USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 978 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 123 CYS SG : rot -168:sc= -2.27! USER MOD Set 1.2: A 128 CYS SG : rot -101:sc= 0.125 USER MOD Set 1.3: A 141 HIS : no HE2:sc= -1.48 K(o=-8.5,f=-11) USER MOD Set 1.4: A 145 HIS : no HD1:sc= -4.87! K(o=-8.5!,f=-13) USER MOD Set 2.1: A 93 CYS SG : rot 100:sc= -0.92 USER MOD Set 2.2: A 98 CYS SG : rot 130:sc= -1.05 USER MOD Set 2.3: A 111 HIS : no HD1:sc= -2.6 K(o=-4.6,f=-7.1) USER MOD Set 3.1: A 58 HIS : no HD1:sc= -2.07! K(o=-1.7!,f=-0.9) USER MOD Set 3.2: A 75 LYS NZ :NH3+ 167:sc= 0.41 (180deg=0.324) USER MOD Set 4.1: A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 76 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: A 60 CYS SG : rot -127:sc= 0.688 USER MOD Set 5.2: A 65 CYS SG : rot 77:sc= -1.14 USER MOD Set 5.3: A 81 HIS : no HE2:sc= 0.0304 K(o=-0.38,f=-5.9!) USER MOD Set 5.4: A 85 HIS : no HE2:sc= 0.0481 K(o=-0.38,f=-6.9) USER MOD Set 6.1: A 16 CYS SG : rot -44:sc= -0.778 USER MOD Set 6.2: A 31 CYS SG : rot -134:sc= 0.515 USER MOD Set 6.3: A 44 HIS : no HD1:sc= -6.73! C(o=-19!,f=-23!) USER MOD Set 6.4: A 49 HIS : no HD1:sc= -12.5! C(o=-19!,f=-19!) USER MOD Single : A 12 GLN : amide:sc= -6.07! C(o=-6.1!,f=-6.1!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 GLN : amide:sc= -7.25! C(o=-7.2!,f=-7.5!) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 159:sc= -0.032 (180deg=-0.278) USER MOD Single : A 30 SER OG : rot -159:sc= 0.219 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= -0.25 USER MOD Single : A 37 THR OG1 : rot 180:sc= -1 USER MOD Single : A 38 MET CE :methyl 162:sc= -1.3 (180deg=-2.38!) USER MOD Single : A 39 HIS : no HD1:sc= -0.19 X(o=-0.19,f=-0.19) USER MOD Single : A 43 THR OG1 : rot 94:sc= 1.13 USER MOD Single : A 46 THR OG1 : rot 64:sc= 1.24 USER MOD Single : A 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= -3.87! C(o=-3.9!,f=-3.1!) USER MOD Single : A 56 ASN : amide:sc= -0.492 X(o=-0.49,f=-0.0012) USER MOD Single : A 57 ASN : amide:sc= -0.812! C(o=-0.81!,f=-4!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 146:sc= -0.298 (180deg=-1.3!) USER MOD Single : A 71 SER OG : rot 180:sc= -0.065 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN : amide:sc= -0.816 K(o=-0.82,f=-1.9!) USER MOD Single : A 86 THR OG1 : rot 180:sc= -0.465 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot 180:sc= -0.216 USER MOD Single : A 107 ASN : amide:sc= -0.211 K(o=-0.21,f=-1.8!) USER MOD Single : A 109 LYS NZ :NH3+ 136:sc= -0.171 (180deg=-1.59!) USER MOD Single : A 112 LYS NZ :NH3+ -123:sc= -0.784 (180deg=-1.36) USER MOD Single : A 122 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.00793) USER MOD Single : A 134 ASN : amide:sc= -3.43! C(o=-3.4!,f=-11!) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 LYS NZ :NH3+ 164:sc= -0.138 (180deg=-0.618) USER MOD Single : A 142 MET CE :methyl -125:sc= -3.56! (180deg=-7.57!) USER MOD Single : A 143 HIS : no HD1:sc= -9.92! C(o=-9.9!,f=-13!) USER MOD ----------------------------------------------------------------- ATOM 138 N GLN A 12 -9.746 6.894 -34.329 1.00 0.00 N ATOM 139 CA GLN A 12 -9.166 6.504 -33.049 1.00 0.00 C ATOM 140 C GLN A 12 -9.606 7.455 -31.940 1.00 0.00 C ATOM 141 O GLN A 12 -9.681 8.666 -32.142 1.00 0.00 O ATOM 142 CB GLN A 12 -7.639 6.482 -33.142 1.00 0.00 C ATOM 143 CG GLN A 12 -6.985 5.509 -32.175 1.00 0.00 C ATOM 144 CD GLN A 12 -7.100 5.955 -30.731 1.00 0.00 C ATOM 145 OE1 GLN A 12 -7.868 5.389 -29.953 1.00 0.00 O ATOM 146 NE2 GLN A 12 -6.335 6.976 -30.364 1.00 0.00 N ATOM 0 HA GLN A 12 -9.522 5.503 -32.807 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -7.349 6.220 -34.160 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -7.257 7.485 -32.950 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -7.446 4.528 -32.286 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -5.932 5.398 -32.434 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -5.712 7.416 -31.042 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -6.370 7.320 -29.405 1.00 0.00 H new ATOM 155 N GLU A 13 -9.897 6.896 -30.769 1.00 0.00 N ATOM 156 CA GLU A 13 -10.331 7.695 -29.629 1.00 0.00 C ATOM 157 C GLU A 13 -9.137 8.125 -28.781 1.00 0.00 C ATOM 158 O GLU A 13 -8.140 7.409 -28.683 1.00 0.00 O ATOM 159 CB GLU A 13 -11.321 6.905 -28.772 1.00 0.00 C ATOM 160 CG GLU A 13 -10.667 6.139 -27.635 1.00 0.00 C ATOM 161 CD GLU A 13 -11.576 5.078 -27.046 1.00 0.00 C ATOM 162 OE1 GLU A 13 -12.059 4.219 -27.814 1.00 0.00 O ATOM 163 OE2 GLU A 13 -11.805 5.106 -25.819 1.00 0.00 O ATOM 0 H GLU A 13 -9.840 5.894 -30.585 1.00 0.00 H new ATOM 0 HA GLU A 13 -10.825 8.589 -30.011 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -12.059 7.592 -28.358 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -11.860 6.203 -29.409 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -9.753 5.668 -27.998 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -10.376 6.838 -26.851 1.00 0.00 H new ATOM 170 N LEU A 14 -9.247 9.299 -28.169 1.00 0.00 N ATOM 171 CA LEU A 14 -8.177 9.827 -27.329 1.00 0.00 C ATOM 172 C LEU A 14 -8.721 10.287 -25.980 1.00 0.00 C ATOM 173 O LEU A 14 -9.930 10.449 -25.810 1.00 0.00 O ATOM 174 CB LEU A 14 -7.476 10.990 -28.032 1.00 0.00 C ATOM 175 CG LEU A 14 -7.346 10.876 -29.552 1.00 0.00 C ATOM 176 CD1 LEU A 14 -7.312 12.256 -30.190 1.00 0.00 C ATOM 177 CD2 LEU A 14 -6.101 10.084 -29.923 1.00 0.00 C ATOM 0 H LEU A 14 -10.066 9.903 -28.238 1.00 0.00 H new ATOM 0 HA LEU A 14 -7.456 9.028 -27.156 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -8.018 11.907 -27.802 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -6.477 11.095 -27.609 1.00 0.00 H new ATOM 0 HG LEU A 14 -8.218 10.344 -29.933 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -7.219 12.155 -31.271 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -8.233 12.789 -29.953 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -6.460 12.815 -29.803 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -6.025 10.013 -31.008 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -5.218 10.588 -29.529 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -6.167 9.083 -29.498 1.00 0.00 H new ATOM 189 N SER A 15 -7.821 10.497 -25.025 1.00 0.00 N ATOM 190 CA SER A 15 -8.210 10.937 -23.691 1.00 0.00 C ATOM 191 C SER A 15 -7.348 12.108 -23.231 1.00 0.00 C ATOM 192 O SER A 15 -6.298 12.387 -23.812 1.00 0.00 O ATOM 193 CB SER A 15 -8.093 9.781 -22.695 1.00 0.00 C ATOM 194 OG SER A 15 -8.654 8.592 -23.226 1.00 0.00 O ATOM 0 H SER A 15 -6.817 10.369 -25.151 1.00 0.00 H new ATOM 0 HA SER A 15 -9.248 11.268 -23.734 1.00 0.00 H new ATOM 0 HB2 SER A 15 -7.044 9.614 -22.449 1.00 0.00 H new ATOM 0 HB3 SER A 15 -8.601 10.044 -21.767 1.00 0.00 H new ATOM 0 HG SER A 15 -8.565 7.868 -22.572 1.00 0.00 H new ATOM 200 N CYS A 16 -7.798 12.792 -22.184 1.00 0.00 N ATOM 201 CA CYS A 16 -7.069 13.933 -21.645 1.00 0.00 C ATOM 202 C CYS A 16 -7.242 14.024 -20.132 1.00 0.00 C ATOM 203 O CYS A 16 -8.263 14.506 -19.640 1.00 0.00 O ATOM 204 CB CYS A 16 -7.549 15.229 -22.303 1.00 0.00 C ATOM 205 SG CYS A 16 -7.315 16.715 -21.277 1.00 0.00 S ATOM 0 H CYS A 16 -8.665 12.575 -21.692 1.00 0.00 H new ATOM 0 HA CYS A 16 -6.011 13.792 -21.864 1.00 0.00 H new ATOM 0 HB2 CYS A 16 -7.018 15.364 -23.245 1.00 0.00 H new ATOM 0 HB3 CYS A 16 -8.607 15.131 -22.545 1.00 0.00 H new ATOM 0 HG CYS A 16 -7.688 16.463 -20.057 1.00 0.00 H new ATOM 210 N LYS A 17 -6.238 13.557 -19.398 1.00 0.00 N ATOM 211 CA LYS A 17 -6.277 13.586 -17.941 1.00 0.00 C ATOM 212 C LYS A 17 -5.681 14.885 -17.406 1.00 0.00 C ATOM 213 O LYS A 17 -4.462 15.023 -17.304 1.00 0.00 O ATOM 214 CB LYS A 17 -5.515 12.389 -17.366 1.00 0.00 C ATOM 215 CG LYS A 17 -5.789 11.086 -18.098 1.00 0.00 C ATOM 216 CD LYS A 17 -7.258 10.706 -18.029 1.00 0.00 C ATOM 217 CE LYS A 17 -7.662 9.829 -19.204 1.00 0.00 C ATOM 218 NZ LYS A 17 -7.193 8.425 -19.036 1.00 0.00 N ATOM 0 H LYS A 17 -5.387 13.154 -19.789 1.00 0.00 H new ATOM 0 HA LYS A 17 -7.320 13.530 -17.629 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -4.446 12.598 -17.402 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -5.782 12.269 -16.316 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -5.486 11.183 -19.141 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -5.185 10.289 -17.663 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -7.455 10.179 -17.095 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -7.869 11.609 -18.021 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -8.747 9.839 -19.309 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -7.249 10.242 -20.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -7.488 7.860 -19.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -6.156 8.412 -18.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -7.607 8.022 -18.171 1.00 0.00 H new ATOM 232 N TRP A 18 -6.548 15.831 -17.066 1.00 0.00 N ATOM 233 CA TRP A 18 -6.107 17.119 -16.541 1.00 0.00 C ATOM 234 C TRP A 18 -6.391 17.223 -15.046 1.00 0.00 C ATOM 235 O TRP A 18 -7.533 17.073 -14.611 1.00 0.00 O ATOM 236 CB TRP A 18 -6.800 18.261 -17.285 1.00 0.00 C ATOM 237 CG TRP A 18 -6.120 19.585 -17.107 1.00 0.00 C ATOM 238 CD1 TRP A 18 -6.199 20.407 -16.020 1.00 0.00 C ATOM 239 CD2 TRP A 18 -5.258 20.239 -18.045 1.00 0.00 C ATOM 240 NE1 TRP A 18 -5.439 21.533 -16.226 1.00 0.00 N ATOM 241 CE2 TRP A 18 -4.851 21.454 -17.460 1.00 0.00 C ATOM 242 CE3 TRP A 18 -4.790 19.916 -19.322 1.00 0.00 C ATOM 243 CZ2 TRP A 18 -4.000 22.344 -18.110 1.00 0.00 C ATOM 244 CZ3 TRP A 18 -3.945 20.800 -19.965 1.00 0.00 C ATOM 245 CH2 TRP A 18 -3.557 22.002 -19.358 1.00 0.00 C ATOM 0 H TRP A 18 -7.560 15.731 -17.144 1.00 0.00 H new ATOM 0 HA TRP A 18 -5.031 17.196 -16.694 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -6.840 18.021 -18.348 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -7.830 18.340 -16.937 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -6.774 20.202 -15.129 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -5.330 22.303 -15.566 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -5.084 18.992 -19.798 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -3.700 23.272 -17.645 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -3.577 20.561 -20.952 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -2.895 22.672 -19.886 1.00 0.00 H new ATOM 256 N ILE A 19 -5.347 17.480 -14.266 1.00 0.00 N ATOM 257 CA ILE A 19 -5.486 17.605 -12.821 1.00 0.00 C ATOM 258 C ILE A 19 -4.989 18.963 -12.336 1.00 0.00 C ATOM 259 O ILE A 19 -3.785 19.181 -12.196 1.00 0.00 O ATOM 260 CB ILE A 19 -4.715 16.495 -12.083 1.00 0.00 C ATOM 261 CG1 ILE A 19 -5.103 15.121 -12.633 1.00 0.00 C ATOM 262 CG2 ILE A 19 -4.984 16.568 -10.587 1.00 0.00 C ATOM 263 CD1 ILE A 19 -4.995 14.009 -11.614 1.00 0.00 C ATOM 0 H ILE A 19 -4.395 17.606 -14.611 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.548 17.509 -12.597 1.00 0.00 H new ATOM 0 HB ILE A 19 -3.648 16.643 -12.248 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.127 15.164 -13.005 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -4.464 14.886 -13.484 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.432 15.777 -10.079 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.662 17.537 -10.206 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -6.051 16.442 -10.403 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -5.285 13.064 -12.074 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -3.967 13.939 -11.259 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.655 14.221 -10.773 1.00 0.00 H new ATOM 275 N ASP A 20 -5.923 19.872 -12.081 1.00 0.00 N ATOM 276 CA ASP A 20 -5.581 21.208 -11.609 1.00 0.00 C ATOM 277 C ASP A 20 -5.235 21.188 -10.123 1.00 0.00 C ATOM 278 O ASP A 20 -5.974 20.632 -9.312 1.00 0.00 O ATOM 279 CB ASP A 20 -6.739 22.174 -11.862 1.00 0.00 C ATOM 280 CG ASP A 20 -6.546 23.506 -11.164 1.00 0.00 C ATOM 281 OD1 ASP A 20 -5.446 24.085 -11.287 1.00 0.00 O ATOM 282 OD2 ASP A 20 -7.493 23.969 -10.495 1.00 0.00 O ATOM 0 H ASP A 20 -6.923 19.708 -12.193 1.00 0.00 H new ATOM 0 HA ASP A 20 -4.706 21.549 -12.163 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -6.841 22.341 -12.934 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -7.669 21.719 -11.520 1.00 0.00 H new ATOM 287 N GLU A 21 -4.106 21.797 -9.775 1.00 0.00 N ATOM 288 CA GLU A 21 -3.662 21.847 -8.387 1.00 0.00 C ATOM 289 C GLU A 21 -4.522 22.811 -7.575 1.00 0.00 C ATOM 290 O GLU A 21 -4.772 22.589 -6.390 1.00 0.00 O ATOM 291 CB GLU A 21 -2.193 22.270 -8.313 1.00 0.00 C ATOM 292 CG GLU A 21 -1.362 21.791 -9.491 1.00 0.00 C ATOM 293 CD GLU A 21 0.091 21.558 -9.123 1.00 0.00 C ATOM 294 OE1 GLU A 21 0.723 22.489 -8.582 1.00 0.00 O ATOM 295 OE2 GLU A 21 0.595 20.443 -9.376 1.00 0.00 O ATOM 0 H GLU A 21 -3.482 22.262 -10.435 1.00 0.00 H new ATOM 0 HA GLU A 21 -3.767 20.848 -7.963 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -2.139 23.357 -8.259 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -1.758 21.883 -7.391 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -1.788 20.866 -9.879 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -1.416 22.527 -10.293 1.00 0.00 H new ATOM 302 N ALA A 22 -4.970 23.882 -8.221 1.00 0.00 N ATOM 303 CA ALA A 22 -5.803 24.879 -7.560 1.00 0.00 C ATOM 304 C ALA A 22 -7.206 24.339 -7.301 1.00 0.00 C ATOM 305 O ALA A 22 -8.067 25.048 -6.781 1.00 0.00 O ATOM 306 CB ALA A 22 -5.870 26.149 -8.396 1.00 0.00 C ATOM 0 H ALA A 22 -4.770 24.082 -9.201 1.00 0.00 H new ATOM 0 HA ALA A 22 -5.350 25.114 -6.597 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.495 26.885 -7.890 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -4.866 26.553 -8.525 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -6.297 25.920 -9.372 1.00 0.00 H new ATOM 312 N GLN A 23 -7.427 23.081 -7.668 1.00 0.00 N ATOM 313 CA GLN A 23 -8.727 22.448 -7.477 1.00 0.00 C ATOM 314 C GLN A 23 -9.025 22.255 -5.993 1.00 0.00 C ATOM 315 O GLN A 23 -8.229 21.666 -5.261 1.00 0.00 O ATOM 316 CB GLN A 23 -8.771 21.099 -8.198 1.00 0.00 C ATOM 317 CG GLN A 23 -7.987 20.006 -7.491 1.00 0.00 C ATOM 318 CD GLN A 23 -7.989 18.698 -8.258 1.00 0.00 C ATOM 319 OE1 GLN A 23 -9.010 18.014 -8.339 1.00 0.00 O ATOM 320 NE2 GLN A 23 -6.843 18.343 -8.827 1.00 0.00 N ATOM 0 H GLN A 23 -6.724 22.480 -8.099 1.00 0.00 H new ATOM 0 HA GLN A 23 -9.489 23.103 -7.900 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -9.810 20.783 -8.298 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -8.377 21.223 -9.207 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -6.958 20.337 -7.347 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -8.411 19.843 -6.500 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -6.021 18.940 -8.734 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -6.784 17.473 -9.357 1.00 0.00 H new ATOM 329 N LEU A 24 -10.175 22.755 -5.556 1.00 0.00 N ATOM 330 CA LEU A 24 -10.579 22.638 -4.160 1.00 0.00 C ATOM 331 C LEU A 24 -11.444 21.400 -3.945 1.00 0.00 C ATOM 332 O LEU A 24 -12.122 21.274 -2.925 1.00 0.00 O ATOM 333 CB LEU A 24 -11.341 23.890 -3.722 1.00 0.00 C ATOM 334 CG LEU A 24 -10.487 25.058 -3.229 1.00 0.00 C ATOM 335 CD1 LEU A 24 -10.125 24.874 -1.763 1.00 0.00 C ATOM 336 CD2 LEU A 24 -9.231 25.195 -4.077 1.00 0.00 C ATOM 0 H LEU A 24 -10.845 23.246 -6.149 1.00 0.00 H new ATOM 0 HA LEU A 24 -9.678 22.538 -3.554 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -11.944 24.236 -4.561 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -12.032 23.611 -2.927 1.00 0.00 H new ATOM 0 HG LEU A 24 -11.069 25.975 -3.326 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -9.517 25.715 -1.430 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.036 24.826 -1.167 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -9.562 23.949 -1.641 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -8.635 26.031 -3.712 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -8.646 24.277 -4.012 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -9.511 25.375 -5.115 1.00 0.00 H new ATOM 348 N SER A 25 -11.415 20.489 -4.911 1.00 0.00 N ATOM 349 CA SER A 25 -12.198 19.261 -4.829 1.00 0.00 C ATOM 350 C SER A 25 -11.319 18.082 -4.424 1.00 0.00 C ATOM 351 O SER A 25 -10.112 18.080 -4.670 1.00 0.00 O ATOM 352 CB SER A 25 -12.873 18.971 -6.171 1.00 0.00 C ATOM 353 OG SER A 25 -13.653 17.790 -6.104 1.00 0.00 O ATOM 0 H SER A 25 -10.858 20.577 -5.761 1.00 0.00 H new ATOM 0 HA SER A 25 -12.965 19.399 -4.067 1.00 0.00 H new ATOM 0 HB2 SER A 25 -13.505 19.813 -6.453 1.00 0.00 H new ATOM 0 HB3 SER A 25 -12.116 18.867 -6.948 1.00 0.00 H new ATOM 0 HG SER A 25 -14.075 17.627 -6.973 1.00 0.00 H new ATOM 359 N ARG A 26 -11.932 17.082 -3.800 1.00 0.00 N ATOM 360 CA ARG A 26 -11.206 15.897 -3.359 1.00 0.00 C ATOM 361 C ARG A 26 -12.130 14.684 -3.299 1.00 0.00 C ATOM 362 O ARG A 26 -13.286 14.774 -2.885 1.00 0.00 O ATOM 363 CB ARG A 26 -10.576 16.140 -1.987 1.00 0.00 C ATOM 364 CG ARG A 26 -10.006 14.885 -1.347 1.00 0.00 C ATOM 365 CD ARG A 26 -8.506 14.775 -1.576 1.00 0.00 C ATOM 366 NE ARG A 26 -8.042 13.392 -1.507 1.00 0.00 N ATOM 367 CZ ARG A 26 -7.787 12.758 -0.368 1.00 0.00 C ATOM 368 NH1 ARG A 26 -7.952 13.380 0.791 1.00 0.00 N ATOM 369 NH2 ARG A 26 -7.368 11.500 -0.387 1.00 0.00 N ATOM 0 H ARG A 26 -12.930 17.069 -3.588 1.00 0.00 H new ATOM 0 HA ARG A 26 -10.417 15.695 -4.083 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -9.781 16.879 -2.087 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -11.327 16.567 -1.322 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -10.212 14.895 -0.277 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -10.503 14.007 -1.759 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -8.257 15.193 -2.551 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -7.981 15.371 -0.830 1.00 0.00 H new ATOM 0 HE ARG A 26 -7.906 12.885 -2.382 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -8.275 14.347 0.809 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -7.756 12.891 1.665 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -7.241 11.018 -1.277 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -7.173 11.014 0.488 1.00 0.00 H new ATOM 383 N PRO A 27 -11.611 13.522 -3.721 1.00 0.00 N ATOM 384 CA PRO A 27 -10.236 13.403 -4.216 1.00 0.00 C ATOM 385 C PRO A 27 -10.043 14.092 -5.563 1.00 0.00 C ATOM 386 O PRO A 27 -10.971 14.176 -6.368 1.00 0.00 O ATOM 387 CB PRO A 27 -10.038 11.892 -4.355 1.00 0.00 C ATOM 388 CG PRO A 27 -11.411 11.346 -4.547 1.00 0.00 C ATOM 389 CD PRO A 27 -12.325 12.235 -3.749 1.00 0.00 C ATOM 0 HA PRO A 27 -9.520 13.881 -3.547 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -9.395 11.653 -5.202 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -9.565 11.471 -3.468 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -11.688 11.347 -5.601 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -11.472 10.314 -4.203 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -13.304 12.329 -4.218 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -12.489 11.845 -2.745 1.00 0.00 H new ATOM 397 N LYS A 28 -8.832 14.583 -5.803 1.00 0.00 N ATOM 398 CA LYS A 28 -8.516 15.263 -7.054 1.00 0.00 C ATOM 399 C LYS A 28 -9.070 14.492 -8.247 1.00 0.00 C ATOM 400 O LYS A 28 -8.772 13.312 -8.431 1.00 0.00 O ATOM 401 CB LYS A 28 -7.001 15.429 -7.199 1.00 0.00 C ATOM 402 CG LYS A 28 -6.294 15.733 -5.890 1.00 0.00 C ATOM 403 CD LYS A 28 -5.082 16.624 -6.104 1.00 0.00 C ATOM 404 CE LYS A 28 -5.433 18.094 -5.929 1.00 0.00 C ATOM 405 NZ LYS A 28 -4.296 18.871 -5.362 1.00 0.00 N ATOM 0 H LYS A 28 -8.053 14.523 -5.148 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.983 16.248 -7.032 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.583 14.517 -7.624 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.798 16.233 -7.907 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -6.988 16.220 -5.205 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -5.983 14.801 -5.419 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -4.298 16.349 -5.398 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -4.681 16.461 -7.105 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -5.717 18.517 -6.893 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -6.299 18.185 -5.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -4.574 19.868 -5.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -4.041 18.484 -4.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -3.478 18.805 -6.001 1.00 0.00 H new ATOM 419 N LYS A 29 -9.878 15.168 -9.058 1.00 0.00 N ATOM 420 CA LYS A 29 -10.473 14.548 -10.236 1.00 0.00 C ATOM 421 C LYS A 29 -9.781 15.025 -11.509 1.00 0.00 C ATOM 422 O LYS A 29 -9.289 16.151 -11.575 1.00 0.00 O ATOM 423 CB LYS A 29 -11.968 14.867 -10.306 1.00 0.00 C ATOM 424 CG LYS A 29 -12.285 16.341 -10.121 1.00 0.00 C ATOM 425 CD LYS A 29 -13.774 16.612 -10.256 1.00 0.00 C ATOM 426 CE LYS A 29 -14.040 18.019 -10.770 1.00 0.00 C ATOM 427 NZ LYS A 29 -13.637 18.175 -12.195 1.00 0.00 N ATOM 0 H LYS A 29 -10.135 16.145 -8.921 1.00 0.00 H new ATOM 0 HA LYS A 29 -10.342 13.469 -10.153 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -12.356 14.539 -11.270 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -12.490 14.293 -9.540 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -11.942 16.667 -9.139 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -11.739 16.927 -10.860 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -14.217 15.885 -10.937 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -14.258 16.479 -9.289 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -15.100 18.249 -10.665 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -13.496 18.738 -10.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -14.137 18.987 -12.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -12.611 18.335 -12.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -13.882 17.312 -12.721 1.00 0.00 H new ATOM 441 N SER A 30 -9.748 14.161 -12.519 1.00 0.00 N ATOM 442 CA SER A 30 -9.114 14.493 -13.789 1.00 0.00 C ATOM 443 C SER A 30 -10.159 14.873 -14.834 1.00 0.00 C ATOM 444 O SER A 30 -11.298 14.408 -14.788 1.00 0.00 O ATOM 445 CB SER A 30 -8.280 13.313 -14.291 1.00 0.00 C ATOM 446 OG SER A 30 -7.642 12.646 -13.216 1.00 0.00 O ATOM 0 H SER A 30 -10.153 13.226 -12.482 1.00 0.00 H new ATOM 0 HA SER A 30 -8.459 15.349 -13.627 1.00 0.00 H new ATOM 0 HB2 SER A 30 -8.920 12.614 -14.828 1.00 0.00 H new ATOM 0 HB3 SER A 30 -7.531 13.668 -14.999 1.00 0.00 H new ATOM 0 HG SER A 30 -6.877 12.137 -13.555 1.00 0.00 H new ATOM 452 N CYS A 31 -9.762 15.721 -15.777 1.00 0.00 N ATOM 453 CA CYS A 31 -10.662 16.165 -16.835 1.00 0.00 C ATOM 454 C CYS A 31 -11.250 14.973 -17.584 1.00 0.00 C ATOM 455 O CYS A 31 -10.557 13.992 -17.853 1.00 0.00 O ATOM 456 CB CYS A 31 -9.922 17.081 -17.811 1.00 0.00 C ATOM 457 SG CYS A 31 -10.558 17.018 -19.517 1.00 0.00 S ATOM 0 H CYS A 31 -8.823 16.115 -15.830 1.00 0.00 H new ATOM 0 HA CYS A 31 -11.479 16.721 -16.374 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -9.985 18.107 -17.449 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -8.866 16.810 -17.818 1.00 0.00 H new ATOM 0 HG CYS A 31 -9.562 16.931 -20.348 1.00 0.00 H new ATOM 462 N ASP A 32 -12.533 15.066 -17.919 1.00 0.00 N ATOM 463 CA ASP A 32 -13.215 13.997 -18.639 1.00 0.00 C ATOM 464 C ASP A 32 -13.682 14.477 -20.010 1.00 0.00 C ATOM 465 O ASP A 32 -14.450 15.434 -20.115 1.00 0.00 O ATOM 466 CB ASP A 32 -14.408 13.488 -17.829 1.00 0.00 C ATOM 467 CG ASP A 32 -15.411 14.584 -17.526 1.00 0.00 C ATOM 468 OD1 ASP A 32 -15.046 15.772 -17.645 1.00 0.00 O ATOM 469 OD2 ASP A 32 -16.561 14.253 -17.168 1.00 0.00 O ATOM 0 H ASP A 32 -13.121 15.871 -17.703 1.00 0.00 H new ATOM 0 HA ASP A 32 -12.508 13.180 -18.782 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -14.903 12.688 -18.380 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -14.051 13.057 -16.894 1.00 0.00 H new ATOM 474 N ARG A 33 -13.213 13.807 -21.057 1.00 0.00 N ATOM 475 CA ARG A 33 -13.581 14.167 -22.421 1.00 0.00 C ATOM 476 C ARG A 33 -13.022 13.157 -23.419 1.00 0.00 C ATOM 477 O ARG A 33 -12.184 12.324 -23.073 1.00 0.00 O ATOM 478 CB ARG A 33 -13.070 15.569 -22.757 1.00 0.00 C ATOM 479 CG ARG A 33 -13.762 16.198 -23.956 1.00 0.00 C ATOM 480 CD ARG A 33 -13.721 17.717 -23.889 1.00 0.00 C ATOM 481 NE ARG A 33 -14.647 18.332 -24.836 1.00 0.00 N ATOM 482 CZ ARG A 33 -15.951 18.452 -24.616 1.00 0.00 C ATOM 483 NH1 ARG A 33 -16.480 18.001 -23.487 1.00 0.00 N ATOM 484 NH2 ARG A 33 -16.729 19.023 -25.526 1.00 0.00 N ATOM 0 H ARG A 33 -12.578 13.012 -20.987 1.00 0.00 H new ATOM 0 HA ARG A 33 -14.669 14.158 -22.492 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -13.207 16.214 -21.889 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -11.999 15.519 -22.951 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -13.281 15.860 -24.874 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -14.798 15.862 -23.997 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -13.967 18.042 -22.878 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -12.708 18.062 -24.097 1.00 0.00 H new ATOM 0 HE ARG A 33 -14.272 18.689 -25.715 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -15.885 17.561 -22.785 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -17.482 18.094 -23.320 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -16.326 19.371 -26.396 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -17.731 19.115 -25.356 1.00 0.00 H new ATOM 498 N THR A 34 -13.491 13.237 -24.661 1.00 0.00 N ATOM 499 CA THR A 34 -13.040 12.331 -25.709 1.00 0.00 C ATOM 500 C THR A 34 -12.978 13.037 -27.058 1.00 0.00 C ATOM 501 O THR A 34 -13.487 14.148 -27.213 1.00 0.00 O ATOM 502 CB THR A 34 -13.964 11.104 -25.827 1.00 0.00 C ATOM 503 OG1 THR A 34 -15.333 11.511 -25.726 1.00 0.00 O ATOM 504 CG2 THR A 34 -13.652 10.085 -24.741 1.00 0.00 C ATOM 0 H THR A 34 -14.184 13.921 -24.965 1.00 0.00 H new ATOM 0 HA THR A 34 -12.040 11.999 -25.430 1.00 0.00 H new ATOM 0 HB THR A 34 -13.793 10.640 -26.798 1.00 0.00 H new ATOM 0 HG1 THR A 34 -15.914 10.726 -25.804 1.00 0.00 H new ATOM 0 HG21 THR A 34 -14.317 9.228 -24.845 1.00 0.00 H new ATOM 0 HG22 THR A 34 -12.617 9.756 -24.838 1.00 0.00 H new ATOM 0 HG23 THR A 34 -13.798 10.541 -23.762 1.00 0.00 H new ATOM 512 N PHE A 35 -12.351 12.387 -28.033 1.00 0.00 N ATOM 513 CA PHE A 35 -12.222 12.954 -29.370 1.00 0.00 C ATOM 514 C PHE A 35 -12.118 11.852 -30.420 1.00 0.00 C ATOM 515 O PHE A 35 -11.868 10.691 -30.095 1.00 0.00 O ATOM 516 CB PHE A 35 -10.993 13.863 -29.445 1.00 0.00 C ATOM 517 CG PHE A 35 -10.788 14.698 -28.214 1.00 0.00 C ATOM 518 CD1 PHE A 35 -10.221 14.149 -27.075 1.00 0.00 C ATOM 519 CD2 PHE A 35 -11.163 16.031 -28.195 1.00 0.00 C ATOM 520 CE1 PHE A 35 -10.032 14.914 -25.940 1.00 0.00 C ATOM 521 CE2 PHE A 35 -10.976 16.802 -27.063 1.00 0.00 C ATOM 522 CZ PHE A 35 -10.409 16.243 -25.934 1.00 0.00 C ATOM 0 H PHE A 35 -11.924 11.467 -27.922 1.00 0.00 H new ATOM 0 HA PHE A 35 -13.115 13.544 -29.575 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -10.107 13.250 -29.610 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -11.090 14.521 -30.308 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -9.923 13.111 -27.074 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -11.607 16.473 -29.075 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -9.590 14.473 -25.059 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -11.273 17.840 -27.061 1.00 0.00 H new ATOM 0 HZ PHE A 35 -10.261 16.844 -25.049 1.00 0.00 H new ATOM 532 N SER A 36 -12.314 12.224 -31.681 1.00 0.00 N ATOM 533 CA SER A 36 -12.247 11.268 -32.780 1.00 0.00 C ATOM 534 C SER A 36 -10.946 11.427 -33.561 1.00 0.00 C ATOM 535 O SER A 36 -10.447 10.474 -34.161 1.00 0.00 O ATOM 536 CB SER A 36 -13.443 11.450 -33.716 1.00 0.00 C ATOM 537 OG SER A 36 -13.428 12.732 -34.319 1.00 0.00 O ATOM 0 H SER A 36 -12.521 13.181 -31.967 1.00 0.00 H new ATOM 0 HA SER A 36 -12.275 10.264 -32.357 1.00 0.00 H new ATOM 0 HB2 SER A 36 -13.425 10.681 -34.488 1.00 0.00 H new ATOM 0 HB3 SER A 36 -14.370 11.318 -33.157 1.00 0.00 H new ATOM 0 HG SER A 36 -14.202 12.823 -34.914 1.00 0.00 H new ATOM 543 N THR A 37 -10.401 12.639 -33.549 1.00 0.00 N ATOM 544 CA THR A 37 -9.160 12.926 -34.257 1.00 0.00 C ATOM 545 C THR A 37 -8.108 13.496 -33.313 1.00 0.00 C ATOM 546 O THR A 37 -8.408 13.841 -32.170 1.00 0.00 O ATOM 547 CB THR A 37 -9.388 13.919 -35.412 1.00 0.00 C ATOM 548 OG1 THR A 37 -9.375 15.261 -34.915 1.00 0.00 O ATOM 549 CG2 THR A 37 -10.712 13.643 -36.109 1.00 0.00 C ATOM 0 H THR A 37 -10.800 13.438 -33.056 1.00 0.00 H new ATOM 0 HA THR A 37 -8.804 11.980 -34.666 1.00 0.00 H new ATOM 0 HB THR A 37 -8.582 13.793 -36.135 1.00 0.00 H new ATOM 0 HG1 THR A 37 -9.519 15.886 -35.656 1.00 0.00 H new ATOM 0 HG21 THR A 37 -10.851 14.357 -36.921 1.00 0.00 H new ATOM 0 HG22 THR A 37 -10.707 12.630 -36.513 1.00 0.00 H new ATOM 0 HG23 THR A 37 -11.528 13.744 -35.393 1.00 0.00 H new ATOM 557 N MET A 38 -6.874 13.592 -33.797 1.00 0.00 N ATOM 558 CA MET A 38 -5.777 14.123 -32.996 1.00 0.00 C ATOM 559 C MET A 38 -5.963 15.615 -32.741 1.00 0.00 C ATOM 560 O MET A 38 -5.983 16.062 -31.593 1.00 0.00 O ATOM 561 CB MET A 38 -4.440 13.876 -33.695 1.00 0.00 C ATOM 562 CG MET A 38 -3.341 14.833 -33.262 1.00 0.00 C ATOM 563 SD MET A 38 -2.832 14.576 -31.551 1.00 0.00 S ATOM 564 CE MET A 38 -2.809 12.787 -31.469 1.00 0.00 C ATOM 0 H MET A 38 -6.609 13.309 -34.740 1.00 0.00 H new ATOM 0 HA MET A 38 -5.777 13.606 -32.037 1.00 0.00 H new ATOM 0 HB2 MET A 38 -4.119 12.853 -33.496 1.00 0.00 H new ATOM 0 HB3 MET A 38 -4.581 13.962 -34.772 1.00 0.00 H new ATOM 0 HG2 MET A 38 -2.478 14.709 -33.916 1.00 0.00 H new ATOM 0 HG3 MET A 38 -3.689 15.859 -33.384 1.00 0.00 H new ATOM 0 HE1 MET A 38 -2.222 12.470 -30.607 1.00 0.00 H new ATOM 0 HE2 MET A 38 -3.828 12.414 -31.370 1.00 0.00 H new ATOM 0 HE3 MET A 38 -2.363 12.387 -32.379 1.00 0.00 H new ATOM 574 N HIS A 39 -6.099 16.383 -33.818 1.00 0.00 N ATOM 575 CA HIS A 39 -6.283 17.826 -33.710 1.00 0.00 C ATOM 576 C HIS A 39 -7.376 18.160 -32.698 1.00 0.00 C ATOM 577 O HIS A 39 -7.294 19.165 -31.993 1.00 0.00 O ATOM 578 CB HIS A 39 -6.637 18.419 -35.074 1.00 0.00 C ATOM 579 CG HIS A 39 -5.683 18.031 -36.161 1.00 0.00 C ATOM 580 ND1 HIS A 39 -6.094 17.574 -37.395 1.00 0.00 N ATOM 581 CD2 HIS A 39 -4.329 18.036 -36.195 1.00 0.00 C ATOM 582 CE1 HIS A 39 -5.035 17.313 -38.141 1.00 0.00 C ATOM 583 NE2 HIS A 39 -3.952 17.585 -37.436 1.00 0.00 N ATOM 0 H HIS A 39 -6.085 16.030 -34.775 1.00 0.00 H new ATOM 0 HA HIS A 39 -5.346 18.262 -33.364 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -7.641 18.098 -35.351 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -6.661 19.506 -34.994 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -3.669 18.338 -35.395 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -5.052 16.941 -39.155 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -2.991 17.477 -37.761 1.00 0.00 H new ATOM 591 N GLU A 40 -8.396 17.310 -32.634 1.00 0.00 N ATOM 592 CA GLU A 40 -9.504 17.517 -31.709 1.00 0.00 C ATOM 593 C GLU A 40 -9.012 17.534 -30.265 1.00 0.00 C ATOM 594 O GLU A 40 -9.417 18.383 -29.469 1.00 0.00 O ATOM 595 CB GLU A 40 -10.558 16.422 -31.888 1.00 0.00 C ATOM 596 CG GLU A 40 -11.386 16.574 -33.153 1.00 0.00 C ATOM 597 CD GLU A 40 -12.418 17.680 -33.045 1.00 0.00 C ATOM 598 OE1 GLU A 40 -12.608 18.206 -31.928 1.00 0.00 O ATOM 599 OE2 GLU A 40 -13.036 18.018 -34.076 1.00 0.00 O ATOM 0 H GLU A 40 -8.478 16.473 -33.211 1.00 0.00 H new ATOM 0 HA GLU A 40 -9.954 18.484 -31.932 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -10.062 15.451 -31.903 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -11.224 16.426 -31.025 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -10.724 16.781 -33.994 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -11.890 15.632 -33.368 1.00 0.00 H new ATOM 606 N LEU A 41 -8.138 16.591 -29.933 1.00 0.00 N ATOM 607 CA LEU A 41 -7.590 16.496 -28.584 1.00 0.00 C ATOM 608 C LEU A 41 -6.689 17.688 -28.278 1.00 0.00 C ATOM 609 O LEU A 41 -6.922 18.426 -27.320 1.00 0.00 O ATOM 610 CB LEU A 41 -6.805 15.193 -28.422 1.00 0.00 C ATOM 611 CG LEU A 41 -5.950 15.077 -27.160 1.00 0.00 C ATOM 612 CD1 LEU A 41 -6.798 15.306 -25.918 1.00 0.00 C ATOM 613 CD2 LEU A 41 -5.269 13.718 -27.100 1.00 0.00 C ATOM 0 H LEU A 41 -7.793 15.881 -30.579 1.00 0.00 H new ATOM 0 HA LEU A 41 -8.421 16.502 -27.879 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -7.511 14.363 -28.436 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.155 15.073 -29.289 1.00 0.00 H new ATOM 0 HG LEU A 41 -5.178 15.846 -27.195 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -6.173 15.220 -25.029 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -7.238 16.302 -25.957 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -7.592 14.560 -25.877 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.665 13.653 -26.195 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -6.025 12.933 -27.089 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.629 13.593 -27.973 1.00 0.00 H new ATOM 625 N VAL A 42 -5.659 17.871 -29.098 1.00 0.00 N ATOM 626 CA VAL A 42 -4.724 18.975 -28.917 1.00 0.00 C ATOM 627 C VAL A 42 -5.463 20.299 -28.751 1.00 0.00 C ATOM 628 O VAL A 42 -5.240 21.031 -27.786 1.00 0.00 O ATOM 629 CB VAL A 42 -3.752 19.088 -30.106 1.00 0.00 C ATOM 630 CG1 VAL A 42 -2.778 20.237 -29.892 1.00 0.00 C ATOM 631 CG2 VAL A 42 -3.006 17.778 -30.310 1.00 0.00 C ATOM 0 H VAL A 42 -5.451 17.269 -29.894 1.00 0.00 H new ATOM 0 HA VAL A 42 -4.155 18.763 -28.012 1.00 0.00 H new ATOM 0 HB VAL A 42 -4.330 19.295 -31.007 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -2.099 20.301 -30.742 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -3.332 21.171 -29.798 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -2.204 20.063 -28.982 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.323 17.876 -31.154 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -2.439 17.538 -29.411 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -3.721 16.980 -30.512 1.00 0.00 H new ATOM 641 N THR A 43 -6.345 20.601 -29.698 1.00 0.00 N ATOM 642 CA THR A 43 -7.117 21.836 -29.658 1.00 0.00 C ATOM 643 C THR A 43 -7.790 22.020 -28.303 1.00 0.00 C ATOM 644 O THR A 43 -8.003 23.146 -27.852 1.00 0.00 O ATOM 645 CB THR A 43 -8.192 21.863 -30.761 1.00 0.00 C ATOM 646 OG1 THR A 43 -7.589 21.633 -32.039 1.00 0.00 O ATOM 647 CG2 THR A 43 -8.923 23.197 -30.772 1.00 0.00 C ATOM 0 H THR A 43 -6.543 20.006 -30.503 1.00 0.00 H new ATOM 0 HA THR A 43 -6.415 22.653 -29.826 1.00 0.00 H new ATOM 0 HB THR A 43 -8.914 21.073 -30.553 1.00 0.00 H new ATOM 0 HG1 THR A 43 -7.632 20.678 -32.254 1.00 0.00 H new ATOM 0 HG21 THR A 43 -9.677 23.192 -31.559 1.00 0.00 H new ATOM 0 HG22 THR A 43 -9.406 23.355 -29.808 1.00 0.00 H new ATOM 0 HG23 THR A 43 -8.210 24.001 -30.957 1.00 0.00 H new ATOM 655 N HIS A 44 -8.123 20.907 -27.657 1.00 0.00 N ATOM 656 CA HIS A 44 -8.772 20.946 -26.351 1.00 0.00 C ATOM 657 C HIS A 44 -7.748 21.171 -25.242 1.00 0.00 C ATOM 658 O HIS A 44 -7.792 22.180 -24.538 1.00 0.00 O ATOM 659 CB HIS A 44 -9.537 19.647 -26.099 1.00 0.00 C ATOM 660 CG HIS A 44 -9.909 19.440 -24.663 1.00 0.00 C ATOM 661 ND1 HIS A 44 -11.107 19.864 -24.128 1.00 0.00 N ATOM 662 CD2 HIS A 44 -9.235 18.848 -23.650 1.00 0.00 C ATOM 663 CE1 HIS A 44 -11.153 19.544 -22.847 1.00 0.00 C ATOM 664 NE2 HIS A 44 -10.029 18.926 -22.532 1.00 0.00 N ATOM 0 H HIS A 44 -7.954 19.967 -28.016 1.00 0.00 H new ATOM 0 HA HIS A 44 -9.475 21.779 -26.347 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -10.443 19.645 -26.704 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -8.929 18.806 -26.433 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -8.255 18.398 -23.710 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -11.970 19.752 -22.172 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -9.790 18.565 -21.608 1.00 0.00 H new ATOM 672 N VAL A 45 -6.827 20.224 -25.093 1.00 0.00 N ATOM 673 CA VAL A 45 -5.792 20.319 -24.071 1.00 0.00 C ATOM 674 C VAL A 45 -5.031 21.635 -24.179 1.00 0.00 C ATOM 675 O VAL A 45 -4.417 22.092 -23.215 1.00 0.00 O ATOM 676 CB VAL A 45 -4.793 19.151 -24.174 1.00 0.00 C ATOM 677 CG1 VAL A 45 -3.887 19.114 -22.952 1.00 0.00 C ATOM 678 CG2 VAL A 45 -5.531 17.832 -24.341 1.00 0.00 C ATOM 0 H VAL A 45 -6.777 19.382 -25.667 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.296 20.273 -23.106 1.00 0.00 H new ATOM 0 HB VAL A 45 -4.169 19.306 -25.054 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -3.188 18.283 -23.042 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -3.331 20.049 -22.883 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -4.492 18.984 -22.055 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -4.810 17.018 -24.412 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -6.181 17.667 -23.481 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.133 17.864 -25.249 1.00 0.00 H new ATOM 688 N THR A 46 -5.076 22.243 -25.361 1.00 0.00 N ATOM 689 CA THR A 46 -4.391 23.507 -25.597 1.00 0.00 C ATOM 690 C THR A 46 -5.320 24.690 -25.353 1.00 0.00 C ATOM 691 O THR A 46 -5.022 25.569 -24.544 1.00 0.00 O ATOM 692 CB THR A 46 -3.841 23.589 -27.034 1.00 0.00 C ATOM 693 OG1 THR A 46 -3.129 22.389 -27.355 1.00 0.00 O ATOM 694 CG2 THR A 46 -2.920 24.789 -27.193 1.00 0.00 C ATOM 0 H THR A 46 -5.580 21.879 -26.170 1.00 0.00 H new ATOM 0 HA THR A 46 -3.559 23.551 -24.894 1.00 0.00 H new ATOM 0 HB THR A 46 -4.683 23.705 -27.716 1.00 0.00 H new ATOM 0 HG1 THR A 46 -3.748 21.630 -27.349 1.00 0.00 H new ATOM 0 HG21 THR A 46 -2.544 24.826 -28.215 1.00 0.00 H new ATOM 0 HG22 THR A 46 -3.473 25.703 -26.976 1.00 0.00 H new ATOM 0 HG23 THR A 46 -2.082 24.699 -26.501 1.00 0.00 H new ATOM 702 N MET A 47 -6.448 24.706 -26.056 1.00 0.00 N ATOM 703 CA MET A 47 -7.423 25.781 -25.912 1.00 0.00 C ATOM 704 C MET A 47 -8.402 25.481 -24.782 1.00 0.00 C ATOM 705 O MET A 47 -8.634 26.320 -23.912 1.00 0.00 O ATOM 706 CB MET A 47 -8.186 25.985 -27.223 1.00 0.00 C ATOM 707 CG MET A 47 -7.294 25.967 -28.454 1.00 0.00 C ATOM 708 SD MET A 47 -8.083 26.713 -29.893 1.00 0.00 S ATOM 709 CE MET A 47 -6.650 27.194 -30.854 1.00 0.00 C ATOM 0 H MET A 47 -6.709 23.987 -26.731 1.00 0.00 H new ATOM 0 HA MET A 47 -6.884 26.696 -25.667 1.00 0.00 H new ATOM 0 HB2 MET A 47 -8.941 25.205 -27.320 1.00 0.00 H new ATOM 0 HB3 MET A 47 -8.715 26.937 -27.182 1.00 0.00 H new ATOM 0 HG2 MET A 47 -6.368 26.499 -28.235 1.00 0.00 H new ATOM 0 HG3 MET A 47 -7.022 24.937 -28.686 1.00 0.00 H new ATOM 0 HE1 MET A 47 -6.975 27.672 -31.778 1.00 0.00 H new ATOM 0 HE2 MET A 47 -6.044 27.893 -30.278 1.00 0.00 H new ATOM 0 HE3 MET A 47 -6.058 26.310 -31.091 1.00 0.00 H new ATOM 719 N GLU A 48 -8.971 24.280 -24.802 1.00 0.00 N ATOM 720 CA GLU A 48 -9.926 23.872 -23.778 1.00 0.00 C ATOM 721 C GLU A 48 -9.226 23.645 -22.441 1.00 0.00 C ATOM 722 O GLU A 48 -9.850 23.232 -21.463 1.00 0.00 O ATOM 723 CB GLU A 48 -10.654 22.596 -24.208 1.00 0.00 C ATOM 724 CG GLU A 48 -11.470 22.760 -25.479 1.00 0.00 C ATOM 725 CD GLU A 48 -12.817 23.409 -25.227 1.00 0.00 C ATOM 726 OE1 GLU A 48 -13.596 22.866 -24.416 1.00 0.00 O ATOM 727 OE2 GLU A 48 -13.092 24.461 -25.842 1.00 0.00 O ATOM 0 H GLU A 48 -8.788 23.574 -25.515 1.00 0.00 H new ATOM 0 HA GLU A 48 -10.654 24.674 -23.656 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -9.922 21.802 -24.356 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -11.313 22.275 -23.402 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -10.908 23.363 -26.192 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -11.622 21.783 -25.938 1.00 0.00 H new ATOM 734 N HIS A 49 -7.925 23.917 -22.407 1.00 0.00 N ATOM 735 CA HIS A 49 -7.140 23.744 -21.190 1.00 0.00 C ATOM 736 C HIS A 49 -6.103 24.854 -21.050 1.00 0.00 C ATOM 737 O HIS A 49 -6.251 25.755 -20.225 1.00 0.00 O ATOM 738 CB HIS A 49 -6.447 22.381 -21.196 1.00 0.00 C ATOM 739 CG HIS A 49 -7.183 21.331 -20.421 1.00 0.00 C ATOM 740 ND1 HIS A 49 -7.964 21.617 -19.321 1.00 0.00 N ATOM 741 CD2 HIS A 49 -7.255 19.991 -20.594 1.00 0.00 C ATOM 742 CE1 HIS A 49 -8.483 20.498 -18.850 1.00 0.00 C ATOM 743 NE2 HIS A 49 -8.069 19.496 -19.605 1.00 0.00 N ATOM 0 H HIS A 49 -7.393 24.258 -23.208 1.00 0.00 H new ATOM 0 HA HIS A 49 -7.818 23.795 -20.338 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -6.332 22.046 -22.227 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -5.445 22.490 -20.782 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -6.764 19.418 -21.366 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -9.135 20.416 -17.993 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -8.314 18.515 -19.475 1.00 0.00 H new ATOM 751 N VAL A 50 -5.052 24.782 -21.861 1.00 0.00 N ATOM 752 CA VAL A 50 -3.990 25.781 -21.828 1.00 0.00 C ATOM 753 C VAL A 50 -4.479 27.120 -22.367 1.00 0.00 C ATOM 754 O VAL A 50 -3.743 28.106 -22.371 1.00 0.00 O ATOM 755 CB VAL A 50 -2.767 25.327 -22.646 1.00 0.00 C ATOM 756 CG1 VAL A 50 -1.778 26.471 -22.808 1.00 0.00 C ATOM 757 CG2 VAL A 50 -2.102 24.127 -21.987 1.00 0.00 C ATOM 0 H VAL A 50 -4.913 24.042 -22.549 1.00 0.00 H new ATOM 0 HA VAL A 50 -3.697 25.897 -20.785 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.106 25.028 -23.638 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -0.920 26.131 -23.389 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.262 27.299 -23.326 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.442 26.804 -21.826 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -1.239 23.819 -22.578 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -1.776 24.398 -20.983 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -2.814 23.304 -21.928 1.00 0.00 H new ATOM 767 N GLY A 51 -5.729 27.149 -22.822 1.00 0.00 N ATOM 768 CA GLY A 51 -6.295 28.373 -23.357 1.00 0.00 C ATOM 769 C GLY A 51 -5.690 28.756 -24.693 1.00 0.00 C ATOM 770 O GLY A 51 -4.956 27.975 -25.297 1.00 0.00 O ATOM 0 H GLY A 51 -6.359 26.347 -22.829 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -7.372 28.252 -23.471 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -6.139 29.183 -22.645 1.00 0.00 H new ATOM 774 N GLY A 52 -6.001 29.963 -25.158 1.00 0.00 N ATOM 775 CA GLY A 52 -5.476 30.426 -26.429 1.00 0.00 C ATOM 776 C GLY A 52 -4.219 31.259 -26.268 1.00 0.00 C ATOM 777 O GLY A 52 -3.557 31.229 -25.231 1.00 0.00 O ATOM 0 H GLY A 52 -6.607 30.628 -24.677 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -5.260 29.567 -27.064 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -6.237 31.017 -26.939 1.00 0.00 H new ATOM 781 N PRO A 53 -3.874 32.024 -27.315 1.00 0.00 N ATOM 782 CA PRO A 53 -2.686 32.882 -27.310 1.00 0.00 C ATOM 783 C PRO A 53 -2.833 34.071 -26.365 1.00 0.00 C ATOM 784 O PRO A 53 -1.934 34.903 -26.257 1.00 0.00 O ATOM 785 CB PRO A 53 -2.588 33.361 -28.760 1.00 0.00 C ATOM 786 CG PRO A 53 -3.982 33.281 -29.280 1.00 0.00 C ATOM 787 CD PRO A 53 -4.617 32.109 -28.583 1.00 0.00 C ATOM 0 HA PRO A 53 -1.801 32.350 -26.962 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -2.203 34.379 -28.815 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -1.912 32.732 -29.340 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -4.529 34.201 -29.074 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -3.988 33.142 -30.361 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -5.682 32.270 -28.415 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -4.521 31.194 -29.167 1.00 0.00 H new ATOM 795 N GLU A 54 -3.972 34.141 -25.684 1.00 0.00 N ATOM 796 CA GLU A 54 -4.236 35.229 -24.749 1.00 0.00 C ATOM 797 C GLU A 54 -3.855 34.827 -23.326 1.00 0.00 C ATOM 798 O GLU A 54 -3.236 35.601 -22.597 1.00 0.00 O ATOM 799 CB GLU A 54 -5.712 35.629 -24.800 1.00 0.00 C ATOM 800 CG GLU A 54 -6.121 36.277 -26.112 1.00 0.00 C ATOM 801 CD GLU A 54 -5.858 37.770 -26.132 1.00 0.00 C ATOM 802 OE1 GLU A 54 -4.818 38.197 -25.589 1.00 0.00 O ATOM 803 OE2 GLU A 54 -6.692 38.511 -26.693 1.00 0.00 O ATOM 0 H GLU A 54 -4.726 33.458 -25.762 1.00 0.00 H new ATOM 0 HA GLU A 54 -3.626 36.083 -25.043 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -6.326 34.744 -24.635 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -5.921 36.319 -23.983 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -5.578 35.805 -26.931 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -7.182 36.096 -26.287 1.00 0.00 H new ATOM 810 N GLN A 55 -4.232 33.612 -22.940 1.00 0.00 N ATOM 811 CA GLN A 55 -3.932 33.109 -21.605 1.00 0.00 C ATOM 812 C GLN A 55 -2.504 33.457 -21.200 1.00 0.00 C ATOM 813 O GLN A 55 -1.545 32.881 -21.713 1.00 0.00 O ATOM 814 CB GLN A 55 -4.135 31.593 -21.551 1.00 0.00 C ATOM 815 CG GLN A 55 -4.553 31.084 -20.181 1.00 0.00 C ATOM 816 CD GLN A 55 -5.377 29.813 -20.258 1.00 0.00 C ATOM 817 OE1 GLN A 55 -6.575 29.852 -20.540 1.00 0.00 O ATOM 818 NE2 GLN A 55 -4.738 28.677 -20.006 1.00 0.00 N ATOM 0 H GLN A 55 -4.745 32.959 -23.532 1.00 0.00 H new ATOM 0 HA GLN A 55 -4.616 33.586 -20.902 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -4.893 31.310 -22.281 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -3.209 31.100 -21.846 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -3.663 30.900 -19.579 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -5.129 31.856 -19.671 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -3.744 28.691 -19.776 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -5.241 27.790 -20.042 1.00 0.00 H new ATOM 827 N ASN A 56 -2.370 34.404 -20.277 1.00 0.00 N ATOM 828 CA ASN A 56 -1.057 34.829 -19.804 1.00 0.00 C ATOM 829 C ASN A 56 -0.250 33.639 -19.296 1.00 0.00 C ATOM 830 O ASN A 56 0.654 33.154 -19.975 1.00 0.00 O ATOM 831 CB ASN A 56 -1.206 35.871 -18.693 1.00 0.00 C ATOM 832 CG ASN A 56 0.130 36.285 -18.106 1.00 0.00 C ATOM 833 OD1 ASN A 56 0.814 37.154 -18.646 1.00 0.00 O ATOM 834 ND2 ASN A 56 0.506 35.663 -16.995 1.00 0.00 N ATOM 0 H ASN A 56 -3.153 34.891 -19.842 1.00 0.00 H new ATOM 0 HA ASN A 56 -0.523 35.275 -20.643 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -1.714 36.750 -19.089 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -1.838 35.467 -17.902 1.00 0.00 H new ATOM 0 HD21 ASN A 56 1.395 35.900 -16.554 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -0.094 34.949 -16.582 1.00 0.00 H new ATOM 841 N ASN A 57 -0.583 33.173 -18.097 1.00 0.00 N ATOM 842 CA ASN A 57 0.111 32.039 -17.497 1.00 0.00 C ATOM 843 C ASN A 57 -0.438 30.720 -18.033 1.00 0.00 C ATOM 844 O ASN A 57 -1.469 30.231 -17.570 1.00 0.00 O ATOM 845 CB ASN A 57 -0.024 32.079 -15.974 1.00 0.00 C ATOM 846 CG ASN A 57 -1.457 31.888 -15.515 1.00 0.00 C ATOM 847 OD1 ASN A 57 -2.343 32.666 -15.869 1.00 0.00 O ATOM 848 ND2 ASN A 57 -1.690 30.849 -14.721 1.00 0.00 N ATOM 0 H ASN A 57 -1.329 33.563 -17.521 1.00 0.00 H new ATOM 0 HA ASN A 57 1.166 32.108 -17.763 1.00 0.00 H new ATOM 0 HB2 ASN A 57 0.602 31.301 -15.536 1.00 0.00 H new ATOM 0 HB3 ASN A 57 0.349 33.034 -15.604 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -2.634 30.670 -14.379 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -0.925 30.230 -14.453 1.00 0.00 H new ATOM 855 N HIS A 58 0.258 30.149 -19.011 1.00 0.00 N ATOM 856 CA HIS A 58 -0.159 28.886 -19.609 1.00 0.00 C ATOM 857 C HIS A 58 0.619 27.718 -19.010 1.00 0.00 C ATOM 858 O HIS A 58 1.816 27.565 -19.255 1.00 0.00 O ATOM 859 CB HIS A 58 0.042 28.924 -21.124 1.00 0.00 C ATOM 860 CG HIS A 58 1.208 29.761 -21.553 1.00 0.00 C ATOM 861 ND1 HIS A 58 1.146 30.660 -22.596 1.00 0.00 N ATOM 862 CD2 HIS A 58 2.471 29.832 -21.071 1.00 0.00 C ATOM 863 CE1 HIS A 58 2.321 31.247 -22.739 1.00 0.00 C ATOM 864 NE2 HIS A 58 3.143 30.763 -21.825 1.00 0.00 N ATOM 0 H HIS A 58 1.113 30.541 -19.406 1.00 0.00 H new ATOM 0 HA HIS A 58 -1.218 28.743 -19.394 1.00 0.00 H new ATOM 0 HB2 HIS A 58 0.182 27.907 -21.489 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -0.863 29.309 -21.593 1.00 0.00 H new ATOM 0 HD2 HIS A 58 2.875 29.263 -20.247 1.00 0.00 H new ATOM 0 HE1 HIS A 58 2.568 31.995 -23.478 1.00 0.00 H new ATOM 0 HE2 HIS A 58 4.118 31.036 -21.700 1.00 0.00 H new ATOM 872 N VAL A 59 -0.069 26.897 -18.223 1.00 0.00 N ATOM 873 CA VAL A 59 0.557 25.743 -17.589 1.00 0.00 C ATOM 874 C VAL A 59 -0.336 24.511 -17.684 1.00 0.00 C ATOM 875 O VAL A 59 -1.540 24.584 -17.436 1.00 0.00 O ATOM 876 CB VAL A 59 0.875 26.020 -16.108 1.00 0.00 C ATOM 877 CG1 VAL A 59 1.928 25.048 -15.596 1.00 0.00 C ATOM 878 CG2 VAL A 59 1.331 27.459 -15.921 1.00 0.00 C ATOM 0 H VAL A 59 -1.060 27.010 -18.009 1.00 0.00 H new ATOM 0 HA VAL A 59 1.488 25.555 -18.124 1.00 0.00 H new ATOM 0 HB VAL A 59 -0.035 25.872 -15.526 1.00 0.00 H new ATOM 0 HG11 VAL A 59 2.139 25.260 -14.548 1.00 0.00 H new ATOM 0 HG12 VAL A 59 1.559 24.027 -15.693 1.00 0.00 H new ATOM 0 HG13 VAL A 59 2.841 25.160 -16.180 1.00 0.00 H new ATOM 0 HG21 VAL A 59 1.551 27.637 -14.868 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.228 27.637 -16.515 1.00 0.00 H new ATOM 0 HG23 VAL A 59 0.541 28.136 -16.246 1.00 0.00 H new ATOM 888 N CYS A 60 0.261 23.380 -18.044 1.00 0.00 N ATOM 889 CA CYS A 60 -0.480 22.131 -18.172 1.00 0.00 C ATOM 890 C CYS A 60 -0.243 21.232 -16.963 1.00 0.00 C ATOM 891 O CYS A 60 0.869 20.750 -16.742 1.00 0.00 O ATOM 892 CB CYS A 60 -0.071 21.401 -19.453 1.00 0.00 C ATOM 893 SG CYS A 60 0.063 19.593 -19.267 1.00 0.00 S ATOM 0 H CYS A 60 1.256 23.303 -18.252 1.00 0.00 H new ATOM 0 HA CYS A 60 -1.542 22.370 -18.221 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -0.799 21.622 -20.233 1.00 0.00 H new ATOM 0 HB3 CYS A 60 0.888 21.793 -19.792 1.00 0.00 H new ATOM 0 HG CYS A 60 1.228 19.198 -19.689 1.00 0.00 H new ATOM 898 N TYR A 61 -1.295 21.009 -16.183 1.00 0.00 N ATOM 899 CA TYR A 61 -1.202 20.169 -14.995 1.00 0.00 C ATOM 900 C TYR A 61 -1.721 18.763 -15.279 1.00 0.00 C ATOM 901 O TYR A 61 -2.926 18.513 -15.229 1.00 0.00 O ATOM 902 CB TYR A 61 -1.989 20.793 -13.841 1.00 0.00 C ATOM 903 CG TYR A 61 -1.605 22.226 -13.551 1.00 0.00 C ATOM 904 CD1 TYR A 61 -0.558 22.525 -12.688 1.00 0.00 C ATOM 905 CD2 TYR A 61 -2.291 23.282 -14.139 1.00 0.00 C ATOM 906 CE1 TYR A 61 -0.205 23.833 -12.420 1.00 0.00 C ATOM 907 CE2 TYR A 61 -1.944 24.593 -13.878 1.00 0.00 C ATOM 908 CZ TYR A 61 -0.900 24.864 -13.018 1.00 0.00 C ATOM 909 OH TYR A 61 -0.552 26.169 -12.754 1.00 0.00 O ATOM 0 H TYR A 61 -2.222 21.399 -16.352 1.00 0.00 H new ATOM 0 HA TYR A 61 -0.152 20.098 -14.713 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -3.053 20.751 -14.073 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -1.835 20.196 -12.942 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -0.011 21.721 -12.219 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -3.110 23.074 -14.812 1.00 0.00 H new ATOM 0 HE1 TYR A 61 0.611 24.048 -11.746 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -2.487 25.402 -14.345 1.00 0.00 H new ATOM 0 HH TYR A 61 -1.139 26.772 -13.256 1.00 0.00 H new ATOM 919 N TRP A 62 -0.805 17.850 -15.576 1.00 0.00 N ATOM 920 CA TRP A 62 -1.169 16.468 -15.868 1.00 0.00 C ATOM 921 C TRP A 62 -1.158 15.623 -14.599 1.00 0.00 C ATOM 922 O TRP A 62 -0.336 15.836 -13.708 1.00 0.00 O ATOM 923 CB TRP A 62 -0.210 15.873 -16.900 1.00 0.00 C ATOM 924 CG TRP A 62 -0.869 14.902 -17.832 1.00 0.00 C ATOM 925 CD1 TRP A 62 -0.743 13.542 -17.823 1.00 0.00 C ATOM 926 CD2 TRP A 62 -1.756 15.216 -18.912 1.00 0.00 C ATOM 927 NE1 TRP A 62 -1.497 12.992 -18.831 1.00 0.00 N ATOM 928 CE2 TRP A 62 -2.129 13.998 -19.513 1.00 0.00 C ATOM 929 CE3 TRP A 62 -2.273 16.408 -19.427 1.00 0.00 C ATOM 930 CZ2 TRP A 62 -2.993 13.941 -20.603 1.00 0.00 C ATOM 931 CZ3 TRP A 62 -3.130 16.349 -20.510 1.00 0.00 C ATOM 932 CH2 TRP A 62 -3.484 15.123 -21.088 1.00 0.00 C ATOM 0 H TRP A 62 0.196 18.041 -15.621 1.00 0.00 H new ATOM 0 HA TRP A 62 -2.179 16.463 -16.277 1.00 0.00 H new ATOM 0 HB2 TRP A 62 0.233 16.681 -17.482 1.00 0.00 H new ATOM 0 HB3 TRP A 62 0.606 15.370 -16.380 1.00 0.00 H new ATOM 0 HD1 TRP A 62 -0.139 12.981 -17.125 1.00 0.00 H new ATOM 0 HE1 TRP A 62 -1.574 11.996 -19.038 1.00 0.00 H new ATOM 0 HE3 TRP A 62 -2.008 17.358 -18.987 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 -3.266 12.997 -21.050 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 -3.534 17.264 -20.918 1.00 0.00 H new ATOM 0 HH2 TRP A 62 -4.157 15.110 -21.932 1.00 0.00 H new ATOM 943 N GLU A 63 -2.074 14.663 -14.524 1.00 0.00 N ATOM 944 CA GLU A 63 -2.168 13.786 -13.362 1.00 0.00 C ATOM 945 C GLU A 63 -0.787 13.296 -12.938 1.00 0.00 C ATOM 946 O GLU A 63 -0.567 12.961 -11.774 1.00 0.00 O ATOM 947 CB GLU A 63 -3.073 12.591 -13.669 1.00 0.00 C ATOM 948 CG GLU A 63 -3.106 11.552 -12.561 1.00 0.00 C ATOM 949 CD GLU A 63 -4.162 10.488 -12.791 1.00 0.00 C ATOM 950 OE1 GLU A 63 -5.363 10.830 -12.768 1.00 0.00 O ATOM 951 OE2 GLU A 63 -3.787 9.314 -12.992 1.00 0.00 O ATOM 0 H GLU A 63 -2.761 14.472 -15.253 1.00 0.00 H new ATOM 0 HA GLU A 63 -2.600 14.358 -12.541 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -4.086 12.950 -13.849 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.734 12.117 -14.590 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.128 11.077 -12.484 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -3.296 12.047 -11.609 1.00 0.00 H new ATOM 958 N GLU A 64 0.139 13.257 -13.890 1.00 0.00 N ATOM 959 CA GLU A 64 1.499 12.807 -13.615 1.00 0.00 C ATOM 960 C GLU A 64 2.495 13.473 -14.560 1.00 0.00 C ATOM 961 O GLU A 64 3.517 12.886 -14.917 1.00 0.00 O ATOM 962 CB GLU A 64 1.592 11.285 -13.748 1.00 0.00 C ATOM 963 CG GLU A 64 0.282 10.568 -13.469 1.00 0.00 C ATOM 964 CD GLU A 64 -0.724 10.734 -14.592 1.00 0.00 C ATOM 965 OE1 GLU A 64 -0.454 11.525 -15.519 1.00 0.00 O ATOM 966 OE2 GLU A 64 -1.782 10.071 -14.542 1.00 0.00 O ATOM 0 H GLU A 64 -0.027 13.531 -14.858 1.00 0.00 H new ATOM 0 HA GLU A 64 1.749 13.092 -12.593 1.00 0.00 H new ATOM 0 HB2 GLU A 64 1.925 11.037 -14.756 1.00 0.00 H new ATOM 0 HB3 GLU A 64 2.353 10.915 -13.061 1.00 0.00 H new ATOM 0 HG2 GLU A 64 0.478 9.507 -13.316 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -0.147 10.950 -12.543 1.00 0.00 H new ATOM 973 N CYS A 65 2.189 14.702 -14.961 1.00 0.00 N ATOM 974 CA CYS A 65 3.055 15.449 -15.865 1.00 0.00 C ATOM 975 C CYS A 65 4.517 15.320 -15.448 1.00 0.00 C ATOM 976 O CYS A 65 4.868 15.451 -14.275 1.00 0.00 O ATOM 977 CB CYS A 65 2.649 16.924 -15.891 1.00 0.00 C ATOM 978 SG CYS A 65 3.134 17.802 -17.411 1.00 0.00 S ATOM 0 H CYS A 65 1.347 15.202 -14.674 1.00 0.00 H new ATOM 0 HA CYS A 65 2.942 15.030 -16.865 1.00 0.00 H new ATOM 0 HB2 CYS A 65 1.568 16.994 -15.773 1.00 0.00 H new ATOM 0 HB3 CYS A 65 3.097 17.428 -15.034 1.00 0.00 H new ATOM 0 HG CYS A 65 2.320 17.484 -18.374 1.00 0.00 H new ATOM 983 N PRO A 66 5.392 15.059 -16.431 1.00 0.00 N ATOM 984 CA PRO A 66 6.830 14.907 -16.191 1.00 0.00 C ATOM 985 C PRO A 66 7.497 16.226 -15.816 1.00 0.00 C ATOM 986 O PRO A 66 8.586 16.240 -15.242 1.00 0.00 O ATOM 987 CB PRO A 66 7.362 14.402 -17.535 1.00 0.00 C ATOM 988 CG PRO A 66 6.380 14.895 -18.541 1.00 0.00 C ATOM 989 CD PRO A 66 5.044 14.891 -17.852 1.00 0.00 C ATOM 0 HA PRO A 66 7.036 14.237 -15.356 1.00 0.00 H new ATOM 0 HB2 PRO A 66 8.361 14.788 -17.735 1.00 0.00 H new ATOM 0 HB3 PRO A 66 7.432 13.314 -17.550 1.00 0.00 H new ATOM 0 HG2 PRO A 66 6.640 15.897 -18.882 1.00 0.00 H new ATOM 0 HG3 PRO A 66 6.367 14.252 -19.421 1.00 0.00 H new ATOM 0 HD2 PRO A 66 4.406 15.700 -18.208 1.00 0.00 H new ATOM 0 HD3 PRO A 66 4.505 13.960 -18.026 1.00 0.00 H new ATOM 997 N ARG A 67 6.837 17.332 -16.143 1.00 0.00 N ATOM 998 CA ARG A 67 7.367 18.656 -15.841 1.00 0.00 C ATOM 999 C ARG A 67 6.930 19.112 -14.451 1.00 0.00 C ATOM 1000 O ARG A 67 7.294 20.198 -14.002 1.00 0.00 O ATOM 1001 CB ARG A 67 6.902 19.667 -16.890 1.00 0.00 C ATOM 1002 CG ARG A 67 7.233 19.260 -18.317 1.00 0.00 C ATOM 1003 CD ARG A 67 8.601 19.774 -18.740 1.00 0.00 C ATOM 1004 NE ARG A 67 9.676 18.880 -18.318 1.00 0.00 N ATOM 1005 CZ ARG A 67 9.863 17.666 -18.823 1.00 0.00 C ATOM 1006 NH1 ARG A 67 9.051 17.203 -19.763 1.00 0.00 N ATOM 1007 NH2 ARG A 67 10.864 16.912 -18.387 1.00 0.00 N ATOM 0 H ARG A 67 5.934 17.337 -16.617 1.00 0.00 H new ATOM 0 HA ARG A 67 8.455 18.597 -15.861 1.00 0.00 H new ATOM 0 HB2 ARG A 67 5.824 19.801 -16.800 1.00 0.00 H new ATOM 0 HB3 ARG A 67 7.362 20.633 -16.681 1.00 0.00 H new ATOM 0 HG2 ARG A 67 7.209 18.174 -18.401 1.00 0.00 H new ATOM 0 HG3 ARG A 67 6.472 19.649 -18.993 1.00 0.00 H new ATOM 0 HD2 ARG A 67 8.627 19.886 -19.824 1.00 0.00 H new ATOM 0 HD3 ARG A 67 8.764 20.764 -18.314 1.00 0.00 H new ATOM 0 HE ARG A 67 10.318 19.206 -17.596 1.00 0.00 H new ATOM 0 HH11 ARG A 67 8.280 17.780 -20.100 1.00 0.00 H new ATOM 0 HH12 ARG A 67 9.197 16.270 -20.149 1.00 0.00 H new ATOM 0 HH21 ARG A 67 11.491 17.265 -17.663 1.00 0.00 H new ATOM 0 HH22 ARG A 67 11.007 15.980 -18.775 1.00 0.00 H new ATOM 1021 N GLU A 68 6.148 18.274 -13.778 1.00 0.00 N ATOM 1022 CA GLU A 68 5.661 18.593 -12.441 1.00 0.00 C ATOM 1023 C GLU A 68 5.054 19.992 -12.402 1.00 0.00 C ATOM 1024 O GLU A 68 5.108 20.677 -11.381 1.00 0.00 O ATOM 1025 CB GLU A 68 6.799 18.490 -11.422 1.00 0.00 C ATOM 1026 CG GLU A 68 7.533 17.161 -11.462 1.00 0.00 C ATOM 1027 CD GLU A 68 8.164 16.803 -10.130 1.00 0.00 C ATOM 1028 OE1 GLU A 68 7.426 16.364 -9.223 1.00 0.00 O ATOM 1029 OE2 GLU A 68 9.395 16.961 -9.995 1.00 0.00 O ATOM 0 H GLU A 68 5.838 17.370 -14.136 1.00 0.00 H new ATOM 0 HA GLU A 68 4.885 17.872 -12.183 1.00 0.00 H new ATOM 0 HB2 GLU A 68 7.512 19.295 -11.603 1.00 0.00 H new ATOM 0 HB3 GLU A 68 6.394 18.642 -10.421 1.00 0.00 H new ATOM 0 HG2 GLU A 68 6.837 16.374 -11.753 1.00 0.00 H new ATOM 0 HG3 GLU A 68 8.308 17.201 -12.228 1.00 0.00 H new ATOM 1036 N GLY A 69 4.475 20.411 -13.523 1.00 0.00 N ATOM 1037 CA GLY A 69 3.866 21.727 -13.598 1.00 0.00 C ATOM 1038 C GLY A 69 4.892 22.842 -13.574 1.00 0.00 C ATOM 1039 O GLY A 69 4.914 23.657 -12.651 1.00 0.00 O ATOM 0 H GLY A 69 4.417 19.863 -14.381 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.276 21.800 -14.512 1.00 0.00 H new ATOM 0 HA3 GLY A 69 3.177 21.853 -12.763 1.00 0.00 H new ATOM 1043 N LYS A 70 5.746 22.881 -14.592 1.00 0.00 N ATOM 1044 CA LYS A 70 6.780 23.904 -14.685 1.00 0.00 C ATOM 1045 C LYS A 70 6.516 24.838 -15.862 1.00 0.00 C ATOM 1046 O LYS A 70 6.938 24.569 -16.987 1.00 0.00 O ATOM 1047 CB LYS A 70 8.157 23.254 -14.835 1.00 0.00 C ATOM 1048 CG LYS A 70 8.857 22.999 -13.511 1.00 0.00 C ATOM 1049 CD LYS A 70 9.736 24.171 -13.110 1.00 0.00 C ATOM 1050 CE LYS A 70 8.939 25.243 -12.383 1.00 0.00 C ATOM 1051 NZ LYS A 70 8.136 24.674 -11.265 1.00 0.00 N ATOM 0 H LYS A 70 5.742 22.215 -15.365 1.00 0.00 H new ATOM 0 HA LYS A 70 6.760 24.490 -13.766 1.00 0.00 H new ATOM 0 HB2 LYS A 70 8.047 22.309 -15.366 1.00 0.00 H new ATOM 0 HB3 LYS A 70 8.787 23.895 -15.452 1.00 0.00 H new ATOM 0 HG2 LYS A 70 8.114 22.818 -12.734 1.00 0.00 H new ATOM 0 HG3 LYS A 70 9.464 22.097 -13.587 1.00 0.00 H new ATOM 0 HD2 LYS A 70 10.543 23.819 -12.468 1.00 0.00 H new ATOM 0 HD3 LYS A 70 10.199 24.600 -13.998 1.00 0.00 H new ATOM 0 HE2 LYS A 70 9.620 26.000 -11.993 1.00 0.00 H new ATOM 0 HE3 LYS A 70 8.276 25.744 -13.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 8.086 25.363 -10.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 7.175 24.461 -11.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 8.585 23.800 -10.924 1.00 0.00 H new ATOM 1065 N SER A 71 5.817 25.937 -15.595 1.00 0.00 N ATOM 1066 CA SER A 71 5.495 26.910 -16.632 1.00 0.00 C ATOM 1067 C SER A 71 6.650 27.053 -17.619 1.00 0.00 C ATOM 1068 O SER A 71 7.805 26.790 -17.284 1.00 0.00 O ATOM 1069 CB SER A 71 5.174 28.268 -16.006 1.00 0.00 C ATOM 1070 OG SER A 71 5.339 29.315 -16.946 1.00 0.00 O ATOM 0 H SER A 71 5.463 26.176 -14.669 1.00 0.00 H new ATOM 0 HA SER A 71 4.619 26.551 -17.172 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.149 28.267 -15.634 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.824 28.439 -15.148 1.00 0.00 H new ATOM 0 HG SER A 71 5.126 30.172 -16.522 1.00 0.00 H new ATOM 1076 N PHE A 72 6.329 27.472 -18.839 1.00 0.00 N ATOM 1077 CA PHE A 72 7.338 27.651 -19.876 1.00 0.00 C ATOM 1078 C PHE A 72 7.671 29.128 -20.063 1.00 0.00 C ATOM 1079 O PHE A 72 7.202 29.982 -19.311 1.00 0.00 O ATOM 1080 CB PHE A 72 6.851 27.054 -21.199 1.00 0.00 C ATOM 1081 CG PHE A 72 6.691 25.561 -21.160 1.00 0.00 C ATOM 1082 CD1 PHE A 72 5.583 24.985 -20.560 1.00 0.00 C ATOM 1083 CD2 PHE A 72 7.649 24.734 -21.724 1.00 0.00 C ATOM 1084 CE1 PHE A 72 5.433 23.612 -20.523 1.00 0.00 C ATOM 1085 CE2 PHE A 72 7.504 23.360 -21.691 1.00 0.00 C ATOM 1086 CZ PHE A 72 6.395 22.798 -21.089 1.00 0.00 C ATOM 0 H PHE A 72 5.378 27.694 -19.133 1.00 0.00 H new ATOM 0 HA PHE A 72 8.243 27.131 -19.561 1.00 0.00 H new ATOM 0 HB2 PHE A 72 5.895 27.507 -21.463 1.00 0.00 H new ATOM 0 HB3 PHE A 72 7.556 27.315 -21.988 1.00 0.00 H new ATOM 0 HD1 PHE A 72 4.828 25.617 -20.116 1.00 0.00 H new ATOM 0 HD2 PHE A 72 8.519 25.168 -22.195 1.00 0.00 H new ATOM 0 HE1 PHE A 72 4.565 23.176 -20.052 1.00 0.00 H new ATOM 0 HE2 PHE A 72 8.257 22.726 -22.135 1.00 0.00 H new ATOM 0 HZ PHE A 72 6.280 21.724 -21.061 1.00 0.00 H new ATOM 1096 N LYS A 73 8.484 29.422 -21.072 1.00 0.00 N ATOM 1097 CA LYS A 73 8.881 30.795 -21.361 1.00 0.00 C ATOM 1098 C LYS A 73 8.381 31.228 -22.735 1.00 0.00 C ATOM 1099 O LYS A 73 8.833 32.234 -23.282 1.00 0.00 O ATOM 1100 CB LYS A 73 10.404 30.932 -21.294 1.00 0.00 C ATOM 1101 CG LYS A 73 11.145 29.640 -21.589 1.00 0.00 C ATOM 1102 CD LYS A 73 11.156 29.331 -23.076 1.00 0.00 C ATOM 1103 CE LYS A 73 12.383 29.918 -23.758 1.00 0.00 C ATOM 1104 NZ LYS A 73 12.728 29.183 -25.007 1.00 0.00 N ATOM 0 H LYS A 73 8.881 28.727 -21.704 1.00 0.00 H new ATOM 0 HA LYS A 73 8.431 31.443 -20.609 1.00 0.00 H new ATOM 0 HB2 LYS A 73 10.723 31.694 -22.005 1.00 0.00 H new ATOM 0 HB3 LYS A 73 10.685 31.284 -20.301 1.00 0.00 H new ATOM 0 HG2 LYS A 73 12.169 29.716 -21.225 1.00 0.00 H new ATOM 0 HG3 LYS A 73 10.675 28.818 -21.049 1.00 0.00 H new ATOM 0 HD2 LYS A 73 11.137 28.251 -23.225 1.00 0.00 H new ATOM 0 HD3 LYS A 73 10.254 29.732 -23.539 1.00 0.00 H new ATOM 0 HE2 LYS A 73 12.201 30.967 -23.992 1.00 0.00 H new ATOM 0 HE3 LYS A 73 13.230 29.886 -23.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 13.569 29.613 -25.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 12.926 28.187 -24.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 11.930 29.235 -25.672 1.00 0.00 H new ATOM 1118 N ALA A 74 7.445 30.463 -23.288 1.00 0.00 N ATOM 1119 CA ALA A 74 6.881 30.770 -24.596 1.00 0.00 C ATOM 1120 C ALA A 74 5.567 30.029 -24.816 1.00 0.00 C ATOM 1121 O ALA A 74 5.122 29.265 -23.959 1.00 0.00 O ATOM 1122 CB ALA A 74 7.876 30.423 -25.694 1.00 0.00 C ATOM 0 H ALA A 74 7.061 29.626 -22.850 1.00 0.00 H new ATOM 0 HA ALA A 74 6.674 31.840 -24.633 1.00 0.00 H new ATOM 0 HB1 ALA A 74 7.442 30.657 -26.666 1.00 0.00 H new ATOM 0 HB2 ALA A 74 8.788 31.003 -25.555 1.00 0.00 H new ATOM 0 HB3 ALA A 74 8.112 29.360 -25.649 1.00 0.00 H new ATOM 1128 N LYS A 75 4.949 30.258 -25.970 1.00 0.00 N ATOM 1129 CA LYS A 75 3.686 29.612 -26.304 1.00 0.00 C ATOM 1130 C LYS A 75 3.926 28.274 -26.997 1.00 0.00 C ATOM 1131 O LYS A 75 3.325 27.261 -26.638 1.00 0.00 O ATOM 1132 CB LYS A 75 2.846 30.521 -27.203 1.00 0.00 C ATOM 1133 CG LYS A 75 1.378 30.136 -27.256 1.00 0.00 C ATOM 1134 CD LYS A 75 0.824 29.855 -25.869 1.00 0.00 C ATOM 1135 CE LYS A 75 -0.667 30.146 -25.794 1.00 0.00 C ATOM 1136 NZ LYS A 75 -1.311 29.450 -24.646 1.00 0.00 N ATOM 0 H LYS A 75 5.303 30.887 -26.690 1.00 0.00 H new ATOM 0 HA LYS A 75 3.144 29.429 -25.376 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.931 31.548 -26.848 1.00 0.00 H new ATOM 0 HB3 LYS A 75 3.256 30.498 -28.213 1.00 0.00 H new ATOM 0 HG2 LYS A 75 0.807 30.940 -27.721 1.00 0.00 H new ATOM 0 HG3 LYS A 75 1.255 29.253 -27.884 1.00 0.00 H new ATOM 0 HD2 LYS A 75 1.006 28.812 -25.608 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.352 30.464 -25.135 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -0.823 31.221 -25.701 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.145 29.834 -26.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -2.264 29.838 -24.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -1.380 28.433 -24.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -0.739 29.592 -23.789 1.00 0.00 H new ATOM 1150 N TYR A 76 4.807 28.278 -27.991 1.00 0.00 N ATOM 1151 CA TYR A 76 5.125 27.066 -28.735 1.00 0.00 C ATOM 1152 C TYR A 76 5.823 26.045 -27.842 1.00 0.00 C ATOM 1153 O TYR A 76 5.867 24.855 -28.154 1.00 0.00 O ATOM 1154 CB TYR A 76 6.011 27.398 -29.938 1.00 0.00 C ATOM 1155 CG TYR A 76 7.406 27.838 -29.558 1.00 0.00 C ATOM 1156 CD1 TYR A 76 8.381 26.908 -29.216 1.00 0.00 C ATOM 1157 CD2 TYR A 76 7.751 29.184 -29.541 1.00 0.00 C ATOM 1158 CE1 TYR A 76 9.657 27.305 -28.869 1.00 0.00 C ATOM 1159 CE2 TYR A 76 9.026 29.590 -29.196 1.00 0.00 C ATOM 1160 CZ TYR A 76 9.975 28.647 -28.860 1.00 0.00 C ATOM 1161 OH TYR A 76 11.245 29.048 -28.514 1.00 0.00 O ATOM 0 H TYR A 76 5.314 29.108 -28.300 1.00 0.00 H new ATOM 0 HA TYR A 76 4.190 26.632 -29.089 1.00 0.00 H new ATOM 0 HB2 TYR A 76 6.078 26.521 -30.582 1.00 0.00 H new ATOM 0 HB3 TYR A 76 5.536 28.187 -30.522 1.00 0.00 H new ATOM 0 HD1 TYR A 76 8.136 25.856 -29.222 1.00 0.00 H new ATOM 0 HD2 TYR A 76 7.010 29.925 -29.802 1.00 0.00 H new ATOM 0 HE1 TYR A 76 10.402 26.569 -28.606 1.00 0.00 H new ATOM 0 HE2 TYR A 76 9.278 30.640 -29.189 1.00 0.00 H new ATOM 0 HH TYR A 76 11.303 30.025 -28.559 1.00 0.00 H new ATOM 1171 N LYS A 77 6.369 26.520 -26.727 1.00 0.00 N ATOM 1172 CA LYS A 77 7.064 25.652 -25.785 1.00 0.00 C ATOM 1173 C LYS A 77 6.081 24.740 -25.057 1.00 0.00 C ATOM 1174 O LYS A 77 6.358 23.560 -24.840 1.00 0.00 O ATOM 1175 CB LYS A 77 7.847 26.489 -24.770 1.00 0.00 C ATOM 1176 CG LYS A 77 8.891 27.392 -25.403 1.00 0.00 C ATOM 1177 CD LYS A 77 9.921 26.592 -26.184 1.00 0.00 C ATOM 1178 CE LYS A 77 10.713 25.666 -25.274 1.00 0.00 C ATOM 1179 NZ LYS A 77 12.058 25.357 -25.833 1.00 0.00 N ATOM 0 H LYS A 77 6.343 27.502 -26.454 1.00 0.00 H new ATOM 0 HA LYS A 77 7.760 25.030 -26.348 1.00 0.00 H new ATOM 0 HB2 LYS A 77 7.148 27.100 -24.199 1.00 0.00 H new ATOM 0 HB3 LYS A 77 8.338 25.821 -24.062 1.00 0.00 H new ATOM 0 HG2 LYS A 77 8.402 28.105 -26.068 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.391 27.971 -24.627 1.00 0.00 H new ATOM 0 HD2 LYS A 77 9.420 26.006 -26.955 1.00 0.00 H new ATOM 0 HD3 LYS A 77 10.602 27.273 -26.694 1.00 0.00 H new ATOM 0 HE2 LYS A 77 10.825 26.129 -24.293 1.00 0.00 H new ATOM 0 HE3 LYS A 77 10.159 24.739 -25.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 12.567 24.723 -25.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 11.951 24.893 -26.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 12.597 26.239 -25.949 1.00 0.00 H new ATOM 1193 N LEU A 78 4.932 25.294 -24.685 1.00 0.00 N ATOM 1194 CA LEU A 78 3.907 24.530 -23.983 1.00 0.00 C ATOM 1195 C LEU A 78 3.094 23.685 -24.959 1.00 0.00 C ATOM 1196 O LEU A 78 2.955 22.475 -24.781 1.00 0.00 O ATOM 1197 CB LEU A 78 2.980 25.472 -23.213 1.00 0.00 C ATOM 1198 CG LEU A 78 1.840 24.808 -22.439 1.00 0.00 C ATOM 1199 CD1 LEU A 78 2.282 23.460 -21.891 1.00 0.00 C ATOM 1200 CD2 LEU A 78 1.361 25.712 -21.313 1.00 0.00 C ATOM 0 H LEU A 78 4.687 26.269 -24.858 1.00 0.00 H new ATOM 0 HA LEU A 78 4.404 23.862 -23.279 1.00 0.00 H new ATOM 0 HB2 LEU A 78 3.582 26.048 -22.510 1.00 0.00 H new ATOM 0 HB3 LEU A 78 2.548 26.182 -23.919 1.00 0.00 H new ATOM 0 HG LEU A 78 1.008 24.644 -23.124 1.00 0.00 H new ATOM 0 HD11 LEU A 78 1.458 23.002 -21.343 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.575 22.810 -22.716 1.00 0.00 H new ATOM 0 HD13 LEU A 78 3.130 23.600 -21.221 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.550 25.223 -20.774 1.00 0.00 H new ATOM 0 HD22 LEU A 78 2.186 25.908 -20.628 1.00 0.00 H new ATOM 0 HD23 LEU A 78 1.004 26.654 -21.730 1.00 0.00 H new ATOM 1212 N VAL A 79 2.562 24.330 -25.992 1.00 0.00 N ATOM 1213 CA VAL A 79 1.766 23.637 -26.998 1.00 0.00 C ATOM 1214 C VAL A 79 2.505 22.417 -27.538 1.00 0.00 C ATOM 1215 O VAL A 79 1.887 21.425 -27.924 1.00 0.00 O ATOM 1216 CB VAL A 79 1.410 24.569 -28.172 1.00 0.00 C ATOM 1217 CG1 VAL A 79 0.641 23.809 -29.242 1.00 0.00 C ATOM 1218 CG2 VAL A 79 0.612 25.765 -27.677 1.00 0.00 C ATOM 0 H VAL A 79 2.668 25.331 -26.154 1.00 0.00 H new ATOM 0 HA VAL A 79 0.847 23.315 -26.508 1.00 0.00 H new ATOM 0 HB VAL A 79 2.335 24.937 -28.616 1.00 0.00 H new ATOM 0 HG11 VAL A 79 0.398 24.483 -30.063 1.00 0.00 H new ATOM 0 HG12 VAL A 79 1.253 22.988 -29.615 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -0.279 23.411 -28.815 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.369 26.413 -28.519 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.309 25.419 -27.207 1.00 0.00 H new ATOM 0 HG23 VAL A 79 1.203 26.321 -26.950 1.00 0.00 H new ATOM 1228 N ASN A 80 3.831 22.498 -27.563 1.00 0.00 N ATOM 1229 CA ASN A 80 4.655 21.400 -28.056 1.00 0.00 C ATOM 1230 C ASN A 80 4.844 20.336 -26.979 1.00 0.00 C ATOM 1231 O ASN A 80 5.160 19.184 -27.279 1.00 0.00 O ATOM 1232 CB ASN A 80 6.017 21.924 -28.516 1.00 0.00 C ATOM 1233 CG ASN A 80 7.075 20.838 -28.544 1.00 0.00 C ATOM 1234 OD1 ASN A 80 6.837 19.737 -29.043 1.00 0.00 O ATOM 1235 ND2 ASN A 80 8.250 21.142 -28.007 1.00 0.00 N ATOM 0 H ASN A 80 4.358 23.312 -27.248 1.00 0.00 H new ATOM 0 HA ASN A 80 4.143 20.946 -28.904 1.00 0.00 H new ATOM 0 HB2 ASN A 80 5.919 22.358 -29.511 1.00 0.00 H new ATOM 0 HB3 ASN A 80 6.339 22.724 -27.850 1.00 0.00 H new ATOM 0 HD21 ASN A 80 9.000 20.451 -27.997 1.00 0.00 H new ATOM 0 HD22 ASN A 80 8.403 22.067 -27.605 1.00 0.00 H new ATOM 1242 N HIS A 81 4.648 20.729 -25.725 1.00 0.00 N ATOM 1243 CA HIS A 81 4.796 19.809 -24.603 1.00 0.00 C ATOM 1244 C HIS A 81 3.602 18.863 -24.516 1.00 0.00 C ATOM 1245 O HIS A 81 3.765 17.660 -24.307 1.00 0.00 O ATOM 1246 CB HIS A 81 4.943 20.586 -23.295 1.00 0.00 C ATOM 1247 CG HIS A 81 4.359 19.880 -22.110 1.00 0.00 C ATOM 1248 ND1 HIS A 81 5.027 18.891 -21.419 1.00 0.00 N ATOM 1249 CD2 HIS A 81 3.163 20.025 -21.493 1.00 0.00 C ATOM 1250 CE1 HIS A 81 4.267 18.458 -20.429 1.00 0.00 C ATOM 1251 NE2 HIS A 81 3.130 19.130 -20.452 1.00 0.00 N ATOM 0 H HIS A 81 4.386 21.679 -25.460 1.00 0.00 H new ATOM 0 HA HIS A 81 5.696 19.216 -24.767 1.00 0.00 H new ATOM 0 HB2 HIS A 81 6.001 20.774 -23.111 1.00 0.00 H new ATOM 0 HB3 HIS A 81 4.461 21.557 -23.403 1.00 0.00 H new ATOM 0 HD1 HIS A 81 5.962 18.547 -21.638 1.00 0.00 H new ATOM 0 HD2 HIS A 81 2.380 20.716 -21.768 1.00 0.00 H new ATOM 0 HE1 HIS A 81 4.530 17.686 -19.721 1.00 0.00 H new ATOM 1259 N ILE A 82 2.403 19.414 -24.675 1.00 0.00 N ATOM 1260 CA ILE A 82 1.183 18.619 -24.614 1.00 0.00 C ATOM 1261 C ILE A 82 1.255 17.428 -25.562 1.00 0.00 C ATOM 1262 O ILE A 82 0.584 16.417 -25.357 1.00 0.00 O ATOM 1263 CB ILE A 82 -0.057 19.464 -24.962 1.00 0.00 C ATOM 1264 CG1 ILE A 82 0.038 20.844 -24.307 1.00 0.00 C ATOM 1265 CG2 ILE A 82 -1.326 18.749 -24.521 1.00 0.00 C ATOM 1266 CD1 ILE A 82 -1.296 21.543 -24.174 1.00 0.00 C ATOM 0 H ILE A 82 2.251 20.408 -24.847 1.00 0.00 H new ATOM 0 HA ILE A 82 1.092 18.259 -23.589 1.00 0.00 H new ATOM 0 HB ILE A 82 -0.095 19.598 -26.043 1.00 0.00 H new ATOM 0 HG12 ILE A 82 0.483 20.738 -23.318 1.00 0.00 H new ATOM 0 HG13 ILE A 82 0.710 21.470 -24.894 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -2.194 19.359 -24.774 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -1.397 17.788 -25.030 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -1.297 18.588 -23.443 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -1.152 22.515 -23.702 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -1.734 21.681 -25.162 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -1.965 20.938 -23.562 1.00 0.00 H new ATOM 1278 N ARG A 83 2.076 17.553 -26.600 1.00 0.00 N ATOM 1279 CA ARG A 83 2.237 16.486 -27.580 1.00 0.00 C ATOM 1280 C ARG A 83 2.731 15.206 -26.914 1.00 0.00 C ATOM 1281 O ARG A 83 2.651 14.122 -27.492 1.00 0.00 O ATOM 1282 CB ARG A 83 3.216 16.914 -28.675 1.00 0.00 C ATOM 1283 CG ARG A 83 3.002 18.338 -29.162 1.00 0.00 C ATOM 1284 CD ARG A 83 1.557 18.575 -29.572 1.00 0.00 C ATOM 1285 NE ARG A 83 1.372 19.883 -30.195 1.00 0.00 N ATOM 1286 CZ ARG A 83 0.361 20.175 -31.005 1.00 0.00 C ATOM 1287 NH1 ARG A 83 -0.553 19.257 -31.288 1.00 0.00 N ATOM 1288 NH2 ARG A 83 0.261 21.388 -31.534 1.00 0.00 N ATOM 0 H ARG A 83 2.640 18.383 -26.784 1.00 0.00 H new ATOM 0 HA ARG A 83 1.263 16.289 -28.029 1.00 0.00 H new ATOM 0 HB2 ARG A 83 4.234 16.817 -28.298 1.00 0.00 H new ATOM 0 HB3 ARG A 83 3.123 16.232 -29.520 1.00 0.00 H new ATOM 0 HG2 ARG A 83 3.277 19.039 -28.374 1.00 0.00 H new ATOM 0 HG3 ARG A 83 3.659 18.537 -30.009 1.00 0.00 H new ATOM 0 HD2 ARG A 83 1.245 17.795 -30.267 1.00 0.00 H new ATOM 0 HD3 ARG A 83 0.914 18.497 -28.695 1.00 0.00 H new ATOM 0 HE ARG A 83 2.057 20.612 -29.997 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -0.481 18.324 -30.883 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -1.328 19.484 -31.910 1.00 0.00 H new ATOM 0 HH21 ARG A 83 0.961 22.098 -31.319 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -0.516 21.611 -32.156 1.00 0.00 H new ATOM 1302 N VAL A 84 3.241 15.338 -25.694 1.00 0.00 N ATOM 1303 CA VAL A 84 3.748 14.192 -24.948 1.00 0.00 C ATOM 1304 C VAL A 84 2.635 13.521 -24.151 1.00 0.00 C ATOM 1305 O VAL A 84 2.816 12.430 -23.609 1.00 0.00 O ATOM 1306 CB VAL A 84 4.878 14.604 -23.986 1.00 0.00 C ATOM 1307 CG1 VAL A 84 5.905 15.464 -24.705 1.00 0.00 C ATOM 1308 CG2 VAL A 84 4.309 15.335 -22.779 1.00 0.00 C ATOM 0 H VAL A 84 3.314 16.228 -25.201 1.00 0.00 H new ATOM 0 HA VAL A 84 4.144 13.487 -25.679 1.00 0.00 H new ATOM 0 HB VAL A 84 5.379 13.702 -23.634 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.695 15.745 -24.009 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.335 14.901 -25.534 1.00 0.00 H new ATOM 0 HG13 VAL A 84 5.422 16.363 -25.088 1.00 0.00 H new ATOM 0 HG21 VAL A 84 5.121 15.619 -22.110 1.00 0.00 H new ATOM 0 HG22 VAL A 84 3.782 16.230 -23.111 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.615 14.681 -22.251 1.00 0.00 H new ATOM 1318 N HIS A 85 1.483 14.180 -24.082 1.00 0.00 N ATOM 1319 CA HIS A 85 0.339 13.646 -23.351 1.00 0.00 C ATOM 1320 C HIS A 85 -0.638 12.957 -24.299 1.00 0.00 C ATOM 1321 O HIS A 85 -1.632 12.372 -23.867 1.00 0.00 O ATOM 1322 CB HIS A 85 -0.374 14.764 -22.590 1.00 0.00 C ATOM 1323 CG HIS A 85 0.454 15.366 -21.496 1.00 0.00 C ATOM 1324 ND1 HIS A 85 1.324 14.630 -20.719 1.00 0.00 N ATOM 1325 CD2 HIS A 85 0.541 16.641 -21.051 1.00 0.00 C ATOM 1326 CE1 HIS A 85 1.910 15.427 -19.843 1.00 0.00 C ATOM 1327 NE2 HIS A 85 1.453 16.653 -20.024 1.00 0.00 N ATOM 0 H HIS A 85 1.317 15.084 -24.523 1.00 0.00 H new ATOM 0 HA HIS A 85 0.707 12.909 -22.638 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -0.658 15.547 -23.293 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -1.296 14.371 -22.162 1.00 0.00 H new ATOM 0 HD1 HIS A 85 1.489 13.627 -20.807 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -0.005 17.491 -21.432 1.00 0.00 H new ATOM 0 HE1 HIS A 85 2.639 15.127 -19.105 1.00 0.00 H new ATOM 1335 N THR A 86 -0.349 13.030 -25.595 1.00 0.00 N ATOM 1336 CA THR A 86 -1.203 12.416 -26.604 1.00 0.00 C ATOM 1337 C THR A 86 -0.827 10.955 -26.826 1.00 0.00 C ATOM 1338 O THR A 86 -1.528 10.049 -26.378 1.00 0.00 O ATOM 1339 CB THR A 86 -1.115 13.167 -27.946 1.00 0.00 C ATOM 1340 OG1 THR A 86 0.228 13.606 -28.176 1.00 0.00 O ATOM 1341 CG2 THR A 86 -2.054 14.363 -27.960 1.00 0.00 C ATOM 0 H THR A 86 0.470 13.508 -25.970 1.00 0.00 H new ATOM 0 HA THR A 86 -2.226 12.473 -26.231 1.00 0.00 H new ATOM 0 HB THR A 86 -1.413 12.482 -28.740 1.00 0.00 H new ATOM 0 HG1 THR A 86 0.275 14.081 -29.032 1.00 0.00 H new ATOM 0 HG21 THR A 86 -1.974 14.877 -28.918 1.00 0.00 H new ATOM 0 HG22 THR A 86 -3.079 14.022 -27.816 1.00 0.00 H new ATOM 0 HG23 THR A 86 -1.783 15.048 -27.157 1.00 0.00 H new ATOM 1407 N PHE A 91 -0.432 2.759 -18.979 1.00 0.00 N ATOM 1408 CA PHE A 91 0.440 1.951 -18.135 1.00 0.00 C ATOM 1409 C PHE A 91 1.238 0.956 -18.972 1.00 0.00 C ATOM 1410 O PHE A 91 0.685 0.076 -19.632 1.00 0.00 O ATOM 1411 CB PHE A 91 -0.383 1.204 -17.083 1.00 0.00 C ATOM 1412 CG PHE A 91 -1.767 0.850 -17.545 1.00 0.00 C ATOM 1413 CD1 PHE A 91 -1.974 -0.224 -18.395 1.00 0.00 C ATOM 1414 CD2 PHE A 91 -2.862 1.590 -17.129 1.00 0.00 C ATOM 1415 CE1 PHE A 91 -3.247 -0.552 -18.823 1.00 0.00 C ATOM 1416 CE2 PHE A 91 -4.137 1.267 -17.553 1.00 0.00 C ATOM 1417 CZ PHE A 91 -4.330 0.193 -18.400 1.00 0.00 C ATOM 0 HA PHE A 91 1.139 2.620 -17.633 1.00 0.00 H new ATOM 0 HB2 PHE A 91 0.143 0.291 -16.803 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -0.454 1.818 -16.186 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -1.131 -0.812 -18.727 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -2.717 2.430 -16.465 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.394 -1.390 -19.488 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -4.981 1.854 -17.223 1.00 0.00 H new ATOM 0 HZ PHE A 91 -5.326 -0.063 -18.731 1.00 0.00 H new ATOM 1427 N PRO A 92 2.572 1.099 -18.947 1.00 0.00 N ATOM 1428 CA PRO A 92 3.476 0.223 -19.699 1.00 0.00 C ATOM 1429 C PRO A 92 3.518 -1.192 -19.130 1.00 0.00 C ATOM 1430 O PRO A 92 2.646 -1.586 -18.355 1.00 0.00 O ATOM 1431 CB PRO A 92 4.839 0.902 -19.543 1.00 0.00 C ATOM 1432 CG PRO A 92 4.733 1.679 -18.276 1.00 0.00 C ATOM 1433 CD PRO A 92 3.300 2.126 -18.183 1.00 0.00 C ATOM 0 HA PRO A 92 3.160 0.104 -20.735 1.00 0.00 H new ATOM 0 HB2 PRO A 92 5.643 0.168 -19.491 1.00 0.00 H new ATOM 0 HB3 PRO A 92 5.056 1.553 -20.390 1.00 0.00 H new ATOM 0 HG2 PRO A 92 5.007 1.065 -17.418 1.00 0.00 H new ATOM 0 HG3 PRO A 92 5.409 2.534 -18.285 1.00 0.00 H new ATOM 0 HD2 PRO A 92 2.960 2.173 -17.148 1.00 0.00 H new ATOM 0 HD3 PRO A 92 3.160 3.119 -18.610 1.00 0.00 H new ATOM 1441 N CYS A 93 4.537 -1.951 -19.519 1.00 0.00 N ATOM 1442 CA CYS A 93 4.693 -3.322 -19.048 1.00 0.00 C ATOM 1443 C CYS A 93 5.520 -3.366 -17.766 1.00 0.00 C ATOM 1444 O CYS A 93 6.547 -2.699 -17.637 1.00 0.00 O ATOM 1445 CB CYS A 93 5.357 -4.181 -20.126 1.00 0.00 C ATOM 1446 SG CYS A 93 5.613 -5.917 -19.640 1.00 0.00 S ATOM 0 H CYS A 93 5.267 -1.640 -20.159 1.00 0.00 H new ATOM 0 HA CYS A 93 3.702 -3.721 -18.834 1.00 0.00 H new ATOM 0 HB2 CYS A 93 4.743 -4.154 -21.026 1.00 0.00 H new ATOM 0 HB3 CYS A 93 6.320 -3.741 -20.384 1.00 0.00 H new ATOM 0 HG CYS A 93 4.674 -6.655 -20.155 1.00 0.00 H new ATOM 1451 N PRO A 94 5.062 -4.169 -16.795 1.00 0.00 N ATOM 1452 CA PRO A 94 5.745 -4.321 -15.506 1.00 0.00 C ATOM 1453 C PRO A 94 7.068 -5.067 -15.635 1.00 0.00 C ATOM 1454 O PRO A 94 7.740 -5.336 -14.639 1.00 0.00 O ATOM 1455 CB PRO A 94 4.751 -5.134 -14.673 1.00 0.00 C ATOM 1456 CG PRO A 94 3.943 -5.885 -15.673 1.00 0.00 C ATOM 1457 CD PRO A 94 3.845 -4.993 -16.880 1.00 0.00 C ATOM 0 HA PRO A 94 6.004 -3.358 -15.066 1.00 0.00 H new ATOM 0 HB2 PRO A 94 5.266 -5.811 -13.992 1.00 0.00 H new ATOM 0 HB3 PRO A 94 4.122 -4.485 -14.063 1.00 0.00 H new ATOM 0 HG2 PRO A 94 4.418 -6.833 -15.926 1.00 0.00 H new ATOM 0 HG3 PRO A 94 2.954 -6.119 -15.279 1.00 0.00 H new ATOM 0 HD2 PRO A 94 3.814 -5.570 -17.804 1.00 0.00 H new ATOM 0 HD3 PRO A 94 2.943 -4.381 -16.855 1.00 0.00 H new ATOM 1465 N PHE A 95 7.438 -5.398 -16.868 1.00 0.00 N ATOM 1466 CA PHE A 95 8.682 -6.113 -17.127 1.00 0.00 C ATOM 1467 C PHE A 95 9.713 -5.194 -17.775 1.00 0.00 C ATOM 1468 O PHE A 95 9.430 -4.486 -18.741 1.00 0.00 O ATOM 1469 CB PHE A 95 8.422 -7.322 -18.028 1.00 0.00 C ATOM 1470 CG PHE A 95 9.421 -8.429 -17.849 1.00 0.00 C ATOM 1471 CD1 PHE A 95 10.743 -8.254 -18.226 1.00 0.00 C ATOM 1472 CD2 PHE A 95 9.039 -9.644 -17.304 1.00 0.00 C ATOM 1473 CE1 PHE A 95 11.665 -9.271 -18.064 1.00 0.00 C ATOM 1474 CE2 PHE A 95 9.957 -10.665 -17.139 1.00 0.00 C ATOM 1475 CZ PHE A 95 11.271 -10.478 -17.518 1.00 0.00 C ATOM 0 H PHE A 95 6.894 -5.182 -17.703 1.00 0.00 H new ATOM 0 HA PHE A 95 9.079 -6.459 -16.172 1.00 0.00 H new ATOM 0 HB2 PHE A 95 7.423 -7.708 -17.825 1.00 0.00 H new ATOM 0 HB3 PHE A 95 8.433 -6.998 -19.069 1.00 0.00 H new ATOM 0 HD1 PHE A 95 11.057 -7.312 -18.651 1.00 0.00 H new ATOM 0 HD2 PHE A 95 8.012 -9.796 -17.005 1.00 0.00 H new ATOM 0 HE1 PHE A 95 12.692 -9.123 -18.364 1.00 0.00 H new ATOM 0 HE2 PHE A 95 9.646 -11.608 -16.714 1.00 0.00 H new ATOM 0 HZ PHE A 95 11.990 -11.273 -17.388 1.00 0.00 H new ATOM 1485 N PRO A 96 10.939 -5.205 -17.231 1.00 0.00 N ATOM 1486 CA PRO A 96 12.038 -4.379 -17.739 1.00 0.00 C ATOM 1487 C PRO A 96 12.533 -4.847 -19.103 1.00 0.00 C ATOM 1488 O PRO A 96 12.597 -4.068 -20.053 1.00 0.00 O ATOM 1489 CB PRO A 96 13.133 -4.555 -16.684 1.00 0.00 C ATOM 1490 CG PRO A 96 12.843 -5.875 -16.056 1.00 0.00 C ATOM 1491 CD PRO A 96 11.347 -6.025 -16.078 1.00 0.00 C ATOM 0 HA PRO A 96 11.733 -3.343 -17.887 1.00 0.00 H new ATOM 0 HB2 PRO A 96 14.125 -4.541 -17.136 1.00 0.00 H new ATOM 0 HB3 PRO A 96 13.107 -3.752 -15.948 1.00 0.00 H new ATOM 0 HG2 PRO A 96 13.324 -6.683 -16.607 1.00 0.00 H new ATOM 0 HG3 PRO A 96 13.224 -5.914 -15.035 1.00 0.00 H new ATOM 0 HD2 PRO A 96 11.049 -7.066 -16.200 1.00 0.00 H new ATOM 0 HD3 PRO A 96 10.894 -5.670 -15.152 1.00 0.00 H new ATOM 1499 N GLY A 97 12.881 -6.127 -19.194 1.00 0.00 N ATOM 1500 CA GLY A 97 13.365 -6.678 -20.447 1.00 0.00 C ATOM 1501 C GLY A 97 12.301 -6.685 -21.526 1.00 0.00 C ATOM 1502 O GLY A 97 12.564 -7.074 -22.665 1.00 0.00 O ATOM 0 H GLY A 97 12.836 -6.793 -18.422 1.00 0.00 H new ATOM 0 HA2 GLY A 97 14.221 -6.097 -20.789 1.00 0.00 H new ATOM 0 HA3 GLY A 97 13.717 -7.696 -20.281 1.00 0.00 H new ATOM 1506 N CYS A 98 11.095 -6.256 -21.169 1.00 0.00 N ATOM 1507 CA CYS A 98 9.986 -6.217 -22.115 1.00 0.00 C ATOM 1508 C CYS A 98 9.775 -4.802 -22.646 1.00 0.00 C ATOM 1509 O CYS A 98 9.661 -4.592 -23.853 1.00 0.00 O ATOM 1510 CB CYS A 98 8.704 -6.721 -21.450 1.00 0.00 C ATOM 1511 SG CYS A 98 7.359 -7.098 -22.619 1.00 0.00 S ATOM 0 H CYS A 98 10.861 -5.930 -20.231 1.00 0.00 H new ATOM 0 HA CYS A 98 10.232 -6.868 -22.954 1.00 0.00 H new ATOM 0 HB2 CYS A 98 8.934 -7.618 -20.876 1.00 0.00 H new ATOM 0 HB3 CYS A 98 8.355 -5.970 -20.741 1.00 0.00 H new ATOM 0 HG CYS A 98 6.886 -8.283 -22.369 1.00 0.00 H new ATOM 1516 N GLY A 99 9.723 -3.835 -21.735 1.00 0.00 N ATOM 1517 CA GLY A 99 9.525 -2.453 -22.131 1.00 0.00 C ATOM 1518 C GLY A 99 8.387 -2.290 -23.119 1.00 0.00 C ATOM 1519 O GLY A 99 8.361 -1.336 -23.896 1.00 0.00 O ATOM 0 H GLY A 99 9.814 -3.984 -20.730 1.00 0.00 H new ATOM 0 HA2 GLY A 99 9.323 -1.850 -21.246 1.00 0.00 H new ATOM 0 HA3 GLY A 99 10.444 -2.070 -22.574 1.00 0.00 H new ATOM 1523 N LYS A 100 7.443 -3.224 -23.090 1.00 0.00 N ATOM 1524 CA LYS A 100 6.296 -3.181 -23.990 1.00 0.00 C ATOM 1525 C LYS A 100 5.149 -2.387 -23.373 1.00 0.00 C ATOM 1526 O LYS A 100 5.019 -2.316 -22.150 1.00 0.00 O ATOM 1527 CB LYS A 100 5.828 -4.600 -24.320 1.00 0.00 C ATOM 1528 CG LYS A 100 4.462 -4.651 -24.984 1.00 0.00 C ATOM 1529 CD LYS A 100 4.541 -4.268 -26.452 1.00 0.00 C ATOM 1530 CE LYS A 100 3.502 -5.009 -27.279 1.00 0.00 C ATOM 1531 NZ LYS A 100 3.910 -5.129 -28.706 1.00 0.00 N ATOM 0 H LYS A 100 7.449 -4.021 -22.453 1.00 0.00 H new ATOM 0 HA LYS A 100 6.606 -2.683 -24.909 1.00 0.00 H new ATOM 0 HB2 LYS A 100 6.560 -5.071 -24.976 1.00 0.00 H new ATOM 0 HB3 LYS A 100 5.799 -5.187 -23.402 1.00 0.00 H new ATOM 0 HG2 LYS A 100 4.048 -5.655 -24.891 1.00 0.00 H new ATOM 0 HG3 LYS A 100 3.780 -3.976 -24.467 1.00 0.00 H new ATOM 0 HD2 LYS A 100 4.392 -3.193 -26.557 1.00 0.00 H new ATOM 0 HD3 LYS A 100 5.537 -4.490 -26.834 1.00 0.00 H new ATOM 0 HE2 LYS A 100 3.347 -6.004 -26.861 1.00 0.00 H new ATOM 0 HE3 LYS A 100 2.548 -4.485 -27.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 3.175 -5.640 -29.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 4.033 -4.180 -29.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 4.807 -5.651 -28.768 1.00 0.00 H new ATOM 1545 N ILE A 101 4.321 -1.793 -24.225 1.00 0.00 N ATOM 1546 CA ILE A 101 3.184 -1.007 -23.762 1.00 0.00 C ATOM 1547 C ILE A 101 1.932 -1.318 -24.575 1.00 0.00 C ATOM 1548 O ILE A 101 2.008 -1.573 -25.778 1.00 0.00 O ATOM 1549 CB ILE A 101 3.474 0.504 -23.845 1.00 0.00 C ATOM 1550 CG1 ILE A 101 4.916 0.793 -23.423 1.00 0.00 C ATOM 1551 CG2 ILE A 101 2.496 1.279 -22.974 1.00 0.00 C ATOM 1552 CD1 ILE A 101 5.301 2.250 -23.546 1.00 0.00 C ATOM 0 H ILE A 101 4.416 -1.841 -25.239 1.00 0.00 H new ATOM 0 HA ILE A 101 3.015 -1.280 -22.721 1.00 0.00 H new ATOM 0 HB ILE A 101 3.346 0.827 -24.878 1.00 0.00 H new ATOM 0 HG12 ILE A 101 5.054 0.475 -22.390 1.00 0.00 H new ATOM 0 HG13 ILE A 101 5.592 0.194 -24.034 1.00 0.00 H new ATOM 0 HG21 ILE A 101 2.713 2.345 -23.043 1.00 0.00 H new ATOM 0 HG22 ILE A 101 1.478 1.093 -23.316 1.00 0.00 H new ATOM 0 HG23 ILE A 101 2.595 0.955 -21.938 1.00 0.00 H new ATOM 0 HD11 ILE A 101 6.336 2.381 -23.230 1.00 0.00 H new ATOM 0 HD12 ILE A 101 5.195 2.568 -24.583 1.00 0.00 H new ATOM 0 HD13 ILE A 101 4.650 2.853 -22.914 1.00 0.00 H new ATOM 1564 N PHE A 102 0.781 -1.295 -23.912 1.00 0.00 N ATOM 1565 CA PHE A 102 -0.488 -1.574 -24.573 1.00 0.00 C ATOM 1566 C PHE A 102 -1.506 -0.476 -24.281 1.00 0.00 C ATOM 1567 O PHE A 102 -1.369 0.272 -23.313 1.00 0.00 O ATOM 1568 CB PHE A 102 -1.037 -2.928 -24.118 1.00 0.00 C ATOM 1569 CG PHE A 102 -0.008 -4.022 -24.115 1.00 0.00 C ATOM 1570 CD1 PHE A 102 1.092 -3.954 -23.276 1.00 0.00 C ATOM 1571 CD2 PHE A 102 -0.140 -5.118 -24.953 1.00 0.00 C ATOM 1572 CE1 PHE A 102 2.041 -4.959 -23.271 1.00 0.00 C ATOM 1573 CE2 PHE A 102 0.805 -6.126 -24.952 1.00 0.00 C ATOM 1574 CZ PHE A 102 1.898 -6.046 -24.110 1.00 0.00 C ATOM 0 H PHE A 102 0.701 -1.086 -22.917 1.00 0.00 H new ATOM 0 HA PHE A 102 -0.310 -1.604 -25.648 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -1.449 -2.825 -23.114 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -1.860 -3.216 -24.772 1.00 0.00 H new ATOM 0 HD1 PHE A 102 1.210 -3.106 -22.618 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -0.991 -5.185 -25.614 1.00 0.00 H new ATOM 0 HE1 PHE A 102 2.894 -4.894 -22.611 1.00 0.00 H new ATOM 0 HE2 PHE A 102 0.690 -6.976 -25.609 1.00 0.00 H new ATOM 0 HZ PHE A 102 2.639 -6.832 -24.108 1.00 0.00 H new ATOM 1584 N ALA A 103 -2.528 -0.385 -25.126 1.00 0.00 N ATOM 1585 CA ALA A 103 -3.570 0.621 -24.959 1.00 0.00 C ATOM 1586 C ALA A 103 -4.783 0.039 -24.241 1.00 0.00 C ATOM 1587 O ALA A 103 -5.771 0.736 -24.008 1.00 0.00 O ATOM 1588 CB ALA A 103 -3.977 1.189 -26.310 1.00 0.00 C ATOM 0 H ALA A 103 -2.657 -0.996 -25.933 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.168 1.427 -24.345 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -4.756 1.939 -26.170 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -3.112 1.649 -26.787 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -4.356 0.386 -26.943 1.00 0.00 H new ATOM 1594 N ARG A 104 -4.702 -1.241 -23.893 1.00 0.00 N ATOM 1595 CA ARG A 104 -5.794 -1.916 -23.203 1.00 0.00 C ATOM 1596 C ARG A 104 -5.316 -2.517 -21.884 1.00 0.00 C ATOM 1597 O ARG A 104 -4.152 -2.896 -21.749 1.00 0.00 O ATOM 1598 CB ARG A 104 -6.386 -3.012 -24.090 1.00 0.00 C ATOM 1599 CG ARG A 104 -7.665 -3.620 -23.537 1.00 0.00 C ATOM 1600 CD ARG A 104 -8.878 -2.765 -23.869 1.00 0.00 C ATOM 1601 NE ARG A 104 -8.950 -1.569 -23.033 1.00 0.00 N ATOM 1602 CZ ARG A 104 -9.600 -0.465 -23.385 1.00 0.00 C ATOM 1603 NH1 ARG A 104 -10.230 -0.406 -24.550 1.00 0.00 N ATOM 1604 NH2 ARG A 104 -9.620 0.582 -22.570 1.00 0.00 N ATOM 0 H ARG A 104 -3.891 -1.831 -24.078 1.00 0.00 H new ATOM 0 HA ARG A 104 -6.565 -1.177 -22.987 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -6.588 -2.598 -25.078 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -5.646 -3.801 -24.221 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -7.801 -4.621 -23.948 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -7.580 -3.728 -22.456 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -8.839 -2.472 -24.918 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -9.785 -3.355 -23.736 1.00 0.00 H new ATOM 0 HE ARG A 104 -8.476 -1.582 -22.130 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -10.216 -1.209 -25.178 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -10.728 0.443 -24.818 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -9.136 0.539 -21.673 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -10.119 1.429 -22.841 1.00 0.00 H new ATOM 1618 N SER A 105 -6.221 -2.600 -20.915 1.00 0.00 N ATOM 1619 CA SER A 105 -5.891 -3.151 -19.606 1.00 0.00 C ATOM 1620 C SER A 105 -5.803 -4.673 -19.663 1.00 0.00 C ATOM 1621 O SER A 105 -4.858 -5.270 -19.149 1.00 0.00 O ATOM 1622 CB SER A 105 -6.936 -2.727 -18.572 1.00 0.00 C ATOM 1623 OG SER A 105 -8.099 -3.532 -18.663 1.00 0.00 O ATOM 0 H SER A 105 -7.189 -2.293 -21.011 1.00 0.00 H new ATOM 0 HA SER A 105 -4.918 -2.759 -19.310 1.00 0.00 H new ATOM 0 HB2 SER A 105 -6.513 -2.805 -17.570 1.00 0.00 H new ATOM 0 HB3 SER A 105 -7.201 -1.681 -18.726 1.00 0.00 H new ATOM 0 HG SER A 105 -8.751 -3.242 -17.991 1.00 0.00 H new ATOM 1629 N GLU A 106 -6.797 -5.294 -20.291 1.00 0.00 N ATOM 1630 CA GLU A 106 -6.833 -6.746 -20.415 1.00 0.00 C ATOM 1631 C GLU A 106 -5.612 -7.258 -21.174 1.00 0.00 C ATOM 1632 O GLU A 106 -5.096 -8.336 -20.886 1.00 0.00 O ATOM 1633 CB GLU A 106 -8.113 -7.188 -21.127 1.00 0.00 C ATOM 1634 CG GLU A 106 -7.980 -7.243 -22.640 1.00 0.00 C ATOM 1635 CD GLU A 106 -9.313 -7.103 -23.348 1.00 0.00 C ATOM 1636 OE1 GLU A 106 -10.237 -6.503 -22.759 1.00 0.00 O ATOM 1637 OE2 GLU A 106 -9.433 -7.593 -24.490 1.00 0.00 O ATOM 0 H GLU A 106 -7.587 -4.814 -20.721 1.00 0.00 H new ATOM 0 HA GLU A 106 -6.819 -7.171 -19.411 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -8.401 -8.173 -20.760 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -8.919 -6.502 -20.866 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -7.312 -6.448 -22.971 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -7.518 -8.188 -22.926 1.00 0.00 H new ATOM 1644 N ASN A 107 -5.158 -6.475 -22.148 1.00 0.00 N ATOM 1645 CA ASN A 107 -3.999 -6.849 -22.951 1.00 0.00 C ATOM 1646 C ASN A 107 -2.758 -7.001 -22.077 1.00 0.00 C ATOM 1647 O ASN A 107 -2.042 -7.999 -22.164 1.00 0.00 O ATOM 1648 CB ASN A 107 -3.746 -5.802 -24.037 1.00 0.00 C ATOM 1649 CG ASN A 107 -4.559 -6.062 -25.291 1.00 0.00 C ATOM 1650 OD1 ASN A 107 -5.752 -6.357 -25.221 1.00 0.00 O ATOM 1651 ND2 ASN A 107 -3.914 -5.954 -26.447 1.00 0.00 N ATOM 0 H ASN A 107 -5.575 -5.579 -22.400 1.00 0.00 H new ATOM 0 HA ASN A 107 -4.209 -7.809 -23.423 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -3.989 -4.813 -23.648 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.686 -5.793 -24.290 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.408 -6.118 -27.324 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -2.924 -5.707 -26.458 1.00 0.00 H new ATOM 1658 N LEU A 108 -2.509 -6.005 -21.234 1.00 0.00 N ATOM 1659 CA LEU A 108 -1.355 -6.027 -20.342 1.00 0.00 C ATOM 1660 C LEU A 108 -1.458 -7.177 -19.346 1.00 0.00 C ATOM 1661 O LEU A 108 -0.590 -8.048 -19.293 1.00 0.00 O ATOM 1662 CB LEU A 108 -1.237 -4.698 -19.594 1.00 0.00 C ATOM 1663 CG LEU A 108 0.002 -4.529 -18.715 1.00 0.00 C ATOM 1664 CD1 LEU A 108 1.228 -5.107 -19.404 1.00 0.00 C ATOM 1665 CD2 LEU A 108 0.221 -3.062 -18.376 1.00 0.00 C ATOM 0 H LEU A 108 -3.091 -5.172 -21.149 1.00 0.00 H new ATOM 0 HA LEU A 108 -0.462 -6.175 -20.949 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.251 -3.890 -20.326 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -2.121 -4.577 -18.968 1.00 0.00 H new ATOM 0 HG LEU A 108 -0.159 -5.075 -17.786 1.00 0.00 H new ATOM 0 HD11 LEU A 108 2.100 -4.978 -18.763 1.00 0.00 H new ATOM 0 HD12 LEU A 108 1.072 -6.169 -19.594 1.00 0.00 H new ATOM 0 HD13 LEU A 108 1.392 -4.589 -20.349 1.00 0.00 H new ATOM 0 HD21 LEU A 108 1.107 -2.962 -17.750 1.00 0.00 H new ATOM 0 HD22 LEU A 108 0.360 -2.493 -19.295 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -0.647 -2.679 -17.840 1.00 0.00 H new ATOM 1677 N LYS A 109 -2.527 -7.175 -18.557 1.00 0.00 N ATOM 1678 CA LYS A 109 -2.748 -8.219 -17.564 1.00 0.00 C ATOM 1679 C LYS A 109 -2.614 -9.603 -18.190 1.00 0.00 C ATOM 1680 O LYS A 109 -2.037 -10.512 -17.593 1.00 0.00 O ATOM 1681 CB LYS A 109 -4.134 -8.066 -16.932 1.00 0.00 C ATOM 1682 CG LYS A 109 -5.228 -8.808 -17.679 1.00 0.00 C ATOM 1683 CD LYS A 109 -6.585 -8.605 -17.026 1.00 0.00 C ATOM 1684 CE LYS A 109 -6.808 -9.588 -15.888 1.00 0.00 C ATOM 1685 NZ LYS A 109 -6.227 -9.097 -14.608 1.00 0.00 N ATOM 0 H LYS A 109 -3.255 -6.461 -18.586 1.00 0.00 H new ATOM 0 HA LYS A 109 -1.988 -8.115 -16.789 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -4.098 -8.428 -15.904 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -4.389 -7.007 -16.888 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -5.265 -8.461 -18.712 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -4.993 -9.872 -17.708 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -6.659 -7.586 -16.647 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -7.371 -8.726 -17.772 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -7.877 -9.758 -15.760 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -6.361 -10.548 -16.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -6.903 -9.261 -13.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -5.343 -9.608 -14.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -6.029 -8.079 -14.685 1.00 0.00 H new ATOM 1699 N ILE A 110 -3.148 -9.756 -19.397 1.00 0.00 N ATOM 1700 CA ILE A 110 -3.085 -11.028 -20.105 1.00 0.00 C ATOM 1701 C ILE A 110 -1.693 -11.271 -20.676 1.00 0.00 C ATOM 1702 O ILE A 110 -1.245 -12.413 -20.784 1.00 0.00 O ATOM 1703 CB ILE A 110 -4.115 -11.088 -21.249 1.00 0.00 C ATOM 1704 CG1 ILE A 110 -5.537 -11.055 -20.686 1.00 0.00 C ATOM 1705 CG2 ILE A 110 -3.901 -12.338 -22.089 1.00 0.00 C ATOM 1706 CD1 ILE A 110 -6.585 -10.690 -21.714 1.00 0.00 C ATOM 0 H ILE A 110 -3.629 -9.014 -19.905 1.00 0.00 H new ATOM 0 HA ILE A 110 -3.317 -11.806 -19.377 1.00 0.00 H new ATOM 0 HB ILE A 110 -3.977 -10.216 -21.889 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -5.776 -12.032 -20.267 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -5.578 -10.338 -19.866 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -4.636 -12.366 -22.893 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -2.898 -12.323 -22.515 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -4.015 -13.222 -21.462 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -7.569 -10.686 -21.245 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -6.371 -9.700 -22.116 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -6.572 -11.421 -22.523 1.00 0.00 H new ATOM 1718 N HIS A 111 -1.011 -10.189 -21.039 1.00 0.00 N ATOM 1719 CA HIS A 111 0.333 -10.284 -21.597 1.00 0.00 C ATOM 1720 C HIS A 111 1.371 -10.450 -20.491 1.00 0.00 C ATOM 1721 O HIS A 111 2.488 -10.905 -20.735 1.00 0.00 O ATOM 1722 CB HIS A 111 0.652 -9.042 -22.429 1.00 0.00 C ATOM 1723 CG HIS A 111 2.117 -8.753 -22.537 1.00 0.00 C ATOM 1724 ND1 HIS A 111 2.953 -9.415 -23.412 1.00 0.00 N ATOM 1725 CD2 HIS A 111 2.896 -7.865 -21.875 1.00 0.00 C ATOM 1726 CE1 HIS A 111 4.182 -8.948 -23.282 1.00 0.00 C ATOM 1727 NE2 HIS A 111 4.174 -8.006 -22.356 1.00 0.00 N ATOM 0 H HIS A 111 -1.367 -9.237 -20.957 1.00 0.00 H new ATOM 0 HA HIS A 111 0.370 -11.163 -22.241 1.00 0.00 H new ATOM 0 HB2 HIS A 111 0.241 -9.170 -23.430 1.00 0.00 H new ATOM 0 HB3 HIS A 111 0.152 -8.180 -21.987 1.00 0.00 H new ATOM 0 HD2 HIS A 111 2.572 -7.174 -21.111 1.00 0.00 H new ATOM 0 HE1 HIS A 111 5.046 -9.280 -23.838 1.00 0.00 H new ATOM 0 HE2 HIS A 111 4.986 -7.470 -22.048 1.00 0.00 H new ATOM 1735 N LYS A 112 0.994 -10.076 -19.273 1.00 0.00 N ATOM 1736 CA LYS A 112 1.890 -10.183 -18.127 1.00 0.00 C ATOM 1737 C LYS A 112 1.987 -11.627 -17.645 1.00 0.00 C ATOM 1738 O LYS A 112 3.007 -12.039 -17.092 1.00 0.00 O ATOM 1739 CB LYS A 112 1.404 -9.285 -16.988 1.00 0.00 C ATOM 1740 CG LYS A 112 1.799 -7.828 -17.151 1.00 0.00 C ATOM 1741 CD LYS A 112 0.875 -6.909 -16.369 1.00 0.00 C ATOM 1742 CE LYS A 112 0.882 -7.242 -14.885 1.00 0.00 C ATOM 1743 NZ LYS A 112 -0.152 -8.256 -14.539 1.00 0.00 N ATOM 0 H LYS A 112 0.073 -9.696 -19.054 1.00 0.00 H new ATOM 0 HA LYS A 112 2.881 -9.856 -18.441 1.00 0.00 H new ATOM 0 HB2 LYS A 112 0.318 -9.353 -16.921 1.00 0.00 H new ATOM 0 HB3 LYS A 112 1.805 -9.658 -16.046 1.00 0.00 H new ATOM 0 HG2 LYS A 112 2.825 -7.688 -16.812 1.00 0.00 H new ATOM 0 HG3 LYS A 112 1.773 -7.559 -18.207 1.00 0.00 H new ATOM 0 HD2 LYS A 112 1.184 -5.874 -16.512 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -0.140 -6.995 -16.757 1.00 0.00 H new ATOM 0 HE2 LYS A 112 1.866 -7.615 -14.601 1.00 0.00 H new ATOM 0 HE3 LYS A 112 0.707 -6.334 -14.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -0.785 -7.871 -13.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -0.705 -8.492 -15.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 0.311 -9.114 -14.178 1.00 0.00 H new ATOM 1757 N ARG A 113 0.921 -12.391 -17.860 1.00 0.00 N ATOM 1758 CA ARG A 113 0.887 -13.788 -17.447 1.00 0.00 C ATOM 1759 C ARG A 113 1.686 -14.660 -18.412 1.00 0.00 C ATOM 1760 O ARG A 113 2.020 -15.804 -18.102 1.00 0.00 O ATOM 1761 CB ARG A 113 -0.558 -14.285 -17.372 1.00 0.00 C ATOM 1762 CG ARG A 113 -1.371 -13.985 -18.621 1.00 0.00 C ATOM 1763 CD ARG A 113 -2.654 -14.800 -18.660 1.00 0.00 C ATOM 1764 NE ARG A 113 -2.412 -16.184 -19.060 1.00 0.00 N ATOM 1765 CZ ARG A 113 -3.360 -16.992 -19.521 1.00 0.00 C ATOM 1766 NH1 ARG A 113 -4.607 -16.557 -19.640 1.00 0.00 N ATOM 1767 NH2 ARG A 113 -3.061 -18.238 -19.865 1.00 0.00 N ATOM 0 H ARG A 113 0.070 -12.066 -18.318 1.00 0.00 H new ATOM 0 HA ARG A 113 1.341 -13.859 -16.458 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -0.555 -15.361 -17.201 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -1.047 -13.827 -16.512 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -1.613 -12.923 -18.653 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -0.773 -14.203 -19.506 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -3.124 -14.784 -17.676 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -3.355 -14.339 -19.356 1.00 0.00 H new ATOM 0 HE ARG A 113 -1.463 -16.550 -18.981 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -4.840 -15.599 -19.377 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -5.333 -17.180 -19.994 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -2.103 -18.576 -19.775 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -3.789 -18.858 -20.219 1.00 0.00 H new ATOM 1884 N PHE A 121 12.944 -9.923 -9.560 1.00 0.00 N ATOM 1885 CA PHE A 121 13.592 -9.308 -8.407 1.00 0.00 C ATOM 1886 C PHE A 121 12.744 -9.481 -7.151 1.00 0.00 C ATOM 1887 O PHE A 121 11.581 -9.078 -7.112 1.00 0.00 O ATOM 1888 CB PHE A 121 13.841 -7.821 -8.668 1.00 0.00 C ATOM 1889 CG PHE A 121 14.735 -7.560 -9.846 1.00 0.00 C ATOM 1890 CD1 PHE A 121 14.218 -7.527 -11.131 1.00 0.00 C ATOM 1891 CD2 PHE A 121 16.092 -7.348 -9.669 1.00 0.00 C ATOM 1892 CE1 PHE A 121 15.038 -7.288 -12.217 1.00 0.00 C ATOM 1893 CE2 PHE A 121 16.918 -7.108 -10.751 1.00 0.00 C ATOM 1894 CZ PHE A 121 16.390 -7.077 -12.026 1.00 0.00 C ATOM 0 HA PHE A 121 14.548 -9.807 -8.250 1.00 0.00 H new ATOM 0 HB2 PHE A 121 12.885 -7.324 -8.831 1.00 0.00 H new ATOM 0 HB3 PHE A 121 14.285 -7.374 -7.779 1.00 0.00 H new ATOM 0 HD1 PHE A 121 13.162 -7.690 -11.286 1.00 0.00 H new ATOM 0 HD2 PHE A 121 16.510 -7.370 -8.673 1.00 0.00 H new ATOM 0 HE1 PHE A 121 14.623 -7.266 -13.214 1.00 0.00 H new ATOM 0 HE2 PHE A 121 17.975 -6.945 -10.599 1.00 0.00 H new ATOM 0 HZ PHE A 121 17.033 -6.888 -12.873 1.00 0.00 H new ATOM 1904 N LYS A 122 13.334 -10.085 -6.124 1.00 0.00 N ATOM 1905 CA LYS A 122 12.635 -10.312 -4.865 1.00 0.00 C ATOM 1906 C LYS A 122 13.386 -9.672 -3.702 1.00 0.00 C ATOM 1907 O LYS A 122 14.602 -9.823 -3.577 1.00 0.00 O ATOM 1908 CB LYS A 122 12.467 -11.812 -4.614 1.00 0.00 C ATOM 1909 CG LYS A 122 12.326 -12.171 -3.145 1.00 0.00 C ATOM 1910 CD LYS A 122 12.245 -13.675 -2.944 1.00 0.00 C ATOM 1911 CE LYS A 122 13.618 -14.324 -3.029 1.00 0.00 C ATOM 1912 NZ LYS A 122 14.403 -14.128 -1.779 1.00 0.00 N ATOM 0 H LYS A 122 14.295 -10.426 -6.140 1.00 0.00 H new ATOM 0 HA LYS A 122 11.651 -9.850 -4.937 1.00 0.00 H new ATOM 0 HB2 LYS A 122 11.587 -12.165 -5.152 1.00 0.00 H new ATOM 0 HB3 LYS A 122 13.327 -12.340 -5.027 1.00 0.00 H new ATOM 0 HG2 LYS A 122 13.175 -11.774 -2.589 1.00 0.00 H new ATOM 0 HG3 LYS A 122 11.431 -11.700 -2.739 1.00 0.00 H new ATOM 0 HD2 LYS A 122 11.800 -13.890 -1.973 1.00 0.00 H new ATOM 0 HD3 LYS A 122 11.589 -14.109 -3.699 1.00 0.00 H new ATOM 0 HE2 LYS A 122 13.504 -15.391 -3.223 1.00 0.00 H new ATOM 0 HE3 LYS A 122 14.167 -13.904 -3.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 15.297 -14.656 -1.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 14.607 -13.116 -1.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 13.854 -14.475 -0.967 1.00 0.00 H new ATOM 1926 N CYS A 123 12.656 -8.957 -2.853 1.00 0.00 N ATOM 1927 CA CYS A 123 13.253 -8.295 -1.699 1.00 0.00 C ATOM 1928 C CYS A 123 14.357 -9.155 -1.090 1.00 0.00 C ATOM 1929 O CYS A 123 14.082 -10.148 -0.418 1.00 0.00 O ATOM 1930 CB CYS A 123 12.184 -7.996 -0.647 1.00 0.00 C ATOM 1931 SG CYS A 123 12.825 -7.188 0.855 1.00 0.00 S ATOM 0 H CYS A 123 11.649 -8.821 -2.942 1.00 0.00 H new ATOM 0 HA CYS A 123 13.693 -7.356 -2.036 1.00 0.00 H new ATOM 0 HB2 CYS A 123 11.420 -7.358 -1.092 1.00 0.00 H new ATOM 0 HB3 CYS A 123 11.696 -8.929 -0.365 1.00 0.00 H new ATOM 0 HG CYS A 123 11.910 -7.200 1.778 1.00 0.00 H new ATOM 1936 N GLU A 124 15.604 -8.764 -1.329 1.00 0.00 N ATOM 1937 CA GLU A 124 16.749 -9.499 -0.804 1.00 0.00 C ATOM 1938 C GLU A 124 16.764 -9.464 0.722 1.00 0.00 C ATOM 1939 O GLU A 124 17.568 -10.142 1.362 1.00 0.00 O ATOM 1940 CB GLU A 124 18.053 -8.915 -1.351 1.00 0.00 C ATOM 1941 CG GLU A 124 18.177 -7.414 -1.155 1.00 0.00 C ATOM 1942 CD GLU A 124 19.617 -6.938 -1.188 1.00 0.00 C ATOM 1943 OE1 GLU A 124 20.231 -6.978 -2.275 1.00 0.00 O ATOM 1944 OE2 GLU A 124 20.129 -6.526 -0.126 1.00 0.00 O ATOM 0 H GLU A 124 15.848 -7.943 -1.883 1.00 0.00 H new ATOM 0 HA GLU A 124 16.661 -10.537 -1.126 1.00 0.00 H new ATOM 0 HB2 GLU A 124 18.894 -9.407 -0.863 1.00 0.00 H new ATOM 0 HB3 GLU A 124 18.124 -9.141 -2.415 1.00 0.00 H new ATOM 0 HG2 GLU A 124 17.611 -6.902 -1.933 1.00 0.00 H new ATOM 0 HG3 GLU A 124 17.729 -7.138 -0.201 1.00 0.00 H new ATOM 1951 N PHE A 125 15.869 -8.669 1.299 1.00 0.00 N ATOM 1952 CA PHE A 125 15.780 -8.543 2.749 1.00 0.00 C ATOM 1953 C PHE A 125 15.210 -9.815 3.370 1.00 0.00 C ATOM 1954 O PHE A 125 14.092 -10.224 3.057 1.00 0.00 O ATOM 1955 CB PHE A 125 14.908 -7.343 3.125 1.00 0.00 C ATOM 1956 CG PHE A 125 15.279 -6.723 4.442 1.00 0.00 C ATOM 1957 CD1 PHE A 125 16.245 -5.731 4.508 1.00 0.00 C ATOM 1958 CD2 PHE A 125 14.663 -7.132 5.614 1.00 0.00 C ATOM 1959 CE1 PHE A 125 16.588 -5.158 5.718 1.00 0.00 C ATOM 1960 CE2 PHE A 125 15.002 -6.562 6.826 1.00 0.00 C ATOM 1961 CZ PHE A 125 15.966 -5.575 6.879 1.00 0.00 C ATOM 0 H PHE A 125 15.195 -8.102 0.784 1.00 0.00 H new ATOM 0 HA PHE A 125 16.786 -8.388 3.139 1.00 0.00 H new ATOM 0 HB2 PHE A 125 14.985 -6.588 2.342 1.00 0.00 H new ATOM 0 HB3 PHE A 125 13.865 -7.659 3.162 1.00 0.00 H new ATOM 0 HD1 PHE A 125 16.735 -5.402 3.604 1.00 0.00 H new ATOM 0 HD2 PHE A 125 13.910 -7.905 5.580 1.00 0.00 H new ATOM 0 HE1 PHE A 125 17.341 -4.385 5.756 1.00 0.00 H new ATOM 0 HE2 PHE A 125 14.513 -6.888 7.732 1.00 0.00 H new ATOM 0 HZ PHE A 125 16.233 -5.130 7.826 1.00 0.00 H new ATOM 1971 N GLU A 126 15.987 -10.435 4.252 1.00 0.00 N ATOM 1972 CA GLU A 126 15.560 -11.661 4.917 1.00 0.00 C ATOM 1973 C GLU A 126 14.312 -11.417 5.760 1.00 0.00 C ATOM 1974 O GLU A 126 14.143 -10.346 6.343 1.00 0.00 O ATOM 1975 CB GLU A 126 16.685 -12.208 5.798 1.00 0.00 C ATOM 1976 CG GLU A 126 16.193 -13.076 6.944 1.00 0.00 C ATOM 1977 CD GLU A 126 15.314 -14.219 6.475 1.00 0.00 C ATOM 1978 OE1 GLU A 126 15.345 -14.533 5.267 1.00 0.00 O ATOM 1979 OE2 GLU A 126 14.596 -14.800 7.315 1.00 0.00 O ATOM 0 H GLU A 126 16.915 -10.109 4.523 1.00 0.00 H new ATOM 0 HA GLU A 126 15.320 -12.396 4.148 1.00 0.00 H new ATOM 0 HB2 GLU A 126 17.369 -12.790 5.180 1.00 0.00 H new ATOM 0 HB3 GLU A 126 17.255 -11.373 6.205 1.00 0.00 H new ATOM 0 HG2 GLU A 126 17.050 -13.479 7.483 1.00 0.00 H new ATOM 0 HG3 GLU A 126 15.635 -12.459 7.648 1.00 0.00 H new ATOM 1986 N GLY A 127 13.439 -12.418 5.819 1.00 0.00 N ATOM 1987 CA GLY A 127 12.217 -12.292 6.592 1.00 0.00 C ATOM 1988 C GLY A 127 11.228 -11.333 5.960 1.00 0.00 C ATOM 1989 O GLY A 127 10.306 -10.855 6.622 1.00 0.00 O ATOM 0 H GLY A 127 13.556 -13.314 5.345 1.00 0.00 H new ATOM 0 HA2 GLY A 127 11.753 -13.273 6.694 1.00 0.00 H new ATOM 0 HA3 GLY A 127 12.460 -11.948 7.597 1.00 0.00 H new ATOM 1993 N CYS A 128 11.418 -11.050 4.676 1.00 0.00 N ATOM 1994 CA CYS A 128 10.537 -10.140 3.954 1.00 0.00 C ATOM 1995 C CYS A 128 9.938 -10.822 2.727 1.00 0.00 C ATOM 1996 O CYS A 128 10.593 -11.634 2.074 1.00 0.00 O ATOM 1997 CB CYS A 128 11.301 -8.884 3.532 1.00 0.00 C ATOM 1998 SG CYS A 128 10.253 -7.408 3.330 1.00 0.00 S ATOM 0 H CYS A 128 12.175 -11.438 4.113 1.00 0.00 H new ATOM 0 HA CYS A 128 9.724 -9.855 4.622 1.00 0.00 H new ATOM 0 HB2 CYS A 128 12.069 -8.672 4.276 1.00 0.00 H new ATOM 0 HB3 CYS A 128 11.815 -9.083 2.591 1.00 0.00 H new ATOM 0 HG CYS A 128 10.018 -7.212 2.066 1.00 0.00 H new ATOM 2003 N ASP A 129 8.691 -10.485 2.420 1.00 0.00 N ATOM 2004 CA ASP A 129 8.003 -11.063 1.271 1.00 0.00 C ATOM 2005 C ASP A 129 7.484 -9.970 0.342 1.00 0.00 C ATOM 2006 O ASP A 129 6.502 -9.294 0.652 1.00 0.00 O ATOM 2007 CB ASP A 129 6.846 -11.949 1.734 1.00 0.00 C ATOM 2008 CG ASP A 129 7.250 -12.892 2.850 1.00 0.00 C ATOM 2009 OD1 ASP A 129 8.436 -13.281 2.899 1.00 0.00 O ATOM 2010 OD2 ASP A 129 6.380 -13.240 3.676 1.00 0.00 O ATOM 0 H ASP A 129 8.135 -9.814 2.951 1.00 0.00 H new ATOM 0 HA ASP A 129 8.719 -11.673 0.720 1.00 0.00 H new ATOM 0 HB2 ASP A 129 6.024 -11.320 2.074 1.00 0.00 H new ATOM 0 HB3 ASP A 129 6.475 -12.529 0.889 1.00 0.00 H new ATOM 2015 N ARG A 130 8.149 -9.801 -0.796 1.00 0.00 N ATOM 2016 CA ARG A 130 7.755 -8.789 -1.768 1.00 0.00 C ATOM 2017 C ARG A 130 8.135 -9.217 -3.183 1.00 0.00 C ATOM 2018 O ARG A 130 8.739 -10.270 -3.382 1.00 0.00 O ATOM 2019 CB ARG A 130 8.414 -7.449 -1.435 1.00 0.00 C ATOM 2020 CG ARG A 130 8.166 -6.986 -0.009 1.00 0.00 C ATOM 2021 CD ARG A 130 6.711 -6.601 0.208 1.00 0.00 C ATOM 2022 NE ARG A 130 6.295 -6.792 1.594 1.00 0.00 N ATOM 2023 CZ ARG A 130 5.025 -6.821 1.983 1.00 0.00 C ATOM 2024 NH1 ARG A 130 4.053 -6.672 1.093 1.00 0.00 N ATOM 2025 NH2 ARG A 130 4.725 -7.000 3.263 1.00 0.00 N ATOM 0 H ARG A 130 8.963 -10.352 -1.067 1.00 0.00 H new ATOM 0 HA ARG A 130 6.672 -8.676 -1.720 1.00 0.00 H new ATOM 0 HB2 ARG A 130 9.488 -7.531 -1.600 1.00 0.00 H new ATOM 0 HB3 ARG A 130 8.043 -6.690 -2.124 1.00 0.00 H new ATOM 0 HG2 ARG A 130 8.440 -7.780 0.685 1.00 0.00 H new ATOM 0 HG3 ARG A 130 8.806 -6.132 0.214 1.00 0.00 H new ATOM 0 HD2 ARG A 130 6.566 -5.558 -0.073 1.00 0.00 H new ATOM 0 HD3 ARG A 130 6.076 -7.199 -0.446 1.00 0.00 H new ATOM 0 HE ARG A 130 7.019 -6.910 2.303 1.00 0.00 H new ATOM 0 HH11 ARG A 130 4.280 -6.535 0.108 1.00 0.00 H new ATOM 0 HH12 ARG A 130 3.079 -6.695 1.393 1.00 0.00 H new ATOM 0 HH21 ARG A 130 5.470 -7.116 3.950 1.00 0.00 H new ATOM 0 HH22 ARG A 130 3.749 -7.022 3.560 1.00 0.00 H new ATOM 2039 N ARG A 131 7.775 -8.393 -4.161 1.00 0.00 N ATOM 2040 CA ARG A 131 8.076 -8.687 -5.557 1.00 0.00 C ATOM 2041 C ARG A 131 8.327 -7.402 -6.341 1.00 0.00 C ATOM 2042 O ARG A 131 7.519 -6.473 -6.307 1.00 0.00 O ATOM 2043 CB ARG A 131 6.927 -9.470 -6.195 1.00 0.00 C ATOM 2044 CG ARG A 131 5.560 -8.853 -5.952 1.00 0.00 C ATOM 2045 CD ARG A 131 4.567 -9.254 -7.031 1.00 0.00 C ATOM 2046 NE ARG A 131 4.611 -8.351 -8.178 1.00 0.00 N ATOM 2047 CZ ARG A 131 3.937 -7.209 -8.241 1.00 0.00 C ATOM 2048 NH1 ARG A 131 3.170 -6.831 -7.227 1.00 0.00 N ATOM 2049 NH2 ARG A 131 4.028 -6.441 -9.319 1.00 0.00 N ATOM 0 H ARG A 131 7.275 -7.517 -4.013 1.00 0.00 H new ATOM 0 HA ARG A 131 8.981 -9.294 -5.587 1.00 0.00 H new ATOM 0 HB2 ARG A 131 7.099 -9.540 -7.269 1.00 0.00 H new ATOM 0 HB3 ARG A 131 6.931 -10.488 -5.805 1.00 0.00 H new ATOM 0 HG2 ARG A 131 5.186 -9.167 -4.977 1.00 0.00 H new ATOM 0 HG3 ARG A 131 5.650 -7.767 -5.924 1.00 0.00 H new ATOM 0 HD2 ARG A 131 4.781 -10.270 -7.361 1.00 0.00 H new ATOM 0 HD3 ARG A 131 3.560 -9.260 -6.613 1.00 0.00 H new ATOM 0 HE ARG A 131 5.192 -8.612 -8.975 1.00 0.00 H new ATOM 0 HH11 ARG A 131 3.097 -7.418 -6.396 1.00 0.00 H new ATOM 0 HH12 ARG A 131 2.653 -5.953 -7.278 1.00 0.00 H new ATOM 0 HH21 ARG A 131 4.617 -6.728 -10.101 1.00 0.00 H new ATOM 0 HH22 ARG A 131 3.509 -5.564 -9.366 1.00 0.00 H new ATOM 2063 N PHE A 132 9.452 -7.355 -7.047 1.00 0.00 N ATOM 2064 CA PHE A 132 9.810 -6.184 -7.839 1.00 0.00 C ATOM 2065 C PHE A 132 10.130 -6.578 -9.278 1.00 0.00 C ATOM 2066 O PHE A 132 10.446 -7.733 -9.561 1.00 0.00 O ATOM 2067 CB PHE A 132 11.009 -5.468 -7.215 1.00 0.00 C ATOM 2068 CG PHE A 132 10.872 -5.244 -5.737 1.00 0.00 C ATOM 2069 CD1 PHE A 132 9.886 -4.407 -5.238 1.00 0.00 C ATOM 2070 CD2 PHE A 132 11.727 -5.871 -4.845 1.00 0.00 C ATOM 2071 CE1 PHE A 132 9.757 -4.199 -3.878 1.00 0.00 C ATOM 2072 CE2 PHE A 132 11.603 -5.666 -3.483 1.00 0.00 C ATOM 2073 CZ PHE A 132 10.616 -4.830 -3.000 1.00 0.00 C ATOM 0 H PHE A 132 10.132 -8.115 -7.087 1.00 0.00 H new ATOM 0 HA PHE A 132 8.956 -5.507 -7.848 1.00 0.00 H new ATOM 0 HB2 PHE A 132 11.909 -6.053 -7.404 1.00 0.00 H new ATOM 0 HB3 PHE A 132 11.145 -4.506 -7.709 1.00 0.00 H new ATOM 0 HD1 PHE A 132 9.211 -3.912 -5.920 1.00 0.00 H new ATOM 0 HD2 PHE A 132 12.499 -6.527 -5.218 1.00 0.00 H new ATOM 0 HE1 PHE A 132 8.985 -3.544 -3.502 1.00 0.00 H new ATOM 0 HE2 PHE A 132 12.277 -6.159 -2.798 1.00 0.00 H new ATOM 0 HZ PHE A 132 10.516 -4.670 -1.937 1.00 0.00 H new ATOM 2083 N ALA A 133 10.044 -5.608 -10.183 1.00 0.00 N ATOM 2084 CA ALA A 133 10.326 -5.852 -11.593 1.00 0.00 C ATOM 2085 C ALA A 133 11.608 -5.151 -12.025 1.00 0.00 C ATOM 2086 O ALA A 133 12.204 -5.499 -13.043 1.00 0.00 O ATOM 2087 CB ALA A 133 9.156 -5.394 -12.451 1.00 0.00 C ATOM 0 H ALA A 133 9.782 -4.647 -9.965 1.00 0.00 H new ATOM 0 HA ALA A 133 10.466 -6.924 -11.731 1.00 0.00 H new ATOM 0 HB1 ALA A 133 9.379 -5.582 -13.501 1.00 0.00 H new ATOM 0 HB2 ALA A 133 8.259 -5.944 -12.167 1.00 0.00 H new ATOM 0 HB3 ALA A 133 8.990 -4.327 -12.301 1.00 0.00 H new ATOM 2093 N ASN A 134 12.028 -4.160 -11.245 1.00 0.00 N ATOM 2094 CA ASN A 134 13.240 -3.408 -11.549 1.00 0.00 C ATOM 2095 C ASN A 134 14.145 -3.316 -10.324 1.00 0.00 C ATOM 2096 O ASN A 134 13.676 -3.088 -9.209 1.00 0.00 O ATOM 2097 CB ASN A 134 12.884 -2.003 -12.041 1.00 0.00 C ATOM 2098 CG ASN A 134 11.695 -1.417 -11.305 1.00 0.00 C ATOM 2099 OD1 ASN A 134 11.854 -0.710 -10.309 1.00 0.00 O ATOM 2100 ND2 ASN A 134 10.495 -1.708 -11.793 1.00 0.00 N ATOM 0 H ASN A 134 11.547 -3.859 -10.398 1.00 0.00 H new ATOM 0 HA ASN A 134 13.777 -3.936 -12.337 1.00 0.00 H new ATOM 0 HB2 ASN A 134 13.746 -1.347 -11.914 1.00 0.00 H new ATOM 0 HB3 ASN A 134 12.665 -2.039 -13.108 1.00 0.00 H new ATOM 0 HD21 ASN A 134 9.658 -1.342 -11.340 1.00 0.00 H new ATOM 0 HD22 ASN A 134 10.410 -2.298 -12.621 1.00 0.00 H new ATOM 2107 N SER A 135 15.444 -3.495 -10.540 1.00 0.00 N ATOM 2108 CA SER A 135 16.415 -3.436 -9.454 1.00 0.00 C ATOM 2109 C SER A 135 16.272 -2.136 -8.668 1.00 0.00 C ATOM 2110 O SER A 135 16.444 -2.112 -7.450 1.00 0.00 O ATOM 2111 CB SER A 135 17.837 -3.559 -10.005 1.00 0.00 C ATOM 2112 OG SER A 135 18.763 -2.869 -9.184 1.00 0.00 O ATOM 0 H SER A 135 15.848 -3.682 -11.457 1.00 0.00 H new ATOM 0 HA SER A 135 16.221 -4.271 -8.780 1.00 0.00 H new ATOM 0 HB2 SER A 135 18.116 -4.611 -10.069 1.00 0.00 H new ATOM 0 HB3 SER A 135 17.874 -3.157 -11.018 1.00 0.00 H new ATOM 0 HG SER A 135 19.664 -2.964 -9.556 1.00 0.00 H new ATOM 2118 N SER A 136 15.957 -1.056 -9.376 1.00 0.00 N ATOM 2119 CA SER A 136 15.794 0.249 -8.747 1.00 0.00 C ATOM 2120 C SER A 136 14.759 0.188 -7.628 1.00 0.00 C ATOM 2121 O SER A 136 14.966 0.735 -6.545 1.00 0.00 O ATOM 2122 CB SER A 136 15.378 1.292 -9.786 1.00 0.00 C ATOM 2123 OG SER A 136 15.608 2.607 -9.310 1.00 0.00 O ATOM 0 H SER A 136 15.810 -1.059 -10.385 1.00 0.00 H new ATOM 0 HA SER A 136 16.752 0.539 -8.316 1.00 0.00 H new ATOM 0 HB2 SER A 136 15.936 1.133 -10.709 1.00 0.00 H new ATOM 0 HB3 SER A 136 14.322 1.169 -10.027 1.00 0.00 H new ATOM 0 HG SER A 136 15.335 3.255 -9.993 1.00 0.00 H new ATOM 2129 N ASP A 137 13.643 -0.480 -7.900 1.00 0.00 N ATOM 2130 CA ASP A 137 12.574 -0.614 -6.917 1.00 0.00 C ATOM 2131 C ASP A 137 13.050 -1.402 -5.701 1.00 0.00 C ATOM 2132 O ASP A 137 12.774 -1.029 -4.560 1.00 0.00 O ATOM 2133 CB ASP A 137 11.360 -1.303 -7.543 1.00 0.00 C ATOM 2134 CG ASP A 137 10.414 -0.320 -8.204 1.00 0.00 C ATOM 2135 OD1 ASP A 137 10.505 0.887 -7.898 1.00 0.00 O ATOM 2136 OD2 ASP A 137 9.582 -0.758 -9.026 1.00 0.00 O ATOM 0 H ASP A 137 13.455 -0.937 -8.792 1.00 0.00 H new ATOM 0 HA ASP A 137 12.287 0.385 -6.590 1.00 0.00 H new ATOM 0 HB2 ASP A 137 11.699 -2.029 -8.282 1.00 0.00 H new ATOM 0 HB3 ASP A 137 10.823 -1.858 -6.773 1.00 0.00 H new ATOM 2141 N ARG A 138 13.765 -2.494 -5.952 1.00 0.00 N ATOM 2142 CA ARG A 138 14.277 -3.336 -4.877 1.00 0.00 C ATOM 2143 C ARG A 138 15.151 -2.527 -3.923 1.00 0.00 C ATOM 2144 O ARG A 138 15.029 -2.644 -2.703 1.00 0.00 O ATOM 2145 CB ARG A 138 15.079 -4.504 -5.454 1.00 0.00 C ATOM 2146 CG ARG A 138 16.123 -5.057 -4.498 1.00 0.00 C ATOM 2147 CD ARG A 138 16.386 -6.533 -4.752 1.00 0.00 C ATOM 2148 NE ARG A 138 17.171 -6.748 -5.965 1.00 0.00 N ATOM 2149 CZ ARG A 138 18.446 -6.393 -6.088 1.00 0.00 C ATOM 2150 NH1 ARG A 138 19.075 -5.809 -5.077 1.00 0.00 N ATOM 2151 NH2 ARG A 138 19.093 -6.622 -7.223 1.00 0.00 N ATOM 0 H ARG A 138 14.003 -2.816 -6.890 1.00 0.00 H new ATOM 0 HA ARG A 138 13.427 -3.728 -4.319 1.00 0.00 H new ATOM 0 HB2 ARG A 138 14.392 -5.304 -5.731 1.00 0.00 H new ATOM 0 HB3 ARG A 138 15.573 -4.177 -6.369 1.00 0.00 H new ATOM 0 HG2 ARG A 138 17.052 -4.497 -4.608 1.00 0.00 H new ATOM 0 HG3 ARG A 138 15.787 -4.918 -3.471 1.00 0.00 H new ATOM 0 HD2 ARG A 138 16.913 -6.959 -3.899 1.00 0.00 H new ATOM 0 HD3 ARG A 138 15.436 -7.061 -4.836 1.00 0.00 H new ATOM 0 HE ARG A 138 16.716 -7.195 -6.761 1.00 0.00 H new ATOM 0 HH11 ARG A 138 18.580 -5.631 -4.203 1.00 0.00 H new ATOM 0 HH12 ARG A 138 20.053 -5.537 -5.174 1.00 0.00 H new ATOM 0 HH21 ARG A 138 18.612 -7.071 -8.003 1.00 0.00 H new ATOM 0 HH22 ARG A 138 20.071 -6.349 -7.316 1.00 0.00 H new ATOM 2165 N LYS A 139 16.032 -1.708 -4.486 1.00 0.00 N ATOM 2166 CA LYS A 139 16.926 -0.879 -3.686 1.00 0.00 C ATOM 2167 C LYS A 139 16.164 0.266 -3.028 1.00 0.00 C ATOM 2168 O LYS A 139 16.615 0.836 -2.035 1.00 0.00 O ATOM 2169 CB LYS A 139 18.053 -0.321 -4.559 1.00 0.00 C ATOM 2170 CG LYS A 139 19.190 0.295 -3.762 1.00 0.00 C ATOM 2171 CD LYS A 139 19.980 -0.762 -3.009 1.00 0.00 C ATOM 2172 CE LYS A 139 20.528 -1.825 -3.950 1.00 0.00 C ATOM 2173 NZ LYS A 139 21.608 -2.627 -3.312 1.00 0.00 N ATOM 0 H LYS A 139 16.146 -1.600 -5.494 1.00 0.00 H new ATOM 0 HA LYS A 139 17.356 -1.503 -2.902 1.00 0.00 H new ATOM 0 HB2 LYS A 139 18.450 -1.123 -5.182 1.00 0.00 H new ATOM 0 HB3 LYS A 139 17.642 0.432 -5.231 1.00 0.00 H new ATOM 0 HG2 LYS A 139 19.855 0.837 -4.434 1.00 0.00 H new ATOM 0 HG3 LYS A 139 18.789 1.022 -3.056 1.00 0.00 H new ATOM 0 HD2 LYS A 139 20.803 -0.289 -2.473 1.00 0.00 H new ATOM 0 HD3 LYS A 139 19.341 -1.231 -2.261 1.00 0.00 H new ATOM 0 HE2 LYS A 139 19.719 -2.487 -4.261 1.00 0.00 H new ATOM 0 HE3 LYS A 139 20.914 -1.348 -4.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 21.955 -3.340 -3.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 22.391 -1.999 -3.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 21.234 -3.103 -2.466 1.00 0.00 H new ATOM 2187 N LYS A 140 15.005 0.598 -3.588 1.00 0.00 N ATOM 2188 CA LYS A 140 14.177 1.673 -3.054 1.00 0.00 C ATOM 2189 C LYS A 140 13.283 1.164 -1.928 1.00 0.00 C ATOM 2190 O LYS A 140 12.807 1.941 -1.100 1.00 0.00 O ATOM 2191 CB LYS A 140 13.319 2.283 -4.165 1.00 0.00 C ATOM 2192 CG LYS A 140 14.022 3.384 -4.941 1.00 0.00 C ATOM 2193 CD LYS A 140 13.339 3.651 -6.272 1.00 0.00 C ATOM 2194 CE LYS A 140 11.922 4.170 -6.077 1.00 0.00 C ATOM 2195 NZ LYS A 140 11.866 5.267 -5.071 1.00 0.00 N ATOM 0 H LYS A 140 14.618 0.138 -4.412 1.00 0.00 H new ATOM 0 HA LYS A 140 14.838 2.440 -2.650 1.00 0.00 H new ATOM 0 HB2 LYS A 140 13.022 1.495 -4.857 1.00 0.00 H new ATOM 0 HB3 LYS A 140 12.405 2.685 -3.728 1.00 0.00 H new ATOM 0 HG2 LYS A 140 14.034 4.298 -4.347 1.00 0.00 H new ATOM 0 HG3 LYS A 140 15.061 3.102 -5.114 1.00 0.00 H new ATOM 0 HD2 LYS A 140 13.919 4.378 -6.840 1.00 0.00 H new ATOM 0 HD3 LYS A 140 13.314 2.733 -6.860 1.00 0.00 H new ATOM 0 HE2 LYS A 140 11.533 4.531 -7.029 1.00 0.00 H new ATOM 0 HE3 LYS A 140 11.276 3.352 -5.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 10.961 5.772 -5.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 11.948 4.866 -4.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 12.650 5.930 -5.237 1.00 0.00 H new ATOM 2209 N HIS A 141 13.059 -0.146 -1.903 1.00 0.00 N ATOM 2210 CA HIS A 141 12.223 -0.760 -0.877 1.00 0.00 C ATOM 2211 C HIS A 141 13.014 -0.977 0.410 1.00 0.00 C ATOM 2212 O HIS A 141 12.468 -1.429 1.416 1.00 0.00 O ATOM 2213 CB HIS A 141 11.661 -2.091 -1.375 1.00 0.00 C ATOM 2214 CG HIS A 141 11.040 -2.922 -0.295 1.00 0.00 C ATOM 2215 ND1 HIS A 141 9.778 -2.684 0.205 1.00 0.00 N ATOM 2216 CD2 HIS A 141 11.516 -3.994 0.381 1.00 0.00 C ATOM 2217 CE1 HIS A 141 9.503 -3.573 1.143 1.00 0.00 C ATOM 2218 NE2 HIS A 141 10.542 -4.380 1.269 1.00 0.00 N ATOM 0 H HIS A 141 13.445 -0.803 -2.581 1.00 0.00 H new ATOM 0 HA HIS A 141 11.396 -0.083 -0.665 1.00 0.00 H new ATOM 0 HB2 HIS A 141 10.915 -1.895 -2.145 1.00 0.00 H new ATOM 0 HB3 HIS A 141 12.462 -2.661 -1.845 1.00 0.00 H new ATOM 0 HD1 HIS A 141 9.154 -1.938 -0.101 1.00 0.00 H new ATOM 0 HD2 HIS A 141 12.482 -4.459 0.247 1.00 0.00 H new ATOM 0 HE1 HIS A 141 8.586 -3.630 1.710 1.00 0.00 H new ATOM 2226 N MET A 142 14.302 -0.653 0.369 1.00 0.00 N ATOM 2227 CA MET A 142 15.167 -0.813 1.532 1.00 0.00 C ATOM 2228 C MET A 142 15.132 0.433 2.411 1.00 0.00 C ATOM 2229 O MET A 142 15.502 0.387 3.585 1.00 0.00 O ATOM 2230 CB MET A 142 16.604 -1.099 1.090 1.00 0.00 C ATOM 2231 CG MET A 142 16.697 -1.838 -0.235 1.00 0.00 C ATOM 2232 SD MET A 142 18.100 -2.969 -0.303 1.00 0.00 S ATOM 2233 CE MET A 142 17.280 -4.501 -0.736 1.00 0.00 C ATOM 0 H MET A 142 14.770 -0.278 -0.456 1.00 0.00 H new ATOM 0 HA MET A 142 14.798 -1.658 2.114 1.00 0.00 H new ATOM 0 HB2 MET A 142 17.145 -0.156 1.009 1.00 0.00 H new ATOM 0 HB3 MET A 142 17.102 -1.687 1.861 1.00 0.00 H new ATOM 0 HG2 MET A 142 15.776 -2.397 -0.400 1.00 0.00 H new ATOM 0 HG3 MET A 142 16.780 -1.114 -1.045 1.00 0.00 H new ATOM 0 HE1 MET A 142 17.530 -5.267 -0.002 1.00 0.00 H new ATOM 0 HE2 MET A 142 16.201 -4.346 -0.746 1.00 0.00 H new ATOM 0 HE3 MET A 142 17.609 -4.823 -1.724 1.00 0.00 H new ATOM 2243 N HIS A 143 14.684 1.545 1.837 1.00 0.00 N ATOM 2244 CA HIS A 143 14.600 2.803 2.569 1.00 0.00 C ATOM 2245 C HIS A 143 13.681 2.666 3.780 1.00 0.00 C ATOM 2246 O HIS A 143 13.753 3.459 4.719 1.00 0.00 O ATOM 2247 CB HIS A 143 14.093 3.918 1.654 1.00 0.00 C ATOM 2248 CG HIS A 143 12.647 3.782 1.289 1.00 0.00 C ATOM 2249 ND1 HIS A 143 11.684 3.349 2.176 1.00 0.00 N ATOM 2250 CD2 HIS A 143 12.001 4.027 0.125 1.00 0.00 C ATOM 2251 CE1 HIS A 143 10.509 3.332 1.572 1.00 0.00 C ATOM 2252 NE2 HIS A 143 10.674 3.739 0.327 1.00 0.00 N ATOM 0 H HIS A 143 14.374 1.600 0.867 1.00 0.00 H new ATOM 0 HA HIS A 143 15.600 3.058 2.920 1.00 0.00 H new ATOM 0 HB2 HIS A 143 14.246 4.878 2.146 1.00 0.00 H new ATOM 0 HB3 HIS A 143 14.690 3.928 0.742 1.00 0.00 H new ATOM 0 HD2 HIS A 143 12.447 4.383 -0.792 1.00 0.00 H new ATOM 0 HE1 HIS A 143 9.572 3.035 2.021 1.00 0.00 H new ATOM 0 HE2 HIS A 143 9.936 3.825 -0.371 1.00 0.00 H new ATOM 2260 N VAL A 144 12.818 1.656 3.751 1.00 0.00 N ATOM 2261 CA VAL A 144 11.886 1.416 4.846 1.00 0.00 C ATOM 2262 C VAL A 144 12.409 0.336 5.786 1.00 0.00 C ATOM 2263 O VAL A 144 11.974 0.232 6.934 1.00 0.00 O ATOM 2264 CB VAL A 144 10.500 0.996 4.321 1.00 0.00 C ATOM 2265 CG1 VAL A 144 10.622 0.341 2.954 1.00 0.00 C ATOM 2266 CG2 VAL A 144 9.817 0.063 5.309 1.00 0.00 C ATOM 0 H VAL A 144 12.745 0.991 2.981 1.00 0.00 H new ATOM 0 HA VAL A 144 11.791 2.354 5.392 1.00 0.00 H new ATOM 0 HB VAL A 144 9.885 1.890 4.215 1.00 0.00 H new ATOM 0 HG11 VAL A 144 9.633 0.051 2.600 1.00 0.00 H new ATOM 0 HG12 VAL A 144 11.067 1.046 2.251 1.00 0.00 H new ATOM 0 HG13 VAL A 144 11.254 -0.544 3.030 1.00 0.00 H new ATOM 0 HG21 VAL A 144 8.839 -0.224 4.922 1.00 0.00 H new ATOM 0 HG22 VAL A 144 10.428 -0.829 5.449 1.00 0.00 H new ATOM 0 HG23 VAL A 144 9.694 0.572 6.265 1.00 0.00 H new ATOM 2276 N HIS A 145 13.347 -0.467 5.293 1.00 0.00 N ATOM 2277 CA HIS A 145 13.931 -1.540 6.090 1.00 0.00 C ATOM 2278 C HIS A 145 14.865 -0.977 7.157 1.00 0.00 C ATOM 2279 O HIS A 145 14.894 -1.460 8.289 1.00 0.00 O ATOM 2280 CB HIS A 145 14.693 -2.515 5.191 1.00 0.00 C ATOM 2281 CG HIS A 145 13.836 -3.606 4.628 1.00 0.00 C ATOM 2282 ND1 HIS A 145 13.119 -4.482 5.415 1.00 0.00 N ATOM 2283 CD2 HIS A 145 13.580 -3.959 3.346 1.00 0.00 C ATOM 2284 CE1 HIS A 145 12.462 -5.328 4.642 1.00 0.00 C ATOM 2285 NE2 HIS A 145 12.724 -5.032 3.382 1.00 0.00 N ATOM 0 H HIS A 145 13.719 -0.395 4.346 1.00 0.00 H new ATOM 0 HA HIS A 145 13.120 -2.073 6.586 1.00 0.00 H new ATOM 0 HB2 HIS A 145 15.146 -1.960 4.370 1.00 0.00 H new ATOM 0 HB3 HIS A 145 15.507 -2.962 5.762 1.00 0.00 H new ATOM 0 HD2 HIS A 145 13.976 -3.485 2.460 1.00 0.00 H new ATOM 0 HE1 HIS A 145 11.819 -6.126 4.983 1.00 0.00 H new ATOM 0 HE2 HIS A 145 12.351 -5.521 2.568 1.00 0.00 H new