USER MOD reduce.3.24.130724 H: found=0, std=0, add=777, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 780 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 78 THR OG1 : rot -95:sc= 1.25 USER MOD Set 1.2: A 79 HIS : no HD1:sc= 0 X(o=1.3,f=1.2) USER MOD Set 2.1: A 17 TYR OH : rot 180:sc= 1.02 USER MOD Set 2.2: A 72 LYS NZ :NH3+ -133:sc= 1.28 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 69:sc= 1.12 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 ASN :FLIP amide:sc= -0.134 F(o=-1.6!,f=-0.13) USER MOD Single : A 27 HIS : no HD1:sc= -0.0283 X(o=-0.028,f=-0.31) USER MOD Single : A 30 LYS NZ :NH3+ 158:sc=-0.00934 (180deg=-0.227) USER MOD Single : A 38 SER OG : rot -40:sc= 0.161 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0.00965 USER MOD Single : A 47 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 TYR OH : rot 17:sc= 0.0272 USER MOD Single : A 51 LYS NZ :NH3+ -138:sc= 0.909 (180deg=-0.714!) USER MOD Single : A 55 SER OG : rot 180:sc= 0.00524 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= -0.373 K(o=-0.37,f=-4!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ -170:sc= -0.204 (180deg=-0.513) USER MOD Single : A 75 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 HIS : no HD1:sc= -0.346 X(o=-0.35,f=-0.35) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -2.99! C(o=-3!,f=-3.6!) USER MOD Single : A 113 ASN : amide:sc=-0.000818 K(o=-0.00082,f=-0.76) USER MOD Single : A 114 TYR OH : rot -30:sc= -0.687 USER MOD Single : B 396 LYS NZ :NH3+ 164:sc= 1.95 (180deg=1.35) USER MOD ----------------------------------------------------------------- ATOM 139 N PHE A 14 -5.572 12.796 -9.788 1.00 0.00 N ATOM 140 CA PHE A 14 -4.889 11.754 -9.003 1.00 0.00 C ATOM 141 C PHE A 14 -5.418 11.624 -7.568 1.00 0.00 C ATOM 142 O PHE A 14 -4.644 11.570 -6.610 1.00 0.00 O ATOM 143 CB PHE A 14 -3.361 11.979 -9.005 1.00 0.00 C ATOM 144 CG PHE A 14 -2.909 13.341 -8.533 1.00 0.00 C ATOM 145 CD1 PHE A 14 -2.903 14.423 -9.397 1.00 0.00 C ATOM 146 CD2 PHE A 14 -2.487 13.532 -7.226 1.00 0.00 C ATOM 147 CE1 PHE A 14 -2.491 15.667 -8.966 1.00 0.00 C ATOM 148 CE2 PHE A 14 -2.073 14.776 -6.791 1.00 0.00 C ATOM 149 CZ PHE A 14 -2.076 15.844 -7.662 1.00 0.00 C ATOM 0 HA PHE A 14 -5.112 10.808 -9.496 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -2.898 11.221 -8.373 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -2.988 11.821 -10.017 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -3.224 14.292 -10.420 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -2.482 12.698 -6.540 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -2.493 16.503 -9.650 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -1.748 14.911 -5.770 1.00 0.00 H new ATOM 0 HZ PHE A 14 -1.754 16.818 -7.324 1.00 0.00 H new ATOM 159 N SER A 15 -6.737 11.541 -7.432 1.00 0.00 N ATOM 160 CA SER A 15 -7.363 11.411 -6.122 1.00 0.00 C ATOM 161 C SER A 15 -6.960 10.087 -5.481 1.00 0.00 C ATOM 162 O SER A 15 -6.601 10.039 -4.303 1.00 0.00 O ATOM 163 CB SER A 15 -8.884 11.519 -6.255 1.00 0.00 C ATOM 164 OG SER A 15 -9.236 12.649 -7.034 1.00 0.00 O ATOM 0 H SER A 15 -7.393 11.561 -8.213 1.00 0.00 H new ATOM 0 HA SER A 15 -7.020 12.220 -5.477 1.00 0.00 H new ATOM 0 HB2 SER A 15 -9.280 10.614 -6.717 1.00 0.00 H new ATOM 0 HB3 SER A 15 -9.337 11.596 -5.266 1.00 0.00 H new ATOM 0 HG SER A 15 -10.212 12.702 -7.111 1.00 0.00 H new ATOM 170 N GLU A 16 -6.992 9.021 -6.275 1.00 0.00 N ATOM 171 CA GLU A 16 -6.609 7.701 -5.800 1.00 0.00 C ATOM 172 C GLU A 16 -5.153 7.719 -5.370 1.00 0.00 C ATOM 173 O GLU A 16 -4.806 7.268 -4.278 1.00 0.00 O ATOM 174 CB GLU A 16 -6.809 6.648 -6.892 1.00 0.00 C ATOM 175 CG GLU A 16 -8.262 6.328 -7.180 1.00 0.00 C ATOM 176 CD GLU A 16 -8.935 7.350 -8.078 1.00 0.00 C ATOM 177 OE1 GLU A 16 -8.226 8.038 -8.847 1.00 0.00 O ATOM 178 OE2 GLU A 16 -10.177 7.469 -8.016 1.00 0.00 O ATOM 0 H GLU A 16 -7.281 9.049 -7.253 1.00 0.00 H new ATOM 0 HA GLU A 16 -7.242 7.442 -4.951 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -6.335 6.997 -7.810 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -6.297 5.732 -6.597 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -8.325 5.346 -7.648 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -8.807 6.267 -6.238 1.00 0.00 H new ATOM 185 N TYR A 17 -4.310 8.267 -6.237 1.00 0.00 N ATOM 186 CA TYR A 17 -2.884 8.366 -5.961 1.00 0.00 C ATOM 187 C TYR A 17 -2.627 9.126 -4.667 1.00 0.00 C ATOM 188 O TYR A 17 -1.793 8.722 -3.863 1.00 0.00 O ATOM 189 CB TYR A 17 -2.152 9.046 -7.117 1.00 0.00 C ATOM 190 CG TYR A 17 -1.750 8.091 -8.215 1.00 0.00 C ATOM 191 CD1 TYR A 17 -0.746 7.150 -8.011 1.00 0.00 C ATOM 192 CD2 TYR A 17 -2.371 8.128 -9.453 1.00 0.00 C ATOM 193 CE1 TYR A 17 -0.376 6.277 -9.015 1.00 0.00 C ATOM 194 CE2 TYR A 17 -2.006 7.259 -10.462 1.00 0.00 C ATOM 195 CZ TYR A 17 -1.010 6.335 -10.237 1.00 0.00 C ATOM 196 OH TYR A 17 -0.642 5.471 -11.240 1.00 0.00 O ATOM 0 H TYR A 17 -4.591 8.650 -7.139 1.00 0.00 H new ATOM 0 HA TYR A 17 -2.500 7.352 -5.850 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -2.792 9.822 -7.537 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -1.261 9.542 -6.732 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -0.249 7.101 -7.054 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -3.155 8.849 -9.632 1.00 0.00 H new ATOM 0 HE1 TYR A 17 0.406 5.552 -8.843 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -2.499 7.304 -11.422 1.00 0.00 H new ATOM 0 HH TYR A 17 -1.187 5.643 -12.036 1.00 0.00 H new ATOM 206 N SER A 18 -3.365 10.215 -4.464 1.00 0.00 N ATOM 207 CA SER A 18 -3.212 11.024 -3.263 1.00 0.00 C ATOM 208 C SER A 18 -3.563 10.217 -2.016 1.00 0.00 C ATOM 209 O SER A 18 -2.851 10.269 -1.017 1.00 0.00 O ATOM 210 CB SER A 18 -4.096 12.271 -3.345 1.00 0.00 C ATOM 211 OG SER A 18 -3.747 13.078 -4.459 1.00 0.00 O ATOM 0 H SER A 18 -4.073 10.555 -5.115 1.00 0.00 H new ATOM 0 HA SER A 18 -2.169 11.332 -3.193 1.00 0.00 H new ATOM 0 HB2 SER A 18 -5.142 11.974 -3.422 1.00 0.00 H new ATOM 0 HB3 SER A 18 -3.996 12.851 -2.428 1.00 0.00 H new ATOM 0 HG SER A 18 -3.994 12.616 -5.287 1.00 0.00 H new ATOM 217 N ARG A 19 -4.646 9.454 -2.090 1.00 0.00 N ATOM 218 CA ARG A 19 -5.086 8.644 -0.961 1.00 0.00 C ATOM 219 C ARG A 19 -4.049 7.582 -0.604 1.00 0.00 C ATOM 220 O ARG A 19 -3.843 7.270 0.568 1.00 0.00 O ATOM 221 CB ARG A 19 -6.427 7.977 -1.272 1.00 0.00 C ATOM 222 CG ARG A 19 -7.565 8.963 -1.479 1.00 0.00 C ATOM 223 CD ARG A 19 -7.769 9.845 -0.258 1.00 0.00 C ATOM 224 NE ARG A 19 -8.903 10.752 -0.420 1.00 0.00 N ATOM 225 CZ ARG A 19 -9.153 11.787 0.381 1.00 0.00 C ATOM 226 NH1 ARG A 19 -8.330 12.077 1.382 1.00 0.00 N ATOM 227 NH2 ARG A 19 -10.225 12.542 0.170 1.00 0.00 N ATOM 0 H ARG A 19 -5.235 9.379 -2.919 1.00 0.00 H new ATOM 0 HA ARG A 19 -5.206 9.307 -0.104 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -6.320 7.366 -2.168 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -6.686 7.303 -0.455 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -7.354 9.586 -2.348 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -8.485 8.419 -1.693 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -7.929 9.218 0.619 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -6.864 10.425 -0.075 1.00 0.00 H new ATOM 0 HE ARG A 19 -9.544 10.582 -1.195 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -7.500 11.506 1.542 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -8.528 12.871 1.991 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -10.855 12.329 -0.604 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -10.419 13.335 0.782 1.00 0.00 H new ATOM 241 N ILE A 20 -3.403 7.028 -1.619 1.00 0.00 N ATOM 242 CA ILE A 20 -2.387 6.007 -1.407 1.00 0.00 C ATOM 243 C ILE A 20 -1.078 6.638 -0.939 1.00 0.00 C ATOM 244 O ILE A 20 -0.477 6.189 0.035 1.00 0.00 O ATOM 245 CB ILE A 20 -2.158 5.169 -2.689 1.00 0.00 C ATOM 246 CG1 ILE A 20 -3.153 4.009 -2.756 1.00 0.00 C ATOM 247 CG2 ILE A 20 -0.734 4.633 -2.757 1.00 0.00 C ATOM 248 CD1 ILE A 20 -4.579 4.424 -3.044 1.00 0.00 C ATOM 0 H ILE A 20 -3.564 7.268 -2.597 1.00 0.00 H new ATOM 0 HA ILE A 20 -2.747 5.336 -0.627 1.00 0.00 H new ATOM 0 HB ILE A 20 -2.316 5.827 -3.544 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -2.828 3.311 -3.528 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -3.129 3.470 -1.809 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.608 4.050 -3.669 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -0.031 5.466 -2.759 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -0.542 3.999 -1.891 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -5.216 3.540 -3.074 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -4.928 5.096 -2.260 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -4.622 4.935 -4.006 1.00 0.00 H new ATOM 260 N SER A 21 -0.652 7.686 -1.631 1.00 0.00 N ATOM 261 CA SER A 21 0.578 8.392 -1.286 1.00 0.00 C ATOM 262 C SER A 21 0.497 8.936 0.142 1.00 0.00 C ATOM 263 O SER A 21 1.488 8.935 0.879 1.00 0.00 O ATOM 264 CB SER A 21 0.831 9.529 -2.281 1.00 0.00 C ATOM 265 OG SER A 21 2.013 10.245 -1.965 1.00 0.00 O ATOM 0 H SER A 21 -1.142 8.069 -2.439 1.00 0.00 H new ATOM 0 HA SER A 21 1.411 7.692 -1.340 1.00 0.00 H new ATOM 0 HB2 SER A 21 0.911 9.121 -3.289 1.00 0.00 H new ATOM 0 HB3 SER A 21 -0.020 10.211 -2.280 1.00 0.00 H new ATOM 0 HG SER A 21 2.146 10.962 -2.620 1.00 0.00 H new ATOM 271 N ASN A 22 -0.697 9.378 0.527 1.00 0.00 N ATOM 272 CA ASN A 22 -0.929 9.914 1.864 1.00 0.00 C ATOM 273 C ASN A 22 -0.630 8.861 2.924 1.00 0.00 C ATOM 274 O ASN A 22 -0.150 9.182 4.007 1.00 0.00 O ATOM 275 CB ASN A 22 -2.375 10.394 1.997 1.00 0.00 C ATOM 276 CG ASN A 22 -2.586 11.331 3.172 1.00 0.00 C ATOM 277 OD1 ASN A 22 -1.564 12.099 3.524 1.00 0.00 O flip ATOM 278 ND2 ASN A 22 -3.670 11.376 3.753 1.00 0.00 N flip ATOM 0 H ASN A 22 -1.523 9.375 -0.072 1.00 0.00 H new ATOM 0 HA ASN A 22 -0.258 10.760 2.016 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -2.669 10.901 1.078 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -3.030 9.530 2.107 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -4.434 10.770 3.454 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -3.804 12.019 4.533 1.00 0.00 H new ATOM 285 N LEU A 23 -0.898 7.601 2.596 1.00 0.00 N ATOM 286 CA LEU A 23 -0.645 6.502 3.520 1.00 0.00 C ATOM 287 C LEU A 23 0.843 6.397 3.834 1.00 0.00 C ATOM 288 O LEU A 23 1.228 6.153 4.978 1.00 0.00 O ATOM 289 CB LEU A 23 -1.157 5.175 2.934 1.00 0.00 C ATOM 290 CG LEU A 23 -0.363 3.921 3.337 1.00 0.00 C ATOM 291 CD1 LEU A 23 -1.284 2.731 3.504 1.00 0.00 C ATOM 292 CD2 LEU A 23 0.708 3.603 2.304 1.00 0.00 C ATOM 0 H LEU A 23 -1.290 7.316 1.698 1.00 0.00 H new ATOM 0 HA LEU A 23 -1.183 6.705 4.446 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -2.195 5.040 3.239 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -1.152 5.253 1.847 1.00 0.00 H new ATOM 0 HG LEU A 23 0.121 4.127 4.292 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -0.700 1.856 3.789 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -2.019 2.946 4.280 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -1.798 2.534 2.563 1.00 0.00 H new ATOM 0 HD21 LEU A 23 1.256 2.712 2.611 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.239 3.425 1.336 1.00 0.00 H new ATOM 0 HD23 LEU A 23 1.397 4.444 2.224 1.00 0.00 H new ATOM 304 N ILE A 24 1.669 6.594 2.811 1.00 0.00 N ATOM 305 CA ILE A 24 3.112 6.503 2.963 1.00 0.00 C ATOM 306 C ILE A 24 3.622 7.520 3.969 1.00 0.00 C ATOM 307 O ILE A 24 4.310 7.159 4.925 1.00 0.00 O ATOM 308 CB ILE A 24 3.838 6.678 1.605 1.00 0.00 C ATOM 309 CG1 ILE A 24 3.838 5.352 0.847 1.00 0.00 C ATOM 310 CG2 ILE A 24 5.267 7.179 1.795 1.00 0.00 C ATOM 311 CD1 ILE A 24 4.520 4.232 1.604 1.00 0.00 C ATOM 0 H ILE A 24 1.359 6.818 1.865 1.00 0.00 H new ATOM 0 HA ILE A 24 3.334 5.504 3.339 1.00 0.00 H new ATOM 0 HB ILE A 24 3.300 7.428 1.025 1.00 0.00 H new ATOM 0 HG12 ILE A 24 2.809 5.063 0.633 1.00 0.00 H new ATOM 0 HG13 ILE A 24 4.336 5.489 -0.113 1.00 0.00 H new ATOM 0 HG21 ILE A 24 5.746 7.290 0.822 1.00 0.00 H new ATOM 0 HG22 ILE A 24 5.250 8.143 2.303 1.00 0.00 H new ATOM 0 HG23 ILE A 24 5.827 6.462 2.395 1.00 0.00 H new ATOM 0 HD11 ILE A 24 4.485 3.318 1.011 1.00 0.00 H new ATOM 0 HD12 ILE A 24 5.559 4.502 1.795 1.00 0.00 H new ATOM 0 HD13 ILE A 24 4.007 4.069 2.552 1.00 0.00 H new ATOM 323 N VAL A 25 3.257 8.776 3.777 1.00 0.00 N ATOM 324 CA VAL A 25 3.703 9.828 4.678 1.00 0.00 C ATOM 325 C VAL A 25 3.055 9.690 6.056 1.00 0.00 C ATOM 326 O VAL A 25 3.734 9.809 7.071 1.00 0.00 O ATOM 327 CB VAL A 25 3.447 11.241 4.102 1.00 0.00 C ATOM 328 CG1 VAL A 25 4.400 11.525 2.953 1.00 0.00 C ATOM 329 CG2 VAL A 25 2.007 11.406 3.643 1.00 0.00 C ATOM 0 H VAL A 25 2.659 9.092 3.013 1.00 0.00 H new ATOM 0 HA VAL A 25 4.781 9.708 4.787 1.00 0.00 H new ATOM 0 HB VAL A 25 3.627 11.961 4.901 1.00 0.00 H new ATOM 0 HG11 VAL A 25 4.207 12.523 2.559 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.428 11.469 3.311 1.00 0.00 H new ATOM 0 HG13 VAL A 25 4.249 10.788 2.164 1.00 0.00 H new ATOM 0 HG21 VAL A 25 1.865 12.411 3.245 1.00 0.00 H new ATOM 0 HG22 VAL A 25 1.786 10.673 2.867 1.00 0.00 H new ATOM 0 HG23 VAL A 25 1.336 11.253 4.488 1.00 0.00 H new ATOM 339 N LEU A 26 1.752 9.404 6.084 1.00 0.00 N ATOM 340 CA LEU A 26 1.018 9.242 7.341 1.00 0.00 C ATOM 341 C LEU A 26 1.634 8.149 8.195 1.00 0.00 C ATOM 342 O LEU A 26 1.849 8.326 9.397 1.00 0.00 O ATOM 343 CB LEU A 26 -0.441 8.886 7.072 1.00 0.00 C ATOM 344 CG LEU A 26 -1.394 10.066 6.921 1.00 0.00 C ATOM 345 CD1 LEU A 26 -2.708 9.596 6.327 1.00 0.00 C ATOM 346 CD2 LEU A 26 -1.629 10.732 8.266 1.00 0.00 C ATOM 0 H LEU A 26 1.182 9.279 5.248 1.00 0.00 H new ATOM 0 HA LEU A 26 1.073 10.192 7.873 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -0.488 8.287 6.163 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -0.798 8.257 7.887 1.00 0.00 H new ATOM 0 HG LEU A 26 -0.945 10.798 6.249 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -3.384 10.445 6.222 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -2.527 9.153 5.348 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -3.159 8.852 6.984 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.312 11.573 8.141 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -2.064 10.011 8.958 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.680 11.091 8.665 1.00 0.00 H new ATOM 358 N HIS A 27 1.907 7.018 7.571 1.00 0.00 N ATOM 359 CA HIS A 27 2.492 5.893 8.275 1.00 0.00 C ATOM 360 C HIS A 27 3.942 6.180 8.649 1.00 0.00 C ATOM 361 O HIS A 27 4.351 5.908 9.770 1.00 0.00 O ATOM 362 CB HIS A 27 2.404 4.623 7.430 1.00 0.00 C ATOM 363 CG HIS A 27 2.545 3.364 8.230 1.00 0.00 C ATOM 364 ND1 HIS A 27 3.403 2.340 7.883 1.00 0.00 N ATOM 365 CD2 HIS A 27 1.920 2.960 9.360 1.00 0.00 C ATOM 366 CE1 HIS A 27 3.297 1.363 8.767 1.00 0.00 C ATOM 367 NE2 HIS A 27 2.405 1.715 9.670 1.00 0.00 N ATOM 0 H HIS A 27 1.733 6.855 6.579 1.00 0.00 H new ATOM 0 HA HIS A 27 1.925 5.739 9.193 1.00 0.00 H new ATOM 0 HB2 HIS A 27 1.447 4.608 6.909 1.00 0.00 H new ATOM 0 HB3 HIS A 27 3.182 4.649 6.667 1.00 0.00 H new ATOM 0 HD2 HIS A 27 1.178 3.515 9.915 1.00 0.00 H new ATOM 0 HE1 HIS A 27 3.848 0.434 8.752 1.00 0.00 H new ATOM 0 HE2 HIS A 27 2.120 1.152 10.471 1.00 0.00 H new ATOM 376 N LEU A 28 4.712 6.732 7.715 1.00 0.00 N ATOM 377 CA LEU A 28 6.121 7.037 7.971 1.00 0.00 C ATOM 378 C LEU A 28 6.293 7.980 9.160 1.00 0.00 C ATOM 379 O LEU A 28 7.063 7.681 10.077 1.00 0.00 O ATOM 380 CB LEU A 28 6.782 7.640 6.725 1.00 0.00 C ATOM 381 CG LEU A 28 8.213 8.146 6.926 1.00 0.00 C ATOM 382 CD1 LEU A 28 9.126 7.017 7.384 1.00 0.00 C ATOM 383 CD2 LEU A 28 8.740 8.768 5.645 1.00 0.00 C ATOM 0 H LEU A 28 4.389 6.977 6.779 1.00 0.00 H new ATOM 0 HA LEU A 28 6.613 6.095 8.216 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.787 6.888 5.936 1.00 0.00 H new ATOM 0 HB3 LEU A 28 6.167 8.468 6.372 1.00 0.00 H new ATOM 0 HG LEU A 28 8.199 8.910 7.703 1.00 0.00 H new ATOM 0 HD11 LEU A 28 10.137 7.400 7.520 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.760 6.614 8.328 1.00 0.00 H new ATOM 0 HD13 LEU A 28 9.135 6.228 6.632 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.758 9.123 5.805 1.00 0.00 H new ATOM 0 HD22 LEU A 28 8.736 8.022 4.850 1.00 0.00 H new ATOM 0 HD23 LEU A 28 8.105 9.606 5.359 1.00 0.00 H new ATOM 395 N ARG A 29 5.566 9.093 9.166 1.00 0.00 N ATOM 396 CA ARG A 29 5.672 10.058 10.257 1.00 0.00 C ATOM 397 C ARG A 29 5.269 9.432 11.590 1.00 0.00 C ATOM 398 O ARG A 29 5.834 9.761 12.629 1.00 0.00 O ATOM 399 CB ARG A 29 4.835 11.311 9.972 1.00 0.00 C ATOM 400 CG ARG A 29 3.351 11.048 9.790 1.00 0.00 C ATOM 401 CD ARG A 29 2.654 12.236 9.142 1.00 0.00 C ATOM 402 NE ARG A 29 3.331 12.678 7.921 1.00 0.00 N ATOM 403 CZ ARG A 29 2.788 13.495 7.017 1.00 0.00 C ATOM 404 NH1 ARG A 29 1.552 13.947 7.171 1.00 0.00 N ATOM 405 NH2 ARG A 29 3.483 13.862 5.948 1.00 0.00 N ATOM 0 H ARG A 29 4.902 9.349 8.435 1.00 0.00 H new ATOM 0 HA ARG A 29 6.717 10.359 10.328 1.00 0.00 H new ATOM 0 HB2 ARG A 29 4.968 12.016 10.792 1.00 0.00 H new ATOM 0 HB3 ARG A 29 5.219 11.792 9.073 1.00 0.00 H new ATOM 0 HG2 ARG A 29 3.210 10.160 9.174 1.00 0.00 H new ATOM 0 HG3 ARG A 29 2.895 10.840 10.758 1.00 0.00 H new ATOM 0 HD2 ARG A 29 1.624 11.967 8.907 1.00 0.00 H new ATOM 0 HD3 ARG A 29 2.613 13.062 9.852 1.00 0.00 H new ATOM 0 HE ARG A 29 4.278 12.340 7.751 1.00 0.00 H new ATOM 0 HH11 ARG A 29 1.006 13.671 7.987 1.00 0.00 H new ATOM 0 HH12 ARG A 29 1.147 14.571 6.474 1.00 0.00 H new ATOM 0 HH21 ARG A 29 4.435 13.519 5.816 1.00 0.00 H new ATOM 0 HH22 ARG A 29 3.066 14.487 5.258 1.00 0.00 H new ATOM 419 N LYS A 30 4.292 8.535 11.558 1.00 0.00 N ATOM 420 CA LYS A 30 3.837 7.856 12.767 1.00 0.00 C ATOM 421 C LYS A 30 4.866 6.820 13.214 1.00 0.00 C ATOM 422 O LYS A 30 5.151 6.672 14.406 1.00 0.00 O ATOM 423 CB LYS A 30 2.485 7.184 12.523 1.00 0.00 C ATOM 424 CG LYS A 30 1.866 6.584 13.775 1.00 0.00 C ATOM 425 CD LYS A 30 0.401 6.246 13.562 1.00 0.00 C ATOM 426 CE LYS A 30 -0.505 7.124 14.412 1.00 0.00 C ATOM 427 NZ LYS A 30 -0.293 8.572 14.139 1.00 0.00 N ATOM 0 H LYS A 30 3.799 8.260 10.709 1.00 0.00 H new ATOM 0 HA LYS A 30 3.722 8.598 13.557 1.00 0.00 H new ATOM 0 HB2 LYS A 30 1.796 7.916 12.103 1.00 0.00 H new ATOM 0 HB3 LYS A 30 2.609 6.399 11.777 1.00 0.00 H new ATOM 0 HG2 LYS A 30 2.411 5.683 14.056 1.00 0.00 H new ATOM 0 HG3 LYS A 30 1.962 7.287 14.603 1.00 0.00 H new ATOM 0 HD2 LYS A 30 0.147 6.372 12.509 1.00 0.00 H new ATOM 0 HD3 LYS A 30 0.229 5.198 13.809 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -1.546 6.867 14.217 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -0.319 6.923 15.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -1.137 9.107 14.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 0.532 8.909 14.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -0.126 8.713 13.122 1.00 0.00 H new ATOM 441 N VAL A 31 5.433 6.124 12.239 1.00 0.00 N ATOM 442 CA VAL A 31 6.422 5.091 12.494 1.00 0.00 C ATOM 443 C VAL A 31 7.673 5.668 13.145 1.00 0.00 C ATOM 444 O VAL A 31 8.111 5.182 14.182 1.00 0.00 O ATOM 445 CB VAL A 31 6.799 4.348 11.191 1.00 0.00 C ATOM 446 CG1 VAL A 31 8.126 3.622 11.332 1.00 0.00 C ATOM 447 CG2 VAL A 31 5.702 3.367 10.805 1.00 0.00 C ATOM 0 H VAL A 31 5.220 6.260 11.251 1.00 0.00 H new ATOM 0 HA VAL A 31 5.973 4.378 13.185 1.00 0.00 H new ATOM 0 HB VAL A 31 6.905 5.092 10.401 1.00 0.00 H new ATOM 0 HG11 VAL A 31 8.362 3.110 10.399 1.00 0.00 H new ATOM 0 HG12 VAL A 31 8.912 4.342 11.560 1.00 0.00 H new ATOM 0 HG13 VAL A 31 8.058 2.892 12.139 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.982 2.852 9.886 1.00 0.00 H new ATOM 0 HG22 VAL A 31 5.569 2.638 11.604 1.00 0.00 H new ATOM 0 HG23 VAL A 31 4.769 3.908 10.648 1.00 0.00 H new ATOM 457 N GLU A 32 8.235 6.713 12.553 1.00 0.00 N ATOM 458 CA GLU A 32 9.439 7.333 13.098 1.00 0.00 C ATOM 459 C GLU A 32 9.148 7.990 14.446 1.00 0.00 C ATOM 460 O GLU A 32 10.027 8.107 15.298 1.00 0.00 O ATOM 461 CB GLU A 32 10.025 8.351 12.115 1.00 0.00 C ATOM 462 CG GLU A 32 9.095 9.508 11.790 1.00 0.00 C ATOM 463 CD GLU A 32 9.766 10.564 10.938 1.00 0.00 C ATOM 464 OE1 GLU A 32 10.499 11.404 11.497 1.00 0.00 O ATOM 465 OE2 GLU A 32 9.571 10.557 9.705 1.00 0.00 O ATOM 0 H GLU A 32 7.881 7.148 11.701 1.00 0.00 H new ATOM 0 HA GLU A 32 10.180 6.549 13.253 1.00 0.00 H new ATOM 0 HB2 GLU A 32 10.951 8.749 12.530 1.00 0.00 H new ATOM 0 HB3 GLU A 32 10.285 7.838 11.189 1.00 0.00 H new ATOM 0 HG2 GLU A 32 8.216 9.129 11.269 1.00 0.00 H new ATOM 0 HG3 GLU A 32 8.745 9.961 12.717 1.00 0.00 H new ATOM 472 N GLU A 33 7.905 8.406 14.628 1.00 0.00 N ATOM 473 CA GLU A 33 7.477 9.049 15.860 1.00 0.00 C ATOM 474 C GLU A 33 7.468 8.064 17.026 1.00 0.00 C ATOM 475 O GLU A 33 7.910 8.392 18.126 1.00 0.00 O ATOM 476 CB GLU A 33 6.083 9.641 15.663 1.00 0.00 C ATOM 477 CG GLU A 33 5.534 10.375 16.871 1.00 0.00 C ATOM 478 CD GLU A 33 4.223 11.062 16.564 1.00 0.00 C ATOM 479 OE1 GLU A 33 3.160 10.420 16.706 1.00 0.00 O ATOM 480 OE2 GLU A 33 4.244 12.242 16.166 1.00 0.00 O ATOM 0 H GLU A 33 7.168 8.308 13.930 1.00 0.00 H new ATOM 0 HA GLU A 33 8.185 9.842 16.101 1.00 0.00 H new ATOM 0 HB2 GLU A 33 6.110 10.329 14.818 1.00 0.00 H new ATOM 0 HB3 GLU A 33 5.395 8.838 15.398 1.00 0.00 H new ATOM 0 HG2 GLU A 33 5.392 9.670 17.690 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.261 11.114 17.208 1.00 0.00 H new ATOM 487 N GLU A 34 6.969 6.858 16.788 1.00 0.00 N ATOM 488 CA GLU A 34 6.888 5.852 17.842 1.00 0.00 C ATOM 489 C GLU A 34 7.984 4.792 17.724 1.00 0.00 C ATOM 490 O GLU A 34 8.860 4.700 18.584 1.00 0.00 O ATOM 491 CB GLU A 34 5.510 5.197 17.825 1.00 0.00 C ATOM 492 CG GLU A 34 4.377 6.187 18.019 1.00 0.00 C ATOM 493 CD GLU A 34 3.022 5.522 18.037 1.00 0.00 C ATOM 494 OE1 GLU A 34 2.927 4.363 18.492 1.00 0.00 O ATOM 495 OE2 GLU A 34 2.040 6.155 17.598 1.00 0.00 O ATOM 0 H GLU A 34 6.616 6.553 15.881 1.00 0.00 H new ATOM 0 HA GLU A 34 7.042 6.360 18.794 1.00 0.00 H new ATOM 0 HB2 GLU A 34 5.373 4.678 16.876 1.00 0.00 H new ATOM 0 HB3 GLU A 34 5.463 4.442 18.610 1.00 0.00 H new ATOM 0 HG2 GLU A 34 4.526 6.725 18.955 1.00 0.00 H new ATOM 0 HG3 GLU A 34 4.404 6.926 17.218 1.00 0.00 H new ATOM 502 N GLU A 35 7.934 3.997 16.662 1.00 0.00 N ATOM 503 CA GLU A 35 8.913 2.930 16.442 1.00 0.00 C ATOM 504 C GLU A 35 10.315 3.490 16.212 1.00 0.00 C ATOM 505 O GLU A 35 11.306 2.897 16.647 1.00 0.00 O ATOM 506 CB GLU A 35 8.505 2.069 15.243 1.00 0.00 C ATOM 507 CG GLU A 35 7.371 1.104 15.540 1.00 0.00 C ATOM 508 CD GLU A 35 7.772 0.002 16.502 1.00 0.00 C ATOM 509 OE1 GLU A 35 8.967 -0.353 16.553 1.00 0.00 O ATOM 510 OE2 GLU A 35 6.892 -0.522 17.213 1.00 0.00 O ATOM 0 H GLU A 35 7.223 4.069 15.934 1.00 0.00 H new ATOM 0 HA GLU A 35 8.932 2.317 17.343 1.00 0.00 H new ATOM 0 HB2 GLU A 35 8.208 2.722 14.422 1.00 0.00 H new ATOM 0 HB3 GLU A 35 9.372 1.503 14.902 1.00 0.00 H new ATOM 0 HG2 GLU A 35 6.530 1.657 15.959 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.026 0.658 14.607 1.00 0.00 H new ATOM 517 N ASP A 36 10.381 4.622 15.512 1.00 0.00 N ATOM 518 CA ASP A 36 11.653 5.280 15.197 1.00 0.00 C ATOM 519 C ASP A 36 12.497 4.382 14.290 1.00 0.00 C ATOM 520 O ASP A 36 13.726 4.401 14.325 1.00 0.00 O ATOM 521 CB ASP A 36 12.406 5.631 16.490 1.00 0.00 C ATOM 522 CG ASP A 36 13.636 6.487 16.256 1.00 0.00 C ATOM 523 OD1 ASP A 36 13.566 7.453 15.469 1.00 0.00 O ATOM 524 OD2 ASP A 36 14.683 6.199 16.868 1.00 0.00 O ATOM 0 H ASP A 36 9.561 5.108 15.148 1.00 0.00 H new ATOM 0 HA ASP A 36 11.453 6.209 14.664 1.00 0.00 H new ATOM 0 HB2 ASP A 36 11.730 6.156 17.165 1.00 0.00 H new ATOM 0 HB3 ASP A 36 12.703 4.709 16.990 1.00 0.00 H new ATOM 529 N GLU A 37 11.807 3.591 13.474 1.00 0.00 N ATOM 530 CA GLU A 37 12.441 2.668 12.544 1.00 0.00 C ATOM 531 C GLU A 37 11.513 2.405 11.368 1.00 0.00 C ATOM 532 O GLU A 37 10.515 1.701 11.503 1.00 0.00 O ATOM 533 CB GLU A 37 12.790 1.348 13.241 1.00 0.00 C ATOM 534 CG GLU A 37 14.160 1.342 13.899 1.00 0.00 C ATOM 535 CD GLU A 37 15.293 1.279 12.896 1.00 0.00 C ATOM 536 OE1 GLU A 37 15.648 2.332 12.323 1.00 0.00 O ATOM 537 OE2 GLU A 37 15.842 0.179 12.686 1.00 0.00 O ATOM 0 H GLU A 37 10.788 3.574 13.441 1.00 0.00 H new ATOM 0 HA GLU A 37 13.365 3.120 12.182 1.00 0.00 H new ATOM 0 HB2 GLU A 37 12.034 1.137 13.997 1.00 0.00 H new ATOM 0 HB3 GLU A 37 12.745 0.540 12.511 1.00 0.00 H new ATOM 0 HG2 GLU A 37 14.269 2.239 14.508 1.00 0.00 H new ATOM 0 HG3 GLU A 37 14.230 0.489 14.574 1.00 0.00 H new ATOM 544 N SER A 38 11.843 2.984 10.226 1.00 0.00 N ATOM 545 CA SER A 38 11.041 2.825 9.013 1.00 0.00 C ATOM 546 C SER A 38 11.129 1.396 8.469 1.00 0.00 C ATOM 547 O SER A 38 10.372 1.017 7.568 1.00 0.00 O ATOM 548 CB SER A 38 11.512 3.821 7.948 1.00 0.00 C ATOM 549 OG SER A 38 10.557 3.974 6.910 1.00 0.00 O ATOM 0 H SER A 38 12.667 3.574 10.108 1.00 0.00 H new ATOM 0 HA SER A 38 9.999 3.024 9.265 1.00 0.00 H new ATOM 0 HB2 SER A 38 11.701 4.788 8.413 1.00 0.00 H new ATOM 0 HB3 SER A 38 12.457 3.481 7.525 1.00 0.00 H new ATOM 0 HG SER A 38 10.173 3.100 6.688 1.00 0.00 H new ATOM 555 N ALA A 39 12.053 0.612 9.019 1.00 0.00 N ATOM 556 CA ALA A 39 12.251 -0.770 8.601 1.00 0.00 C ATOM 557 C ALA A 39 11.108 -1.665 9.078 1.00 0.00 C ATOM 558 O ALA A 39 11.168 -2.253 10.158 1.00 0.00 O ATOM 559 CB ALA A 39 13.588 -1.287 9.118 1.00 0.00 C ATOM 0 H ALA A 39 12.681 0.916 9.763 1.00 0.00 H new ATOM 0 HA ALA A 39 12.259 -0.797 7.511 1.00 0.00 H new ATOM 0 HB1 ALA A 39 13.726 -2.320 8.800 1.00 0.00 H new ATOM 0 HB2 ALA A 39 14.395 -0.673 8.717 1.00 0.00 H new ATOM 0 HB3 ALA A 39 13.601 -1.238 10.207 1.00 0.00 H new ATOM 565 N LEU A 40 10.065 -1.763 8.262 1.00 0.00 N ATOM 566 CA LEU A 40 8.902 -2.575 8.590 1.00 0.00 C ATOM 567 C LEU A 40 8.422 -3.335 7.356 1.00 0.00 C ATOM 568 O LEU A 40 8.751 -2.964 6.226 1.00 0.00 O ATOM 569 CB LEU A 40 7.766 -1.693 9.123 1.00 0.00 C ATOM 570 CG LEU A 40 8.055 -0.952 10.432 1.00 0.00 C ATOM 571 CD1 LEU A 40 6.933 0.022 10.755 1.00 0.00 C ATOM 572 CD2 LEU A 40 8.240 -1.939 11.573 1.00 0.00 C ATOM 0 H LEU A 40 10.002 -1.286 7.363 1.00 0.00 H new ATOM 0 HA LEU A 40 9.190 -3.289 9.362 1.00 0.00 H new ATOM 0 HB2 LEU A 40 7.514 -0.957 8.359 1.00 0.00 H new ATOM 0 HB3 LEU A 40 6.884 -2.317 9.268 1.00 0.00 H new ATOM 0 HG LEU A 40 8.979 -0.387 10.307 1.00 0.00 H new ATOM 0 HD11 LEU A 40 7.157 0.538 11.688 1.00 0.00 H new ATOM 0 HD12 LEU A 40 6.841 0.751 9.950 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.995 -0.524 10.859 1.00 0.00 H new ATOM 0 HD21 LEU A 40 8.445 -1.395 12.495 1.00 0.00 H new ATOM 0 HD22 LEU A 40 7.332 -2.530 11.694 1.00 0.00 H new ATOM 0 HD23 LEU A 40 9.076 -2.601 11.349 1.00 0.00 H new ATOM 584 N LYS A 41 7.633 -4.379 7.576 1.00 0.00 N ATOM 585 CA LYS A 41 7.103 -5.197 6.490 1.00 0.00 C ATOM 586 C LYS A 41 6.076 -4.412 5.683 1.00 0.00 C ATOM 587 O LYS A 41 5.182 -3.779 6.240 1.00 0.00 O ATOM 588 CB LYS A 41 6.475 -6.476 7.050 1.00 0.00 C ATOM 589 CG LYS A 41 7.438 -7.305 7.886 1.00 0.00 C ATOM 590 CD LYS A 41 6.711 -8.362 8.700 1.00 0.00 C ATOM 591 CE LYS A 41 7.575 -8.875 9.841 1.00 0.00 C ATOM 592 NZ LYS A 41 8.682 -9.741 9.362 1.00 0.00 N ATOM 0 H LYS A 41 7.343 -4.682 8.506 1.00 0.00 H new ATOM 0 HA LYS A 41 7.925 -5.471 5.828 1.00 0.00 H new ATOM 0 HB2 LYS A 41 5.611 -6.211 7.660 1.00 0.00 H new ATOM 0 HB3 LYS A 41 6.107 -7.084 6.223 1.00 0.00 H new ATOM 0 HG2 LYS A 41 8.166 -7.786 7.232 1.00 0.00 H new ATOM 0 HG3 LYS A 41 7.995 -6.650 8.556 1.00 0.00 H new ATOM 0 HD2 LYS A 41 5.788 -7.944 9.101 1.00 0.00 H new ATOM 0 HD3 LYS A 41 6.430 -9.193 8.052 1.00 0.00 H new ATOM 0 HE2 LYS A 41 7.989 -8.029 10.389 1.00 0.00 H new ATOM 0 HE3 LYS A 41 6.955 -9.435 10.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 9.244 -10.067 10.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 8.288 -10.563 8.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 9.291 -9.200 8.715 1.00 0.00 H new ATOM 606 N ARG A 42 6.212 -4.443 4.368 1.00 0.00 N ATOM 607 CA ARG A 42 5.301 -3.716 3.495 1.00 0.00 C ATOM 608 C ARG A 42 3.961 -4.436 3.348 1.00 0.00 C ATOM 609 O ARG A 42 2.965 -3.829 2.957 1.00 0.00 O ATOM 610 CB ARG A 42 5.949 -3.468 2.133 1.00 0.00 C ATOM 611 CG ARG A 42 6.551 -2.073 1.999 1.00 0.00 C ATOM 612 CD ARG A 42 7.474 -1.738 3.166 1.00 0.00 C ATOM 613 NE ARG A 42 7.863 -0.325 3.174 1.00 0.00 N ATOM 614 CZ ARG A 42 8.476 0.277 4.198 1.00 0.00 C ATOM 615 NH1 ARG A 42 8.756 -0.395 5.307 1.00 0.00 N ATOM 616 NH2 ARG A 42 8.809 1.560 4.115 1.00 0.00 N ATOM 0 H ARG A 42 6.942 -4.962 3.881 1.00 0.00 H new ATOM 0 HA ARG A 42 5.095 -2.751 3.958 1.00 0.00 H new ATOM 0 HB2 ARG A 42 6.730 -4.211 1.969 1.00 0.00 H new ATOM 0 HB3 ARG A 42 5.203 -3.611 1.351 1.00 0.00 H new ATOM 0 HG2 ARG A 42 7.108 -2.006 1.065 1.00 0.00 H new ATOM 0 HG3 ARG A 42 5.750 -1.335 1.946 1.00 0.00 H new ATOM 0 HD2 ARG A 42 6.975 -1.981 4.104 1.00 0.00 H new ATOM 0 HD3 ARG A 42 8.368 -2.359 3.110 1.00 0.00 H new ATOM 0 HE ARG A 42 7.653 0.234 2.347 1.00 0.00 H new ATOM 0 HH11 ARG A 42 8.503 -1.380 5.384 1.00 0.00 H new ATOM 0 HH12 ARG A 42 9.224 0.074 6.083 1.00 0.00 H new ATOM 0 HH21 ARG A 42 8.597 2.088 3.269 1.00 0.00 H new ATOM 0 HH22 ARG A 42 9.277 2.017 4.898 1.00 0.00 H new ATOM 630 N SER A 43 3.939 -5.726 3.662 1.00 0.00 N ATOM 631 CA SER A 43 2.714 -6.516 3.575 1.00 0.00 C ATOM 632 C SER A 43 1.639 -5.948 4.501 1.00 0.00 C ATOM 633 O SER A 43 0.473 -5.829 4.118 1.00 0.00 O ATOM 634 CB SER A 43 3.016 -7.970 3.935 1.00 0.00 C ATOM 635 OG SER A 43 4.244 -8.379 3.357 1.00 0.00 O ATOM 0 H SER A 43 4.755 -6.249 3.979 1.00 0.00 H new ATOM 0 HA SER A 43 2.336 -6.472 2.553 1.00 0.00 H new ATOM 0 HB2 SER A 43 3.062 -8.081 5.018 1.00 0.00 H new ATOM 0 HB3 SER A 43 2.209 -8.613 3.583 1.00 0.00 H new ATOM 0 HG SER A 43 4.424 -9.312 3.598 1.00 0.00 H new ATOM 641 N GLU A 44 2.047 -5.572 5.708 1.00 0.00 N ATOM 642 CA GLU A 44 1.134 -5.006 6.689 1.00 0.00 C ATOM 643 C GLU A 44 0.719 -3.595 6.284 1.00 0.00 C ATOM 644 O GLU A 44 -0.375 -3.149 6.618 1.00 0.00 O ATOM 645 CB GLU A 44 1.752 -5.020 8.092 1.00 0.00 C ATOM 646 CG GLU A 44 2.967 -4.128 8.253 1.00 0.00 C ATOM 647 CD GLU A 44 3.501 -4.137 9.668 1.00 0.00 C ATOM 648 OE1 GLU A 44 2.960 -3.395 10.515 1.00 0.00 O ATOM 649 OE2 GLU A 44 4.451 -4.891 9.947 1.00 0.00 O ATOM 0 H GLU A 44 3.012 -5.651 6.030 1.00 0.00 H new ATOM 0 HA GLU A 44 0.239 -5.627 6.718 1.00 0.00 H new ATOM 0 HB2 GLU A 44 0.994 -4.713 8.812 1.00 0.00 H new ATOM 0 HB3 GLU A 44 2.033 -6.043 8.341 1.00 0.00 H new ATOM 0 HG2 GLU A 44 3.750 -4.457 7.569 1.00 0.00 H new ATOM 0 HG3 GLU A 44 2.706 -3.108 7.972 1.00 0.00 H new ATOM 656 N LEU A 45 1.606 -2.895 5.571 1.00 0.00 N ATOM 657 CA LEU A 45 1.324 -1.541 5.103 1.00 0.00 C ATOM 658 C LEU A 45 0.023 -1.524 4.304 1.00 0.00 C ATOM 659 O LEU A 45 -0.850 -0.687 4.530 1.00 0.00 O ATOM 660 CB LEU A 45 2.480 -1.025 4.242 1.00 0.00 C ATOM 661 CG LEU A 45 2.309 0.392 3.695 1.00 0.00 C ATOM 662 CD1 LEU A 45 2.284 1.406 4.826 1.00 0.00 C ATOM 663 CD2 LEU A 45 3.420 0.720 2.710 1.00 0.00 C ATOM 0 H LEU A 45 2.526 -3.247 5.306 1.00 0.00 H new ATOM 0 HA LEU A 45 1.215 -0.886 5.968 1.00 0.00 H new ATOM 0 HB2 LEU A 45 3.395 -1.060 4.834 1.00 0.00 H new ATOM 0 HB3 LEU A 45 2.617 -1.706 3.402 1.00 0.00 H new ATOM 0 HG LEU A 45 1.355 0.443 3.170 1.00 0.00 H new ATOM 0 HD11 LEU A 45 2.162 2.408 4.414 1.00 0.00 H new ATOM 0 HD12 LEU A 45 1.452 1.185 5.495 1.00 0.00 H new ATOM 0 HD13 LEU A 45 3.220 1.354 5.382 1.00 0.00 H new ATOM 0 HD21 LEU A 45 3.283 1.733 2.330 1.00 0.00 H new ATOM 0 HD22 LEU A 45 4.385 0.649 3.213 1.00 0.00 H new ATOM 0 HD23 LEU A 45 3.390 0.014 1.880 1.00 0.00 H new ATOM 675 N VAL A 46 -0.099 -2.454 3.368 1.00 0.00 N ATOM 676 CA VAL A 46 -1.309 -2.569 2.570 1.00 0.00 C ATOM 677 C VAL A 46 -2.427 -3.136 3.431 1.00 0.00 C ATOM 678 O VAL A 46 -3.594 -2.771 3.288 1.00 0.00 O ATOM 679 CB VAL A 46 -1.108 -3.489 1.347 1.00 0.00 C ATOM 680 CG1 VAL A 46 -2.341 -3.476 0.457 1.00 0.00 C ATOM 681 CG2 VAL A 46 0.120 -3.080 0.557 1.00 0.00 C ATOM 0 H VAL A 46 0.624 -3.138 3.143 1.00 0.00 H new ATOM 0 HA VAL A 46 -1.563 -1.573 2.209 1.00 0.00 H new ATOM 0 HB VAL A 46 -0.956 -4.505 1.712 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -2.179 -4.131 -0.399 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -3.203 -3.827 1.024 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -2.526 -2.460 0.107 1.00 0.00 H new ATOM 0 HG21 VAL A 46 0.239 -3.744 -0.299 1.00 0.00 H new ATOM 0 HG22 VAL A 46 0.003 -2.054 0.208 1.00 0.00 H new ATOM 0 HG23 VAL A 46 1.002 -3.148 1.194 1.00 0.00 H new ATOM 691 N ASN A 47 -2.036 -4.015 4.347 1.00 0.00 N ATOM 692 CA ASN A 47 -2.967 -4.680 5.251 1.00 0.00 C ATOM 693 C ASN A 47 -3.802 -3.677 6.037 1.00 0.00 C ATOM 694 O ASN A 47 -5.028 -3.678 5.940 1.00 0.00 O ATOM 695 CB ASN A 47 -2.206 -5.591 6.220 1.00 0.00 C ATOM 696 CG ASN A 47 -3.132 -6.344 7.154 1.00 0.00 C ATOM 697 OD1 ASN A 47 -3.834 -7.265 6.743 1.00 0.00 O ATOM 698 ND2 ASN A 47 -3.126 -5.965 8.424 1.00 0.00 N ATOM 0 H ASN A 47 -1.063 -4.287 4.484 1.00 0.00 H new ATOM 0 HA ASN A 47 -3.644 -5.279 4.642 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -1.610 -6.304 5.651 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -1.511 -4.992 6.808 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -3.720 -6.443 9.102 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -2.528 -5.195 8.724 1.00 0.00 H new ATOM 705 N TRP A 48 -3.142 -2.806 6.797 1.00 0.00 N ATOM 706 CA TRP A 48 -3.862 -1.827 7.602 1.00 0.00 C ATOM 707 C TRP A 48 -4.594 -0.826 6.714 1.00 0.00 C ATOM 708 O TRP A 48 -5.644 -0.323 7.096 1.00 0.00 O ATOM 709 CB TRP A 48 -2.943 -1.117 8.615 1.00 0.00 C ATOM 710 CG TRP A 48 -1.989 -0.111 8.032 1.00 0.00 C ATOM 711 CD1 TRP A 48 -0.705 -0.339 7.646 1.00 0.00 C ATOM 712 CD2 TRP A 48 -2.233 1.284 7.802 1.00 0.00 C ATOM 713 NE1 TRP A 48 -0.140 0.819 7.175 1.00 0.00 N ATOM 714 CE2 TRP A 48 -1.055 1.829 7.261 1.00 0.00 C ATOM 715 CE3 TRP A 48 -3.332 2.123 7.994 1.00 0.00 C ATOM 716 CZ2 TRP A 48 -0.945 3.170 6.912 1.00 0.00 C ATOM 717 CZ3 TRP A 48 -3.223 3.455 7.646 1.00 0.00 C ATOM 718 CH2 TRP A 48 -2.036 3.967 7.110 1.00 0.00 C ATOM 0 H TRP A 48 -2.126 -2.759 6.871 1.00 0.00 H new ATOM 0 HA TRP A 48 -4.606 -2.370 8.184 1.00 0.00 H new ATOM 0 HB2 TRP A 48 -3.567 -0.614 9.354 1.00 0.00 H new ATOM 0 HB3 TRP A 48 -2.366 -1.873 9.147 1.00 0.00 H new ATOM 0 HD1 TRP A 48 -0.203 -1.294 7.702 1.00 0.00 H new ATOM 0 HE1 TRP A 48 0.811 0.911 6.818 1.00 0.00 H new ATOM 0 HE3 TRP A 48 -4.252 1.737 8.408 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 -0.030 3.567 6.499 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 -4.068 4.112 7.790 1.00 0.00 H new ATOM 0 HH2 TRP A 48 -1.982 5.013 6.848 1.00 0.00 H new ATOM 729 N TYR A 49 -4.059 -0.564 5.525 1.00 0.00 N ATOM 730 CA TYR A 49 -4.697 0.369 4.601 1.00 0.00 C ATOM 731 C TYR A 49 -6.097 -0.117 4.261 1.00 0.00 C ATOM 732 O TYR A 49 -7.073 0.626 4.368 1.00 0.00 O ATOM 733 CB TYR A 49 -3.882 0.524 3.317 1.00 0.00 C ATOM 734 CG TYR A 49 -4.347 1.682 2.455 1.00 0.00 C ATOM 735 CD1 TYR A 49 -4.521 2.949 3.008 1.00 0.00 C ATOM 736 CD2 TYR A 49 -4.623 1.515 1.101 1.00 0.00 C ATOM 737 CE1 TYR A 49 -4.950 4.010 2.238 1.00 0.00 C ATOM 738 CE2 TYR A 49 -5.054 2.575 0.328 1.00 0.00 C ATOM 739 CZ TYR A 49 -5.217 3.820 0.901 1.00 0.00 C ATOM 740 OH TYR A 49 -5.642 4.881 0.138 1.00 0.00 O ATOM 0 H TYR A 49 -3.194 -0.980 5.181 1.00 0.00 H new ATOM 0 HA TYR A 49 -4.753 1.342 5.090 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -2.833 0.669 3.575 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -3.944 -0.399 2.740 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -4.317 3.103 4.057 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -4.498 0.542 0.648 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -5.076 4.986 2.682 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -5.263 2.430 -0.722 1.00 0.00 H new ATOM 0 HH TYR A 49 -5.445 5.720 0.605 1.00 0.00 H new ATOM 750 N LEU A 50 -6.187 -1.382 3.874 1.00 0.00 N ATOM 751 CA LEU A 50 -7.462 -1.977 3.526 1.00 0.00 C ATOM 752 C LEU A 50 -8.325 -2.118 4.771 1.00 0.00 C ATOM 753 O LEU A 50 -9.528 -1.938 4.719 1.00 0.00 O ATOM 754 CB LEU A 50 -7.256 -3.343 2.877 1.00 0.00 C ATOM 755 CG LEU A 50 -6.153 -3.396 1.820 1.00 0.00 C ATOM 756 CD1 LEU A 50 -5.778 -4.835 1.529 1.00 0.00 C ATOM 757 CD2 LEU A 50 -6.578 -2.678 0.545 1.00 0.00 C ATOM 0 H LEU A 50 -5.390 -2.013 3.794 1.00 0.00 H new ATOM 0 HA LEU A 50 -7.967 -1.326 2.812 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -7.026 -4.068 3.657 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -8.194 -3.656 2.418 1.00 0.00 H new ATOM 0 HG LEU A 50 -5.277 -2.880 2.212 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.992 -4.861 0.775 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -5.420 -5.310 2.443 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -6.652 -5.371 1.160 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -5.774 -2.732 -0.188 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.471 -3.154 0.140 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -6.794 -1.634 0.770 1.00 0.00 H new ATOM 769 N LYS A 51 -7.688 -2.418 5.896 1.00 0.00 N ATOM 770 CA LYS A 51 -8.395 -2.586 7.167 1.00 0.00 C ATOM 771 C LYS A 51 -8.984 -1.266 7.669 1.00 0.00 C ATOM 772 O LYS A 51 -9.930 -1.255 8.457 1.00 0.00 O ATOM 773 CB LYS A 51 -7.453 -3.167 8.226 1.00 0.00 C ATOM 774 CG LYS A 51 -7.600 -4.667 8.434 1.00 0.00 C ATOM 775 CD LYS A 51 -7.249 -5.458 7.181 1.00 0.00 C ATOM 776 CE LYS A 51 -8.491 -5.959 6.457 1.00 0.00 C ATOM 777 NZ LYS A 51 -9.466 -6.591 7.385 1.00 0.00 N ATOM 0 H LYS A 51 -6.679 -2.551 5.958 1.00 0.00 H new ATOM 0 HA LYS A 51 -9.219 -3.277 6.992 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.424 -2.950 7.939 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -7.633 -2.660 9.174 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -6.955 -4.983 9.254 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -8.625 -4.893 8.729 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -6.665 -4.830 6.508 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -6.620 -6.306 7.452 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -8.970 -5.126 5.942 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -8.198 -6.680 5.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -9.852 -7.453 6.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -8.988 -6.837 8.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -10.241 -5.925 7.581 1.00 0.00 H new ATOM 791 N GLU A 52 -8.422 -0.162 7.219 1.00 0.00 N ATOM 792 CA GLU A 52 -8.897 1.155 7.623 1.00 0.00 C ATOM 793 C GLU A 52 -10.084 1.594 6.776 1.00 0.00 C ATOM 794 O GLU A 52 -11.010 2.232 7.275 1.00 0.00 O ATOM 795 CB GLU A 52 -7.776 2.187 7.493 1.00 0.00 C ATOM 796 CG GLU A 52 -6.713 2.081 8.570 1.00 0.00 C ATOM 797 CD GLU A 52 -7.266 2.289 9.960 1.00 0.00 C ATOM 798 OE1 GLU A 52 -7.988 3.289 10.174 1.00 0.00 O ATOM 799 OE2 GLU A 52 -6.980 1.461 10.851 1.00 0.00 O ATOM 0 H GLU A 52 -7.634 -0.146 6.572 1.00 0.00 H new ATOM 0 HA GLU A 52 -9.214 1.088 8.664 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -7.303 2.074 6.517 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -8.211 3.186 7.523 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -6.242 1.099 8.514 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -5.934 2.819 8.379 1.00 0.00 H new ATOM 806 N ILE A 53 -10.055 1.240 5.500 1.00 0.00 N ATOM 807 CA ILE A 53 -11.112 1.629 4.571 1.00 0.00 C ATOM 808 C ILE A 53 -12.130 0.510 4.330 1.00 0.00 C ATOM 809 O ILE A 53 -13.146 0.728 3.680 1.00 0.00 O ATOM 810 CB ILE A 53 -10.517 2.055 3.212 1.00 0.00 C ATOM 811 CG1 ILE A 53 -9.747 0.889 2.585 1.00 0.00 C ATOM 812 CG2 ILE A 53 -9.606 3.265 3.385 1.00 0.00 C ATOM 813 CD1 ILE A 53 -9.190 1.194 1.214 1.00 0.00 C ATOM 0 H ILE A 53 -9.310 0.683 5.081 1.00 0.00 H new ATOM 0 HA ILE A 53 -11.629 2.467 5.038 1.00 0.00 H new ATOM 0 HB ILE A 53 -11.333 2.333 2.545 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -8.927 0.610 3.246 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -10.408 0.025 2.515 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -9.195 3.552 2.417 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -10.179 4.096 3.797 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -8.792 3.013 4.065 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -8.658 0.321 0.835 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -10.007 1.444 0.537 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -8.503 2.037 1.280 1.00 0.00 H new ATOM 825 N GLU A 54 -11.866 -0.675 4.862 1.00 0.00 N ATOM 826 CA GLU A 54 -12.749 -1.833 4.672 1.00 0.00 C ATOM 827 C GLU A 54 -14.195 -1.547 5.073 1.00 0.00 C ATOM 828 O GLU A 54 -15.126 -2.127 4.513 1.00 0.00 O ATOM 829 CB GLU A 54 -12.229 -3.036 5.460 1.00 0.00 C ATOM 830 CG GLU A 54 -12.188 -2.818 6.963 1.00 0.00 C ATOM 831 CD GLU A 54 -11.974 -4.101 7.736 1.00 0.00 C ATOM 832 OE1 GLU A 54 -12.960 -4.821 7.981 1.00 0.00 O ATOM 833 OE2 GLU A 54 -10.823 -4.398 8.108 1.00 0.00 O ATOM 0 H GLU A 54 -11.043 -0.867 5.434 1.00 0.00 H new ATOM 0 HA GLU A 54 -12.743 -2.055 3.605 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -12.860 -3.899 5.245 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -11.226 -3.280 5.111 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.388 -2.117 7.202 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -13.122 -2.357 7.284 1.00 0.00 H new ATOM 840 N SER A 55 -14.388 -0.656 6.030 1.00 0.00 N ATOM 841 CA SER A 55 -15.724 -0.329 6.493 1.00 0.00 C ATOM 842 C SER A 55 -16.434 0.640 5.546 1.00 0.00 C ATOM 843 O SER A 55 -17.663 0.680 5.506 1.00 0.00 O ATOM 844 CB SER A 55 -15.646 0.258 7.897 1.00 0.00 C ATOM 845 OG SER A 55 -14.579 -0.330 8.627 1.00 0.00 O ATOM 0 H SER A 55 -13.639 -0.148 6.500 1.00 0.00 H new ATOM 0 HA SER A 55 -16.311 -1.247 6.512 1.00 0.00 H new ATOM 0 HB2 SER A 55 -15.502 1.337 7.838 1.00 0.00 H new ATOM 0 HB3 SER A 55 -16.587 0.090 8.420 1.00 0.00 H new ATOM 0 HG SER A 55 -14.543 0.060 9.525 1.00 0.00 H new ATOM 851 N GLU A 56 -15.669 1.403 4.770 1.00 0.00 N ATOM 852 CA GLU A 56 -16.261 2.363 3.844 1.00 0.00 C ATOM 853 C GLU A 56 -16.394 1.741 2.460 1.00 0.00 C ATOM 854 O GLU A 56 -17.304 2.076 1.698 1.00 0.00 O ATOM 855 CB GLU A 56 -15.442 3.664 3.781 1.00 0.00 C ATOM 856 CG GLU A 56 -14.086 3.518 3.108 1.00 0.00 C ATOM 857 CD GLU A 56 -13.486 4.848 2.714 1.00 0.00 C ATOM 858 OE1 GLU A 56 -12.832 5.489 3.561 1.00 0.00 O ATOM 859 OE2 GLU A 56 -13.658 5.262 1.549 1.00 0.00 O ATOM 0 H GLU A 56 -14.649 1.376 4.763 1.00 0.00 H new ATOM 0 HA GLU A 56 -17.254 2.621 4.212 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -16.020 4.418 3.247 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -15.293 4.035 4.795 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -13.403 3.001 3.783 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -14.190 2.894 2.221 1.00 0.00 H new ATOM 866 N ILE A 57 -15.483 0.830 2.147 1.00 0.00 N ATOM 867 CA ILE A 57 -15.501 0.147 0.866 1.00 0.00 C ATOM 868 C ILE A 57 -16.657 -0.838 0.826 1.00 0.00 C ATOM 869 O ILE A 57 -16.614 -1.893 1.459 1.00 0.00 O ATOM 870 CB ILE A 57 -14.182 -0.607 0.588 1.00 0.00 C ATOM 871 CG1 ILE A 57 -12.979 0.334 0.696 1.00 0.00 C ATOM 872 CG2 ILE A 57 -14.218 -1.259 -0.784 1.00 0.00 C ATOM 873 CD1 ILE A 57 -13.101 1.586 -0.144 1.00 0.00 C ATOM 0 H ILE A 57 -14.722 0.548 2.765 1.00 0.00 H new ATOM 0 HA ILE A 57 -15.621 0.907 0.094 1.00 0.00 H new ATOM 0 HB ILE A 57 -14.076 -1.386 1.343 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -12.847 0.620 1.739 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -12.080 -0.206 0.397 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -13.280 -1.785 -0.961 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -15.045 -1.967 -0.829 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -14.354 -0.493 -1.547 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -12.210 2.200 -0.013 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -13.201 1.311 -1.194 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -13.980 2.150 0.169 1.00 0.00 H new ATOM 885 N ASP A 58 -17.692 -0.479 0.092 1.00 0.00 N ATOM 886 CA ASP A 58 -18.867 -1.324 -0.033 1.00 0.00 C ATOM 887 C ASP A 58 -18.849 -2.036 -1.368 1.00 0.00 C ATOM 888 O ASP A 58 -19.561 -3.017 -1.579 1.00 0.00 O ATOM 889 CB ASP A 58 -20.145 -0.492 0.090 1.00 0.00 C ATOM 890 CG ASP A 58 -21.361 -1.344 0.392 1.00 0.00 C ATOM 891 OD1 ASP A 58 -21.599 -1.638 1.581 1.00 0.00 O ATOM 892 OD2 ASP A 58 -22.094 -1.710 -0.553 1.00 0.00 O ATOM 0 H ASP A 58 -17.744 0.396 -0.430 1.00 0.00 H new ATOM 0 HA ASP A 58 -18.851 -2.060 0.771 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -20.019 0.249 0.879 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -20.310 0.056 -0.838 1.00 0.00 H new ATOM 897 N SER A 59 -18.006 -1.550 -2.263 1.00 0.00 N ATOM 898 CA SER A 59 -17.899 -2.123 -3.579 1.00 0.00 C ATOM 899 C SER A 59 -16.538 -2.766 -3.739 1.00 0.00 C ATOM 900 O SER A 59 -15.514 -2.149 -3.440 1.00 0.00 O ATOM 901 CB SER A 59 -18.102 -1.037 -4.636 1.00 0.00 C ATOM 902 OG SER A 59 -18.897 0.030 -4.134 1.00 0.00 O ATOM 0 H SER A 59 -17.387 -0.757 -2.094 1.00 0.00 H new ATOM 0 HA SER A 59 -18.669 -2.884 -3.710 1.00 0.00 H new ATOM 0 HB2 SER A 59 -17.134 -0.652 -4.956 1.00 0.00 H new ATOM 0 HB3 SER A 59 -18.581 -1.467 -5.516 1.00 0.00 H new ATOM 0 HG SER A 59 -19.009 0.710 -4.830 1.00 0.00 H new ATOM 908 N GLU A 60 -16.530 -4.001 -4.206 1.00 0.00 N ATOM 909 CA GLU A 60 -15.292 -4.733 -4.412 1.00 0.00 C ATOM 910 C GLU A 60 -14.361 -3.943 -5.308 1.00 0.00 C ATOM 911 O GLU A 60 -13.177 -3.811 -5.026 1.00 0.00 O ATOM 912 CB GLU A 60 -15.597 -6.087 -5.057 1.00 0.00 C ATOM 913 CG GLU A 60 -14.499 -7.121 -4.871 1.00 0.00 C ATOM 914 CD GLU A 60 -14.509 -7.717 -3.485 1.00 0.00 C ATOM 915 OE1 GLU A 60 -14.647 -6.950 -2.509 1.00 0.00 O ATOM 916 OE2 GLU A 60 -14.389 -8.956 -3.360 1.00 0.00 O ATOM 0 H GLU A 60 -17.372 -4.522 -4.451 1.00 0.00 H new ATOM 0 HA GLU A 60 -14.809 -4.889 -3.448 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -16.524 -6.477 -4.638 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -15.767 -5.940 -6.124 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -14.621 -7.915 -5.607 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -13.530 -6.658 -5.059 1.00 0.00 H new ATOM 923 N GLU A 61 -14.941 -3.363 -6.344 1.00 0.00 N ATOM 924 CA GLU A 61 -14.203 -2.596 -7.335 1.00 0.00 C ATOM 925 C GLU A 61 -13.417 -1.452 -6.712 1.00 0.00 C ATOM 926 O GLU A 61 -12.301 -1.149 -7.146 1.00 0.00 O ATOM 927 CB GLU A 61 -15.161 -2.075 -8.388 1.00 0.00 C ATOM 928 CG GLU A 61 -15.768 -3.190 -9.221 1.00 0.00 C ATOM 929 CD GLU A 61 -16.937 -3.872 -8.538 1.00 0.00 C ATOM 930 OE1 GLU A 61 -17.453 -3.329 -7.538 1.00 0.00 O ATOM 931 OE2 GLU A 61 -17.336 -4.967 -8.989 1.00 0.00 O ATOM 0 H GLU A 61 -15.944 -3.411 -6.523 1.00 0.00 H new ATOM 0 HA GLU A 61 -13.474 -3.261 -7.799 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -15.959 -1.512 -7.903 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -14.634 -1.381 -9.043 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -16.100 -2.783 -10.176 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -15.000 -3.931 -9.440 1.00 0.00 H new ATOM 938 N GLU A 62 -14.004 -0.802 -5.712 1.00 0.00 N ATOM 939 CA GLU A 62 -13.332 0.284 -5.011 1.00 0.00 C ATOM 940 C GLU A 62 -12.075 -0.255 -4.344 1.00 0.00 C ATOM 941 O GLU A 62 -11.007 0.356 -4.412 1.00 0.00 O ATOM 942 CB GLU A 62 -14.246 0.919 -3.957 1.00 0.00 C ATOM 943 CG GLU A 62 -15.506 1.537 -4.534 1.00 0.00 C ATOM 944 CD GLU A 62 -15.220 2.608 -5.569 1.00 0.00 C ATOM 945 OE1 GLU A 62 -14.295 3.423 -5.359 1.00 0.00 O ATOM 946 OE2 GLU A 62 -15.923 2.642 -6.597 1.00 0.00 O ATOM 0 H GLU A 62 -14.942 -1.009 -5.370 1.00 0.00 H new ATOM 0 HA GLU A 62 -13.072 1.055 -5.736 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -14.526 0.160 -3.227 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -13.688 1.687 -3.421 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -16.113 0.754 -4.988 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -16.095 1.969 -3.725 1.00 0.00 H new ATOM 953 N LEU A 63 -12.215 -1.417 -3.717 1.00 0.00 N ATOM 954 CA LEU A 63 -11.100 -2.067 -3.048 1.00 0.00 C ATOM 955 C LEU A 63 -10.059 -2.516 -4.061 1.00 0.00 C ATOM 956 O LEU A 63 -8.860 -2.372 -3.823 1.00 0.00 O ATOM 957 CB LEU A 63 -11.590 -3.253 -2.218 1.00 0.00 C ATOM 958 CG LEU A 63 -10.737 -3.579 -0.990 1.00 0.00 C ATOM 959 CD1 LEU A 63 -10.237 -2.306 -0.322 1.00 0.00 C ATOM 960 CD2 LEU A 63 -11.543 -4.406 -0.006 1.00 0.00 C ATOM 0 H LEU A 63 -13.095 -1.929 -3.659 1.00 0.00 H new ATOM 0 HA LEU A 63 -10.635 -1.347 -2.375 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -12.610 -3.051 -1.890 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -11.630 -4.134 -2.859 1.00 0.00 H new ATOM 0 HG LEU A 63 -9.870 -4.154 -1.315 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -9.633 -2.565 0.548 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -9.631 -1.738 -1.028 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -11.088 -1.702 -0.007 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -10.930 -4.634 0.866 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -12.423 -3.844 0.307 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -11.856 -5.335 -0.482 1.00 0.00 H new ATOM 972 N ILE A 64 -10.513 -3.063 -5.189 1.00 0.00 N ATOM 973 CA ILE A 64 -9.590 -3.493 -6.239 1.00 0.00 C ATOM 974 C ILE A 64 -8.749 -2.309 -6.684 1.00 0.00 C ATOM 975 O ILE A 64 -7.530 -2.404 -6.811 1.00 0.00 O ATOM 976 CB ILE A 64 -10.299 -4.053 -7.489 1.00 0.00 C ATOM 977 CG1 ILE A 64 -11.563 -4.834 -7.135 1.00 0.00 C ATOM 978 CG2 ILE A 64 -9.341 -4.925 -8.280 1.00 0.00 C ATOM 979 CD1 ILE A 64 -11.339 -6.056 -6.266 1.00 0.00 C ATOM 0 H ILE A 64 -11.499 -3.217 -5.397 1.00 0.00 H new ATOM 0 HA ILE A 64 -8.987 -4.291 -5.806 1.00 0.00 H new ATOM 0 HB ILE A 64 -10.608 -3.205 -8.100 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -12.254 -4.164 -6.623 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -12.049 -5.148 -8.059 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -9.849 -5.317 -9.161 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -8.481 -4.332 -8.591 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -9.004 -5.754 -7.657 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -12.294 -6.543 -6.069 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -10.676 -6.752 -6.781 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -10.885 -5.753 -5.322 1.00 0.00 H new ATOM 991 N ASN A 65 -9.430 -1.195 -6.919 1.00 0.00 N ATOM 992 CA ASN A 65 -8.781 0.044 -7.341 1.00 0.00 C ATOM 993 C ASN A 65 -7.782 0.521 -6.290 1.00 0.00 C ATOM 994 O ASN A 65 -6.635 0.818 -6.608 1.00 0.00 O ATOM 995 CB ASN A 65 -9.834 1.128 -7.604 1.00 0.00 C ATOM 996 CG ASN A 65 -9.295 2.540 -7.425 1.00 0.00 C ATOM 997 OD1 ASN A 65 -8.675 3.099 -8.330 1.00 0.00 O ATOM 998 ND2 ASN A 65 -9.545 3.132 -6.263 1.00 0.00 N ATOM 0 H ASN A 65 -10.443 -1.122 -6.824 1.00 0.00 H new ATOM 0 HA ASN A 65 -8.236 -0.152 -8.264 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -10.215 1.017 -8.619 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -10.677 0.979 -6.929 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -9.220 4.084 -6.095 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -10.062 2.635 -5.538 1.00 0.00 H new ATOM 1005 N LYS A 66 -8.222 0.582 -5.037 1.00 0.00 N ATOM 1006 CA LYS A 66 -7.358 1.020 -3.946 1.00 0.00 C ATOM 1007 C LYS A 66 -6.122 0.134 -3.858 1.00 0.00 C ATOM 1008 O LYS A 66 -5.001 0.623 -3.706 1.00 0.00 O ATOM 1009 CB LYS A 66 -8.114 0.991 -2.615 1.00 0.00 C ATOM 1010 CG LYS A 66 -9.116 2.123 -2.445 1.00 0.00 C ATOM 1011 CD LYS A 66 -8.423 3.463 -2.249 1.00 0.00 C ATOM 1012 CE LYS A 66 -9.309 4.442 -1.491 1.00 0.00 C ATOM 1013 NZ LYS A 66 -10.494 4.862 -2.286 1.00 0.00 N ATOM 0 H LYS A 66 -9.170 0.334 -4.752 1.00 0.00 H new ATOM 0 HA LYS A 66 -7.046 2.044 -4.150 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -8.639 0.040 -2.528 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -7.393 1.033 -1.799 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -9.762 2.172 -3.322 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -9.757 1.916 -1.588 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -7.491 3.316 -1.703 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -8.161 3.884 -3.220 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -9.643 3.982 -0.561 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -8.726 5.322 -1.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -11.067 5.528 -1.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -10.178 5.325 -3.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -11.067 4.027 -2.523 1.00 0.00 H new ATOM 1027 N LYS A 67 -6.339 -1.169 -3.990 1.00 0.00 N ATOM 1028 CA LYS A 67 -5.263 -2.144 -3.918 1.00 0.00 C ATOM 1029 C LYS A 67 -4.331 -2.054 -5.127 1.00 0.00 C ATOM 1030 O LYS A 67 -3.113 -2.084 -4.975 1.00 0.00 O ATOM 1031 CB LYS A 67 -5.842 -3.554 -3.800 1.00 0.00 C ATOM 1032 CG LYS A 67 -4.795 -4.651 -3.863 1.00 0.00 C ATOM 1033 CD LYS A 67 -5.315 -5.950 -3.275 1.00 0.00 C ATOM 1034 CE LYS A 67 -5.091 -6.017 -1.775 1.00 0.00 C ATOM 1035 NZ LYS A 67 -3.638 -6.013 -1.440 1.00 0.00 N ATOM 0 H LYS A 67 -7.261 -1.576 -4.149 1.00 0.00 H new ATOM 0 HA LYS A 67 -4.671 -1.920 -3.031 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -6.385 -3.636 -2.859 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -6.566 -3.708 -4.600 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -4.498 -4.813 -4.899 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -3.903 -4.336 -3.321 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -6.380 -6.046 -3.489 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -4.817 -6.792 -3.755 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -5.579 -5.169 -1.295 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -5.555 -6.919 -1.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -3.514 -6.229 -0.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -3.148 -6.732 -2.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -3.237 -5.076 -1.645 1.00 0.00 H new ATOM 1049 N ARG A 68 -4.900 -1.920 -6.322 1.00 0.00 N ATOM 1050 CA ARG A 68 -4.097 -1.844 -7.543 1.00 0.00 C ATOM 1051 C ARG A 68 -3.156 -0.642 -7.513 1.00 0.00 C ATOM 1052 O ARG A 68 -2.116 -0.646 -8.173 1.00 0.00 O ATOM 1053 CB ARG A 68 -4.989 -1.797 -8.794 1.00 0.00 C ATOM 1054 CG ARG A 68 -5.521 -0.414 -9.135 1.00 0.00 C ATOM 1055 CD ARG A 68 -6.113 -0.364 -10.534 1.00 0.00 C ATOM 1056 NE ARG A 68 -7.271 -1.245 -10.679 1.00 0.00 N ATOM 1057 CZ ARG A 68 -8.488 -0.828 -11.031 1.00 0.00 C ATOM 1058 NH1 ARG A 68 -8.706 0.454 -11.309 1.00 0.00 N ATOM 1059 NH2 ARG A 68 -9.482 -1.702 -11.125 1.00 0.00 N ATOM 0 H ARG A 68 -5.907 -1.862 -6.473 1.00 0.00 H new ATOM 0 HA ARG A 68 -3.491 -2.749 -7.590 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -4.421 -2.174 -9.644 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -5.833 -2.472 -8.649 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -6.282 -0.128 -8.408 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -4.715 0.315 -9.056 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -6.407 0.660 -10.765 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -5.350 -0.648 -11.259 1.00 0.00 H new ATOM 0 HE ARG A 68 -7.140 -2.241 -10.500 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -7.940 1.125 -11.254 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -9.639 0.766 -11.578 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -9.314 -2.689 -10.928 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -10.414 -1.387 -11.394 1.00 0.00 H new ATOM 1073 N ILE A 69 -3.521 0.381 -6.748 1.00 0.00 N ATOM 1074 CA ILE A 69 -2.698 1.573 -6.633 1.00 0.00 C ATOM 1075 C ILE A 69 -1.672 1.408 -5.518 1.00 0.00 C ATOM 1076 O ILE A 69 -0.475 1.567 -5.752 1.00 0.00 O ATOM 1077 CB ILE A 69 -3.543 2.845 -6.364 1.00 0.00 C ATOM 1078 CG1 ILE A 69 -4.633 3.015 -7.428 1.00 0.00 C ATOM 1079 CG2 ILE A 69 -2.651 4.079 -6.319 1.00 0.00 C ATOM 1080 CD1 ILE A 69 -4.099 3.294 -8.816 1.00 0.00 C ATOM 0 H ILE A 69 -4.381 0.406 -6.200 1.00 0.00 H new ATOM 0 HA ILE A 69 -2.191 1.698 -7.589 1.00 0.00 H new ATOM 0 HB ILE A 69 -4.028 2.729 -5.395 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -5.241 2.111 -7.459 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -5.291 3.832 -7.132 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -3.261 4.962 -6.129 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -1.916 3.968 -5.522 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -2.137 4.191 -7.274 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -4.932 3.402 -9.511 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -3.516 4.215 -8.803 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -3.465 2.467 -9.135 1.00 0.00 H new ATOM 1092 N ILE A 70 -2.142 1.065 -4.317 1.00 0.00 N ATOM 1093 CA ILE A 70 -1.253 0.897 -3.167 1.00 0.00 C ATOM 1094 C ILE A 70 -0.158 -0.134 -3.459 1.00 0.00 C ATOM 1095 O ILE A 70 1.016 0.100 -3.173 1.00 0.00 O ATOM 1096 CB ILE A 70 -2.031 0.507 -1.878 1.00 0.00 C ATOM 1097 CG1 ILE A 70 -1.088 0.495 -0.674 1.00 0.00 C ATOM 1098 CG2 ILE A 70 -2.729 -0.836 -2.017 1.00 0.00 C ATOM 1099 CD1 ILE A 70 -0.600 1.871 -0.286 1.00 0.00 C ATOM 0 H ILE A 70 -3.128 0.899 -4.116 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.783 1.864 -2.990 1.00 0.00 H new ATOM 0 HB ILE A 70 -2.804 1.260 -1.722 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -1.601 0.045 0.176 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -0.229 -0.138 -0.899 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -3.259 -1.068 -1.093 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -3.439 -0.793 -2.843 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -1.989 -1.612 -2.215 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.064 1.792 0.574 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -0.060 2.315 -1.122 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.452 2.500 -0.030 1.00 0.00 H new ATOM 1111 N GLU A 71 -0.550 -1.244 -4.063 1.00 0.00 N ATOM 1112 CA GLU A 71 0.373 -2.313 -4.406 1.00 0.00 C ATOM 1113 C GLU A 71 1.423 -1.814 -5.389 1.00 0.00 C ATOM 1114 O GLU A 71 2.631 -1.899 -5.145 1.00 0.00 O ATOM 1115 CB GLU A 71 -0.405 -3.466 -5.035 1.00 0.00 C ATOM 1116 CG GLU A 71 -0.200 -4.788 -4.343 1.00 0.00 C ATOM 1117 CD GLU A 71 -1.347 -5.158 -3.413 1.00 0.00 C ATOM 1118 OE1 GLU A 71 -1.635 -4.390 -2.476 1.00 0.00 O ATOM 1119 OE2 GLU A 71 -1.969 -6.224 -3.617 1.00 0.00 O ATOM 0 H GLU A 71 -1.517 -1.429 -4.329 1.00 0.00 H new ATOM 0 HA GLU A 71 0.875 -2.653 -3.500 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -1.467 -3.223 -5.026 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -0.110 -3.564 -6.080 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -0.082 -5.570 -5.093 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.727 -4.752 -3.771 1.00 0.00 H new ATOM 1126 N LYS A 72 0.932 -1.304 -6.503 1.00 0.00 N ATOM 1127 CA LYS A 72 1.774 -0.771 -7.571 1.00 0.00 C ATOM 1128 C LYS A 72 2.731 0.313 -7.070 1.00 0.00 C ATOM 1129 O LYS A 72 3.908 0.311 -7.429 1.00 0.00 O ATOM 1130 CB LYS A 72 0.903 -0.206 -8.691 1.00 0.00 C ATOM 1131 CG LYS A 72 1.701 0.403 -9.830 1.00 0.00 C ATOM 1132 CD LYS A 72 0.804 0.906 -10.946 1.00 0.00 C ATOM 1133 CE LYS A 72 0.123 2.210 -10.566 1.00 0.00 C ATOM 1134 NZ LYS A 72 -0.500 2.867 -11.744 1.00 0.00 N ATOM 0 H LYS A 72 -0.067 -1.245 -6.699 1.00 0.00 H new ATOM 0 HA LYS A 72 2.378 -1.597 -7.947 1.00 0.00 H new ATOM 0 HB2 LYS A 72 0.271 -1.002 -9.085 1.00 0.00 H new ATOM 0 HB3 LYS A 72 0.239 0.553 -8.277 1.00 0.00 H new ATOM 0 HG2 LYS A 72 2.304 1.228 -9.450 1.00 0.00 H new ATOM 0 HG3 LYS A 72 2.392 -0.341 -10.227 1.00 0.00 H new ATOM 0 HD2 LYS A 72 1.394 1.052 -11.851 1.00 0.00 H new ATOM 0 HD3 LYS A 72 0.050 0.153 -11.175 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.640 2.016 -9.812 1.00 0.00 H new ATOM 0 HE3 LYS A 72 0.852 2.884 -10.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -0.246 3.876 -11.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -0.156 2.415 -12.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -1.534 2.771 -11.689 1.00 0.00 H new ATOM 1148 N VAL A 73 2.227 1.234 -6.252 1.00 0.00 N ATOM 1149 CA VAL A 73 3.055 2.317 -5.725 1.00 0.00 C ATOM 1150 C VAL A 73 4.249 1.762 -4.956 1.00 0.00 C ATOM 1151 O VAL A 73 5.385 2.172 -5.186 1.00 0.00 O ATOM 1152 CB VAL A 73 2.245 3.272 -4.821 1.00 0.00 C ATOM 1153 CG1 VAL A 73 3.157 4.174 -4.001 1.00 0.00 C ATOM 1154 CG2 VAL A 73 1.295 4.112 -5.658 1.00 0.00 C ATOM 0 H VAL A 73 1.256 1.253 -5.941 1.00 0.00 H new ATOM 0 HA VAL A 73 3.416 2.888 -6.580 1.00 0.00 H new ATOM 0 HB VAL A 73 1.667 2.661 -4.128 1.00 0.00 H new ATOM 0 HG11 VAL A 73 2.552 4.832 -3.377 1.00 0.00 H new ATOM 0 HG12 VAL A 73 3.799 3.563 -3.367 1.00 0.00 H new ATOM 0 HG13 VAL A 73 3.773 4.774 -4.671 1.00 0.00 H new ATOM 0 HG21 VAL A 73 0.731 4.780 -5.007 1.00 0.00 H new ATOM 0 HG22 VAL A 73 1.866 4.701 -6.376 1.00 0.00 H new ATOM 0 HG23 VAL A 73 0.606 3.458 -6.192 1.00 0.00 H new ATOM 1164 N ILE A 74 3.992 0.808 -4.067 1.00 0.00 N ATOM 1165 CA ILE A 74 5.056 0.192 -3.287 1.00 0.00 C ATOM 1166 C ILE A 74 6.056 -0.488 -4.217 1.00 0.00 C ATOM 1167 O ILE A 74 7.271 -0.383 -4.032 1.00 0.00 O ATOM 1168 CB ILE A 74 4.500 -0.840 -2.283 1.00 0.00 C ATOM 1169 CG1 ILE A 74 3.576 -0.149 -1.281 1.00 0.00 C ATOM 1170 CG2 ILE A 74 5.636 -1.556 -1.558 1.00 0.00 C ATOM 1171 CD1 ILE A 74 2.738 -1.111 -0.475 1.00 0.00 C ATOM 0 H ILE A 74 3.059 0.447 -3.870 1.00 0.00 H new ATOM 0 HA ILE A 74 5.553 0.981 -2.722 1.00 0.00 H new ATOM 0 HB ILE A 74 3.927 -1.587 -2.833 1.00 0.00 H new ATOM 0 HG12 ILE A 74 4.177 0.455 -0.601 1.00 0.00 H new ATOM 0 HG13 ILE A 74 2.917 0.534 -1.817 1.00 0.00 H new ATOM 0 HG21 ILE A 74 5.221 -2.279 -0.855 1.00 0.00 H new ATOM 0 HG22 ILE A 74 6.262 -2.074 -2.285 1.00 0.00 H new ATOM 0 HG23 ILE A 74 6.238 -0.827 -1.015 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.106 -0.553 0.216 1.00 0.00 H new ATOM 0 HD12 ILE A 74 2.111 -1.698 -1.146 1.00 0.00 H new ATOM 0 HD13 ILE A 74 3.390 -1.778 0.088 1.00 0.00 H new ATOM 1183 N HIS A 75 5.528 -1.163 -5.236 1.00 0.00 N ATOM 1184 CA HIS A 75 6.350 -1.861 -6.220 1.00 0.00 C ATOM 1185 C HIS A 75 7.243 -0.877 -6.983 1.00 0.00 C ATOM 1186 O HIS A 75 8.422 -1.146 -7.222 1.00 0.00 O ATOM 1187 CB HIS A 75 5.454 -2.633 -7.203 1.00 0.00 C ATOM 1188 CG HIS A 75 6.167 -3.116 -8.427 1.00 0.00 C ATOM 1189 ND1 HIS A 75 7.262 -3.942 -8.376 1.00 0.00 N ATOM 1190 CD2 HIS A 75 5.949 -2.865 -9.738 1.00 0.00 C ATOM 1191 CE1 HIS A 75 7.695 -4.175 -9.597 1.00 0.00 C ATOM 1192 NE2 HIS A 75 6.914 -3.535 -10.448 1.00 0.00 N ATOM 0 H HIS A 75 4.525 -1.241 -5.402 1.00 0.00 H new ATOM 0 HA HIS A 75 6.992 -2.566 -5.692 1.00 0.00 H new ATOM 0 HB2 HIS A 75 5.019 -3.489 -6.687 1.00 0.00 H new ATOM 0 HB3 HIS A 75 4.627 -1.990 -7.506 1.00 0.00 H new ATOM 0 HD2 HIS A 75 5.162 -2.251 -10.150 1.00 0.00 H new ATOM 0 HE1 HIS A 75 8.546 -4.787 -9.859 1.00 0.00 H new ATOM 0 HE2 HIS A 75 7.012 -3.538 -11.463 1.00 0.00 H new ATOM 1201 N ARG A 76 6.671 0.255 -7.362 1.00 0.00 N ATOM 1202 CA ARG A 76 7.403 1.274 -8.102 1.00 0.00 C ATOM 1203 C ARG A 76 8.469 1.916 -7.220 1.00 0.00 C ATOM 1204 O ARG A 76 9.622 2.065 -7.626 1.00 0.00 O ATOM 1205 CB ARG A 76 6.435 2.342 -8.619 1.00 0.00 C ATOM 1206 CG ARG A 76 7.068 3.302 -9.608 1.00 0.00 C ATOM 1207 CD ARG A 76 6.278 4.591 -9.719 1.00 0.00 C ATOM 1208 NE ARG A 76 7.106 5.749 -9.411 1.00 0.00 N ATOM 1209 CZ ARG A 76 7.062 6.898 -10.074 1.00 0.00 C ATOM 1210 NH1 ARG A 76 6.200 7.072 -11.071 1.00 0.00 N ATOM 1211 NH2 ARG A 76 7.891 7.875 -9.748 1.00 0.00 N ATOM 0 H ARG A 76 5.698 0.493 -7.169 1.00 0.00 H new ATOM 0 HA ARG A 76 7.897 0.800 -8.950 1.00 0.00 H new ATOM 0 HB2 ARG A 76 5.585 1.852 -9.093 1.00 0.00 H new ATOM 0 HB3 ARG A 76 6.045 2.908 -7.773 1.00 0.00 H new ATOM 0 HG2 ARG A 76 8.088 3.526 -9.296 1.00 0.00 H new ATOM 0 HG3 ARG A 76 7.130 2.828 -10.587 1.00 0.00 H new ATOM 0 HD2 ARG A 76 5.875 4.687 -10.727 1.00 0.00 H new ATOM 0 HD3 ARG A 76 5.428 4.558 -9.038 1.00 0.00 H new ATOM 0 HE ARG A 76 7.763 5.672 -8.635 1.00 0.00 H new ATOM 0 HH11 ARG A 76 5.564 6.319 -11.333 1.00 0.00 H new ATOM 0 HH12 ARG A 76 6.174 7.959 -11.574 1.00 0.00 H new ATOM 0 HH21 ARG A 76 8.561 7.744 -8.990 1.00 0.00 H new ATOM 0 HH22 ARG A 76 7.861 8.760 -10.255 1.00 0.00 H new ATOM 1225 N LEU A 77 8.068 2.266 -6.009 1.00 0.00 N ATOM 1226 CA LEU A 77 8.947 2.897 -5.034 1.00 0.00 C ATOM 1227 C LEU A 77 10.165 2.023 -4.708 1.00 0.00 C ATOM 1228 O LEU A 77 11.286 2.525 -4.575 1.00 0.00 O ATOM 1229 CB LEU A 77 8.127 3.204 -3.769 1.00 0.00 C ATOM 1230 CG LEU A 77 8.843 3.049 -2.426 1.00 0.00 C ATOM 1231 CD1 LEU A 77 9.727 4.247 -2.144 1.00 0.00 C ATOM 1232 CD2 LEU A 77 7.825 2.872 -1.310 1.00 0.00 C ATOM 0 H LEU A 77 7.117 2.120 -5.671 1.00 0.00 H new ATOM 0 HA LEU A 77 9.341 3.822 -5.455 1.00 0.00 H new ATOM 0 HB2 LEU A 77 7.761 4.228 -3.842 1.00 0.00 H new ATOM 0 HB3 LEU A 77 7.253 2.553 -3.765 1.00 0.00 H new ATOM 0 HG LEU A 77 9.476 2.163 -2.474 1.00 0.00 H new ATOM 0 HD11 LEU A 77 10.225 4.113 -1.184 1.00 0.00 H new ATOM 0 HD12 LEU A 77 10.475 4.340 -2.931 1.00 0.00 H new ATOM 0 HD13 LEU A 77 9.117 5.150 -2.114 1.00 0.00 H new ATOM 0 HD21 LEU A 77 8.344 2.762 -0.358 1.00 0.00 H new ATOM 0 HD22 LEU A 77 7.174 3.745 -1.270 1.00 0.00 H new ATOM 0 HD23 LEU A 77 7.226 1.981 -1.501 1.00 0.00 H new ATOM 1244 N THR A 78 9.953 0.719 -4.610 1.00 0.00 N ATOM 1245 CA THR A 78 11.027 -0.208 -4.274 1.00 0.00 C ATOM 1246 C THR A 78 11.860 -0.620 -5.489 1.00 0.00 C ATOM 1247 O THR A 78 12.964 -1.143 -5.336 1.00 0.00 O ATOM 1248 CB THR A 78 10.463 -1.480 -3.613 1.00 0.00 C ATOM 1249 OG1 THR A 78 9.350 -1.971 -4.372 1.00 0.00 O ATOM 1250 CG2 THR A 78 10.019 -1.204 -2.186 1.00 0.00 C ATOM 0 H THR A 78 9.046 0.277 -4.758 1.00 0.00 H new ATOM 0 HA THR A 78 11.677 0.326 -3.581 1.00 0.00 H new ATOM 0 HB THR A 78 11.254 -2.229 -3.591 1.00 0.00 H new ATOM 0 HG1 THR A 78 8.515 -1.634 -3.984 1.00 0.00 H new ATOM 0 HG21 THR A 78 9.625 -2.119 -1.744 1.00 0.00 H new ATOM 0 HG22 THR A 78 10.870 -0.856 -1.601 1.00 0.00 H new ATOM 0 HG23 THR A 78 9.243 -0.439 -2.188 1.00 0.00 H new ATOM 1258 N HIS A 79 11.351 -0.382 -6.691 1.00 0.00 N ATOM 1259 CA HIS A 79 12.071 -0.789 -7.897 1.00 0.00 C ATOM 1260 C HIS A 79 12.487 0.397 -8.767 1.00 0.00 C ATOM 1261 O HIS A 79 13.658 0.779 -8.792 1.00 0.00 O ATOM 1262 CB HIS A 79 11.218 -1.757 -8.729 1.00 0.00 C ATOM 1263 CG HIS A 79 11.175 -3.160 -8.199 1.00 0.00 C ATOM 1264 ND1 HIS A 79 11.394 -4.270 -8.991 1.00 0.00 N ATOM 1265 CD2 HIS A 79 10.916 -3.637 -6.958 1.00 0.00 C ATOM 1266 CE1 HIS A 79 11.271 -5.363 -8.258 1.00 0.00 C ATOM 1267 NE2 HIS A 79 10.986 -5.005 -7.023 1.00 0.00 N ATOM 0 H HIS A 79 10.458 0.082 -6.859 1.00 0.00 H new ATOM 0 HA HIS A 79 12.981 -1.286 -7.561 1.00 0.00 H new ATOM 0 HB2 HIS A 79 10.200 -1.371 -8.782 1.00 0.00 H new ATOM 0 HB3 HIS A 79 11.605 -1.778 -9.748 1.00 0.00 H new ATOM 0 HD2 HIS A 79 10.695 -3.049 -6.080 1.00 0.00 H new ATOM 0 HE1 HIS A 79 11.385 -6.377 -8.612 1.00 0.00 H new ATOM 0 HE2 HIS A 79 10.841 -5.643 -6.240 1.00 0.00 H new ATOM 1276 N TYR A 80 11.516 0.966 -9.474 1.00 0.00 N ATOM 1277 CA TYR A 80 11.756 2.078 -10.392 1.00 0.00 C ATOM 1278 C TYR A 80 12.357 3.296 -9.697 1.00 0.00 C ATOM 1279 O TYR A 80 13.406 3.797 -10.107 1.00 0.00 O ATOM 1280 CB TYR A 80 10.453 2.471 -11.091 1.00 0.00 C ATOM 1281 CG TYR A 80 9.837 1.352 -11.901 1.00 0.00 C ATOM 1282 CD1 TYR A 80 10.323 1.038 -13.164 1.00 0.00 C ATOM 1283 CD2 TYR A 80 8.771 0.612 -11.406 1.00 0.00 C ATOM 1284 CE1 TYR A 80 9.766 0.018 -13.910 1.00 0.00 C ATOM 1285 CE2 TYR A 80 8.208 -0.410 -12.147 1.00 0.00 C ATOM 1286 CZ TYR A 80 8.709 -0.702 -13.398 1.00 0.00 C ATOM 1287 OH TYR A 80 8.146 -1.718 -14.139 1.00 0.00 O ATOM 0 H TYR A 80 10.541 0.671 -9.428 1.00 0.00 H new ATOM 0 HA TYR A 80 12.484 1.733 -11.126 1.00 0.00 H new ATOM 0 HB2 TYR A 80 9.735 2.803 -10.341 1.00 0.00 H new ATOM 0 HB3 TYR A 80 10.645 3.320 -11.747 1.00 0.00 H new ATOM 0 HD1 TYR A 80 11.151 1.601 -13.569 1.00 0.00 H new ATOM 0 HD2 TYR A 80 8.376 0.839 -10.427 1.00 0.00 H new ATOM 0 HE1 TYR A 80 10.157 -0.214 -14.890 1.00 0.00 H new ATOM 0 HE2 TYR A 80 7.380 -0.977 -11.748 1.00 0.00 H new ATOM 0 HH TYR A 80 7.412 -2.125 -13.632 1.00 0.00 H new ATOM 1297 N ASP A 81 11.700 3.771 -8.648 1.00 0.00 N ATOM 1298 CA ASP A 81 12.177 4.949 -7.927 1.00 0.00 C ATOM 1299 C ASP A 81 13.493 4.657 -7.224 1.00 0.00 C ATOM 1300 O ASP A 81 14.394 5.499 -7.201 1.00 0.00 O ATOM 1301 CB ASP A 81 11.139 5.427 -6.907 1.00 0.00 C ATOM 1302 CG ASP A 81 9.889 5.978 -7.559 1.00 0.00 C ATOM 1303 OD1 ASP A 81 9.961 7.047 -8.202 1.00 0.00 O ATOM 1304 OD2 ASP A 81 8.828 5.340 -7.439 1.00 0.00 O ATOM 0 H ASP A 81 10.841 3.364 -8.277 1.00 0.00 H new ATOM 0 HA ASP A 81 12.337 5.740 -8.659 1.00 0.00 H new ATOM 0 HB2 ASP A 81 10.868 4.597 -6.255 1.00 0.00 H new ATOM 0 HB3 ASP A 81 11.584 6.196 -6.276 1.00 0.00 H new ATOM 1309 N HIS A 82 13.589 3.461 -6.644 1.00 0.00 N ATOM 1310 CA HIS A 82 14.786 3.025 -5.923 1.00 0.00 C ATOM 1311 C HIS A 82 15.085 3.957 -4.744 1.00 0.00 C ATOM 1312 O HIS A 82 16.203 4.002 -4.234 1.00 0.00 O ATOM 1313 CB HIS A 82 15.994 2.933 -6.874 1.00 0.00 C ATOM 1314 CG HIS A 82 17.188 2.244 -6.272 1.00 0.00 C ATOM 1315 ND1 HIS A 82 18.465 2.758 -6.326 1.00 0.00 N ATOM 1316 CD2 HIS A 82 17.282 1.088 -5.574 1.00 0.00 C ATOM 1317 CE1 HIS A 82 19.291 1.949 -5.687 1.00 0.00 C ATOM 1318 NE2 HIS A 82 18.598 0.927 -5.222 1.00 0.00 N ATOM 0 H HIS A 82 12.841 2.768 -6.660 1.00 0.00 H new ATOM 0 HA HIS A 82 14.596 2.029 -5.522 1.00 0.00 H new ATOM 0 HB2 HIS A 82 15.695 2.400 -7.776 1.00 0.00 H new ATOM 0 HB3 HIS A 82 16.282 3.939 -7.179 1.00 0.00 H new ATOM 0 HD2 HIS A 82 16.470 0.416 -5.338 1.00 0.00 H new ATOM 0 HE1 HIS A 82 20.354 2.099 -5.566 1.00 0.00 H new ATOM 0 HE2 HIS A 82 18.978 0.145 -4.688 1.00 0.00 H new ATOM 1327 N VAL A 83 14.071 4.687 -4.297 1.00 0.00 N ATOM 1328 CA VAL A 83 14.228 5.600 -3.173 1.00 0.00 C ATOM 1329 C VAL A 83 13.916 4.855 -1.874 1.00 0.00 C ATOM 1330 O VAL A 83 13.847 5.430 -0.787 1.00 0.00 O ATOM 1331 CB VAL A 83 13.335 6.856 -3.339 1.00 0.00 C ATOM 1332 CG1 VAL A 83 11.863 6.508 -3.216 1.00 0.00 C ATOM 1333 CG2 VAL A 83 13.722 7.943 -2.348 1.00 0.00 C ATOM 0 H VAL A 83 13.132 4.664 -4.695 1.00 0.00 H new ATOM 0 HA VAL A 83 15.259 5.952 -3.139 1.00 0.00 H new ATOM 0 HB VAL A 83 13.502 7.245 -4.344 1.00 0.00 H new ATOM 0 HG11 VAL A 83 11.264 7.411 -3.337 1.00 0.00 H new ATOM 0 HG12 VAL A 83 11.594 5.788 -3.988 1.00 0.00 H new ATOM 0 HG13 VAL A 83 11.672 6.075 -2.234 1.00 0.00 H new ATOM 0 HG21 VAL A 83 13.078 8.811 -2.490 1.00 0.00 H new ATOM 0 HG22 VAL A 83 13.606 7.567 -1.332 1.00 0.00 H new ATOM 0 HG23 VAL A 83 14.760 8.232 -2.512 1.00 0.00 H new ATOM 1343 N LEU A 84 13.741 3.549 -2.015 1.00 0.00 N ATOM 1344 CA LEU A 84 13.461 2.671 -0.896 1.00 0.00 C ATOM 1345 C LEU A 84 14.743 1.941 -0.515 1.00 0.00 C ATOM 1346 O LEU A 84 15.390 1.324 -1.366 1.00 0.00 O ATOM 1347 CB LEU A 84 12.372 1.662 -1.283 1.00 0.00 C ATOM 1348 CG LEU A 84 11.449 1.198 -0.148 1.00 0.00 C ATOM 1349 CD1 LEU A 84 12.159 0.209 0.761 1.00 0.00 C ATOM 1350 CD2 LEU A 84 10.941 2.385 0.653 1.00 0.00 C ATOM 0 H LEU A 84 13.790 3.070 -2.914 1.00 0.00 H new ATOM 0 HA LEU A 84 13.105 3.254 -0.047 1.00 0.00 H new ATOM 0 HB2 LEU A 84 11.757 2.104 -2.067 1.00 0.00 H new ATOM 0 HB3 LEU A 84 12.854 0.785 -1.714 1.00 0.00 H new ATOM 0 HG LEU A 84 10.593 0.694 -0.598 1.00 0.00 H new ATOM 0 HD11 LEU A 84 11.483 -0.104 1.557 1.00 0.00 H new ATOM 0 HD12 LEU A 84 12.466 -0.662 0.182 1.00 0.00 H new ATOM 0 HD13 LEU A 84 13.038 0.683 1.197 1.00 0.00 H new ATOM 0 HD21 LEU A 84 10.289 2.032 1.452 1.00 0.00 H new ATOM 0 HD22 LEU A 84 11.786 2.921 1.085 1.00 0.00 H new ATOM 0 HD23 LEU A 84 10.383 3.054 -0.002 1.00 0.00 H new ATOM 1362 N ILE A 85 15.121 2.028 0.748 1.00 0.00 N ATOM 1363 CA ILE A 85 16.328 1.371 1.226 1.00 0.00 C ATOM 1364 C ILE A 85 15.973 0.003 1.782 1.00 0.00 C ATOM 1365 O ILE A 85 14.920 -0.165 2.398 1.00 0.00 O ATOM 1366 CB ILE A 85 17.025 2.195 2.332 1.00 0.00 C ATOM 1367 CG1 ILE A 85 16.972 3.688 2.012 1.00 0.00 C ATOM 1368 CG2 ILE A 85 18.467 1.740 2.516 1.00 0.00 C ATOM 1369 CD1 ILE A 85 17.044 4.565 3.241 1.00 0.00 C ATOM 0 H ILE A 85 14.611 2.547 1.463 1.00 0.00 H new ATOM 0 HA ILE A 85 17.013 1.277 0.383 1.00 0.00 H new ATOM 0 HB ILE A 85 16.490 2.026 3.266 1.00 0.00 H new ATOM 0 HG12 ILE A 85 17.797 3.939 1.346 1.00 0.00 H new ATOM 0 HG13 ILE A 85 16.050 3.905 1.473 1.00 0.00 H new ATOM 0 HG21 ILE A 85 18.939 2.333 3.299 1.00 0.00 H new ATOM 0 HG22 ILE A 85 18.483 0.687 2.799 1.00 0.00 H new ATOM 0 HG23 ILE A 85 19.013 1.873 1.582 1.00 0.00 H new ATOM 0 HD11 ILE A 85 17.002 5.613 2.943 1.00 0.00 H new ATOM 0 HD12 ILE A 85 16.204 4.340 3.898 1.00 0.00 H new ATOM 0 HD13 ILE A 85 17.979 4.375 3.769 1.00 0.00 H new ATOM 1381 N GLU A 86 16.822 -0.981 1.550 1.00 0.00 N ATOM 1382 CA GLU A 86 16.557 -2.313 2.057 1.00 0.00 C ATOM 1383 C GLU A 86 17.760 -2.836 2.828 1.00 0.00 C ATOM 1384 O GLU A 86 18.713 -3.348 2.233 1.00 0.00 O ATOM 1385 CB GLU A 86 16.205 -3.275 0.923 1.00 0.00 C ATOM 1386 CG GLU A 86 15.627 -2.612 -0.317 1.00 0.00 C ATOM 1387 CD GLU A 86 15.363 -3.602 -1.432 1.00 0.00 C ATOM 1388 OE1 GLU A 86 14.610 -4.571 -1.207 1.00 0.00 O ATOM 1389 OE2 GLU A 86 15.907 -3.415 -2.544 1.00 0.00 O ATOM 0 H GLU A 86 17.689 -0.885 1.021 1.00 0.00 H new ATOM 0 HA GLU A 86 15.702 -2.250 2.730 1.00 0.00 H new ATOM 0 HB2 GLU A 86 17.103 -3.825 0.639 1.00 0.00 H new ATOM 0 HB3 GLU A 86 15.488 -4.006 1.295 1.00 0.00 H new ATOM 0 HG2 GLU A 86 14.697 -2.107 -0.056 1.00 0.00 H new ATOM 0 HG3 GLU A 86 16.317 -1.846 -0.671 1.00 0.00 H new ATOM 1672 N TYR A 107 15.335 -5.397 5.356 1.00 0.00 N ATOM 1673 CA TYR A 107 14.380 -4.499 5.991 1.00 0.00 C ATOM 1674 C TYR A 107 14.093 -3.304 5.098 1.00 0.00 C ATOM 1675 O TYR A 107 15.004 -2.569 4.725 1.00 0.00 O ATOM 1676 CB TYR A 107 14.918 -4.014 7.340 1.00 0.00 C ATOM 1677 CG TYR A 107 14.975 -5.084 8.404 1.00 0.00 C ATOM 1678 CD1 TYR A 107 15.915 -6.103 8.339 1.00 0.00 C ATOM 1679 CD2 TYR A 107 14.094 -5.070 9.478 1.00 0.00 C ATOM 1680 CE1 TYR A 107 15.975 -7.079 9.311 1.00 0.00 C ATOM 1681 CE2 TYR A 107 14.150 -6.044 10.456 1.00 0.00 C ATOM 1682 CZ TYR A 107 15.093 -7.044 10.366 1.00 0.00 C ATOM 1683 OH TYR A 107 15.152 -8.014 11.334 1.00 0.00 O ATOM 0 HA TYR A 107 13.454 -5.050 6.153 1.00 0.00 H new ATOM 0 HB2 TYR A 107 15.919 -3.608 7.195 1.00 0.00 H new ATOM 0 HB3 TYR A 107 14.291 -3.196 7.696 1.00 0.00 H new ATOM 0 HD1 TYR A 107 16.611 -6.132 7.514 1.00 0.00 H new ATOM 0 HD2 TYR A 107 13.354 -4.286 9.549 1.00 0.00 H new ATOM 0 HE1 TYR A 107 16.711 -7.867 9.244 1.00 0.00 H new ATOM 0 HE2 TYR A 107 13.459 -6.022 11.286 1.00 0.00 H new ATOM 0 HH TYR A 107 14.462 -7.845 12.009 1.00 0.00 H new ATOM 1693 N LEU A 108 12.829 -3.113 4.768 1.00 0.00 N ATOM 1694 CA LEU A 108 12.429 -2.007 3.915 1.00 0.00 C ATOM 1695 C LEU A 108 12.288 -0.729 4.715 1.00 0.00 C ATOM 1696 O LEU A 108 11.523 -0.672 5.673 1.00 0.00 O ATOM 1697 CB LEU A 108 11.102 -2.309 3.214 1.00 0.00 C ATOM 1698 CG LEU A 108 11.161 -3.377 2.129 1.00 0.00 C ATOM 1699 CD1 LEU A 108 12.492 -3.325 1.402 1.00 0.00 C ATOM 1700 CD2 LEU A 108 10.928 -4.752 2.729 1.00 0.00 C ATOM 0 H LEU A 108 12.061 -3.709 5.077 1.00 0.00 H new ATOM 0 HA LEU A 108 13.210 -1.876 3.165 1.00 0.00 H new ATOM 0 HB2 LEU A 108 10.377 -2.620 3.966 1.00 0.00 H new ATOM 0 HB3 LEU A 108 10.727 -1.386 2.771 1.00 0.00 H new ATOM 0 HG LEU A 108 10.371 -3.180 1.404 1.00 0.00 H new ATOM 0 HD11 LEU A 108 12.516 -4.095 0.631 1.00 0.00 H new ATOM 0 HD12 LEU A 108 12.617 -2.345 0.941 1.00 0.00 H new ATOM 0 HD13 LEU A 108 13.301 -3.497 2.112 1.00 0.00 H new ATOM 0 HD21 LEU A 108 10.973 -5.505 1.942 1.00 0.00 H new ATOM 0 HD22 LEU A 108 11.697 -4.959 3.474 1.00 0.00 H new ATOM 0 HD23 LEU A 108 9.947 -4.781 3.203 1.00 0.00 H new ATOM 1712 N VAL A 109 13.025 0.290 4.317 1.00 0.00 N ATOM 1713 CA VAL A 109 12.969 1.582 4.985 1.00 0.00 C ATOM 1714 C VAL A 109 12.752 2.686 3.952 1.00 0.00 C ATOM 1715 O VAL A 109 13.348 2.660 2.876 1.00 0.00 O ATOM 1716 CB VAL A 109 14.246 1.850 5.830 1.00 0.00 C ATOM 1717 CG1 VAL A 109 15.474 1.233 5.183 1.00 0.00 C ATOM 1718 CG2 VAL A 109 14.464 3.343 6.065 1.00 0.00 C ATOM 0 H VAL A 109 13.674 0.250 3.531 1.00 0.00 H new ATOM 0 HA VAL A 109 12.128 1.573 5.678 1.00 0.00 H new ATOM 0 HB VAL A 109 14.092 1.376 6.799 1.00 0.00 H new ATOM 0 HG11 VAL A 109 16.351 1.438 5.798 1.00 0.00 H new ATOM 0 HG12 VAL A 109 15.336 0.155 5.095 1.00 0.00 H new ATOM 0 HG13 VAL A 109 15.618 1.663 4.192 1.00 0.00 H new ATOM 0 HG21 VAL A 109 15.366 3.490 6.659 1.00 0.00 H new ATOM 0 HG22 VAL A 109 14.574 3.850 5.106 1.00 0.00 H new ATOM 0 HG23 VAL A 109 13.607 3.756 6.597 1.00 0.00 H new ATOM 1728 N VAL A 110 11.896 3.651 4.278 1.00 0.00 N ATOM 1729 CA VAL A 110 11.597 4.738 3.357 1.00 0.00 C ATOM 1730 C VAL A 110 11.994 6.088 3.948 1.00 0.00 C ATOM 1731 O VAL A 110 11.860 6.319 5.152 1.00 0.00 O ATOM 1732 CB VAL A 110 10.096 4.754 2.967 1.00 0.00 C ATOM 1733 CG1 VAL A 110 9.207 5.074 4.161 1.00 0.00 C ATOM 1734 CG2 VAL A 110 9.838 5.738 1.833 1.00 0.00 C ATOM 0 H VAL A 110 11.401 3.701 5.168 1.00 0.00 H new ATOM 0 HA VAL A 110 12.186 4.564 2.456 1.00 0.00 H new ATOM 0 HB VAL A 110 9.842 3.752 2.622 1.00 0.00 H new ATOM 0 HG11 VAL A 110 8.163 5.076 3.847 1.00 0.00 H new ATOM 0 HG12 VAL A 110 9.352 4.320 4.935 1.00 0.00 H new ATOM 0 HG13 VAL A 110 9.469 6.055 4.557 1.00 0.00 H new ATOM 0 HG21 VAL A 110 8.778 5.730 1.578 1.00 0.00 H new ATOM 0 HG22 VAL A 110 10.128 6.740 2.148 1.00 0.00 H new ATOM 0 HG23 VAL A 110 10.423 5.449 0.960 1.00 0.00 H new ATOM 1744 N ASN A 111 12.500 6.963 3.091 1.00 0.00 N ATOM 1745 CA ASN A 111 12.906 8.300 3.497 1.00 0.00 C ATOM 1746 C ASN A 111 11.834 9.301 3.078 1.00 0.00 C ATOM 1747 O ASN A 111 11.189 9.116 2.048 1.00 0.00 O ATOM 1748 CB ASN A 111 14.246 8.675 2.851 1.00 0.00 C ATOM 1749 CG ASN A 111 15.425 7.912 3.429 1.00 0.00 C ATOM 1750 OD1 ASN A 111 16.402 7.642 2.726 1.00 0.00 O ATOM 1751 ND2 ASN A 111 15.362 7.582 4.711 1.00 0.00 N ATOM 0 H ASN A 111 12.640 6.767 2.100 1.00 0.00 H new ATOM 0 HA ASN A 111 13.026 8.320 4.580 1.00 0.00 H new ATOM 0 HB2 ASN A 111 14.190 8.486 1.779 1.00 0.00 H new ATOM 0 HB3 ASN A 111 14.416 9.744 2.978 1.00 0.00 H new ATOM 0 HD21 ASN A 111 16.139 7.087 5.149 1.00 0.00 H new ATOM 0 HD22 ASN A 111 14.537 7.823 5.260 1.00 0.00 H new ATOM 1758 N PRO A 112 11.639 10.380 3.854 1.00 0.00 N ATOM 1759 CA PRO A 112 10.629 11.404 3.550 1.00 0.00 C ATOM 1760 C PRO A 112 10.985 12.236 2.318 1.00 0.00 C ATOM 1761 O PRO A 112 10.191 13.060 1.859 1.00 0.00 O ATOM 1762 CB PRO A 112 10.622 12.282 4.804 1.00 0.00 C ATOM 1763 CG PRO A 112 11.971 12.097 5.405 1.00 0.00 C ATOM 1764 CD PRO A 112 12.378 10.685 5.093 1.00 0.00 C ATOM 0 HA PRO A 112 9.662 10.959 3.317 1.00 0.00 H new ATOM 0 HB2 PRO A 112 10.440 13.327 4.554 1.00 0.00 H new ATOM 0 HB3 PRO A 112 9.836 11.978 5.495 1.00 0.00 H new ATOM 0 HG2 PRO A 112 12.684 12.809 4.988 1.00 0.00 H new ATOM 0 HG3 PRO A 112 11.944 12.266 6.482 1.00 0.00 H new ATOM 0 HD2 PRO A 112 13.455 10.600 4.949 1.00 0.00 H new ATOM 0 HD3 PRO A 112 12.109 10.002 5.899 1.00 0.00 H new ATOM 1772 N ASN A 113 12.185 12.017 1.790 1.00 0.00 N ATOM 1773 CA ASN A 113 12.650 12.738 0.616 1.00 0.00 C ATOM 1774 C ASN A 113 11.780 12.412 -0.592 1.00 0.00 C ATOM 1775 O ASN A 113 11.098 13.290 -1.130 1.00 0.00 O ATOM 1776 CB ASN A 113 14.108 12.382 0.318 1.00 0.00 C ATOM 1777 CG ASN A 113 14.744 13.320 -0.689 1.00 0.00 C ATOM 1778 OD1 ASN A 113 14.453 14.516 -0.713 1.00 0.00 O ATOM 1779 ND2 ASN A 113 15.607 12.781 -1.535 1.00 0.00 N ATOM 0 H ASN A 113 12.854 11.342 2.161 1.00 0.00 H new ATOM 0 HA ASN A 113 12.580 13.806 0.820 1.00 0.00 H new ATOM 0 HB2 ASN A 113 14.681 12.408 1.245 1.00 0.00 H new ATOM 0 HB3 ASN A 113 14.159 11.361 -0.060 1.00 0.00 H new ATOM 0 HD21 ASN A 113 16.059 13.362 -2.241 1.00 0.00 H new ATOM 0 HD22 ASN A 113 15.820 11.785 -1.481 1.00 0.00 H new ATOM 1786 N TYR A 114 11.793 11.139 -0.996 1.00 0.00 N ATOM 1787 CA TYR A 114 11.019 10.673 -2.140 1.00 0.00 C ATOM 1788 C TYR A 114 11.334 11.518 -3.378 1.00 0.00 C ATOM 1789 O TYR A 114 12.423 12.081 -3.493 1.00 0.00 O ATOM 1790 CB TYR A 114 9.523 10.728 -1.812 1.00 0.00 C ATOM 1791 CG TYR A 114 8.783 9.428 -2.042 1.00 0.00 C ATOM 1792 CD1 TYR A 114 8.582 8.933 -3.325 1.00 0.00 C ATOM 1793 CD2 TYR A 114 8.269 8.703 -0.975 1.00 0.00 C ATOM 1794 CE1 TYR A 114 7.888 7.756 -3.537 1.00 0.00 C ATOM 1795 CE2 TYR A 114 7.579 7.523 -1.179 1.00 0.00 C ATOM 1796 CZ TYR A 114 7.390 7.057 -2.462 1.00 0.00 C ATOM 1797 OH TYR A 114 6.696 5.887 -2.670 1.00 0.00 O ATOM 0 H TYR A 114 12.339 10.409 -0.539 1.00 0.00 H new ATOM 0 HA TYR A 114 11.292 9.640 -2.357 1.00 0.00 H new ATOM 0 HB2 TYR A 114 9.403 11.020 -0.769 1.00 0.00 H new ATOM 0 HB3 TYR A 114 9.060 11.507 -2.417 1.00 0.00 H new ATOM 0 HD1 TYR A 114 8.975 9.477 -4.171 1.00 0.00 H new ATOM 0 HD2 TYR A 114 8.411 9.068 0.032 1.00 0.00 H new ATOM 0 HE1 TYR A 114 7.738 7.388 -4.541 1.00 0.00 H new ATOM 0 HE2 TYR A 114 7.190 6.969 -0.337 1.00 0.00 H new ATOM 0 HH TYR A 114 6.239 5.927 -3.536 1.00 0.00 H new ATOM 1807 N LEU A 115 10.393 11.586 -4.309 1.00 0.00 N ATOM 1808 CA LEU A 115 10.579 12.374 -5.524 1.00 0.00 C ATOM 1809 C LEU A 115 9.251 12.946 -6.013 1.00 0.00 C ATOM 1810 O LEU A 115 9.098 13.272 -7.188 1.00 0.00 O ATOM 1811 CB LEU A 115 11.269 11.560 -6.649 1.00 0.00 C ATOM 1812 CG LEU A 115 10.862 10.081 -6.843 1.00 0.00 C ATOM 1813 CD1 LEU A 115 11.591 9.179 -5.859 1.00 0.00 C ATOM 1814 CD2 LEU A 115 9.356 9.882 -6.738 1.00 0.00 C ATOM 0 H LEU A 115 9.494 11.107 -4.249 1.00 0.00 H new ATOM 0 HA LEU A 115 11.241 13.201 -5.268 1.00 0.00 H new ATOM 0 HB2 LEU A 115 11.092 12.079 -7.591 1.00 0.00 H new ATOM 0 HB3 LEU A 115 12.343 11.587 -6.467 1.00 0.00 H new ATOM 0 HG LEU A 115 11.158 9.801 -7.854 1.00 0.00 H new ATOM 0 HD11 LEU A 115 11.285 8.145 -6.018 1.00 0.00 H new ATOM 0 HD12 LEU A 115 12.667 9.267 -6.012 1.00 0.00 H new ATOM 0 HD13 LEU A 115 11.344 9.477 -4.840 1.00 0.00 H new ATOM 0 HD21 LEU A 115 9.117 8.828 -6.881 1.00 0.00 H new ATOM 0 HD22 LEU A 115 9.015 10.201 -5.753 1.00 0.00 H new ATOM 0 HD23 LEU A 115 8.856 10.474 -7.505 1.00 0.00 H new ATOM 2020 N LEU B 390 -4.677 -9.587 -3.165 1.00 0.00 N ATOM 2021 CA LEU B 390 -6.117 -9.370 -3.287 1.00 0.00 C ATOM 2022 C LEU B 390 -6.867 -10.608 -2.792 1.00 0.00 C ATOM 2023 O LEU B 390 -8.091 -10.606 -2.677 1.00 0.00 O ATOM 2024 CB LEU B 390 -6.517 -9.038 -4.735 1.00 0.00 C ATOM 2025 CG LEU B 390 -7.957 -8.523 -4.916 1.00 0.00 C ATOM 2026 CD1 LEU B 390 -8.003 -6.997 -4.956 1.00 0.00 C ATOM 2027 CD2 LEU B 390 -8.575 -9.106 -6.177 1.00 0.00 C ATOM 0 HA LEU B 390 -6.388 -8.513 -2.670 1.00 0.00 H new ATOM 0 HB2 LEU B 390 -5.828 -8.287 -5.122 1.00 0.00 H new ATOM 0 HB3 LEU B 390 -6.389 -9.932 -5.345 1.00 0.00 H new ATOM 0 HG LEU B 390 -8.539 -8.851 -4.055 1.00 0.00 H new ATOM 0 HD11 LEU B 390 -9.034 -6.667 -5.085 1.00 0.00 H new ATOM 0 HD12 LEU B 390 -7.608 -6.596 -4.022 1.00 0.00 H new ATOM 0 HD13 LEU B 390 -7.400 -6.637 -5.789 1.00 0.00 H new ATOM 0 HD21 LEU B 390 -9.593 -8.732 -6.290 1.00 0.00 H new ATOM 0 HD22 LEU B 390 -7.982 -8.811 -7.043 1.00 0.00 H new ATOM 0 HD23 LEU B 390 -8.594 -10.193 -6.104 1.00 0.00 H new ATOM 2039 N GLU B 391 -6.114 -11.669 -2.494 1.00 0.00 N ATOM 2040 CA GLU B 391 -6.684 -12.904 -1.972 1.00 0.00 C ATOM 2041 C GLU B 391 -7.284 -12.649 -0.591 1.00 0.00 C ATOM 2042 O GLU B 391 -8.079 -13.430 -0.088 1.00 0.00 O ATOM 2043 CB GLU B 391 -5.607 -13.989 -1.883 1.00 0.00 C ATOM 2044 CG GLU B 391 -4.482 -13.650 -0.919 1.00 0.00 C ATOM 2045 CD GLU B 391 -3.660 -14.854 -0.524 1.00 0.00 C ATOM 2046 OE1 GLU B 391 -2.910 -15.377 -1.374 1.00 0.00 O ATOM 2047 OE2 GLU B 391 -3.765 -15.293 0.639 1.00 0.00 O ATOM 0 H GLU B 391 -5.101 -11.693 -2.608 1.00 0.00 H new ATOM 0 HA GLU B 391 -7.468 -13.246 -2.647 1.00 0.00 H new ATOM 0 HB2 GLU B 391 -6.071 -14.925 -1.573 1.00 0.00 H new ATOM 0 HB3 GLU B 391 -5.187 -14.155 -2.875 1.00 0.00 H new ATOM 0 HG2 GLU B 391 -3.830 -12.906 -1.377 1.00 0.00 H new ATOM 0 HG3 GLU B 391 -4.904 -13.195 -0.023 1.00 0.00 H new ATOM 2054 N ARG B 392 -6.884 -11.538 0.013 1.00 0.00 N ATOM 2055 CA ARG B 392 -7.388 -11.146 1.319 1.00 0.00 C ATOM 2056 C ARG B 392 -8.776 -10.527 1.166 1.00 0.00 C ATOM 2057 O ARG B 392 -9.574 -10.500 2.104 1.00 0.00 O ATOM 2058 CB ARG B 392 -6.428 -10.139 1.963 1.00 0.00 C ATOM 2059 CG ARG B 392 -6.968 -9.469 3.214 1.00 0.00 C ATOM 2060 CD ARG B 392 -6.657 -10.281 4.459 1.00 0.00 C ATOM 2061 NE ARG B 392 -5.233 -10.236 4.804 1.00 0.00 N ATOM 2062 CZ ARG B 392 -4.763 -10.354 6.047 1.00 0.00 C ATOM 2063 NH1 ARG B 392 -5.600 -10.535 7.066 1.00 0.00 N ATOM 2064 NH2 ARG B 392 -3.452 -10.295 6.273 1.00 0.00 N ATOM 0 H ARG B 392 -6.206 -10.889 -0.386 1.00 0.00 H new ATOM 0 HA ARG B 392 -7.459 -12.024 1.960 1.00 0.00 H new ATOM 0 HB2 ARG B 392 -5.498 -10.650 2.212 1.00 0.00 H new ATOM 0 HB3 ARG B 392 -6.183 -9.370 1.231 1.00 0.00 H new ATOM 0 HG2 ARG B 392 -6.535 -8.473 3.310 1.00 0.00 H new ATOM 0 HG3 ARG B 392 -8.046 -9.340 3.122 1.00 0.00 H new ATOM 0 HD2 ARG B 392 -7.244 -9.902 5.295 1.00 0.00 H new ATOM 0 HD3 ARG B 392 -6.959 -11.316 4.301 1.00 0.00 H new ATOM 0 HE ARG B 392 -4.561 -10.107 4.048 1.00 0.00 H new ATOM 0 HH11 ARG B 392 -6.605 -10.584 6.898 1.00 0.00 H new ATOM 0 HH12 ARG B 392 -5.237 -10.625 8.015 1.00 0.00 H new ATOM 0 HH21 ARG B 392 -2.806 -10.159 5.495 1.00 0.00 H new ATOM 0 HH22 ARG B 392 -3.094 -10.385 7.224 1.00 0.00 H new ATOM 2078 N ILE B 393 -9.069 -10.057 -0.041 1.00 0.00 N ATOM 2079 CA ILE B 393 -10.345 -9.415 -0.321 1.00 0.00 C ATOM 2080 C ILE B 393 -11.501 -10.423 -0.321 1.00 0.00 C ATOM 2081 O ILE B 393 -12.645 -10.075 -0.020 1.00 0.00 O ATOM 2082 CB ILE B 393 -10.327 -8.662 -1.664 1.00 0.00 C ATOM 2083 CG1 ILE B 393 -9.083 -7.771 -1.767 1.00 0.00 C ATOM 2084 CG2 ILE B 393 -11.592 -7.830 -1.817 1.00 0.00 C ATOM 2085 CD1 ILE B 393 -8.911 -6.809 -0.613 1.00 0.00 C ATOM 0 H ILE B 393 -8.439 -10.109 -0.841 1.00 0.00 H new ATOM 0 HA ILE B 393 -10.504 -8.695 0.482 1.00 0.00 H new ATOM 0 HB ILE B 393 -10.291 -9.394 -2.471 1.00 0.00 H new ATOM 0 HG12 ILE B 393 -8.199 -8.406 -1.830 1.00 0.00 H new ATOM 0 HG13 ILE B 393 -9.134 -7.202 -2.695 1.00 0.00 H new ATOM 0 HG21 ILE B 393 -11.567 -7.302 -2.770 1.00 0.00 H new ATOM 0 HG22 ILE B 393 -12.463 -8.484 -1.787 1.00 0.00 H new ATOM 0 HG23 ILE B 393 -11.652 -7.107 -1.004 1.00 0.00 H new ATOM 0 HD11 ILE B 393 -8.008 -6.217 -0.764 1.00 0.00 H new ATOM 0 HD12 ILE B 393 -9.775 -6.146 -0.560 1.00 0.00 H new ATOM 0 HD13 ILE B 393 -8.826 -7.369 0.318 1.00 0.00 H new ATOM 2097 N ARG B 394 -11.209 -11.674 -0.654 1.00 0.00 N ATOM 2098 CA ARG B 394 -12.246 -12.699 -0.670 1.00 0.00 C ATOM 2099 C ARG B 394 -12.701 -12.995 0.754 1.00 0.00 C ATOM 2100 O ARG B 394 -13.838 -13.401 0.986 1.00 0.00 O ATOM 2101 CB ARG B 394 -11.760 -13.977 -1.368 1.00 0.00 C ATOM 2102 CG ARG B 394 -10.586 -14.649 -0.681 1.00 0.00 C ATOM 2103 CD ARG B 394 -10.084 -15.846 -1.471 1.00 0.00 C ATOM 2104 NE ARG B 394 -8.768 -16.295 -1.015 1.00 0.00 N ATOM 2105 CZ ARG B 394 -7.950 -17.048 -1.747 1.00 0.00 C ATOM 2106 NH1 ARG B 394 -8.307 -17.428 -2.968 1.00 0.00 N ATOM 2107 NH2 ARG B 394 -6.769 -17.418 -1.266 1.00 0.00 N ATOM 0 H ARG B 394 -10.278 -12.001 -0.913 1.00 0.00 H new ATOM 0 HA ARG B 394 -13.095 -12.322 -1.241 1.00 0.00 H new ATOM 0 HB2 ARG B 394 -12.587 -14.684 -1.425 1.00 0.00 H new ATOM 0 HB3 ARG B 394 -11.477 -13.734 -2.392 1.00 0.00 H new ATOM 0 HG2 ARG B 394 -9.777 -13.930 -0.556 1.00 0.00 H new ATOM 0 HG3 ARG B 394 -10.883 -14.970 0.317 1.00 0.00 H new ATOM 0 HD2 ARG B 394 -10.797 -16.665 -1.380 1.00 0.00 H new ATOM 0 HD3 ARG B 394 -10.031 -15.586 -2.528 1.00 0.00 H new ATOM 0 HE ARG B 394 -8.460 -16.015 -0.084 1.00 0.00 H new ATOM 0 HH11 ARG B 394 -9.210 -17.143 -3.347 1.00 0.00 H new ATOM 0 HH12 ARG B 394 -7.678 -18.005 -3.527 1.00 0.00 H new ATOM 0 HH21 ARG B 394 -6.485 -17.125 -0.331 1.00 0.00 H new ATOM 0 HH22 ARG B 394 -6.146 -17.995 -1.831 1.00 0.00 H new ATOM 2121 N ALA B 395 -11.817 -12.746 1.712 1.00 0.00 N ATOM 2122 CA ALA B 395 -12.126 -12.975 3.115 1.00 0.00 C ATOM 2123 C ALA B 395 -13.102 -11.919 3.630 1.00 0.00 C ATOM 2124 O ALA B 395 -14.081 -12.238 4.303 1.00 0.00 O ATOM 2125 CB ALA B 395 -10.850 -12.971 3.938 1.00 0.00 C ATOM 0 H ALA B 395 -10.879 -12.385 1.541 1.00 0.00 H new ATOM 0 HA ALA B 395 -12.601 -13.951 3.213 1.00 0.00 H new ATOM 0 HB1 ALA B 395 -11.093 -13.143 4.987 1.00 0.00 H new ATOM 0 HB2 ALA B 395 -10.187 -13.760 3.585 1.00 0.00 H new ATOM 0 HB3 ALA B 395 -10.353 -12.006 3.834 1.00 0.00 H new ATOM 2131 N LYS B 396 -12.841 -10.659 3.289 1.00 0.00 N ATOM 2132 CA LYS B 396 -13.697 -9.553 3.715 1.00 0.00 C ATOM 2133 C LYS B 396 -15.048 -9.606 3.011 1.00 0.00 C ATOM 2134 O LYS B 396 -15.987 -8.916 3.403 1.00 0.00 O ATOM 2135 CB LYS B 396 -13.024 -8.196 3.439 1.00 0.00 C ATOM 2136 CG LYS B 396 -12.552 -8.013 2.003 1.00 0.00 C ATOM 2137 CD LYS B 396 -13.272 -6.872 1.283 1.00 0.00 C ATOM 2138 CE LYS B 396 -14.689 -7.249 0.865 1.00 0.00 C ATOM 2139 NZ LYS B 396 -14.704 -8.203 -0.277 1.00 0.00 N ATOM 0 H LYS B 396 -12.043 -10.378 2.719 1.00 0.00 H new ATOM 0 HA LYS B 396 -13.854 -9.657 4.789 1.00 0.00 H new ATOM 0 HB2 LYS B 396 -13.726 -7.399 3.683 1.00 0.00 H new ATOM 0 HB3 LYS B 396 -12.170 -8.084 4.107 1.00 0.00 H new ATOM 0 HG2 LYS B 396 -11.479 -7.819 2.000 1.00 0.00 H new ATOM 0 HG3 LYS B 396 -12.710 -8.941 1.453 1.00 0.00 H new ATOM 0 HD2 LYS B 396 -13.309 -6.000 1.936 1.00 0.00 H new ATOM 0 HD3 LYS B 396 -12.700 -6.585 0.400 1.00 0.00 H new ATOM 0 HE2 LYS B 396 -15.210 -7.693 1.713 1.00 0.00 H new ATOM 0 HE3 LYS B 396 -15.237 -6.348 0.590 1.00 0.00 H new ATOM 0 HZ1 LYS B 396 -15.646 -8.638 -0.354 1.00 0.00 H new ATOM 0 HZ2 LYS B 396 -14.485 -7.694 -1.157 1.00 0.00 H new ATOM 0 HZ3 LYS B 396 -13.992 -8.945 -0.119 1.00 0.00 H new