USER MOD reduce.3.24.130724 H: found=0, std=0, add=873, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 874 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 411 MET CE :methyl 174:sc= -4.2 (180deg=-4.26!) USER MOD Set 1.2: A 450 MET CE :methyl 147:sc= -3.99! (180deg=-5.79!) USER MOD Set 2.1: A 421 HIS : no HD1:sc= -2.35 K(o=-5.4,f=-15!) USER MOD Set 2.2: A 423 SER OG : rot 72:sc= -0.562! USER MOD Set 2.3: A 439 SER OG : rot 177:sc= 1.18 USER MOD Set 2.4: A 442 CYS SG : rot 180:sc= 0.452 USER MOD Set 2.5: A 444 ASN : amide:sc= -4.17! C(o=-5.4!,f=-12!) USER MOD Set 3.1: A 372 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 374 THR OG1 : rot 180:sc= -0.86 USER MOD Set 3.3: A 375 THR OG1 : rot 65:sc= -0.13 USER MOD Set 3.4: A 440 HIS : no HD1:sc= -0.517 K(o=-1.5,f=-0.74) USER MOD Set 4.1: A 352 GLN : amide:sc= -7.68! C(o=-10!,f=-15!) USER MOD Set 4.2: A 370 SER OG : rot -150:sc= -1.64! USER MOD Set 4.3: A 377 THR OG1 : rot 81:sc= -0.87 USER MOD Single : A 343 THR OG1 : rot 31:sc= 0.336 USER MOD Single : A 344 TYR OH : rot 7:sc= 0.702 USER MOD Single : A 351 ASN : amide:sc= 0.0508 X(o=0.051,f=0) USER MOD Single : A 353 HIS : no HE2:sc= -4.55! C(o=-4.6!,f=-5.1!) USER MOD Single : A 354 MET CE :methyl -177:sc= -6.59! (180deg=-6.98!) USER MOD Single : A 356 TYR OH : rot 180:sc= 0 USER MOD Single : A 357 TYR OH : rot 180:sc= 0 USER MOD Single : A 358 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 361 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 366 THR OG1 : rot 80:sc= -1.99! USER MOD Single : A 383 TYR OH : rot 180:sc= 0 USER MOD Single : A 386 ASN : amide:sc= -0.776 K(o=-0.78,f=-0.13) USER MOD Single : A 387 LYS NZ :NH3+ -142:sc= 1.28 (180deg=-0.106) USER MOD Single : A 392 THR OG1 : rot 180:sc= 0 USER MOD Single : A 394 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 405 SER OG : rot -96:sc= 0.527 USER MOD Single : A 408 ASN : amide:sc= -1.29! K(o=-1.3!,f=-0.26) USER MOD Single : A 409 TYR OH : rot 180:sc= 0 USER MOD Single : A 416 THR OG1 : rot -84:sc= 1.23 USER MOD Single : A 426 GLN : amide:sc= -3.99 K(o=-4,f=-4.7!) USER MOD Single : A 429 TYR OH : rot 29:sc= -0.169 USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 436 THR OG1 : rot -36:sc= 0.963 USER MOD Single : A 445 THR OG1 : rot -141:sc= 1.1 USER MOD Single : A 448 SER OG : rot 180:sc= 0 USER MOD Single : A 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 456 MET CE :methyl 176:sc= -4.58! (180deg=-4.73!) USER MOD Single : A 459 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 461 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 72 N THR A 343 -16.166 0.100 4.389 1.00 0.23 N ATOM 73 CA THR A 343 -15.554 0.695 3.251 1.00 0.19 C ATOM 74 C THR A 343 -14.161 1.157 3.639 1.00 0.13 C ATOM 75 O THR A 343 -13.990 1.948 4.567 1.00 0.16 O ATOM 76 CB THR A 343 -16.382 1.890 2.777 1.00 0.24 C ATOM 77 OG1 THR A 343 -17.774 1.540 2.762 1.00 0.45 O ATOM 78 CG2 THR A 343 -15.960 2.305 1.397 1.00 0.20 C ATOM 0 HA THR A 343 -15.495 -0.031 2.440 1.00 0.19 H new ATOM 0 HB THR A 343 -16.219 2.720 3.464 1.00 0.24 H new ATOM 0 HG1 THR A 343 -17.954 0.882 3.466 1.00 0.45 H new ATOM 0 HG21 THR A 343 -16.559 3.157 1.074 1.00 0.20 H new ATOM 0 HG22 THR A 343 -14.907 2.585 1.407 1.00 0.20 H new ATOM 0 HG23 THR A 343 -16.108 1.475 0.706 1.00 0.20 H new ATOM 86 N TYR A 344 -13.186 0.661 2.912 1.00 0.10 N ATOM 87 CA TYR A 344 -11.794 0.891 3.199 1.00 0.07 C ATOM 88 C TYR A 344 -10.945 0.524 2.012 1.00 0.06 C ATOM 89 O TYR A 344 -11.443 0.288 0.921 1.00 0.08 O ATOM 90 CB TYR A 344 -11.332 0.027 4.357 1.00 0.08 C ATOM 91 CG TYR A 344 -11.796 -1.404 4.283 1.00 0.12 C ATOM 92 CD1 TYR A 344 -11.121 -2.326 3.513 1.00 0.14 C ATOM 93 CD2 TYR A 344 -12.905 -1.827 4.990 1.00 0.19 C ATOM 94 CE1 TYR A 344 -11.538 -3.639 3.451 1.00 0.20 C ATOM 95 CE2 TYR A 344 -13.329 -3.131 4.938 1.00 0.25 C ATOM 96 CZ TYR A 344 -12.656 -4.029 4.122 1.00 0.25 C ATOM 97 OH TYR A 344 -13.066 -5.338 4.129 1.00 0.32 O ATOM 0 H TYR A 344 -13.344 0.077 2.091 1.00 0.10 H new ATOM 0 HA TYR A 344 -11.688 1.948 3.443 1.00 0.07 H new ATOM 0 HB2 TYR A 344 -10.243 0.043 4.395 1.00 0.08 H new ATOM 0 HB3 TYR A 344 -11.690 0.466 5.288 1.00 0.08 H new ATOM 0 HD1 TYR A 344 -10.253 -2.016 2.950 1.00 0.14 H new ATOM 0 HD2 TYR A 344 -13.449 -1.117 5.596 1.00 0.19 H new ATOM 0 HE1 TYR A 344 -10.978 -4.357 2.871 1.00 0.20 H new ATOM 0 HE2 TYR A 344 -14.176 -3.454 5.525 1.00 0.25 H new ATOM 0 HH TYR A 344 -12.384 -5.897 3.701 1.00 0.32 H new ATOM 107 N ILE A 345 -9.647 0.497 2.238 1.00 0.05 N ATOM 108 CA ILE A 345 -8.742 -0.101 1.291 1.00 0.05 C ATOM 109 C ILE A 345 -8.316 -1.457 1.819 1.00 0.05 C ATOM 110 O ILE A 345 -8.410 -1.680 3.011 1.00 0.08 O ATOM 111 CB ILE A 345 -7.496 0.758 1.042 1.00 0.06 C ATOM 112 CG1 ILE A 345 -7.875 2.206 0.901 1.00 0.07 C ATOM 113 CG2 ILE A 345 -6.835 0.288 -0.231 1.00 0.06 C ATOM 114 CD1 ILE A 345 -8.907 2.377 -0.152 1.00 0.07 C ATOM 0 H ILE A 345 -9.200 0.883 3.070 1.00 0.05 H new ATOM 0 HA ILE A 345 -9.266 -0.192 0.340 1.00 0.05 H new ATOM 0 HB ILE A 345 -6.813 0.658 1.886 1.00 0.06 H new ATOM 0 HG12 ILE A 345 -8.252 2.583 1.852 1.00 0.07 H new ATOM 0 HG13 ILE A 345 -6.993 2.796 0.652 1.00 0.07 H new ATOM 0 HG21 ILE A 345 -5.946 0.889 -0.423 1.00 0.06 H new ATOM 0 HG22 ILE A 345 -6.550 -0.759 -0.128 1.00 0.06 H new ATOM 0 HG23 ILE A 345 -7.531 0.394 -1.063 1.00 0.06 H new ATOM 0 HD11 ILE A 345 -9.167 3.432 -0.238 1.00 0.07 H new ATOM 0 HD12 ILE A 345 -8.517 2.020 -1.105 1.00 0.07 H new ATOM 0 HD13 ILE A 345 -9.796 1.804 0.113 1.00 0.07 H new ATOM 126 N GLU A 346 -7.860 -2.360 0.967 1.00 0.05 N ATOM 127 CA GLU A 346 -7.458 -3.684 1.439 1.00 0.05 C ATOM 128 C GLU A 346 -6.216 -4.154 0.739 1.00 0.05 C ATOM 129 O GLU A 346 -5.870 -3.672 -0.315 1.00 0.06 O ATOM 130 CB GLU A 346 -8.581 -4.690 1.226 1.00 0.06 C ATOM 131 CG GLU A 346 -8.750 -5.603 2.389 1.00 0.07 C ATOM 132 CD GLU A 346 -9.774 -6.707 2.178 1.00 0.09 C ATOM 133 OE1 GLU A 346 -9.525 -7.615 1.355 1.00 0.12 O ATOM 134 OE2 GLU A 346 -10.826 -6.685 2.857 1.00 0.17 O1- ATOM 0 H GLU A 346 -7.758 -2.210 -0.037 1.00 0.05 H new ATOM 0 HA GLU A 346 -7.246 -3.606 2.505 1.00 0.05 H new ATOM 0 HB2 GLU A 346 -9.515 -4.156 1.047 1.00 0.06 H new ATOM 0 HB3 GLU A 346 -8.374 -5.278 0.332 1.00 0.06 H new ATOM 0 HG2 GLU A 346 -7.787 -6.057 2.622 1.00 0.07 H new ATOM 0 HG3 GLU A 346 -9.043 -5.014 3.258 1.00 0.07 H new ATOM 141 N VAL A 347 -5.518 -5.042 1.400 1.00 0.05 N ATOM 142 CA VAL A 347 -4.279 -5.596 0.923 1.00 0.05 C ATOM 143 C VAL A 347 -4.109 -6.984 1.470 1.00 0.07 C ATOM 144 O VAL A 347 -4.375 -7.244 2.640 1.00 0.08 O ATOM 145 CB VAL A 347 -3.094 -4.772 1.417 1.00 0.06 C ATOM 146 CG1 VAL A 347 -1.794 -5.481 1.106 1.00 0.06 C ATOM 147 CG2 VAL A 347 -3.100 -3.393 0.816 1.00 0.06 C ATOM 0 H VAL A 347 -5.804 -5.408 2.308 1.00 0.05 H new ATOM 0 HA VAL A 347 -4.310 -5.597 -0.167 1.00 0.05 H new ATOM 0 HB VAL A 347 -3.185 -4.665 2.498 1.00 0.06 H new ATOM 0 HG11 VAL A 347 -0.958 -4.881 1.464 1.00 0.06 H new ATOM 0 HG12 VAL A 347 -1.782 -6.452 1.600 1.00 0.06 H new ATOM 0 HG13 VAL A 347 -1.705 -5.621 0.029 1.00 0.06 H new ATOM 0 HG21 VAL A 347 -2.243 -2.830 1.187 1.00 0.06 H new ATOM 0 HG22 VAL A 347 -3.041 -3.469 -0.270 1.00 0.06 H new ATOM 0 HG23 VAL A 347 -4.020 -2.879 1.094 1.00 0.06 H new ATOM 157 N ASP A 348 -3.644 -7.847 0.623 1.00 0.08 N ATOM 158 CA ASP A 348 -3.298 -9.180 1.016 1.00 0.11 C ATOM 159 C ASP A 348 -1.839 -9.392 0.714 1.00 0.15 C ATOM 160 O ASP A 348 -1.424 -9.307 -0.438 1.00 0.24 O ATOM 161 CB ASP A 348 -4.185 -10.170 0.284 1.00 0.14 C ATOM 162 CG ASP A 348 -3.968 -11.615 0.685 1.00 0.18 C ATOM 163 OD1 ASP A 348 -2.838 -12.120 0.514 1.00 0.33 O ATOM 164 OD2 ASP A 348 -4.908 -12.252 1.182 1.00 0.37 O1- ATOM 0 H ASP A 348 -3.492 -7.648 -0.366 1.00 0.08 H new ATOM 0 HA ASP A 348 -3.458 -9.333 2.083 1.00 0.11 H new ATOM 0 HB2 ASP A 348 -5.228 -9.908 0.463 1.00 0.14 H new ATOM 0 HB3 ASP A 348 -4.012 -10.072 -0.788 1.00 0.14 H new ATOM 169 N LEU A 349 -1.063 -9.591 1.748 1.00 0.13 N ATOM 170 CA LEU A 349 0.371 -9.714 1.617 1.00 0.14 C ATOM 171 C LEU A 349 0.722 -10.970 0.858 1.00 0.20 C ATOM 172 O LEU A 349 1.497 -10.977 -0.092 1.00 0.32 O ATOM 173 CB LEU A 349 1.005 -9.741 3.010 1.00 0.16 C ATOM 174 CG LEU A 349 0.857 -8.474 3.842 1.00 0.14 C ATOM 175 CD1 LEU A 349 0.995 -7.250 2.995 1.00 0.14 C ATOM 176 CD2 LEU A 349 -0.457 -8.444 4.556 1.00 0.12 C ATOM 0 H LEU A 349 -1.405 -9.673 2.706 1.00 0.13 H new ATOM 0 HA LEU A 349 0.757 -8.860 1.061 1.00 0.14 H new ATOM 0 HB2 LEU A 349 0.570 -10.570 3.568 1.00 0.16 H new ATOM 0 HB3 LEU A 349 2.068 -9.955 2.898 1.00 0.16 H new ATOM 0 HG LEU A 349 1.658 -8.482 4.581 1.00 0.14 H new ATOM 0 HD11 LEU A 349 0.885 -6.362 3.618 1.00 0.14 H new ATOM 0 HD12 LEU A 349 1.978 -7.243 2.524 1.00 0.14 H new ATOM 0 HD13 LEU A 349 0.223 -7.251 2.225 1.00 0.14 H new ATOM 0 HD21 LEU A 349 -0.532 -7.527 5.141 1.00 0.12 H new ATOM 0 HD22 LEU A 349 -1.268 -8.477 3.828 1.00 0.12 H new ATOM 0 HD23 LEU A 349 -0.530 -9.305 5.220 1.00 0.12 H new ATOM 188 N GLU A 350 0.082 -12.018 1.303 1.00 0.20 N ATOM 189 CA GLU A 350 0.288 -13.358 0.801 1.00 0.24 C ATOM 190 C GLU A 350 0.091 -13.449 -0.698 1.00 0.22 C ATOM 191 O GLU A 350 0.924 -13.973 -1.431 1.00 0.31 O ATOM 192 CB GLU A 350 -0.702 -14.249 1.471 1.00 0.31 C ATOM 193 CG GLU A 350 -0.402 -14.448 2.927 1.00 0.41 C ATOM 194 CD GLU A 350 0.736 -15.408 3.180 1.00 0.84 C ATOM 195 OE1 GLU A 350 1.899 -14.960 3.231 1.00 0.96 O1- ATOM 196 OE2 GLU A 350 0.477 -16.624 3.304 1.00 1.51 O ATOM 0 H GLU A 350 -0.617 -11.966 2.044 1.00 0.20 H new ATOM 0 HA GLU A 350 1.316 -13.653 1.013 1.00 0.24 H new ATOM 0 HB2 GLU A 350 -1.700 -13.824 1.364 1.00 0.31 H new ATOM 0 HB3 GLU A 350 -0.713 -15.217 0.970 1.00 0.31 H new ATOM 0 HG2 GLU A 350 -0.161 -13.484 3.376 1.00 0.41 H new ATOM 0 HG3 GLU A 350 -1.297 -14.817 3.427 1.00 0.41 H new ATOM 203 N ASN A 351 -1.067 -12.984 -1.117 1.00 0.18 N ATOM 204 CA ASN A 351 -1.508 -13.080 -2.489 1.00 0.19 C ATOM 205 C ASN A 351 -1.222 -11.775 -3.174 1.00 0.21 C ATOM 206 O ASN A 351 -1.692 -11.538 -4.287 1.00 0.35 O ATOM 207 CB ASN A 351 -3.010 -13.379 -2.537 1.00 0.27 C ATOM 208 CG ASN A 351 -3.360 -14.710 -1.911 1.00 0.48 C ATOM 209 OD1 ASN A 351 -3.397 -15.741 -2.583 1.00 0.91 O ATOM 210 ND2 ASN A 351 -3.617 -14.697 -0.612 1.00 0.39 N ATOM 0 H ASN A 351 -1.737 -12.522 -0.503 1.00 0.18 H new ATOM 0 HA ASN A 351 -0.979 -13.888 -2.994 1.00 0.19 H new ATOM 0 HB2 ASN A 351 -3.551 -12.586 -2.021 1.00 0.27 H new ATOM 0 HB3 ASN A 351 -3.345 -13.371 -3.574 1.00 0.27 H new ATOM 0 HD21 ASN A 351 -3.857 -15.564 -0.131 1.00 0.39 H new ATOM 0 HD22 ASN A 351 -3.575 -13.820 -0.093 1.00 0.39 H new ATOM 217 N GLN A 352 -0.456 -10.938 -2.463 1.00 0.12 N ATOM 218 CA GLN A 352 0.015 -9.650 -2.973 1.00 0.11 C ATOM 219 C GLN A 352 -1.039 -8.957 -3.815 1.00 0.11 C ATOM 220 O GLN A 352 -0.895 -8.806 -5.032 1.00 0.18 O ATOM 221 CB GLN A 352 1.284 -9.831 -3.784 1.00 0.18 C ATOM 222 CG GLN A 352 2.484 -10.294 -2.968 1.00 0.30 C ATOM 223 CD GLN A 352 3.147 -9.172 -2.207 1.00 1.41 C ATOM 224 OE1 GLN A 352 4.150 -8.629 -2.650 1.00 2.22 O ATOM 225 NE2 GLN A 352 2.591 -8.808 -1.065 1.00 1.92 N ATOM 0 H GLN A 352 -0.145 -11.139 -1.513 1.00 0.12 H new ATOM 0 HA GLN A 352 0.225 -9.018 -2.110 1.00 0.11 H new ATOM 0 HB2 GLN A 352 1.096 -10.556 -4.576 1.00 0.18 H new ATOM 0 HB3 GLN A 352 1.531 -8.886 -4.268 1.00 0.18 H new ATOM 0 HG2 GLN A 352 2.164 -11.063 -2.265 1.00 0.30 H new ATOM 0 HG3 GLN A 352 3.213 -10.755 -3.634 1.00 0.30 H new ATOM 0 HE21 GLN A 352 1.755 -9.286 -0.730 1.00 1.92 H new ATOM 0 HE22 GLN A 352 2.998 -8.049 -0.519 1.00 1.92 H new ATOM 234 N HIS A 353 -2.081 -8.516 -3.155 1.00 0.07 N ATOM 235 CA HIS A 353 -3.206 -7.895 -3.837 1.00 0.07 C ATOM 236 C HIS A 353 -3.831 -6.838 -2.939 1.00 0.06 C ATOM 237 O HIS A 353 -4.172 -7.099 -1.802 1.00 0.07 O ATOM 238 CB HIS A 353 -4.257 -8.947 -4.180 1.00 0.08 C ATOM 239 CG HIS A 353 -5.172 -8.526 -5.290 1.00 0.09 C ATOM 240 ND1 HIS A 353 -4.997 -8.876 -6.611 1.00 0.11 N ATOM 241 CD2 HIS A 353 -6.283 -7.776 -5.255 1.00 0.12 C ATOM 242 CE1 HIS A 353 -5.975 -8.348 -7.328 1.00 0.13 C ATOM 243 NE2 HIS A 353 -6.773 -7.682 -6.527 1.00 0.13 N ATOM 0 H HIS A 353 -2.180 -8.573 -2.141 1.00 0.07 H new ATOM 0 HA HIS A 353 -2.847 -7.431 -4.756 1.00 0.07 H new ATOM 0 HB2 HIS A 353 -3.756 -9.873 -4.462 1.00 0.08 H new ATOM 0 HB3 HIS A 353 -4.850 -9.163 -3.291 1.00 0.08 H new ATOM 0 HD1 HIS A 353 -4.237 -9.449 -6.977 1.00 0.11 H new ATOM 0 HD2 HIS A 353 -6.715 -7.325 -4.374 1.00 0.12 H new ATOM 0 HE1 HIS A 353 -6.097 -8.448 -8.396 1.00 0.13 H new ATOM 252 N MET A 354 -3.945 -5.647 -3.461 1.00 0.05 N ATOM 253 CA MET A 354 -4.517 -4.530 -2.760 1.00 0.05 C ATOM 254 C MET A 354 -5.825 -4.111 -3.408 1.00 0.04 C ATOM 255 O MET A 354 -5.906 -3.901 -4.614 1.00 0.05 O ATOM 256 CB MET A 354 -3.512 -3.399 -2.782 1.00 0.05 C ATOM 257 CG MET A 354 -3.995 -2.176 -2.063 1.00 0.06 C ATOM 258 SD MET A 354 -3.668 -0.671 -2.957 1.00 0.06 S ATOM 259 CE MET A 354 -4.720 -1.018 -4.328 1.00 0.06 C ATOM 0 H MET A 354 -3.636 -5.421 -4.406 1.00 0.05 H new ATOM 0 HA MET A 354 -4.740 -4.803 -1.729 1.00 0.05 H new ATOM 0 HB2 MET A 354 -2.581 -3.738 -2.327 1.00 0.05 H new ATOM 0 HB3 MET A 354 -3.286 -3.141 -3.816 1.00 0.05 H new ATOM 0 HG2 MET A 354 -5.067 -2.263 -1.889 1.00 0.06 H new ATOM 0 HG3 MET A 354 -3.516 -2.123 -1.085 1.00 0.06 H new ATOM 0 HE1 MET A 354 -4.636 -0.217 -5.063 1.00 0.06 H new ATOM 0 HE2 MET A 354 -4.423 -1.962 -4.784 1.00 0.06 H new ATOM 0 HE3 MET A 354 -5.752 -1.089 -3.986 1.00 0.06 H new ATOM 269 N TRP A 355 -6.843 -4.020 -2.572 1.00 0.05 N ATOM 270 CA TRP A 355 -8.194 -3.708 -2.988 1.00 0.05 C ATOM 271 C TRP A 355 -8.637 -2.370 -2.479 1.00 0.05 C ATOM 272 O TRP A 355 -7.973 -1.767 -1.668 1.00 0.05 O ATOM 273 CB TRP A 355 -9.188 -4.710 -2.443 1.00 0.06 C ATOM 274 CG TRP A 355 -9.061 -6.074 -2.987 1.00 0.07 C ATOM 275 CD1 TRP A 355 -9.657 -6.544 -4.102 1.00 0.08 C ATOM 276 CD2 TRP A 355 -8.314 -7.148 -2.430 1.00 0.08 C ATOM 277 NE1 TRP A 355 -9.327 -7.854 -4.292 1.00 0.09 N ATOM 278 CE2 TRP A 355 -8.497 -8.257 -3.267 1.00 0.08 C ATOM 279 CE3 TRP A 355 -7.504 -7.272 -1.304 1.00 0.08 C ATOM 280 CZ2 TRP A 355 -7.890 -9.487 -3.005 1.00 0.10 C ATOM 281 CZ3 TRP A 355 -6.906 -8.479 -1.048 1.00 0.09 C ATOM 282 CH2 TRP A 355 -7.099 -9.577 -1.894 1.00 0.10 C ATOM 0 H TRP A 355 -6.750 -4.164 -1.566 1.00 0.05 H new ATOM 0 HA TRP A 355 -8.173 -3.725 -4.078 1.00 0.05 H new ATOM 0 HB2 TRP A 355 -9.078 -4.756 -1.360 1.00 0.06 H new ATOM 0 HB3 TRP A 355 -10.195 -4.347 -2.646 1.00 0.06 H new ATOM 0 HD1 TRP A 355 -10.301 -5.968 -4.750 1.00 0.08 H new ATOM 0 HE1 TRP A 355 -9.642 -8.439 -5.065 1.00 0.09 H new ATOM 0 HE3 TRP A 355 -7.349 -6.432 -0.644 1.00 0.08 H new ATOM 0 HZ2 TRP A 355 -8.040 -10.336 -3.656 1.00 0.10 H new ATOM 0 HZ3 TRP A 355 -6.275 -8.584 -0.178 1.00 0.09 H new ATOM 0 HH2 TRP A 355 -6.613 -10.514 -1.664 1.00 0.10 H new ATOM 293 N TYR A 356 -9.794 -1.953 -2.927 1.00 0.06 N ATOM 294 CA TYR A 356 -10.521 -0.885 -2.284 1.00 0.06 C ATOM 295 C TYR A 356 -11.877 -1.434 -1.983 1.00 0.06 C ATOM 296 O TYR A 356 -12.610 -1.779 -2.878 1.00 0.07 O ATOM 297 CB TYR A 356 -10.606 0.353 -3.165 1.00 0.06 C ATOM 298 CG TYR A 356 -11.421 1.502 -2.533 1.00 0.08 C ATOM 299 CD1 TYR A 356 -12.702 1.298 -2.059 1.00 0.18 C ATOM 300 CD2 TYR A 356 -10.896 2.782 -2.386 1.00 0.07 C ATOM 301 CE1 TYR A 356 -13.424 2.316 -1.469 1.00 0.22 C ATOM 302 CE2 TYR A 356 -11.616 3.801 -1.792 1.00 0.09 C ATOM 303 CZ TYR A 356 -12.907 3.600 -1.446 1.00 0.13 C ATOM 304 OH TYR A 356 -13.599 4.569 -0.740 1.00 0.20 O ATOM 0 H TYR A 356 -10.259 -2.343 -3.747 1.00 0.06 H new ATOM 0 HA TYR A 356 -10.013 -0.560 -1.376 1.00 0.06 H new ATOM 0 HB2 TYR A 356 -9.598 0.708 -3.378 1.00 0.06 H new ATOM 0 HB3 TYR A 356 -11.057 0.080 -4.119 1.00 0.06 H new ATOM 0 HD1 TYR A 356 -13.149 0.319 -2.152 1.00 0.18 H new ATOM 0 HD2 TYR A 356 -9.898 2.985 -2.746 1.00 0.07 H new ATOM 0 HE1 TYR A 356 -14.388 2.112 -1.027 1.00 0.22 H new ATOM 0 HE2 TYR A 356 -11.148 4.756 -1.605 1.00 0.09 H new ATOM 0 HH TYR A 356 -13.124 5.424 -0.806 1.00 0.20 H new ATOM 314 N TYR A 357 -12.193 -1.580 -0.729 1.00 0.09 N ATOM 315 CA TYR A 357 -13.471 -2.130 -0.387 1.00 0.11 C ATOM 316 C TYR A 357 -14.485 -1.066 -0.117 1.00 0.12 C ATOM 317 O TYR A 357 -14.293 -0.186 0.703 1.00 0.14 O ATOM 318 CB TYR A 357 -13.424 -3.090 0.788 1.00 0.12 C ATOM 319 CG TYR A 357 -13.011 -4.476 0.403 1.00 0.12 C ATOM 320 CD1 TYR A 357 -11.701 -4.766 0.037 1.00 0.12 C ATOM 321 CD2 TYR A 357 -13.930 -5.497 0.420 1.00 0.14 C ATOM 322 CE1 TYR A 357 -11.333 -6.051 -0.307 1.00 0.14 C ATOM 323 CE2 TYR A 357 -13.575 -6.776 0.087 1.00 0.16 C ATOM 324 CZ TYR A 357 -12.215 -7.020 -0.339 1.00 0.14 C ATOM 325 OH TYR A 357 -11.925 -8.340 -0.617 1.00 0.18 O ATOM 0 H TYR A 357 -11.596 -1.331 0.060 1.00 0.09 H new ATOM 0 HA TYR A 357 -13.771 -2.699 -1.267 1.00 0.11 H new ATOM 0 HB2 TYR A 357 -12.729 -2.706 1.535 1.00 0.12 H new ATOM 0 HB3 TYR A 357 -14.407 -3.128 1.257 1.00 0.12 H new ATOM 0 HD1 TYR A 357 -10.964 -3.977 0.022 1.00 0.12 H new ATOM 0 HD2 TYR A 357 -14.951 -5.286 0.701 1.00 0.14 H new ATOM 0 HE1 TYR A 357 -10.303 -6.261 -0.554 1.00 0.14 H new ATOM 0 HE2 TYR A 357 -14.292 -7.582 0.141 1.00 0.16 H new ATOM 0 HH TYR A 357 -12.748 -8.871 -0.580 1.00 0.18 H new ATOM 335 N LYS A 358 -15.560 -1.193 -0.824 1.00 0.12 N ATOM 336 CA LYS A 358 -16.698 -0.398 -0.685 1.00 0.14 C ATOM 337 C LYS A 358 -17.892 -1.227 -1.018 1.00 0.17 C ATOM 338 O LYS A 358 -17.867 -2.050 -1.931 1.00 0.19 O ATOM 339 CB LYS A 358 -16.601 0.786 -1.565 1.00 0.18 C ATOM 340 CG LYS A 358 -17.880 1.425 -1.765 1.00 0.24 C ATOM 341 CD LYS A 358 -17.674 2.868 -1.614 1.00 0.28 C ATOM 342 CE LYS A 358 -17.119 3.425 -2.878 1.00 0.42 C ATOM 343 NZ LYS A 358 -17.380 4.876 -3.049 1.00 0.47 N1+ ATOM 0 H LYS A 358 -15.655 -1.901 -1.552 1.00 0.12 H new ATOM 0 HA LYS A 358 -16.788 -0.036 0.339 1.00 0.14 H new ATOM 0 HB2 LYS A 358 -15.903 1.502 -1.131 1.00 0.18 H new ATOM 0 HB3 LYS A 358 -16.192 0.486 -2.530 1.00 0.18 H new ATOM 0 HG2 LYS A 358 -18.274 1.195 -2.755 1.00 0.24 H new ATOM 0 HG3 LYS A 358 -18.608 1.063 -1.039 1.00 0.24 H new ATOM 0 HD2 LYS A 358 -18.617 3.357 -1.372 1.00 0.28 H new ATOM 0 HD3 LYS A 358 -16.992 3.064 -0.787 1.00 0.28 H new ATOM 0 HE2 LYS A 358 -16.043 3.252 -2.901 1.00 0.42 H new ATOM 0 HE3 LYS A 358 -17.547 2.885 -3.723 1.00 0.42 H new ATOM 0 HZ1 LYS A 358 -16.968 5.199 -3.947 1.00 0.47 H new ATOM 0 HZ2 LYS A 358 -18.406 5.045 -3.058 1.00 0.47 H new ATOM 0 HZ3 LYS A 358 -16.949 5.401 -2.262 1.00 0.47 H new ATOM 357 N ASP A 359 -18.913 -1.026 -0.218 1.00 0.23 N ATOM 358 CA ASP A 359 -20.178 -1.694 -0.380 1.00 0.30 C ATOM 359 C ASP A 359 -20.022 -3.130 0.001 1.00 0.27 C ATOM 360 O ASP A 359 -20.877 -3.976 -0.252 1.00 0.33 O ATOM 361 CB ASP A 359 -20.664 -1.552 -1.806 1.00 0.34 C ATOM 362 CG ASP A 359 -22.132 -1.197 -1.895 1.00 0.44 C ATOM 363 OD1 ASP A 359 -22.517 -0.119 -1.394 1.00 0.49 O1- ATOM 364 OD2 ASP A 359 -22.911 -2.000 -2.458 1.00 0.60 O ATOM 0 H ASP A 359 -18.885 -0.384 0.574 1.00 0.23 H new ATOM 0 HA ASP A 359 -20.926 -1.238 0.269 1.00 0.30 H new ATOM 0 HB2 ASP A 359 -20.078 -0.783 -2.309 1.00 0.34 H new ATOM 0 HB3 ASP A 359 -20.488 -2.486 -2.339 1.00 0.34 H new ATOM 369 N GLY A 360 -18.903 -3.359 0.672 1.00 0.22 N ATOM 370 CA GLY A 360 -18.550 -4.661 1.128 1.00 0.21 C ATOM 371 C GLY A 360 -17.966 -5.493 0.027 1.00 0.19 C ATOM 372 O GLY A 360 -17.837 -6.711 0.116 1.00 0.23 O ATOM 0 H GLY A 360 -18.225 -2.635 0.907 1.00 0.22 H new ATOM 0 HA2 GLY A 360 -17.831 -4.579 1.943 1.00 0.21 H new ATOM 0 HA3 GLY A 360 -19.433 -5.158 1.531 1.00 0.21 H new ATOM 376 N LYS A 361 -17.593 -4.783 -0.984 1.00 0.16 N ATOM 377 CA LYS A 361 -17.181 -5.294 -2.249 1.00 0.17 C ATOM 378 C LYS A 361 -15.990 -4.457 -2.646 1.00 0.13 C ATOM 379 O LYS A 361 -15.611 -3.570 -1.895 1.00 0.15 O ATOM 380 CB LYS A 361 -18.383 -5.117 -3.161 1.00 0.22 C ATOM 381 CG LYS A 361 -18.129 -4.958 -4.623 1.00 0.32 C ATOM 382 CD LYS A 361 -17.613 -6.210 -5.302 1.00 0.55 C ATOM 383 CE LYS A 361 -18.071 -7.447 -4.600 1.00 0.52 C ATOM 384 NZ LYS A 361 -17.773 -8.688 -5.368 1.00 0.68 N1+ ATOM 0 H LYS A 361 -17.566 -3.764 -0.947 1.00 0.16 H new ATOM 0 HA LYS A 361 -16.885 -6.343 -2.274 1.00 0.17 H new ATOM 0 HB2 LYS A 361 -19.036 -5.979 -3.026 1.00 0.22 H new ATOM 0 HB3 LYS A 361 -18.936 -4.242 -2.820 1.00 0.22 H new ATOM 0 HG2 LYS A 361 -19.054 -4.649 -5.110 1.00 0.32 H new ATOM 0 HG3 LYS A 361 -17.407 -4.154 -4.770 1.00 0.32 H new ATOM 0 HD2 LYS A 361 -17.955 -6.231 -6.337 1.00 0.55 H new ATOM 0 HD3 LYS A 361 -16.524 -6.188 -5.327 1.00 0.55 H new ATOM 0 HE2 LYS A 361 -17.590 -7.505 -3.624 1.00 0.52 H new ATOM 0 HE3 LYS A 361 -19.145 -7.383 -4.423 1.00 0.52 H new ATOM 0 HZ1 LYS A 361 -18.111 -9.515 -4.836 1.00 0.68 H new ATOM 0 HZ2 LYS A 361 -18.253 -8.649 -6.290 1.00 0.68 H new ATOM 0 HZ3 LYS A 361 -16.746 -8.767 -5.515 1.00 0.68 H new ATOM 398 N VAL A 362 -15.366 -4.710 -3.761 1.00 0.10 N ATOM 399 CA VAL A 362 -14.241 -3.887 -4.089 1.00 0.09 C ATOM 400 C VAL A 362 -14.533 -2.940 -5.186 1.00 0.09 C ATOM 401 O VAL A 362 -15.155 -3.237 -6.208 1.00 0.11 O ATOM 402 CB VAL A 362 -12.918 -4.597 -4.354 1.00 0.18 C ATOM 403 CG1 VAL A 362 -12.681 -5.658 -3.324 1.00 0.53 C ATOM 404 CG2 VAL A 362 -12.816 -5.132 -5.753 1.00 0.52 C ATOM 0 H VAL A 362 -15.602 -5.443 -4.429 1.00 0.10 H new ATOM 0 HA VAL A 362 -14.084 -3.344 -3.157 1.00 0.09 H new ATOM 0 HB VAL A 362 -12.124 -3.855 -4.267 1.00 0.18 H new ATOM 0 HG11 VAL A 362 -11.733 -6.156 -3.526 1.00 0.53 H new ATOM 0 HG12 VAL A 362 -12.648 -5.203 -2.334 1.00 0.53 H new ATOM 0 HG13 VAL A 362 -13.490 -6.388 -3.361 1.00 0.53 H new ATOM 0 HG21 VAL A 362 -11.854 -5.627 -5.884 1.00 0.52 H new ATOM 0 HG22 VAL A 362 -13.619 -5.848 -5.928 1.00 0.52 H new ATOM 0 HG23 VAL A 362 -12.901 -4.310 -6.464 1.00 0.52 H new ATOM 414 N ALA A 363 -14.069 -1.790 -4.888 1.00 0.09 N ATOM 415 CA ALA A 363 -14.065 -0.675 -5.740 1.00 0.10 C ATOM 416 C ALA A 363 -12.836 -0.742 -6.581 1.00 0.10 C ATOM 417 O ALA A 363 -12.777 -0.213 -7.692 1.00 0.12 O ATOM 418 CB ALA A 363 -14.000 0.527 -4.858 1.00 0.11 C ATOM 0 H ALA A 363 -13.653 -1.592 -3.978 1.00 0.09 H new ATOM 0 HA ALA A 363 -14.944 -0.640 -6.384 1.00 0.10 H new ATOM 0 HB1 ALA A 363 -13.994 1.428 -5.471 1.00 0.11 H new ATOM 0 HB2 ALA A 363 -14.868 0.542 -4.199 1.00 0.11 H new ATOM 0 HB3 ALA A 363 -13.090 0.490 -4.259 1.00 0.11 H new ATOM 424 N LEU A 364 -11.843 -1.410 -6.026 1.00 0.08 N ATOM 425 CA LEU A 364 -10.566 -1.456 -6.644 1.00 0.07 C ATOM 426 C LEU A 364 -9.855 -2.736 -6.257 1.00 0.06 C ATOM 427 O LEU A 364 -10.140 -3.323 -5.218 1.00 0.08 O ATOM 428 CB LEU A 364 -9.745 -0.236 -6.270 1.00 0.06 C ATOM 429 CG LEU A 364 -8.784 0.147 -7.366 1.00 0.07 C ATOM 430 CD1 LEU A 364 -9.453 0.976 -8.425 1.00 0.07 C ATOM 431 CD2 LEU A 364 -7.576 0.870 -6.871 1.00 0.06 C ATOM 0 H LEU A 364 -11.913 -1.923 -5.147 1.00 0.08 H new ATOM 0 HA LEU A 364 -10.694 -1.446 -7.726 1.00 0.07 H new ATOM 0 HB2 LEU A 364 -10.411 0.601 -6.061 1.00 0.06 H new ATOM 0 HB3 LEU A 364 -9.190 -0.438 -5.354 1.00 0.06 H new ATOM 0 HG LEU A 364 -8.453 -0.799 -7.794 1.00 0.07 H new ATOM 0 HD11 LEU A 364 -8.728 1.233 -9.198 1.00 0.07 H new ATOM 0 HD12 LEU A 364 -10.271 0.408 -8.869 1.00 0.07 H new ATOM 0 HD13 LEU A 364 -9.846 1.889 -7.978 1.00 0.07 H new ATOM 0 HD21 LEU A 364 -6.928 1.115 -7.713 1.00 0.06 H new ATOM 0 HD22 LEU A 364 -7.882 1.788 -6.369 1.00 0.06 H new ATOM 0 HD23 LEU A 364 -7.035 0.236 -6.169 1.00 0.06 H new ATOM 443 N GLU A 365 -8.948 -3.162 -7.106 1.00 0.07 N ATOM 444 CA GLU A 365 -8.232 -4.421 -6.932 1.00 0.07 C ATOM 445 C GLU A 365 -6.998 -4.445 -7.780 1.00 0.07 C ATOM 446 O GLU A 365 -7.070 -4.295 -9.000 1.00 0.09 O ATOM 447 CB GLU A 365 -9.076 -5.616 -7.331 1.00 0.09 C ATOM 448 CG GLU A 365 -10.081 -5.275 -8.380 1.00 0.22 C ATOM 449 CD GLU A 365 -10.941 -6.452 -8.793 1.00 0.26 C ATOM 450 OE1 GLU A 365 -10.386 -7.431 -9.339 1.00 0.60 O1- ATOM 451 OE2 GLU A 365 -12.167 -6.409 -8.564 1.00 0.61 O ATOM 0 H GLU A 365 -8.679 -2.647 -7.944 1.00 0.07 H new ATOM 0 HA GLU A 365 -7.983 -4.487 -5.873 1.00 0.07 H new ATOM 0 HB2 GLU A 365 -8.426 -6.410 -7.698 1.00 0.09 H new ATOM 0 HB3 GLU A 365 -9.590 -6.005 -6.452 1.00 0.09 H new ATOM 0 HG2 GLU A 365 -10.724 -4.476 -8.011 1.00 0.22 H new ATOM 0 HG3 GLU A 365 -9.563 -4.887 -9.257 1.00 0.22 H new ATOM 458 N THR A 366 -5.865 -4.623 -7.155 1.00 0.06 N ATOM 459 CA THR A 366 -4.664 -4.799 -7.896 1.00 0.06 C ATOM 460 C THR A 366 -3.667 -5.673 -7.185 1.00 0.06 C ATOM 461 O THR A 366 -3.795 -5.990 -6.015 1.00 0.07 O ATOM 462 CB THR A 366 -4.070 -3.442 -8.237 1.00 0.07 C ATOM 463 OG1 THR A 366 -2.836 -3.581 -8.926 1.00 0.09 O ATOM 464 CG2 THR A 366 -3.882 -2.647 -6.979 1.00 0.07 C ATOM 0 H THR A 366 -5.757 -4.649 -6.141 1.00 0.06 H new ATOM 0 HA THR A 366 -4.915 -5.322 -8.819 1.00 0.06 H new ATOM 0 HB THR A 366 -4.759 -2.916 -8.897 1.00 0.07 H new ATOM 0 HG1 THR A 366 -3.009 -3.779 -9.870 1.00 0.09 H new ATOM 0 HG21 THR A 366 -3.456 -1.674 -7.224 1.00 0.07 H new ATOM 0 HG22 THR A 366 -4.846 -2.508 -6.489 1.00 0.07 H new ATOM 0 HG23 THR A 366 -3.208 -3.180 -6.309 1.00 0.07 H new ATOM 472 N ASP A 367 -2.697 -6.050 -7.946 1.00 0.07 N ATOM 473 CA ASP A 367 -1.580 -6.813 -7.522 1.00 0.10 C ATOM 474 C ASP A 367 -0.552 -5.858 -6.992 1.00 0.10 C ATOM 475 O ASP A 367 -0.418 -4.743 -7.495 1.00 0.11 O ATOM 476 CB ASP A 367 -1.058 -7.584 -8.724 1.00 0.15 C ATOM 477 CG ASP A 367 -0.993 -6.771 -10.020 1.00 1.14 C ATOM 478 OD1 ASP A 367 -2.000 -6.121 -10.378 1.00 1.88 O ATOM 479 OD2 ASP A 367 0.034 -6.832 -10.721 1.00 1.54 O1- ATOM 0 H ASP A 367 -2.664 -5.819 -8.939 1.00 0.07 H new ATOM 0 HA ASP A 367 -1.837 -7.525 -6.737 1.00 0.10 H new ATOM 0 HB2 ASP A 367 -0.060 -7.958 -8.494 1.00 0.15 H new ATOM 0 HB3 ASP A 367 -1.695 -8.453 -8.887 1.00 0.15 H new ATOM 484 N ILE A 368 0.105 -6.265 -5.933 1.00 0.09 N ATOM 485 CA ILE A 368 1.055 -5.409 -5.253 1.00 0.09 C ATOM 486 C ILE A 368 2.268 -6.169 -4.766 1.00 0.09 C ATOM 487 O ILE A 368 2.411 -7.362 -5.012 1.00 0.11 O ATOM 488 CB ILE A 368 0.411 -4.712 -4.059 1.00 0.08 C ATOM 489 CG1 ILE A 368 -0.285 -5.740 -3.189 1.00 0.08 C ATOM 490 CG2 ILE A 368 -0.537 -3.625 -4.527 1.00 0.08 C ATOM 491 CD1 ILE A 368 0.471 -6.053 -1.921 1.00 0.11 C ATOM 0 H ILE A 368 -0.000 -7.191 -5.518 1.00 0.09 H new ATOM 0 HA ILE A 368 1.375 -4.671 -5.989 1.00 0.09 H new ATOM 0 HB ILE A 368 1.180 -4.226 -3.458 1.00 0.08 H new ATOM 0 HG12 ILE A 368 -1.279 -5.375 -2.931 1.00 0.08 H new ATOM 0 HG13 ILE A 368 -0.420 -6.658 -3.760 1.00 0.08 H new ATOM 0 HG21 ILE A 368 -0.988 -3.138 -3.662 1.00 0.08 H new ATOM 0 HG22 ILE A 368 0.014 -2.889 -5.112 1.00 0.08 H new ATOM 0 HG23 ILE A 368 -1.320 -4.066 -5.144 1.00 0.08 H new ATOM 0 HD11 ILE A 368 -0.080 -6.795 -1.343 1.00 0.11 H new ATOM 0 HD12 ILE A 368 1.456 -6.447 -2.172 1.00 0.11 H new ATOM 0 HD13 ILE A 368 0.584 -5.144 -1.331 1.00 0.11 H new ATOM 503 N VAL A 369 3.134 -5.454 -4.071 1.00 0.09 N ATOM 504 CA VAL A 369 4.295 -6.055 -3.427 1.00 0.09 C ATOM 505 C VAL A 369 4.698 -5.244 -2.195 1.00 0.09 C ATOM 506 O VAL A 369 5.053 -4.071 -2.282 1.00 0.11 O ATOM 507 CB VAL A 369 5.476 -6.288 -4.411 1.00 0.10 C ATOM 508 CG1 VAL A 369 5.370 -5.417 -5.632 1.00 0.10 C ATOM 509 CG2 VAL A 369 6.822 -6.087 -3.752 1.00 0.12 C ATOM 0 H VAL A 369 3.056 -4.446 -3.936 1.00 0.09 H new ATOM 0 HA VAL A 369 4.010 -7.051 -3.089 1.00 0.09 H new ATOM 0 HB VAL A 369 5.403 -7.330 -4.721 1.00 0.10 H new ATOM 0 HG11 VAL A 369 6.215 -5.612 -6.292 1.00 0.10 H new ATOM 0 HG12 VAL A 369 4.441 -5.638 -6.157 1.00 0.10 H new ATOM 0 HG13 VAL A 369 5.378 -4.369 -5.333 1.00 0.10 H new ATOM 0 HG21 VAL A 369 7.614 -6.261 -4.481 1.00 0.12 H new ATOM 0 HG22 VAL A 369 6.894 -5.067 -3.375 1.00 0.12 H new ATOM 0 HG23 VAL A 369 6.930 -6.788 -2.924 1.00 0.12 H new ATOM 519 N SER A 370 4.597 -5.883 -1.039 1.00 0.09 N ATOM 520 CA SER A 370 4.599 -5.177 0.233 1.00 0.10 C ATOM 521 C SER A 370 5.388 -5.894 1.325 1.00 0.10 C ATOM 522 O SER A 370 5.303 -7.112 1.443 1.00 0.10 O ATOM 523 CB SER A 370 3.157 -5.080 0.671 1.00 0.12 C ATOM 524 OG SER A 370 2.590 -6.370 0.713 1.00 0.70 O ATOM 0 H SER A 370 4.512 -6.896 -0.956 1.00 0.09 H new ATOM 0 HA SER A 370 5.077 -4.208 0.090 1.00 0.10 H new ATOM 0 HB2 SER A 370 3.095 -4.612 1.653 1.00 0.12 H new ATOM 0 HB3 SER A 370 2.598 -4.448 -0.019 1.00 0.12 H new ATOM 0 HG SER A 370 1.631 -6.312 0.521 1.00 0.70 H new ATOM 530 N GLY A 371 6.108 -5.141 2.144 1.00 0.09 N ATOM 531 CA GLY A 371 6.572 -5.684 3.400 1.00 0.10 C ATOM 532 C GLY A 371 7.666 -6.742 3.333 1.00 0.11 C ATOM 533 O GLY A 371 7.504 -7.777 3.970 1.00 0.13 O ATOM 0 H GLY A 371 6.376 -4.174 1.962 1.00 0.09 H new ATOM 0 HA2 GLY A 371 6.936 -4.859 4.012 1.00 0.10 H new ATOM 0 HA3 GLY A 371 5.716 -6.114 3.920 1.00 0.10 H new ATOM 537 N LYS A 372 8.737 -6.532 2.550 1.00 0.11 N ATOM 538 CA LYS A 372 9.768 -7.538 2.353 1.00 0.14 C ATOM 539 C LYS A 372 10.180 -8.158 3.669 1.00 0.16 C ATOM 540 O LYS A 372 10.187 -7.502 4.693 1.00 0.19 O ATOM 541 CB LYS A 372 10.987 -6.908 1.716 1.00 0.17 C ATOM 542 CG LYS A 372 11.544 -5.735 2.439 1.00 0.22 C ATOM 543 CD LYS A 372 13.016 -5.780 2.258 1.00 0.30 C ATOM 544 CE LYS A 372 13.617 -4.418 2.274 1.00 0.47 C ATOM 545 NZ LYS A 372 15.079 -4.450 2.000 1.00 0.48 N1+ ATOM 0 H LYS A 372 8.903 -5.663 2.043 1.00 0.11 H new ATOM 0 HA LYS A 372 9.359 -8.312 1.704 1.00 0.14 H new ATOM 0 HB2 LYS A 372 11.766 -7.666 1.632 1.00 0.17 H new ATOM 0 HB3 LYS A 372 10.730 -6.601 0.702 1.00 0.17 H new ATOM 0 HG2 LYS A 372 11.134 -4.806 2.043 1.00 0.22 H new ATOM 0 HG3 LYS A 372 11.283 -5.773 3.497 1.00 0.22 H new ATOM 0 HD2 LYS A 372 13.461 -6.383 3.049 1.00 0.30 H new ATOM 0 HD3 LYS A 372 13.251 -6.270 1.313 1.00 0.30 H new ATOM 0 HE2 LYS A 372 13.122 -3.795 1.529 1.00 0.47 H new ATOM 0 HE3 LYS A 372 13.440 -3.955 3.245 1.00 0.47 H new ATOM 0 HZ1 LYS A 372 15.457 -3.481 2.020 1.00 0.48 H new ATOM 0 HZ2 LYS A 372 15.556 -5.023 2.725 1.00 0.48 H new ATOM 0 HZ3 LYS A 372 15.247 -4.868 1.063 1.00 0.48 H new ATOM 559 N PRO A 373 10.509 -9.440 3.625 1.00 0.18 N ATOM 560 CA PRO A 373 10.854 -10.264 4.785 1.00 0.20 C ATOM 561 C PRO A 373 11.681 -9.555 5.872 1.00 0.20 C ATOM 562 O PRO A 373 11.553 -9.870 7.056 1.00 0.22 O ATOM 563 CB PRO A 373 11.649 -11.359 4.119 1.00 0.23 C ATOM 564 CG PRO A 373 10.874 -11.601 2.890 1.00 0.22 C ATOM 565 CD PRO A 373 10.565 -10.228 2.391 1.00 0.19 C ATOM 0 HA PRO A 373 9.974 -10.580 5.345 1.00 0.20 H new ATOM 0 HB2 PRO A 373 12.670 -11.046 3.902 1.00 0.23 H new ATOM 0 HB3 PRO A 373 11.714 -12.251 4.742 1.00 0.23 H new ATOM 0 HG2 PRO A 373 11.448 -12.173 2.161 1.00 0.22 H new ATOM 0 HG3 PRO A 373 9.965 -12.167 3.095 1.00 0.22 H new ATOM 0 HD2 PRO A 373 11.335 -9.862 1.712 1.00 0.19 H new ATOM 0 HD3 PRO A 373 9.620 -10.198 1.848 1.00 0.19 H new ATOM 573 N THR A 374 12.513 -8.604 5.466 1.00 0.20 N ATOM 574 CA THR A 374 13.362 -7.862 6.383 1.00 0.23 C ATOM 575 C THR A 374 12.589 -6.724 7.050 1.00 0.20 C ATOM 576 O THR A 374 12.840 -6.372 8.203 1.00 0.23 O ATOM 577 CB THR A 374 14.572 -7.282 5.624 1.00 0.28 C ATOM 578 OG1 THR A 374 14.267 -5.987 5.088 1.00 0.28 O ATOM 579 CG2 THR A 374 14.951 -8.196 4.479 1.00 0.30 C ATOM 0 H THR A 374 12.617 -8.327 4.490 1.00 0.20 H new ATOM 0 HA THR A 374 13.705 -8.549 7.157 1.00 0.23 H new ATOM 0 HB THR A 374 15.398 -7.196 6.330 1.00 0.28 H new ATOM 0 HG1 THR A 374 15.049 -5.637 4.612 1.00 0.28 H new ATOM 0 HG21 THR A 374 15.807 -7.779 3.948 1.00 0.30 H new ATOM 0 HG22 THR A 374 15.211 -9.180 4.870 1.00 0.30 H new ATOM 0 HG23 THR A 374 14.109 -8.289 3.793 1.00 0.30 H new ATOM 587 N THR A 375 11.651 -6.148 6.311 1.00 0.18 N ATOM 588 CA THR A 375 10.824 -5.058 6.809 1.00 0.18 C ATOM 589 C THR A 375 9.386 -5.227 6.323 1.00 0.14 C ATOM 590 O THR A 375 8.906 -4.518 5.436 1.00 0.13 O ATOM 591 CB THR A 375 11.370 -3.686 6.393 1.00 0.23 C ATOM 592 OG1 THR A 375 12.792 -3.646 6.580 1.00 0.30 O ATOM 593 CG2 THR A 375 10.719 -2.585 7.210 1.00 0.27 C ATOM 0 H THR A 375 11.442 -6.423 5.351 1.00 0.18 H new ATOM 0 HA THR A 375 10.845 -5.099 7.898 1.00 0.18 H new ATOM 0 HB THR A 375 11.139 -3.528 5.340 1.00 0.23 H new ATOM 0 HG1 THR A 375 13.219 -4.289 5.977 1.00 0.30 H new ATOM 0 HG21 THR A 375 11.118 -1.619 6.902 1.00 0.27 H new ATOM 0 HG22 THR A 375 9.641 -2.601 7.048 1.00 0.27 H new ATOM 0 HG23 THR A 375 10.930 -2.744 8.268 1.00 0.27 H new ATOM 601 N PRO A 376 8.728 -6.217 6.901 1.00 0.13 N ATOM 602 CA PRO A 376 7.381 -6.670 6.541 1.00 0.11 C ATOM 603 C PRO A 376 6.259 -5.716 6.890 1.00 0.11 C ATOM 604 O PRO A 376 6.406 -4.785 7.683 1.00 0.15 O ATOM 605 CB PRO A 376 7.213 -7.935 7.365 1.00 0.14 C ATOM 606 CG PRO A 376 8.576 -8.314 7.742 1.00 0.16 C ATOM 607 CD PRO A 376 9.290 -7.037 7.950 1.00 0.15 C ATOM 0 HA PRO A 376 7.310 -6.783 5.459 1.00 0.11 H new ATOM 0 HB2 PRO A 376 6.594 -7.756 8.244 1.00 0.14 H new ATOM 0 HB3 PRO A 376 6.728 -8.722 6.788 1.00 0.14 H new ATOM 0 HG2 PRO A 376 8.580 -8.919 8.648 1.00 0.16 H new ATOM 0 HG3 PRO A 376 9.050 -8.907 6.960 1.00 0.16 H new ATOM 0 HD2 PRO A 376 9.105 -6.620 8.940 1.00 0.15 H new ATOM 0 HD3 PRO A 376 10.369 -7.150 7.849 1.00 0.15 H new ATOM 615 N THR A 377 5.130 -5.978 6.248 1.00 0.08 N ATOM 616 CA THR A 377 3.885 -5.318 6.525 1.00 0.08 C ATOM 617 C THR A 377 3.271 -5.825 7.830 1.00 0.08 C ATOM 618 O THR A 377 3.497 -6.961 8.246 1.00 0.11 O ATOM 619 CB THR A 377 2.903 -5.584 5.378 1.00 0.09 C ATOM 620 OG1 THR A 377 3.543 -6.397 4.383 1.00 0.12 O ATOM 621 CG2 THR A 377 2.410 -4.301 4.750 1.00 0.11 C ATOM 0 H THR A 377 5.064 -6.673 5.505 1.00 0.08 H new ATOM 0 HA THR A 377 4.079 -4.250 6.622 1.00 0.08 H new ATOM 0 HB THR A 377 2.037 -6.104 5.789 1.00 0.09 H new ATOM 0 HG1 THR A 377 3.518 -7.336 4.662 1.00 0.12 H new ATOM 0 HG21 THR A 377 1.717 -4.534 3.942 1.00 0.11 H new ATOM 0 HG22 THR A 377 1.900 -3.700 5.503 1.00 0.11 H new ATOM 0 HG23 THR A 377 3.257 -3.742 4.352 1.00 0.11 H new ATOM 629 N PRO A 378 2.455 -4.967 8.441 1.00 0.07 N ATOM 630 CA PRO A 378 1.866 -5.156 9.766 1.00 0.07 C ATOM 631 C PRO A 378 0.590 -5.999 9.774 1.00 0.07 C ATOM 632 O PRO A 378 0.489 -6.959 10.540 1.00 0.09 O ATOM 633 CB PRO A 378 1.522 -3.732 10.195 1.00 0.08 C ATOM 634 CG PRO A 378 1.790 -2.844 9.028 1.00 0.09 C ATOM 635 CD PRO A 378 2.038 -3.713 7.857 1.00 0.08 C ATOM 0 HA PRO A 378 2.556 -5.693 10.417 1.00 0.07 H new ATOM 0 HB2 PRO A 378 0.478 -3.663 10.499 1.00 0.08 H new ATOM 0 HB3 PRO A 378 2.124 -3.432 11.053 1.00 0.08 H new ATOM 0 HG2 PRO A 378 0.941 -2.186 8.844 1.00 0.09 H new ATOM 0 HG3 PRO A 378 2.652 -2.206 9.222 1.00 0.09 H new ATOM 0 HD2 PRO A 378 1.140 -3.833 7.251 1.00 0.08 H new ATOM 0 HD3 PRO A 378 2.809 -3.298 7.207 1.00 0.08 H new ATOM 643 N ALA A 379 -0.378 -5.617 8.934 1.00 0.06 N ATOM 644 CA ALA A 379 -1.689 -6.261 8.864 1.00 0.07 C ATOM 645 C ALA A 379 -2.575 -5.993 10.075 1.00 0.07 C ATOM 646 O ALA A 379 -2.217 -6.267 11.221 1.00 0.09 O ATOM 647 CB ALA A 379 -1.540 -7.727 8.567 1.00 0.08 C ATOM 0 H ALA A 379 -0.270 -4.844 8.278 1.00 0.06 H new ATOM 0 HA ALA A 379 -2.223 -5.799 8.034 1.00 0.07 H new ATOM 0 HB1 ALA A 379 -2.525 -8.190 8.519 1.00 0.08 H new ATOM 0 HB2 ALA A 379 -1.031 -7.855 7.611 1.00 0.08 H new ATOM 0 HB3 ALA A 379 -0.955 -8.200 9.355 1.00 0.08 H new ATOM 653 N GLY A 380 -3.748 -5.439 9.779 1.00 0.08 N ATOM 654 CA GLY A 380 -4.696 -5.058 10.796 1.00 0.10 C ATOM 655 C GLY A 380 -5.776 -4.177 10.235 1.00 0.10 C ATOM 656 O GLY A 380 -6.360 -4.480 9.197 1.00 0.11 O ATOM 0 H GLY A 380 -4.058 -5.246 8.827 1.00 0.08 H new ATOM 0 HA2 GLY A 380 -5.143 -5.951 11.232 1.00 0.10 H new ATOM 0 HA3 GLY A 380 -4.179 -4.535 11.600 1.00 0.10 H new ATOM 660 N VAL A 381 -5.998 -3.067 10.901 1.00 0.11 N ATOM 661 CA VAL A 381 -7.015 -2.112 10.513 1.00 0.12 C ATOM 662 C VAL A 381 -6.370 -0.738 10.416 1.00 0.12 C ATOM 663 O VAL A 381 -6.154 -0.060 11.419 1.00 0.21 O ATOM 664 CB VAL A 381 -8.163 -2.068 11.528 1.00 0.16 C ATOM 665 CG1 VAL A 381 -9.194 -1.008 11.147 1.00 0.89 C ATOM 666 CG2 VAL A 381 -8.820 -3.432 11.659 1.00 0.87 C ATOM 0 H VAL A 381 -5.475 -2.798 11.734 1.00 0.11 H new ATOM 0 HA VAL A 381 -7.433 -2.414 9.553 1.00 0.12 H new ATOM 0 HB VAL A 381 -7.742 -1.796 12.496 1.00 0.16 H new ATOM 0 HG11 VAL A 381 -9.997 -0.999 11.885 1.00 0.89 H new ATOM 0 HG12 VAL A 381 -8.716 -0.029 11.119 1.00 0.89 H new ATOM 0 HG13 VAL A 381 -9.606 -1.238 10.165 1.00 0.89 H new ATOM 0 HG21 VAL A 381 -9.632 -3.377 12.384 1.00 0.87 H new ATOM 0 HG22 VAL A 381 -9.218 -3.738 10.692 1.00 0.87 H new ATOM 0 HG23 VAL A 381 -8.082 -4.161 11.995 1.00 0.87 H new ATOM 676 N PHE A 382 -6.047 -0.354 9.208 1.00 0.10 N ATOM 677 CA PHE A 382 -5.230 0.805 8.946 1.00 0.10 C ATOM 678 C PHE A 382 -6.091 1.970 8.489 1.00 0.09 C ATOM 679 O PHE A 382 -7.256 1.780 8.159 1.00 0.11 O ATOM 680 CB PHE A 382 -4.274 0.415 7.839 1.00 0.16 C ATOM 681 CG PHE A 382 -3.369 -0.710 8.198 1.00 0.11 C ATOM 682 CD1 PHE A 382 -2.226 -0.496 8.940 1.00 0.14 C ATOM 683 CD2 PHE A 382 -3.671 -1.992 7.780 1.00 0.08 C ATOM 684 CE1 PHE A 382 -1.396 -1.547 9.255 1.00 0.15 C ATOM 685 CE2 PHE A 382 -2.853 -3.040 8.094 1.00 0.08 C ATOM 686 CZ PHE A 382 -1.715 -2.822 8.829 1.00 0.10 C ATOM 0 H PHE A 382 -6.348 -0.844 8.366 1.00 0.10 H new ATOM 0 HA PHE A 382 -4.699 1.116 9.846 1.00 0.10 H new ATOM 0 HB2 PHE A 382 -4.849 0.139 6.955 1.00 0.16 H new ATOM 0 HB3 PHE A 382 -3.671 1.282 7.569 1.00 0.16 H new ATOM 0 HD1 PHE A 382 -1.982 0.501 9.275 1.00 0.14 H new ATOM 0 HD2 PHE A 382 -4.564 -2.167 7.198 1.00 0.08 H new ATOM 0 HE1 PHE A 382 -0.499 -1.376 9.832 1.00 0.15 H new ATOM 0 HE2 PHE A 382 -3.101 -4.038 7.764 1.00 0.08 H new ATOM 0 HZ PHE A 382 -1.067 -3.650 9.075 1.00 0.10 H new ATOM 696 N TYR A 383 -5.523 3.168 8.471 1.00 0.08 N ATOM 697 CA TYR A 383 -6.224 4.349 7.965 1.00 0.09 C ATOM 698 C TYR A 383 -5.250 5.333 7.382 1.00 0.09 C ATOM 699 O TYR A 383 -4.202 5.578 7.975 1.00 0.11 O ATOM 700 CB TYR A 383 -7.007 5.089 9.047 1.00 0.12 C ATOM 701 CG TYR A 383 -8.010 4.252 9.810 1.00 0.25 C ATOM 702 CD1 TYR A 383 -9.253 3.952 9.277 1.00 0.39 C ATOM 703 CD2 TYR A 383 -7.707 3.768 11.076 1.00 0.53 C ATOM 704 CE1 TYR A 383 -10.167 3.195 9.982 1.00 0.51 C ATOM 705 CE2 TYR A 383 -8.614 3.008 11.785 1.00 0.64 C ATOM 706 CZ TYR A 383 -9.842 2.726 11.234 1.00 0.54 C ATOM 707 OH TYR A 383 -10.749 1.973 11.941 1.00 0.69 O ATOM 0 H TYR A 383 -4.576 3.352 8.801 1.00 0.08 H new ATOM 0 HA TYR A 383 -6.918 3.973 7.213 1.00 0.09 H new ATOM 0 HB2 TYR A 383 -6.298 5.514 9.758 1.00 0.12 H new ATOM 0 HB3 TYR A 383 -7.533 5.924 8.584 1.00 0.12 H new ATOM 0 HD1 TYR A 383 -9.511 4.316 8.294 1.00 0.39 H new ATOM 0 HD2 TYR A 383 -6.745 3.990 11.513 1.00 0.53 H new ATOM 0 HE1 TYR A 383 -11.133 2.972 9.553 1.00 0.51 H new ATOM 0 HE2 TYR A 383 -8.361 2.637 12.767 1.00 0.64 H new ATOM 0 HH TYR A 383 -10.362 1.721 12.805 1.00 0.69 H new ATOM 717 N VAL A 384 -5.601 5.940 6.264 1.00 0.09 N ATOM 718 CA VAL A 384 -4.740 6.947 5.697 1.00 0.10 C ATOM 719 C VAL A 384 -4.845 8.245 6.490 1.00 0.11 C ATOM 720 O VAL A 384 -5.921 8.833 6.623 1.00 0.13 O ATOM 721 CB VAL A 384 -5.017 7.181 4.195 1.00 0.11 C ATOM 722 CG1 VAL A 384 -6.478 6.987 3.874 1.00 0.12 C ATOM 723 CG2 VAL A 384 -4.565 8.562 3.767 1.00 0.14 C ATOM 0 H VAL A 384 -6.459 5.756 5.743 1.00 0.09 H new ATOM 0 HA VAL A 384 -3.716 6.579 5.768 1.00 0.10 H new ATOM 0 HB VAL A 384 -4.442 6.442 3.637 1.00 0.11 H new ATOM 0 HG11 VAL A 384 -6.643 7.158 2.810 1.00 0.12 H new ATOM 0 HG12 VAL A 384 -6.774 5.969 4.128 1.00 0.12 H new ATOM 0 HG13 VAL A 384 -7.074 7.693 4.452 1.00 0.12 H new ATOM 0 HG21 VAL A 384 -4.772 8.700 2.706 1.00 0.14 H new ATOM 0 HG22 VAL A 384 -5.103 9.315 4.342 1.00 0.14 H new ATOM 0 HG23 VAL A 384 -3.495 8.666 3.945 1.00 0.14 H new ATOM 733 N TRP A 385 -3.721 8.677 7.039 1.00 0.12 N ATOM 734 CA TRP A 385 -3.711 9.841 7.905 1.00 0.14 C ATOM 735 C TRP A 385 -3.086 11.045 7.250 1.00 0.16 C ATOM 736 O TRP A 385 -2.929 12.099 7.866 1.00 0.19 O ATOM 737 CB TRP A 385 -2.980 9.563 9.196 1.00 0.16 C ATOM 738 CG TRP A 385 -1.637 8.960 8.984 1.00 0.15 C ATOM 739 CD1 TRP A 385 -1.365 7.645 8.836 1.00 0.14 C ATOM 740 CD2 TRP A 385 -0.389 9.645 8.899 1.00 0.15 C ATOM 741 NE1 TRP A 385 -0.011 7.460 8.671 1.00 0.14 N ATOM 742 CE2 TRP A 385 0.609 8.676 8.715 1.00 0.15 C ATOM 743 CE3 TRP A 385 -0.022 10.983 8.967 1.00 0.17 C ATOM 744 CZ2 TRP A 385 1.957 9.008 8.601 1.00 0.15 C ATOM 745 CZ3 TRP A 385 1.305 11.316 8.853 1.00 0.18 C ATOM 746 CH2 TRP A 385 2.287 10.333 8.674 1.00 0.17 C ATOM 0 H TRP A 385 -2.809 8.241 6.900 1.00 0.12 H new ATOM 0 HA TRP A 385 -4.758 10.061 8.112 1.00 0.14 H new ATOM 0 HB2 TRP A 385 -2.871 10.493 9.753 1.00 0.16 H new ATOM 0 HB3 TRP A 385 -3.581 8.892 9.810 1.00 0.16 H new ATOM 0 HD1 TRP A 385 -2.102 6.855 8.846 1.00 0.14 H new ATOM 0 HE1 TRP A 385 0.453 6.562 8.538 1.00 0.14 H new ATOM 0 HE3 TRP A 385 -0.769 11.750 9.107 1.00 0.17 H new ATOM 0 HZ2 TRP A 385 2.712 8.249 8.460 1.00 0.15 H new ATOM 0 HZ3 TRP A 385 1.597 12.355 8.902 1.00 0.18 H new ATOM 0 HH2 TRP A 385 3.323 10.627 8.592 1.00 0.17 H new ATOM 757 N ASN A 386 -2.744 10.884 6.003 1.00 0.16 N ATOM 758 CA ASN A 386 -2.144 11.950 5.235 1.00 0.21 C ATOM 759 C ASN A 386 -2.264 11.590 3.777 1.00 0.20 C ATOM 760 O ASN A 386 -2.248 10.422 3.421 1.00 0.18 O ATOM 761 CB ASN A 386 -0.677 12.123 5.620 1.00 0.24 C ATOM 762 CG ASN A 386 -0.093 13.413 5.118 1.00 0.32 C ATOM 763 OD1 ASN A 386 -0.176 14.444 5.783 1.00 0.41 O ATOM 764 ND2 ASN A 386 0.503 13.372 3.952 1.00 0.31 N ATOM 0 H ASN A 386 -2.871 10.014 5.486 1.00 0.16 H new ATOM 0 HA ASN A 386 -2.653 12.893 5.436 1.00 0.21 H new ATOM 0 HB2 ASN A 386 -0.584 12.085 6.705 1.00 0.24 H new ATOM 0 HB3 ASN A 386 -0.100 11.289 5.221 1.00 0.24 H new ATOM 0 HD21 ASN A 386 0.921 14.217 3.563 1.00 0.31 H new ATOM 0 HD22 ASN A 386 0.549 12.495 3.433 1.00 0.31 H new ATOM 771 N LYS A 387 -2.434 12.576 2.942 1.00 0.22 N ATOM 772 CA LYS A 387 -2.591 12.327 1.541 1.00 0.22 C ATOM 773 C LYS A 387 -1.463 13.024 0.810 1.00 0.19 C ATOM 774 O LYS A 387 -1.337 14.249 0.813 1.00 0.24 O ATOM 775 CB LYS A 387 -3.988 12.748 1.073 1.00 0.32 C ATOM 776 CG LYS A 387 -4.103 14.155 0.582 1.00 1.09 C ATOM 777 CD LYS A 387 -5.416 14.734 1.014 1.00 0.96 C ATOM 778 CE LYS A 387 -6.561 13.905 0.531 1.00 0.57 C ATOM 779 NZ LYS A 387 -7.624 14.731 -0.102 1.00 0.67 N1+ ATOM 0 H LYS A 387 -2.467 13.560 3.209 1.00 0.22 H new ATOM 0 HA LYS A 387 -2.524 11.262 1.318 1.00 0.22 H new ATOM 0 HB2 LYS A 387 -4.303 12.076 0.275 1.00 0.32 H new ATOM 0 HB3 LYS A 387 -4.686 12.611 1.899 1.00 0.32 H new ATOM 0 HG2 LYS A 387 -3.283 14.756 0.975 1.00 1.09 H new ATOM 0 HG3 LYS A 387 -4.024 14.179 -0.505 1.00 1.09 H new ATOM 0 HD2 LYS A 387 -5.446 14.801 2.102 1.00 0.96 H new ATOM 0 HD3 LYS A 387 -5.512 15.749 0.630 1.00 0.96 H new ATOM 0 HE2 LYS A 387 -6.198 13.170 -0.187 1.00 0.57 H new ATOM 0 HE3 LYS A 387 -6.984 13.350 1.368 1.00 0.57 H new ATOM 0 HZ1 LYS A 387 -8.557 14.348 0.150 1.00 0.67 H new ATOM 0 HZ2 LYS A 387 -7.549 15.712 0.236 1.00 0.67 H new ATOM 0 HZ3 LYS A 387 -7.510 14.711 -1.136 1.00 0.67 H new ATOM 793 N GLU A 388 -0.607 12.221 0.254 1.00 0.18 N ATOM 794 CA GLU A 388 0.593 12.688 -0.350 1.00 0.18 C ATOM 795 C GLU A 388 0.623 12.360 -1.810 1.00 0.23 C ATOM 796 O GLU A 388 0.342 11.260 -2.236 1.00 0.38 O ATOM 797 CB GLU A 388 1.770 12.112 0.405 1.00 0.16 C ATOM 798 CG GLU A 388 2.457 13.171 1.218 1.00 0.16 C ATOM 799 CD GLU A 388 3.568 12.647 2.100 1.00 0.20 C ATOM 800 OE1 GLU A 388 3.265 12.107 3.181 1.00 0.32 O1- ATOM 801 OE2 GLU A 388 4.749 12.804 1.731 1.00 0.32 O ATOM 0 H GLU A 388 -0.729 11.209 0.209 1.00 0.18 H new ATOM 0 HA GLU A 388 0.646 13.775 -0.290 1.00 0.18 H new ATOM 0 HB2 GLU A 388 1.430 11.310 1.059 1.00 0.16 H new ATOM 0 HB3 GLU A 388 2.477 11.672 -0.298 1.00 0.16 H new ATOM 0 HG2 GLU A 388 2.867 13.923 0.544 1.00 0.16 H new ATOM 0 HG3 GLU A 388 1.717 13.672 1.842 1.00 0.16 H new ATOM 808 N GLU A 389 0.877 13.373 -2.567 1.00 0.17 N ATOM 809 CA GLU A 389 0.896 13.290 -3.986 1.00 0.19 C ATOM 810 C GLU A 389 2.178 13.859 -4.511 1.00 0.21 C ATOM 811 O GLU A 389 2.607 14.934 -4.079 1.00 0.26 O ATOM 812 CB GLU A 389 -0.273 14.078 -4.489 1.00 0.21 C ATOM 813 CG GLU A 389 -1.590 13.534 -4.017 1.00 0.30 C ATOM 814 CD GLU A 389 -2.777 14.356 -4.480 1.00 1.06 C ATOM 815 OE1 GLU A 389 -3.254 14.123 -5.613 1.00 1.96 O1- ATOM 816 OE2 GLU A 389 -3.237 15.236 -3.726 1.00 1.18 O ATOM 0 H GLU A 389 1.082 14.305 -2.206 1.00 0.17 H new ATOM 0 HA GLU A 389 0.830 12.255 -4.320 1.00 0.19 H new ATOM 0 HB2 GLU A 389 -0.175 15.113 -4.162 1.00 0.21 H new ATOM 0 HB3 GLU A 389 -0.258 14.085 -5.579 1.00 0.21 H new ATOM 0 HG2 GLU A 389 -1.703 12.511 -4.376 1.00 0.30 H new ATOM 0 HG3 GLU A 389 -1.589 13.491 -2.928 1.00 0.30 H new ATOM 823 N ASP A 390 2.772 13.147 -5.423 1.00 0.20 N ATOM 824 CA ASP A 390 4.107 13.477 -5.911 1.00 0.19 C ATOM 825 C ASP A 390 5.022 13.612 -4.700 1.00 0.21 C ATOM 826 O ASP A 390 5.848 14.518 -4.572 1.00 0.40 O ATOM 827 CB ASP A 390 4.074 14.763 -6.718 1.00 0.24 C ATOM 828 CG ASP A 390 5.395 15.069 -7.403 1.00 0.26 C ATOM 829 OD1 ASP A 390 5.760 14.344 -8.354 1.00 0.38 O1- ATOM 830 OD2 ASP A 390 6.081 16.031 -6.997 1.00 0.36 O ATOM 0 H ASP A 390 2.359 12.322 -5.857 1.00 0.20 H new ATOM 0 HA ASP A 390 4.478 12.693 -6.571 1.00 0.19 H new ATOM 0 HB2 ASP A 390 3.289 14.693 -7.471 1.00 0.24 H new ATOM 0 HB3 ASP A 390 3.812 15.592 -6.060 1.00 0.24 H new ATOM 835 N ALA A 391 4.771 12.710 -3.779 1.00 0.15 N ATOM 836 CA ALA A 391 5.415 12.671 -2.500 1.00 0.16 C ATOM 837 C ALA A 391 6.609 11.759 -2.511 1.00 0.15 C ATOM 838 O ALA A 391 6.833 10.991 -3.444 1.00 0.16 O ATOM 839 CB ALA A 391 4.409 12.213 -1.464 1.00 0.16 C ATOM 0 H ALA A 391 4.090 11.962 -3.911 1.00 0.15 H new ATOM 0 HA ALA A 391 5.776 13.670 -2.255 1.00 0.16 H new ATOM 0 HB1 ALA A 391 4.886 12.178 -0.484 1.00 0.16 H new ATOM 0 HB2 ALA A 391 3.572 12.911 -1.436 1.00 0.16 H new ATOM 0 HB3 ALA A 391 4.044 11.220 -1.725 1.00 0.16 H new ATOM 845 N THR A 392 7.350 11.843 -1.448 1.00 0.16 N ATOM 846 CA THR A 392 8.567 11.103 -1.310 1.00 0.17 C ATOM 847 C THR A 392 8.554 10.325 -0.022 1.00 0.16 C ATOM 848 O THR A 392 8.677 10.866 1.079 1.00 0.18 O ATOM 849 CB THR A 392 9.802 12.001 -1.367 1.00 0.20 C ATOM 850 OG1 THR A 392 9.980 12.505 -2.700 1.00 0.27 O ATOM 851 CG2 THR A 392 11.043 11.223 -0.923 1.00 0.22 C ATOM 0 H THR A 392 7.125 12.432 -0.646 1.00 0.16 H new ATOM 0 HA THR A 392 8.626 10.416 -2.154 1.00 0.17 H new ATOM 0 HB THR A 392 9.659 12.842 -0.689 1.00 0.20 H new ATOM 0 HG1 THR A 392 10.772 13.081 -2.729 1.00 0.27 H new ATOM 0 HG21 THR A 392 11.916 11.874 -0.968 1.00 0.22 H new ATOM 0 HG22 THR A 392 10.905 10.871 0.099 1.00 0.22 H new ATOM 0 HG23 THR A 392 11.193 10.369 -1.584 1.00 0.22 H new ATOM 859 N LEU A 393 8.354 9.056 -0.190 1.00 0.15 N ATOM 860 CA LEU A 393 8.373 8.113 0.874 1.00 0.16 C ATOM 861 C LEU A 393 9.764 7.923 1.348 1.00 0.17 C ATOM 862 O LEU A 393 10.711 8.161 0.618 1.00 0.18 O ATOM 863 CB LEU A 393 7.832 6.821 0.349 1.00 0.16 C ATOM 864 CG LEU A 393 6.328 6.785 0.193 1.00 0.19 C ATOM 865 CD1 LEU A 393 5.841 7.896 -0.716 1.00 0.16 C ATOM 866 CD2 LEU A 393 5.900 5.452 -0.350 1.00 0.24 C ATOM 0 H LEU A 393 8.167 8.638 -1.102 1.00 0.15 H new ATOM 0 HA LEU A 393 7.769 8.466 1.710 1.00 0.16 H new ATOM 0 HB2 LEU A 393 8.289 6.617 -0.619 1.00 0.16 H new ATOM 0 HB3 LEU A 393 8.134 6.017 1.020 1.00 0.16 H new ATOM 0 HG LEU A 393 5.883 6.935 1.177 1.00 0.19 H new ATOM 0 HD11 LEU A 393 4.756 7.842 -0.807 1.00 0.16 H new ATOM 0 HD12 LEU A 393 6.122 8.861 -0.294 1.00 0.16 H new ATOM 0 HD13 LEU A 393 6.294 7.785 -1.701 1.00 0.16 H new ATOM 0 HD21 LEU A 393 4.816 5.435 -0.459 1.00 0.24 H new ATOM 0 HD22 LEU A 393 6.365 5.289 -1.322 1.00 0.24 H new ATOM 0 HD23 LEU A 393 6.208 4.664 0.337 1.00 0.24 H new ATOM 878 N LYS A 394 9.865 7.527 2.576 1.00 0.20 N ATOM 879 CA LYS A 394 11.096 7.386 3.232 1.00 0.24 C ATOM 880 C LYS A 394 10.934 6.380 4.316 1.00 0.30 C ATOM 881 O LYS A 394 9.820 5.917 4.566 1.00 0.38 O ATOM 882 CB LYS A 394 11.463 8.703 3.814 1.00 0.29 C ATOM 883 CG LYS A 394 12.288 9.432 2.859 1.00 0.29 C ATOM 884 CD LYS A 394 11.786 10.801 2.621 1.00 0.61 C ATOM 885 CE LYS A 394 12.137 11.696 3.775 1.00 0.52 C ATOM 886 NZ LYS A 394 11.842 13.123 3.490 1.00 0.67 N1+ ATOM 0 H LYS A 394 9.060 7.289 3.156 1.00 0.20 H new ATOM 0 HA LYS A 394 11.876 7.059 2.544 1.00 0.24 H new ATOM 0 HB2 LYS A 394 10.565 9.274 4.048 1.00 0.29 H new ATOM 0 HB3 LYS A 394 12.005 8.563 4.749 1.00 0.29 H new ATOM 0 HG2 LYS A 394 13.312 9.481 3.229 1.00 0.29 H new ATOM 0 HG3 LYS A 394 12.316 8.888 1.915 1.00 0.29 H new ATOM 0 HD2 LYS A 394 12.216 11.198 1.701 1.00 0.61 H new ATOM 0 HD3 LYS A 394 10.705 10.780 2.485 1.00 0.61 H new ATOM 0 HE2 LYS A 394 11.581 11.382 4.658 1.00 0.52 H new ATOM 0 HE3 LYS A 394 13.196 11.586 4.009 1.00 0.52 H new ATOM 0 HZ1 LYS A 394 12.100 13.702 4.314 1.00 0.67 H new ATOM 0 HZ2 LYS A 394 12.392 13.433 2.663 1.00 0.67 H new ATOM 0 HZ3 LYS A 394 10.827 13.235 3.293 1.00 0.67 H new ATOM 1015 N GLU A 404 14.095 6.158 0.523 1.00 0.28 N ATOM 1016 CA GLU A 404 13.038 6.914 -0.128 1.00 0.24 C ATOM 1017 C GLU A 404 12.352 6.094 -1.185 1.00 0.24 C ATOM 1018 O GLU A 404 12.886 5.116 -1.710 1.00 0.31 O ATOM 1019 CB GLU A 404 13.540 8.169 -0.805 1.00 0.27 C ATOM 1020 CG GLU A 404 13.775 9.346 0.093 1.00 0.29 C ATOM 1021 CD GLU A 404 14.796 10.313 -0.465 1.00 0.36 C ATOM 1022 OE1 GLU A 404 15.993 9.961 -0.497 1.00 0.62 O1- ATOM 1023 OE2 GLU A 404 14.411 11.427 -0.882 1.00 0.45 O ATOM 0 HA GLU A 404 12.350 7.182 0.674 1.00 0.24 H new ATOM 0 HB2 GLU A 404 14.473 7.934 -1.317 1.00 0.27 H new ATOM 0 HB3 GLU A 404 12.821 8.458 -1.571 1.00 0.27 H new ATOM 0 HG2 GLU A 404 12.833 9.871 0.251 1.00 0.29 H new ATOM 0 HG3 GLU A 404 14.111 8.992 1.068 1.00 0.29 H new ATOM 1030 N SER A 405 11.144 6.510 -1.451 1.00 0.20 N ATOM 1031 CA SER A 405 10.308 5.919 -2.433 1.00 0.20 C ATOM 1032 C SER A 405 9.483 7.018 -3.116 1.00 0.18 C ATOM 1033 O SER A 405 8.466 7.466 -2.586 1.00 0.23 O ATOM 1034 CB SER A 405 9.440 4.913 -1.707 1.00 0.26 C ATOM 1035 OG SER A 405 10.074 3.648 -1.625 1.00 1.33 O ATOM 0 H SER A 405 10.710 7.297 -0.968 1.00 0.20 H new ATOM 0 HA SER A 405 10.871 5.413 -3.217 1.00 0.20 H new ATOM 0 HB2 SER A 405 9.220 5.277 -0.704 1.00 0.26 H new ATOM 0 HB3 SER A 405 8.487 4.811 -2.226 1.00 0.26 H new ATOM 0 HG SER A 405 9.761 3.077 -2.357 1.00 1.33 H new ATOM 1041 N PRO A 406 9.942 7.478 -4.290 1.00 0.18 N ATOM 1042 CA PRO A 406 9.317 8.556 -5.052 1.00 0.19 C ATOM 1043 C PRO A 406 7.962 8.172 -5.604 1.00 0.17 C ATOM 1044 O PRO A 406 7.845 7.441 -6.585 1.00 0.17 O ATOM 1045 CB PRO A 406 10.300 8.778 -6.191 1.00 0.20 C ATOM 1046 CG PRO A 406 10.908 7.455 -6.369 1.00 0.19 C ATOM 1047 CD PRO A 406 11.107 6.963 -4.980 1.00 0.18 C ATOM 0 HA PRO A 406 9.131 9.436 -4.436 1.00 0.19 H new ATOM 0 HB2 PRO A 406 9.797 9.116 -7.097 1.00 0.20 H new ATOM 0 HB3 PRO A 406 11.045 9.533 -5.939 1.00 0.20 H new ATOM 0 HG2 PRO A 406 10.259 6.790 -6.939 1.00 0.19 H new ATOM 0 HG3 PRO A 406 11.852 7.519 -6.909 1.00 0.19 H new ATOM 0 HD2 PRO A 406 11.154 5.875 -4.939 1.00 0.18 H new ATOM 0 HD3 PRO A 406 12.034 7.339 -4.546 1.00 0.18 H new ATOM 1055 N VAL A 407 6.959 8.716 -4.999 1.00 0.17 N ATOM 1056 CA VAL A 407 5.616 8.394 -5.294 1.00 0.17 C ATOM 1057 C VAL A 407 4.870 9.597 -5.835 1.00 0.19 C ATOM 1058 O VAL A 407 5.322 10.737 -5.769 1.00 0.30 O ATOM 1059 CB VAL A 407 5.020 7.867 -3.994 1.00 0.16 C ATOM 1060 CG1 VAL A 407 3.835 8.672 -3.542 1.00 0.15 C ATOM 1061 CG2 VAL A 407 4.712 6.402 -4.115 1.00 0.23 C ATOM 0 H VAL A 407 7.062 9.417 -4.265 1.00 0.17 H new ATOM 0 HA VAL A 407 5.541 7.641 -6.079 1.00 0.17 H new ATOM 0 HB VAL A 407 5.768 7.983 -3.209 1.00 0.16 H new ATOM 0 HG11 VAL A 407 3.446 8.257 -2.612 1.00 0.15 H new ATOM 0 HG12 VAL A 407 4.138 9.706 -3.379 1.00 0.15 H new ATOM 0 HG13 VAL A 407 3.059 8.638 -4.307 1.00 0.15 H new ATOM 0 HG21 VAL A 407 4.287 6.041 -3.178 1.00 0.23 H new ATOM 0 HG22 VAL A 407 3.996 6.246 -4.922 1.00 0.23 H new ATOM 0 HG23 VAL A 407 5.629 5.854 -4.332 1.00 0.23 H new ATOM 1071 N ASN A 408 3.761 9.283 -6.427 1.00 0.19 N ATOM 1072 CA ASN A 408 2.892 10.211 -7.083 1.00 0.21 C ATOM 1073 C ASN A 408 1.614 10.251 -6.308 1.00 0.19 C ATOM 1074 O ASN A 408 0.932 11.266 -6.220 1.00 0.26 O ATOM 1075 CB ASN A 408 2.676 9.640 -8.456 1.00 0.34 C ATOM 1076 CG ASN A 408 3.998 9.407 -9.108 1.00 1.01 C ATOM 1077 OD1 ASN A 408 4.531 10.244 -9.835 1.00 1.84 O ATOM 1078 ND2 ASN A 408 4.541 8.253 -8.809 1.00 1.01 N ATOM 0 H ASN A 408 3.419 8.323 -6.468 1.00 0.19 H new ATOM 0 HA ASN A 408 3.288 11.225 -7.147 1.00 0.21 H new ATOM 0 HB2 ASN A 408 2.121 8.704 -8.390 1.00 0.34 H new ATOM 0 HB3 ASN A 408 2.077 10.324 -9.057 1.00 0.34 H new ATOM 0 HD21 ASN A 408 5.457 8.007 -9.186 1.00 1.01 H new ATOM 0 HD22 ASN A 408 4.048 7.600 -8.200 1.00 1.01 H new ATOM 1085 N TYR A 409 1.324 9.107 -5.736 1.00 0.15 N ATOM 1086 CA TYR A 409 0.180 8.952 -4.853 1.00 0.15 C ATOM 1087 C TYR A 409 0.546 8.139 -3.635 1.00 0.14 C ATOM 1088 O TYR A 409 0.892 6.962 -3.731 1.00 0.15 O ATOM 1089 CB TYR A 409 -0.999 8.324 -5.567 1.00 0.19 C ATOM 1090 CG TYR A 409 -1.494 9.169 -6.703 1.00 0.23 C ATOM 1091 CD1 TYR A 409 -2.095 10.396 -6.480 1.00 0.38 C ATOM 1092 CD2 TYR A 409 -1.374 8.717 -8.005 1.00 0.31 C ATOM 1093 CE1 TYR A 409 -2.562 11.155 -7.530 1.00 0.44 C ATOM 1094 CE2 TYR A 409 -1.834 9.461 -9.062 1.00 0.34 C ATOM 1095 CZ TYR A 409 -2.385 10.776 -8.775 1.00 0.35 C ATOM 1096 OH TYR A 409 -2.887 11.437 -9.879 1.00 0.41 O ATOM 0 H TYR A 409 1.870 8.255 -5.866 1.00 0.15 H new ATOM 0 HA TYR A 409 -0.116 9.951 -4.532 1.00 0.15 H new ATOM 0 HB2 TYR A 409 -0.711 7.343 -5.946 1.00 0.19 H new ATOM 0 HB3 TYR A 409 -1.809 8.166 -4.855 1.00 0.19 H new ATOM 0 HD1 TYR A 409 -2.199 10.763 -5.470 1.00 0.38 H new ATOM 0 HD2 TYR A 409 -0.909 7.760 -8.193 1.00 0.31 H new ATOM 0 HE1 TYR A 409 -3.083 12.079 -7.326 1.00 0.44 H new ATOM 0 HE2 TYR A 409 -1.788 9.083 -10.073 1.00 0.34 H new ATOM 0 HH TYR A 409 -2.620 10.962 -10.694 1.00 0.41 H new ATOM 1106 N TRP A 410 0.462 8.792 -2.502 1.00 0.13 N ATOM 1107 CA TRP A 410 0.820 8.212 -1.224 1.00 0.11 C ATOM 1108 C TRP A 410 -0.324 8.294 -0.258 1.00 0.10 C ATOM 1109 O TRP A 410 -0.977 9.331 -0.116 1.00 0.12 O ATOM 1110 CB TRP A 410 2.011 8.963 -0.636 1.00 0.12 C ATOM 1111 CG TRP A 410 2.500 8.469 0.689 1.00 0.11 C ATOM 1112 CD1 TRP A 410 2.920 9.252 1.710 1.00 0.12 C ATOM 1113 CD2 TRP A 410 2.636 7.115 1.140 1.00 0.11 C ATOM 1114 NE1 TRP A 410 3.301 8.486 2.769 1.00 0.13 N ATOM 1115 CE2 TRP A 410 3.144 7.162 2.448 1.00 0.11 C ATOM 1116 CE3 TRP A 410 2.377 5.875 0.570 1.00 0.11 C ATOM 1117 CZ2 TRP A 410 3.398 6.005 3.192 1.00 0.12 C ATOM 1118 CZ3 TRP A 410 2.633 4.735 1.297 1.00 0.11 C ATOM 1119 CH2 TRP A 410 3.142 4.806 2.598 1.00 0.11 C ATOM 0 H TRP A 410 0.138 9.757 -2.437 1.00 0.13 H new ATOM 0 HA TRP A 410 1.074 7.165 -1.387 1.00 0.11 H new ATOM 0 HB2 TRP A 410 2.835 8.914 -1.348 1.00 0.12 H new ATOM 0 HB3 TRP A 410 1.740 10.014 -0.534 1.00 0.12 H new ATOM 0 HD1 TRP A 410 2.949 10.331 1.688 1.00 0.12 H new ATOM 0 HE1 TRP A 410 3.648 8.841 3.660 1.00 0.13 H new ATOM 0 HE3 TRP A 410 1.979 5.806 -0.432 1.00 0.11 H new ATOM 0 HZ2 TRP A 410 3.783 6.060 4.200 1.00 0.12 H new ATOM 0 HZ3 TRP A 410 2.438 3.769 0.856 1.00 0.11 H new ATOM 0 HH2 TRP A 410 3.336 3.893 3.142 1.00 0.11 H new ATOM 1130 N MET A 411 -0.559 7.196 0.403 1.00 0.09 N ATOM 1131 CA MET A 411 -1.495 7.164 1.475 1.00 0.10 C ATOM 1132 C MET A 411 -0.955 6.429 2.689 1.00 0.09 C ATOM 1133 O MET A 411 -1.156 5.227 2.835 1.00 0.10 O ATOM 1134 CB MET A 411 -2.759 6.529 1.005 1.00 0.12 C ATOM 1135 CG MET A 411 -3.769 7.572 0.661 1.00 0.14 C ATOM 1136 SD MET A 411 -5.428 6.908 0.570 1.00 0.41 S ATOM 1137 CE MET A 411 -5.129 5.467 -0.447 1.00 0.13 C ATOM 0 H MET A 411 -0.105 6.303 0.210 1.00 0.09 H new ATOM 0 HA MET A 411 -1.686 8.191 1.786 1.00 0.10 H new ATOM 0 HB2 MET A 411 -2.558 5.907 0.133 1.00 0.12 H new ATOM 0 HB3 MET A 411 -3.154 5.873 1.781 1.00 0.12 H new ATOM 0 HG2 MET A 411 -3.738 8.365 1.408 1.00 0.14 H new ATOM 0 HG3 MET A 411 -3.509 8.025 -0.296 1.00 0.14 H new ATOM 0 HE1 MET A 411 -6.042 4.875 -0.516 1.00 0.13 H new ATOM 0 HE2 MET A 411 -4.824 5.783 -1.445 1.00 0.13 H new ATOM 0 HE3 MET A 411 -4.338 4.864 -0.000 1.00 0.13 H new ATOM 1147 N PRO A 412 -0.261 7.147 3.571 1.00 0.09 N ATOM 1148 CA PRO A 412 0.287 6.584 4.806 1.00 0.09 C ATOM 1149 C PRO A 412 -0.794 6.288 5.812 1.00 0.09 C ATOM 1150 O PRO A 412 -1.737 7.057 5.998 1.00 0.09 O ATOM 1151 CB PRO A 412 1.171 7.711 5.326 1.00 0.10 C ATOM 1152 CG PRO A 412 0.485 8.931 4.844 1.00 0.16 C ATOM 1153 CD PRO A 412 0.046 8.582 3.450 1.00 0.11 C ATOM 0 HA PRO A 412 0.807 5.641 4.638 1.00 0.09 H new ATOM 0 HB2 PRO A 412 1.246 7.695 6.413 1.00 0.10 H new ATOM 0 HB3 PRO A 412 2.186 7.639 4.935 1.00 0.10 H new ATOM 0 HG2 PRO A 412 -0.365 9.186 5.477 1.00 0.16 H new ATOM 0 HG3 PRO A 412 1.154 9.791 4.847 1.00 0.16 H new ATOM 0 HD2 PRO A 412 -0.825 9.160 3.141 1.00 0.11 H new ATOM 0 HD3 PRO A 412 0.830 8.770 2.717 1.00 0.11 H new ATOM 1161 N ILE A 413 -0.639 5.146 6.432 1.00 0.09 N ATOM 1162 CA ILE A 413 -1.621 4.608 7.340 1.00 0.10 C ATOM 1163 C ILE A 413 -1.005 4.343 8.700 1.00 0.14 C ATOM 1164 O ILE A 413 -1.707 4.133 9.682 1.00 0.17 O ATOM 1165 CB ILE A 413 -2.175 3.310 6.774 1.00 0.09 C ATOM 1166 CG1 ILE A 413 -1.084 2.230 6.763 1.00 0.10 C ATOM 1167 CG2 ILE A 413 -2.689 3.593 5.383 1.00 0.09 C ATOM 1168 CD1 ILE A 413 -1.413 1.031 5.910 1.00 0.11 C ATOM 0 H ILE A 413 0.185 4.555 6.319 1.00 0.09 H new ATOM 0 HA ILE A 413 -2.424 5.336 7.457 1.00 0.10 H new ATOM 0 HB ILE A 413 -2.991 2.935 7.392 1.00 0.09 H new ATOM 0 HG12 ILE A 413 -0.154 2.672 6.406 1.00 0.10 H new ATOM 0 HG13 ILE A 413 -0.907 1.897 7.786 1.00 0.10 H new ATOM 0 HG21 ILE A 413 -3.093 2.677 4.951 1.00 0.09 H new ATOM 0 HG22 ILE A 413 -3.473 4.348 5.432 1.00 0.09 H new ATOM 0 HG23 ILE A 413 -1.872 3.958 4.760 1.00 0.09 H new ATOM 0 HD11 ILE A 413 -0.592 0.315 5.956 1.00 0.11 H new ATOM 0 HD12 ILE A 413 -2.325 0.561 6.279 1.00 0.11 H new ATOM 0 HD13 ILE A 413 -1.560 1.348 4.878 1.00 0.11 H new ATOM 1180 N ASP A 414 0.320 4.312 8.736 1.00 0.15 N ATOM 1181 CA ASP A 414 1.037 4.139 9.991 1.00 0.22 C ATOM 1182 C ASP A 414 2.195 5.124 10.066 1.00 0.21 C ATOM 1183 O ASP A 414 2.668 5.595 9.031 1.00 0.22 O ATOM 1184 CB ASP A 414 1.537 2.702 10.137 1.00 0.31 C ATOM 1185 CG ASP A 414 1.994 2.387 11.543 1.00 0.88 C ATOM 1186 OD1 ASP A 414 1.132 2.199 12.424 1.00 1.59 O ATOM 1187 OD2 ASP A 414 3.217 2.326 11.773 1.00 1.23 O1- ATOM 0 H ASP A 414 0.918 4.404 7.915 1.00 0.15 H new ATOM 0 HA ASP A 414 0.353 4.339 10.815 1.00 0.22 H new ATOM 0 HB2 ASP A 414 0.741 2.013 9.855 1.00 0.31 H new ATOM 0 HB3 ASP A 414 2.362 2.536 9.445 1.00 0.31 H new ATOM 1192 N TRP A 415 2.672 5.413 11.268 1.00 0.24 N ATOM 1193 CA TRP A 415 3.742 6.389 11.453 1.00 0.25 C ATOM 1194 C TRP A 415 5.127 5.759 11.342 1.00 0.27 C ATOM 1195 O TRP A 415 6.126 6.384 11.692 1.00 0.31 O ATOM 1196 CB TRP A 415 3.587 7.127 12.775 1.00 0.28 C ATOM 1197 CG TRP A 415 2.583 8.233 12.702 1.00 0.28 C ATOM 1198 CD1 TRP A 415 2.848 9.567 12.666 1.00 0.30 C ATOM 1199 CD2 TRP A 415 1.158 8.103 12.625 1.00 0.27 C ATOM 1200 NE1 TRP A 415 1.676 10.280 12.602 1.00 0.30 N ATOM 1201 CE2 TRP A 415 0.624 9.403 12.570 1.00 0.28 C ATOM 1202 CE3 TRP A 415 0.284 7.016 12.604 1.00 0.27 C ATOM 1203 CZ2 TRP A 415 -0.747 9.638 12.498 1.00 0.28 C ATOM 1204 CZ3 TRP A 415 -1.074 7.259 12.527 1.00 0.27 C ATOM 1205 CH2 TRP A 415 -1.576 8.558 12.476 1.00 0.27 C ATOM 0 H TRP A 415 2.336 4.987 12.132 1.00 0.24 H new ATOM 0 HA TRP A 415 3.653 7.112 10.642 1.00 0.25 H new ATOM 0 HB2 TRP A 415 3.288 6.420 13.549 1.00 0.28 H new ATOM 0 HB3 TRP A 415 4.552 7.536 13.074 1.00 0.28 H new ATOM 0 HD1 TRP A 415 3.836 10.002 12.685 1.00 0.30 H new ATOM 0 HE1 TRP A 415 1.601 11.297 12.582 1.00 0.30 H new ATOM 0 HE3 TRP A 415 0.661 6.005 12.647 1.00 0.27 H new ATOM 0 HZ2 TRP A 415 -1.140 10.643 12.461 1.00 0.28 H new ATOM 0 HZ3 TRP A 415 -1.760 6.425 12.506 1.00 0.27 H new ATOM 0 HH2 TRP A 415 -2.644 8.711 12.418 1.00 0.27 H new ATOM 1216 N THR A 416 5.201 4.545 10.839 1.00 0.27 N ATOM 1217 CA THR A 416 6.488 3.925 10.588 1.00 0.32 C ATOM 1218 C THR A 416 6.869 4.237 9.169 1.00 0.30 C ATOM 1219 O THR A 416 8.041 4.318 8.799 1.00 0.35 O ATOM 1220 CB THR A 416 6.434 2.403 10.769 1.00 0.40 C ATOM 1221 OG1 THR A 416 5.228 1.892 10.187 1.00 0.41 O ATOM 1222 CG2 THR A 416 6.506 2.027 12.239 1.00 0.44 C ATOM 0 H THR A 416 4.394 3.971 10.597 1.00 0.27 H new ATOM 0 HA THR A 416 7.216 4.314 11.300 1.00 0.32 H new ATOM 0 HB THR A 416 7.295 1.963 10.266 1.00 0.40 H new ATOM 0 HG1 THR A 416 4.494 1.973 10.831 1.00 0.41 H new ATOM 0 HG21 THR A 416 6.466 0.942 12.340 1.00 0.44 H new ATOM 0 HG22 THR A 416 7.439 2.396 12.664 1.00 0.44 H new ATOM 0 HG23 THR A 416 5.665 2.472 12.770 1.00 0.44 H new ATOM 1230 N GLY A 417 5.830 4.463 8.398 1.00 0.24 N ATOM 1231 CA GLY A 417 5.976 4.774 7.013 1.00 0.24 C ATOM 1232 C GLY A 417 5.286 3.771 6.143 1.00 0.19 C ATOM 1233 O GLY A 417 5.703 3.509 5.018 1.00 0.20 O ATOM 0 H GLY A 417 4.864 4.434 8.723 1.00 0.24 H new ATOM 0 HA2 GLY A 417 5.568 5.766 6.818 1.00 0.24 H new ATOM 0 HA3 GLY A 417 7.035 4.809 6.758 1.00 0.24 H new ATOM 1237 N VAL A 418 4.214 3.211 6.667 1.00 0.15 N ATOM 1238 CA VAL A 418 3.434 2.266 5.917 1.00 0.11 C ATOM 1239 C VAL A 418 2.198 2.921 5.355 1.00 0.09 C ATOM 1240 O VAL A 418 1.634 3.835 5.960 1.00 0.09 O ATOM 1241 CB VAL A 418 3.051 1.035 6.763 1.00 0.14 C ATOM 1242 CG1 VAL A 418 2.039 0.157 6.051 1.00 0.14 C ATOM 1243 CG2 VAL A 418 4.295 0.245 7.061 1.00 0.17 C ATOM 0 H VAL A 418 3.869 3.398 7.609 1.00 0.15 H new ATOM 0 HA VAL A 418 4.055 1.918 5.092 1.00 0.11 H new ATOM 0 HB VAL A 418 2.590 1.380 7.688 1.00 0.14 H new ATOM 0 HG11 VAL A 418 1.795 -0.700 6.679 1.00 0.14 H new ATOM 0 HG12 VAL A 418 1.134 0.732 5.853 1.00 0.14 H new ATOM 0 HG13 VAL A 418 2.460 -0.193 5.108 1.00 0.14 H new ATOM 0 HG21 VAL A 418 4.037 -0.629 7.659 1.00 0.17 H new ATOM 0 HG22 VAL A 418 4.754 -0.078 6.126 1.00 0.17 H new ATOM 0 HG23 VAL A 418 4.998 0.868 7.614 1.00 0.17 H new ATOM 1253 N GLY A 419 1.791 2.448 4.199 1.00 0.10 N ATOM 1254 CA GLY A 419 0.641 2.998 3.532 1.00 0.08 C ATOM 1255 C GLY A 419 0.440 2.399 2.164 1.00 0.08 C ATOM 1256 O GLY A 419 1.090 1.411 1.812 1.00 0.09 O ATOM 0 H GLY A 419 2.244 1.681 3.702 1.00 0.10 H new ATOM 0 HA2 GLY A 419 -0.248 2.823 4.138 1.00 0.08 H new ATOM 0 HA3 GLY A 419 0.757 4.078 3.441 1.00 0.08 H new ATOM 1260 N ILE A 420 -0.441 3.003 1.388 1.00 0.08 N ATOM 1261 CA ILE A 420 -0.668 2.590 0.035 1.00 0.09 C ATOM 1262 C ILE A 420 0.005 3.586 -0.894 1.00 0.07 C ATOM 1263 O ILE A 420 -0.032 4.788 -0.639 1.00 0.08 O ATOM 1264 CB ILE A 420 -2.182 2.517 -0.256 1.00 0.10 C ATOM 1265 CG1 ILE A 420 -2.606 1.085 -0.522 1.00 0.11 C ATOM 1266 CG2 ILE A 420 -2.548 3.368 -1.438 1.00 0.12 C ATOM 1267 CD1 ILE A 420 -2.723 0.221 0.710 1.00 0.11 C ATOM 0 H ILE A 420 -1.014 3.792 1.687 1.00 0.08 H new ATOM 0 HA ILE A 420 -0.248 1.597 -0.125 1.00 0.09 H new ATOM 0 HB ILE A 420 -2.703 2.893 0.625 1.00 0.10 H new ATOM 0 HG12 ILE A 420 -3.568 1.095 -1.035 1.00 0.11 H new ATOM 0 HG13 ILE A 420 -1.887 0.628 -1.202 1.00 0.11 H new ATOM 0 HG21 ILE A 420 -3.620 3.297 -1.619 1.00 0.12 H new ATOM 0 HG22 ILE A 420 -2.282 4.406 -1.236 1.00 0.12 H new ATOM 0 HG23 ILE A 420 -2.007 3.020 -2.318 1.00 0.12 H new ATOM 0 HD11 ILE A 420 -3.031 -0.784 0.422 1.00 0.11 H new ATOM 0 HD12 ILE A 420 -1.758 0.174 1.215 1.00 0.11 H new ATOM 0 HD13 ILE A 420 -3.465 0.648 1.385 1.00 0.11 H new ATOM 1279 N HIS A 421 0.629 3.108 -1.949 1.00 0.07 N ATOM 1280 CA HIS A 421 1.279 4.012 -2.884 1.00 0.07 C ATOM 1281 C HIS A 421 1.330 3.446 -4.273 1.00 0.09 C ATOM 1282 O HIS A 421 1.160 2.258 -4.486 1.00 0.11 O ATOM 1283 CB HIS A 421 2.710 4.325 -2.481 1.00 0.09 C ATOM 1284 CG HIS A 421 3.622 3.148 -2.445 1.00 0.11 C ATOM 1285 ND1 HIS A 421 4.193 2.596 -3.566 1.00 0.12 N ATOM 1286 CD2 HIS A 421 4.109 2.466 -1.392 1.00 0.13 C ATOM 1287 CE1 HIS A 421 5.020 1.617 -3.161 1.00 0.15 C ATOM 1288 NE2 HIS A 421 5.000 1.496 -1.847 1.00 0.15 N ATOM 0 H HIS A 421 0.702 2.118 -2.182 1.00 0.07 H new ATOM 0 HA HIS A 421 0.674 4.919 -2.864 1.00 0.07 H new ATOM 0 HB2 HIS A 421 3.116 5.060 -3.176 1.00 0.09 H new ATOM 0 HB3 HIS A 421 2.701 4.790 -1.495 1.00 0.09 H new ATOM 0 HD2 HIS A 421 3.850 2.642 -0.358 1.00 0.13 H new ATOM 0 HE1 HIS A 421 5.621 1.010 -3.823 1.00 0.15 H new ATOM 0 HE2 HIS A 421 5.527 0.831 -1.282 1.00 0.15 H new ATOM 1296 N ASP A 422 1.615 4.333 -5.200 1.00 0.11 N ATOM 1297 CA ASP A 422 1.856 3.986 -6.558 1.00 0.14 C ATOM 1298 C ASP A 422 3.334 3.743 -6.709 1.00 0.19 C ATOM 1299 O ASP A 422 4.143 4.421 -6.090 1.00 0.29 O ATOM 1300 CB ASP A 422 1.397 5.130 -7.445 1.00 0.20 C ATOM 1301 CG ASP A 422 2.512 6.054 -7.873 1.00 0.31 C ATOM 1302 OD1 ASP A 422 2.881 6.940 -7.076 1.00 0.33 O1- ATOM 1303 OD2 ASP A 422 3.017 5.904 -9.004 1.00 0.42 O ATOM 0 H ASP A 422 1.684 5.333 -5.014 1.00 0.11 H new ATOM 0 HA ASP A 422 1.309 3.089 -6.848 1.00 0.14 H new ATOM 0 HB2 ASP A 422 0.917 4.719 -8.333 1.00 0.20 H new ATOM 0 HB3 ASP A 422 0.642 5.709 -6.914 1.00 0.20 H new ATOM 1308 N SER A 423 3.702 2.771 -7.480 1.00 0.15 N ATOM 1309 CA SER A 423 5.095 2.453 -7.587 1.00 0.19 C ATOM 1310 C SER A 423 5.461 2.156 -9.000 1.00 0.15 C ATOM 1311 O SER A 423 5.165 1.106 -9.565 1.00 0.16 O ATOM 1312 CB SER A 423 5.409 1.271 -6.701 1.00 0.26 C ATOM 1313 OG SER A 423 6.775 1.227 -6.372 1.00 1.48 O ATOM 0 H SER A 423 3.074 2.191 -8.037 1.00 0.15 H new ATOM 0 HA SER A 423 5.681 3.313 -7.262 1.00 0.19 H new ATOM 0 HB2 SER A 423 4.815 1.330 -5.789 1.00 0.26 H new ATOM 0 HB3 SER A 423 5.125 0.349 -7.208 1.00 0.26 H new ATOM 0 HG SER A 423 6.982 1.943 -5.736 1.00 1.48 H new ATOM 1319 N ASP A 424 6.106 3.142 -9.549 1.00 0.13 N ATOM 1320 CA ASP A 424 6.554 3.119 -10.909 1.00 0.13 C ATOM 1321 C ASP A 424 7.986 2.613 -10.999 1.00 0.12 C ATOM 1322 O ASP A 424 8.396 2.010 -11.987 1.00 0.15 O ATOM 1323 CB ASP A 424 6.379 4.513 -11.450 1.00 0.15 C ATOM 1324 CG ASP A 424 7.217 4.819 -12.680 1.00 0.25 C ATOM 1325 OD1 ASP A 424 8.406 5.168 -12.522 1.00 0.35 O1- ATOM 1326 OD2 ASP A 424 6.697 4.681 -13.809 1.00 0.34 O ATOM 0 H ASP A 424 6.340 4.002 -9.053 1.00 0.13 H new ATOM 0 HA ASP A 424 5.971 2.425 -11.514 1.00 0.13 H new ATOM 0 HB2 ASP A 424 5.328 4.665 -11.695 1.00 0.15 H new ATOM 0 HB3 ASP A 424 6.631 5.228 -10.667 1.00 0.15 H new ATOM 1331 N TRP A 425 8.744 2.897 -9.933 1.00 0.12 N ATOM 1332 CA TRP A 425 10.125 2.434 -9.788 1.00 0.14 C ATOM 1333 C TRP A 425 10.137 0.932 -9.606 1.00 0.15 C ATOM 1334 O TRP A 425 11.118 0.254 -9.903 1.00 0.18 O ATOM 1335 CB TRP A 425 10.769 3.101 -8.565 1.00 0.14 C ATOM 1336 CG TRP A 425 10.296 2.603 -7.243 1.00 0.12 C ATOM 1337 CD1 TRP A 425 10.700 1.498 -6.575 1.00 0.13 C ATOM 1338 CD2 TRP A 425 9.349 3.246 -6.418 1.00 0.12 C ATOM 1339 NE1 TRP A 425 10.040 1.406 -5.374 1.00 0.13 N ATOM 1340 CE2 TRP A 425 9.204 2.481 -5.254 1.00 0.12 C ATOM 1341 CE3 TRP A 425 8.609 4.399 -6.564 1.00 0.14 C ATOM 1342 CZ2 TRP A 425 8.335 2.845 -4.234 1.00 0.14 C ATOM 1343 CZ3 TRP A 425 7.759 4.770 -5.560 1.00 0.16 C ATOM 1344 CH2 TRP A 425 7.621 4.000 -4.400 1.00 0.15 C ATOM 0 H TRP A 425 8.414 3.456 -9.146 1.00 0.12 H new ATOM 0 HA TRP A 425 10.689 2.698 -10.682 1.00 0.14 H new ATOM 0 HB2 TRP A 425 11.848 2.961 -8.622 1.00 0.14 H new ATOM 0 HB3 TRP A 425 10.584 4.174 -8.618 1.00 0.14 H new ATOM 0 HD1 TRP A 425 11.434 0.792 -6.934 1.00 0.13 H new ATOM 0 HE1 TRP A 425 10.154 0.661 -4.687 1.00 0.13 H new ATOM 0 HE3 TRP A 425 8.699 5.000 -7.457 1.00 0.14 H new ATOM 0 HZ2 TRP A 425 8.227 2.241 -3.345 1.00 0.14 H new ATOM 0 HZ3 TRP A 425 7.182 5.677 -5.664 1.00 0.16 H new ATOM 0 HH2 TRP A 425 6.941 4.322 -3.625 1.00 0.15 H new ATOM 1355 N GLN A 426 9.037 0.455 -9.061 1.00 0.15 N ATOM 1356 CA GLN A 426 8.861 -0.948 -8.704 1.00 0.17 C ATOM 1357 C GLN A 426 7.699 -1.519 -9.452 1.00 0.18 C ATOM 1358 O GLN A 426 6.590 -1.658 -8.953 1.00 0.28 O ATOM 1359 CB GLN A 426 8.584 -1.015 -7.248 1.00 0.18 C ATOM 1360 CG GLN A 426 9.671 -1.664 -6.420 1.00 0.58 C ATOM 1361 CD GLN A 426 9.266 -3.012 -5.867 1.00 0.63 C ATOM 1362 OE1 GLN A 426 9.699 -3.393 -4.791 1.00 1.33 O ATOM 1363 NE2 GLN A 426 8.441 -3.753 -6.588 1.00 0.22 N ATOM 0 H GLN A 426 8.225 1.035 -8.848 1.00 0.15 H new ATOM 0 HA GLN A 426 9.757 -1.516 -8.955 1.00 0.17 H new ATOM 0 HB2 GLN A 426 8.421 -0.003 -6.877 1.00 0.18 H new ATOM 0 HB3 GLN A 426 7.655 -1.564 -7.095 1.00 0.18 H new ATOM 0 HG2 GLN A 426 10.565 -1.782 -7.032 1.00 0.58 H new ATOM 0 HG3 GLN A 426 9.935 -1.003 -5.594 1.00 0.58 H new ATOM 0 HE21 GLN A 426 8.096 -3.408 -7.484 1.00 0.22 H new ATOM 0 HE22 GLN A 426 8.150 -4.670 -6.248 1.00 0.22 H new ATOM 1372 N PRO A 427 8.005 -1.871 -10.662 1.00 0.16 N ATOM 1373 CA PRO A 427 7.056 -2.094 -11.716 1.00 0.18 C ATOM 1374 C PRO A 427 6.416 -3.468 -11.706 1.00 0.16 C ATOM 1375 O PRO A 427 5.690 -3.825 -12.636 1.00 0.18 O ATOM 1376 CB PRO A 427 7.951 -1.936 -12.924 1.00 0.23 C ATOM 1377 CG PRO A 427 9.190 -2.574 -12.479 1.00 0.23 C ATOM 1378 CD PRO A 427 9.367 -2.038 -11.121 1.00 0.19 C ATOM 0 HA PRO A 427 6.197 -1.426 -11.656 1.00 0.18 H new ATOM 0 HB2 PRO A 427 7.535 -2.425 -13.805 1.00 0.23 H new ATOM 0 HB3 PRO A 427 8.103 -0.888 -13.183 1.00 0.23 H new ATOM 0 HG2 PRO A 427 9.106 -3.661 -12.477 1.00 0.23 H new ATOM 0 HG3 PRO A 427 10.030 -2.320 -13.126 1.00 0.23 H new ATOM 0 HD2 PRO A 427 9.927 -2.724 -10.485 1.00 0.19 H new ATOM 0 HD3 PRO A 427 9.911 -1.093 -11.127 1.00 0.19 H new ATOM 1386 N GLU A 428 6.700 -4.234 -10.671 1.00 0.14 N ATOM 1387 CA GLU A 428 6.156 -5.565 -10.547 1.00 0.14 C ATOM 1388 C GLU A 428 5.231 -5.623 -9.353 1.00 0.12 C ATOM 1389 O GLU A 428 5.418 -4.894 -8.391 1.00 0.15 O ATOM 1390 CB GLU A 428 7.266 -6.571 -10.365 1.00 0.17 C ATOM 1391 CG GLU A 428 7.010 -7.887 -11.020 1.00 0.22 C ATOM 1392 CD GLU A 428 8.279 -8.600 -11.423 1.00 0.64 C ATOM 1393 OE1 GLU A 428 8.964 -9.140 -10.537 1.00 0.98 O ATOM 1394 OE2 GLU A 428 8.593 -8.635 -12.629 1.00 1.10 O1- ATOM 0 H GLU A 428 7.308 -3.952 -9.902 1.00 0.14 H new ATOM 0 HA GLU A 428 5.604 -5.804 -11.456 1.00 0.14 H new ATOM 0 HB2 GLU A 428 8.190 -6.152 -10.764 1.00 0.17 H new ATOM 0 HB3 GLU A 428 7.424 -6.733 -9.299 1.00 0.17 H new ATOM 0 HG2 GLU A 428 6.443 -8.522 -10.339 1.00 0.22 H new ATOM 0 HG3 GLU A 428 6.390 -7.733 -11.903 1.00 0.22 H new ATOM 1401 N TYR A 429 4.253 -6.503 -9.445 1.00 0.11 N ATOM 1402 CA TYR A 429 3.160 -6.630 -8.486 1.00 0.10 C ATOM 1403 C TYR A 429 2.545 -7.994 -8.655 1.00 0.10 C ATOM 1404 O TYR A 429 2.228 -8.401 -9.774 1.00 0.14 O ATOM 1405 CB TYR A 429 2.052 -5.644 -8.772 1.00 0.13 C ATOM 1406 CG TYR A 429 2.449 -4.397 -9.515 1.00 0.16 C ATOM 1407 CD1 TYR A 429 2.862 -3.268 -8.829 1.00 0.19 C ATOM 1408 CD2 TYR A 429 2.406 -4.353 -10.898 1.00 0.23 C ATOM 1409 CE1 TYR A 429 3.227 -2.119 -9.508 1.00 0.25 C ATOM 1410 CE2 TYR A 429 2.768 -3.216 -11.584 1.00 0.29 C ATOM 1411 CZ TYR A 429 3.179 -2.101 -10.888 1.00 0.30 C ATOM 1412 OH TYR A 429 3.534 -0.965 -11.579 1.00 0.38 O ATOM 0 H TYR A 429 4.190 -7.173 -10.212 1.00 0.11 H new ATOM 0 HA TYR A 429 3.568 -6.457 -7.490 1.00 0.10 H new ATOM 0 HB2 TYR A 429 1.279 -6.154 -9.347 1.00 0.13 H new ATOM 0 HB3 TYR A 429 1.602 -5.350 -7.824 1.00 0.13 H new ATOM 0 HD1 TYR A 429 2.900 -3.284 -7.750 1.00 0.19 H new ATOM 0 HD2 TYR A 429 2.083 -5.225 -11.448 1.00 0.23 H new ATOM 0 HE1 TYR A 429 3.547 -1.243 -8.963 1.00 0.25 H new ATOM 0 HE2 TYR A 429 2.730 -3.198 -12.663 1.00 0.29 H new ATOM 0 HH TYR A 429 4.196 -0.461 -11.061 1.00 0.38 H new ATOM 1422 N GLY A 430 2.416 -8.715 -7.581 1.00 0.10 N ATOM 1423 CA GLY A 430 1.829 -10.022 -7.678 1.00 0.12 C ATOM 1424 C GLY A 430 2.419 -10.957 -6.672 1.00 0.13 C ATOM 1425 O GLY A 430 3.149 -10.503 -5.795 1.00 0.13 O ATOM 0 H GLY A 430 2.702 -8.430 -6.644 1.00 0.10 H new ATOM 0 HA2 GLY A 430 0.752 -9.952 -7.525 1.00 0.12 H new ATOM 0 HA3 GLY A 430 1.983 -10.419 -8.681 1.00 0.12 H new ATOM 1429 N GLY A 431 2.152 -12.256 -6.857 1.00 0.16 N ATOM 1430 CA GLY A 431 2.732 -13.315 -6.029 1.00 0.20 C ATOM 1431 C GLY A 431 4.103 -12.966 -5.499 1.00 0.17 C ATOM 1432 O GLY A 431 4.883 -12.319 -6.198 1.00 0.16 O ATOM 0 H GLY A 431 1.527 -12.600 -7.586 1.00 0.16 H new ATOM 0 HA2 GLY A 431 2.066 -13.519 -5.191 1.00 0.20 H new ATOM 0 HA3 GLY A 431 2.798 -14.232 -6.615 1.00 0.20 H new ATOM 1436 N ASP A 432 4.467 -13.532 -4.356 1.00 0.18 N ATOM 1437 CA ASP A 432 5.320 -12.828 -3.410 1.00 0.18 C ATOM 1438 C ASP A 432 6.593 -12.363 -4.038 1.00 0.18 C ATOM 1439 O ASP A 432 7.562 -13.096 -4.232 1.00 0.19 O ATOM 1440 CB ASP A 432 5.677 -13.739 -2.245 1.00 0.22 C ATOM 1441 CG ASP A 432 4.501 -14.500 -1.675 1.00 0.25 C ATOM 1442 OD1 ASP A 432 4.224 -15.620 -2.160 1.00 0.29 O ATOM 1443 OD2 ASP A 432 3.876 -14.001 -0.721 1.00 0.33 O1- ATOM 0 H ASP A 432 4.188 -14.468 -4.064 1.00 0.18 H new ATOM 0 HA ASP A 432 4.756 -11.960 -3.067 1.00 0.18 H new ATOM 0 HB2 ASP A 432 6.433 -14.452 -2.574 1.00 0.22 H new ATOM 0 HB3 ASP A 432 6.127 -13.140 -1.453 1.00 0.22 H new ATOM 1448 N LEU A 433 6.535 -11.088 -4.318 1.00 0.16 N ATOM 1449 CA LEU A 433 7.602 -10.335 -4.880 1.00 0.15 C ATOM 1450 C LEU A 433 8.343 -9.633 -3.787 1.00 0.14 C ATOM 1451 O LEU A 433 9.533 -9.395 -3.852 1.00 0.15 O ATOM 1452 CB LEU A 433 6.984 -9.377 -5.857 1.00 0.14 C ATOM 1453 CG LEU A 433 6.605 -10.028 -7.171 1.00 0.15 C ATOM 1454 CD1 LEU A 433 5.720 -9.110 -7.974 1.00 0.13 C ATOM 1455 CD2 LEU A 433 7.860 -10.400 -7.936 1.00 0.18 C ATOM 0 H LEU A 433 5.699 -10.529 -4.149 1.00 0.16 H new ATOM 0 HA LEU A 433 8.327 -10.963 -5.397 1.00 0.15 H new ATOM 0 HB2 LEU A 433 6.095 -8.934 -5.409 1.00 0.14 H new ATOM 0 HB3 LEU A 433 7.683 -8.563 -6.050 1.00 0.14 H new ATOM 0 HG LEU A 433 6.041 -10.940 -6.976 1.00 0.15 H new ATOM 0 HD11 LEU A 433 5.456 -9.591 -8.916 1.00 0.13 H new ATOM 0 HD12 LEU A 433 4.813 -8.894 -7.410 1.00 0.13 H new ATOM 0 HD13 LEU A 433 6.250 -8.180 -8.178 1.00 0.13 H new ATOM 0 HD21 LEU A 433 7.585 -10.868 -8.881 1.00 0.18 H new ATOM 0 HD22 LEU A 433 8.446 -9.502 -8.133 1.00 0.18 H new ATOM 0 HD23 LEU A 433 8.453 -11.098 -7.345 1.00 0.18 H new ATOM 1467 N TRP A 434 7.561 -9.303 -2.762 1.00 0.14 N ATOM 1468 CA TRP A 434 8.020 -8.528 -1.629 1.00 0.14 C ATOM 1469 C TRP A 434 9.296 -9.080 -1.052 1.00 0.17 C ATOM 1470 O TRP A 434 10.134 -8.335 -0.574 1.00 0.22 O ATOM 1471 CB TRP A 434 6.927 -8.436 -0.559 1.00 0.15 C ATOM 1472 CG TRP A 434 6.339 -9.746 -0.097 1.00 0.16 C ATOM 1473 CD1 TRP A 434 5.505 -10.565 -0.795 1.00 0.17 C ATOM 1474 CD2 TRP A 434 6.493 -10.351 1.191 1.00 0.16 C ATOM 1475 NE1 TRP A 434 5.159 -11.652 -0.029 1.00 0.18 N ATOM 1476 CE2 TRP A 434 5.755 -11.540 1.192 1.00 0.18 C ATOM 1477 CE3 TRP A 434 7.194 -10.007 2.336 1.00 0.17 C ATOM 1478 CZ2 TRP A 434 5.700 -12.378 2.298 1.00 0.19 C ATOM 1479 CZ3 TRP A 434 7.140 -10.833 3.436 1.00 0.19 C ATOM 1480 CH2 TRP A 434 6.398 -12.008 3.411 1.00 0.19 C ATOM 0 H TRP A 434 6.579 -9.573 -2.701 1.00 0.14 H new ATOM 0 HA TRP A 434 8.238 -7.522 -1.986 1.00 0.14 H new ATOM 0 HB2 TRP A 434 7.338 -7.920 0.308 1.00 0.15 H new ATOM 0 HB3 TRP A 434 6.119 -7.815 -0.946 1.00 0.15 H new ATOM 0 HD1 TRP A 434 5.165 -10.386 -1.804 1.00 0.17 H new ATOM 0 HE1 TRP A 434 4.555 -12.418 -0.326 1.00 0.18 H new ATOM 0 HE3 TRP A 434 7.778 -9.099 2.365 1.00 0.17 H new ATOM 0 HZ2 TRP A 434 5.124 -13.292 2.278 1.00 0.19 H new ATOM 0 HZ3 TRP A 434 7.682 -10.564 4.331 1.00 0.19 H new ATOM 0 HH2 TRP A 434 6.373 -12.639 4.287 1.00 0.19 H new ATOM 1491 N LYS A 435 9.439 -10.394 -1.145 1.00 0.17 N ATOM 1492 CA LYS A 435 10.576 -11.097 -0.613 1.00 0.19 C ATOM 1493 C LYS A 435 11.856 -10.736 -1.307 1.00 0.20 C ATOM 1494 O LYS A 435 12.944 -10.951 -0.778 1.00 0.22 O ATOM 1495 CB LYS A 435 10.339 -12.553 -0.770 1.00 0.20 C ATOM 1496 CG LYS A 435 9.246 -13.002 0.116 1.00 0.22 C ATOM 1497 CD LYS A 435 9.133 -14.477 0.087 1.00 0.26 C ATOM 1498 CE LYS A 435 7.905 -14.875 0.816 1.00 0.35 C ATOM 1499 NZ LYS A 435 8.107 -16.071 1.676 1.00 0.64 N1+ ATOM 0 H LYS A 435 8.756 -11.000 -1.599 1.00 0.17 H new ATOM 0 HA LYS A 435 10.684 -10.815 0.434 1.00 0.19 H new ATOM 0 HB2 LYS A 435 10.088 -12.776 -1.807 1.00 0.20 H new ATOM 0 HB3 LYS A 435 11.251 -13.102 -0.538 1.00 0.20 H new ATOM 0 HG2 LYS A 435 9.434 -12.665 1.135 1.00 0.22 H new ATOM 0 HG3 LYS A 435 8.305 -12.552 -0.200 1.00 0.22 H new ATOM 0 HD2 LYS A 435 9.093 -14.833 -0.943 1.00 0.26 H new ATOM 0 HD3 LYS A 435 10.010 -14.932 0.548 1.00 0.26 H new ATOM 0 HE2 LYS A 435 7.568 -14.042 1.433 1.00 0.35 H new ATOM 0 HE3 LYS A 435 7.112 -15.080 0.097 1.00 0.35 H new ATOM 0 HZ1 LYS A 435 7.217 -16.304 2.161 1.00 0.64 H new ATOM 0 HZ2 LYS A 435 8.401 -16.876 1.087 1.00 0.64 H new ATOM 0 HZ3 LYS A 435 8.844 -15.871 2.382 1.00 0.64 H new ATOM 1513 N THR A 436 11.718 -10.212 -2.493 1.00 0.19 N ATOM 1514 CA THR A 436 12.857 -9.881 -3.298 1.00 0.21 C ATOM 1515 C THR A 436 12.884 -8.389 -3.585 1.00 0.19 C ATOM 1516 O THR A 436 13.936 -7.747 -3.574 1.00 0.23 O ATOM 1517 CB THR A 436 12.809 -10.658 -4.623 1.00 0.22 C ATOM 1518 OG1 THR A 436 11.688 -10.230 -5.407 1.00 0.21 O ATOM 1519 CG2 THR A 436 12.674 -12.140 -4.343 1.00 0.25 C ATOM 0 H THR A 436 10.818 -10.004 -2.925 1.00 0.19 H new ATOM 0 HA THR A 436 13.759 -10.155 -2.751 1.00 0.21 H new ATOM 0 HB THR A 436 13.731 -10.466 -5.172 1.00 0.22 H new ATOM 0 HG1 THR A 436 10.934 -10.026 -4.815 1.00 0.21 H new ATOM 0 HG21 THR A 436 12.640 -12.687 -5.285 1.00 0.25 H new ATOM 0 HG22 THR A 436 13.528 -12.479 -3.757 1.00 0.25 H new ATOM 0 HG23 THR A 436 11.756 -12.323 -3.785 1.00 0.25 H new ATOM 1527 N ARG A 437 11.696 -7.841 -3.800 1.00 0.16 N ATOM 1528 CA ARG A 437 11.554 -6.491 -4.315 1.00 0.15 C ATOM 1529 C ARG A 437 11.650 -5.429 -3.234 1.00 0.17 C ATOM 1530 O ARG A 437 11.884 -4.257 -3.515 1.00 0.20 O ATOM 1531 CB ARG A 437 10.232 -6.388 -5.026 1.00 0.14 C ATOM 1532 CG ARG A 437 10.040 -7.437 -6.068 1.00 0.15 C ATOM 1533 CD ARG A 437 9.302 -6.883 -7.259 1.00 0.17 C ATOM 1534 NE ARG A 437 10.057 -5.785 -7.875 1.00 0.23 N ATOM 1535 CZ ARG A 437 10.608 -5.817 -9.091 1.00 0.30 C ATOM 1536 NH1 ARG A 437 10.468 -6.878 -9.875 1.00 0.34 N1+ ATOM 1537 NH2 ARG A 437 11.316 -4.780 -9.519 1.00 0.36 N ATOM 0 H ARG A 437 10.811 -8.317 -3.623 1.00 0.16 H new ATOM 0 HA ARG A 437 12.381 -6.304 -5.000 1.00 0.15 H new ATOM 0 HB2 ARG A 437 9.427 -6.461 -4.294 1.00 0.14 H new ATOM 0 HB3 ARG A 437 10.153 -5.405 -5.491 1.00 0.14 H new ATOM 0 HG2 ARG A 437 11.009 -7.824 -6.383 1.00 0.15 H new ATOM 0 HG3 ARG A 437 9.484 -8.275 -5.648 1.00 0.15 H new ATOM 0 HD2 ARG A 437 9.138 -7.674 -7.991 1.00 0.17 H new ATOM 0 HD3 ARG A 437 8.319 -6.526 -6.950 1.00 0.17 H new ATOM 0 HE ARG A 437 10.170 -4.930 -7.331 1.00 0.23 H new ATOM 0 HH11 ARG A 437 9.934 -7.684 -9.551 1.00 0.34 H new ATOM 0 HH12 ARG A 437 10.895 -6.887 -10.801 1.00 0.34 H new ATOM 0 HH21 ARG A 437 11.437 -3.963 -8.920 1.00 0.36 H new ATOM 0 HH22 ARG A 437 11.739 -4.799 -10.447 1.00 0.36 H new ATOM 1551 N GLY A 438 11.510 -5.859 -2.004 1.00 0.16 N ATOM 1552 CA GLY A 438 12.016 -5.071 -0.890 1.00 0.17 C ATOM 1553 C GLY A 438 11.181 -3.867 -0.460 1.00 0.17 C ATOM 1554 O GLY A 438 11.752 -2.832 -0.115 1.00 0.21 O ATOM 0 H GLY A 438 11.058 -6.736 -1.744 1.00 0.16 H new ATOM 0 HA2 GLY A 438 12.127 -5.731 -0.030 1.00 0.17 H new ATOM 0 HA3 GLY A 438 13.013 -4.717 -1.150 1.00 0.17 H new ATOM 1558 N SER A 439 9.859 -3.997 -0.429 1.00 0.15 N ATOM 1559 CA SER A 439 9.004 -2.916 0.087 1.00 0.16 C ATOM 1560 C SER A 439 8.977 -2.963 1.621 1.00 0.14 C ATOM 1561 O SER A 439 8.861 -4.024 2.203 1.00 0.20 O ATOM 1562 CB SER A 439 7.583 -3.087 -0.447 1.00 0.22 C ATOM 1563 OG SER A 439 7.572 -3.181 -1.860 1.00 0.47 O ATOM 0 H SER A 439 9.355 -4.824 -0.748 1.00 0.15 H new ATOM 0 HA SER A 439 9.405 -1.957 -0.240 1.00 0.16 H new ATOM 0 HB2 SER A 439 7.136 -3.984 -0.017 1.00 0.22 H new ATOM 0 HB3 SER A 439 6.970 -2.243 -0.132 1.00 0.22 H new ATOM 0 HG SER A 439 6.657 -3.346 -2.170 1.00 0.47 H new ATOM 1569 N HIS A 440 9.085 -1.815 2.272 1.00 0.14 N ATOM 1570 CA HIS A 440 9.236 -1.766 3.729 1.00 0.16 C ATOM 1571 C HIS A 440 7.908 -1.501 4.401 1.00 0.16 C ATOM 1572 O HIS A 440 7.710 -0.453 5.016 1.00 0.21 O ATOM 1573 CB HIS A 440 10.207 -0.665 4.163 1.00 0.22 C ATOM 1574 CG HIS A 440 11.612 -0.842 3.730 1.00 0.26 C ATOM 1575 ND1 HIS A 440 12.075 -0.401 2.523 1.00 0.33 N ATOM 1576 CD2 HIS A 440 12.682 -1.341 4.386 1.00 0.30 C ATOM 1577 CE1 HIS A 440 13.364 -0.611 2.454 1.00 0.41 C ATOM 1578 NE2 HIS A 440 13.763 -1.184 3.568 1.00 0.38 N ATOM 0 H HIS A 440 9.072 -0.901 1.819 1.00 0.14 H new ATOM 0 HA HIS A 440 9.628 -2.738 4.029 1.00 0.16 H new ATOM 0 HB2 HIS A 440 9.844 0.287 3.777 1.00 0.22 H new ATOM 0 HB3 HIS A 440 10.187 -0.596 5.251 1.00 0.22 H new ATOM 0 HD2 HIS A 440 12.682 -1.781 5.372 1.00 0.30 H new ATOM 0 HE1 HIS A 440 13.998 -0.355 1.618 1.00 0.41 H new ATOM 0 HE2 HIS A 440 14.720 -1.464 3.784 1.00 0.38 H new ATOM 1587 N GLY A 441 7.002 -2.453 4.274 1.00 0.15 N ATOM 1588 CA GLY A 441 5.715 -2.339 4.907 1.00 0.16 C ATOM 1589 C GLY A 441 4.754 -1.604 4.021 1.00 0.15 C ATOM 1590 O GLY A 441 3.549 -1.632 4.234 1.00 0.18 O ATOM 0 H GLY A 441 7.140 -3.310 3.738 1.00 0.15 H new ATOM 0 HA2 GLY A 441 5.325 -3.332 5.131 1.00 0.16 H new ATOM 0 HA3 GLY A 441 5.816 -1.814 5.857 1.00 0.16 H new ATOM 1594 N CYS A 442 5.297 -0.960 3.007 1.00 0.14 N ATOM 1595 CA CYS A 442 4.496 -0.202 2.084 1.00 0.16 C ATOM 1596 C CYS A 442 3.958 -1.107 0.995 1.00 0.18 C ATOM 1597 O CYS A 442 4.596 -2.101 0.633 1.00 0.28 O ATOM 1598 CB CYS A 442 5.305 0.941 1.488 1.00 0.20 C ATOM 1599 SG CYS A 442 6.753 0.407 0.547 1.00 0.83 S ATOM 0 H CYS A 442 6.297 -0.951 2.806 1.00 0.14 H new ATOM 0 HA CYS A 442 3.652 0.228 2.623 1.00 0.16 H new ATOM 0 HB2 CYS A 442 4.658 1.529 0.837 1.00 0.20 H new ATOM 0 HB3 CYS A 442 5.631 1.600 2.293 1.00 0.20 H new ATOM 0 HG CYS A 442 7.374 1.448 0.079 1.00 0.83 H new ATOM 1605 N ILE A 443 2.788 -0.789 0.490 1.00 0.13 N ATOM 1606 CA ILE A 443 2.170 -1.594 -0.528 1.00 0.12 C ATOM 1607 C ILE A 443 2.389 -0.994 -1.898 1.00 0.12 C ATOM 1608 O ILE A 443 2.072 0.165 -2.165 1.00 0.15 O ATOM 1609 CB ILE A 443 0.677 -1.814 -0.231 1.00 0.11 C ATOM 1610 CG1 ILE A 443 0.517 -2.892 0.852 1.00 0.10 C ATOM 1611 CG2 ILE A 443 -0.071 -2.208 -1.501 1.00 0.10 C ATOM 1612 CD1 ILE A 443 1.285 -2.651 2.130 1.00 0.10 C ATOM 0 H ILE A 443 2.246 0.027 0.772 1.00 0.13 H new ATOM 0 HA ILE A 443 2.647 -2.574 -0.522 1.00 0.12 H new ATOM 0 HB ILE A 443 0.247 -0.881 0.135 1.00 0.11 H new ATOM 0 HG12 ILE A 443 -0.541 -2.982 1.097 1.00 0.10 H new ATOM 0 HG13 ILE A 443 0.830 -3.849 0.436 1.00 0.10 H new ATOM 0 HG21 ILE A 443 -1.125 -2.359 -1.270 1.00 0.10 H new ATOM 0 HG22 ILE A 443 0.028 -1.415 -2.242 1.00 0.10 H new ATOM 0 HG23 ILE A 443 0.349 -3.132 -1.899 1.00 0.10 H new ATOM 0 HD11 ILE A 443 1.101 -3.471 2.825 1.00 0.10 H new ATOM 0 HD12 ILE A 443 2.351 -2.595 1.909 1.00 0.10 H new ATOM 0 HD13 ILE A 443 0.958 -1.714 2.580 1.00 0.10 H new ATOM 1624 N ASN A 444 2.973 -1.809 -2.737 1.00 0.14 N ATOM 1625 CA ASN A 444 3.369 -1.412 -4.069 1.00 0.16 C ATOM 1626 C ASN A 444 2.191 -1.459 -5.037 1.00 0.11 C ATOM 1627 O ASN A 444 2.020 -2.445 -5.751 1.00 0.12 O ATOM 1628 CB ASN A 444 4.465 -2.358 -4.535 1.00 0.30 C ATOM 1629 CG ASN A 444 5.650 -1.680 -5.166 1.00 0.88 C ATOM 1630 OD1 ASN A 444 5.717 -1.535 -6.374 1.00 1.56 O ATOM 1631 ND2 ASN A 444 6.612 -1.279 -4.344 1.00 1.77 N ATOM 0 H ASN A 444 3.191 -2.780 -2.515 1.00 0.14 H new ATOM 0 HA ASN A 444 3.730 -0.384 -4.048 1.00 0.16 H new ATOM 0 HB2 ASN A 444 4.809 -2.943 -3.682 1.00 0.30 H new ATOM 0 HB3 ASN A 444 4.040 -3.060 -5.252 1.00 0.30 H new ATOM 0 HD21 ASN A 444 7.448 -0.830 -4.718 1.00 1.77 H new ATOM 0 HD22 ASN A 444 6.515 -1.420 -3.338 1.00 1.77 H new ATOM 1638 N THR A 445 1.385 -0.412 -5.069 1.00 0.11 N ATOM 1639 CA THR A 445 0.262 -0.344 -5.977 1.00 0.10 C ATOM 1640 C THR A 445 0.712 0.247 -7.298 1.00 0.11 C ATOM 1641 O THR A 445 1.521 1.168 -7.347 1.00 0.14 O ATOM 1642 CB THR A 445 -0.863 0.497 -5.350 1.00 0.11 C ATOM 1643 OG1 THR A 445 -1.130 0.011 -4.030 1.00 0.18 O ATOM 1644 CG2 THR A 445 -2.125 0.444 -6.185 1.00 0.14 C ATOM 0 H THR A 445 1.492 0.407 -4.470 1.00 0.11 H new ATOM 0 HA THR A 445 -0.124 -1.347 -6.162 1.00 0.10 H new ATOM 0 HB THR A 445 -0.537 1.536 -5.308 1.00 0.11 H new ATOM 0 HG1 THR A 445 -2.095 0.039 -3.860 1.00 0.18 H new ATOM 0 HG21 THR A 445 -2.899 1.049 -5.713 1.00 0.14 H new ATOM 0 HG22 THR A 445 -1.918 0.833 -7.182 1.00 0.14 H new ATOM 0 HG23 THR A 445 -2.467 -0.588 -6.262 1.00 0.14 H new ATOM 1652 N PRO A 446 0.236 -0.332 -8.391 1.00 0.09 N ATOM 1653 CA PRO A 446 0.555 0.133 -9.726 1.00 0.08 C ATOM 1654 C PRO A 446 0.169 1.582 -9.924 1.00 0.09 C ATOM 1655 O PRO A 446 -0.917 1.990 -9.551 1.00 0.12 O ATOM 1656 CB PRO A 446 -0.281 -0.750 -10.623 1.00 0.09 C ATOM 1657 CG PRO A 446 -0.529 -1.969 -9.814 1.00 0.10 C ATOM 1658 CD PRO A 446 -0.637 -1.503 -8.409 1.00 0.09 C ATOM 0 HA PRO A 446 1.624 0.078 -9.930 1.00 0.08 H new ATOM 0 HB2 PRO A 446 -1.215 -0.262 -10.903 1.00 0.09 H new ATOM 0 HB3 PRO A 446 0.244 -0.987 -11.548 1.00 0.09 H new ATOM 0 HG2 PRO A 446 -1.443 -2.470 -10.132 1.00 0.10 H new ATOM 0 HG3 PRO A 446 0.284 -2.686 -9.927 1.00 0.10 H new ATOM 0 HD2 PRO A 446 -1.663 -1.247 -8.145 1.00 0.09 H new ATOM 0 HD3 PRO A 446 -0.307 -2.265 -7.703 1.00 0.09 H new ATOM 1666 N PRO A 447 1.052 2.353 -10.547 1.00 0.09 N ATOM 1667 CA PRO A 447 0.901 3.806 -10.744 1.00 0.09 C ATOM 1668 C PRO A 447 -0.397 4.175 -11.404 1.00 0.09 C ATOM 1669 O PRO A 447 -0.992 5.218 -11.131 1.00 0.16 O ATOM 1670 CB PRO A 447 2.076 4.099 -11.663 1.00 0.10 C ATOM 1671 CG PRO A 447 3.082 3.153 -11.158 1.00 0.10 C ATOM 1672 CD PRO A 447 2.304 1.882 -11.145 1.00 0.09 C ATOM 0 HA PRO A 447 0.889 4.368 -9.810 1.00 0.09 H new ATOM 0 HB2 PRO A 447 1.833 3.920 -12.710 1.00 0.10 H new ATOM 0 HB3 PRO A 447 2.410 5.134 -11.586 1.00 0.10 H new ATOM 0 HG2 PRO A 447 3.955 3.095 -11.808 1.00 0.10 H new ATOM 0 HG3 PRO A 447 3.442 3.426 -10.166 1.00 0.10 H new ATOM 0 HD2 PRO A 447 2.160 1.472 -12.145 1.00 0.09 H new ATOM 0 HD3 PRO A 447 2.784 1.106 -10.549 1.00 0.09 H new ATOM 1680 N SER A 448 -0.837 3.292 -12.259 1.00 0.08 N ATOM 1681 CA SER A 448 -2.039 3.510 -13.002 1.00 0.09 C ATOM 1682 C SER A 448 -3.247 3.201 -12.133 1.00 0.09 C ATOM 1683 O SER A 448 -4.229 3.939 -12.122 1.00 0.11 O ATOM 1684 CB SER A 448 -2.058 2.626 -14.238 1.00 0.11 C ATOM 1685 OG SER A 448 -0.889 2.812 -15.021 1.00 1.17 O ATOM 0 H SER A 448 -0.372 2.406 -12.457 1.00 0.08 H new ATOM 0 HA SER A 448 -2.076 4.554 -13.312 1.00 0.09 H new ATOM 0 HB2 SER A 448 -2.136 1.581 -13.939 1.00 0.11 H new ATOM 0 HB3 SER A 448 -2.940 2.853 -14.837 1.00 0.11 H new ATOM 0 HG SER A 448 -0.927 2.230 -15.809 1.00 1.17 H new ATOM 1691 N VAL A 449 -3.150 2.121 -11.381 1.00 0.08 N ATOM 1692 CA VAL A 449 -4.236 1.691 -10.521 1.00 0.09 C ATOM 1693 C VAL A 449 -4.296 2.512 -9.233 1.00 0.10 C ATOM 1694 O VAL A 449 -5.360 2.735 -8.662 1.00 0.11 O ATOM 1695 CB VAL A 449 -4.076 0.214 -10.171 1.00 0.11 C ATOM 1696 CG1 VAL A 449 -5.212 -0.228 -9.266 1.00 0.17 C ATOM 1697 CG2 VAL A 449 -4.024 -0.630 -11.432 1.00 0.10 C ATOM 0 H VAL A 449 -2.325 1.522 -11.349 1.00 0.08 H new ATOM 0 HA VAL A 449 -5.166 1.844 -11.068 1.00 0.09 H new ATOM 0 HB VAL A 449 -3.135 0.075 -9.638 1.00 0.11 H new ATOM 0 HG11 VAL A 449 -5.092 -1.283 -9.020 1.00 0.17 H new ATOM 0 HG12 VAL A 449 -5.198 0.362 -8.350 1.00 0.17 H new ATOM 0 HG13 VAL A 449 -6.163 -0.081 -9.778 1.00 0.17 H new ATOM 0 HG21 VAL A 449 -3.910 -1.680 -11.163 1.00 0.10 H new ATOM 0 HG22 VAL A 449 -4.947 -0.499 -11.996 1.00 0.10 H new ATOM 0 HG23 VAL A 449 -3.178 -0.318 -12.044 1.00 0.10 H new ATOM 1707 N MET A 450 -3.152 2.975 -8.781 1.00 0.10 N ATOM 1708 CA MET A 450 -3.056 3.754 -7.574 1.00 0.11 C ATOM 1709 C MET A 450 -3.737 5.101 -7.760 1.00 0.10 C ATOM 1710 O MET A 450 -4.080 5.784 -6.812 1.00 0.14 O ATOM 1711 CB MET A 450 -1.590 3.910 -7.272 1.00 0.13 C ATOM 1712 CG MET A 450 -1.333 4.600 -5.987 1.00 0.13 C ATOM 1713 SD MET A 450 -2.392 4.021 -4.673 1.00 0.46 S ATOM 1714 CE MET A 450 -2.429 5.513 -3.713 1.00 0.10 C ATOM 0 H MET A 450 -2.258 2.819 -9.246 1.00 0.10 H new ATOM 0 HA MET A 450 -3.560 3.263 -6.741 1.00 0.11 H new ATOM 0 HB2 MET A 450 -1.123 2.925 -7.249 1.00 0.13 H new ATOM 0 HB3 MET A 450 -1.116 4.469 -8.079 1.00 0.13 H new ATOM 0 HG2 MET A 450 -0.292 4.452 -5.701 1.00 0.13 H new ATOM 0 HG3 MET A 450 -1.478 5.672 -6.119 1.00 0.13 H new ATOM 0 HE1 MET A 450 -3.400 5.608 -3.226 1.00 0.10 H new ATOM 0 HE2 MET A 450 -1.645 5.478 -2.956 1.00 0.10 H new ATOM 0 HE3 MET A 450 -2.265 6.370 -4.366 1.00 0.10 H new ATOM 1724 N LYS A 451 -3.905 5.459 -9.016 1.00 0.11 N ATOM 1725 CA LYS A 451 -4.598 6.657 -9.432 1.00 0.11 C ATOM 1726 C LYS A 451 -6.086 6.464 -9.379 1.00 0.10 C ATOM 1727 O LYS A 451 -6.867 7.407 -9.329 1.00 0.14 O ATOM 1728 CB LYS A 451 -4.185 6.896 -10.850 1.00 0.14 C ATOM 1729 CG LYS A 451 -4.421 8.295 -11.309 1.00 0.22 C ATOM 1730 CD LYS A 451 -3.408 8.728 -12.326 1.00 0.68 C ATOM 1731 CE LYS A 451 -3.061 7.587 -13.221 1.00 0.63 C ATOM 1732 NZ LYS A 451 -2.830 8.004 -14.629 1.00 0.81 N1+ ATOM 0 H LYS A 451 -3.552 4.907 -9.798 1.00 0.11 H new ATOM 0 HA LYS A 451 -4.351 7.493 -8.777 1.00 0.11 H new ATOM 0 HB2 LYS A 451 -3.126 6.661 -10.957 1.00 0.14 H new ATOM 0 HB3 LYS A 451 -4.731 6.212 -11.500 1.00 0.14 H new ATOM 0 HG2 LYS A 451 -5.421 8.373 -11.736 1.00 0.22 H new ATOM 0 HG3 LYS A 451 -4.387 8.969 -10.453 1.00 0.22 H new ATOM 0 HD2 LYS A 451 -3.803 9.555 -12.915 1.00 0.68 H new ATOM 0 HD3 LYS A 451 -2.511 9.093 -11.825 1.00 0.68 H new ATOM 0 HE2 LYS A 451 -2.166 7.094 -12.842 1.00 0.63 H new ATOM 0 HE3 LYS A 451 -3.866 6.852 -13.193 1.00 0.63 H new ATOM 0 HZ1 LYS A 451 -2.593 7.170 -15.204 1.00 0.81 H new ATOM 0 HZ2 LYS A 451 -3.691 8.450 -15.005 1.00 0.81 H new ATOM 0 HZ3 LYS A 451 -2.044 8.684 -14.665 1.00 0.81 H new ATOM 1746 N GLU A 452 -6.443 5.208 -9.454 1.00 0.09 N ATOM 1747 CA GLU A 452 -7.801 4.765 -9.375 1.00 0.08 C ATOM 1748 C GLU A 452 -8.170 4.745 -7.950 1.00 0.07 C ATOM 1749 O GLU A 452 -9.223 5.198 -7.540 1.00 0.08 O ATOM 1750 CB GLU A 452 -7.878 3.362 -9.921 1.00 0.08 C ATOM 1751 CG GLU A 452 -7.275 3.223 -11.282 1.00 0.09 C ATOM 1752 CD GLU A 452 -8.213 3.651 -12.388 1.00 0.13 C ATOM 1753 OE1 GLU A 452 -8.233 4.855 -12.728 1.00 0.31 O1- ATOM 1754 OE2 GLU A 452 -8.949 2.790 -12.912 1.00 0.38 O ATOM 0 H GLU A 452 -5.774 4.448 -9.575 1.00 0.09 H new ATOM 0 HA GLU A 452 -8.466 5.417 -9.941 1.00 0.08 H new ATOM 0 HB2 GLU A 452 -7.370 2.684 -9.235 1.00 0.08 H new ATOM 0 HB3 GLU A 452 -8.922 3.052 -9.960 1.00 0.08 H new ATOM 0 HG2 GLU A 452 -6.365 3.820 -11.333 1.00 0.09 H new ATOM 0 HG3 GLU A 452 -6.984 2.185 -11.441 1.00 0.09 H new ATOM 1761 N LEU A 453 -7.259 4.165 -7.222 1.00 0.06 N ATOM 1762 CA LEU A 453 -7.321 4.095 -5.823 1.00 0.05 C ATOM 1763 C LEU A 453 -7.246 5.442 -5.185 1.00 0.05 C ATOM 1764 O LEU A 453 -8.176 5.863 -4.563 1.00 0.05 O ATOM 1765 CB LEU A 453 -6.163 3.330 -5.305 1.00 0.05 C ATOM 1766 CG LEU A 453 -6.277 2.969 -3.864 1.00 0.05 C ATOM 1767 CD1 LEU A 453 -7.461 2.064 -3.667 1.00 0.06 C ATOM 1768 CD2 LEU A 453 -5.004 2.328 -3.401 1.00 0.06 C ATOM 0 H LEU A 453 -6.432 3.718 -7.617 1.00 0.06 H new ATOM 0 HA LEU A 453 -8.273 3.621 -5.583 1.00 0.05 H new ATOM 0 HB2 LEU A 453 -6.051 2.418 -5.891 1.00 0.05 H new ATOM 0 HB3 LEU A 453 -5.256 3.917 -5.452 1.00 0.05 H new ATOM 0 HG LEU A 453 -6.434 3.865 -3.264 1.00 0.05 H new ATOM 0 HD11 LEU A 453 -7.545 1.799 -2.613 1.00 0.06 H new ATOM 0 HD12 LEU A 453 -8.368 2.577 -3.986 1.00 0.06 H new ATOM 0 HD13 LEU A 453 -7.329 1.158 -4.259 1.00 0.06 H new ATOM 0 HD21 LEU A 453 -5.091 2.065 -2.347 1.00 0.06 H new ATOM 0 HD22 LEU A 453 -4.817 1.427 -3.985 1.00 0.06 H new ATOM 0 HD23 LEU A 453 -4.176 3.025 -3.534 1.00 0.06 H new ATOM 1780 N PHE A 454 -6.117 6.115 -5.294 1.00 0.07 N ATOM 1781 CA PHE A 454 -6.016 7.448 -4.736 1.00 0.08 C ATOM 1782 C PHE A 454 -7.168 8.283 -5.276 1.00 0.09 C ATOM 1783 O PHE A 454 -7.621 9.264 -4.683 1.00 0.10 O ATOM 1784 CB PHE A 454 -4.694 8.124 -5.072 1.00 0.13 C ATOM 1785 CG PHE A 454 -4.373 9.240 -4.117 1.00 0.17 C ATOM 1786 CD1 PHE A 454 -3.720 8.978 -2.922 1.00 0.19 C ATOM 1787 CD2 PHE A 454 -4.745 10.543 -4.400 1.00 0.25 C ATOM 1788 CE1 PHE A 454 -3.441 9.997 -2.031 1.00 0.25 C ATOM 1789 CE2 PHE A 454 -4.472 11.564 -3.512 1.00 0.31 C ATOM 1790 CZ PHE A 454 -3.818 11.291 -2.327 1.00 0.29 C ATOM 0 H PHE A 454 -5.274 5.770 -5.753 1.00 0.07 H new ATOM 0 HA PHE A 454 -6.063 7.366 -3.650 1.00 0.08 H new ATOM 0 HB2 PHE A 454 -3.893 7.385 -5.049 1.00 0.13 H new ATOM 0 HB3 PHE A 454 -4.736 8.517 -6.088 1.00 0.13 H new ATOM 0 HD1 PHE A 454 -3.426 7.966 -2.685 1.00 0.19 H new ATOM 0 HD2 PHE A 454 -5.255 10.763 -5.326 1.00 0.25 H new ATOM 0 HE1 PHE A 454 -2.929 9.781 -1.105 1.00 0.25 H new ATOM 0 HE2 PHE A 454 -4.770 12.576 -3.744 1.00 0.31 H new ATOM 0 HZ PHE A 454 -3.602 12.089 -1.633 1.00 0.29 H new ATOM 1800 N GLY A 455 -7.626 7.828 -6.440 1.00 0.09 N ATOM 1801 CA GLY A 455 -8.718 8.440 -7.131 1.00 0.11 C ATOM 1802 C GLY A 455 -10.049 8.191 -6.431 1.00 0.10 C ATOM 1803 O GLY A 455 -10.995 8.957 -6.607 1.00 0.13 O ATOM 0 H GLY A 455 -7.235 7.017 -6.920 1.00 0.09 H new ATOM 0 HA2 GLY A 455 -8.543 9.513 -7.206 1.00 0.11 H new ATOM 0 HA3 GLY A 455 -8.766 8.053 -8.149 1.00 0.11 H new ATOM 1807 N MET A 456 -10.133 7.086 -5.676 1.00 0.08 N ATOM 1808 CA MET A 456 -11.257 6.837 -4.775 1.00 0.09 C ATOM 1809 C MET A 456 -10.938 7.298 -3.356 1.00 0.10 C ATOM 1810 O MET A 456 -11.704 8.025 -2.720 1.00 0.13 O ATOM 1811 CB MET A 456 -11.581 5.336 -4.733 1.00 0.08 C ATOM 1812 CG MET A 456 -10.428 4.430 -5.015 1.00 0.06 C ATOM 1813 SD MET A 456 -10.911 2.766 -5.470 1.00 0.06 S ATOM 1814 CE MET A 456 -11.552 3.075 -7.088 1.00 0.07 C ATOM 0 H MET A 456 -9.428 6.349 -5.675 1.00 0.08 H new ATOM 0 HA MET A 456 -12.111 7.399 -5.155 1.00 0.09 H new ATOM 0 HB2 MET A 456 -11.981 5.094 -3.748 1.00 0.08 H new ATOM 0 HB3 MET A 456 -12.370 5.130 -5.456 1.00 0.08 H new ATOM 0 HG2 MET A 456 -9.830 4.858 -5.820 1.00 0.06 H new ATOM 0 HG3 MET A 456 -9.789 4.385 -4.133 1.00 0.06 H new ATOM 0 HE1 MET A 456 -11.836 2.131 -7.553 1.00 0.07 H new ATOM 0 HE2 MET A 456 -12.427 3.721 -7.016 1.00 0.07 H new ATOM 0 HE3 MET A 456 -10.789 3.563 -7.694 1.00 0.07 H new ATOM 1824 N VAL A 457 -9.787 6.862 -2.893 1.00 0.08 N ATOM 1825 CA VAL A 457 -9.398 6.956 -1.503 1.00 0.10 C ATOM 1826 C VAL A 457 -8.323 7.961 -1.227 1.00 0.17 C ATOM 1827 O VAL A 457 -7.282 8.038 -1.875 1.00 0.23 O ATOM 1828 CB VAL A 457 -8.970 5.592 -0.970 1.00 0.06 C ATOM 1829 CG1 VAL A 457 -8.048 4.926 -1.956 1.00 0.06 C ATOM 1830 CG2 VAL A 457 -8.331 5.711 0.397 1.00 0.10 C ATOM 0 H VAL A 457 -9.081 6.423 -3.484 1.00 0.08 H new ATOM 0 HA VAL A 457 -10.288 7.307 -0.982 1.00 0.10 H new ATOM 0 HB VAL A 457 -9.856 4.969 -0.851 1.00 0.06 H new ATOM 0 HG11 VAL A 457 -7.745 3.952 -1.571 1.00 0.06 H new ATOM 0 HG12 VAL A 457 -8.565 4.795 -2.907 1.00 0.06 H new ATOM 0 HG13 VAL A 457 -7.165 5.547 -2.106 1.00 0.06 H new ATOM 0 HG21 VAL A 457 -8.037 4.722 0.749 1.00 0.10 H new ATOM 0 HG22 VAL A 457 -7.450 6.350 0.332 1.00 0.10 H new ATOM 0 HG23 VAL A 457 -9.045 6.147 1.096 1.00 0.10 H new ATOM 1840 N GLU A 458 -8.651 8.705 -0.223 1.00 0.18 N ATOM 1841 CA GLU A 458 -7.853 9.700 0.369 1.00 0.26 C ATOM 1842 C GLU A 458 -8.084 9.596 1.840 1.00 0.15 C ATOM 1843 O GLU A 458 -8.790 8.682 2.276 1.00 0.08 O ATOM 1844 CB GLU A 458 -8.249 11.040 -0.166 1.00 0.42 C ATOM 1845 CG GLU A 458 -9.729 11.241 -0.146 1.00 0.46 C ATOM 1846 CD GLU A 458 -10.133 12.600 -0.666 1.00 0.66 C ATOM 1847 OE1 GLU A 458 -10.096 13.573 0.113 1.00 0.83 O ATOM 1848 OE2 GLU A 458 -10.528 12.695 -1.846 1.00 0.82 O1- ATOM 0 H GLU A 458 -9.559 8.617 0.233 1.00 0.18 H new ATOM 0 HA GLU A 458 -6.793 9.573 0.147 1.00 0.26 H new ATOM 0 HB2 GLU A 458 -7.770 11.821 0.425 1.00 0.42 H new ATOM 0 HB3 GLU A 458 -7.884 11.144 -1.188 1.00 0.42 H new ATOM 0 HG2 GLU A 458 -10.206 10.468 -0.749 1.00 0.46 H new ATOM 0 HG3 GLU A 458 -10.095 11.122 0.874 1.00 0.46 H new ATOM 1855 N LYS A 459 -7.482 10.482 2.609 1.00 0.19 N ATOM 1856 CA LYS A 459 -7.634 10.436 4.022 1.00 0.13 C ATOM 1857 C LYS A 459 -9.040 10.231 4.477 1.00 0.14 C ATOM 1858 O LYS A 459 -10.016 10.608 3.828 1.00 0.21 O ATOM 1859 CB LYS A 459 -7.096 11.658 4.678 1.00 0.14 C ATOM 1860 CG LYS A 459 -5.630 11.661 4.759 1.00 0.15 C ATOM 1861 CD LYS A 459 -5.214 12.857 5.508 1.00 0.15 C ATOM 1862 CE LYS A 459 -5.153 14.038 4.609 1.00 0.20 C ATOM 1863 NZ LYS A 459 -4.512 15.217 5.249 1.00 0.24 N1+ ATOM 0 H LYS A 459 -6.887 11.236 2.265 1.00 0.19 H new ATOM 0 HA LYS A 459 -7.056 9.563 4.324 1.00 0.13 H new ATOM 0 HB2 LYS A 459 -7.427 12.537 4.125 1.00 0.14 H new ATOM 0 HB3 LYS A 459 -7.511 11.738 5.683 1.00 0.14 H new ATOM 0 HG2 LYS A 459 -5.275 10.758 5.256 1.00 0.15 H new ATOM 0 HG3 LYS A 459 -5.194 11.667 3.760 1.00 0.15 H new ATOM 0 HD2 LYS A 459 -5.915 13.047 6.321 1.00 0.15 H new ATOM 0 HD3 LYS A 459 -4.238 12.688 5.963 1.00 0.15 H new ATOM 0 HE2 LYS A 459 -4.600 13.774 3.707 1.00 0.20 H new ATOM 0 HE3 LYS A 459 -6.163 14.304 4.297 1.00 0.20 H new ATOM 0 HZ1 LYS A 459 -4.496 16.011 4.577 1.00 0.24 H new ATOM 0 HZ2 LYS A 459 -5.052 15.490 6.095 1.00 0.24 H new ATOM 0 HZ3 LYS A 459 -3.538 14.976 5.523 1.00 0.24 H new ATOM 1877 N GLY A 460 -9.096 9.675 5.647 1.00 0.13 N ATOM 1878 CA GLY A 460 -10.353 9.351 6.255 1.00 0.19 C ATOM 1879 C GLY A 460 -10.727 7.899 6.073 1.00 0.19 C ATOM 1880 O GLY A 460 -11.351 7.289 6.944 1.00 0.37 O ATOM 0 H GLY A 460 -8.278 9.433 6.207 1.00 0.13 H new ATOM 0 HA2 GLY A 460 -10.308 9.580 7.320 1.00 0.19 H new ATOM 0 HA3 GLY A 460 -11.133 9.980 5.826 1.00 0.19 H new ATOM 1884 N THR A 461 -10.321 7.346 4.942 1.00 0.12 N ATOM 1885 CA THR A 461 -10.624 5.987 4.585 1.00 0.10 C ATOM 1886 C THR A 461 -9.618 5.062 5.237 1.00 0.09 C ATOM 1887 O THR A 461 -8.446 5.408 5.379 1.00 0.12 O ATOM 1888 CB THR A 461 -10.567 5.849 3.051 1.00 0.11 C ATOM 1889 OG1 THR A 461 -11.727 6.454 2.465 1.00 0.15 O ATOM 1890 CG2 THR A 461 -10.437 4.397 2.583 1.00 0.08 C ATOM 0 H THR A 461 -9.766 7.841 4.244 1.00 0.12 H new ATOM 0 HA THR A 461 -11.622 5.719 4.931 1.00 0.10 H new ATOM 0 HB THR A 461 -9.667 6.366 2.719 1.00 0.11 H new ATOM 0 HG1 THR A 461 -11.685 6.365 1.490 1.00 0.15 H new ATOM 0 HG21 THR A 461 -10.402 4.367 1.494 1.00 0.08 H new ATOM 0 HG22 THR A 461 -9.522 3.965 2.987 1.00 0.08 H new ATOM 0 HG23 THR A 461 -11.295 3.823 2.934 1.00 0.08 H new ATOM 1898 N PRO A 462 -10.054 3.892 5.678 1.00 0.08 N ATOM 1899 CA PRO A 462 -9.163 2.904 6.196 1.00 0.10 C ATOM 1900 C PRO A 462 -8.406 2.221 5.102 1.00 0.09 C ATOM 1901 O PRO A 462 -8.716 2.354 3.925 1.00 0.10 O ATOM 1902 CB PRO A 462 -10.056 1.879 6.875 1.00 0.12 C ATOM 1903 CG PRO A 462 -11.418 2.409 6.782 1.00 0.09 C ATOM 1904 CD PRO A 462 -11.427 3.428 5.703 1.00 0.07 C ATOM 0 HA PRO A 462 -8.433 3.358 6.866 1.00 0.10 H new ATOM 0 HB2 PRO A 462 -9.980 0.909 6.384 1.00 0.12 H new ATOM 0 HB3 PRO A 462 -9.763 1.734 7.915 1.00 0.12 H new ATOM 0 HG2 PRO A 462 -12.126 1.610 6.561 1.00 0.09 H new ATOM 0 HG3 PRO A 462 -11.723 2.852 7.730 1.00 0.09 H new ATOM 0 HD2 PRO A 462 -11.725 2.999 4.746 1.00 0.07 H new ATOM 0 HD3 PRO A 462 -12.123 4.239 5.920 1.00 0.07 H new ATOM 1912 N VAL A 463 -7.442 1.469 5.501 1.00 0.09 N ATOM 1913 CA VAL A 463 -6.802 0.545 4.611 1.00 0.14 C ATOM 1914 C VAL A 463 -6.598 -0.746 5.354 1.00 0.12 C ATOM 1915 O VAL A 463 -6.655 -0.791 6.579 1.00 0.22 O ATOM 1916 CB VAL A 463 -5.464 1.042 4.009 1.00 0.27 C ATOM 1917 CG1 VAL A 463 -5.467 2.539 3.799 1.00 1.07 C ATOM 1918 CG2 VAL A 463 -4.282 0.626 4.823 1.00 1.09 C ATOM 0 H VAL A 463 -7.070 1.471 6.451 1.00 0.09 H new ATOM 0 HA VAL A 463 -7.458 0.419 3.750 1.00 0.14 H new ATOM 0 HB VAL A 463 -5.372 0.562 3.035 1.00 0.27 H new ATOM 0 HG11 VAL A 463 -4.512 2.849 3.376 1.00 1.07 H new ATOM 0 HG12 VAL A 463 -6.272 2.809 3.115 1.00 1.07 H new ATOM 0 HG13 VAL A 463 -5.620 3.040 4.755 1.00 1.07 H new ATOM 0 HG21 VAL A 463 -3.370 1.000 4.358 1.00 1.09 H new ATOM 0 HG22 VAL A 463 -4.370 1.036 5.829 1.00 1.09 H new ATOM 0 HG23 VAL A 463 -4.242 -0.462 4.877 1.00 1.09 H new ATOM 1928 N LEU A 464 -6.447 -1.793 4.617 1.00 0.07 N ATOM 1929 CA LEU A 464 -6.260 -3.087 5.186 1.00 0.06 C ATOM 1930 C LEU A 464 -5.095 -3.761 4.562 1.00 0.06 C ATOM 1931 O LEU A 464 -4.786 -3.525 3.411 1.00 0.06 O ATOM 1932 CB LEU A 464 -7.481 -3.893 4.888 1.00 0.06 C ATOM 1933 CG LEU A 464 -8.100 -4.600 6.060 1.00 0.08 C ATOM 1934 CD1 LEU A 464 -8.437 -3.592 7.143 1.00 0.12 C ATOM 1935 CD2 LEU A 464 -9.322 -5.331 5.577 1.00 0.13 C ATOM 0 H LEU A 464 -6.450 -1.777 3.597 1.00 0.07 H new ATOM 0 HA LEU A 464 -6.088 -2.996 6.258 1.00 0.06 H new ATOM 0 HB2 LEU A 464 -8.230 -3.234 4.448 1.00 0.06 H new ATOM 0 HB3 LEU A 464 -7.227 -4.636 4.132 1.00 0.06 H new ATOM 0 HG LEU A 464 -7.407 -5.322 6.492 1.00 0.08 H new ATOM 0 HD11 LEU A 464 -8.886 -4.107 7.992 1.00 0.12 H new ATOM 0 HD12 LEU A 464 -7.527 -3.086 7.465 1.00 0.12 H new ATOM 0 HD13 LEU A 464 -9.141 -2.858 6.751 1.00 0.12 H new ATOM 0 HD21 LEU A 464 -9.788 -5.852 6.413 1.00 0.13 H new ATOM 0 HD22 LEU A 464 -10.029 -4.618 5.154 1.00 0.13 H new ATOM 0 HD23 LEU A 464 -9.035 -6.054 4.813 1.00 0.13 H new ATOM 1947 N VAL A 465 -4.423 -4.534 5.363 1.00 0.06 N ATOM 1948 CA VAL A 465 -3.473 -5.491 4.893 1.00 0.06 C ATOM 1949 C VAL A 465 -3.570 -6.711 5.793 1.00 0.08 C ATOM 1950 O VAL A 465 -3.895 -6.568 6.973 1.00 0.09 O ATOM 1951 CB VAL A 465 -2.029 -4.947 4.841 1.00 0.06 C ATOM 1952 CG1 VAL A 465 -1.964 -3.465 4.474 1.00 0.07 C ATOM 1953 CG2 VAL A 465 -1.295 -5.208 6.101 1.00 0.07 C ATOM 0 H VAL A 465 -4.523 -4.515 6.378 1.00 0.06 H new ATOM 0 HA VAL A 465 -3.713 -5.746 3.861 1.00 0.06 H new ATOM 0 HB VAL A 465 -1.535 -5.496 4.040 1.00 0.06 H new ATOM 0 HG11 VAL A 465 -0.924 -3.141 4.453 1.00 0.07 H new ATOM 0 HG12 VAL A 465 -2.411 -3.314 3.491 1.00 0.07 H new ATOM 0 HG13 VAL A 465 -2.511 -2.882 5.215 1.00 0.07 H new ATOM 0 HG21 VAL A 465 -0.284 -4.809 6.022 1.00 0.07 H new ATOM 0 HG22 VAL A 465 -1.812 -4.725 6.930 1.00 0.07 H new ATOM 0 HG23 VAL A 465 -1.249 -6.282 6.279 1.00 0.07 H new ATOM 1963 N PHE A 466 -3.332 -7.892 5.240 1.00 0.11 N ATOM 1964 CA PHE A 466 -3.469 -9.132 5.994 1.00 0.14 C ATOM 1965 C PHE A 466 -2.878 -10.318 5.230 1.00 0.19 C ATOM 1966 O PHE A 466 -2.867 -10.277 3.982 1.00 1.16 O ATOM 1967 CB PHE A 466 -4.939 -9.375 6.325 1.00 0.13 C ATOM 1968 CG PHE A 466 -5.849 -9.318 5.132 1.00 0.12 C ATOM 1969 CD1 PHE A 466 -5.875 -10.364 4.237 1.00 0.14 C ATOM 1970 CD2 PHE A 466 -6.674 -8.227 4.907 1.00 0.14 C ATOM 1971 CE1 PHE A 466 -6.708 -10.330 3.147 1.00 0.18 C ATOM 1972 CE2 PHE A 466 -7.512 -8.191 3.812 1.00 0.17 C ATOM 1973 CZ PHE A 466 -7.527 -9.178 2.934 1.00 0.19 C ATOM 1974 OXT PHE A 466 -2.392 -11.268 5.881 1.00 1.08 O ATOM 0 H PHE A 466 -3.043 -8.019 4.270 1.00 0.11 H new ATOM 0 HA PHE A 466 -2.908 -9.034 6.923 1.00 0.14 H new ATOM 0 HB2 PHE A 466 -5.038 -10.352 6.799 1.00 0.13 H new ATOM 0 HB3 PHE A 466 -5.265 -8.633 7.054 1.00 0.13 H new ATOM 0 HD1 PHE A 466 -5.234 -11.219 4.394 1.00 0.14 H new ATOM 0 HD2 PHE A 466 -6.660 -7.396 5.597 1.00 0.14 H new ATOM 0 HE1 PHE A 466 -6.744 -11.162 2.460 1.00 0.18 H new ATOM 0 HE2 PHE A 466 -8.166 -7.343 3.670 1.00 0.17 H new ATOM 0 HZ PHE A 466 -8.156 -9.115 2.058 1.00 0.19 H new