO A2081 31.134 -8.522 -20.435 1.00 0.00 N ATOM 342 CA PRO A2081 30.548 -7.303 -19.863 1.00 0.00 C ATOM 343 C PRO A2081 29.254 -6.900 -20.592 1.00 0.00 C ATOM 344 O PRO A2081 28.313 -6.405 -19.973 1.00 0.00 O ATOM 345 CB PRO A2081 31.615 -6.209 -20.013 1.00 0.00 C ATOM 346 CG PRO A2081 32.919 -6.980 -20.193 1.00 0.00 C ATOM 347 CD PRO A2081 32.478 -8.245 -20.924 1.00 0.00 C ATOM 0 HA PRO A2081 30.273 -7.460 -18.820 1.00 0.00 H new ATOM 0 HB2 PRO A2081 31.410 -5.568 -20.870 1.00 0.00 H new ATOM 0 HB3 PRO A2081 31.651 -5.565 -19.134 1.00 0.00 H new ATOM 0 HG2 PRO A2081 33.646 -6.412 -20.774 1.00 0.00 H new ATOM 0 HG3 PRO A2081 33.386 -7.210 -19.235 1.00 0.00 H new ATOM 0 HD2 PRO A2081 32.481 -8.097 -22.004 1.00 0.00 H new ATOM 0 HD3 PRO A2081 33.152 -9.076 -20.714 1.00 0.00 H new ATOM 355 N GLN A2082 29.194 -7.155 -21.906 1.00 0.00 N ATOM 356 CA GLN A2082 28.034 -6.886 -22.763 1.00 0.00 C ATOM 357 C GLN A2082 26.820 -7.731 -22.343 1.00 0.00 C ATOM 358 O GLN A2082 25.712 -7.205 -22.227 1.00 0.00 O ATOM 359 CB GLN A2082 28.400 -7.157 -24.234 1.00 0.00 C ATOM 360 CG GLN A2082 29.637 -6.392 -24.742 1.00 0.00 C ATOM 361 CD GLN A2082 29.560 -4.880 -24.523 1.00 0.00 C ATOM 362 OE1 GLN A2082 28.578 -4.220 -24.840 1.00 0.00 O ATOM 363 NE2 GLN A2082 30.586 -4.271 -23.967 1.00 0.00 N ATOM 0 H GLN A2082 29.975 -7.567 -22.416 1.00 0.00 H new ATOM 0 HA GLN A2082 27.759 -5.837 -22.650 1.00 0.00 H new ATOM 0 HB2 GLN A2082 28.574 -8.226 -24.360 1.00 0.00 H new ATOM 0 HB3 GLN A2082 27.547 -6.897 -24.860 1.00 0.00 H new ATOM 0 HG2 GLN A2082 30.523 -6.778 -24.239 1.00 0.00 H new ATOM 0 HG3 GLN A2082 29.763 -6.590 -25.806 1.00 0.00 H new ATOM 0 HE21 GLN A2082 31.411 -4.806 -23.697 1.00 0.00 H new ATOM 0 HE22 GLN A2082 30.556 -3.264 -23.806 1.00 0.00 H new ATOM 372 N GLN A2083 27.024 -9.024 -22.058 1.00 0.00 N ATOM 373 CA GLN A2083 25.973 -9.925 -21.569 1.00 0.00 C ATOM 374 C GLN A2083 25.438 -9.444 -20.213 1.00 0.00 C ATOM 375 O GLN A2083 24.225 -9.320 -20.034 1.00 0.00 O ATOM 376 CB GLN A2083 26.538 -11.350 -21.448 1.00 0.00 C ATOM 377 CG GLN A2083 25.476 -12.344 -20.956 1.00 0.00 C ATOM 378 CD GLN A2083 26.052 -13.723 -20.668 1.00 0.00 C ATOM 379 OE1 GLN A2083 27.057 -13.889 -19.990 1.00 0.00 O ATOM 380 NE2 GLN A2083 25.404 -14.759 -21.137 1.00 0.00 N ATOM 0 H GLN A2083 27.932 -9.478 -22.162 1.00 0.00 H new ATOM 0 HA GLN A2083 25.145 -9.925 -22.278 1.00 0.00 H new ATOM 0 HB2 GLN A2083 26.918 -11.674 -22.417 1.00 0.00 H new ATOM 0 HB3 GLN A2083 27.382 -11.349 -20.759 1.00 0.00 H new ATOM 0 HG2 GLN A2083 25.010 -11.953 -20.052 1.00 0.00 H new ATOM 0 HG3 GLN A2083 24.691 -12.432 -21.707 1.00 0.00 H new ATOM 0 HE21 GLN A2083 24.566 -14.623 -21.702 1.00 0.00 H new ATOM 0 HE22 GLN A2083 25.737 -15.702 -20.937 1.00 0.00 H new ATOM 389 N GLN A2084 26.338 -9.149 -19.267 1.00 0.00 N ATOM 390 CA GLN A2084 25.972 -8.655 -17.937 1.00 0.00 C ATOM 391 C GLN A2084 25.156 -7.358 -18.051 1.00 0.00 C ATOM 392 O GLN A2084 24.081 -7.253 -17.458 1.00 0.00 O ATOM 393 CB GLN A2084 27.247 -8.487 -17.092 1.00 0.00 C ATOM 394 CG GLN A2084 26.944 -8.163 -15.620 1.00 0.00 C ATOM 395 CD GLN A2084 28.227 -8.099 -14.792 1.00 0.00 C ATOM 396 OE1 GLN A2084 28.817 -9.109 -14.429 1.00 0.00 O ATOM 397 NE2 GLN A2084 28.727 -6.920 -14.480 1.00 0.00 N ATOM 0 H GLN A2084 27.344 -9.247 -19.405 1.00 0.00 H new ATOM 0 HA GLN A2084 25.331 -9.376 -17.430 1.00 0.00 H new ATOM 0 HB2 GLN A2084 27.836 -9.403 -17.145 1.00 0.00 H new ATOM 0 HB3 GLN A2084 27.857 -7.690 -17.517 1.00 0.00 H new ATOM 0 HG2 GLN A2084 26.419 -7.210 -15.555 1.00 0.00 H new ATOM 0 HG3 GLN A2084 26.279 -8.922 -15.207 1.00 0.00 H new ATOM 0 HE21 GLN A2084 28.248 -6.069 -14.775 1.00 0.00 H new ATOM 0 HE22 GLN A2084 29.593 -6.859 -13.944 1.00 0.00 H new ATOM 406 N GLN A2085 25.619 -6.397 -18.858 1.00 0.00 N ATOM 407 CA GLN A2085 24.904 -5.145 -19.103 1.00 0.00 C ATOM 408 C GLN A2085 23.519 -5.387 -19.720 1.00 0.00 C ATOM 409 O GLN A2085 22.567 -4.735 -19.304 1.00 0.00 O ATOM 410 CB GLN A2085 25.761 -4.209 -19.972 1.00 0.00 C ATOM 411 CG GLN A2085 25.162 -2.796 -20.102 1.00 0.00 C ATOM 412 CD GLN A2085 25.032 -2.081 -18.755 1.00 0.00 C ATOM 413 OE1 GLN A2085 26.005 -1.836 -18.053 1.00 0.00 O ATOM 414 NE2 GLN A2085 23.838 -1.725 -18.331 1.00 0.00 N ATOM 0 H GLN A2085 26.504 -6.469 -19.360 1.00 0.00 H new ATOM 0 HA GLN A2085 24.731 -4.658 -18.143 1.00 0.00 H new ATOM 0 HB2 GLN A2085 26.760 -4.136 -19.543 1.00 0.00 H new ATOM 0 HB3 GLN A2085 25.872 -4.644 -20.965 1.00 0.00 H new ATOM 0 HG2 GLN A2085 25.789 -2.200 -20.765 1.00 0.00 H new ATOM 0 HG3 GLN A2085 24.179 -2.864 -20.568 1.00 0.00 H new ATOM 0 HE21 GLN A2085 23.015 -1.920 -18.901 1.00 0.00 H new ATOM 0 HE22 GLN A2085 23.736 -1.254 -17.432 1.00 0.00 H new ATOM 423 N GLN A2086 23.362 -6.326 -20.663 1.00 0.00 N ATOM 424 CA GLN A2086 22.046 -6.627 -21.240 1.00 0.00 C ATOM 425 C GLN A2086 21.062 -7.178 -20.205 1.00 0.00 C ATOM 426 O GLN A2086 19.923 -6.714 -20.165 1.00 0.00 O ATOM 427 CB GLN A2086 22.149 -7.576 -22.447 1.00 0.00 C ATOM 428 CG GLN A2086 22.243 -6.824 -23.781 1.00 0.00 C ATOM 429 CD GLN A2086 21.008 -5.961 -24.048 1.00 0.00 C ATOM 430 OE1 GLN A2086 21.002 -4.752 -23.848 1.00 0.00 O ATOM 431 NE2 GLN A2086 19.904 -6.542 -24.466 1.00 0.00 N ATOM 0 H GLN A2086 24.126 -6.887 -21.040 1.00 0.00 H new ATOM 0 HA GLN A2086 21.650 -5.674 -21.592 1.00 0.00 H new ATOM 0 HB2 GLN A2086 23.026 -8.213 -22.330 1.00 0.00 H new ATOM 0 HB3 GLN A2086 21.279 -8.232 -22.464 1.00 0.00 H new ATOM 0 HG2 GLN A2086 23.131 -6.192 -23.778 1.00 0.00 H new ATOM 0 HG3 GLN A2086 22.365 -7.541 -24.592 1.00 0.00 H new ATOM 0 HE21 GLN A2086 19.890 -7.547 -24.638 1.00 0.00 H new ATOM 0 HE22 GLN A2086 19.062 -5.987 -24.618 1.00 0.00 H new ATOM 440 N VAL A2087 21.467 -8.111 -19.334 1.00 0.00 N ATOM 441 CA VAL A2087 20.559 -8.605 -18.278 1.00 0.00 C ATOM 442 C VAL A2087 20.192 -7.467 -17.321 1.00 0.00 C ATOM 443 O VAL A2087 19.019 -7.316 -16.982 1.00 0.00 O ATOM 444 CB VAL A2087 21.116 -9.835 -17.541 1.00 0.00 C ATOM 445 CG1 VAL A2087 20.142 -10.321 -16.460 1.00 0.00 C ATOM 446 CG2 VAL A2087 21.318 -10.982 -18.541 1.00 0.00 C ATOM 0 H VAL A2087 22.395 -8.534 -19.333 1.00 0.00 H new ATOM 0 HA VAL A2087 19.645 -8.950 -18.761 1.00 0.00 H new ATOM 0 HB VAL A2087 22.059 -9.547 -17.077 1.00 0.00 H new ATOM 0 HG11 VAL A2087 20.562 -11.191 -15.956 1.00 0.00 H new ATOM 0 HG12 VAL A2087 19.978 -9.525 -15.734 1.00 0.00 H new ATOM 0 HG13 VAL A2087 19.192 -10.592 -16.921 1.00 0.00 H new ATOM 0 HG21 VAL A2087 21.713 -11.854 -18.020 1.00 0.00 H new ATOM 0 HG22 VAL A2087 20.363 -11.236 -19.001 1.00 0.00 H new ATOM 0 HG23 VAL A2087 22.022 -10.672 -19.313 1.00 0.00 H new ATOM 456 N LEU A2088 21.148 -6.605 -16.953 1.00 0.00 N ATOM 457 CA LEU A2088 20.869 -5.411 -16.145 1.00 0.00 C ATOM 458 C LEU A2088 19.895 -4.463 -16.869 1.00 0.00 C ATOM 459 O LEU A2088 18.989 -3.943 -16.230 1.00 0.00 O ATOM 460 CB LEU A2088 22.184 -4.697 -15.781 1.00 0.00 C ATOM 461 CG LEU A2088 23.085 -5.483 -14.809 1.00 0.00 C ATOM 462 CD1 LEU A2088 24.420 -4.754 -14.646 1.00 0.00 C ATOM 463 CD2 LEU A2088 22.445 -5.649 -13.430 1.00 0.00 C ATOM 0 H LEU A2088 22.130 -6.714 -17.205 1.00 0.00 H new ATOM 0 HA LEU A2088 20.384 -5.725 -15.221 1.00 0.00 H new ATOM 0 HB2 LEU A2088 22.742 -4.500 -16.696 1.00 0.00 H new ATOM 0 HB3 LEU A2088 21.948 -3.730 -15.337 1.00 0.00 H new ATOM 0 HG LEU A2088 23.233 -6.475 -15.236 1.00 0.00 H new ATOM 0 HD11 LEU A2088 25.057 -5.310 -13.958 1.00 0.00 H new ATOM 0 HD12 LEU A2088 24.913 -4.677 -15.615 1.00 0.00 H new ATOM 0 HD13 LEU A2088 24.243 -3.755 -14.248 1.00 0.00 H new ATOM 0 HD21 LEU A2088 23.118 -6.209 -12.781 1.00 0.00 H new ATOM 0 HD22 LEU A2088 22.256 -4.667 -12.996 1.00 0.00 H new ATOM 0 HD23 LEU A2088 21.503 -6.189 -13.529 1.00 0.00 H new ATOM 475 N ASN A2089 20.017 -4.273 -18.190 1.00 0.00 N ATOM 476 CA ASN A2089 19.095 -3.442 -18.981 1.00 0.00 C ATOM 477 C ASN A2089 17.661 -4.012 -18.934 1.00 0.00 C ATOM 478 O ASN A2089 16.702 -3.279 -18.688 1.00 0.00 O ATOM 479 CB ASN A2089 19.577 -3.328 -20.445 1.00 0.00 C ATOM 480 CG ASN A2089 20.877 -2.567 -20.654 1.00 0.00 C ATOM 481 OD1 ASN A2089 21.352 -1.815 -19.813 1.00 0.00 O ATOM 482 ND2 ASN A2089 21.505 -2.729 -21.798 1.00 0.00 N ATOM 0 H ASN A2089 20.763 -4.694 -18.745 1.00 0.00 H new ATOM 0 HA ASN A2089 19.084 -2.445 -18.541 1.00 0.00 H new ATOM 0 HB2 ASN A2089 19.697 -4.334 -20.848 1.00 0.00 H new ATOM 0 HB3 ASN A2089 18.795 -2.842 -21.029 1.00 0.00 H new ATOM 0 HD21 ASN A2089 22.377 -2.231 -21.976 1.00 0.00 H new ATOM 0 HD22 ASN A2089 21.120 -3.353 -22.507 1.00 0.00 H new ATOM 489 N ILE A2090 17.516 -5.326 -19.143 1.00 0.00 N ATOM 490 CA ILE A2090 16.234 -6.055 -19.107 1.00 0.00 C ATOM 491 C ILE A2090 15.585 -5.947 -17.716 1.00 0.00 C ATOM 492 O ILE A2090 14.388 -5.665 -17.603 1.00 0.00 O ATOM 493 CB ILE A2090 16.470 -7.525 -19.542 1.00 0.00 C ATOM 494 CG1 ILE A2090 16.901 -7.583 -21.029 1.00 0.00 C ATOM 495 CG2 ILE A2090 15.216 -8.396 -19.337 1.00 0.00 C ATOM 496 CD1 ILE A2090 17.641 -8.871 -21.411 1.00 0.00 C ATOM 0 H ILE A2090 18.309 -5.933 -19.348 1.00 0.00 H new ATOM 0 HA ILE A2090 15.532 -5.606 -19.809 1.00 0.00 H new ATOM 0 HB ILE A2090 17.265 -7.923 -18.911 1.00 0.00 H new ATOM 0 HG12 ILE A2090 16.016 -7.484 -21.658 1.00 0.00 H new ATOM 0 HG13 ILE A2090 17.543 -6.729 -21.245 1.00 0.00 H new ATOM 0 HG21 ILE A2090 15.426 -9.417 -19.655 1.00 0.00 H new ATOM 0 HG22 ILE A2090 14.940 -8.394 -18.283 1.00 0.00 H new ATOM 0 HG23 ILE A2090 14.393 -7.994 -19.929 1.00 0.00 H new ATOM 0 HD11 ILE A2090 17.910 -8.837 -22.467 1.00 0.00 H new ATOM 0 HD12 ILE A2090 18.545 -8.963 -20.809 1.00 0.00 H new ATOM 0 HD13 ILE A2090 16.995 -9.730 -21.229 1.00 0.00 H new ATOM 508 N LEU A2091 16.372 -6.123 -16.649 1.00 0.00 N ATOM 509 CA LEU A2091 15.915 -6.003 -15.262 1.00 0.00 C ATOM 510 C LEU A2091 15.550 -4.554 -14.893 1.00 0.00 C ATOM 511 O LEU A2091 14.500 -4.328 -14.292 1.00 0.00 O ATOM 512 CB LEU A2091 16.995 -6.568 -14.327 1.00 0.00 C ATOM 513 CG LEU A2091 17.161 -8.099 -14.357 1.00 0.00 C ATOM 514 CD1 LEU A2091 18.321 -8.497 -13.441 1.00 0.00 C ATOM 515 CD2 LEU A2091 15.910 -8.838 -13.878 1.00 0.00 C ATOM 0 H LEU A2091 17.362 -6.357 -16.728 1.00 0.00 H new ATOM 0 HA LEU A2091 14.999 -6.582 -15.146 1.00 0.00 H new ATOM 0 HB2 LEU A2091 17.950 -6.111 -14.585 1.00 0.00 H new ATOM 0 HB3 LEU A2091 16.762 -6.265 -13.306 1.00 0.00 H new ATOM 0 HG LEU A2091 17.348 -8.378 -15.394 1.00 0.00 H new ATOM 0 HD11 LEU A2091 18.443 -9.580 -13.458 1.00 0.00 H new ATOM 0 HD12 LEU A2091 19.239 -8.023 -13.789 1.00 0.00 H new ATOM 0 HD13 LEU A2091 18.108 -8.172 -12.423 1.00 0.00 H new ATOM 0 HD21 LEU A2091 16.084 -9.913 -13.920 1.00 0.00 H new ATOM 0 HD22 LEU A2091 15.686 -8.547 -12.852 1.00 0.00 H new ATOM 0 HD23 LEU A2091 15.067 -8.581 -14.520 1.00 0.00 H new ATOM 527 N LYS A2092 16.349 -3.556 -15.297 1.00 0.00 N ATOM 528 CA LYS A2092 16.057 -2.120 -15.090 1.00 0.00 C ATOM 529 C LYS A2092 14.792 -1.669 -15.836 1.00 0.00 C ATOM 530 O LYS A2092 14.154 -0.704 -15.419 1.00 0.00 O ATOM 531 CB LYS A2092 17.272 -1.263 -15.495 1.00 0.00 C ATOM 532 CG LYS A2092 18.415 -1.291 -14.460 1.00 0.00 C ATOM 533 CD LYS A2092 18.138 -0.517 -13.158 1.00 0.00 C ATOM 534 CE LYS A2092 17.964 0.989 -13.407 1.00 0.00 C ATOM 535 NZ LYS A2092 17.785 1.743 -12.139 1.00 0.00 N ATOM 0 H LYS A2092 17.230 -3.720 -15.784 1.00 0.00 H new ATOM 0 HA LYS A2092 15.863 -1.976 -14.027 1.00 0.00 H new ATOM 0 HB2 LYS A2092 17.652 -1.615 -16.454 1.00 0.00 H new ATOM 0 HB3 LYS A2092 16.948 -0.232 -15.639 1.00 0.00 H new ATOM 0 HG2 LYS A2092 18.630 -2.329 -14.208 1.00 0.00 H new ATOM 0 HG3 LYS A2092 19.313 -0.882 -14.923 1.00 0.00 H new ATOM 0 HD2 LYS A2092 17.238 -0.912 -12.686 1.00 0.00 H new ATOM 0 HD3 LYS A2092 18.960 -0.676 -12.460 1.00 0.00 H new ATOM 0 HE2 LYS A2092 18.836 1.372 -13.937 1.00 0.00 H new ATOM 0 HE3 LYS A2092 17.101 1.153 -14.052 1.00 0.00 H new ATOM 0 HZ1 LYS A2092 17.671 2.755 -12.350 1.00 0.00 H new ATOM 0 HZ2 LYS A2092 16.939 1.395 -11.645 1.00 0.00 H new ATOM 0 HZ3 LYS A2092 18.620 1.608 -11.534 1.00 0.00 H new ATOM 549 N SER A2093 14.398 -2.387 -16.891 1.00 0.00 N ATOM 550 CA SER A2093 13.147 -2.160 -17.635 1.00 0.00 C ATOM 551 C SER A2093 11.926 -2.793 -16.934 1.00 0.00 C ATOM 552 O SER A2093 10.786 -2.544 -17.330 1.00 0.00 O ATOM 553 CB SER A2093 13.258 -2.710 -19.064 1.00 0.00 C ATOM 554 OG SER A2093 14.342 -2.112 -19.759 1.00 0.00 O ATOM 0 H SER A2093 14.949 -3.160 -17.263 1.00 0.00 H new ATOM 0 HA SER A2093 12.994 -1.081 -17.668 1.00 0.00 H new ATOM 0 HB2 SER A2093 13.395 -3.791 -19.031 1.00 0.00 H new ATOM 0 HB3 SER A2093 12.329 -2.522 -19.602 1.00 0.00 H new ATOM 0 HG SER A2093 15.187 -2.480 -19.426 1.00 0.00 H new ATOM 560 N ASN A2094 12.149 -3.589 -15.878 1.00 0.00 N ATOM 561 CA ASN A2094 11.145 -4.274 -15.053 1.00 0.00 C ATOM 562 C ASN A2094 11.522 -4.181 -13.544 1.00 0.00 C ATOM 563 O ASN A2094 11.717 -5.220 -12.901 1.00 0.00 O ATOM 564 CB ASN A2094 11.028 -5.736 -15.544 1.00 0.00 C ATOM 565 CG ASN A2094 10.549 -5.860 -16.980 1.00 0.00 C ATOM 566 OD1 ASN A2094 9.359 -5.948 -17.256 1.00 0.00 O ATOM 567 ND2 ASN A2094 11.456 -5.890 -17.933 1.00 0.00 N ATOM 0 H ASN A2094 13.098 -3.784 -15.557 1.00 0.00 H new ATOM 0 HA ASN A2094 10.172 -3.794 -15.155 1.00 0.00 H new ATOM 0 HB2 ASN A2094 12.000 -6.220 -15.451 1.00 0.00 H new ATOM 0 HB3 ASN A2094 10.340 -6.275 -14.893 1.00 0.00 H new ATOM 0 HD21 ASN A2094 11.169 -5.987 -18.907 1.00 0.00 H new ATOM 0 HD22 ASN A2094 12.446 -5.816 -17.698 1.00 0.00 H new ATOM 574 N PRO A2095 11.662 -2.970 -12.953 1.00 0.00 N ATOM 575 CA PRO A2095 12.100 -2.791 -11.559 1.00 0.00 C ATOM 576 C PRO A2095 11.340 -3.607 -10.508 1.00 0.00 C ATOM 577 O PRO A2095 11.928 -4.015 -9.509 1.00 0.00 O ATOM 578 CB PRO A2095 11.959 -1.296 -11.254 1.00 0.00 C ATOM 579 CG PRO A2095 12.073 -0.637 -12.621 1.00 0.00 C ATOM 580 CD PRO A2095 11.431 -1.658 -13.554 1.00 0.00 C ATOM 0 HA PRO A2095 13.122 -3.162 -11.487 1.00 0.00 H new ATOM 0 HB2 PRO A2095 11.003 -1.072 -10.780 1.00 0.00 H new ATOM 0 HB3 PRO A2095 12.740 -0.950 -10.576 1.00 0.00 H new ATOM 0 HG2 PRO A2095 11.552 0.320 -12.651 1.00 0.00 H new ATOM 0 HG3 PRO A2095 13.112 -0.443 -12.889 1.00 0.00 H new ATOM 0 HD2 PRO A2095 10.364 -1.465 -13.666 1.00 0.00 H new ATOM 0 HD3 PRO A2095 11.871 -1.604 -14.550 1.00 0.00 H new ATOM 588 N GLN A2096 10.046 -3.850 -10.731 1.00 0.00 N ATOM 589 CA GLN A2096 9.141 -4.575 -9.830 1.00 0.00 C ATOM 590 C GLN A2096 9.709 -5.933 -9.382 1.00 0.00 C ATOM 591 O GLN A2096 9.747 -6.226 -8.184 1.00 0.00 O ATOM 592 CB GLN A2096 7.785 -4.797 -10.534 1.00 0.00 C ATOM 593 CG GLN A2096 6.921 -3.552 -10.802 1.00 0.00 C ATOM 594 CD GLN A2096 7.565 -2.537 -11.747 1.00 0.00 C ATOM 595 OE1 GLN A2096 8.123 -1.528 -11.340 1.00 0.00 O ATOM 596 NE2 GLN A2096 7.553 -2.775 -13.039 1.00 0.00 N ATOM 0 H GLN A2096 9.578 -3.534 -11.581 1.00 0.00 H new ATOM 0 HA GLN A2096 9.018 -3.963 -8.936 1.00 0.00 H new ATOM 0 HB2 GLN A2096 7.976 -5.288 -11.488 1.00 0.00 H new ATOM 0 HB3 GLN A2096 7.200 -5.491 -9.930 1.00 0.00 H new ATOM 0 HG2 GLN A2096 5.967 -3.869 -11.222 1.00 0.00 H new ATOM 0 HG3 GLN A2096 6.704 -3.062 -9.853 1.00 0.00 H new ATOM 0 HE21 GLN A2096 7.093 -3.611 -13.399 1.00 0.00 H new ATOM 0 HE22 GLN A2096 8.004 -2.124 -13.682 1.00 0.00 H new ATOM 605 N LEU A2097 10.168 -6.752 -10.336 1.00 0.00 N ATOM 606 CA LEU A2097 10.747 -8.072 -10.063 1.00 0.00 C ATOM 607 C LEU A2097 12.238 -8.022 -9.686 1.00 0.00 C ATOM 608 O LEU A2097 12.700 -8.860 -8.910 1.00 0.00 O ATOM 609 CB LEU A2097 10.403 -9.053 -11.206 1.00 0.00 C ATOM 610 CG LEU A2097 10.691 -8.649 -12.671 1.00 0.00 C ATOM 611 CD1 LEU A2097 12.178 -8.618 -13.033 1.00 0.00 C ATOM 612 CD2 LEU A2097 10.035 -9.667 -13.607 1.00 0.00 C ATOM 0 H LEU A2097 10.148 -6.515 -11.328 1.00 0.00 H new ATOM 0 HA LEU A2097 10.281 -8.466 -9.160 1.00 0.00 H new ATOM 0 HB2 LEU A2097 10.940 -9.981 -11.012 1.00 0.00 H new ATOM 0 HB3 LEU A2097 9.339 -9.279 -11.133 1.00 0.00 H new ATOM 0 HG LEU A2097 10.294 -7.640 -12.781 1.00 0.00 H new ATOM 0 HD11 LEU A2097 12.292 -8.326 -14.077 1.00 0.00 H new ATOM 0 HD12 LEU A2097 12.693 -7.898 -12.396 1.00 0.00 H new ATOM 0 HD13 LEU A2097 12.609 -9.608 -12.884 1.00 0.00 H new ATOM 0 HD21 LEU A2097 10.233 -9.390 -14.642 1.00 0.00 H new ATOM 0 HD22 LEU A2097 10.445 -10.658 -13.412 1.00 0.00 H new ATOM 0 HD23 LEU A2097 8.959 -9.679 -13.434 1.00 0.00 H new ATOM 624 N MET A2098 12.985 -7.025 -10.175 1.00 0.00 N ATOM 625 CA MET A2098 14.411 -6.868 -9.873 1.00 0.00 C ATOM 626 C MET A2098 14.646 -6.406 -8.429 1.00 0.00 C ATOM 627 O MET A2098 15.420 -7.025 -7.699 1.00 0.00 O ATOM 628 CB MET A2098 15.034 -5.857 -10.846 1.00 0.00 C ATOM 629 CG MET A2098 16.559 -5.806 -10.681 1.00 0.00 C ATOM 630 SD MET A2098 17.333 -4.321 -11.374 1.00 0.00 S ATOM 631 CE MET A2098 17.758 -3.515 -9.811 1.00 0.00 C ATOM 0 H MET A2098 12.615 -6.303 -10.793 1.00 0.00 H new ATOM 0 HA MET A2098 14.884 -7.843 -9.989 1.00 0.00 H new ATOM 0 HB2 MET A2098 14.784 -6.131 -11.871 1.00 0.00 H new ATOM 0 HB3 MET A2098 14.612 -4.868 -10.669 1.00 0.00 H new ATOM 0 HG2 MET A2098 16.800 -5.866 -9.620 1.00 0.00 H new ATOM 0 HG3 MET A2098 16.994 -6.685 -11.157 1.00 0.00 H new ATOM 0 HE1 MET A2098 18.253 -2.566 -10.014 1.00 0.00 H new ATOM 0 HE2 MET A2098 16.850 -3.335 -9.236 1.00 0.00 H new ATOM 0 HE3 MET A2098 18.427 -4.159 -9.240 1.00 0.00 H new ATOM 641 N ALA A2099 13.983 -5.322 -8.013 1.00 0.00 N ATOM 642 CA ALA A2099 14.116 -4.733 -6.683 1.00 0.00 C ATOM 643 C ALA A2099 13.691 -5.705 -5.568 1.00 0.00 C ATOM 644 O ALA A2099 14.343 -5.775 -4.525 1.00 0.00 O ATOM 645 CB ALA A2099 13.341 -3.416 -6.656 1.00 0.00 C ATOM 0 H ALA A2099 13.324 -4.820 -8.608 1.00 0.00 H new ATOM 0 HA ALA A2099 15.167 -4.525 -6.481 1.00 0.00 H new ATOM 0 HB1 ALA A2099 13.430 -2.962 -5.669 1.00 0.00 H new ATOM 0 HB2 ALA A2099 13.750 -2.738 -7.405 1.00 0.00 H new ATOM 0 HB3 ALA A2099 12.290 -3.608 -6.874 1.00 0.00 H new ATOM 651 N ALA A2100 12.639 -6.499 -5.804 1.00 0.00 N ATOM 652 CA ALA A2100 12.189 -7.521 -4.862 1.00 0.00 C ATOM 653 C ALA A2100 13.246 -8.631 -4.682 1.00 0.00 C ATOM 654 O ALA A2100 13.504 -9.062 -3.557 1.00 0.00 O ATOM 655 CB ALA A2100 10.854 -8.084 -5.359 1.00 0.00 C ATOM 0 H ALA A2100 12.079 -6.448 -6.655 1.00 0.00 H new ATOM 0 HA ALA A2100 12.049 -7.074 -3.878 1.00 0.00 H new ATOM 0 HB1 ALA A2100 10.502 -8.849 -4.668 1.00 0.00 H new ATOM 0 HB2 ALA A2100 10.119 -7.281 -5.416 1.00 0.00 H new ATOM 0 HB3 ALA A2100 10.990 -8.523 -6.348 1.00 0.00 H new ATOM 661 N PHE A2101 13.885 -9.074 -5.774 1.00 0.00 N ATOM 662 CA PHE A2101 14.929 -10.102 -5.741 1.00 0.00 C ATOM 663 C PHE A2101 16.229 -9.605 -5.096 1.00 0.00 C ATOM 664 O PHE A2101 16.731 -10.244 -4.170 1.00 0.00 O ATOM 665 CB PHE A2101 15.198 -10.593 -7.173 1.00 0.00 C ATOM 666 CG PHE A2101 16.435 -11.465 -7.302 1.00 0.00 C ATOM 667 CD1 PHE A2101 16.387 -12.822 -6.931 1.00 0.00 C ATOM 668 CD2 PHE A2101 17.647 -10.909 -7.765 1.00 0.00 C ATOM 669 CE1 PHE A2101 17.537 -13.625 -7.031 1.00 0.00 C ATOM 670 CE2 PHE A2101 18.796 -11.717 -7.866 1.00 0.00 C ATOM 671 CZ PHE A2101 18.741 -13.074 -7.502 1.00 0.00 C ATOM 0 H PHE A2101 13.688 -8.724 -6.712 1.00 0.00 H new ATOM 0 HA PHE A2101 14.569 -10.923 -5.121 1.00 0.00 H new ATOM 0 HB2 PHE A2101 14.332 -11.154 -7.523 1.00 0.00 H new ATOM 0 HB3 PHE A2101 15.304 -9.729 -7.829 1.00 0.00 H new ATOM 0 HD1 PHE A2101 15.463 -13.248 -6.568 1.00 0.00 H new ATOM 0 HD2 PHE A2101 17.693 -9.866 -8.041 1.00 0.00 H new ATOM 0 HE1 PHE A2101 17.495 -14.666 -6.746 1.00 0.00 H new ATOM 0 HE2 PHE A2101 19.722 -11.293 -8.224 1.00 0.00 H new ATOM 0 HZ PHE A2101 19.623 -13.692 -7.584 1.00 0.00 H new ATOM 681 N ILE A2102 16.785 -8.474 -5.552 1.00 0.00 N ATOM 682 CA ILE A2102 18.072 -7.959 -5.049 1.00 0.00 C ATOM 683 C ILE A2102 18.062 -7.713 -3.540 1.00 0.00 C ATOM 684 O ILE A2102 19.000 -8.118 -2.854 1.00 0.00 O ATOM 685 CB ILE A2102 18.548 -6.739 -5.870 1.00 0.00 C ATOM 686 CG1 ILE A2102 20.061 -6.468 -5.705 1.00 0.00 C ATOM 687 CG2 ILE A2102 17.696 -5.481 -5.636 1.00 0.00 C ATOM 688 CD1 ILE A2102 20.504 -5.595 -4.518 1.00 0.00 C ATOM 0 H ILE A2102 16.361 -7.892 -6.275 1.00 0.00 H new ATOM 0 HA ILE A2102 18.816 -8.742 -5.198 1.00 0.00 H new ATOM 0 HB ILE A2102 18.394 -7.009 -6.915 1.00 0.00 H new ATOM 0 HG12 ILE A2102 20.567 -7.430 -5.622 1.00 0.00 H new ATOM 0 HG13 ILE A2102 20.420 -5.997 -6.620 1.00 0.00 H new ATOM 0 HG21 ILE A2102 18.083 -4.662 -6.242 1.00 0.00 H new ATOM 0 HG22 ILE A2102 16.663 -5.684 -5.918 1.00 0.00 H new ATOM 0 HG23 ILE A2102 17.737 -5.204 -4.582 1.00 0.00 H new ATOM 0 HD11 ILE A2102 21.589 -5.490 -4.528 1.00 0.00 H new ATOM 0 HD12 ILE A2102 20.044 -4.610 -4.599 1.00 0.00 H new ATOM 0 HD13 ILE A2102 20.194 -6.065 -3.585 1.00 0.00 H new ATOM 700 N LYS A2103 16.989 -7.122 -2.998 1.00 0.00 N ATOM 701 CA LYS A2103 16.839 -6.862 -1.555 1.00 0.00 C ATOM 702 C LYS A2103 16.859 -8.135 -0.692 1.00 0.00 C ATOM 703 O LYS A2103 17.161 -8.050 0.495 1.00 0.00 O ATOM 704 CB LYS A2103 15.580 -6.017 -1.309 1.00 0.00 C ATOM 705 CG LYS A2103 15.809 -4.549 -1.703 1.00 0.00 C ATOM 706 CD LYS A2103 14.553 -3.663 -1.619 1.00 0.00 C ATOM 707 CE LYS A2103 14.061 -3.344 -0.196 1.00 0.00 C ATOM 708 NZ LYS A2103 13.199 -4.407 0.385 1.00 0.00 N ATOM 0 H LYS A2103 16.192 -6.807 -3.551 1.00 0.00 H new ATOM 0 HA LYS A2103 17.715 -6.298 -1.235 1.00 0.00 H new ATOM 0 HB2 LYS A2103 14.748 -6.425 -1.883 1.00 0.00 H new ATOM 0 HB3 LYS A2103 15.300 -6.074 -0.257 1.00 0.00 H new ATOM 0 HG2 LYS A2103 16.579 -4.128 -1.056 1.00 0.00 H new ATOM 0 HG3 LYS A2103 16.195 -4.515 -2.722 1.00 0.00 H new ATOM 0 HD2 LYS A2103 14.757 -2.724 -2.133 1.00 0.00 H new ATOM 0 HD3 LYS A2103 13.746 -4.155 -2.162 1.00 0.00 H new ATOM 0 HE2 LYS A2103 14.924 -3.192 0.453 1.00 0.00 H new ATOM 0 HE3 LYS A2103 13.506 -2.406 -0.214 1.00 0.00 H new ATOM 0 HZ1 LYS A2103 12.486 -3.975 1.007 1.00 0.00 H new ATOM 0 HZ2 LYS A2103 12.722 -4.925 -0.381 1.00 0.00 H new ATOM 0 HZ3 LYS A2103 13.785 -5.066 0.936 1.00 0.00 H new ATOM 722 N GLN A2104 16.609 -9.308 -1.281 1.00 0.00 N ATOM 723 CA GLN A2104 16.712 -10.606 -0.603 1.00 0.00 C ATOM 724 C GLN A2104 18.057 -11.291 -0.916 1.00 0.00 C ATOM 725 O GLN A2104 18.701 -11.814 -0.006 1.00 0.00 O ATOM 726 CB GLN A2104 15.532 -11.509 -0.995 1.00 0.00 C ATOM 727 CG GLN A2104 14.166 -10.928 -0.578 1.00 0.00 C ATOM 728 CD GLN A2104 13.043 -11.965 -0.649 1.00 0.00 C ATOM 729 OE1 GLN A2104 13.222 -13.142 -0.371 1.00 0.00 O ATOM 730 NE2 GLN A2104 11.836 -11.590 -1.008 1.00 0.00 N ATOM 0 H GLN A2104 16.325 -9.385 -2.258 1.00 0.00 H new ATOM 0 HA GLN A2104 16.672 -10.433 0.472 1.00 0.00 H new ATOM 0 HB2 GLN A2104 15.542 -11.662 -2.074 1.00 0.00 H new ATOM 0 HB3 GLN A2104 15.661 -12.488 -0.533 1.00 0.00 H new ATOM 0 HG2 GLN A2104 14.235 -10.540 0.438 1.00 0.00 H new ATOM 0 HG3 GLN A2104 13.920 -10.086 -1.225 1.00 0.00 H new ATOM 0 HE21 GLN A2104 11.655 -10.615 -1.246 1.00 0.00 H new ATOM 0 HE22 GLN A2104 11.080 -12.274 -1.049 1.00 0.00 H new ATOM 739 N ARG A2105 18.517 -11.258 -2.176 1.00 0.00 N ATOM 740 CA ARG A2105 19.800 -11.831 -2.634 1.00 0.00 C ATOM 741 C ARG A2105 21.018 -11.169 -1.981 1.00 0.00 C ATOM 742 O ARG A2105 21.989 -11.854 -1.664 1.00 0.00 O ATOM 743 CB ARG A2105 19.855 -11.733 -4.173 1.00 0.00 C ATOM 744 CG ARG A2105 21.132 -12.288 -4.831 1.00 0.00 C ATOM 745 CD ARG A2105 21.365 -13.782 -4.568 1.00 0.00 C ATOM 746 NE ARG A2105 22.538 -14.262 -5.318 1.00 0.00 N ATOM 747 CZ ARG A2105 23.137 -15.433 -5.247 1.00 0.00 C ATOM 748 NH1 ARG A2105 22.736 -16.393 -4.462 1.00 0.00 N ATOM 749 NH2 ARG A2105 24.175 -15.634 -6.000 1.00 0.00 N ATOM 0 H ARG A2105 17.992 -10.818 -2.932 1.00 0.00 H new ATOM 0 HA ARG A2105 19.845 -12.875 -2.325 1.00 0.00 H new ATOM 0 HB2 ARG A2105 18.996 -12.264 -4.584 1.00 0.00 H new ATOM 0 HB3 ARG A2105 19.748 -10.686 -4.456 1.00 0.00 H new ATOM 0 HG2 ARG A2105 21.077 -12.122 -5.907 1.00 0.00 H new ATOM 0 HG3 ARG A2105 21.992 -11.726 -4.466 1.00 0.00 H new ATOM 0 HD2 ARG A2105 21.514 -13.950 -3.501 1.00 0.00 H new ATOM 0 HD3 ARG A2105 20.482 -14.351 -4.860 1.00 0.00 H new ATOM 0 HE ARG A2105 22.940 -13.599 -5.981 1.00 0.00 H new ATOM 0 HH11 ARG A2105 21.921 -16.256 -3.864 1.00 0.00 H new ATOM 0 HH12 ARG A2105 23.237 -17.281 -4.446 1.00 0.00 H new ATOM 0 HH21 ARG A2105 24.504 -14.896 -6.623 1.00 0.00 H new ATOM 0 HH22 ARG A2105 24.662 -16.530 -5.969 1.00 0.00 H new ATOM 763 N THR A2106 20.974 -9.854 -1.750 1.00 0.00 N ATOM 764 CA THR A2106 22.067 -9.086 -1.119 1.00 0.00 C ATOM 765 C THR A2106 22.468 -9.632 0.261 1.00 0.00 C ATOM 766 O THR A2106 23.644 -9.598 0.627 1.00 0.00 O ATOM 767 CB THR A2106 21.743 -7.582 -1.088 1.00 0.00 C ATOM 768 OG1 THR A2106 22.909 -6.849 -0.791 1.00 0.00 O ATOM 769 CG2 THR A2106 20.673 -7.189 -0.069 1.00 0.00 C ATOM 0 H THR A2106 20.169 -9.278 -1.997 1.00 0.00 H new ATOM 0 HA THR A2106 22.949 -9.217 -1.746 1.00 0.00 H new ATOM 0 HB THR A2106 21.352 -7.351 -2.079 1.00 0.00 H new ATOM 0 HG1 THR A2106 22.698 -5.892 -0.774 1.00 0.00 H new ATOM 0 HG21 THR A2106 20.506 -6.113 -0.113 1.00 0.00 H new ATOM 0 HG22 THR A2106 19.743 -7.710 -0.298 1.00 0.00 H new ATOM 0 HG23 THR A2106 21.006 -7.464 0.932 1.00 0.00 H new ATOM 777 N ALA A2107 21.526 -10.241 0.998 1.00 0.00 N ATOM 778 CA ALA A2107 21.772 -10.896 2.288 1.00 0.00 C ATOM 779 C ALA A2107 22.751 -12.097 2.209 1.00 0.00 C ATOM 780 O ALA A2107 23.246 -12.557 3.242 1.00 0.00 O ATOM 781 CB ALA A2107 20.419 -11.319 2.879 1.00 0.00 C ATOM 0 H ALA A2107 20.550 -10.292 0.705 1.00 0.00 H new ATOM 0 HA ALA A2107 22.270 -10.177 2.938 1.00 0.00 H new ATOM 0 HB1 ALA A2107 20.579 -11.809 3.840 1.00 0.00 H new ATOM 0 HB2 ALA A2107 19.792 -10.438 3.020 1.00 0.00 H new ATOM 0 HB3 ALA A2107 19.924 -12.011 2.197 1.00 0.00 H new ATOM 787 N LYS A2108 23.050 -12.591 0.994 1.00 0.00 N ATOM 788 CA LYS A2108 23.975 -13.704 0.695 1.00 0.00 C ATOM 789 C LYS A2108 25.181 -13.261 -0.165 1.00 0.00 C ATOM 790 O LYS A2108 26.062 -14.063 -0.467 1.00 0.00 O ATOM 791 CB LYS A2108 23.147 -14.845 0.065 1.00 0.00 C ATOM 792 CG LYS A2108 23.802 -16.239 0.034 1.00 0.00 C ATOM 793 CD LYS A2108 24.201 -16.758 1.424 1.00 0.00 C ATOM 794 CE LYS A2108 24.653 -18.221 1.338 1.00 0.00 C ATOM 795 NZ LYS A2108 25.044 -18.752 2.671 1.00 0.00 N ATOM 0 H LYS A2108 22.631 -12.205 0.148 1.00 0.00 H new ATOM 0 HA LYS A2108 24.436 -14.067 1.614 1.00 0.00 H new ATOM 0 HB2 LYS A2108 22.206 -14.923 0.609 1.00 0.00 H new ATOM 0 HB3 LYS A2108 22.901 -14.562 -0.958 1.00 0.00 H new ATOM 0 HG2 LYS A2108 23.111 -16.946 -0.425 1.00 0.00 H new ATOM 0 HG3 LYS A2108 24.688 -16.202 -0.600 1.00 0.00 H new ATOM 0 HD2 LYS A2108 25.005 -16.145 1.831 1.00 0.00 H new ATOM 0 HD3 LYS A2108 23.357 -16.671 2.108 1.00 0.00 H new ATOM 0 HE2 LYS A2108 23.847 -18.828 0.926 1.00 0.00 H new ATOM 0 HE3 LYS A2108 25.496 -18.302 0.652 1.00 0.00 H new ATOM 0 HZ1 LYS A2108 25.344 -19.743 2.575 1.00 0.00 H new ATOM 0 HZ2 LYS A2108 25.830 -18.188 3.053 1.00 0.00 H new ATOM 0 HZ3 LYS A2108 24.232 -18.697 3.318 1.00 0.00 H new ATOM 1019 N THR B 18 10.496 -22.471 -12.589 1.00 0.00 N ATOM 1020 CA THR B 18 11.788 -21.805 -12.852 1.00 0.00 C ATOM 1021 C THR B 18 11.717 -20.300 -12.524 1.00 0.00 C ATOM 1022 O THR B 18 10.756 -19.827 -11.910 1.00 0.00 O ATOM 1023 CB THR B 18 12.210 -22.028 -14.320 1.00 0.00 C ATOM 1024 OG1 THR B 18 11.234 -21.523 -15.201 1.00 0.00 O ATOM 1025 CG2 THR B 18 12.450 -23.498 -14.667 1.00 0.00 C ATOM 0 HA THR B 18 12.541 -22.248 -12.200 1.00 0.00 H new ATOM 0 HB THR B 18 13.153 -21.494 -14.435 1.00 0.00 H new ATOM 0 HG1 THR B 18 10.364 -21.506 -14.750 1.00 0.00 H new ATOM 0 HG21 THR B 18 12.743 -23.582 -15.713 1.00 0.00 H new ATOM 0 HG22 THR B 18 13.244 -23.896 -14.035 1.00 0.00 H new ATOM 0 HG23 THR B 18 11.534 -24.065 -14.500 1.00 0.00 H new ATOM 1033 N PHE B 19 12.741 -19.530 -12.911 1.00 0.00 N ATOM 1034 CA PHE B 19 12.891 -18.079 -12.709 1.00 0.00 C ATOM 1035 C PHE B 19 11.605 -17.233 -12.792 1.00 0.00 C ATOM 1036 O PHE B 19 11.393 -16.370 -11.939 1.00 0.00 O ATOM 1037 CB PHE B 19 13.976 -17.552 -13.667 1.00 0.00 C ATOM 1038 CG PHE B 19 13.554 -17.302 -15.103 1.00 0.00 C ATOM 1039 CD1 PHE B 19 12.957 -18.319 -15.877 1.00 0.00 C ATOM 1040 CD2 PHE B 19 13.767 -16.033 -15.670 1.00 0.00 C ATOM 1041 CE1 PHE B 19 12.539 -18.054 -17.190 1.00 0.00 C ATOM 1042 CE2 PHE B 19 13.383 -15.779 -16.998 1.00 0.00 C ATOM 1043 CZ PHE B 19 12.760 -16.788 -17.752 1.00 0.00 C ATOM 0 H PHE B 19 13.540 -19.927 -13.406 1.00 0.00 H new ATOM 0 HA PHE B 19 13.188 -17.958 -11.667 1.00 0.00 H new ATOM 0 HB2 PHE B 19 14.366 -16.619 -13.260 1.00 0.00 H new ATOM 0 HB3 PHE B 19 14.800 -18.266 -13.674 1.00 0.00 H new ATOM 0 HD1 PHE B 19 12.821 -19.305 -15.458 1.00 0.00 H new ATOM 0 HD2 PHE B 19 14.227 -15.251 -15.083 1.00 0.00 H new ATOM 0 HE1 PHE B 19 12.048 -18.824 -17.767 1.00 0.00 H new ATOM 0 HE2 PHE B 19 13.566 -14.810 -17.438 1.00 0.00 H new ATOM 0 HZ PHE B 19 12.450 -16.588 -18.767 1.00 0.00 H new ATOM 1053 N SER B 20 10.728 -17.493 -13.768 1.00 0.00 N ATOM 1054 CA SER B 20 9.458 -16.778 -13.956 1.00 0.00 C ATOM 1055 C SER B 20 8.497 -16.883 -12.767 1.00 0.00 C ATOM 1056 O SER B 20 7.795 -15.923 -12.444 1.00 0.00 O ATOM 1057 CB SER B 20 8.771 -17.278 -15.228 1.00 0.00 C ATOM 1058 OG SER B 20 8.574 -18.683 -15.182 1.00 0.00 O ATOM 0 H SER B 20 10.883 -18.222 -14.465 1.00 0.00 H new ATOM 0 HA SER B 20 9.712 -15.722 -14.043 1.00 0.00 H new ATOM 0 HB2 SER B 20 7.811 -16.776 -15.348 1.00 0.00 H new ATOM 0 HB3 SER B 20 9.376 -17.020 -16.097 1.00 0.00 H new ATOM 0 HG SER B 20 8.132 -18.978 -16.005 1.00 0.00 H new ATOM 1064 N ASP B 21 8.492 -18.026 -12.084 1.00 0.00 N ATOM 1065 CA ASP B 21 7.700 -18.281 -10.879 1.00 0.00 C ATOM 1066 C ASP B 21 8.480 -17.914 -9.607 1.00 0.00 C ATOM 1067 O ASP B 21 7.884 -17.502 -8.611 1.00 0.00 O ATOM 1068 CB ASP B 21 7.262 -19.745 -10.886 1.00 0.00 C ATOM 1069 CG ASP B 21 6.347 -20.096 -9.702 1.00 0.00 C ATOM 1070 OD1 ASP B 21 5.222 -19.546 -9.625 1.00 0.00 O ATOM 1071 OD2 ASP B 21 6.742 -20.948 -8.872 1.00 0.00 O ATOM 0 H ASP B 21 9.058 -18.828 -12.362 1.00 0.00 H new ATOM 0 HA ASP B 21 6.814 -17.647 -10.879 1.00 0.00 H new ATOM 0 HB2 ASP B 21 6.741 -19.960 -11.819 1.00 0.00 H new ATOM 0 HB3 ASP B 21 8.145 -20.384 -10.860 1.00 0.00 H new ATOM 1076 N LEU B 22 9.818 -17.967 -9.653 1.00 0.00 N ATOM 1077 CA LEU B 22 10.662 -17.519 -8.539 1.00 0.00 C ATOM 1078 C LEU B 22 10.419 -16.029 -8.244 1.00 0.00 C ATOM 1079 O LEU B 22 10.383 -15.668 -7.067 1.00 0.00 O ATOM 1080 CB LEU B 22 12.157 -17.816 -8.784 1.00 0.00 C ATOM 1081 CG LEU B 22 12.555 -19.305 -8.706 1.00 0.00 C ATOM 1082 CD1 LEU B 22 14.033 -19.484 -9.067 1.00 0.00 C ATOM 1083 CD2 LEU B 22 12.362 -19.886 -7.301 1.00 0.00 C ATOM 0 H LEU B 22 10.341 -18.318 -10.455 1.00 0.00 H new ATOM 0 HA LEU B 22 10.376 -18.091 -7.657 1.00 0.00 H new ATOM 0 HB2 LEU B 22 12.430 -17.435 -9.768 1.00 0.00 H new ATOM 0 HB3 LEU B 22 12.745 -17.261 -8.053 1.00 0.00 H new ATOM 0 HG LEU B 22 11.907 -19.828 -9.409 1.00 0.00 H new ATOM 0 HD11 LEU B 22 14.297 -20.540 -9.007 1.00 0.00 H new ATOM 0 HD12 LEU B 22 14.206 -19.124 -10.081 1.00 0.00 H new ATOM 0 HD13 LEU B 22 14.649 -18.916 -8.370 1.00 0.00 H new ATOM 0 HD21 LEU B 22 12.656 -20.936 -7.298 1.00 0.00 H new ATOM 0 HD22 LEU B 22 12.979 -19.335 -6.591 1.00 0.00 H new ATOM 0 HD23 LEU B 22 11.314 -19.802 -7.013 1.00 0.00 H new ATOM 1095 N TRP B 23 10.173 -15.184 -9.263 1.00 0.00 N ATOM 1096 CA TRP B 23 9.837 -13.760 -9.060 1.00 0.00 C ATOM 1097 C TRP B 23 8.592 -13.560 -8.177 1.00 0.00 C ATOM 1098 O TRP B 23 8.522 -12.606 -7.399 1.00 0.00 O ATOM 1099 CB TRP B 23 9.540 -13.057 -10.393 1.00 0.00 C ATOM 1100 CG TRP B 23 10.579 -13.087 -11.468 1.00 0.00 C ATOM 1101 CD1 TRP B 23 10.342 -13.494 -12.732 1.00 0.00 C ATOM 1102 CD2 TRP B 23 11.966 -12.623 -11.452 1.00 0.00 C ATOM 1103 NE1 TRP B 23 11.484 -13.361 -13.494 1.00 0.00 N ATOM 1104 CE2 TRP B 23 12.512 -12.808 -12.760 1.00 0.00 C ATOM 1105 CE3 TRP B 23 12.807 -12.032 -10.483 1.00 0.00 C ATOM 1106 CZ2 TRP B 23 13.821 -12.433 -13.089 1.00 0.00 C ATOM 1107 CZ3 TRP B 23 14.122 -11.645 -10.806 1.00 0.00 C ATOM 1108 CH2 TRP B 23 14.627 -11.847 -12.103 1.00 0.00 C ATOM 0 H TRP B 23 10.201 -15.465 -10.243 1.00 0.00 H new ATOM 0 HA TRP B 23 10.713 -13.334 -8.572 1.00 0.00 H new ATOM 0 HB2 TRP B 23 8.629 -13.494 -10.802 1.00 0.00 H new ATOM 0 HB3 TRP B 23 9.321 -12.012 -10.174 1.00 0.00 H new ATOM 0 HD1 TRP B 23 9.396 -13.869 -13.094 1.00 0.00 H new ATOM 0 HE1 TRP B 23 11.558 -13.636 -14.473 1.00 0.00 H new ATOM 0 HE3 TRP B 23 12.436 -11.875 -9.481 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 14.203 -12.593 -14.086 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 14.747 -11.190 -10.052 1.00 0.00 H new ATOM 0 HH2 TRP B 23 15.638 -11.550 -12.340 1.00 0.00 H new ATOM 1119 N LYS B 24 7.599 -14.452 -8.314 1.00 0.00 N ATOM 1120 CA LYS B 24 6.321 -14.415 -7.588 1.00 0.00 C ATOM 1121 C LYS B 24 6.431 -14.928 -6.150 1.00 0.00 C ATOM 1122 O LYS B 24 5.680 -14.468 -5.288 1.00 0.00 O ATOM 1123 CB LYS B 24 5.274 -15.269 -8.330 1.00 0.00 C ATOM 1124 CG LYS B 24 4.980 -14.793 -9.761 1.00 0.00 C ATOM 1125 CD LYS B 24 3.944 -15.714 -10.423 1.00 0.00 C ATOM 1126 CE LYS B 24 3.551 -15.174 -11.803 1.00 0.00 C ATOM 1127 NZ LYS B 24 2.475 -15.995 -12.420 1.00 0.00 N ATOM 0 H LYS B 24 7.666 -15.244 -8.953 1.00 0.00 H new ATOM 0 HA LYS B 24 6.021 -13.368 -7.547 1.00 0.00 H new ATOM 0 HB2 LYS B 24 5.622 -16.301 -8.366 1.00 0.00 H new ATOM 0 HB3 LYS B 24 4.346 -15.265 -7.759 1.00 0.00 H new ATOM 0 HG2 LYS B 24 4.608 -13.769 -9.742 1.00 0.00 H new ATOM 0 HG3 LYS B 24 5.899 -14.787 -10.346 1.00 0.00 H new ATOM 0 HD2 LYS B 24 4.353 -16.719 -10.522 1.00 0.00 H new ATOM 0 HD3 LYS B 24 3.060 -15.791 -9.790 1.00 0.00 H new ATOM 0 HE2 LYS B 24 3.215 -14.141 -11.709 1.00 0.00 H new ATOM 0 HE3 LYS B 24 4.425 -15.167 -12.455 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 2.232 -15.604 -13.352 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 2.806 -16.975 -12.531 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 1.634 -15.981 -11.808 1.00 0.00 H new ATOM 1141 N LEU B 25 7.327 -15.887 -5.895 1.00 0.00 N ATOM 1142 CA LEU B 25 7.469 -16.527 -4.585 1.00 0.00 C ATOM 1143 C LEU B 25 8.500 -15.879 -3.648 1.00 0.00 C ATOM 1144 O LEU B 25 8.132 -15.595 -2.508 1.00 0.00 O ATOM 1145 CB LEU B 25 7.800 -18.022 -4.769 1.00 0.00 C ATOM 1146 CG LEU B 25 6.719 -18.870 -5.469 1.00 0.00 C ATOM 1147 CD1 LEU B 25 7.154 -20.336 -5.449 1.00 0.00 C ATOM 1148 CD2 LEU B 25 5.348 -18.776 -4.791 1.00 0.00 C ATOM 0 H LEU B 25 7.977 -16.242 -6.596 1.00 0.00 H new ATOM 0 HA LEU B 25 6.506 -16.392 -4.092 1.00 0.00 H new ATOM 0 HB2 LEU B 25 8.724 -18.102 -5.342 1.00 0.00 H new ATOM 0 HB3 LEU B 25 7.995 -18.455 -3.788 1.00 0.00 H new ATOM 0 HG LEU B 25 6.618 -18.483 -6.483 1.00 0.00 H new ATOM 0 HD11 LEU B 25 6.397 -20.947 -5.941 1.00 0.00 H new ATOM 0 HD12 LEU B 25 8.103 -20.441 -5.974 1.00 0.00 H new ATOM 0 HD13 LEU B 25 7.272 -20.667 -4.417 1.00 0.00 H new ATOM 0 HD21 LEU B 25 4.632 -19.395 -5.331 1.00 0.00 H new ATOM 0 HD22 LEU B 25 5.426 -19.126 -3.762 1.00 0.00 H new ATOM 0 HD23 LEU B 25 5.009 -17.740 -4.797 1.00 0.00 H new ATOM 1408 N LEU B 43 28.062 -2.277 -5.649 1.00 0.00 N ATOM 1409 CA LEU B 43 27.850 -3.725 -5.800 1.00 0.00 C ATOM 1410 C LEU B 43 26.731 -3.979 -6.820 1.00 0.00 C ATOM 1411 O LEU B 43 25.771 -3.209 -6.887 1.00 0.00 O ATOM 1412 CB LEU B 43 27.613 -4.370 -4.419 1.00 0.00 C ATOM 1413 CG LEU B 43 26.329 -3.937 -3.680 1.00 0.00 C ATOM 1414 CD1 LEU B 43 25.137 -4.861 -3.949 1.00 0.00 C ATOM 1415 CD2 LEU B 43 26.573 -3.945 -2.169 1.00 0.00 C ATOM 0 HA LEU B 43 28.740 -4.208 -6.202 1.00 0.00 H new ATOM 0 HB2 LEU B 43 27.588 -5.452 -4.545 1.00 0.00 H new ATOM 0 HB3 LEU B 43 28.468 -4.143 -3.783 1.00 0.00 H new ATOM 0 HG LEU B 43 26.090 -2.941 -4.053 1.00 0.00 H new ATOM 0 HD11 LEU B 43 24.267 -4.501 -3.400 1.00 0.00 H new ATOM 0 HD12 LEU B 43 24.916 -4.868 -5.016 1.00 0.00 H new ATOM 0 HD13 LEU B 43 25.379 -5.872 -3.622 1.00 0.00 H new ATOM 0 HD21 LEU B 43 25.664 -3.639 -1.652 1.00 0.00 H new ATOM 0 HD22 LEU B 43 26.850 -4.950 -1.851 1.00 0.00 H new ATOM 0 HD23 LEU B 43 27.379 -3.252 -1.927 1.00 0.00 H new ATOM 1427 N MET B 44 26.870 -5.027 -7.639 1.00 0.00 N ATOM 1428 CA MET B 44 25.951 -5.325 -8.747 1.00 0.00 C ATOM 1429 C MET B 44 25.863 -6.828 -9.071 1.00 0.00 C ATOM 1430 O MET B 44 26.764 -7.596 -8.730 1.00 0.00 O ATOM 1431 CB MET B 44 26.466 -4.545 -9.977 1.00 0.00 C ATOM 1432 CG MET B 44 25.482 -4.442 -11.148 1.00 0.00 C ATOM 1433 SD MET B 44 23.830 -3.802 -10.754 1.00 0.00 S ATOM 1434 CE MET B 44 24.252 -2.219 -9.974 1.00 0.00 C ATOM 0 H MET B 44 27.631 -5.700 -7.552 1.00 0.00 H new ATOM 0 HA MET B 44 24.942 -5.025 -8.464 1.00 0.00 H new ATOM 0 HB2 MET B 44 26.735 -3.537 -9.661 1.00 0.00 H new ATOM 0 HB3 MET B 44 27.379 -5.022 -10.333 1.00 0.00 H new ATOM 0 HG2 MET B 44 25.924 -3.802 -11.911 1.00 0.00 H new ATOM 0 HG3 MET B 44 25.369 -5.433 -11.589 1.00 0.00 H new ATOM 0 HE1 MET B 44 23.422 -1.523 -10.092 1.00 0.00 H new ATOM 0 HE2 MET B 44 24.446 -2.376 -8.913 1.00 0.00 H new ATOM 0 HE3 MET B 44 25.142 -1.806 -10.448 1.00 0.00 H new ATOM 1444 N LEU B 45 24.788 -7.249 -9.749 1.00 0.00 N ATOM 1445 CA LEU B 45 24.578 -8.641 -10.166 1.00 0.00 C ATOM 1446 C LEU B 45 25.643 -9.099 -11.187 1.00 0.00 C ATOM 1447 O LEU B 45 26.141 -8.310 -11.997 1.00 0.00 O ATOM 1448 CB LEU B 45 23.160 -8.837 -10.749 1.00 0.00 C ATOM 1449 CG LEU B 45 21.945 -8.677 -9.808 1.00 0.00 C ATOM 1450 CD1 LEU B 45 22.049 -9.533 -8.545 1.00 0.00 C ATOM 1451 CD2 LEU B 45 21.677 -7.234 -9.381 1.00 0.00 C ATOM 0 H LEU B 45 24.030 -6.625 -10.027 1.00 0.00 H new ATOM 0 HA LEU B 45 24.678 -9.261 -9.275 1.00 0.00 H new ATOM 0 HB2 LEU B 45 23.039 -8.130 -11.569 1.00 0.00 H new ATOM 0 HB3 LEU B 45 23.115 -9.837 -11.181 1.00 0.00 H new ATOM 0 HG LEU B 45 21.110 -9.022 -10.418 1.00 0.00 H new ATOM 0 HD11 LEU B 45 21.166 -9.376 -7.926 1.00 0.00 H new ATOM 0 HD12 LEU B 45 22.115 -10.585 -8.823 1.00 0.00 H new ATOM 0 HD13 LEU B 45 22.940 -9.249 -7.985 1.00 0.00 H new ATOM 0 HD21 LEU B 45 20.809 -7.205 -8.722 1.00 0.00 H new ATOM 0 HD22 LEU B 45 22.547 -6.843 -8.853 1.00 0.00 H new ATOM 0 HD23 LEU B 45 21.484 -6.623 -10.263 1.00 0.00 H new ATOM 1463 N SER B 46 25.954 -10.393 -11.153 1.00 0.00 N ATOM 1464 CA SER B 46 26.950 -11.093 -11.982 1.00 0.00 C ATOM 1465 C SER B 46 26.352 -12.370 -12.606 1.00 0.00 C ATOM 1466 O SER B 46 25.283 -12.809 -12.169 1.00 0.00 O ATOM 1467 CB SER B 46 28.141 -11.447 -11.071 1.00 0.00 C ATOM 1468 OG SER B 46 28.892 -10.291 -10.729 1.00 0.00 O ATOM 0 H SER B 46 25.489 -11.028 -10.504 1.00 0.00 H new ATOM 0 HA SER B 46 27.269 -10.453 -12.805 1.00 0.00 H new ATOM 0 HB2 SER B 46 27.777 -11.928 -10.163 1.00 0.00 H new ATOM 0 HB3 SER B 46 28.786 -12.166 -11.576 1.00 0.00 H new ATOM 0 HG SER B 46 29.640 -10.546 -10.149 1.00 0.00 H new ATOM 1474 N PRO B 47 26.997 -13.014 -13.607 1.00 0.00 N ATOM 1475 CA PRO B 47 26.474 -14.240 -14.227 1.00 0.00 C ATOM 1476 C PRO B 47 26.178 -15.368 -13.226 1.00 0.00 C ATOM 1477 O PRO B 47 25.253 -16.144 -13.453 1.00 0.00 O ATOM 1478 CB PRO B 47 27.480 -14.645 -15.311 1.00 0.00 C ATOM 1479 CG PRO B 47 28.762 -13.915 -14.918 1.00 0.00 C ATOM 1480 CD PRO B 47 28.250 -12.639 -14.250 1.00 0.00 C ATOM 0 HA PRO B 47 25.495 -14.044 -14.664 1.00 0.00 H new ATOM 0 HB2 PRO B 47 27.627 -15.725 -15.335 1.00 0.00 H new ATOM 0 HB3 PRO B 47 27.139 -14.347 -16.303 1.00 0.00 H new ATOM 0 HG2 PRO B 47 29.370 -14.509 -14.236 1.00 0.00 H new ATOM 0 HG3 PRO B 47 29.381 -13.693 -15.787 1.00 0.00 H new ATOM 0 HD2 PRO B 47 28.968 -12.262 -13.522 1.00 0.00 H new ATOM 0 HD3 PRO B 47 28.094 -11.847 -14.983 1.00 0.00 H new ATOM 1488 N ASP B 48 26.887 -15.422 -12.093 1.00 0.00 N ATOM 1489 CA ASP B 48 26.642 -16.384 -11.006 1.00 0.00 C ATOM 1490 C ASP B 48 25.217 -16.273 -10.416 1.00 0.00 C ATOM 1491 O ASP B 48 24.605 -17.277 -10.049 1.00 0.00 O ATOM 1492 CB ASP B 48 27.686 -16.147 -9.909 1.00 0.00 C ATOM 1493 CG ASP B 48 27.561 -17.169 -8.765 1.00 0.00 C ATOM 1494 OD1 ASP B 48 28.015 -18.326 -8.937 1.00 0.00 O ATOM 1495 OD2 ASP B 48 27.032 -16.811 -7.685 1.00 0.00 O ATOM 0 H ASP B 48 27.662 -14.788 -11.900 1.00 0.00 H new ATOM 0 HA ASP B 48 26.727 -17.390 -11.416 1.00 0.00 H new ATOM 0 HB2 ASP B 48 28.685 -16.206 -10.340 1.00 0.00 H new ATOM 0 HB3 ASP B 48 27.570 -15.139 -9.510 1.00 0.00 H new ATOM 1500 N ASP B 49 24.664 -15.056 -10.360 1.00 0.00 N ATOM 1501 CA ASP B 49 23.302 -14.787 -9.885 1.00 0.00 C ATOM 1502 C ASP B 49 22.244 -15.149 -10.942 1.00 0.00 C ATOM 1503 O ASP B 49 21.122 -15.527 -10.600 1.00 0.00 O ATOM 1504 CB ASP B 49 23.143 -13.297 -9.542 1.00 0.00 C ATOM 1505 CG ASP B 49 24.192 -12.796 -8.544 1.00 0.00 C ATOM 1506 OD1 ASP B 49 24.153 -13.239 -7.372 1.00 0.00 O ATOM 1507 OD2 ASP B 49 25.038 -11.958 -8.930 1.00 0.00 O ATOM 0 H ASP B 49 25.161 -14.214 -10.649 1.00 0.00 H new ATOM 0 HA ASP B 49 23.148 -15.405 -9.001 1.00 0.00 H new ATOM 0 HB2 ASP B 49 23.212 -12.710 -10.458 1.00 0.00 H new ATOM 0 HB3 ASP B 49 22.148 -13.129 -9.130 1.00 0.00 H new ATOM 1512 N ILE B 50 22.604 -15.029 -12.223 1.00 0.00 N ATOM 1513 CA ILE B 50 21.732 -15.269 -13.382 1.00 0.00 C ATOM 1514 C ILE B 50 21.656 -16.769 -13.730 1.00 0.00 C ATOM 1515 O ILE B 50 20.599 -17.272 -14.104 1.00 0.00 O ATOM 1516 CB ILE B 50 22.203 -14.404 -14.581 1.00 0.00 C ATOM 1517 CG1 ILE B 50 22.352 -12.902 -14.210 1.00 0.00 C ATOM 1518 CG2 ILE B 50 21.198 -14.524 -15.743 1.00 0.00 C ATOM 1519 CD1 ILE B 50 23.171 -12.079 -15.213 1.00 0.00 C ATOM 0 H ILE B 50 23.547 -14.751 -12.494 1.00 0.00 H new ATOM 0 HA ILE B 50 20.716 -14.966 -13.130 1.00 0.00 H new ATOM 0 HB ILE B 50 23.183 -14.781 -14.874 1.00 0.00 H new ATOM 0 HG12 ILE B 50 21.359 -12.462 -14.123 1.00 0.00 H new ATOM 0 HG13 ILE B 50 22.821 -12.828 -13.229 1.00 0.00 H new ATOM 0 HG21 ILE B 50 21.536 -13.914 -16.581 1.00 0.00 H new ATOM 0 HG22 ILE B 50 21.128 -15.565 -16.057 1.00 0.00 H new ATOM 0 HG23 ILE B 50 20.218 -14.178 -15.414 1.00 0.00 H new ATOM 0 HD11 ILE B 50 23.224 -11.044 -14.876 1.00 0.00 H new ATOM 0 HD12 ILE B 50 24.178 -12.490 -15.284 1.00 0.00 H new ATOM 0 HD13 ILE B 50 22.693 -12.118 -16.192 1.00 0.00 H new ATOM 1531 N GLU B 51 22.743 -17.529 -13.572 1.00 0.00 N ATOM 1532 CA GLU B 51 22.752 -18.984 -13.811 1.00 0.00 C ATOM 1533 C GLU B 51 22.050 -19.792 -12.694 1.00 0.00 C ATOM 1534 O GLU B 51 21.928 -21.015 -12.773 1.00 0.00 O ATOM 1535 CB GLU B 51 24.191 -19.472 -14.059 1.00 0.00 C ATOM 1536 CG GLU B 51 25.072 -19.544 -12.806 1.00 0.00 C ATOM 1537 CD GLU B 51 26.476 -20.078 -13.150 1.00 0.00 C ATOM 1538 OE1 GLU B 51 26.677 -21.317 -13.131 1.00 0.00 O ATOM 1539 OE2 GLU B 51 27.394 -19.270 -13.439 1.00 0.00 O ATOM 0 H GLU B 51 23.645 -17.157 -13.275 1.00 0.00 H new ATOM 0 HA GLU B 51 22.162 -19.167 -14.709 1.00 0.00 H new ATOM 0 HB2 GLU B 51 24.150 -20.461 -14.514 1.00 0.00 H new ATOM 0 HB3 GLU B 51 24.665 -18.808 -14.781 1.00 0.00 H new ATOM 0 HG2 GLU B 51 25.155 -18.554 -12.358 1.00 0.00 H new ATOM 0 HG3 GLU B 51 24.604 -20.191 -12.064 1.00 0.00 H new ATOM 1546 N GLN B 52 21.588 -19.121 -11.634 1.00 0.00 N ATOM 1547 CA GLN B 52 20.936 -19.730 -10.471 1.00 0.00 C ATOM 1548 C GLN B 52 19.439 -20.018 -10.664 1.00 0.00 C ATOM 1549 O GLN B 52 18.980 -21.103 -10.308 1.00 0.00 O ATOM 1550 CB GLN B 52 21.214 -18.808 -9.262 1.00 0.00 C ATOM 1551 CG GLN B 52 20.199 -18.779 -8.097 1.00 0.00 C ATOM 1552 CD GLN B 52 18.975 -17.875 -8.299 1.00 0.00 C ATOM 1553 OE1 GLN B 52 17.870 -18.207 -7.895 1.00 0.00 O ATOM 1554 NE2 GLN B 52 19.090 -16.718 -8.920 1.00 0.00 N ATOM 0 H GLN B 52 21.660 -18.106 -11.560 1.00 0.00 H new ATOM 0 HA GLN B 52 21.357 -20.722 -10.306 1.00 0.00 H new ATOM 0 HB2 GLN B 52 22.182 -19.089 -8.849 1.00 0.00 H new ATOM 0 HB3 GLN B 52 21.312 -17.790 -9.639 1.00 0.00 H new ATOM 0 HG2 GLN B 52 19.850 -19.796 -7.919 1.00 0.00 H new ATOM 0 HG3 GLN B 52 20.719 -18.458 -7.195 1.00 0.00 H new ATOM 0 HE21 GLN B 52 19.999 -16.414 -9.268 1.00 0.00 H new ATOM 0 HE22 GLN B 52 18.270 -16.126 -9.052 1.00 0.00 H new ATOM 1563 N TRP B 53 18.657 -19.070 -11.189 1.00 0.00 N ATOM 1564 CA TRP B 53 17.193 -19.205 -11.279 1.00 0.00 C ATOM 1565 C TRP B 53 16.663 -20.105 -12.411 1.00 0.00 C ATOM 1566 O TRP B 53 15.527 -20.577 -12.338 1.00 0.00 O ATOM 1567 CB TRP B 53 16.561 -17.802 -11.259 1.00 0.00 C ATOM 1568 CG TRP B 53 17.134 -16.735 -12.149 1.00 0.00 C ATOM 1569 CD1 TRP B 53 17.625 -16.904 -13.396 1.00 0.00 C ATOM 1570 CD2 TRP B 53 17.320 -15.313 -11.851 1.00 0.00 C ATOM 1571 NE1 TRP B 53 18.104 -15.707 -13.882 1.00 0.00 N ATOM 1572 CE2 TRP B 53 17.977 -14.696 -12.959 1.00 0.00 C ATOM 1573 CE3 TRP B 53 17.024 -14.485 -10.747 1.00 0.00 C ATOM 1574 CZ2 TRP B 53 18.367 -13.348 -12.958 1.00 0.00 C ATOM 1575 CZ3 TRP B 53 17.398 -13.128 -10.742 1.00 0.00 C ATOM 1576 CH2 TRP B 53 18.084 -12.561 -11.830 1.00 0.00 C ATOM 0 H TRP B 53 19.015 -18.191 -11.563 1.00 0.00 H new ATOM 0 HA TRP B 53 16.874 -19.763 -10.399 1.00 0.00 H new ATOM 0 HB2 TRP B 53 15.507 -17.912 -11.513 1.00 0.00 H new ATOM 0 HB3 TRP B 53 16.606 -17.435 -10.234 1.00 0.00 H new ATOM 0 HD1 TRP B 53 17.640 -17.841 -13.934 1.00 0.00 H new ATOM 0 HE1 TRP B 53 18.504 -15.586 -14.813 1.00 0.00 H new ATOM 0 HE3 TRP B 53 16.504 -14.898 -9.895 1.00 0.00 H new ATOM 0 HZ2 TRP B 53 18.876 -12.923 -13.810 1.00 0.00 H new ATOM 0 HZ3 TRP B 53 17.154 -12.513 -9.889 1.00 0.00 H new ATOM 0 HH2 TRP B 53 18.392 -11.526 -11.799 1.00 0.00 H new ATOM 1587 N PHE B 54 17.463 -20.374 -13.449 1.00 0.00 N ATOM 1588 CA PHE B 54 17.076 -21.245 -14.575 1.00 0.00 C ATOM 1589 C PHE B 54 17.436 -22.736 -14.384 1.00 0.00 C ATOM 1590 O PHE B 54 16.974 -23.581 -15.149 1.00 0.00 O ATOM 1591 CB PHE B 54 17.641 -20.682 -15.898 1.00 0.00 C ATOM 1592 CG PHE B 54 18.990 -21.228 -16.345 1.00 0.00 C ATOM 1593 CD1 PHE B 54 20.097 -21.210 -15.476 1.00 0.00 C ATOM 1594 CD2 PHE B 54 19.130 -21.796 -17.628 1.00 0.00 C ATOM 1595 CE1 PHE B 54 21.322 -21.776 -15.871 1.00 0.00 C ATOM 1596 CE2 PHE B 54 20.360 -22.348 -18.030 1.00 0.00 C ATOM 1597 CZ PHE B 54 21.456 -22.343 -17.150 1.00 0.00 C ATOM 0 H PHE B 54 18.405 -19.993 -13.536 1.00 0.00 H new ATOM 0 HA PHE B 54 15.987 -21.233 -14.614 1.00 0.00 H new ATOM 0 HB2 PHE B 54 16.916 -20.875 -16.689 1.00 0.00 H new ATOM 0 HB3 PHE B 54 17.726 -19.600 -15.800 1.00 0.00 H new ATOM 0 HD1 PHE B 54 20.005 -20.758 -14.499 1.00 0.00 H new ATOM 0 HD2 PHE B 54 18.289 -21.807 -18.305 1.00 0.00 H new ATOM 0 HE1 PHE B 54 22.161 -21.775 -15.191 1.00 0.00 H new ATOM 0 HE2 PHE B 54 20.462 -22.776 -19.016 1.00 0.00 H new ATOM 0 HZ PHE B 54 22.398 -22.774 -17.456 1.00 0.00 H new ATOM 1607 N THR B 55 18.269 -23.067 -13.386 1.00 0.00 N ATOM 1608 CA THR B 55 18.802 -24.424 -13.128 1.00 0.00 C ATOM 1609 C THR B 55 17.755 -25.545 -13.001 1.00 0.00 C ATOM 1610 O THR B 55 18.036 -26.703 -13.310 1.00 0.00 O ATOM 1611 CB THR B 55 19.735 -24.393 -11.902 1.00 0.00 C ATOM 1612 OG1 THR B 55 20.602 -25.508 -11.908 1.00 0.00 O ATOM 1613 CG2 THR B 55 18.998 -24.373 -10.562 1.00 0.00 C ATOM 0 H THR B 55 18.604 -22.379 -12.711 1.00 0.00 H new ATOM 0 HA THR B 55 19.357 -24.690 -14.027 1.00 0.00 H new ATOM 0 HB THR B 55 20.290 -23.459 -11.991 1.00 0.00 H new ATOM 0 HG1 THR B 55 21.188 -25.471 -11.123 1.00 0.00 H new ATOM 0 HG21 THR B 55 19.723 -24.352 -9.748 1.00 0.00 H new ATOM 0 HG22 THR B 55 18.365 -23.487 -10.508 1.00 0.00 H new ATOM 0 HG23 THR B 55 18.380 -25.266 -10.474 1.00 0.00 H new