USER MOD reduce.3.24.130724 H: found=0, std=0, add=720, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 717 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: A2026 MET CE :methyl 138:sc= -10.1! (180deg=-10.3!) USER MOD Set 1.2: A2057 MET CE :methyl 175:sc= -3.69! (180deg=-0.175) USER MOD Set 1.3: A2058 MET CE :methyl 157:sc= -21! (180deg=-12.2!) USER MOD Single : A2024 HIS : no HD1:sc= -2.16 X(o=-2.2,f=-2.5) USER MOD Single : A2028 HIS : no HD1:sc= -1.59 K(o=-1.6,f=-0.54) USER MOD Single : A2035 SER OG : rot 180:sc= 0 USER MOD Single : A2038 TYR OH : rot 180:sc= 0 USER MOD Single : A2043 ASN : amide:sc= -0.825 K(o=-0.83,f=-3.9!) USER MOD Single : A2045 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2047 MET CE :methyl -150:sc= -1.28 (180deg=-3.09!) USER MOD Single : A2055 HIS : no HD1:sc= -8.45! K(o=-8.4!,f=-5.1) USER MOD Single : A2063 GLN : amide:sc= -0.248 K(o=-0.25,f=-2.2!) USER MOD Single : A2064 THR OG1 : rot 180:sc= -0.364 USER MOD Single : A2066 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2068 THR OG1 : rot 62:sc= 0.344 USER MOD Single : A2069 SER OG : rot 180:sc= 0 USER MOD Single : A2071 ASN : amide:sc= -0.528 X(o=-0.53,f=-0.056) USER MOD Single : A2072 GLN : amide:sc= -0.234 K(o=-0.23,f=-2.7!) USER MOD Single : A2074 TYR OH : rot 140:sc= -1.33 USER MOD Single : A2079 MET CE :methyl 142:sc= -0.389 (180deg=-1.98!) USER MOD Single : A2082 GLN : amide:sc= -0.248 X(o=-0.25,f=0) USER MOD Single : A2085 CYS SG : rot 99:sc= -2.98! USER MOD Single : A2087 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2088 TYR OH : rot 30:sc= 0 USER MOD Single : A2089 MET CE :methyl -179:sc= 0 (180deg=-0.00218) USER MOD Single : A2090 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2091 SER OG : rot 180:sc= 0 USER MOD Single : A2093 ASN : amide:sc= -0.477 K(o=-0.48,f=-3.2!) USER MOD Single : A2095 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2098 THR OG1 : rot 79:sc= 0.102 USER MOD Single : A2099 GLN : amide:sc= -0.419 K(o=-0.42,f=-3.1!) USER MOD Single : A2104 TYR OH : rot 180:sc= 0 USER MOD Single : A2105 TYR OH : rot 180:sc= -1.63! USER MOD Single : A2106 HIS : no HD1:sc= -0.712 X(o=-0.71,f=-0.36) USER MOD Single : A2112 SER OG : rot 180:sc= 0 USER MOD Single : A2113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 143 N LEU A2022 -7.552 -12.870 3.348 1.00 52.42 N ATOM 144 CA LEU A2022 -6.253 -12.873 2.698 1.00 1.20 C ATOM 145 C LEU A2022 -5.616 -11.489 2.834 1.00 11.31 C ATOM 146 O LEU A2022 -6.193 -10.592 3.447 1.00 22.15 O ATOM 147 CB LEU A2022 -6.379 -13.352 1.250 1.00 33.32 C ATOM 148 CG LEU A2022 -5.328 -14.361 0.784 1.00 14.12 C ATOM 149 CD1 LEU A2022 -5.902 -15.778 0.754 1.00 51.32 C ATOM 150 CD2 LEU A2022 -4.738 -13.953 -0.567 1.00 43.42 C ATOM 0 HA LEU A2022 -5.585 -13.582 3.187 1.00 1.20 H new ATOM 0 HB2 LEU A2022 -7.365 -13.798 1.120 1.00 33.32 H new ATOM 0 HB3 LEU A2022 -6.334 -12.482 0.595 1.00 33.32 H new ATOM 0 HG LEU A2022 -4.511 -14.361 1.506 1.00 14.12 H new ATOM 0 HD11 LEU A2022 -5.134 -16.475 0.419 1.00 51.32 H new ATOM 0 HD12 LEU A2022 -6.234 -16.057 1.754 1.00 51.32 H new ATOM 0 HD13 LEU A2022 -6.748 -15.813 0.067 1.00 51.32 H new ATOM 0 HD21 LEU A2022 -3.994 -14.687 -0.875 1.00 43.42 H new ATOM 0 HD22 LEU A2022 -5.532 -13.907 -1.312 1.00 43.42 H new ATOM 0 HD23 LEU A2022 -4.267 -12.974 -0.478 1.00 43.42 H new ATOM 162 N TRP A2023 -4.432 -11.356 2.251 1.00 63.41 N ATOM 163 CA TRP A2023 -3.711 -10.098 2.299 1.00 74.43 C ATOM 164 C TRP A2023 -4.365 -9.139 1.301 1.00 61.44 C ATOM 165 O TRP A2023 -4.683 -8.001 1.645 1.00 51.15 O ATOM 166 CB TRP A2023 -2.220 -10.309 2.034 1.00 51.43 C ATOM 167 CG TRP A2023 -1.360 -10.334 3.300 1.00 41.31 C ATOM 168 CD1 TRP A2023 -1.753 -10.571 4.559 1.00 34.32 C ATOM 169 CD2 TRP A2023 0.063 -10.103 3.378 1.00 71.11 C ATOM 170 NE1 TRP A2023 -0.691 -10.510 5.438 1.00 74.52 N ATOM 171 CE2 TRP A2023 0.447 -10.216 4.699 1.00 71.05 C ATOM 172 CE3 TRP A2023 0.993 -9.807 2.367 1.00 40.14 C ATOM 173 CZ2 TRP A2023 1.769 -10.049 5.129 1.00 11.12 C ATOM 174 CZ3 TRP A2023 2.310 -9.642 2.812 1.00 51.13 C ATOM 175 CH2 TRP A2023 2.714 -9.754 4.139 1.00 42.32 C ATOM 0 H TRP A2023 -3.955 -12.101 1.743 1.00 63.41 H new ATOM 0 HA TRP A2023 -3.770 -9.659 3.295 1.00 74.43 H new ATOM 0 HB2 TRP A2023 -2.086 -11.248 1.498 1.00 51.43 H new ATOM 0 HB3 TRP A2023 -1.862 -9.514 1.379 1.00 51.43 H new ATOM 0 HD1 TRP A2023 -2.772 -10.783 4.849 1.00 34.32 H new ATOM 0 HE1 TRP A2023 -0.734 -10.655 6.447 1.00 74.52 H new ATOM 0 HE3 TRP A2023 0.714 -9.714 1.328 1.00 40.14 H new ATOM 0 HZ2 TRP A2023 2.045 -10.143 6.169 1.00 11.12 H new ATOM 0 HZ3 TRP A2023 3.065 -9.412 2.075 1.00 51.13 H new ATOM 0 HH2 TRP A2023 3.752 -9.614 4.404 1.00 42.32 H new ATOM 186 N HIS A2024 -4.545 -9.634 0.085 1.00 61.50 N ATOM 187 CA HIS A2024 -5.156 -8.835 -0.964 1.00 50.40 C ATOM 188 C HIS A2024 -6.427 -8.172 -0.431 1.00 43.31 C ATOM 189 O HIS A2024 -6.874 -7.158 -0.965 1.00 43.33 O ATOM 190 CB HIS A2024 -5.407 -9.682 -2.214 1.00 30.51 C ATOM 191 CG HIS A2024 -4.335 -10.712 -2.484 1.00 51.44 C ATOM 192 ND1 HIS A2024 -4.621 -11.998 -2.907 1.00 24.12 N ATOM 193 CD2 HIS A2024 -2.977 -10.629 -2.388 1.00 4.41 C ATOM 194 CE1 HIS A2024 -3.479 -12.652 -3.055 1.00 1.44 C ATOM 195 NE2 HIS A2024 -2.462 -11.803 -2.732 1.00 44.12 N ATOM 0 H HIS A2024 -4.279 -10.577 -0.197 1.00 61.50 H new ATOM 0 HA HIS A2024 -4.474 -8.040 -1.265 1.00 50.40 H new ATOM 0 HB2 HIS A2024 -6.366 -10.189 -2.110 1.00 30.51 H new ATOM 0 HB3 HIS A2024 -5.488 -9.022 -3.078 1.00 30.51 H new ATOM 0 HD2 HIS A2024 -2.417 -9.757 -2.084 1.00 4.41 H new ATOM 0 HE1 HIS A2024 -3.372 -13.678 -3.375 1.00 1.44 H new ATOM 0 HE2 HIS A2024 -1.468 -12.032 -2.752 1.00 44.12 H new ATOM 204 N GLU A2025 -6.976 -8.773 0.615 1.00 20.21 N ATOM 205 CA GLU A2025 -8.187 -8.254 1.226 1.00 44.11 C ATOM 206 C GLU A2025 -7.879 -6.979 2.015 1.00 64.51 C ATOM 207 O GLU A2025 -8.689 -6.054 2.046 1.00 54.44 O ATOM 208 CB GLU A2025 -8.846 -9.306 2.120 1.00 1.33 C ATOM 209 CG GLU A2025 -10.179 -8.800 2.673 1.00 73.13 C ATOM 210 CD GLU A2025 -11.191 -8.578 1.548 1.00 52.32 C ATOM 211 OE1 GLU A2025 -10.986 -9.061 0.426 1.00 11.14 O ATOM 212 OE2 GLU A2025 -12.222 -7.874 1.873 1.00 60.50 O ATOM 0 H GLU A2025 -6.604 -9.615 1.055 1.00 20.21 H new ATOM 0 HA GLU A2025 -8.893 -8.006 0.433 1.00 44.11 H new ATOM 0 HB2 GLU A2025 -9.009 -10.221 1.551 1.00 1.33 H new ATOM 0 HB3 GLU A2025 -8.178 -9.557 2.944 1.00 1.33 H new ATOM 0 HG2 GLU A2025 -10.577 -9.520 3.388 1.00 73.13 H new ATOM 0 HG3 GLU A2025 -10.021 -7.867 3.214 1.00 73.13 H new ATOM 220 N MET A2026 -6.709 -6.972 2.633 1.00 73.40 N ATOM 221 CA MET A2026 -6.284 -5.826 3.419 1.00 31.44 C ATOM 222 C MET A2026 -5.923 -4.646 2.516 1.00 54.03 C ATOM 223 O MET A2026 -6.117 -3.490 2.894 1.00 3.44 O ATOM 224 CB MET A2026 -5.069 -6.211 4.268 1.00 0.05 C ATOM 225 CG MET A2026 -3.769 -6.006 3.488 1.00 33.00 C ATOM 226 SD MET A2026 -3.203 -4.324 3.678 1.00 70.42 S ATOM 227 CE MET A2026 -1.463 -4.544 3.352 1.00 31.33 C ATOM 0 H MET A2026 -6.041 -7.742 2.606 1.00 73.40 H new ATOM 0 HA MET A2026 -7.109 -5.526 4.065 1.00 31.44 H new ATOM 0 HB2 MET A2026 -5.051 -5.610 5.177 1.00 0.05 H new ATOM 0 HB3 MET A2026 -5.152 -7.253 4.577 1.00 0.05 H new ATOM 0 HG2 MET A2026 -3.007 -6.698 3.847 1.00 33.00 H new ATOM 0 HG3 MET A2026 -3.929 -6.228 2.433 1.00 33.00 H new ATOM 0 HE1 MET A2026 -1.105 -3.729 2.724 1.00 31.33 H new ATOM 0 HE2 MET A2026 -0.914 -4.545 4.293 1.00 31.33 H new ATOM 0 HE3 MET A2026 -1.306 -5.493 2.839 1.00 31.33 H new ATOM 237 N TRP A2027 -5.403 -4.975 1.345 1.00 44.32 N ATOM 238 CA TRP A2027 -5.014 -3.956 0.384 1.00 52.43 C ATOM 239 C TRP A2027 -6.288 -3.340 -0.195 1.00 4.30 C ATOM 240 O TRP A2027 -6.447 -2.120 -0.202 1.00 11.43 O ATOM 241 CB TRP A2027 -4.089 -4.535 -0.687 1.00 21.05 C ATOM 242 CG TRP A2027 -2.783 -5.113 -0.135 1.00 33.21 C ATOM 243 CD1 TRP A2027 -2.556 -6.353 0.322 1.00 62.43 C ATOM 244 CD2 TRP A2027 -1.524 -4.419 -0.001 1.00 30.41 C ATOM 245 NE1 TRP A2027 -1.252 -6.508 0.739 1.00 12.24 N ATOM 246 CE2 TRP A2027 -0.603 -5.294 0.538 1.00 23.22 C ATOM 247 CE3 TRP A2027 -1.177 -3.097 -0.322 1.00 50.52 C ATOM 248 CZ2 TRP A2027 0.725 -4.943 0.800 1.00 52.23 C ATOM 249 CZ3 TRP A2027 0.156 -2.760 -0.053 1.00 62.34 C ATOM 250 CH2 TRP A2027 1.095 -3.628 0.488 1.00 32.41 C ATOM 0 H TRP A2027 -5.241 -5.934 1.038 1.00 44.32 H new ATOM 0 HA TRP A2027 -4.437 -3.169 0.870 1.00 52.43 H new ATOM 0 HB2 TRP A2027 -4.621 -5.318 -1.228 1.00 21.05 H new ATOM 0 HB3 TRP A2027 -3.852 -3.754 -1.409 1.00 21.05 H new ATOM 0 HD1 TRP A2027 -3.302 -7.133 0.359 1.00 62.43 H new ATOM 0 HE1 TRP A2027 -0.838 -7.357 1.124 1.00 12.24 H new ATOM 0 HE3 TRP A2027 -1.882 -2.395 -0.743 1.00 50.52 H new ATOM 0 HZ2 TRP A2027 1.428 -5.647 1.220 1.00 52.23 H new ATOM 0 HZ3 TRP A2027 0.476 -1.754 -0.283 1.00 62.34 H new ATOM 0 HH2 TRP A2027 2.105 -3.291 0.667 1.00 32.41 H new ATOM 261 N HIS A2028 -7.165 -4.213 -0.670 1.00 64.21 N ATOM 262 CA HIS A2028 -8.422 -3.770 -1.251 1.00 31.14 C ATOM 263 C HIS A2028 -9.142 -2.841 -0.272 1.00 14.15 C ATOM 264 O HIS A2028 -9.405 -1.683 -0.588 1.00 40.32 O ATOM 265 CB HIS A2028 -9.278 -4.969 -1.671 1.00 55.35 C ATOM 266 CG HIS A2028 -10.760 -4.767 -1.460 1.00 34.44 C ATOM 267 ND1 HIS A2028 -11.612 -4.356 -2.470 1.00 4.30 N ATOM 268 CD2 HIS A2028 -11.531 -4.926 -0.346 1.00 51.41 C ATOM 269 CE1 HIS A2028 -12.837 -4.272 -1.975 1.00 25.55 C ATOM 270 NE2 HIS A2028 -12.786 -4.627 -0.659 1.00 43.45 N ATOM 0 H HIS A2028 -7.030 -5.224 -0.664 1.00 64.21 H new ATOM 0 HA HIS A2028 -8.226 -3.200 -2.159 1.00 31.14 H new ATOM 0 HB2 HIS A2028 -9.097 -5.181 -2.725 1.00 55.35 H new ATOM 0 HB3 HIS A2028 -8.957 -5.846 -1.109 1.00 55.35 H new ATOM 0 HD2 HIS A2028 -11.180 -5.241 0.625 1.00 51.41 H new ATOM 0 HE1 HIS A2028 -13.722 -3.974 -2.518 1.00 25.55 H new ATOM 0 HE2 HIS A2028 -13.581 -4.658 -0.021 1.00 43.45 H new ATOM 279 N GLU A2029 -9.440 -3.384 0.899 1.00 74.41 N ATOM 280 CA GLU A2029 -10.125 -2.618 1.927 1.00 13.43 C ATOM 281 C GLU A2029 -9.213 -1.510 2.459 1.00 63.20 C ATOM 282 O GLU A2029 -9.688 -0.448 2.858 1.00 75.21 O ATOM 283 CB GLU A2029 -10.600 -3.526 3.062 1.00 60.42 C ATOM 284 CG GLU A2029 -9.472 -3.798 4.059 1.00 52.34 C ATOM 285 CD GLU A2029 -9.905 -4.817 5.114 1.00 74.12 C ATOM 286 OE1 GLU A2029 -10.623 -5.775 4.793 1.00 34.22 O ATOM 287 OE2 GLU A2029 -9.470 -4.585 6.308 1.00 4.54 O ATOM 0 H GLU A2029 -9.220 -4.345 1.159 1.00 74.41 H new ATOM 0 HA GLU A2029 -11.006 -2.156 1.481 1.00 13.43 H new ATOM 0 HB2 GLU A2029 -11.440 -3.060 3.577 1.00 60.42 H new ATOM 0 HB3 GLU A2029 -10.961 -4.469 2.651 1.00 60.42 H new ATOM 0 HG2 GLU A2029 -8.595 -4.169 3.529 1.00 52.34 H new ATOM 0 HG3 GLU A2029 -9.180 -2.867 4.546 1.00 52.34 H new ATOM 295 N GLY A2030 -7.919 -1.795 2.445 1.00 45.53 N ATOM 296 CA GLY A2030 -6.936 -0.835 2.920 1.00 23.34 C ATOM 297 C GLY A2030 -7.022 0.475 2.132 1.00 34.43 C ATOM 298 O GLY A2030 -7.388 1.511 2.683 1.00 10.32 O ATOM 0 H GLY A2030 -7.528 -2.677 2.112 1.00 45.53 H new ATOM 0 HA2 GLY A2030 -7.098 -0.637 3.980 1.00 23.34 H new ATOM 0 HA3 GLY A2030 -5.935 -1.256 2.824 1.00 23.34 H new ATOM 302 N LEU A2031 -6.679 0.384 0.856 1.00 24.30 N ATOM 303 CA LEU A2031 -6.714 1.548 -0.013 1.00 31.40 C ATOM 304 C LEU A2031 -8.147 2.081 -0.088 1.00 41.10 C ATOM 305 O LEU A2031 -8.357 3.279 -0.266 1.00 60.51 O ATOM 306 CB LEU A2031 -6.110 1.215 -1.379 1.00 54.01 C ATOM 307 CG LEU A2031 -4.654 1.639 -1.589 1.00 44.05 C ATOM 308 CD1 LEU A2031 -4.251 1.504 -3.059 1.00 31.14 C ATOM 309 CD2 LEU A2031 -4.411 3.053 -1.056 1.00 35.54 C ATOM 0 H LEU A2031 -6.375 -0.478 0.403 1.00 24.30 H new ATOM 0 HA LEU A2031 -6.097 2.348 0.397 1.00 31.40 H new ATOM 0 HB2 LEU A2031 -6.180 0.138 -1.533 1.00 54.01 H new ATOM 0 HB3 LEU A2031 -6.720 1.687 -2.149 1.00 54.01 H new ATOM 0 HG LEU A2031 -4.016 0.966 -1.016 1.00 44.05 H new ATOM 0 HD11 LEU A2031 -3.212 1.811 -3.181 1.00 31.14 H new ATOM 0 HD12 LEU A2031 -4.362 0.466 -3.373 1.00 31.14 H new ATOM 0 HD13 LEU A2031 -4.892 2.138 -3.672 1.00 31.14 H new ATOM 0 HD21 LEU A2031 -3.369 3.329 -1.218 1.00 35.54 H new ATOM 0 HD22 LEU A2031 -5.058 3.756 -1.581 1.00 35.54 H new ATOM 0 HD23 LEU A2031 -4.633 3.083 0.011 1.00 35.54 H new ATOM 321 N GLU A2032 -9.093 1.164 0.051 1.00 31.23 N ATOM 322 CA GLU A2032 -10.498 1.527 0.001 1.00 34.45 C ATOM 323 C GLU A2032 -10.795 2.643 1.003 1.00 51.33 C ATOM 324 O GLU A2032 -11.410 3.650 0.654 1.00 24.52 O ATOM 325 CB GLU A2032 -11.389 0.309 0.260 1.00 44.50 C ATOM 326 CG GLU A2032 -12.422 0.606 1.347 1.00 50.31 C ATOM 327 CD GLU A2032 -13.333 -0.600 1.583 1.00 10.04 C ATOM 328 OE1 GLU A2032 -13.967 -1.093 0.638 1.00 3.44 O ATOM 329 OE2 GLU A2032 -13.367 -1.026 2.800 1.00 30.32 O ATOM 0 H GLU A2032 -8.914 0.171 0.198 1.00 31.23 H new ATOM 0 HA GLU A2032 -10.721 1.895 -1.000 1.00 34.45 H new ATOM 0 HB2 GLU A2032 -11.897 0.023 -0.661 1.00 44.50 H new ATOM 0 HB3 GLU A2032 -10.773 -0.539 0.560 1.00 44.50 H new ATOM 0 HG2 GLU A2032 -11.913 0.869 2.275 1.00 50.31 H new ATOM 0 HG3 GLU A2032 -13.022 1.468 1.057 1.00 50.31 H new ATOM 337 N GLU A2033 -10.340 2.431 2.229 1.00 22.40 N ATOM 338 CA GLU A2033 -10.548 3.407 3.284 1.00 54.42 C ATOM 339 C GLU A2033 -9.658 4.632 3.059 1.00 75.02 C ATOM 340 O GLU A2033 -10.133 5.765 3.095 1.00 63.34 O ATOM 341 CB GLU A2033 -10.293 2.791 4.662 1.00 70.51 C ATOM 342 CG GLU A2033 -11.311 3.298 5.687 1.00 13.30 C ATOM 343 CD GLU A2033 -11.530 2.267 6.796 1.00 23.52 C ATOM 344 OE1 GLU A2033 -11.933 1.129 6.512 1.00 74.43 O ATOM 345 OE2 GLU A2033 -11.269 2.685 7.987 1.00 10.11 O ATOM 0 H GLU A2033 -9.828 1.597 2.515 1.00 22.40 H new ATOM 0 HA GLU A2033 -11.589 3.727 3.253 1.00 54.42 H new ATOM 0 HB2 GLU A2033 -10.350 1.705 4.595 1.00 70.51 H new ATOM 0 HB3 GLU A2033 -9.284 3.038 4.993 1.00 70.51 H new ATOM 0 HG2 GLU A2033 -10.961 4.235 6.120 1.00 13.30 H new ATOM 0 HG3 GLU A2033 -12.258 3.510 5.191 1.00 13.30 H new ATOM 353 N ALA A2034 -8.381 4.360 2.832 1.00 62.22 N ATOM 354 CA ALA A2034 -7.418 5.424 2.601 1.00 44.40 C ATOM 355 C ALA A2034 -7.907 6.303 1.448 1.00 1.51 C ATOM 356 O ALA A2034 -7.913 7.529 1.557 1.00 25.21 O ATOM 357 CB ALA A2034 -6.042 4.817 2.329 1.00 12.31 C ATOM 0 H ALA A2034 -7.991 3.418 2.803 1.00 62.22 H new ATOM 0 HA ALA A2034 -7.325 6.057 3.483 1.00 44.40 H new ATOM 0 HB1 ALA A2034 -5.320 5.615 2.156 1.00 12.31 H new ATOM 0 HB2 ALA A2034 -5.729 4.225 3.189 1.00 12.31 H new ATOM 0 HB3 ALA A2034 -6.094 4.177 1.448 1.00 12.31 H new ATOM 363 N SER A2035 -8.301 5.644 0.368 1.00 41.10 N ATOM 364 CA SER A2035 -8.789 6.351 -0.804 1.00 2.13 C ATOM 365 C SER A2035 -9.977 7.235 -0.426 1.00 54.15 C ATOM 366 O SER A2035 -10.021 8.410 -0.786 1.00 4.33 O ATOM 367 CB SER A2035 -9.186 5.372 -1.911 1.00 64.35 C ATOM 368 OG SER A2035 -10.007 5.989 -2.899 1.00 62.44 O ATOM 0 H SER A2035 -8.292 4.628 0.280 1.00 41.10 H new ATOM 0 HA SER A2035 -7.984 6.980 -1.184 1.00 2.13 H new ATOM 0 HB2 SER A2035 -8.288 4.974 -2.383 1.00 64.35 H new ATOM 0 HB3 SER A2035 -9.717 4.527 -1.474 1.00 64.35 H new ATOM 0 HG SER A2035 -10.238 5.332 -3.589 1.00 62.44 H new ATOM 374 N ARG A2036 -10.913 6.637 0.297 1.00 22.20 N ATOM 375 CA ARG A2036 -12.099 7.356 0.729 1.00 60.04 C ATOM 376 C ARG A2036 -11.705 8.644 1.454 1.00 52.34 C ATOM 377 O ARG A2036 -12.361 9.673 1.300 1.00 61.14 O ATOM 378 CB ARG A2036 -12.956 6.497 1.661 1.00 51.33 C ATOM 379 CG ARG A2036 -14.437 6.603 1.296 1.00 64.41 C ATOM 380 CD ARG A2036 -15.126 5.240 1.399 1.00 71.24 C ATOM 381 NE ARG A2036 -15.864 4.951 0.150 1.00 72.22 N ATOM 382 CZ ARG A2036 -16.312 3.725 -0.198 1.00 55.23 C ATOM 383 NH1 ARG A2036 -16.099 2.662 0.608 1.00 41.33 N ATOM 384 NH2 ARG A2036 -16.960 3.581 -1.339 1.00 24.22 N ATOM 0 H ARG A2036 -10.874 5.662 0.594 1.00 22.20 H new ATOM 0 HA ARG A2036 -12.681 7.599 -0.160 1.00 60.04 H new ATOM 0 HB2 ARG A2036 -12.636 5.457 1.599 1.00 51.33 H new ATOM 0 HB3 ARG A2036 -12.808 6.815 2.693 1.00 51.33 H new ATOM 0 HG2 ARG A2036 -14.929 7.314 1.960 1.00 64.41 H new ATOM 0 HG3 ARG A2036 -14.539 6.990 0.282 1.00 64.41 H new ATOM 0 HD2 ARG A2036 -14.385 4.462 1.582 1.00 71.24 H new ATOM 0 HD3 ARG A2036 -15.812 5.233 2.246 1.00 71.24 H new ATOM 0 HE ARG A2036 -16.046 5.726 -0.488 1.00 72.22 H new ATOM 0 HH11 ARG A2036 -15.596 2.781 1.487 1.00 41.33 H new ATOM 0 HH12 ARG A2036 -16.441 1.740 0.337 1.00 41.33 H new ATOM 0 HH21 ARG A2036 -17.116 4.388 -1.943 1.00 24.22 H new ATOM 0 HH22 ARG A2036 -17.305 2.662 -1.617 1.00 24.22 H new ATOM 396 N LEU A2037 -10.634 8.546 2.227 1.00 31.42 N ATOM 397 CA LEU A2037 -10.144 9.690 2.977 1.00 72.10 C ATOM 398 C LEU A2037 -9.532 10.704 2.009 1.00 22.41 C ATOM 399 O LEU A2037 -9.660 11.911 2.205 1.00 41.44 O ATOM 400 CB LEU A2037 -9.185 9.237 4.081 1.00 44.25 C ATOM 401 CG LEU A2037 -9.740 8.213 5.071 1.00 20.53 C ATOM 402 CD1 LEU A2037 -8.708 7.123 5.369 1.00 63.12 C ATOM 403 CD2 LEU A2037 -10.235 8.897 6.348 1.00 22.12 C ATOM 0 H LEU A2037 -10.091 7.691 2.350 1.00 31.42 H new ATOM 0 HA LEU A2037 -10.966 10.191 3.487 1.00 72.10 H new ATOM 0 HB2 LEU A2037 -8.296 8.815 3.612 1.00 44.25 H new ATOM 0 HB3 LEU A2037 -8.864 10.116 4.640 1.00 44.25 H new ATOM 0 HG LEU A2037 -10.600 7.726 4.612 1.00 20.53 H new ATOM 0 HD11 LEU A2037 -9.128 6.408 6.076 1.00 63.12 H new ATOM 0 HD12 LEU A2037 -8.445 6.608 4.445 1.00 63.12 H new ATOM 0 HD13 LEU A2037 -7.814 7.576 5.799 1.00 63.12 H new ATOM 0 HD21 LEU A2037 -10.625 8.146 7.035 1.00 22.12 H new ATOM 0 HD22 LEU A2037 -9.408 9.427 6.821 1.00 22.12 H new ATOM 0 HD23 LEU A2037 -11.025 9.605 6.099 1.00 22.12 H new ATOM 415 N TYR A2038 -8.878 10.176 0.983 1.00 24.51 N ATOM 416 CA TYR A2038 -8.245 11.019 -0.016 1.00 63.14 C ATOM 417 C TYR A2038 -9.287 11.637 -0.952 1.00 31.32 C ATOM 418 O TYR A2038 -9.344 12.855 -1.105 1.00 61.13 O ATOM 419 CB TYR A2038 -7.331 10.098 -0.827 1.00 63.42 C ATOM 420 CG TYR A2038 -6.502 10.824 -1.888 1.00 22.01 C ATOM 421 CD1 TYR A2038 -5.600 11.800 -1.513 1.00 23.20 C ATOM 422 CD2 TYR A2038 -6.654 10.502 -3.221 1.00 45.22 C ATOM 423 CE1 TYR A2038 -4.819 12.481 -2.512 1.00 72.24 C ATOM 424 CE2 TYR A2038 -5.874 11.185 -4.222 1.00 32.44 C ATOM 425 CZ TYR A2038 -4.994 12.140 -3.816 1.00 50.42 C ATOM 426 OH TYR A2038 -4.256 12.785 -4.760 1.00 32.33 O ATOM 0 H TYR A2038 -8.774 9.174 0.823 1.00 24.51 H new ATOM 0 HA TYR A2038 -7.701 11.835 0.459 1.00 63.14 H new ATOM 0 HB2 TYR A2038 -6.657 9.580 -0.145 1.00 63.42 H new ATOM 0 HB3 TYR A2038 -7.939 9.336 -1.314 1.00 63.42 H new ATOM 0 HD1 TYR A2038 -5.481 12.052 -0.470 1.00 23.20 H new ATOM 0 HD2 TYR A2038 -7.358 9.737 -3.515 1.00 45.22 H new ATOM 0 HE1 TYR A2038 -4.110 13.246 -2.232 1.00 72.24 H new ATOM 0 HE2 TYR A2038 -5.985 10.945 -5.269 1.00 32.44 H new ATOM 0 HH TYR A2038 -4.485 12.438 -5.648 1.00 32.33 H new ATOM 501 N ASN A2043 -7.863 14.431 4.412 1.00 22.11 N ATOM 502 CA ASN A2043 -7.017 13.999 5.510 1.00 73.14 C ATOM 503 C ASN A2043 -6.046 12.929 5.012 1.00 11.33 C ATOM 504 O ASN A2043 -6.315 11.734 5.135 1.00 55.45 O ATOM 505 CB ASN A2043 -7.852 13.392 6.641 1.00 11.21 C ATOM 506 CG ASN A2043 -8.073 14.405 7.766 1.00 44.40 C ATOM 507 OD1 ASN A2043 -7.587 15.524 7.732 1.00 13.53 O ATOM 508 ND2 ASN A2043 -8.834 13.953 8.758 1.00 11.33 N ATOM 0 HA ASN A2043 -6.480 14.870 5.885 1.00 73.14 H new ATOM 0 HB2 ASN A2043 -8.814 13.062 6.250 1.00 11.21 H new ATOM 0 HB3 ASN A2043 -7.349 12.509 7.036 1.00 11.21 H new ATOM 0 HD21 ASN A2043 -9.043 14.554 9.555 1.00 11.33 H new ATOM 0 HD22 ASN A2043 -9.209 13.005 8.722 1.00 11.33 H new ATOM 515 N VAL A2044 -4.934 13.394 4.457 1.00 63.41 N ATOM 516 CA VAL A2044 -3.921 12.492 3.939 1.00 41.35 C ATOM 517 C VAL A2044 -3.378 11.633 5.081 1.00 11.52 C ATOM 518 O VAL A2044 -2.684 10.645 4.844 1.00 54.51 O ATOM 519 CB VAL A2044 -2.831 13.287 3.217 1.00 73.54 C ATOM 520 CG1 VAL A2044 -1.552 12.461 3.077 1.00 34.24 C ATOM 521 CG2 VAL A2044 -3.322 13.776 1.853 1.00 74.44 C ATOM 0 H VAL A2044 -4.714 14.385 4.356 1.00 63.41 H new ATOM 0 HA VAL A2044 -4.353 11.816 3.201 1.00 41.35 H new ATOM 0 HB VAL A2044 -2.598 14.163 3.822 1.00 73.54 H new ATOM 0 HG11 VAL A2044 -0.794 13.049 2.560 1.00 34.24 H new ATOM 0 HG12 VAL A2044 -1.186 12.186 4.066 1.00 34.24 H new ATOM 0 HG13 VAL A2044 -1.763 11.558 2.504 1.00 34.24 H new ATOM 0 HG21 VAL A2044 -2.528 14.338 1.361 1.00 74.44 H new ATOM 0 HG22 VAL A2044 -3.596 12.920 1.237 1.00 74.44 H new ATOM 0 HG23 VAL A2044 -4.192 14.419 1.988 1.00 74.44 H new ATOM 531 N LYS A2045 -3.713 12.039 6.298 1.00 21.13 N ATOM 532 CA LYS A2045 -3.266 11.319 7.477 1.00 40.45 C ATOM 533 C LYS A2045 -4.027 9.996 7.581 1.00 43.42 C ATOM 534 O LYS A2045 -3.443 8.966 7.912 1.00 22.33 O ATOM 535 CB LYS A2045 -3.394 12.199 8.722 1.00 41.50 C ATOM 536 CG LYS A2045 -4.720 12.962 8.721 1.00 62.02 C ATOM 537 CD LYS A2045 -4.529 14.396 8.223 1.00 21.01 C ATOM 538 CE LYS A2045 -4.388 15.369 9.395 1.00 60.21 C ATOM 539 NZ LYS A2045 -3.791 16.646 8.939 1.00 24.34 N ATOM 0 H LYS A2045 -4.289 12.858 6.492 1.00 21.13 H new ATOM 0 HA LYS A2045 -2.207 11.073 7.394 1.00 40.45 H new ATOM 0 HB2 LYS A2045 -3.327 11.581 9.617 1.00 41.50 H new ATOM 0 HB3 LYS A2045 -2.564 12.905 8.759 1.00 41.50 H new ATOM 0 HG2 LYS A2045 -5.440 12.446 8.086 1.00 62.02 H new ATOM 0 HG3 LYS A2045 -5.136 12.976 9.728 1.00 62.02 H new ATOM 0 HD2 LYS A2045 -3.642 14.450 7.592 1.00 21.01 H new ATOM 0 HD3 LYS A2045 -5.379 14.686 7.605 1.00 21.01 H new ATOM 0 HE2 LYS A2045 -5.365 15.556 9.840 1.00 60.21 H new ATOM 0 HE3 LYS A2045 -3.764 14.925 10.171 1.00 60.21 H new ATOM 0 HZ1 LYS A2045 -3.702 17.295 9.746 1.00 24.34 H new ATOM 0 HZ2 LYS A2045 -2.850 16.465 8.535 1.00 24.34 H new ATOM 0 HZ3 LYS A2045 -4.401 17.076 8.215 1.00 24.34 H new ATOM 552 N GLY A2046 -5.317 10.067 7.288 1.00 11.12 N ATOM 553 CA GLY A2046 -6.163 8.886 7.343 1.00 42.20 C ATOM 554 C GLY A2046 -5.592 7.763 6.478 1.00 21.13 C ATOM 555 O GLY A2046 -5.333 6.666 6.971 1.00 55.35 O ATOM 0 H GLY A2046 -5.797 10.923 7.012 1.00 11.12 H new ATOM 0 HA2 GLY A2046 -6.252 8.546 8.375 1.00 42.20 H new ATOM 0 HA3 GLY A2046 -7.167 9.137 7.002 1.00 42.20 H new ATOM 559 N MET A2047 -5.414 8.071 5.202 1.00 52.21 N ATOM 560 CA MET A2047 -4.877 7.101 4.263 1.00 53.04 C ATOM 561 C MET A2047 -3.514 6.583 4.728 1.00 51.00 C ATOM 562 O MET A2047 -3.281 5.376 4.763 1.00 45.32 O ATOM 563 CB MET A2047 -4.736 7.748 2.884 1.00 24.13 C ATOM 564 CG MET A2047 -4.673 9.272 2.997 1.00 73.41 C ATOM 565 SD MET A2047 -3.915 9.962 1.536 1.00 14.51 S ATOM 566 CE MET A2047 -2.323 9.156 1.605 1.00 12.34 C ATOM 0 H MET A2047 -5.633 8.981 4.796 1.00 52.21 H new ATOM 0 HA MET A2047 -5.565 6.257 4.208 1.00 53.04 H new ATOM 0 HB2 MET A2047 -3.834 7.378 2.396 1.00 24.13 H new ATOM 0 HB3 MET A2047 -5.579 7.461 2.256 1.00 24.13 H new ATOM 0 HG2 MET A2047 -5.677 9.677 3.122 1.00 73.41 H new ATOM 0 HG3 MET A2047 -4.103 9.556 3.881 1.00 73.41 H new ATOM 0 HE1 MET A2047 -1.569 9.801 1.153 1.00 12.34 H new ATOM 0 HE2 MET A2047 -2.059 8.961 2.644 1.00 12.34 H new ATOM 0 HE3 MET A2047 -2.368 8.213 1.059 1.00 12.34 H new ATOM 576 N PHE A2048 -2.646 7.525 5.073 1.00 74.51 N ATOM 577 CA PHE A2048 -1.313 7.180 5.534 1.00 34.44 C ATOM 578 C PHE A2048 -1.373 6.345 6.816 1.00 13.23 C ATOM 579 O PHE A2048 -0.549 5.457 7.022 1.00 13.21 O ATOM 580 CB PHE A2048 -0.587 8.493 5.830 1.00 65.30 C ATOM 581 CG PHE A2048 0.159 9.078 4.628 1.00 21.32 C ATOM 582 CD1 PHE A2048 0.860 8.257 3.800 1.00 73.12 C ATOM 583 CD2 PHE A2048 0.121 10.415 4.388 1.00 41.54 C ATOM 584 CE1 PHE A2048 1.552 8.799 2.685 1.00 64.21 C ATOM 585 CE2 PHE A2048 0.814 10.956 3.273 1.00 53.43 C ATOM 586 CZ PHE A2048 1.515 10.137 2.444 1.00 24.44 C ATOM 0 H PHE A2048 -2.841 8.526 5.042 1.00 74.51 H new ATOM 0 HA PHE A2048 -0.799 6.593 4.773 1.00 34.44 H new ATOM 0 HB2 PHE A2048 -1.312 9.225 6.185 1.00 65.30 H new ATOM 0 HB3 PHE A2048 0.123 8.329 6.640 1.00 65.30 H new ATOM 0 HD1 PHE A2048 0.890 7.194 3.991 1.00 73.12 H new ATOM 0 HD2 PHE A2048 -0.436 11.066 5.045 1.00 41.54 H new ATOM 0 HE1 PHE A2048 2.109 8.148 2.027 1.00 64.21 H new ATOM 0 HE2 PHE A2048 0.784 12.019 3.083 1.00 53.43 H new ATOM 0 HZ PHE A2048 2.042 10.548 1.596 1.00 24.44 H new ATOM 596 N GLU A2049 -2.360 6.660 7.643 1.00 52.45 N ATOM 597 CA GLU A2049 -2.539 5.951 8.898 1.00 40.35 C ATOM 598 C GLU A2049 -3.177 4.583 8.648 1.00 0.30 C ATOM 599 O GLU A2049 -3.171 3.721 9.526 1.00 42.34 O ATOM 600 CB GLU A2049 -3.376 6.774 9.879 1.00 53.22 C ATOM 601 CG GLU A2049 -2.675 8.090 10.227 1.00 13.11 C ATOM 602 CD GLU A2049 -1.814 7.936 11.482 1.00 54.31 C ATOM 603 OE1 GLU A2049 -2.304 8.149 12.601 1.00 51.33 O ATOM 604 OE2 GLU A2049 -0.592 7.582 11.265 1.00 71.20 O ATOM 0 H GLU A2049 -3.043 7.397 7.468 1.00 52.45 H new ATOM 0 HA GLU A2049 -1.558 5.797 9.348 1.00 40.35 H new ATOM 0 HB2 GLU A2049 -4.353 6.982 9.443 1.00 53.22 H new ATOM 0 HB3 GLU A2049 -3.548 6.198 10.788 1.00 53.22 H new ATOM 0 HG2 GLU A2049 -2.052 8.407 9.391 1.00 13.11 H new ATOM 0 HG3 GLU A2049 -3.418 8.872 10.385 1.00 13.11 H new ATOM 612 N VAL A2050 -3.711 4.425 7.445 1.00 25.11 N ATOM 613 CA VAL A2050 -4.350 3.176 7.070 1.00 65.05 C ATOM 614 C VAL A2050 -3.292 2.202 6.547 1.00 54.12 C ATOM 615 O VAL A2050 -3.315 1.018 6.880 1.00 51.24 O ATOM 616 CB VAL A2050 -5.465 3.445 6.057 1.00 3.11 C ATOM 617 CG1 VAL A2050 -5.738 2.207 5.200 1.00 1.12 C ATOM 618 CG2 VAL A2050 -6.741 3.917 6.758 1.00 33.32 C ATOM 0 H VAL A2050 -3.714 5.141 6.719 1.00 25.11 H new ATOM 0 HA VAL A2050 -4.819 2.711 7.937 1.00 65.05 H new ATOM 0 HB VAL A2050 -5.130 4.244 5.396 1.00 3.11 H new ATOM 0 HG11 VAL A2050 -6.534 2.425 4.489 1.00 1.12 H new ATOM 0 HG12 VAL A2050 -4.833 1.933 4.658 1.00 1.12 H new ATOM 0 HG13 VAL A2050 -6.041 1.380 5.842 1.00 1.12 H new ATOM 0 HG21 VAL A2050 -7.517 4.101 6.015 1.00 33.32 H new ATOM 0 HG22 VAL A2050 -7.079 3.149 7.454 1.00 33.32 H new ATOM 0 HG23 VAL A2050 -6.537 4.837 7.305 1.00 33.32 H new ATOM 628 N LEU A2051 -2.388 2.738 5.740 1.00 71.04 N ATOM 629 CA LEU A2051 -1.323 1.931 5.169 1.00 22.32 C ATOM 630 C LEU A2051 -0.240 1.703 6.225 1.00 41.52 C ATOM 631 O LEU A2051 0.265 0.591 6.374 1.00 32.24 O ATOM 632 CB LEU A2051 -0.800 2.566 3.880 1.00 50.25 C ATOM 633 CG LEU A2051 -1.767 3.508 3.157 1.00 11.52 C ATOM 634 CD1 LEU A2051 -1.302 3.777 1.725 1.00 72.20 C ATOM 635 CD2 LEU A2051 -3.197 2.969 3.203 1.00 34.34 C ATOM 0 H LEU A2051 -2.371 3.721 5.468 1.00 71.04 H new ATOM 0 HA LEU A2051 -1.702 0.950 4.882 1.00 22.32 H new ATOM 0 HB2 LEU A2051 0.109 3.120 4.114 1.00 50.25 H new ATOM 0 HB3 LEU A2051 -0.519 1.768 3.193 1.00 50.25 H new ATOM 0 HG LEU A2051 -1.767 4.464 3.681 1.00 11.52 H new ATOM 0 HD11 LEU A2051 -2.006 4.449 1.234 1.00 72.20 H new ATOM 0 HD12 LEU A2051 -0.314 4.237 1.744 1.00 72.20 H new ATOM 0 HD13 LEU A2051 -1.254 2.837 1.175 1.00 72.20 H new ATOM 0 HD21 LEU A2051 -3.862 3.658 2.682 1.00 34.34 H new ATOM 0 HD22 LEU A2051 -3.234 1.993 2.719 1.00 34.34 H new ATOM 0 HD23 LEU A2051 -3.516 2.871 4.241 1.00 34.34 H new ATOM 647 N GLU A2052 0.089 2.776 6.932 1.00 63.53 N ATOM 648 CA GLU A2052 1.102 2.706 7.971 1.00 70.04 C ATOM 649 C GLU A2052 1.012 1.374 8.713 1.00 32.25 C ATOM 650 O GLU A2052 2.005 0.659 8.838 1.00 11.01 O ATOM 651 CB GLU A2052 0.976 3.884 8.940 1.00 24.43 C ATOM 652 CG GLU A2052 2.143 4.858 8.776 1.00 13.41 C ATOM 653 CD GLU A2052 3.114 4.755 9.955 1.00 74.05 C ATOM 654 OE1 GLU A2052 3.705 3.688 10.179 1.00 12.33 O ATOM 655 OE2 GLU A2052 3.242 5.834 10.650 1.00 73.20 O ATOM 0 H GLU A2052 -0.329 3.698 6.805 1.00 63.53 H new ATOM 0 HA GLU A2052 2.082 2.769 7.499 1.00 70.04 H new ATOM 0 HB2 GLU A2052 0.035 4.405 8.763 1.00 24.43 H new ATOM 0 HB3 GLU A2052 0.948 3.514 9.965 1.00 24.43 H new ATOM 0 HG2 GLU A2052 2.671 4.645 7.846 1.00 13.41 H new ATOM 0 HG3 GLU A2052 1.763 5.877 8.701 1.00 13.41 H new ATOM 663 N PRO A2053 -0.220 1.068 9.202 1.00 53.22 N ATOM 664 CA PRO A2053 -0.454 -0.167 9.930 1.00 4.12 C ATOM 665 C PRO A2053 -0.497 -1.364 8.977 1.00 34.01 C ATOM 666 O PRO A2053 0.190 -2.360 9.196 1.00 63.51 O ATOM 667 CB PRO A2053 -1.764 0.053 10.668 1.00 51.03 C ATOM 668 CG PRO A2053 -2.448 1.214 9.967 1.00 21.12 C ATOM 669 CD PRO A2053 -1.420 1.891 9.074 1.00 54.24 C ATOM 0 HA PRO A2053 0.347 -0.401 10.631 1.00 4.12 H new ATOM 0 HB2 PRO A2053 -2.385 -0.842 10.637 1.00 51.03 H new ATOM 0 HB3 PRO A2053 -1.586 0.281 11.719 1.00 51.03 H new ATOM 0 HG2 PRO A2053 -3.292 0.859 9.376 1.00 21.12 H new ATOM 0 HG3 PRO A2053 -2.844 1.920 10.696 1.00 21.12 H new ATOM 0 HD2 PRO A2053 -1.762 1.935 8.040 1.00 54.24 H new ATOM 0 HD3 PRO A2053 -1.233 2.917 9.392 1.00 54.24 H new ATOM 677 N LEU A2054 -1.313 -1.226 7.942 1.00 25.13 N ATOM 678 CA LEU A2054 -1.455 -2.283 6.956 1.00 11.24 C ATOM 679 C LEU A2054 -0.069 -2.763 6.524 1.00 35.13 C ATOM 680 O LEU A2054 0.240 -3.951 6.624 1.00 44.32 O ATOM 681 CB LEU A2054 -2.334 -1.817 5.792 1.00 10.31 C ATOM 682 CG LEU A2054 -3.844 -1.966 5.991 1.00 54.52 C ATOM 683 CD1 LEU A2054 -4.177 -2.264 7.453 1.00 20.32 C ATOM 684 CD2 LEU A2054 -4.588 -0.733 5.473 1.00 12.44 C ATOM 0 H LEU A2054 -1.882 -0.398 7.765 1.00 25.13 H new ATOM 0 HA LEU A2054 -1.969 -3.141 7.390 1.00 11.24 H new ATOM 0 HB2 LEU A2054 -2.115 -0.768 5.595 1.00 10.31 H new ATOM 0 HB3 LEU A2054 -2.048 -2.375 4.900 1.00 10.31 H new ATOM 0 HG LEU A2054 -4.184 -2.819 5.404 1.00 54.52 H new ATOM 0 HD11 LEU A2054 -5.256 -2.365 7.567 1.00 20.32 H new ATOM 0 HD12 LEU A2054 -3.692 -3.192 7.755 1.00 20.32 H new ATOM 0 HD13 LEU A2054 -3.821 -1.447 8.081 1.00 20.32 H new ATOM 0 HD21 LEU A2054 -5.659 -0.864 5.626 1.00 12.44 H new ATOM 0 HD22 LEU A2054 -4.249 0.150 6.014 1.00 12.44 H new ATOM 0 HD23 LEU A2054 -4.386 -0.606 4.409 1.00 12.44 H new ATOM 696 N HIS A2055 0.732 -1.817 6.057 1.00 73.35 N ATOM 697 CA HIS A2055 2.080 -2.129 5.610 1.00 74.12 C ATOM 698 C HIS A2055 2.894 -2.679 6.781 1.00 21.54 C ATOM 699 O HIS A2055 3.551 -3.711 6.654 1.00 64.51 O ATOM 700 CB HIS A2055 2.732 -0.907 4.957 1.00 52.03 C ATOM 701 CG HIS A2055 2.050 -0.452 3.690 1.00 42.32 C ATOM 702 ND1 HIS A2055 2.049 0.869 3.273 1.00 22.41 N ATOM 703 CD2 HIS A2055 1.347 -1.152 2.754 1.00 5.40 C ATOM 704 CE1 HIS A2055 1.374 0.947 2.135 1.00 3.20 C ATOM 705 NE2 HIS A2055 0.940 -0.306 1.816 1.00 11.15 N ATOM 0 H HIS A2055 0.474 -0.833 5.978 1.00 73.35 H new ATOM 0 HA HIS A2055 2.043 -2.903 4.843 1.00 74.12 H new ATOM 0 HB2 HIS A2055 2.735 -0.084 5.672 1.00 52.03 H new ATOM 0 HB3 HIS A2055 3.773 -1.139 4.734 1.00 52.03 H new ATOM 0 HD2 HIS A2055 1.154 -2.214 2.773 1.00 5.40 H new ATOM 0 HE1 HIS A2055 1.199 1.845 1.561 1.00 3.20 H new ATOM 0 HE2 HIS A2055 0.392 -0.552 0.992 1.00 11.15 H new ATOM 714 N ALA A2056 2.822 -1.968 7.897 1.00 33.43 N ATOM 715 CA ALA A2056 3.545 -2.373 9.092 1.00 44.12 C ATOM 716 C ALA A2056 3.186 -3.820 9.433 1.00 65.53 C ATOM 717 O ALA A2056 4.068 -4.651 9.641 1.00 44.10 O ATOM 718 CB ALA A2056 3.226 -1.408 10.234 1.00 63.32 C ATOM 0 H ALA A2056 2.274 -1.114 7.999 1.00 33.43 H new ATOM 0 HA ALA A2056 4.621 -2.331 8.922 1.00 44.12 H new ATOM 0 HB1 ALA A2056 3.768 -1.712 11.129 1.00 63.32 H new ATOM 0 HB2 ALA A2056 3.527 -0.399 9.953 1.00 63.32 H new ATOM 0 HB3 ALA A2056 2.155 -1.424 10.435 1.00 63.32 H new ATOM 724 N MET A2057 1.885 -4.078 9.483 1.00 40.31 N ATOM 725 CA MET A2057 1.398 -5.410 9.795 1.00 14.22 C ATOM 726 C MET A2057 2.062 -6.461 8.903 1.00 32.12 C ATOM 727 O MET A2057 2.367 -7.563 9.356 1.00 23.24 O ATOM 728 CB MET A2057 -0.118 -5.458 9.597 1.00 34.30 C ATOM 729 CG MET A2057 -0.500 -6.478 8.523 1.00 44.41 C ATOM 730 SD MET A2057 -2.275 -6.583 8.384 1.00 0.23 S ATOM 731 CE MET A2057 -2.432 -6.884 6.630 1.00 53.41 C ATOM 0 H MET A2057 1.155 -3.386 9.312 1.00 40.31 H new ATOM 0 HA MET A2057 1.646 -5.633 10.833 1.00 14.22 H new ATOM 0 HB2 MET A2057 -0.603 -5.717 10.538 1.00 34.30 H new ATOM 0 HB3 MET A2057 -0.482 -4.471 9.312 1.00 34.30 H new ATOM 0 HG2 MET A2057 -0.069 -6.188 7.565 1.00 44.41 H new ATOM 0 HG3 MET A2057 -0.088 -7.455 8.775 1.00 44.41 H new ATOM 0 HE1 MET A2057 -3.478 -7.064 6.384 1.00 53.41 H new ATOM 0 HE2 MET A2057 -2.074 -6.015 6.078 1.00 53.41 H new ATOM 0 HE3 MET A2057 -1.839 -7.757 6.356 1.00 53.41 H new ATOM 741 N MET A2058 2.270 -6.082 7.650 1.00 32.24 N ATOM 742 CA MET A2058 2.893 -6.978 6.691 1.00 75.10 C ATOM 743 C MET A2058 4.349 -7.255 7.065 1.00 12.12 C ATOM 744 O MET A2058 4.820 -8.386 6.950 1.00 3.00 O ATOM 745 CB MET A2058 2.833 -6.353 5.296 1.00 62.44 C ATOM 746 CG MET A2058 1.390 -6.050 4.890 1.00 25.40 C ATOM 747 SD MET A2058 0.891 -7.127 3.557 1.00 11.03 S ATOM 748 CE MET A2058 -0.808 -7.424 4.015 1.00 53.32 C ATOM 0 H MET A2058 2.018 -5.167 7.277 1.00 32.24 H new ATOM 0 HA MET A2058 2.350 -7.923 6.699 1.00 75.10 H new ATOM 0 HB2 MET A2058 3.419 -5.434 5.280 1.00 62.44 H new ATOM 0 HB3 MET A2058 3.283 -7.031 4.571 1.00 62.44 H new ATOM 0 HG2 MET A2058 0.727 -6.185 5.745 1.00 25.40 H new ATOM 0 HG3 MET A2058 1.302 -5.009 4.580 1.00 25.40 H new ATOM 0 HE1 MET A2058 -1.377 -7.717 3.133 1.00 53.32 H new ATOM 0 HE2 MET A2058 -0.851 -8.222 4.756 1.00 53.32 H new ATOM 0 HE3 MET A2058 -1.236 -6.514 4.437 1.00 53.32 H new ATOM 758 N GLU A2059 5.025 -6.203 7.505 1.00 53.10 N ATOM 759 CA GLU A2059 6.418 -6.319 7.898 1.00 34.10 C ATOM 760 C GLU A2059 6.551 -7.207 9.137 1.00 24.41 C ATOM 761 O GLU A2059 7.152 -8.278 9.075 1.00 33.32 O ATOM 762 CB GLU A2059 7.035 -4.940 8.144 1.00 62.21 C ATOM 763 CG GLU A2059 6.488 -3.910 7.154 1.00 51.24 C ATOM 764 CD GLU A2059 6.319 -4.524 5.762 1.00 10.32 C ATOM 765 OE1 GLU A2059 7.107 -5.396 5.370 1.00 10.44 O ATOM 766 OE2 GLU A2059 5.326 -4.064 5.081 1.00 51.04 O ATOM 0 H GLU A2059 4.633 -5.266 7.598 1.00 53.10 H new ATOM 0 HA GLU A2059 6.966 -6.787 7.080 1.00 34.10 H new ATOM 0 HB2 GLU A2059 6.822 -4.619 9.163 1.00 62.21 H new ATOM 0 HB3 GLU A2059 8.119 -5.001 8.049 1.00 62.21 H new ATOM 0 HG2 GLU A2059 5.528 -3.533 7.508 1.00 51.24 H new ATOM 0 HG3 GLU A2059 7.165 -3.057 7.100 1.00 51.24 H new ATOM 774 N ARG A2060 5.976 -6.730 10.232 1.00 50.30 N ATOM 775 CA ARG A2060 6.021 -7.468 11.483 1.00 52.43 C ATOM 776 C ARG A2060 5.235 -8.776 11.357 1.00 13.01 C ATOM 777 O ARG A2060 5.652 -9.808 11.878 1.00 13.21 O ATOM 778 CB ARG A2060 5.440 -6.641 12.632 1.00 14.45 C ATOM 779 CG ARG A2060 3.985 -6.262 12.353 1.00 54.25 C ATOM 780 CD ARG A2060 3.547 -5.086 13.229 1.00 72.43 C ATOM 781 NE ARG A2060 2.402 -5.487 14.077 1.00 65.22 N ATOM 782 CZ ARG A2060 1.907 -4.737 15.085 1.00 61.25 C ATOM 783 NH1 ARG A2060 2.455 -3.539 15.381 1.00 5.10 N ATOM 784 NH2 ARG A2060 0.880 -5.191 15.777 1.00 61.10 N ATOM 0 H ARG A2060 5.477 -5.842 10.278 1.00 50.30 H new ATOM 0 HA ARG A2060 7.066 -7.688 11.701 1.00 52.43 H new ATOM 0 HB2 ARG A2060 5.500 -7.209 13.560 1.00 14.45 H new ATOM 0 HB3 ARG A2060 6.034 -5.738 12.772 1.00 14.45 H new ATOM 0 HG2 ARG A2060 3.869 -6.000 11.301 1.00 54.25 H new ATOM 0 HG3 ARG A2060 3.340 -7.120 12.541 1.00 54.25 H new ATOM 0 HD2 ARG A2060 4.377 -4.759 13.855 1.00 72.43 H new ATOM 0 HD3 ARG A2060 3.267 -4.239 12.602 1.00 72.43 H new ATOM 0 HE ARG A2060 1.959 -6.386 13.888 1.00 65.22 H new ATOM 0 HH11 ARG A2060 3.249 -3.194 14.842 1.00 5.10 H new ATOM 0 HH12 ARG A2060 2.075 -2.979 16.144 1.00 5.10 H new ATOM 0 HH21 ARG A2060 0.471 -6.097 15.548 1.00 61.10 H new ATOM 0 HH22 ARG A2060 0.495 -4.636 16.541 1.00 61.10 H new ATOM 796 N GLY A2061 4.111 -8.687 10.660 1.00 41.24 N ATOM 797 CA GLY A2061 3.263 -9.849 10.459 1.00 31.22 C ATOM 798 C GLY A2061 3.154 -10.200 8.974 1.00 12.42 C ATOM 799 O GLY A2061 2.183 -9.833 8.315 1.00 55.02 O ATOM 0 H GLY A2061 3.769 -7.829 10.228 1.00 41.24 H new ATOM 0 HA2 GLY A2061 3.669 -10.699 11.008 1.00 31.22 H new ATOM 0 HA3 GLY A2061 2.270 -9.653 10.864 1.00 31.22 H new ATOM 803 N PRO A2062 4.193 -10.924 8.477 1.00 60.12 N ATOM 804 CA PRO A2062 4.224 -11.327 7.082 1.00 4.41 C ATOM 805 C PRO A2062 3.252 -12.478 6.823 1.00 5.21 C ATOM 806 O PRO A2062 2.067 -12.254 6.578 1.00 3.21 O ATOM 807 CB PRO A2062 5.672 -11.700 6.812 1.00 51.23 C ATOM 808 CG PRO A2062 6.303 -11.936 8.175 1.00 62.33 C ATOM 809 CD PRO A2062 5.361 -11.375 9.227 1.00 10.24 C ATOM 0 HA PRO A2062 3.899 -10.535 6.408 1.00 4.41 H new ATOM 0 HB2 PRO A2062 5.736 -12.594 6.192 1.00 51.23 H new ATOM 0 HB3 PRO A2062 6.187 -10.903 6.276 1.00 51.23 H new ATOM 0 HG2 PRO A2062 6.469 -13.001 8.340 1.00 62.33 H new ATOM 0 HG3 PRO A2062 7.276 -11.449 8.235 1.00 62.33 H new ATOM 0 HD2 PRO A2062 5.091 -12.134 9.962 1.00 10.24 H new ATOM 0 HD3 PRO A2062 5.822 -10.552 9.773 1.00 10.24 H new ATOM 817 N GLN A2063 3.788 -13.690 6.884 1.00 55.44 N ATOM 818 CA GLN A2063 2.982 -14.877 6.660 1.00 45.41 C ATOM 819 C GLN A2063 3.857 -16.131 6.724 1.00 70.40 C ATOM 820 O GLN A2063 3.927 -16.791 7.760 1.00 72.53 O ATOM 821 CB GLN A2063 2.242 -14.793 5.323 1.00 52.21 C ATOM 822 CG GLN A2063 0.727 -14.793 5.534 1.00 72.23 C ATOM 823 CD GLN A2063 0.116 -16.136 5.128 1.00 11.31 C ATOM 824 OE1 GLN A2063 0.638 -16.857 4.293 1.00 21.44 O ATOM 825 NE2 GLN A2063 -1.014 -16.430 5.763 1.00 23.01 N ATOM 0 H GLN A2063 4.771 -13.874 7.085 1.00 55.44 H new ATOM 0 HA GLN A2063 2.233 -14.939 7.449 1.00 45.41 H new ATOM 0 HB2 GLN A2063 2.539 -13.887 4.795 1.00 52.21 H new ATOM 0 HB3 GLN A2063 2.525 -15.636 4.693 1.00 52.21 H new ATOM 0 HG2 GLN A2063 0.502 -14.589 6.581 1.00 72.23 H new ATOM 0 HG3 GLN A2063 0.275 -13.992 4.949 1.00 72.23 H new ATOM 0 HE21 GLN A2063 -1.396 -15.781 6.451 1.00 23.01 H new ATOM 0 HE22 GLN A2063 -1.499 -17.305 5.562 1.00 23.01 H new ATOM 834 N THR A2064 4.501 -16.423 5.603 1.00 71.22 N ATOM 835 CA THR A2064 5.369 -17.585 5.520 1.00 74.50 C ATOM 836 C THR A2064 6.423 -17.388 4.430 1.00 53.31 C ATOM 837 O THR A2064 6.317 -16.471 3.617 1.00 63.32 O ATOM 838 CB THR A2064 4.487 -18.816 5.295 1.00 14.11 C ATOM 839 OG1 THR A2064 5.414 -19.895 5.199 1.00 44.30 O ATOM 840 CG2 THR A2064 3.793 -18.797 3.932 1.00 31.32 C ATOM 0 H THR A2064 4.439 -15.875 4.745 1.00 71.22 H new ATOM 0 HA THR A2064 5.927 -17.729 6.445 1.00 74.50 H new ATOM 0 HB THR A2064 3.736 -18.874 6.083 1.00 14.11 H new ATOM 0 HG1 THR A2064 4.927 -20.733 5.054 1.00 44.30 H new ATOM 0 HG21 THR A2064 3.180 -19.692 3.823 1.00 31.32 H new ATOM 0 HG22 THR A2064 3.160 -17.913 3.858 1.00 31.32 H new ATOM 0 HG23 THR A2064 4.543 -18.773 3.142 1.00 31.32 H new ATOM 848 N LEU A2065 7.420 -18.261 4.449 1.00 55.41 N ATOM 849 CA LEU A2065 8.494 -18.193 3.474 1.00 4.44 C ATOM 850 C LEU A2065 7.897 -18.022 2.076 1.00 63.43 C ATOM 851 O LEU A2065 8.532 -17.448 1.191 1.00 22.54 O ATOM 852 CB LEU A2065 9.415 -19.408 3.604 1.00 54.31 C ATOM 853 CG LEU A2065 10.915 -19.125 3.519 1.00 50.14 C ATOM 854 CD1 LEU A2065 11.345 -18.880 2.071 1.00 24.25 C ATOM 855 CD2 LEU A2065 11.309 -17.964 4.436 1.00 23.42 C ATOM 0 H LEU A2065 7.506 -19.020 5.125 1.00 55.41 H new ATOM 0 HA LEU A2065 9.124 -17.323 3.662 1.00 4.44 H new ATOM 0 HB2 LEU A2065 9.211 -19.893 4.558 1.00 54.31 H new ATOM 0 HB3 LEU A2065 9.155 -20.121 2.822 1.00 54.31 H new ATOM 0 HG LEU A2065 11.448 -20.008 3.870 1.00 50.14 H new ATOM 0 HD11 LEU A2065 12.416 -18.681 2.038 1.00 24.25 H new ATOM 0 HD12 LEU A2065 11.121 -19.762 1.471 1.00 24.25 H new ATOM 0 HD13 LEU A2065 10.804 -18.022 1.671 1.00 24.25 H new ATOM 0 HD21 LEU A2065 12.381 -17.785 4.356 1.00 23.42 H new ATOM 0 HD22 LEU A2065 10.767 -17.066 4.139 1.00 23.42 H new ATOM 0 HD23 LEU A2065 11.059 -18.214 5.467 1.00 23.42 H new ATOM 867 N LYS A2066 6.682 -18.528 1.919 1.00 0.12 N ATOM 868 CA LYS A2066 5.992 -18.438 0.644 1.00 73.42 C ATOM 869 C LYS A2066 5.506 -17.004 0.431 1.00 75.04 C ATOM 870 O LYS A2066 5.604 -16.468 -0.671 1.00 73.04 O ATOM 871 CB LYS A2066 4.877 -19.484 0.563 1.00 60.12 C ATOM 872 CG LYS A2066 4.460 -19.728 -0.889 1.00 34.30 C ATOM 873 CD LYS A2066 2.944 -19.603 -1.051 1.00 43.42 C ATOM 874 CE LYS A2066 2.522 -19.894 -2.493 1.00 32.21 C ATOM 875 NZ LYS A2066 1.057 -20.087 -2.574 1.00 41.43 N ATOM 0 H LYS A2066 6.158 -19.002 2.655 1.00 0.12 H new ATOM 0 HA LYS A2066 6.674 -18.668 -0.175 1.00 73.42 H new ATOM 0 HB2 LYS A2066 5.217 -20.418 1.010 1.00 60.12 H new ATOM 0 HB3 LYS A2066 4.016 -19.149 1.141 1.00 60.12 H new ATOM 0 HG2 LYS A2066 4.960 -19.011 -1.540 1.00 34.30 H new ATOM 0 HG3 LYS A2066 4.782 -20.721 -1.202 1.00 34.30 H new ATOM 0 HD2 LYS A2066 2.444 -20.296 -0.375 1.00 43.42 H new ATOM 0 HD3 LYS A2066 2.626 -18.599 -0.771 1.00 43.42 H new ATOM 0 HE2 LYS A2066 2.823 -19.070 -3.140 1.00 32.21 H new ATOM 0 HE3 LYS A2066 3.033 -20.786 -2.855 1.00 32.21 H new ATOM 0 HZ1 LYS A2066 0.787 -20.284 -3.559 1.00 41.43 H new ATOM 0 HZ2 LYS A2066 0.779 -20.888 -1.972 1.00 41.43 H new ATOM 0 HZ3 LYS A2066 0.575 -19.225 -2.248 1.00 41.43 H new ATOM 888 N GLU A2067 4.993 -16.422 1.506 1.00 64.43 N ATOM 889 CA GLU A2067 4.491 -15.058 1.451 1.00 21.21 C ATOM 890 C GLU A2067 5.645 -14.064 1.587 1.00 54.33 C ATOM 891 O GLU A2067 5.509 -12.897 1.217 1.00 15.02 O ATOM 892 CB GLU A2067 3.431 -14.821 2.529 1.00 41.15 C ATOM 893 CG GLU A2067 2.445 -13.734 2.098 1.00 32.12 C ATOM 894 CD GLU A2067 1.222 -14.343 1.410 1.00 12.23 C ATOM 895 OE1 GLU A2067 0.741 -15.406 1.830 1.00 23.15 O ATOM 896 OE2 GLU A2067 0.770 -13.671 0.406 1.00 34.34 O ATOM 0 H GLU A2067 4.914 -16.869 2.419 1.00 64.43 H new ATOM 0 HA GLU A2067 4.016 -14.903 0.482 1.00 21.21 H new ATOM 0 HB2 GLU A2067 2.893 -15.748 2.725 1.00 41.15 H new ATOM 0 HB3 GLU A2067 3.914 -14.530 3.462 1.00 41.15 H new ATOM 0 HG2 GLU A2067 2.128 -13.160 2.969 1.00 32.12 H new ATOM 0 HG3 GLU A2067 2.939 -13.038 1.420 1.00 32.12 H new ATOM 904 N THR A2068 6.753 -14.558 2.119 1.00 53.34 N ATOM 905 CA THR A2068 7.930 -13.726 2.308 1.00 62.40 C ATOM 906 C THR A2068 8.366 -13.110 0.978 1.00 24.03 C ATOM 907 O THR A2068 8.973 -12.041 0.955 1.00 44.31 O ATOM 908 CB THR A2068 9.013 -14.582 2.966 1.00 33.33 C ATOM 909 OG1 THR A2068 8.584 -14.705 4.321 1.00 44.42 O ATOM 910 CG2 THR A2068 10.355 -13.855 3.065 1.00 63.34 C ATOM 0 H THR A2068 6.861 -15.525 2.426 1.00 53.34 H new ATOM 0 HA THR A2068 7.718 -12.883 2.966 1.00 62.40 H new ATOM 0 HB THR A2068 9.141 -15.504 2.398 1.00 33.33 H new ATOM 0 HG1 THR A2068 7.723 -15.171 4.350 1.00 44.42 H new ATOM 0 HG21 THR A2068 11.088 -14.507 3.540 1.00 63.34 H new ATOM 0 HG22 THR A2068 10.699 -13.589 2.066 1.00 63.34 H new ATOM 0 HG23 THR A2068 10.235 -12.950 3.660 1.00 63.34 H new ATOM 918 N SER A2069 8.041 -13.813 -0.099 1.00 53.22 N ATOM 919 CA SER A2069 8.393 -13.348 -1.430 1.00 72.51 C ATOM 920 C SER A2069 7.580 -12.100 -1.779 1.00 43.14 C ATOM 921 O SER A2069 8.142 -11.081 -2.176 1.00 33.31 O ATOM 922 CB SER A2069 8.161 -14.442 -2.474 1.00 1.01 C ATOM 923 OG SER A2069 8.692 -14.086 -3.747 1.00 75.33 O ATOM 0 H SER A2069 7.538 -14.700 -0.076 1.00 53.22 H new ATOM 0 HA SER A2069 9.454 -13.097 -1.436 1.00 72.51 H new ATOM 0 HB2 SER A2069 8.622 -15.370 -2.135 1.00 1.01 H new ATOM 0 HB3 SER A2069 7.092 -14.633 -2.568 1.00 1.01 H new ATOM 0 HG SER A2069 8.525 -14.811 -4.385 1.00 75.33 H new ATOM 929 N PHE A2070 6.270 -12.222 -1.621 1.00 1.32 N ATOM 930 CA PHE A2070 5.374 -11.115 -1.915 1.00 3.05 C ATOM 931 C PHE A2070 5.635 -9.935 -0.979 1.00 32.21 C ATOM 932 O PHE A2070 5.856 -8.814 -1.433 1.00 1.21 O ATOM 933 CB PHE A2070 3.949 -11.622 -1.694 1.00 4.15 C ATOM 934 CG PHE A2070 2.877 -10.538 -1.815 1.00 72.34 C ATOM 935 CD1 PHE A2070 2.745 -9.601 -0.837 1.00 24.53 C ATOM 936 CD2 PHE A2070 2.055 -10.512 -2.897 1.00 71.32 C ATOM 937 CE1 PHE A2070 1.749 -8.594 -0.949 1.00 1.05 C ATOM 938 CE2 PHE A2070 1.059 -9.505 -3.009 1.00 14.20 C ATOM 939 CZ PHE A2070 0.928 -8.568 -2.033 1.00 42.04 C ATOM 0 H PHE A2070 5.807 -13.070 -1.293 1.00 1.32 H new ATOM 0 HA PHE A2070 5.529 -10.773 -2.938 1.00 3.05 H new ATOM 0 HB2 PHE A2070 3.738 -12.409 -2.418 1.00 4.15 H new ATOM 0 HB3 PHE A2070 3.884 -12.073 -0.704 1.00 4.15 H new ATOM 0 HD1 PHE A2070 3.397 -9.623 0.024 1.00 24.53 H new ATOM 0 HD2 PHE A2070 2.159 -11.257 -3.672 1.00 71.32 H new ATOM 0 HE1 PHE A2070 1.644 -7.850 -0.174 1.00 1.05 H new ATOM 0 HE2 PHE A2070 0.406 -9.484 -3.869 1.00 14.20 H new ATOM 0 HZ PHE A2070 0.171 -7.802 -2.118 1.00 42.04 H new ATOM 949 N ASN A2071 5.599 -10.227 0.314 1.00 0.43 N ATOM 950 CA ASN A2071 5.828 -9.203 1.318 1.00 12.24 C ATOM 951 C ASN A2071 7.113 -8.442 0.982 1.00 65.53 C ATOM 952 O ASN A2071 7.203 -7.237 1.214 1.00 4.14 O ATOM 953 CB ASN A2071 5.998 -9.823 2.707 1.00 25.24 C ATOM 954 CG ASN A2071 6.439 -8.770 3.727 1.00 34.01 C ATOM 955 OD1 ASN A2071 7.507 -8.846 4.313 1.00 63.31 O ATOM 956 ND2 ASN A2071 5.560 -7.789 3.907 1.00 63.12 N ATOM 0 H ASN A2071 5.415 -11.158 0.688 1.00 0.43 H new ATOM 0 HA ASN A2071 4.966 -8.536 1.322 1.00 12.24 H new ATOM 0 HB2 ASN A2071 5.058 -10.272 3.026 1.00 25.24 H new ATOM 0 HB3 ASN A2071 6.736 -10.624 2.664 1.00 25.24 H new ATOM 0 HD21 ASN A2071 5.761 -7.039 4.568 1.00 63.12 H new ATOM 0 HD22 ASN A2071 4.685 -7.786 3.384 1.00 63.12 H new ATOM 963 N GLN A2072 8.074 -9.176 0.441 1.00 64.42 N ATOM 964 CA GLN A2072 9.348 -8.585 0.070 1.00 4.12 C ATOM 965 C GLN A2072 9.223 -7.847 -1.264 1.00 12.23 C ATOM 966 O GLN A2072 9.541 -6.661 -1.354 1.00 30.25 O ATOM 967 CB GLN A2072 10.447 -9.648 0.007 1.00 13.34 C ATOM 968 CG GLN A2072 11.137 -9.804 1.363 1.00 20.13 C ATOM 969 CD GLN A2072 12.639 -10.042 1.192 1.00 2.42 C ATOM 970 OE1 GLN A2072 13.218 -9.780 0.151 1.00 21.02 O ATOM 971 NE2 GLN A2072 13.232 -10.552 2.266 1.00 73.01 N ATOM 0 H GLN A2072 7.996 -10.175 0.251 1.00 64.42 H new ATOM 0 HA GLN A2072 9.629 -7.863 0.837 1.00 4.12 H new ATOM 0 HB2 GLN A2072 10.018 -10.602 -0.299 1.00 13.34 H new ATOM 0 HB3 GLN A2072 11.182 -9.372 -0.749 1.00 13.34 H new ATOM 0 HG2 GLN A2072 10.973 -8.909 1.963 1.00 20.13 H new ATOM 0 HG3 GLN A2072 10.693 -10.638 1.907 1.00 20.13 H new ATOM 0 HE21 GLN A2072 12.686 -10.747 3.105 1.00 73.01 H new ATOM 0 HE22 GLN A2072 14.233 -10.748 2.251 1.00 73.01 H new ATOM 980 N ALA A2073 8.759 -8.578 -2.267 1.00 41.13 N ATOM 981 CA ALA A2073 8.587 -8.007 -3.592 1.00 52.42 C ATOM 982 C ALA A2073 7.957 -6.618 -3.466 1.00 12.31 C ATOM 983 O ALA A2073 8.358 -5.685 -4.161 1.00 21.40 O ATOM 984 CB ALA A2073 7.747 -8.953 -4.452 1.00 12.34 C ATOM 0 H ALA A2073 8.497 -9.561 -2.189 1.00 41.13 H new ATOM 0 HA ALA A2073 9.551 -7.888 -4.086 1.00 52.42 H new ATOM 0 HB1 ALA A2073 7.618 -8.524 -5.446 1.00 12.34 H new ATOM 0 HB2 ALA A2073 8.253 -9.915 -4.535 1.00 12.34 H new ATOM 0 HB3 ALA A2073 6.770 -9.095 -3.989 1.00 12.34 H new ATOM 990 N TYR A2074 6.981 -6.525 -2.576 1.00 54.33 N ATOM 991 CA TYR A2074 6.292 -5.266 -2.350 1.00 63.34 C ATOM 992 C TYR A2074 6.924 -4.494 -1.190 1.00 45.45 C ATOM 993 O TYR A2074 6.944 -3.264 -1.196 1.00 3.14 O ATOM 994 CB TYR A2074 4.854 -5.634 -1.978 1.00 63.13 C ATOM 995 CG TYR A2074 4.019 -6.148 -3.153 1.00 52.45 C ATOM 996 CD1 TYR A2074 4.447 -7.241 -3.878 1.00 25.43 C ATOM 997 CD2 TYR A2074 2.839 -5.516 -3.490 1.00 61.15 C ATOM 998 CE1 TYR A2074 3.661 -7.725 -4.984 1.00 42.14 C ATOM 999 CE2 TYR A2074 2.053 -6.000 -4.596 1.00 44.22 C ATOM 1000 CZ TYR A2074 2.502 -7.080 -5.289 1.00 15.44 C ATOM 1001 OH TYR A2074 1.762 -7.536 -6.333 1.00 12.41 O ATOM 0 H TYR A2074 6.651 -7.301 -2.002 1.00 54.33 H new ATOM 0 HA TYR A2074 6.347 -4.634 -3.237 1.00 63.34 H new ATOM 0 HB2 TYR A2074 4.875 -6.397 -1.199 1.00 63.13 H new ATOM 0 HB3 TYR A2074 4.364 -4.758 -1.553 1.00 63.13 H new ATOM 0 HD1 TYR A2074 5.372 -7.734 -3.616 1.00 25.43 H new ATOM 0 HD2 TYR A2074 2.505 -4.659 -2.924 1.00 61.15 H new ATOM 0 HE1 TYR A2074 3.984 -8.581 -5.558 1.00 42.14 H new ATOM 0 HE2 TYR A2074 1.127 -5.515 -4.869 1.00 44.22 H new ATOM 0 HH TYR A2074 0.811 -7.496 -6.102 1.00 12.41 H new ATOM 1011 N GLY A2075 7.424 -5.249 -0.223 1.00 75.34 N ATOM 1012 CA GLY A2075 8.055 -4.651 0.942 1.00 11.13 C ATOM 1013 C GLY A2075 9.012 -3.529 0.531 1.00 33.54 C ATOM 1014 O GLY A2075 9.270 -2.614 1.311 1.00 41.40 O ATOM 0 H GLY A2075 7.405 -6.269 -0.222 1.00 75.34 H new ATOM 0 HA2 GLY A2075 7.291 -4.255 1.611 1.00 11.13 H new ATOM 0 HA3 GLY A2075 8.600 -5.414 1.497 1.00 11.13 H new ATOM 1018 N ARG A2076 9.510 -3.637 -0.691 1.00 54.22 N ATOM 1019 CA ARG A2076 10.431 -2.644 -1.215 1.00 40.43 C ATOM 1020 C ARG A2076 9.663 -1.423 -1.724 1.00 3.14 C ATOM 1021 O ARG A2076 10.134 -0.294 -1.603 1.00 42.31 O ATOM 1022 CB ARG A2076 11.275 -3.220 -2.353 1.00 63.15 C ATOM 1023 CG ARG A2076 12.445 -2.293 -2.693 1.00 64.54 C ATOM 1024 CD ARG A2076 12.499 -2.008 -4.197 1.00 53.31 C ATOM 1025 NE ARG A2076 12.764 -3.261 -4.939 1.00 60.04 N ATOM 1026 CZ ARG A2076 13.999 -3.743 -5.194 1.00 13.44 C ATOM 1027 NH1 ARG A2076 15.094 -3.080 -4.767 1.00 21.32 N ATOM 1028 NH2 ARG A2076 14.119 -4.873 -5.867 1.00 62.52 N ATOM 0 H ARG A2076 9.293 -4.398 -1.334 1.00 54.22 H new ATOM 0 HA ARG A2076 11.094 -2.347 -0.403 1.00 40.43 H new ATOM 0 HB2 ARG A2076 11.655 -4.201 -2.068 1.00 63.15 H new ATOM 0 HB3 ARG A2076 10.652 -3.364 -3.236 1.00 63.15 H new ATOM 0 HG2 ARG A2076 12.343 -1.356 -2.145 1.00 64.54 H new ATOM 0 HG3 ARG A2076 13.381 -2.750 -2.372 1.00 64.54 H new ATOM 0 HD2 ARG A2076 11.556 -1.572 -4.527 1.00 53.31 H new ATOM 0 HD3 ARG A2076 13.280 -1.277 -4.410 1.00 53.31 H new ATOM 0 HE ARG A2076 11.963 -3.794 -5.279 1.00 60.04 H new ATOM 0 HH11 ARG A2076 14.992 -2.208 -4.248 1.00 21.32 H new ATOM 0 HH12 ARG A2076 16.024 -3.451 -4.964 1.00 21.32 H new ATOM 0 HH21 ARG A2076 13.286 -5.368 -6.186 1.00 62.52 H new ATOM 0 HH22 ARG A2076 15.045 -5.251 -6.068 1.00 62.52 H new ATOM 1040 N ASP A2077 8.493 -1.692 -2.285 1.00 1.33 N ATOM 1041 CA ASP A2077 7.655 -0.630 -2.815 1.00 31.40 C ATOM 1042 C ASP A2077 7.154 0.241 -1.661 1.00 43.51 C ATOM 1043 O ASP A2077 7.427 1.439 -1.618 1.00 73.13 O ATOM 1044 CB ASP A2077 6.434 -1.202 -3.540 1.00 42.23 C ATOM 1045 CG ASP A2077 6.716 -1.761 -4.937 1.00 53.10 C ATOM 1046 OD1 ASP A2077 7.113 -1.024 -5.851 1.00 43.23 O ATOM 1047 OD2 ASP A2077 6.509 -3.028 -5.068 1.00 54.55 O ATOM 0 H ASP A2077 8.106 -2.630 -2.384 1.00 1.33 H new ATOM 0 HA ASP A2077 8.251 -0.048 -3.517 1.00 31.40 H new ATOM 0 HB2 ASP A2077 6.005 -1.995 -2.927 1.00 42.23 H new ATOM 0 HB3 ASP A2077 5.680 -0.420 -3.623 1.00 42.23 H new ATOM 1053 N LEU A2078 6.427 -0.395 -0.754 1.00 33.03 N ATOM 1054 CA LEU A2078 5.884 0.306 0.398 1.00 52.31 C ATOM 1055 C LEU A2078 7.011 1.063 1.106 1.00 53.31 C ATOM 1056 O LEU A2078 6.851 2.227 1.466 1.00 23.41 O ATOM 1057 CB LEU A2078 5.127 -0.662 1.309 1.00 24.22 C ATOM 1058 CG LEU A2078 4.015 -1.476 0.642 1.00 73.34 C ATOM 1059 CD1 LEU A2078 3.658 -0.898 -0.729 1.00 23.32 C ATOM 1060 CD2 LEU A2078 4.393 -2.956 0.561 1.00 73.20 C ATOM 0 H LEU A2078 6.201 -1.389 -0.793 1.00 33.03 H new ATOM 0 HA LEU A2078 5.150 1.047 0.081 1.00 52.31 H new ATOM 0 HB2 LEU A2078 5.845 -1.355 1.747 1.00 24.22 H new ATOM 0 HB3 LEU A2078 4.692 -0.093 2.130 1.00 24.22 H new ATOM 0 HG LEU A2078 3.121 -1.406 1.262 1.00 73.34 H new ATOM 0 HD11 LEU A2078 2.866 -1.495 -1.181 1.00 23.32 H new ATOM 0 HD12 LEU A2078 3.316 0.130 -0.612 1.00 23.32 H new ATOM 0 HD13 LEU A2078 4.538 -0.917 -1.372 1.00 23.32 H new ATOM 0 HD21 LEU A2078 3.586 -3.512 0.083 1.00 73.20 H new ATOM 0 HD22 LEU A2078 5.306 -3.067 -0.024 1.00 73.20 H new ATOM 0 HD23 LEU A2078 4.556 -3.345 1.566 1.00 73.20 H new ATOM 1072 N MET A2079 8.126 0.367 1.284 1.00 41.33 N ATOM 1073 CA MET A2079 9.278 0.959 1.942 1.00 5.34 C ATOM 1074 C MET A2079 9.647 2.298 1.302 1.00 0.22 C ATOM 1075 O MET A2079 9.814 3.298 1.999 1.00 53.33 O ATOM 1076 CB MET A2079 10.468 0.001 1.846 1.00 41.13 C ATOM 1077 CG MET A2079 10.678 -0.744 3.166 1.00 70.30 C ATOM 1078 SD MET A2079 12.423 -0.969 3.470 1.00 44.35 S ATOM 1079 CE MET A2079 12.948 0.737 3.528 1.00 42.44 C ATOM 0 H MET A2079 8.255 -0.599 0.984 1.00 41.33 H new ATOM 0 HA MET A2079 9.025 1.136 2.988 1.00 5.34 H new ATOM 0 HB2 MET A2079 10.299 -0.716 1.042 1.00 41.13 H new ATOM 0 HB3 MET A2079 11.369 0.559 1.591 1.00 41.13 H new ATOM 0 HG2 MET A2079 10.227 -0.184 3.985 1.00 70.30 H new ATOM 0 HG3 MET A2079 10.179 -1.712 3.130 1.00 70.30 H new ATOM 0 HE1 MET A2079 13.710 0.857 4.298 1.00 42.44 H new ATOM 0 HE2 MET A2079 13.362 1.023 2.561 1.00 42.44 H new ATOM 0 HE3 MET A2079 12.094 1.373 3.760 1.00 42.44 H new ATOM 1089 N GLU A2080 9.768 2.275 -0.018 1.00 73.43 N ATOM 1090 CA GLU A2080 10.115 3.475 -0.758 1.00 11.13 C ATOM 1091 C GLU A2080 9.027 4.538 -0.589 1.00 64.22 C ATOM 1092 O GLU A2080 9.305 5.651 -0.147 1.00 23.14 O ATOM 1093 CB GLU A2080 10.346 3.158 -2.236 1.00 64.01 C ATOM 1094 CG GLU A2080 10.738 4.416 -3.013 1.00 61.15 C ATOM 1095 CD GLU A2080 11.998 4.176 -3.848 1.00 51.01 C ATOM 1096 OE1 GLU A2080 13.117 4.313 -3.334 1.00 74.04 O ATOM 1097 OE2 GLU A2080 11.783 3.833 -5.072 1.00 74.11 O ATOM 0 H GLU A2080 9.632 1.444 -0.593 1.00 73.43 H new ATOM 0 HA GLU A2080 11.047 3.871 -0.354 1.00 11.13 H new ATOM 0 HB2 GLU A2080 11.131 2.408 -2.332 1.00 64.01 H new ATOM 0 HB3 GLU A2080 9.441 2.729 -2.665 1.00 64.01 H new ATOM 0 HG2 GLU A2080 9.917 4.715 -3.665 1.00 61.15 H new ATOM 0 HG3 GLU A2080 10.909 5.238 -2.318 1.00 61.15 H new ATOM 1105 N ALA A2081 7.811 4.156 -0.949 1.00 61.24 N ATOM 1106 CA ALA A2081 6.679 5.061 -0.842 1.00 44.45 C ATOM 1107 C ALA A2081 6.591 5.592 0.589 1.00 71.13 C ATOM 1108 O ALA A2081 6.314 6.772 0.802 1.00 14.53 O ATOM 1109 CB ALA A2081 5.404 4.338 -1.278 1.00 75.33 C ATOM 0 H ALA A2081 7.584 3.231 -1.315 1.00 61.24 H new ATOM 0 HA ALA A2081 6.808 5.918 -1.503 1.00 44.45 H new ATOM 0 HB1 ALA A2081 4.555 5.017 -1.198 1.00 75.33 H new ATOM 0 HB2 ALA A2081 5.508 4.008 -2.312 1.00 75.33 H new ATOM 0 HB3 ALA A2081 5.239 3.473 -0.636 1.00 75.33 H new ATOM 1115 N GLN A2082 6.829 4.696 1.535 1.00 31.32 N ATOM 1116 CA GLN A2082 6.777 5.059 2.941 1.00 14.22 C ATOM 1117 C GLN A2082 7.716 6.235 3.220 1.00 4.52 C ATOM 1118 O GLN A2082 7.342 7.180 3.913 1.00 12.04 O ATOM 1119 CB GLN A2082 7.122 3.861 3.830 1.00 64.30 C ATOM 1120 CG GLN A2082 7.199 4.273 5.301 1.00 60.13 C ATOM 1121 CD GLN A2082 6.126 3.557 6.127 1.00 45.40 C ATOM 1122 OE1 GLN A2082 6.259 2.403 6.494 1.00 22.24 O ATOM 1123 NE2 GLN A2082 5.062 4.308 6.397 1.00 23.14 N ATOM 0 H GLN A2082 7.059 3.719 1.355 1.00 31.32 H new ATOM 0 HA GLN A2082 5.759 5.366 3.179 1.00 14.22 H new ATOM 0 HB2 GLN A2082 6.369 3.083 3.706 1.00 64.30 H new ATOM 0 HB3 GLN A2082 8.075 3.435 3.518 1.00 64.30 H new ATOM 0 HG2 GLN A2082 8.186 4.037 5.698 1.00 60.13 H new ATOM 0 HG3 GLN A2082 7.070 5.352 5.388 1.00 60.13 H new ATOM 0 HE21 GLN A2082 5.016 5.269 6.058 1.00 23.14 H new ATOM 0 HE22 GLN A2082 4.292 3.923 6.944 1.00 23.14 H new ATOM 1132 N GLU A2083 8.914 6.138 2.665 1.00 52.54 N ATOM 1133 CA GLU A2083 9.909 7.183 2.843 1.00 72.10 C ATOM 1134 C GLU A2083 9.434 8.484 2.194 1.00 21.41 C ATOM 1135 O GLU A2083 9.731 9.572 2.688 1.00 64.05 O ATOM 1136 CB GLU A2083 11.265 6.752 2.282 1.00 62.35 C ATOM 1137 CG GLU A2083 11.770 7.754 1.241 1.00 63.53 C ATOM 1138 CD GLU A2083 13.185 7.400 0.781 1.00 13.23 C ATOM 1139 OE1 GLU A2083 14.163 7.952 1.307 1.00 34.32 O ATOM 1140 OE2 GLU A2083 13.250 6.518 -0.159 1.00 71.44 O ATOM 0 H GLU A2083 9.219 5.352 2.091 1.00 52.54 H new ATOM 0 HA GLU A2083 10.036 7.358 3.911 1.00 72.10 H new ATOM 0 HB2 GLU A2083 11.988 6.669 3.093 1.00 62.35 H new ATOM 0 HB3 GLU A2083 11.178 5.764 1.829 1.00 62.35 H new ATOM 0 HG2 GLU A2083 11.097 7.764 0.384 1.00 63.53 H new ATOM 0 HG3 GLU A2083 11.762 8.759 1.664 1.00 63.53 H new ATOM 1148 N TRP A2084 8.706 8.331 1.100 1.00 65.31 N ATOM 1149 CA TRP A2084 8.186 9.480 0.378 1.00 12.53 C ATOM 1150 C TRP A2084 7.151 10.169 1.268 1.00 44.34 C ATOM 1151 O TRP A2084 7.032 11.393 1.254 1.00 51.24 O ATOM 1152 CB TRP A2084 7.623 9.065 -0.984 1.00 12.20 C ATOM 1153 CG TRP A2084 8.692 8.839 -2.055 1.00 24.33 C ATOM 1154 CD1 TRP A2084 9.236 7.677 -2.445 1.00 13.01 C ATOM 1155 CD2 TRP A2084 9.324 9.851 -2.866 1.00 52.11 C ATOM 1156 NE1 TRP A2084 10.170 7.867 -3.443 1.00 41.55 N ATOM 1157 CE2 TRP A2084 10.224 9.231 -3.708 1.00 1.34 C ATOM 1158 CE3 TRP A2084 9.139 11.245 -2.888 1.00 14.51 C ATOM 1159 CZ2 TRP A2084 11.013 9.925 -4.632 1.00 50.40 C ATOM 1160 CZ3 TRP A2084 9.935 11.924 -3.818 1.00 41.34 C ATOM 1161 CH2 TRP A2084 10.848 11.315 -4.671 1.00 23.23 C ATOM 0 H TRP A2084 8.463 7.427 0.694 1.00 65.31 H new ATOM 0 HA TRP A2084 8.984 10.190 0.158 1.00 12.53 H new ATOM 0 HB2 TRP A2084 7.045 8.149 -0.863 1.00 12.20 H new ATOM 0 HB3 TRP A2084 6.933 9.834 -1.330 1.00 12.20 H new ATOM 0 HD1 TRP A2084 8.976 6.714 -2.030 1.00 13.01 H new ATOM 0 HE1 TRP A2084 10.720 7.141 -3.902 1.00 41.55 H new ATOM 0 HE3 TRP A2084 8.439 11.751 -2.240 1.00 14.51 H new ATOM 0 HZ2 TRP A2084 11.711 9.416 -5.280 1.00 50.40 H new ATOM 0 HZ3 TRP A2084 9.832 12.998 -3.877 1.00 41.34 H new ATOM 0 HH2 TRP A2084 11.427 11.911 -5.361 1.00 23.23 H new ATOM 1172 N CYS A2085 6.429 9.353 2.022 1.00 71.04 N ATOM 1173 CA CYS A2085 5.407 9.870 2.917 1.00 11.33 C ATOM 1174 C CYS A2085 6.093 10.708 3.996 1.00 14.32 C ATOM 1175 O CYS A2085 5.721 11.858 4.226 1.00 24.04 O ATOM 1176 CB CYS A2085 4.562 8.746 3.518 1.00 71.53 C ATOM 1177 SG CYS A2085 3.459 9.418 4.816 1.00 33.51 S ATOM 0 H CYS A2085 6.531 8.338 2.032 1.00 71.04 H new ATOM 0 HA CYS A2085 4.713 10.498 2.358 1.00 11.33 H new ATOM 0 HB2 CYS A2085 3.970 8.268 2.738 1.00 71.53 H new ATOM 0 HB3 CYS A2085 5.210 7.979 3.941 1.00 71.53 H new ATOM 0 HG CYS A2085 2.270 9.601 4.323 1.00 33.51 H new ATOM 1183 N ARG A2086 7.085 10.100 4.631 1.00 14.41 N ATOM 1184 CA ARG A2086 7.828 10.777 5.681 1.00 11.11 C ATOM 1185 C ARG A2086 8.376 12.110 5.170 1.00 0.22 C ATOM 1186 O ARG A2086 8.360 13.108 5.888 1.00 13.35 O ATOM 1187 CB ARG A2086 8.988 9.914 6.179 1.00 22.43 C ATOM 1188 CG ARG A2086 8.499 8.848 7.162 1.00 73.24 C ATOM 1189 CD ARG A2086 8.744 7.441 6.614 1.00 42.12 C ATOM 1190 NE ARG A2086 10.004 6.897 7.164 1.00 20.33 N ATOM 1191 CZ ARG A2086 10.121 6.363 8.400 1.00 34.35 C ATOM 1192 NH1 ARG A2086 9.053 6.298 9.223 1.00 74.02 N ATOM 1193 NH2 ARG A2086 11.297 5.905 8.790 1.00 31.30 N ATOM 0 H ARG A2086 7.391 9.146 4.439 1.00 14.41 H new ATOM 0 HA ARG A2086 7.142 10.956 6.509 1.00 11.11 H new ATOM 0 HB2 ARG A2086 9.478 9.434 5.332 1.00 22.43 H new ATOM 0 HB3 ARG A2086 9.733 10.545 6.663 1.00 22.43 H new ATOM 0 HG2 ARG A2086 9.013 8.965 8.116 1.00 73.24 H new ATOM 0 HG3 ARG A2086 7.435 8.987 7.354 1.00 73.24 H new ATOM 0 HD2 ARG A2086 7.911 6.789 6.877 1.00 42.12 H new ATOM 0 HD3 ARG A2086 8.795 7.469 5.526 1.00 42.12 H new ATOM 0 HE ARG A2086 10.836 6.927 6.575 1.00 20.33 H new ATOM 0 HH11 ARG A2086 8.148 6.654 8.914 1.00 74.02 H new ATOM 0 HH12 ARG A2086 9.151 5.893 10.154 1.00 74.02 H new ATOM 0 HH21 ARG A2086 12.099 5.958 8.162 1.00 31.30 H new ATOM 0 HH22 ARG A2086 11.403 5.499 9.720 1.00 31.30 H new ATOM 1205 N LYS A2087 8.848 12.085 3.932 1.00 75.11 N ATOM 1206 CA LYS A2087 9.400 13.279 3.316 1.00 41.21 C ATOM 1207 C LYS A2087 8.282 14.299 3.100 1.00 72.54 C ATOM 1208 O LYS A2087 8.514 15.505 3.166 1.00 54.41 O ATOM 1209 CB LYS A2087 10.160 12.920 2.036 1.00 12.03 C ATOM 1210 CG LYS A2087 10.523 14.175 1.243 1.00 54.24 C ATOM 1211 CD LYS A2087 10.019 14.080 -0.197 1.00 22.23 C ATOM 1212 CE LYS A2087 11.173 13.809 -1.165 1.00 61.03 C ATOM 1213 NZ LYS A2087 11.731 15.081 -1.676 1.00 33.34 N ATOM 0 H LYS A2087 8.859 11.255 3.339 1.00 75.11 H new ATOM 0 HA LYS A2087 10.133 13.743 3.975 1.00 41.21 H new ATOM 0 HB2 LYS A2087 11.067 12.371 2.289 1.00 12.03 H new ATOM 0 HB3 LYS A2087 9.550 12.260 1.420 1.00 12.03 H new ATOM 0 HG2 LYS A2087 10.091 15.052 1.726 1.00 54.24 H new ATOM 0 HG3 LYS A2087 11.605 14.310 1.245 1.00 54.24 H new ATOM 0 HD2 LYS A2087 9.279 13.283 -0.275 1.00 22.23 H new ATOM 0 HD3 LYS A2087 9.518 15.008 -0.473 1.00 22.23 H new ATOM 0 HE2 LYS A2087 11.953 13.240 -0.660 1.00 61.03 H new ATOM 0 HE3 LYS A2087 10.822 13.199 -1.997 1.00 61.03 H new ATOM 0 HZ1 LYS A2087 12.513 14.879 -2.331 1.00 33.34 H new ATOM 0 HZ2 LYS A2087 10.988 15.610 -2.176 1.00 33.34 H new ATOM 0 HZ3 LYS A2087 12.085 15.650 -0.880 1.00 33.34 H new ATOM 1226 N TYR A2088 7.090 13.779 2.846 1.00 41.23 N ATOM 1227 CA TYR A2088 5.934 14.630 2.621 1.00 41.42 C ATOM 1228 C TYR A2088 5.370 15.152 3.944 1.00 14.21 C ATOM 1229 O TYR A2088 5.108 16.346 4.083 1.00 71.33 O ATOM 1230 CB TYR A2088 4.883 13.746 1.946 1.00 23.22 C ATOM 1231 CG TYR A2088 3.446 14.235 2.131 1.00 51.11 C ATOM 1232 CD1 TYR A2088 2.895 15.118 1.223 1.00 51.24 C ATOM 1233 CD2 TYR A2088 2.698 13.796 3.204 1.00 30.02 C ATOM 1234 CE1 TYR A2088 1.543 15.580 1.395 1.00 33.50 C ATOM 1235 CE2 TYR A2088 1.346 14.257 3.377 1.00 52.34 C ATOM 1236 CZ TYR A2088 0.834 15.127 2.465 1.00 33.02 C ATOM 1237 OH TYR A2088 -0.444 15.562 2.629 1.00 42.13 O ATOM 0 H TYR A2088 6.900 12.778 2.791 1.00 41.23 H new ATOM 0 HA TYR A2088 6.207 15.493 2.014 1.00 41.42 H new ATOM 0 HB2 TYR A2088 5.102 13.689 0.880 1.00 23.22 H new ATOM 0 HB3 TYR A2088 4.965 12.734 2.343 1.00 23.22 H new ATOM 0 HD1 TYR A2088 3.480 15.462 0.383 1.00 51.24 H new ATOM 0 HD2 TYR A2088 3.128 13.106 3.915 1.00 30.02 H new ATOM 0 HE1 TYR A2088 1.101 16.270 0.691 1.00 33.50 H new ATOM 0 HE2 TYR A2088 0.751 13.920 4.213 1.00 52.34 H new ATOM 0 HH TYR A2088 -0.839 15.755 1.753 1.00 42.13 H new ATOM 1247 N MET A2089 5.202 14.232 4.882 1.00 64.32 N ATOM 1248 CA MET A2089 4.675 14.585 6.189 1.00 14.02 C ATOM 1249 C MET A2089 5.549 15.643 6.865 1.00 31.55 C ATOM 1250 O MET A2089 5.043 16.506 7.582 1.00 10.22 O ATOM 1251 CB MET A2089 4.613 13.335 7.069 1.00 65.24 C ATOM 1252 CG MET A2089 3.622 12.316 6.503 1.00 31.33 C ATOM 1253 SD MET A2089 2.013 13.066 6.314 1.00 75.40 S ATOM 1254 CE MET A2089 1.056 12.030 7.408 1.00 73.23 C ATOM 0 H MET A2089 5.421 13.243 4.763 1.00 64.32 H new ATOM 0 HA MET A2089 3.675 14.997 6.058 1.00 14.02 H new ATOM 0 HB2 MET A2089 5.603 12.885 7.138 1.00 65.24 H new ATOM 0 HB3 MET A2089 4.317 13.612 8.081 1.00 65.24 H new ATOM 0 HG2 MET A2089 3.976 11.949 5.540 1.00 31.33 H new ATOM 0 HG3 MET A2089 3.555 11.455 7.167 1.00 31.33 H new ATOM 0 HE1 MET A2089 0.015 12.352 7.395 1.00 73.23 H new ATOM 0 HE2 MET A2089 1.120 10.994 7.076 1.00 73.23 H new ATOM 0 HE3 MET A2089 1.448 12.111 8.422 1.00 73.23 H new ATOM 1264 N LYS A2090 6.846 15.540 6.617 1.00 50.31 N ATOM 1265 CA LYS A2090 7.796 16.478 7.193 1.00 41.52 C ATOM 1266 C LYS A2090 7.923 17.696 6.275 1.00 33.12 C ATOM 1267 O LYS A2090 7.714 18.827 6.709 1.00 63.21 O ATOM 1268 CB LYS A2090 9.127 15.783 7.481 1.00 33.04 C ATOM 1269 CG LYS A2090 9.581 16.040 8.918 1.00 52.44 C ATOM 1270 CD LYS A2090 10.304 17.385 9.030 1.00 14.23 C ATOM 1271 CE LYS A2090 9.961 18.085 10.346 1.00 3.32 C ATOM 1272 NZ LYS A2090 10.341 19.514 10.289 1.00 0.45 N ATOM 0 H LYS A2090 7.262 14.821 6.025 1.00 50.31 H new ATOM 0 HA LYS A2090 7.438 16.841 8.157 1.00 41.52 H new ATOM 0 HB2 LYS A2090 9.025 14.711 7.315 1.00 33.04 H new ATOM 0 HB3 LYS A2090 9.886 16.142 6.786 1.00 33.04 H new ATOM 0 HG2 LYS A2090 8.718 16.030 9.584 1.00 52.44 H new ATOM 0 HG3 LYS A2090 10.244 15.238 9.243 1.00 52.44 H new ATOM 0 HD2 LYS A2090 11.381 17.229 8.967 1.00 14.23 H new ATOM 0 HD3 LYS A2090 10.025 18.023 8.191 1.00 14.23 H new ATOM 0 HE2 LYS A2090 8.893 17.995 10.545 1.00 3.32 H new ATOM 0 HE3 LYS A2090 10.481 17.597 11.170 1.00 3.32 H new ATOM 0 HZ1 LYS A2090 10.101 19.973 11.191 1.00 0.45 H new ATOM 0 HZ2 LYS A2090 11.364 19.595 10.121 1.00 0.45 H new ATOM 0 HZ3 LYS A2090 9.825 19.980 9.515 1.00 0.45 H new ATOM 1285 N SER A2091 8.267 17.423 5.026 1.00 24.32 N ATOM 1286 CA SER A2091 8.425 18.482 4.044 1.00 52.21 C ATOM 1287 C SER A2091 7.056 19.040 3.651 1.00 1.35 C ATOM 1288 O SER A2091 6.742 20.191 3.949 1.00 30.33 O ATOM 1289 CB SER A2091 9.172 17.979 2.807 1.00 70.44 C ATOM 1290 OG SER A2091 9.793 19.042 2.088 1.00 73.24 O ATOM 0 H SER A2091 8.441 16.483 4.671 1.00 24.32 H new ATOM 0 HA SER A2091 9.018 19.279 4.492 1.00 52.21 H new ATOM 0 HB2 SER A2091 9.929 17.256 3.110 1.00 70.44 H new ATOM 0 HB3 SER A2091 8.476 17.456 2.151 1.00 70.44 H new ATOM 0 HG SER A2091 10.261 18.679 1.307 1.00 73.24 H new ATOM 1296 N GLY A2092 6.280 18.197 2.985 1.00 12.12 N ATOM 1297 CA GLY A2092 4.952 18.591 2.546 1.00 13.12 C ATOM 1298 C GLY A2092 4.957 18.989 1.068 1.00 53.12 C ATOM 1299 O GLY A2092 5.135 20.161 0.740 1.00 73.53 O ATOM 0 H GLY A2092 6.545 17.243 2.739 1.00 12.12 H new ATOM 0 HA2 GLY A2092 4.255 17.768 2.702 1.00 13.12 H new ATOM 0 HA3 GLY A2092 4.599 19.427 3.150 1.00 13.12 H new ATOM 1303 N ASN A2093 4.762 17.993 0.219 1.00 2.32 N ATOM 1304 CA ASN A2093 4.745 18.225 -1.215 1.00 65.33 C ATOM 1305 C ASN A2093 3.789 17.228 -1.876 1.00 5.32 C ATOM 1306 O ASN A2093 3.927 16.018 -1.695 1.00 61.53 O ATOM 1307 CB ASN A2093 6.132 18.025 -1.825 1.00 45.40 C ATOM 1308 CG ASN A2093 6.605 19.294 -2.537 1.00 4.44 C ATOM 1309 OD1 ASN A2093 5.959 20.327 -2.516 1.00 24.14 O ATOM 1310 ND2 ASN A2093 7.769 19.157 -3.170 1.00 73.21 N ATOM 0 H ASN A2093 4.614 17.022 0.496 1.00 2.32 H new ATOM 0 HA ASN A2093 4.423 19.252 -1.386 1.00 65.33 H new ATOM 0 HB2 ASN A2093 6.842 17.756 -1.043 1.00 45.40 H new ATOM 0 HB3 ASN A2093 6.107 17.195 -2.531 1.00 45.40 H new ATOM 0 HD21 ASN A2093 8.170 19.946 -3.677 1.00 73.21 H new ATOM 0 HD22 ASN A2093 8.259 18.263 -3.148 1.00 73.21 H new ATOM 1317 N VAL A2094 2.844 17.772 -2.628 1.00 42.24 N ATOM 1318 CA VAL A2094 1.868 16.944 -3.318 1.00 54.34 C ATOM 1319 C VAL A2094 2.592 16.009 -4.287 1.00 72.54 C ATOM 1320 O VAL A2094 2.260 14.828 -4.380 1.00 1.43 O ATOM 1321 CB VAL A2094 0.826 17.829 -4.007 1.00 22.10 C ATOM 1322 CG1 VAL A2094 1.377 18.411 -5.309 1.00 14.30 C ATOM 1323 CG2 VAL A2094 -0.471 17.056 -4.255 1.00 3.41 C ATOM 0 H VAL A2094 2.733 18.775 -2.775 1.00 42.24 H new ATOM 0 HA VAL A2094 1.327 16.319 -2.608 1.00 54.34 H new ATOM 0 HB VAL A2094 0.597 18.660 -3.340 1.00 22.10 H new ATOM 0 HG11 VAL A2094 0.617 19.036 -5.779 1.00 14.30 H new ATOM 0 HG12 VAL A2094 2.260 19.013 -5.094 1.00 14.30 H new ATOM 0 HG13 VAL A2094 1.648 17.599 -5.984 1.00 14.30 H new ATOM 0 HG21 VAL A2094 -1.195 17.707 -4.745 1.00 3.41 H new ATOM 0 HG22 VAL A2094 -0.266 16.196 -4.893 1.00 3.41 H new ATOM 0 HG23 VAL A2094 -0.878 16.713 -3.304 1.00 3.41 H new ATOM 1333 N LYS A2095 3.569 16.570 -4.984 1.00 62.00 N ATOM 1334 CA LYS A2095 4.344 15.801 -5.943 1.00 25.42 C ATOM 1335 C LYS A2095 4.888 14.544 -5.259 1.00 64.30 C ATOM 1336 O LYS A2095 4.790 13.446 -5.805 1.00 71.31 O ATOM 1337 CB LYS A2095 5.425 16.674 -6.583 1.00 72.21 C ATOM 1338 CG LYS A2095 5.694 16.245 -8.025 1.00 62.53 C ATOM 1339 CD LYS A2095 7.167 15.883 -8.226 1.00 44.13 C ATOM 1340 CE LYS A2095 7.413 14.403 -7.929 1.00 12.33 C ATOM 1341 NZ LYS A2095 8.866 14.122 -7.868 1.00 65.23 N ATOM 0 H LYS A2095 3.842 17.549 -4.904 1.00 62.00 H new ATOM 0 HA LYS A2095 3.712 15.468 -6.766 1.00 25.42 H new ATOM 0 HB2 LYS A2095 5.113 17.718 -6.563 1.00 72.21 H new ATOM 0 HB3 LYS A2095 6.345 16.605 -6.002 1.00 72.21 H new ATOM 0 HG2 LYS A2095 5.068 15.388 -8.276 1.00 62.53 H new ATOM 0 HG3 LYS A2095 5.418 17.051 -8.705 1.00 62.53 H new ATOM 0 HD2 LYS A2095 7.463 16.106 -9.251 1.00 44.13 H new ATOM 0 HD3 LYS A2095 7.788 16.497 -7.574 1.00 44.13 H new ATOM 0 HE2 LYS A2095 6.944 14.133 -6.983 1.00 12.33 H new ATOM 0 HE3 LYS A2095 6.950 13.789 -8.701 1.00 12.33 H new ATOM 0 HZ1 LYS A2095 9.016 13.113 -7.666 1.00 65.23 H new ATOM 0 HZ2 LYS A2095 9.304 14.361 -8.780 1.00 65.23 H new ATOM 0 HZ3 LYS A2095 9.299 14.694 -7.115 1.00 65.23 H new ATOM 1354 N ASP A2096 5.452 14.749 -4.078 1.00 63.41 N ATOM 1355 CA ASP A2096 6.011 13.647 -3.316 1.00 11.05 C ATOM 1356 C ASP A2096 4.883 12.712 -2.873 1.00 34.03 C ATOM 1357 O ASP A2096 5.031 11.492 -2.913 1.00 2.24 O ATOM 1358 CB ASP A2096 6.727 14.152 -2.062 1.00 61.32 C ATOM 1359 CG ASP A2096 6.817 13.141 -0.917 1.00 11.12 C ATOM 1360 OD1 ASP A2096 6.561 11.943 -1.102 1.00 20.52 O ATOM 1361 OD2 ASP A2096 7.173 13.636 0.221 1.00 23.21 O ATOM 0 H ASP A2096 5.534 15.662 -3.631 1.00 63.41 H new ATOM 0 HA ASP A2096 6.725 13.125 -3.954 1.00 11.05 H new ATOM 0 HB2 ASP A2096 7.737 14.458 -2.337 1.00 61.32 H new ATOM 0 HB3 ASP A2096 6.211 15.042 -1.701 1.00 61.32 H new ATOM 1367 N LEU A2097 3.781 13.322 -2.460 1.00 62.13 N ATOM 1368 CA LEU A2097 2.629 12.559 -2.010 1.00 51.52 C ATOM 1369 C LEU A2097 2.106 11.705 -3.165 1.00 70.21 C ATOM 1370 O LEU A2097 1.815 10.522 -2.987 1.00 54.24 O ATOM 1371 CB LEU A2097 1.575 13.489 -1.406 1.00 55.24 C ATOM 1372 CG LEU A2097 0.153 12.928 -1.325 1.00 42.34 C ATOM 1373 CD1 LEU A2097 0.161 11.482 -0.827 1.00 54.05 C ATOM 1374 CD2 LEU A2097 -0.743 13.825 -0.470 1.00 21.11 C ATOM 0 H LEU A2097 3.662 14.334 -2.428 1.00 62.13 H new ATOM 0 HA LEU A2097 2.913 11.874 -1.211 1.00 51.52 H new ATOM 0 HB2 LEU A2097 1.894 13.763 -0.400 1.00 55.24 H new ATOM 0 HB3 LEU A2097 1.549 14.407 -1.993 1.00 55.24 H new ATOM 0 HG LEU A2097 -0.268 12.919 -2.330 1.00 42.34 H new ATOM 0 HD11 LEU A2097 -0.862 11.108 -0.779 1.00 54.05 H new ATOM 0 HD12 LEU A2097 0.741 10.864 -1.512 1.00 54.05 H new ATOM 0 HD13 LEU A2097 0.609 11.442 0.166 1.00 54.05 H new ATOM 0 HD21 LEU A2097 -1.747 13.403 -0.429 1.00 21.11 H new ATOM 0 HD22 LEU A2097 -0.336 13.890 0.539 1.00 21.11 H new ATOM 0 HD23 LEU A2097 -0.786 14.822 -0.909 1.00 21.11 H new ATOM 1386 N THR A2098 2.001 12.335 -4.326 1.00 20.23 N ATOM 1387 CA THR A2098 1.518 11.648 -5.512 1.00 33.21 C ATOM 1388 C THR A2098 2.403 10.438 -5.825 1.00 34.41 C ATOM 1389 O THR A2098 1.898 9.341 -6.059 1.00 44.31 O ATOM 1390 CB THR A2098 1.451 12.663 -6.654 1.00 31.51 C ATOM 1391 OG1 THR A2098 0.321 13.472 -6.334 1.00 34.15 O ATOM 1392 CG2 THR A2098 1.080 12.017 -7.990 1.00 22.10 C ATOM 0 H THR A2098 2.243 13.315 -4.471 1.00 20.23 H new ATOM 0 HA THR A2098 0.516 11.248 -5.356 1.00 33.21 H new ATOM 0 HB THR A2098 2.413 13.167 -6.749 1.00 31.51 H new ATOM 0 HG1 THR A2098 0.570 14.123 -5.645 1.00 34.15 H new ATOM 0 HG21 THR A2098 1.046 12.781 -8.767 1.00 22.10 H new ATOM 0 HG22 THR A2098 1.826 11.267 -8.251 1.00 22.10 H new ATOM 0 HG23 THR A2098 0.103 11.542 -7.906 1.00 22.10 H new ATOM 1400 N GLN A2099 3.705 10.681 -5.818 1.00 32.31 N ATOM 1401 CA GLN A2099 4.664 9.626 -6.097 1.00 20.41 C ATOM 1402 C GLN A2099 4.449 8.447 -5.146 1.00 14.43 C ATOM 1403 O GLN A2099 4.429 7.294 -5.574 1.00 54.41 O ATOM 1404 CB GLN A2099 6.099 10.151 -6.006 1.00 64.44 C ATOM 1405 CG GLN A2099 6.757 10.190 -7.387 1.00 14.11 C ATOM 1406 CD GLN A2099 8.016 9.322 -7.417 1.00 30.42 C ATOM 1407 OE1 GLN A2099 8.325 8.596 -6.486 1.00 72.02 O ATOM 1408 NE2 GLN A2099 8.725 9.435 -8.537 1.00 4.01 N ATOM 0 H GLN A2099 4.118 11.593 -5.624 1.00 32.31 H new ATOM 0 HA GLN A2099 4.504 9.277 -7.117 1.00 20.41 H new ATOM 0 HB2 GLN A2099 6.097 11.151 -5.572 1.00 64.44 H new ATOM 0 HB3 GLN A2099 6.681 9.515 -5.340 1.00 64.44 H new ATOM 0 HG2 GLN A2099 6.051 9.840 -8.140 1.00 14.11 H new ATOM 0 HG3 GLN A2099 7.013 11.218 -7.643 1.00 14.11 H new ATOM 0 HE21 GLN A2099 8.411 10.061 -9.278 1.00 4.01 H new ATOM 0 HE22 GLN A2099 9.583 8.896 -8.654 1.00 4.01 H new ATOM 1417 N ALA A2100 4.294 8.778 -3.872 1.00 20.14 N ATOM 1418 CA ALA A2100 4.083 7.760 -2.856 1.00 14.03 C ATOM 1419 C ALA A2100 2.854 6.926 -3.224 1.00 3.51 C ATOM 1420 O ALA A2100 2.872 5.702 -3.103 1.00 2.12 O ATOM 1421 CB ALA A2100 3.947 8.428 -1.486 1.00 61.43 C ATOM 0 H ALA A2100 4.310 9.735 -3.520 1.00 20.14 H new ATOM 0 HA ALA A2100 4.936 7.084 -2.806 1.00 14.03 H new ATOM 0 HB1 ALA A2100 3.789 7.665 -0.723 1.00 61.43 H new ATOM 0 HB2 ALA A2100 4.857 8.984 -1.260 1.00 61.43 H new ATOM 0 HB3 ALA A2100 3.098 9.112 -1.497 1.00 61.43 H new ATOM 1427 N TRP A2101 1.817 7.621 -3.666 1.00 42.11 N ATOM 1428 CA TRP A2101 0.583 6.961 -4.053 1.00 72.22 C ATOM 1429 C TRP A2101 0.866 6.122 -5.302 1.00 2.01 C ATOM 1430 O TRP A2101 0.225 5.096 -5.522 1.00 31.41 O ATOM 1431 CB TRP A2101 -0.543 7.977 -4.258 1.00 22.20 C ATOM 1432 CG TRP A2101 -1.766 7.739 -3.370 1.00 50.03 C ATOM 1433 CD1 TRP A2101 -2.213 8.497 -2.361 1.00 61.10 C ATOM 1434 CD2 TRP A2101 -2.686 6.630 -3.456 1.00 64.51 C ATOM 1435 NE1 TRP A2101 -3.350 7.960 -1.791 1.00 42.14 N ATOM 1436 CE2 TRP A2101 -3.647 6.790 -2.478 1.00 44.33 C ATOM 1437 CE3 TRP A2101 -2.707 5.530 -4.330 1.00 12.22 C ATOM 1438 CZ2 TRP A2101 -4.699 5.886 -2.281 1.00 33.01 C ATOM 1439 CZ3 TRP A2101 -3.764 4.635 -4.120 1.00 42.11 C ATOM 1440 CH2 TRP A2101 -4.738 4.782 -3.141 1.00 21.23 C ATOM 0 H TRP A2101 1.806 8.636 -3.765 1.00 42.11 H new ATOM 0 HA TRP A2101 0.236 6.299 -3.260 1.00 72.22 H new ATOM 0 HB2 TRP A2101 -0.155 8.977 -4.064 1.00 22.20 H new ATOM 0 HB3 TRP A2101 -0.855 7.953 -5.302 1.00 22.20 H new ATOM 0 HD1 TRP A2101 -1.743 9.413 -2.034 1.00 61.10 H new ATOM 0 HE1 TRP A2101 -3.875 8.351 -1.009 1.00 42.14 H new ATOM 0 HE3 TRP A2101 -1.967 5.386 -5.103 1.00 12.22 H new ATOM 0 HZ2 TRP A2101 -5.439 6.033 -1.508 1.00 33.01 H new ATOM 0 HZ3 TRP A2101 -3.826 3.770 -4.764 1.00 42.11 H new ATOM 0 HH2 TRP A2101 -5.523 4.047 -3.043 1.00 21.23 H new ATOM 1451 N ASP A2102 1.827 6.591 -6.084 1.00 43.23 N ATOM 1452 CA ASP A2102 2.202 5.899 -7.306 1.00 34.35 C ATOM 1453 C ASP A2102 2.724 4.503 -6.954 1.00 73.53 C ATOM 1454 O ASP A2102 2.279 3.508 -7.525 1.00 53.22 O ATOM 1455 CB ASP A2102 3.313 6.647 -8.043 1.00 2.33 C ATOM 1456 CG ASP A2102 3.140 6.727 -9.561 1.00 5.51 C ATOM 1457 OD1 ASP A2102 2.959 5.704 -10.239 1.00 71.12 O ATOM 1458 OD2 ASP A2102 3.198 7.917 -10.055 1.00 1.41 O ATOM 0 H ASP A2102 2.357 7.442 -5.896 1.00 43.23 H new ATOM 0 HA ASP A2102 1.322 5.840 -7.946 1.00 34.35 H new ATOM 0 HB2 ASP A2102 3.374 7.660 -7.645 1.00 2.33 H new ATOM 0 HB3 ASP A2102 4.264 6.161 -7.826 1.00 2.33 H new ATOM 1464 N LEU A2103 3.660 4.475 -6.016 1.00 21.24 N ATOM 1465 CA LEU A2103 4.247 3.219 -5.582 1.00 24.11 C ATOM 1466 C LEU A2103 3.146 2.308 -5.033 1.00 74.12 C ATOM 1467 O LEU A2103 3.014 1.161 -5.457 1.00 40.32 O ATOM 1468 CB LEU A2103 5.386 3.473 -4.593 1.00 63.43 C ATOM 1469 CG LEU A2103 6.459 4.465 -5.046 1.00 31.34 C ATOM 1470 CD1 LEU A2103 6.941 5.323 -3.874 1.00 52.22 C ATOM 1471 CD2 LEU A2103 7.615 3.740 -5.738 1.00 53.53 C ATOM 0 H LEU A2103 4.026 5.302 -5.545 1.00 21.24 H new ATOM 0 HA LEU A2103 4.699 2.699 -6.426 1.00 24.11 H new ATOM 0 HB2 LEU A2103 4.956 3.835 -3.659 1.00 63.43 H new ATOM 0 HB3 LEU A2103 5.869 2.521 -4.373 1.00 63.43 H new ATOM 0 HG LEU A2103 6.016 5.140 -5.778 1.00 31.34 H new ATOM 0 HD11 LEU A2103 7.703 6.020 -4.223 1.00 52.22 H new ATOM 0 HD12 LEU A2103 6.100 5.881 -3.462 1.00 52.22 H new ATOM 0 HD13 LEU A2103 7.363 4.680 -3.102 1.00 52.22 H new ATOM 0 HD21 LEU A2103 8.365 4.467 -6.051 1.00 53.53 H new ATOM 0 HD22 LEU A2103 8.065 3.029 -5.045 1.00 53.53 H new ATOM 0 HD23 LEU A2103 7.239 3.207 -6.612 1.00 53.53 H new ATOM 1483 N TYR A2104 2.382 2.855 -4.099 1.00 31.12 N ATOM 1484 CA TYR A2104 1.297 2.108 -3.487 1.00 21.21 C ATOM 1485 C TYR A2104 0.315 1.602 -4.547 1.00 24.44 C ATOM 1486 O TYR A2104 -0.008 0.416 -4.581 1.00 21.31 O ATOM 1487 CB TYR A2104 0.572 3.091 -2.567 1.00 52.55 C ATOM 1488 CG TYR A2104 1.382 3.505 -1.337 1.00 71.40 C ATOM 1489 CD1 TYR A2104 2.172 2.577 -0.687 1.00 54.11 C ATOM 1490 CD2 TYR A2104 1.323 4.804 -0.875 1.00 24.51 C ATOM 1491 CE1 TYR A2104 2.934 2.966 0.471 1.00 55.32 C ATOM 1492 CE2 TYR A2104 2.085 5.193 0.283 1.00 63.20 C ATOM 1493 CZ TYR A2104 2.854 4.254 0.899 1.00 23.31 C ATOM 1494 OH TYR A2104 3.573 4.621 1.993 1.00 34.13 O ATOM 0 H TYR A2104 2.493 3.807 -3.751 1.00 31.12 H new ATOM 0 HA TYR A2104 1.683 1.242 -2.950 1.00 21.21 H new ATOM 0 HB2 TYR A2104 0.314 3.984 -3.137 1.00 52.55 H new ATOM 0 HB3 TYR A2104 -0.365 2.641 -2.238 1.00 52.55 H new ATOM 0 HD1 TYR A2104 2.218 1.560 -1.047 1.00 54.11 H new ATOM 0 HD2 TYR A2104 0.705 5.530 -1.383 1.00 24.51 H new ATOM 0 HE1 TYR A2104 3.556 2.250 0.988 1.00 55.32 H new ATOM 0 HE2 TYR A2104 2.047 6.206 0.654 1.00 63.20 H new ATOM 0 HH TYR A2104 3.419 5.570 2.182 1.00 34.13 H new ATOM 1504 N TYR A2105 -0.131 2.526 -5.384 1.00 74.02 N ATOM 1505 CA TYR A2105 -1.069 2.188 -6.441 1.00 31.13 C ATOM 1506 C TYR A2105 -0.616 0.938 -7.197 1.00 22.51 C ATOM 1507 O TYR A2105 -1.417 0.041 -7.460 1.00 15.22 O ATOM 1508 CB TYR A2105 -1.068 3.380 -7.401 1.00 22.20 C ATOM 1509 CG TYR A2105 -2.094 3.268 -8.530 1.00 24.44 C ATOM 1510 CD1 TYR A2105 -3.013 2.239 -8.529 1.00 33.50 C ATOM 1511 CD2 TYR A2105 -2.100 4.197 -9.553 1.00 20.31 C ATOM 1512 CE1 TYR A2105 -3.979 2.133 -9.592 1.00 61.13 C ATOM 1513 CE2 TYR A2105 -3.066 4.092 -10.616 1.00 61.22 C ATOM 1514 CZ TYR A2105 -3.958 3.065 -10.583 1.00 34.32 C ATOM 1515 OH TYR A2105 -4.870 2.966 -11.587 1.00 3.44 O ATOM 0 H TYR A2105 0.140 3.509 -5.352 1.00 74.02 H new ATOM 0 HA TYR A2105 -2.057 1.984 -6.028 1.00 31.13 H new ATOM 0 HB2 TYR A2105 -1.264 4.290 -6.834 1.00 22.20 H new ATOM 0 HB3 TYR A2105 -0.074 3.483 -7.836 1.00 22.20 H new ATOM 0 HD1 TYR A2105 -3.008 1.512 -7.730 1.00 33.50 H new ATOM 0 HD2 TYR A2105 -1.380 5.002 -9.555 1.00 20.31 H new ATOM 0 HE1 TYR A2105 -4.703 1.332 -9.602 1.00 61.13 H new ATOM 0 HE2 TYR A2105 -3.082 4.812 -11.421 1.00 61.22 H new ATOM 0 HH TYR A2105 -4.737 3.700 -12.223 1.00 3.44 H new ATOM 1525 N HIS A2106 0.668 0.918 -7.527 1.00 31.21 N ATOM 1526 CA HIS A2106 1.237 -0.207 -8.248 1.00 3.03 C ATOM 1527 C HIS A2106 1.098 -1.479 -7.409 1.00 63.45 C ATOM 1528 O HIS A2106 0.741 -2.535 -7.928 1.00 64.21 O ATOM 1529 CB HIS A2106 2.684 0.081 -8.651 1.00 14.14 C ATOM 1530 CG HIS A2106 2.886 0.258 -10.137 1.00 31.13 C ATOM 1531 ND1 HIS A2106 4.137 0.375 -10.715 1.00 50.15 N ATOM 1532 CD2 HIS A2106 1.982 0.335 -11.156 1.00 0.14 C ATOM 1533 CE1 HIS A2106 3.982 0.518 -12.023 1.00 65.51 C ATOM 1534 NE2 HIS A2106 2.646 0.492 -12.294 1.00 54.24 N ATOM 0 H HIS A2106 1.329 1.663 -7.308 1.00 31.21 H new ATOM 0 HA HIS A2106 0.687 -0.363 -9.176 1.00 3.03 H new ATOM 0 HB2 HIS A2106 3.020 0.983 -8.139 1.00 14.14 H new ATOM 0 HB3 HIS A2106 3.316 -0.736 -8.304 1.00 14.14 H new ATOM 0 HD2 HIS A2106 0.908 0.278 -11.054 1.00 0.14 H new ATOM 0 HE1 HIS A2106 4.775 0.635 -12.747 1.00 65.51 H new ATOM 0 HE2 HIS A2106 2.226 0.579 -13.219 1.00 54.24 H new ATOM 1543 N VAL A2107 1.385 -1.336 -6.123 1.00 3.45 N ATOM 1544 CA VAL A2107 1.297 -2.459 -5.206 1.00 22.05 C ATOM 1545 C VAL A2107 -0.151 -2.950 -5.146 1.00 61.02 C ATOM 1546 O VAL A2107 -0.429 -4.111 -5.435 1.00 63.11 O ATOM 1547 CB VAL A2107 1.851 -2.062 -3.837 1.00 13.14 C ATOM 1548 CG1 VAL A2107 1.152 -2.836 -2.717 1.00 3.51 C ATOM 1549 CG2 VAL A2107 3.367 -2.265 -3.780 1.00 61.23 C ATOM 0 H VAL A2107 1.679 -0.458 -5.695 1.00 3.45 H new ATOM 0 HA VAL A2107 1.908 -3.290 -5.560 1.00 22.05 H new ATOM 0 HB VAL A2107 1.648 -1.001 -3.688 1.00 13.14 H new ATOM 0 HG11 VAL A2107 1.565 -2.535 -1.754 1.00 3.51 H new ATOM 0 HG12 VAL A2107 0.084 -2.620 -2.737 1.00 3.51 H new ATOM 0 HG13 VAL A2107 1.309 -3.905 -2.861 1.00 3.51 H new ATOM 0 HG21 VAL A2107 3.736 -1.975 -2.796 1.00 61.23 H new ATOM 0 HG22 VAL A2107 3.601 -3.314 -3.961 1.00 61.23 H new ATOM 0 HG23 VAL A2107 3.845 -1.650 -4.542 1.00 61.23 H new ATOM 1559 N PHE A2108 -1.036 -2.038 -4.767 1.00 53.54 N ATOM 1560 CA PHE A2108 -2.448 -2.363 -4.665 1.00 1.42 C ATOM 1561 C PHE A2108 -3.027 -2.727 -6.033 1.00 72.25 C ATOM 1562 O PHE A2108 -3.999 -3.475 -6.119 1.00 63.32 O ATOM 1563 CB PHE A2108 -3.157 -1.111 -4.142 1.00 1.05 C ATOM 1564 CG PHE A2108 -2.991 -0.886 -2.636 1.00 4.30 C ATOM 1565 CD1 PHE A2108 -1.875 -0.268 -2.161 1.00 63.41 C ATOM 1566 CD2 PHE A2108 -3.957 -1.303 -1.776 1.00 1.43 C ATOM 1567 CE1 PHE A2108 -1.721 -0.058 -0.766 1.00 73.01 C ATOM 1568 CE2 PHE A2108 -3.801 -1.093 -0.379 1.00 25.23 C ATOM 1569 CZ PHE A2108 -2.687 -0.475 0.096 1.00 11.33 C ATOM 0 H PHE A2108 -0.802 -1.075 -4.527 1.00 53.54 H new ATOM 0 HA PHE A2108 -2.587 -3.217 -4.003 1.00 1.42 H new ATOM 0 HB2 PHE A2108 -2.774 -0.240 -4.674 1.00 1.05 H new ATOM 0 HB3 PHE A2108 -4.220 -1.184 -4.373 1.00 1.05 H new ATOM 0 HD1 PHE A2108 -1.107 0.062 -2.845 1.00 63.41 H new ATOM 0 HD2 PHE A2108 -4.842 -1.793 -2.154 1.00 1.43 H new ATOM 0 HE1 PHE A2108 -0.836 0.433 -0.389 1.00 73.01 H new ATOM 0 HE2 PHE A2108 -4.568 -1.424 0.306 1.00 25.23 H new ATOM 0 HZ PHE A2108 -2.569 -0.315 1.158 1.00 11.33 H new ATOM 1579 N ARG A2109 -2.405 -2.183 -7.068 1.00 14.41 N ATOM 1580 CA ARG A2109 -2.846 -2.441 -8.427 1.00 51.50 C ATOM 1581 C ARG A2109 -2.387 -3.831 -8.880 1.00 72.45 C ATOM 1582 O ARG A2109 -3.154 -4.573 -9.491 1.00 52.04 O ATOM 1583 CB ARG A2109 -2.296 -1.391 -9.395 1.00 31.45 C ATOM 1584 CG ARG A2109 -2.514 -1.816 -10.849 1.00 21.24 C ATOM 1585 CD ARG A2109 -3.266 -0.737 -11.629 1.00 61.05 C ATOM 1586 NE ARG A2109 -4.629 -1.208 -11.963 1.00 15.35 N ATOM 1587 CZ ARG A2109 -5.580 -0.436 -12.527 1.00 22.33 C ATOM 1588 NH1 ARG A2109 -5.327 0.856 -12.825 1.00 44.33 N ATOM 1589 NH2 ARG A2109 -6.765 -0.962 -12.782 1.00 11.42 N ATOM 0 H ARG A2109 -1.598 -1.564 -6.992 1.00 14.41 H new ATOM 0 HA ARG A2109 -3.935 -2.392 -8.436 1.00 51.50 H new ATOM 0 HB2 ARG A2109 -2.786 -0.434 -9.215 1.00 31.45 H new ATOM 0 HB3 ARG A2109 -1.232 -1.244 -9.211 1.00 31.45 H new ATOM 0 HG2 ARG A2109 -1.552 -2.009 -11.323 1.00 21.24 H new ATOM 0 HG3 ARG A2109 -3.076 -2.749 -10.878 1.00 21.24 H new ATOM 0 HD2 ARG A2109 -3.323 0.177 -11.038 1.00 61.05 H new ATOM 0 HD3 ARG A2109 -2.723 -0.492 -12.542 1.00 61.05 H new ATOM 0 HE ARG A2109 -4.864 -2.178 -11.753 1.00 15.35 H new ATOM 0 HH11 ARG A2109 -4.410 1.256 -12.624 1.00 44.33 H new ATOM 0 HH12 ARG A2109 -6.052 1.432 -13.252 1.00 44.33 H new ATOM 0 HH21 ARG A2109 -6.950 -1.939 -12.552 1.00 11.42 H new ATOM 0 HH22 ARG A2109 -7.495 -0.391 -13.208 1.00 11.42 H new ATOM 1601 N ARG A2110 -1.139 -4.138 -8.562 1.00 21.33 N ATOM 1602 CA ARG A2110 -0.569 -5.425 -8.927 1.00 45.53 C ATOM 1603 C ARG A2110 -1.367 -6.560 -8.285 1.00 64.44 C ATOM 1604 O ARG A2110 -1.795 -7.488 -8.972 1.00 71.30 O ATOM 1605 CB ARG A2110 0.892 -5.524 -8.484 1.00 3.25 C ATOM 1606 CG ARG A2110 1.665 -6.512 -9.363 1.00 41.34 C ATOM 1607 CD ARG A2110 2.539 -5.774 -10.377 1.00 3.22 C ATOM 1608 NE ARG A2110 3.970 -5.993 -10.066 1.00 22.51 N ATOM 1609 CZ ARG A2110 4.674 -7.073 -10.467 1.00 55.32 C ATOM 1610 NH1 ARG A2110 4.086 -8.043 -11.199 1.00 54.24 N ATOM 1611 NH2 ARG A2110 5.949 -7.166 -10.131 1.00 61.20 N ATOM 0 H ARG A2110 -0.506 -3.519 -8.056 1.00 21.33 H new ATOM 0 HA ARG A2110 -0.615 -5.513 -10.012 1.00 45.53 H new ATOM 0 HB2 ARG A2110 1.360 -4.541 -8.537 1.00 3.25 H new ATOM 0 HB3 ARG A2110 0.939 -5.843 -7.443 1.00 3.25 H new ATOM 0 HG2 ARG A2110 2.288 -7.151 -8.737 1.00 41.34 H new ATOM 0 HG3 ARG A2110 0.965 -7.163 -9.886 1.00 41.34 H new ATOM 0 HD2 ARG A2110 2.319 -6.127 -11.384 1.00 3.22 H new ATOM 0 HD3 ARG A2110 2.313 -4.708 -10.357 1.00 3.22 H new ATOM 0 HE ARG A2110 4.454 -5.284 -9.515 1.00 22.51 H new ATOM 0 HH11 ARG A2110 3.102 -7.964 -11.454 1.00 54.24 H new ATOM 0 HH12 ARG A2110 4.626 -8.855 -11.497 1.00 54.24 H new ATOM 0 HH21 ARG A2110 6.386 -6.429 -9.577 1.00 61.20 H new ATOM 0 HH22 ARG A2110 6.496 -7.975 -10.425 1.00 61.20 H new ATOM 1623 N ILE A2111 -1.546 -6.451 -6.977 1.00 13.33 N ATOM 1624 CA ILE A2111 -2.287 -7.456 -6.235 1.00 4.45 C ATOM 1625 C ILE A2111 -3.551 -7.830 -7.013 1.00 45.25 C ATOM 1626 O ILE A2111 -4.013 -8.969 -6.944 1.00 41.45 O ATOM 1627 CB ILE A2111 -2.561 -6.977 -4.809 1.00 44.02 C ATOM 1628 CG1 ILE A2111 -3.193 -5.585 -4.811 1.00 72.54 C ATOM 1629 CG2 ILE A2111 -1.291 -7.028 -3.959 1.00 11.42 C ATOM 1630 CD1 ILE A2111 -3.687 -5.203 -3.414 1.00 12.33 C ATOM 0 H ILE A2111 -1.190 -5.681 -6.411 1.00 13.33 H new ATOM 0 HA ILE A2111 -1.695 -8.366 -6.132 1.00 4.45 H new ATOM 0 HB ILE A2111 -3.280 -7.657 -4.353 1.00 44.02 H new ATOM 0 HG12 ILE A2111 -2.464 -4.852 -5.156 1.00 72.54 H new ATOM 0 HG13 ILE A2111 -4.026 -5.561 -5.514 1.00 72.54 H new ATOM 0 HG21 ILE A2111 -1.514 -6.682 -2.950 1.00 11.42 H new ATOM 0 HG22 ILE A2111 -0.922 -8.053 -3.918 1.00 11.42 H new ATOM 0 HG23 ILE A2111 -0.530 -6.386 -4.403 1.00 11.42 H new ATOM 0 HD11 ILE A2111 -4.132 -4.208 -3.445 1.00 12.33 H new ATOM 0 HD12 ILE A2111 -4.434 -5.924 -3.082 1.00 12.33 H new ATOM 0 HD13 ILE A2111 -2.848 -5.204 -2.718 1.00 12.33 H new ATOM 1642 N SER A2112 -4.074 -6.849 -7.735 1.00 31.55 N ATOM 1643 CA SER A2112 -5.275 -7.061 -8.524 1.00 11.50 C ATOM 1644 C SER A2112 -4.912 -7.686 -9.873 1.00 45.12 C ATOM 1645 O SER A2112 -5.503 -8.689 -10.275 1.00 50.55 O ATOM 1646 CB SER A2112 -6.034 -5.749 -8.734 1.00 64.52 C ATOM 1647 OG SER A2112 -6.681 -5.309 -7.544 1.00 34.42 O ATOM 0 H SER A2112 -3.688 -5.906 -7.790 1.00 31.55 H new ATOM 0 HA SER A2112 -5.927 -7.744 -7.978 1.00 11.50 H new ATOM 0 HB2 SER A2112 -5.341 -4.980 -9.075 1.00 64.52 H new ATOM 0 HB3 SER A2112 -6.776 -5.882 -9.522 1.00 64.52 H new ATOM 0 HG SER A2112 -7.153 -4.468 -7.720 1.00 34.42 H new ATOM 1653 N LYS A2113 -3.943 -7.069 -10.533 1.00 21.33 N ATOM 1654 CA LYS A2113 -3.495 -7.552 -11.828 1.00 24.24 C ATOM 1655 C LYS A2113 -3.209 -9.053 -11.736 1.00 10.32 C ATOM 1656 O LYS A2113 -2.374 -9.482 -10.942 1.00 5.41 O ATOM 1657 CB LYS A2113 -2.305 -6.729 -12.325 1.00 13.14 C ATOM 1658 CG LYS A2113 -2.693 -5.877 -13.535 1.00 74.31 C ATOM 1659 CD LYS A2113 -2.147 -6.482 -14.829 1.00 24.00 C ATOM 1660 CE LYS A2113 -3.221 -7.306 -15.543 1.00 2.44 C ATOM 1661 NZ LYS A2113 -2.643 -8.562 -16.076 1.00 72.11 N ATOM 0 H LYS A2113 -3.456 -6.239 -10.195 1.00 21.33 H new ATOM 0 HA LYS A2113 -4.278 -7.421 -12.575 1.00 24.24 H new ATOM 0 HB2 LYS A2113 -1.944 -6.085 -11.523 1.00 13.14 H new ATOM 0 HB3 LYS A2113 -1.485 -7.395 -12.593 1.00 13.14 H new ATOM 0 HG2 LYS A2113 -3.778 -5.798 -13.596 1.00 74.31 H new ATOM 0 HG3 LYS A2113 -2.307 -4.865 -13.411 1.00 74.31 H new ATOM 0 HD2 LYS A2113 -1.796 -5.687 -15.487 1.00 24.00 H new ATOM 0 HD3 LYS A2113 -1.287 -7.114 -14.605 1.00 24.00 H new ATOM 0 HE2 LYS A2113 -4.031 -7.537 -14.851 1.00 2.44 H new ATOM 0 HE3 LYS A2113 -3.653 -6.724 -16.357 1.00 2.44 H new ATOM 0 HZ1 LYS A2113 -3.385 -9.109 -16.557 1.00 72.11 H new ATOM 0 HZ2 LYS A2113 -1.886 -8.336 -16.752 1.00 72.11 H new ATOM 0 HZ3 LYS A2113 -2.252 -9.124 -15.293 1.00 72.11 H new