USER MOD reduce.3.24.130724 H: found=0, std=0, add=684, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 686 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 375 GLN : amide:sc= -13.6! C(o=-22!,f=-12!) USER MOD Set 1.2: A 394 GLN : amide:sc= -8.37! C(o=-22!,f=-12!) USER MOD Set 2.1: A 347 HIS : no HD1:sc= -1.04 K(o=-2.2,f=-0.26) USER MOD Set 2.2: A 391 GLN : amide:sc= -1.17 K(o=-2.2,f=-0.26) USER MOD Set 3.1: A 311 LYS NZ :NH3+ -162:sc= 0.621 (180deg=0) USER MOD Set 3.2: A 335 THR OG1 : rot 180:sc= 0.376 USER MOD Set 4.1: A 321 SER OG : rot 113:sc= 1.98 USER MOD Set 4.2: A 323 HIS : no HD1:sc= 0.88 K(o=3.5,f=1.5) USER MOD Set 4.3: A 325 THR OG1 : rot 48:sc= 0.643 USER MOD Single : A 303 THR OG1 : rot 180:sc= 0 USER MOD Single : A 304 TYR OH : rot 180:sc= 0 USER MOD Single : A 305 THR OG1 : rot 180:sc=-0.00807 USER MOD Single : A 309 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 310 THR OG1 : rot -38:sc= 0.203 USER MOD Single : A 313 THR OG1 : rot -50:sc= 0.834 USER MOD Single : A 315 LYS NZ :NH3+ 172:sc= 1.21 (180deg=0.946) USER MOD Single : A 319 THR OG1 : rot 71:sc= 0.838 USER MOD Single : A 328 MET CE :methyl -127:sc= -2.11 (180deg=-2.57!) USER MOD Single : A 333 SER OG : rot 180:sc= 0 USER MOD Single : A 353 ASN : amide:sc= 0.65 K(o=0.65,f=-6.7!) USER MOD Single : A 356 MET CE :methyl -156:sc= -0.271 (180deg=-1.1) USER MOD Single : A 359 THR OG1 : rot 116:sc= 1.16 USER MOD Single : A 361 ASN : amide:sc=-0.00283 X(o=-0.0028,f=-0.0028) USER MOD Single : A 363 THR OG1 : rot 180:sc=-0.000573 USER MOD Single : A 364 MET CE :methyl -135:sc= -7.51! (180deg=-8.58!) USER MOD Single : A 374 MET CE :methyl 140:sc= -0.923 (180deg=-5.63!) USER MOD Single : A 381 ASN : amide:sc= -1.69 K(o=-1.7,f=-2.5!) USER MOD Single : A 384 TYR OH : rot 180:sc= 0 USER MOD Single : A 389 ASN : amide:sc= -0.139 K(o=-0.14,f=-2.6!) USER MOD Single : A 390 HIS : no HD1:sc= -0.947 K(o=-0.95,f=-0.3) USER MOD Single : A 395 LYS NZ :NH3+ -167:sc= -0.0427 (180deg=-0.233) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 303 17.857 -5.293 -1.985 1.00 0.00 N ATOM 2 CA THR A 303 17.112 -5.911 -3.058 1.00 0.00 C ATOM 3 C THR A 303 15.993 -4.985 -3.542 1.00 0.00 C ATOM 4 O THR A 303 14.847 -5.074 -3.100 1.00 0.00 O ATOM 5 CB THR A 303 16.542 -7.284 -2.624 1.00 0.00 C ATOM 6 OG1 THR A 303 15.709 -7.831 -3.653 1.00 0.00 O ATOM 7 CG2 THR A 303 15.755 -7.173 -1.326 1.00 0.00 C ATOM 0 HA THR A 303 17.797 -6.082 -3.888 1.00 0.00 H new ATOM 0 HB THR A 303 17.387 -7.952 -2.455 1.00 0.00 H new ATOM 0 HG1 THR A 303 15.358 -8.699 -3.363 1.00 0.00 H new ATOM 0 HG21 THR A 303 15.369 -8.154 -1.050 1.00 0.00 H new ATOM 0 HG22 THR A 303 16.408 -6.804 -0.535 1.00 0.00 H new ATOM 0 HG23 THR A 303 14.924 -6.481 -1.462 1.00 0.00 H new ATOM 15 N TYR A 304 16.333 -4.048 -4.417 1.00 0.00 N ATOM 16 CA TYR A 304 15.302 -3.254 -5.063 1.00 0.00 C ATOM 17 C TYR A 304 14.612 -4.115 -6.111 1.00 0.00 C ATOM 18 O TYR A 304 15.268 -4.734 -6.952 1.00 0.00 O ATOM 19 CB TYR A 304 15.858 -1.961 -5.682 1.00 0.00 C ATOM 20 CG TYR A 304 16.400 -2.093 -7.095 1.00 0.00 C ATOM 21 CD1 TYR A 304 17.703 -2.508 -7.336 1.00 0.00 C ATOM 22 CD2 TYR A 304 15.597 -1.787 -8.190 1.00 0.00 C ATOM 23 CE1 TYR A 304 18.189 -2.618 -8.627 1.00 0.00 C ATOM 24 CE2 TYR A 304 16.077 -1.892 -9.481 1.00 0.00 C ATOM 25 CZ TYR A 304 17.371 -2.308 -9.696 1.00 0.00 C ATOM 26 OH TYR A 304 17.856 -2.409 -10.986 1.00 0.00 O ATOM 0 H TYR A 304 17.290 -3.824 -4.690 1.00 0.00 H new ATOM 0 HA TYR A 304 14.581 -2.937 -4.309 1.00 0.00 H new ATOM 0 HB2 TYR A 304 15.068 -1.210 -5.683 1.00 0.00 H new ATOM 0 HB3 TYR A 304 16.654 -1.584 -5.040 1.00 0.00 H new ATOM 0 HD1 TYR A 304 18.347 -2.749 -6.503 1.00 0.00 H new ATOM 0 HD2 TYR A 304 14.580 -1.462 -8.027 1.00 0.00 H new ATOM 0 HE1 TYR A 304 19.204 -2.945 -8.798 1.00 0.00 H new ATOM 0 HE2 TYR A 304 15.439 -1.649 -10.318 1.00 0.00 H new ATOM 0 HH TYR A 304 17.153 -2.156 -11.620 1.00 0.00 H new ATOM 36 N THR A 305 13.296 -4.176 -6.033 1.00 0.00 N ATOM 37 CA THR A 305 12.513 -5.058 -6.877 1.00 0.00 C ATOM 38 C THR A 305 11.070 -5.018 -6.418 1.00 0.00 C ATOM 39 O THR A 305 10.706 -4.163 -5.608 1.00 0.00 O ATOM 40 CB THR A 305 13.054 -6.516 -6.811 1.00 0.00 C ATOM 41 OG1 THR A 305 12.466 -7.328 -7.838 1.00 0.00 O ATOM 42 CG2 THR A 305 12.788 -7.149 -5.447 1.00 0.00 C ATOM 0 H THR A 305 12.741 -3.617 -5.385 1.00 0.00 H new ATOM 0 HA THR A 305 12.586 -4.721 -7.911 1.00 0.00 H new ATOM 0 HB THR A 305 14.132 -6.466 -6.967 1.00 0.00 H new ATOM 0 HG1 THR A 305 12.822 -8.239 -7.778 1.00 0.00 H new ATOM 0 HG21 THR A 305 13.179 -8.167 -5.436 1.00 0.00 H new ATOM 0 HG22 THR A 305 13.281 -6.563 -4.671 1.00 0.00 H new ATOM 0 HG23 THR A 305 11.715 -7.170 -5.259 1.00 0.00 H new ATOM 50 N VAL A 306 10.248 -5.910 -6.933 1.00 0.00 N ATOM 51 CA VAL A 306 8.928 -6.087 -6.380 1.00 0.00 C ATOM 52 C VAL A 306 9.098 -6.656 -4.983 1.00 0.00 C ATOM 53 O VAL A 306 9.569 -7.781 -4.814 1.00 0.00 O ATOM 54 CB VAL A 306 8.053 -7.028 -7.232 1.00 0.00 C ATOM 55 CG1 VAL A 306 6.631 -7.078 -6.690 1.00 0.00 C ATOM 56 CG2 VAL A 306 8.060 -6.585 -8.685 1.00 0.00 C ATOM 0 H VAL A 306 10.470 -6.515 -7.724 1.00 0.00 H new ATOM 0 HA VAL A 306 8.415 -5.125 -6.362 1.00 0.00 H new ATOM 0 HB VAL A 306 8.471 -8.033 -7.177 1.00 0.00 H new ATOM 0 HG11 VAL A 306 6.030 -7.748 -7.306 1.00 0.00 H new ATOM 0 HG12 VAL A 306 6.646 -7.444 -5.663 1.00 0.00 H new ATOM 0 HG13 VAL A 306 6.198 -6.078 -6.712 1.00 0.00 H new ATOM 0 HG21 VAL A 306 7.438 -7.259 -9.274 1.00 0.00 H new ATOM 0 HG22 VAL A 306 7.667 -5.571 -8.758 1.00 0.00 H new ATOM 0 HG23 VAL A 306 9.081 -6.606 -9.067 1.00 0.00 H new ATOM 66 N CYS A 307 8.743 -5.870 -3.990 1.00 0.00 N ATOM 67 CA CYS A 307 9.014 -6.224 -2.607 1.00 0.00 C ATOM 68 C CYS A 307 8.181 -7.425 -2.194 1.00 0.00 C ATOM 69 O CYS A 307 7.028 -7.569 -2.607 1.00 0.00 O ATOM 70 CB CYS A 307 8.721 -5.028 -1.703 1.00 0.00 C ATOM 71 SG CYS A 307 7.751 -3.713 -2.526 1.00 0.00 S ATOM 0 H CYS A 307 8.264 -4.978 -4.112 1.00 0.00 H new ATOM 0 HA CYS A 307 10.066 -6.492 -2.507 1.00 0.00 H new ATOM 0 HB2 CYS A 307 8.178 -5.372 -0.823 1.00 0.00 H new ATOM 0 HB3 CYS A 307 9.664 -4.608 -1.352 1.00 0.00 H new ATOM 76 N ASP A 308 8.795 -8.307 -1.412 1.00 0.00 N ATOM 77 CA ASP A 308 8.150 -9.545 -0.996 1.00 0.00 C ATOM 78 C ASP A 308 6.879 -9.237 -0.233 1.00 0.00 C ATOM 79 O ASP A 308 6.891 -8.482 0.740 1.00 0.00 O ATOM 80 CB ASP A 308 9.089 -10.393 -0.136 1.00 0.00 C ATOM 81 CG ASP A 308 8.621 -11.834 -0.013 1.00 0.00 C ATOM 82 OD1 ASP A 308 7.445 -12.060 0.342 1.00 0.00 O ATOM 83 OD2 ASP A 308 9.424 -12.750 -0.301 1.00 0.00 O ATOM 0 H ASP A 308 9.742 -8.186 -1.053 1.00 0.00 H new ATOM 0 HA ASP A 308 7.901 -10.117 -1.890 1.00 0.00 H new ATOM 0 HB2 ASP A 308 10.089 -10.375 -0.569 1.00 0.00 H new ATOM 0 HB3 ASP A 308 9.164 -9.952 0.858 1.00 0.00 H new ATOM 88 N LYS A 309 5.796 -9.814 -0.731 1.00 0.00 N ATOM 89 CA LYS A 309 4.450 -9.642 -0.209 1.00 0.00 C ATOM 90 C LYS A 309 4.361 -9.630 1.313 1.00 0.00 C ATOM 91 O LYS A 309 3.465 -8.995 1.863 1.00 0.00 O ATOM 92 CB LYS A 309 3.574 -10.775 -0.734 1.00 0.00 C ATOM 93 CG LYS A 309 4.124 -12.145 -0.386 1.00 0.00 C ATOM 94 CD LYS A 309 3.154 -13.259 -0.740 1.00 0.00 C ATOM 95 CE LYS A 309 3.675 -14.604 -0.262 1.00 0.00 C ATOM 96 NZ LYS A 309 2.659 -15.679 -0.417 1.00 0.00 N ATOM 0 H LYS A 309 5.832 -10.437 -1.538 1.00 0.00 H new ATOM 0 HA LYS A 309 4.113 -8.662 -0.548 1.00 0.00 H new ATOM 0 HB2 LYS A 309 2.570 -10.675 -0.321 1.00 0.00 H new ATOM 0 HB3 LYS A 309 3.484 -10.688 -1.817 1.00 0.00 H new ATOM 0 HG2 LYS A 309 5.064 -12.302 -0.915 1.00 0.00 H new ATOM 0 HG3 LYS A 309 4.347 -12.185 0.680 1.00 0.00 H new ATOM 0 HD2 LYS A 309 2.183 -13.059 -0.287 1.00 0.00 H new ATOM 0 HD3 LYS A 309 3.003 -13.286 -1.819 1.00 0.00 H new ATOM 0 HE2 LYS A 309 4.571 -14.867 -0.825 1.00 0.00 H new ATOM 0 HE3 LYS A 309 3.967 -14.529 0.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 309 3.053 -16.580 -0.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 309 1.814 -15.441 0.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 309 2.399 -15.769 -1.420 1.00 0.00 H new ATOM 110 N THR A 310 5.253 -10.329 2.001 1.00 0.00 N ATOM 111 CA THR A 310 5.106 -10.527 3.427 1.00 0.00 C ATOM 112 C THR A 310 6.123 -9.683 4.211 1.00 0.00 C ATOM 113 O THR A 310 6.164 -9.709 5.443 1.00 0.00 O ATOM 114 CB THR A 310 5.295 -12.025 3.729 1.00 0.00 C ATOM 115 OG1 THR A 310 4.894 -12.334 5.069 1.00 0.00 O ATOM 116 CG2 THR A 310 6.743 -12.443 3.509 1.00 0.00 C ATOM 0 H THR A 310 6.080 -10.764 1.593 1.00 0.00 H new ATOM 0 HA THR A 310 4.113 -10.205 3.740 1.00 0.00 H new ATOM 0 HB THR A 310 4.661 -12.584 3.041 1.00 0.00 H new ATOM 0 HG1 THR A 310 5.159 -11.604 5.666 1.00 0.00 H new ATOM 0 HG21 THR A 310 6.852 -13.505 3.728 1.00 0.00 H new ATOM 0 HG22 THR A 310 7.022 -12.256 2.472 1.00 0.00 H new ATOM 0 HG23 THR A 310 7.392 -11.867 4.169 1.00 0.00 H new ATOM 124 N LYS A 311 6.924 -8.913 3.485 1.00 0.00 N ATOM 125 CA LYS A 311 7.941 -8.059 4.096 1.00 0.00 C ATOM 126 C LYS A 311 7.362 -6.690 4.391 1.00 0.00 C ATOM 127 O LYS A 311 8.003 -5.658 4.175 1.00 0.00 O ATOM 128 CB LYS A 311 9.158 -7.934 3.185 1.00 0.00 C ATOM 129 CG LYS A 311 9.975 -9.211 3.121 1.00 0.00 C ATOM 130 CD LYS A 311 11.295 -9.000 2.407 1.00 0.00 C ATOM 131 CE LYS A 311 12.170 -7.978 3.124 1.00 0.00 C ATOM 132 NZ LYS A 311 13.501 -7.852 2.468 1.00 0.00 N ATOM 0 H LYS A 311 6.890 -8.861 2.467 1.00 0.00 H new ATOM 0 HA LYS A 311 8.260 -8.517 5.032 1.00 0.00 H new ATOM 0 HB2 LYS A 311 8.829 -7.667 2.181 1.00 0.00 H new ATOM 0 HB3 LYS A 311 9.790 -7.120 3.540 1.00 0.00 H new ATOM 0 HG2 LYS A 311 10.162 -9.573 4.132 1.00 0.00 H new ATOM 0 HG3 LYS A 311 9.403 -9.983 2.606 1.00 0.00 H new ATOM 0 HD2 LYS A 311 11.827 -9.949 2.338 1.00 0.00 H new ATOM 0 HD3 LYS A 311 11.107 -8.665 1.387 1.00 0.00 H new ATOM 0 HE2 LYS A 311 11.671 -7.009 3.129 1.00 0.00 H new ATOM 0 HE3 LYS A 311 12.301 -8.275 4.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 311 14.170 -7.402 3.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 311 13.852 -8.796 2.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 311 13.412 -7.270 1.611 1.00 0.00 H new ATOM 146 N PHE A 312 6.162 -6.707 4.926 1.00 0.00 N ATOM 147 CA PHE A 312 5.352 -5.521 5.053 1.00 0.00 C ATOM 148 C PHE A 312 4.612 -5.517 6.382 1.00 0.00 C ATOM 149 O PHE A 312 4.401 -6.569 6.987 1.00 0.00 O ATOM 150 CB PHE A 312 4.355 -5.520 3.907 1.00 0.00 C ATOM 151 CG PHE A 312 4.580 -4.465 2.883 1.00 0.00 C ATOM 152 CD1 PHE A 312 4.399 -3.134 3.193 1.00 0.00 C ATOM 153 CD2 PHE A 312 4.956 -4.815 1.597 1.00 0.00 C ATOM 154 CE1 PHE A 312 4.591 -2.165 2.230 1.00 0.00 C ATOM 155 CE2 PHE A 312 5.149 -3.851 0.633 1.00 0.00 C ATOM 156 CZ PHE A 312 4.964 -2.522 0.949 1.00 0.00 C ATOM 0 H PHE A 312 5.719 -7.552 5.287 1.00 0.00 H new ATOM 0 HA PHE A 312 5.982 -4.632 5.019 1.00 0.00 H new ATOM 0 HB2 PHE A 312 4.385 -6.493 3.418 1.00 0.00 H new ATOM 0 HB3 PHE A 312 3.352 -5.400 4.317 1.00 0.00 H new ATOM 0 HD1 PHE A 312 4.106 -2.849 4.193 1.00 0.00 H new ATOM 0 HD2 PHE A 312 5.099 -5.856 1.347 1.00 0.00 H new ATOM 0 HE1 PHE A 312 4.449 -1.124 2.479 1.00 0.00 H new ATOM 0 HE2 PHE A 312 5.444 -4.135 -0.366 1.00 0.00 H new ATOM 0 HZ PHE A 312 5.110 -1.761 0.196 1.00 0.00 H new ATOM 166 N THR A 313 4.227 -4.333 6.829 1.00 0.00 N ATOM 167 CA THR A 313 3.423 -4.184 8.029 1.00 0.00 C ATOM 168 C THR A 313 2.450 -3.021 7.863 1.00 0.00 C ATOM 169 O THR A 313 2.721 -2.079 7.113 1.00 0.00 O ATOM 170 CB THR A 313 4.297 -3.931 9.278 1.00 0.00 C ATOM 171 OG1 THR A 313 5.290 -2.937 8.995 1.00 0.00 O ATOM 172 CG2 THR A 313 4.966 -5.197 9.764 1.00 0.00 C ATOM 0 H THR A 313 4.462 -3.452 6.372 1.00 0.00 H new ATOM 0 HA THR A 313 2.878 -5.117 8.173 1.00 0.00 H new ATOM 0 HB THR A 313 3.638 -3.575 10.070 1.00 0.00 H new ATOM 0 HG1 THR A 313 5.758 -3.169 8.166 1.00 0.00 H new ATOM 0 HG21 THR A 313 5.571 -4.975 10.643 1.00 0.00 H new ATOM 0 HG22 THR A 313 4.206 -5.934 10.023 1.00 0.00 H new ATOM 0 HG23 THR A 313 5.605 -5.597 8.976 1.00 0.00 H new ATOM 180 N TRP A 314 1.324 -3.086 8.564 1.00 0.00 N ATOM 181 CA TRP A 314 0.319 -2.030 8.508 1.00 0.00 C ATOM 182 C TRP A 314 0.727 -0.870 9.396 1.00 0.00 C ATOM 183 O TRP A 314 0.486 -0.881 10.603 1.00 0.00 O ATOM 184 CB TRP A 314 -1.046 -2.546 8.978 1.00 0.00 C ATOM 185 CG TRP A 314 -1.565 -3.721 8.211 1.00 0.00 C ATOM 186 CD1 TRP A 314 -2.317 -3.688 7.075 1.00 0.00 C ATOM 187 CD2 TRP A 314 -1.385 -5.104 8.537 1.00 0.00 C ATOM 188 NE1 TRP A 314 -2.610 -4.966 6.671 1.00 0.00 N ATOM 189 CE2 TRP A 314 -2.051 -5.854 7.552 1.00 0.00 C ATOM 190 CE3 TRP A 314 -0.722 -5.780 9.565 1.00 0.00 C ATOM 191 CZ2 TRP A 314 -2.075 -7.247 7.565 1.00 0.00 C ATOM 192 CZ3 TRP A 314 -0.746 -7.162 9.578 1.00 0.00 C ATOM 193 CH2 TRP A 314 -1.418 -7.883 8.584 1.00 0.00 C ATOM 0 H TRP A 314 1.083 -3.862 9.180 1.00 0.00 H new ATOM 0 HA TRP A 314 0.244 -1.701 7.472 1.00 0.00 H new ATOM 0 HB2 TRP A 314 -0.974 -2.819 10.031 1.00 0.00 H new ATOM 0 HB3 TRP A 314 -1.770 -1.734 8.908 1.00 0.00 H new ATOM 0 HD1 TRP A 314 -2.635 -2.789 6.568 1.00 0.00 H new ATOM 0 HE1 TRP A 314 -3.157 -5.215 5.847 1.00 0.00 H new ATOM 0 HE3 TRP A 314 -0.200 -5.232 10.336 1.00 0.00 H new ATOM 0 HZ2 TRP A 314 -2.593 -7.805 6.799 1.00 0.00 H new ATOM 0 HZ3 TRP A 314 -0.238 -7.694 10.368 1.00 0.00 H new ATOM 0 HH2 TRP A 314 -1.418 -8.962 8.622 1.00 0.00 H new ATOM 204 N LYS A 315 1.374 0.106 8.793 1.00 0.00 N ATOM 205 CA LYS A 315 1.702 1.338 9.482 1.00 0.00 C ATOM 206 C LYS A 315 0.436 2.164 9.717 1.00 0.00 C ATOM 207 O LYS A 315 0.244 2.737 10.790 1.00 0.00 O ATOM 208 CB LYS A 315 2.729 2.114 8.663 1.00 0.00 C ATOM 209 CG LYS A 315 3.485 3.143 9.453 1.00 0.00 C ATOM 210 CD LYS A 315 4.946 3.185 9.026 1.00 0.00 C ATOM 211 CE LYS A 315 5.737 4.230 9.791 1.00 0.00 C ATOM 212 NZ LYS A 315 5.434 5.611 9.332 1.00 0.00 N ATOM 0 H LYS A 315 1.685 0.070 7.822 1.00 0.00 H new ATOM 0 HA LYS A 315 2.134 1.113 10.457 1.00 0.00 H new ATOM 0 HB2 LYS A 315 3.439 1.411 8.228 1.00 0.00 H new ATOM 0 HB3 LYS A 315 2.221 2.607 7.835 1.00 0.00 H new ATOM 0 HG2 LYS A 315 3.031 4.124 9.310 1.00 0.00 H new ATOM 0 HG3 LYS A 315 3.418 2.913 10.516 1.00 0.00 H new ATOM 0 HD2 LYS A 315 5.397 2.205 9.182 1.00 0.00 H new ATOM 0 HD3 LYS A 315 5.005 3.397 7.958 1.00 0.00 H new ATOM 0 HE2 LYS A 315 5.514 4.145 10.855 1.00 0.00 H new ATOM 0 HE3 LYS A 315 6.803 4.035 9.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 315 5.890 6.296 9.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 315 5.794 5.742 8.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 315 4.405 5.762 9.341 1.00 0.00 H new ATOM 226 N ARG A 316 -0.419 2.227 8.701 1.00 0.00 N ATOM 227 CA ARG A 316 -1.728 2.846 8.821 1.00 0.00 C ATOM 228 C ARG A 316 -2.685 2.257 7.784 1.00 0.00 C ATOM 229 O ARG A 316 -2.626 2.619 6.610 1.00 0.00 O ATOM 230 CB ARG A 316 -1.615 4.355 8.622 1.00 0.00 C ATOM 231 CG ARG A 316 -2.899 5.123 8.903 1.00 0.00 C ATOM 232 CD ARG A 316 -2.672 6.615 8.738 1.00 0.00 C ATOM 233 NE ARG A 316 -1.507 7.058 9.499 1.00 0.00 N ATOM 234 CZ ARG A 316 -0.432 7.626 8.951 1.00 0.00 C ATOM 235 NH1 ARG A 316 -0.433 7.960 7.664 1.00 0.00 N ATOM 236 NH2 ARG A 316 0.631 7.880 9.701 1.00 0.00 N ATOM 0 H ARG A 316 -0.221 1.850 7.774 1.00 0.00 H new ATOM 0 HA ARG A 316 -2.119 2.647 9.819 1.00 0.00 H new ATOM 0 HB2 ARG A 316 -0.828 4.737 9.272 1.00 0.00 H new ATOM 0 HB3 ARG A 316 -1.305 4.552 7.596 1.00 0.00 H new ATOM 0 HG2 ARG A 316 -3.684 4.791 8.224 1.00 0.00 H new ATOM 0 HG3 ARG A 316 -3.243 4.911 9.915 1.00 0.00 H new ATOM 0 HD2 ARG A 316 -2.532 6.850 7.683 1.00 0.00 H new ATOM 0 HD3 ARG A 316 -3.556 7.159 9.071 1.00 0.00 H new ATOM 0 HE ARG A 316 -1.516 6.925 10.510 1.00 0.00 H new ATOM 0 HH11 ARG A 316 -1.258 7.782 7.092 1.00 0.00 H new ATOM 0 HH12 ARG A 316 0.391 8.394 7.249 1.00 0.00 H new ATOM 0 HH21 ARG A 316 0.624 7.641 10.693 1.00 0.00 H new ATOM 0 HH22 ARG A 316 1.456 8.314 9.287 1.00 0.00 H new ATOM 250 N ALA A 317 -3.503 1.303 8.225 1.00 0.00 N ATOM 251 CA ALA A 317 -4.576 0.707 7.412 1.00 0.00 C ATOM 252 C ALA A 317 -5.340 1.755 6.591 1.00 0.00 C ATOM 253 O ALA A 317 -5.429 2.917 7.002 1.00 0.00 O ATOM 254 CB ALA A 317 -5.532 -0.034 8.330 1.00 0.00 C ATOM 0 H ALA A 317 -3.444 0.914 9.166 1.00 0.00 H new ATOM 0 HA ALA A 317 -4.119 0.020 6.699 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -6.332 -0.480 7.739 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -4.992 -0.818 8.861 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -5.959 0.664 9.050 1.00 0.00 H new ATOM 260 N PRO A 318 -5.915 1.349 5.421 1.00 0.00 N ATOM 261 CA PRO A 318 -6.566 2.272 4.487 1.00 0.00 C ATOM 262 C PRO A 318 -7.474 3.292 5.184 1.00 0.00 C ATOM 263 O PRO A 318 -8.464 2.941 5.826 1.00 0.00 O ATOM 264 CB PRO A 318 -7.383 1.362 3.547 1.00 0.00 C ATOM 265 CG PRO A 318 -7.222 -0.037 4.060 1.00 0.00 C ATOM 266 CD PRO A 318 -5.978 -0.037 4.918 1.00 0.00 C ATOM 0 HA PRO A 318 -5.827 2.877 3.961 1.00 0.00 H new ATOM 0 HB2 PRO A 318 -8.433 1.654 3.541 1.00 0.00 H new ATOM 0 HB3 PRO A 318 -7.024 1.442 2.521 1.00 0.00 H new ATOM 0 HG2 PRO A 318 -8.094 -0.341 4.640 1.00 0.00 H new ATOM 0 HG3 PRO A 318 -7.125 -0.744 3.236 1.00 0.00 H new ATOM 0 HD2 PRO A 318 -6.051 -0.758 5.732 1.00 0.00 H new ATOM 0 HD3 PRO A 318 -5.091 -0.297 4.341 1.00 0.00 H new ATOM 274 N THR A 319 -7.102 4.552 5.040 1.00 0.00 N ATOM 275 CA THR A 319 -7.744 5.670 5.703 1.00 0.00 C ATOM 276 C THR A 319 -8.000 6.799 4.698 1.00 0.00 C ATOM 277 O THR A 319 -7.204 7.013 3.796 1.00 0.00 O ATOM 278 CB THR A 319 -6.818 6.172 6.835 1.00 0.00 C ATOM 279 OG1 THR A 319 -6.831 5.245 7.930 1.00 0.00 O ATOM 280 CG2 THR A 319 -7.202 7.565 7.307 1.00 0.00 C ATOM 0 H THR A 319 -6.324 4.832 4.442 1.00 0.00 H new ATOM 0 HA THR A 319 -8.700 5.353 6.119 1.00 0.00 H new ATOM 0 HB THR A 319 -5.807 6.236 6.434 1.00 0.00 H new ATOM 0 HG1 THR A 319 -6.364 4.424 7.669 1.00 0.00 H new ATOM 0 HG21 THR A 319 -6.526 7.879 8.102 1.00 0.00 H new ATOM 0 HG22 THR A 319 -7.131 8.264 6.474 1.00 0.00 H new ATOM 0 HG23 THR A 319 -8.225 7.552 7.684 1.00 0.00 H new ATOM 288 N ASP A 320 -9.115 7.504 4.851 1.00 0.00 N ATOM 289 CA ASP A 320 -9.437 8.636 3.974 1.00 0.00 C ATOM 290 C ASP A 320 -8.345 9.700 4.049 1.00 0.00 C ATOM 291 O ASP A 320 -7.952 10.120 5.138 1.00 0.00 O ATOM 292 CB ASP A 320 -10.790 9.248 4.346 1.00 0.00 C ATOM 293 CG ASP A 320 -10.971 10.645 3.776 1.00 0.00 C ATOM 294 OD1 ASP A 320 -11.121 10.786 2.546 1.00 0.00 O ATOM 295 OD2 ASP A 320 -10.960 11.614 4.563 1.00 0.00 O ATOM 0 H ASP A 320 -9.813 7.317 5.571 1.00 0.00 H new ATOM 0 HA ASP A 320 -9.496 8.262 2.952 1.00 0.00 H new ATOM 0 HB2 ASP A 320 -11.590 8.603 3.981 1.00 0.00 H new ATOM 0 HB3 ASP A 320 -10.882 9.287 5.431 1.00 0.00 H new ATOM 300 N SER A 321 -7.856 10.134 2.890 1.00 0.00 N ATOM 301 CA SER A 321 -6.742 11.063 2.786 1.00 0.00 C ATOM 302 C SER A 321 -7.176 12.503 3.066 1.00 0.00 C ATOM 303 O SER A 321 -6.390 13.439 2.901 1.00 0.00 O ATOM 304 CB SER A 321 -6.199 10.996 1.351 1.00 0.00 C ATOM 305 OG SER A 321 -7.115 11.604 0.456 1.00 0.00 O ATOM 0 H SER A 321 -8.230 9.844 1.986 1.00 0.00 H new ATOM 0 HA SER A 321 -5.988 10.783 3.522 1.00 0.00 H new ATOM 0 HB2 SER A 321 -5.234 11.500 1.295 1.00 0.00 H new ATOM 0 HB3 SER A 321 -6.033 9.957 1.064 1.00 0.00 H new ATOM 0 HG SER A 321 -6.716 12.417 0.082 1.00 0.00 H new ATOM 311 N GLY A 322 -8.419 12.680 3.486 1.00 0.00 N ATOM 312 CA GLY A 322 -8.983 14.010 3.583 1.00 0.00 C ATOM 313 C GLY A 322 -9.496 14.538 2.251 1.00 0.00 C ATOM 314 O GLY A 322 -10.259 15.502 2.220 1.00 0.00 O ATOM 0 H GLY A 322 -9.048 11.926 3.762 1.00 0.00 H new ATOM 0 HA2 GLY A 322 -9.801 14.000 4.303 1.00 0.00 H new ATOM 0 HA3 GLY A 322 -8.226 14.692 3.971 1.00 0.00 H new ATOM 318 N HIS A 323 -9.076 13.918 1.147 1.00 0.00 N ATOM 319 CA HIS A 323 -9.467 14.380 -0.189 1.00 0.00 C ATOM 320 C HIS A 323 -10.636 13.562 -0.737 1.00 0.00 C ATOM 321 O HIS A 323 -10.993 13.694 -1.907 1.00 0.00 O ATOM 322 CB HIS A 323 -8.293 14.273 -1.170 1.00 0.00 C ATOM 323 CG HIS A 323 -7.007 14.850 -0.669 1.00 0.00 C ATOM 324 ND1 HIS A 323 -5.855 14.103 -0.549 1.00 0.00 N ATOM 325 CD2 HIS A 323 -6.685 16.103 -0.271 1.00 0.00 C ATOM 326 CE1 HIS A 323 -4.882 14.869 -0.097 1.00 0.00 C ATOM 327 NE2 HIS A 323 -5.358 16.085 0.079 1.00 0.00 N ATOM 0 H HIS A 323 -8.468 13.099 1.149 1.00 0.00 H new ATOM 0 HA HIS A 323 -9.770 15.422 -0.090 1.00 0.00 H new ATOM 0 HB2 HIS A 323 -8.134 13.222 -1.413 1.00 0.00 H new ATOM 0 HB3 HIS A 323 -8.565 14.777 -2.098 1.00 0.00 H new ATOM 0 HD2 HIS A 323 -7.347 16.956 -0.236 1.00 0.00 H new ATOM 0 HE1 HIS A 323 -3.867 14.554 0.096 1.00 0.00 H new ATOM 0 HE2 HIS A 323 -4.825 16.885 0.421 1.00 0.00 H new ATOM 336 N ASP A 324 -11.196 12.705 0.115 1.00 0.00 N ATOM 337 CA ASP A 324 -12.288 11.804 -0.262 1.00 0.00 C ATOM 338 C ASP A 324 -11.743 10.704 -1.155 1.00 0.00 C ATOM 339 O ASP A 324 -12.289 10.394 -2.213 1.00 0.00 O ATOM 340 CB ASP A 324 -13.449 12.535 -0.947 1.00 0.00 C ATOM 341 CG ASP A 324 -14.177 13.479 -0.018 1.00 0.00 C ATOM 342 OD1 ASP A 324 -14.868 12.996 0.905 1.00 0.00 O ATOM 343 OD2 ASP A 324 -14.061 14.712 -0.206 1.00 0.00 O ATOM 0 H ASP A 324 -10.906 12.614 1.089 1.00 0.00 H new ATOM 0 HA ASP A 324 -12.696 11.373 0.652 1.00 0.00 H new ATOM 0 HB2 ASP A 324 -13.067 13.095 -1.800 1.00 0.00 H new ATOM 0 HB3 ASP A 324 -14.154 11.801 -1.338 1.00 0.00 H new ATOM 348 N THR A 325 -10.668 10.116 -0.671 1.00 0.00 N ATOM 349 CA THR A 325 -9.925 9.067 -1.339 1.00 0.00 C ATOM 350 C THR A 325 -9.171 8.345 -0.246 1.00 0.00 C ATOM 351 O THR A 325 -9.060 8.882 0.846 1.00 0.00 O ATOM 352 CB THR A 325 -8.937 9.631 -2.374 1.00 0.00 C ATOM 353 OG1 THR A 325 -8.296 10.795 -1.844 1.00 0.00 O ATOM 354 CG2 THR A 325 -9.636 9.971 -3.681 1.00 0.00 C ATOM 0 H THR A 325 -10.272 10.366 0.235 1.00 0.00 H new ATOM 0 HA THR A 325 -10.599 8.409 -1.888 1.00 0.00 H new ATOM 0 HB THR A 325 -8.190 8.865 -2.584 1.00 0.00 H new ATOM 0 HG1 THR A 325 -7.970 10.606 -0.939 1.00 0.00 H new ATOM 0 HG21 THR A 325 -8.909 10.367 -4.390 1.00 0.00 H new ATOM 0 HG22 THR A 325 -10.093 9.072 -4.094 1.00 0.00 H new ATOM 0 HG23 THR A 325 -10.408 10.718 -3.497 1.00 0.00 H new ATOM 362 N VAL A 326 -8.660 7.162 -0.481 1.00 0.00 N ATOM 363 CA VAL A 326 -8.079 6.418 0.619 1.00 0.00 C ATOM 364 C VAL A 326 -6.574 6.293 0.507 1.00 0.00 C ATOM 365 O VAL A 326 -6.037 5.978 -0.535 1.00 0.00 O ATOM 366 CB VAL A 326 -8.684 5.019 0.762 1.00 0.00 C ATOM 367 CG1 VAL A 326 -8.848 4.692 2.223 1.00 0.00 C ATOM 368 CG2 VAL A 326 -10.012 4.922 0.052 1.00 0.00 C ATOM 0 H VAL A 326 -8.631 6.702 -1.391 1.00 0.00 H new ATOM 0 HA VAL A 326 -8.317 7.000 1.509 1.00 0.00 H new ATOM 0 HB VAL A 326 -8.008 4.299 0.300 1.00 0.00 H new ATOM 0 HG11 VAL A 326 -9.279 3.696 2.327 1.00 0.00 H new ATOM 0 HG12 VAL A 326 -7.875 4.719 2.713 1.00 0.00 H new ATOM 0 HG13 VAL A 326 -9.509 5.423 2.688 1.00 0.00 H new ATOM 0 HG21 VAL A 326 -10.416 3.917 0.172 1.00 0.00 H new ATOM 0 HG22 VAL A 326 -10.707 5.646 0.479 1.00 0.00 H new ATOM 0 HG23 VAL A 326 -9.874 5.133 -1.008 1.00 0.00 H new ATOM 378 N VAL A 327 -5.912 6.568 1.598 1.00 0.00 N ATOM 379 CA VAL A 327 -4.481 6.385 1.712 1.00 0.00 C ATOM 380 C VAL A 327 -4.180 5.320 2.738 1.00 0.00 C ATOM 381 O VAL A 327 -5.042 4.955 3.527 1.00 0.00 O ATOM 382 CB VAL A 327 -3.798 7.691 2.139 1.00 0.00 C ATOM 383 CG1 VAL A 327 -3.842 8.703 1.008 1.00 0.00 C ATOM 384 CG2 VAL A 327 -4.456 8.240 3.406 1.00 0.00 C ATOM 0 H VAL A 327 -6.351 6.930 2.445 1.00 0.00 H new ATOM 0 HA VAL A 327 -4.099 6.083 0.737 1.00 0.00 H new ATOM 0 HB VAL A 327 -2.751 7.489 2.365 1.00 0.00 H new ATOM 0 HG11 VAL A 327 -3.354 9.625 1.325 1.00 0.00 H new ATOM 0 HG12 VAL A 327 -3.324 8.299 0.138 1.00 0.00 H new ATOM 0 HG13 VAL A 327 -4.879 8.913 0.748 1.00 0.00 H new ATOM 0 HG21 VAL A 327 -3.963 9.167 3.700 1.00 0.00 H new ATOM 0 HG22 VAL A 327 -5.511 8.435 3.213 1.00 0.00 H new ATOM 0 HG23 VAL A 327 -4.364 7.510 4.210 1.00 0.00 H new ATOM 394 N MET A 328 -2.972 4.815 2.725 1.00 0.00 N ATOM 395 CA MET A 328 -2.532 3.916 3.761 1.00 0.00 C ATOM 396 C MET A 328 -1.026 4.018 3.885 1.00 0.00 C ATOM 397 O MET A 328 -0.336 4.363 2.921 1.00 0.00 O ATOM 398 CB MET A 328 -2.958 2.472 3.473 1.00 0.00 C ATOM 399 CG MET A 328 -1.980 1.682 2.622 1.00 0.00 C ATOM 400 SD MET A 328 -2.360 -0.079 2.608 1.00 0.00 S ATOM 401 CE MET A 328 -2.248 -0.467 4.355 1.00 0.00 C ATOM 0 H MET A 328 -2.275 5.012 2.007 1.00 0.00 H new ATOM 0 HA MET A 328 -3.001 4.202 4.703 1.00 0.00 H new ATOM 0 HB2 MET A 328 -3.097 1.952 4.421 1.00 0.00 H new ATOM 0 HB3 MET A 328 -3.926 2.486 2.972 1.00 0.00 H new ATOM 0 HG2 MET A 328 -1.998 2.064 1.601 1.00 0.00 H new ATOM 0 HG3 MET A 328 -0.969 1.831 3.000 1.00 0.00 H new ATOM 0 HE1 MET A 328 -1.568 -1.307 4.498 1.00 0.00 H new ATOM 0 HE2 MET A 328 -1.872 0.401 4.897 1.00 0.00 H new ATOM 0 HE3 MET A 328 -3.236 -0.731 4.733 1.00 0.00 H new ATOM 411 N GLU A 329 -0.528 3.745 5.068 1.00 0.00 N ATOM 412 CA GLU A 329 0.899 3.813 5.326 1.00 0.00 C ATOM 413 C GLU A 329 1.404 2.413 5.627 1.00 0.00 C ATOM 414 O GLU A 329 0.747 1.657 6.338 1.00 0.00 O ATOM 415 CB GLU A 329 1.172 4.760 6.498 1.00 0.00 C ATOM 416 CG GLU A 329 2.597 5.262 6.571 1.00 0.00 C ATOM 417 CD GLU A 329 2.757 6.448 7.507 1.00 0.00 C ATOM 418 OE1 GLU A 329 2.989 6.230 8.713 1.00 0.00 O ATOM 419 OE2 GLU A 329 2.660 7.605 7.041 1.00 0.00 O ATOM 0 H GLU A 329 -1.090 3.472 5.874 1.00 0.00 H new ATOM 0 HA GLU A 329 1.423 4.202 4.453 1.00 0.00 H new ATOM 0 HB2 GLU A 329 0.501 5.616 6.423 1.00 0.00 H new ATOM 0 HB3 GLU A 329 0.931 4.247 7.429 1.00 0.00 H new ATOM 0 HG2 GLU A 329 3.246 4.452 6.904 1.00 0.00 H new ATOM 0 HG3 GLU A 329 2.929 5.546 5.572 1.00 0.00 H new ATOM 426 N VAL A 330 2.524 2.032 5.050 1.00 0.00 N ATOM 427 CA VAL A 330 3.045 0.689 5.268 1.00 0.00 C ATOM 428 C VAL A 330 4.538 0.693 5.598 1.00 0.00 C ATOM 429 O VAL A 330 5.283 1.534 5.115 1.00 0.00 O ATOM 430 CB VAL A 330 2.774 -0.190 4.031 1.00 0.00 C ATOM 431 CG1 VAL A 330 1.326 -0.652 4.011 1.00 0.00 C ATOM 432 CG2 VAL A 330 3.083 0.579 2.756 1.00 0.00 C ATOM 0 H VAL A 330 3.088 2.619 4.435 1.00 0.00 H new ATOM 0 HA VAL A 330 2.525 0.274 6.131 1.00 0.00 H new ATOM 0 HB VAL A 330 3.423 -1.064 4.087 1.00 0.00 H new ATOM 0 HG11 VAL A 330 1.154 -1.271 3.131 1.00 0.00 H new ATOM 0 HG12 VAL A 330 1.117 -1.233 4.910 1.00 0.00 H new ATOM 0 HG13 VAL A 330 0.668 0.216 3.979 1.00 0.00 H new ATOM 0 HG21 VAL A 330 2.887 -0.055 1.892 1.00 0.00 H new ATOM 0 HG22 VAL A 330 2.453 1.467 2.705 1.00 0.00 H new ATOM 0 HG23 VAL A 330 4.131 0.877 2.756 1.00 0.00 H new ATOM 442 N GLY A 331 4.975 -0.245 6.436 1.00 0.00 N ATOM 443 CA GLY A 331 6.380 -0.295 6.812 1.00 0.00 C ATOM 444 C GLY A 331 7.034 -1.594 6.395 1.00 0.00 C ATOM 445 O GLY A 331 6.458 -2.667 6.578 1.00 0.00 O ATOM 0 H GLY A 331 4.389 -0.965 6.858 1.00 0.00 H new ATOM 0 HA2 GLY A 331 6.908 0.540 6.352 1.00 0.00 H new ATOM 0 HA3 GLY A 331 6.471 -0.174 7.891 1.00 0.00 H new ATOM 449 N PHE A 332 8.224 -1.504 5.814 1.00 0.00 N ATOM 450 CA PHE A 332 8.917 -2.687 5.316 1.00 0.00 C ATOM 451 C PHE A 332 9.820 -3.361 6.336 1.00 0.00 C ATOM 452 O PHE A 332 10.242 -2.781 7.336 1.00 0.00 O ATOM 453 CB PHE A 332 9.783 -2.339 4.113 1.00 0.00 C ATOM 454 CG PHE A 332 10.993 -1.477 4.438 1.00 0.00 C ATOM 455 CD1 PHE A 332 10.988 -0.587 5.503 1.00 0.00 C ATOM 456 CD2 PHE A 332 12.137 -1.567 3.677 1.00 0.00 C ATOM 457 CE1 PHE A 332 12.095 0.182 5.796 1.00 0.00 C ATOM 458 CE2 PHE A 332 13.251 -0.797 3.962 1.00 0.00 C ATOM 459 CZ PHE A 332 13.229 0.077 5.024 1.00 0.00 C ATOM 0 H PHE A 332 8.728 -0.628 5.676 1.00 0.00 H new ATOM 0 HA PHE A 332 8.117 -3.380 5.057 1.00 0.00 H new ATOM 0 HB2 PHE A 332 10.125 -3.263 3.647 1.00 0.00 H new ATOM 0 HB3 PHE A 332 9.169 -1.820 3.377 1.00 0.00 H new ATOM 0 HD1 PHE A 332 10.102 -0.495 6.113 1.00 0.00 H new ATOM 0 HD2 PHE A 332 12.165 -2.251 2.842 1.00 0.00 H new ATOM 0 HE1 PHE A 332 12.072 0.866 6.631 1.00 0.00 H new ATOM 0 HE2 PHE A 332 14.137 -0.882 3.351 1.00 0.00 H new ATOM 0 HZ PHE A 332 14.097 0.678 5.251 1.00 0.00 H new ATOM 469 N SER A 333 10.052 -4.625 6.051 1.00 0.00 N ATOM 470 CA SER A 333 11.046 -5.437 6.738 1.00 0.00 C ATOM 471 C SER A 333 12.482 -5.029 6.377 1.00 0.00 C ATOM 472 O SER A 333 13.379 -5.122 7.219 1.00 0.00 O ATOM 473 CB SER A 333 10.807 -6.909 6.390 1.00 0.00 C ATOM 474 OG SER A 333 11.703 -7.768 7.068 1.00 0.00 O ATOM 0 H SER A 333 9.548 -5.130 5.322 1.00 0.00 H new ATOM 0 HA SER A 333 10.936 -5.279 7.811 1.00 0.00 H new ATOM 0 HB2 SER A 333 9.783 -7.180 6.645 1.00 0.00 H new ATOM 0 HB3 SER A 333 10.915 -7.049 5.314 1.00 0.00 H new ATOM 0 HG SER A 333 11.516 -8.697 6.820 1.00 0.00 H new ATOM 480 N GLY A 334 12.710 -4.583 5.136 1.00 0.00 N ATOM 481 CA GLY A 334 14.063 -4.193 4.746 1.00 0.00 C ATOM 482 C GLY A 334 14.254 -3.964 3.249 1.00 0.00 C ATOM 483 O GLY A 334 15.232 -3.352 2.838 1.00 0.00 O ATOM 0 H GLY A 334 12.001 -4.486 4.410 1.00 0.00 H new ATOM 0 HA2 GLY A 334 14.330 -3.279 5.277 1.00 0.00 H new ATOM 0 HA3 GLY A 334 14.758 -4.966 5.073 1.00 0.00 H new ATOM 487 N THR A 335 13.334 -4.478 2.446 1.00 0.00 N ATOM 488 CA THR A 335 13.373 -4.260 0.994 1.00 0.00 C ATOM 489 C THR A 335 13.428 -2.762 0.667 1.00 0.00 C ATOM 490 O THR A 335 12.506 -2.021 0.988 1.00 0.00 O ATOM 491 CB THR A 335 12.141 -4.878 0.308 1.00 0.00 C ATOM 492 OG1 THR A 335 11.996 -6.240 0.716 1.00 0.00 O ATOM 493 CG2 THR A 335 12.268 -4.815 -1.206 1.00 0.00 C ATOM 0 H THR A 335 12.551 -5.048 2.767 1.00 0.00 H new ATOM 0 HA THR A 335 14.274 -4.746 0.618 1.00 0.00 H new ATOM 0 HB THR A 335 11.263 -4.305 0.605 1.00 0.00 H new ATOM 0 HG1 THR A 335 11.210 -6.630 0.279 1.00 0.00 H new ATOM 0 HG21 THR A 335 11.384 -5.258 -1.664 1.00 0.00 H new ATOM 0 HG22 THR A 335 12.357 -3.775 -1.521 1.00 0.00 H new ATOM 0 HG23 THR A 335 13.154 -5.366 -1.520 1.00 0.00 H new ATOM 501 N ARG A 336 14.490 -2.334 -0.023 1.00 0.00 N ATOM 502 CA ARG A 336 14.735 -0.905 -0.244 1.00 0.00 C ATOM 503 C ARG A 336 13.769 -0.398 -1.316 1.00 0.00 C ATOM 504 O ARG A 336 12.940 -1.191 -1.757 1.00 0.00 O ATOM 505 CB ARG A 336 16.191 -0.670 -0.672 1.00 0.00 C ATOM 506 CG ARG A 336 16.457 -0.936 -2.147 1.00 0.00 C ATOM 507 CD ARG A 336 17.762 -0.296 -2.592 1.00 0.00 C ATOM 508 NE ARG A 336 17.758 0.049 -4.013 1.00 0.00 N ATOM 509 CZ ARG A 336 18.794 0.598 -4.648 1.00 0.00 C ATOM 510 NH1 ARG A 336 19.930 0.832 -4.001 1.00 0.00 N ATOM 511 NH2 ARG A 336 18.692 0.926 -5.927 1.00 0.00 N ATOM 0 H ARG A 336 15.189 -2.951 -0.436 1.00 0.00 H new ATOM 0 HA ARG A 336 14.568 -0.357 0.683 1.00 0.00 H new ATOM 0 HB2 ARG A 336 16.463 0.361 -0.445 1.00 0.00 H new ATOM 0 HB3 ARG A 336 16.841 -1.310 -0.076 1.00 0.00 H new ATOM 0 HG2 ARG A 336 16.496 -2.011 -2.325 1.00 0.00 H new ATOM 0 HG3 ARG A 336 15.634 -0.544 -2.745 1.00 0.00 H new ATOM 0 HD2 ARG A 336 17.942 0.603 -2.003 1.00 0.00 H new ATOM 0 HD3 ARG A 336 18.586 -0.980 -2.389 1.00 0.00 H new ATOM 0 HE ARG A 336 16.912 -0.142 -4.550 1.00 0.00 H new ATOM 0 HH11 ARG A 336 20.013 0.592 -3.013 1.00 0.00 H new ATOM 0 HH12 ARG A 336 20.719 1.252 -4.492 1.00 0.00 H new ATOM 0 HH21 ARG A 336 17.820 0.759 -6.428 1.00 0.00 H new ATOM 0 HH22 ARG A 336 19.486 1.346 -6.411 1.00 0.00 H new ATOM 525 N PRO A 337 13.848 0.901 -1.754 1.00 0.00 N ATOM 526 CA PRO A 337 13.005 1.453 -2.820 1.00 0.00 C ATOM 527 C PRO A 337 12.524 0.411 -3.805 1.00 0.00 C ATOM 528 O PRO A 337 13.211 0.036 -4.759 1.00 0.00 O ATOM 529 CB PRO A 337 13.938 2.468 -3.443 1.00 0.00 C ATOM 530 CG PRO A 337 14.561 3.090 -2.244 1.00 0.00 C ATOM 531 CD PRO A 337 14.736 1.968 -1.235 1.00 0.00 C ATOM 0 HA PRO A 337 12.068 1.876 -2.459 1.00 0.00 H new ATOM 0 HB2 PRO A 337 14.678 1.998 -4.091 1.00 0.00 H new ATOM 0 HB3 PRO A 337 13.401 3.198 -4.049 1.00 0.00 H new ATOM 0 HG2 PRO A 337 15.520 3.544 -2.493 1.00 0.00 H new ATOM 0 HG3 PRO A 337 13.929 3.882 -1.842 1.00 0.00 H new ATOM 0 HD2 PRO A 337 15.773 1.636 -1.178 1.00 0.00 H new ATOM 0 HD3 PRO A 337 14.446 2.280 -0.232 1.00 0.00 H new ATOM 539 N CYS A 338 11.320 -0.053 -3.538 1.00 0.00 N ATOM 540 CA CYS A 338 10.795 -1.243 -4.197 1.00 0.00 C ATOM 541 C CYS A 338 9.592 -0.901 -5.051 1.00 0.00 C ATOM 542 O CYS A 338 9.227 0.259 -5.200 1.00 0.00 O ATOM 543 CB CYS A 338 10.413 -2.326 -3.174 1.00 0.00 C ATOM 544 SG CYS A 338 8.848 -2.010 -2.294 1.00 0.00 S ATOM 0 H CYS A 338 10.681 0.374 -2.868 1.00 0.00 H new ATOM 0 HA CYS A 338 11.585 -1.634 -4.838 1.00 0.00 H new ATOM 0 HB2 CYS A 338 10.340 -3.285 -3.688 1.00 0.00 H new ATOM 0 HB3 CYS A 338 11.216 -2.417 -2.442 1.00 0.00 H new ATOM 549 N ARG A 339 8.987 -1.923 -5.615 1.00 0.00 N ATOM 550 CA ARG A 339 7.818 -1.757 -6.448 1.00 0.00 C ATOM 551 C ARG A 339 6.653 -2.341 -5.684 1.00 0.00 C ATOM 552 O ARG A 339 6.496 -3.560 -5.637 1.00 0.00 O ATOM 553 CB ARG A 339 7.988 -2.465 -7.795 1.00 0.00 C ATOM 554 CG ARG A 339 8.861 -1.717 -8.795 1.00 0.00 C ATOM 555 CD ARG A 339 10.252 -1.433 -8.251 1.00 0.00 C ATOM 556 NE ARG A 339 11.173 -0.998 -9.299 1.00 0.00 N ATOM 557 CZ ARG A 339 12.161 -0.122 -9.114 1.00 0.00 C ATOM 558 NH1 ARG A 339 12.340 0.450 -7.927 1.00 0.00 N ATOM 559 NH2 ARG A 339 12.975 0.178 -10.114 1.00 0.00 N ATOM 0 H ARG A 339 9.291 -2.891 -5.509 1.00 0.00 H new ATOM 0 HA ARG A 339 7.655 -0.702 -6.670 1.00 0.00 H new ATOM 0 HB2 ARG A 339 8.419 -3.451 -7.621 1.00 0.00 H new ATOM 0 HB3 ARG A 339 7.004 -2.621 -8.236 1.00 0.00 H new ATOM 0 HG2 ARG A 339 8.944 -2.303 -9.710 1.00 0.00 H new ATOM 0 HG3 ARG A 339 8.379 -0.776 -9.062 1.00 0.00 H new ATOM 0 HD2 ARG A 339 10.190 -0.664 -7.481 1.00 0.00 H new ATOM 0 HD3 ARG A 339 10.645 -2.331 -7.774 1.00 0.00 H new ATOM 0 HE ARG A 339 11.052 -1.390 -10.233 1.00 0.00 H new ATOM 0 HH11 ARG A 339 11.719 0.219 -7.151 1.00 0.00 H new ATOM 0 HH12 ARG A 339 13.098 1.119 -7.792 1.00 0.00 H new ATOM 0 HH21 ARG A 339 12.846 -0.261 -11.026 1.00 0.00 H new ATOM 0 HH22 ARG A 339 13.731 0.848 -9.973 1.00 0.00 H new ATOM 573 N ILE A 340 5.865 -1.481 -5.058 1.00 0.00 N ATOM 574 CA ILE A 340 4.870 -1.960 -4.113 1.00 0.00 C ATOM 575 C ILE A 340 3.691 -2.590 -4.841 1.00 0.00 C ATOM 576 O ILE A 340 2.985 -1.921 -5.600 1.00 0.00 O ATOM 577 CB ILE A 340 4.354 -0.860 -3.166 1.00 0.00 C ATOM 578 CG1 ILE A 340 5.505 -0.222 -2.393 1.00 0.00 C ATOM 579 CG2 ILE A 340 3.347 -1.447 -2.192 1.00 0.00 C ATOM 580 CD1 ILE A 340 5.044 0.746 -1.323 1.00 0.00 C ATOM 0 H ILE A 340 5.893 -0.469 -5.183 1.00 0.00 H new ATOM 0 HA ILE A 340 5.375 -2.708 -3.502 1.00 0.00 H new ATOM 0 HB ILE A 340 3.873 -0.089 -3.768 1.00 0.00 H new ATOM 0 HG12 ILE A 340 6.102 -1.008 -1.930 1.00 0.00 H new ATOM 0 HG13 ILE A 340 6.156 0.303 -3.092 1.00 0.00 H new ATOM 0 HG21 ILE A 340 2.986 -0.664 -1.525 1.00 0.00 H new ATOM 0 HG22 ILE A 340 2.507 -1.867 -2.746 1.00 0.00 H new ATOM 0 HG23 ILE A 340 3.824 -2.232 -1.605 1.00 0.00 H new ATOM 0 HD11 ILE A 340 5.911 1.163 -0.812 1.00 0.00 H new ATOM 0 HD12 ILE A 340 4.472 1.551 -1.783 1.00 0.00 H new ATOM 0 HD13 ILE A 340 4.417 0.221 -0.603 1.00 0.00 H new ATOM 592 N PRO A 341 3.476 -3.897 -4.630 1.00 0.00 N ATOM 593 CA PRO A 341 2.359 -4.610 -5.226 1.00 0.00 C ATOM 594 C PRO A 341 1.073 -4.355 -4.451 1.00 0.00 C ATOM 595 O PRO A 341 0.659 -5.157 -3.611 1.00 0.00 O ATOM 596 CB PRO A 341 2.785 -6.074 -5.122 1.00 0.00 C ATOM 597 CG PRO A 341 3.659 -6.131 -3.915 1.00 0.00 C ATOM 598 CD PRO A 341 4.309 -4.776 -3.788 1.00 0.00 C ATOM 0 HA PRO A 341 2.148 -4.299 -6.249 1.00 0.00 H new ATOM 0 HB2 PRO A 341 1.922 -6.731 -5.017 1.00 0.00 H new ATOM 0 HB3 PRO A 341 3.322 -6.394 -6.015 1.00 0.00 H new ATOM 0 HG2 PRO A 341 3.075 -6.365 -3.025 1.00 0.00 H new ATOM 0 HG3 PRO A 341 4.411 -6.913 -4.018 1.00 0.00 H new ATOM 0 HD2 PRO A 341 4.325 -4.437 -2.752 1.00 0.00 H new ATOM 0 HD3 PRO A 341 5.343 -4.796 -4.133 1.00 0.00 H new ATOM 606 N VAL A 342 0.448 -3.229 -4.734 1.00 0.00 N ATOM 607 CA VAL A 342 -0.774 -2.851 -4.055 1.00 0.00 C ATOM 608 C VAL A 342 -1.982 -3.082 -4.925 1.00 0.00 C ATOM 609 O VAL A 342 -1.998 -2.768 -6.117 1.00 0.00 O ATOM 610 CB VAL A 342 -0.758 -1.394 -3.595 1.00 0.00 C ATOM 611 CG1 VAL A 342 0.114 -1.271 -2.368 1.00 0.00 C ATOM 612 CG2 VAL A 342 -0.274 -0.479 -4.705 1.00 0.00 C ATOM 0 H VAL A 342 0.768 -2.558 -5.432 1.00 0.00 H new ATOM 0 HA VAL A 342 -0.836 -3.489 -3.173 1.00 0.00 H new ATOM 0 HB VAL A 342 -1.773 -1.086 -3.343 1.00 0.00 H new ATOM 0 HG11 VAL A 342 0.129 -0.233 -2.035 1.00 0.00 H new ATOM 0 HG12 VAL A 342 -0.285 -1.901 -1.573 1.00 0.00 H new ATOM 0 HG13 VAL A 342 1.128 -1.590 -2.609 1.00 0.00 H new ATOM 0 HG21 VAL A 342 -0.272 0.552 -4.352 1.00 0.00 H new ATOM 0 HG22 VAL A 342 0.737 -0.764 -4.997 1.00 0.00 H new ATOM 0 HG23 VAL A 342 -0.938 -0.567 -5.565 1.00 0.00 H new ATOM 622 N ARG A 343 -2.966 -3.673 -4.314 1.00 0.00 N ATOM 623 CA ARG A 343 -4.246 -3.883 -4.927 1.00 0.00 C ATOM 624 C ARG A 343 -5.300 -3.639 -3.882 1.00 0.00 C ATOM 625 O ARG A 343 -4.982 -3.358 -2.738 1.00 0.00 O ATOM 626 CB ARG A 343 -4.370 -5.310 -5.436 1.00 0.00 C ATOM 627 CG ARG A 343 -4.196 -6.328 -4.323 1.00 0.00 C ATOM 628 CD ARG A 343 -4.289 -7.760 -4.821 1.00 0.00 C ATOM 629 NE ARG A 343 -3.816 -8.694 -3.799 1.00 0.00 N ATOM 630 CZ ARG A 343 -4.265 -9.942 -3.638 1.00 0.00 C ATOM 631 NH1 ARG A 343 -5.246 -10.412 -4.401 1.00 0.00 N ATOM 632 NH2 ARG A 343 -3.732 -10.718 -2.697 1.00 0.00 N ATOM 0 H ARG A 343 -2.902 -4.029 -3.360 1.00 0.00 H new ATOM 0 HA ARG A 343 -4.364 -3.206 -5.773 1.00 0.00 H new ATOM 0 HB2 ARG A 343 -5.346 -5.445 -5.902 1.00 0.00 H new ATOM 0 HB3 ARG A 343 -3.621 -5.486 -6.208 1.00 0.00 H new ATOM 0 HG2 ARG A 343 -3.229 -6.176 -3.845 1.00 0.00 H new ATOM 0 HG3 ARG A 343 -4.958 -6.162 -3.561 1.00 0.00 H new ATOM 0 HD2 ARG A 343 -5.321 -7.993 -5.084 1.00 0.00 H new ATOM 0 HD3 ARG A 343 -3.695 -7.874 -5.728 1.00 0.00 H new ATOM 0 HE ARG A 343 -3.089 -8.368 -3.162 1.00 0.00 H new ATOM 0 HH11 ARG A 343 -5.664 -9.819 -5.118 1.00 0.00 H new ATOM 0 HH12 ARG A 343 -5.581 -11.366 -4.270 1.00 0.00 H new ATOM 0 HH21 ARG A 343 -2.984 -10.359 -2.103 1.00 0.00 H new ATOM 0 HH22 ARG A 343 -4.071 -11.672 -2.570 1.00 0.00 H new ATOM 646 N ALA A 344 -6.534 -3.723 -4.272 1.00 0.00 N ATOM 647 CA ALA A 344 -7.605 -3.663 -3.320 1.00 0.00 C ATOM 648 C ALA A 344 -8.724 -4.572 -3.750 1.00 0.00 C ATOM 649 O ALA A 344 -8.964 -4.736 -4.937 1.00 0.00 O ATOM 650 CB ALA A 344 -8.084 -2.233 -3.150 1.00 0.00 C ATOM 0 H ALA A 344 -6.827 -3.833 -5.243 1.00 0.00 H new ATOM 0 HA ALA A 344 -7.243 -4.006 -2.351 1.00 0.00 H new ATOM 0 HB1 ALA A 344 -8.897 -2.205 -2.424 1.00 0.00 H new ATOM 0 HB2 ALA A 344 -7.260 -1.613 -2.796 1.00 0.00 H new ATOM 0 HB3 ALA A 344 -8.439 -1.852 -4.107 1.00 0.00 H new ATOM 656 N VAL A 345 -9.398 -5.189 -2.806 1.00 0.00 N ATOM 657 CA VAL A 345 -10.492 -6.070 -3.125 1.00 0.00 C ATOM 658 C VAL A 345 -11.744 -5.514 -2.486 1.00 0.00 C ATOM 659 O VAL A 345 -11.685 -4.840 -1.460 1.00 0.00 O ATOM 660 CB VAL A 345 -10.216 -7.509 -2.627 1.00 0.00 C ATOM 661 CG1 VAL A 345 -8.866 -7.995 -3.131 1.00 0.00 C ATOM 662 CG2 VAL A 345 -10.280 -7.597 -1.110 1.00 0.00 C ATOM 0 H VAL A 345 -9.205 -5.095 -1.809 1.00 0.00 H new ATOM 0 HA VAL A 345 -10.615 -6.126 -4.207 1.00 0.00 H new ATOM 0 HB VAL A 345 -10.996 -8.155 -3.030 1.00 0.00 H new ATOM 0 HG11 VAL A 345 -8.687 -9.008 -2.772 1.00 0.00 H new ATOM 0 HG12 VAL A 345 -8.861 -7.990 -4.221 1.00 0.00 H new ATOM 0 HG13 VAL A 345 -8.081 -7.335 -2.762 1.00 0.00 H new ATOM 0 HG21 VAL A 345 -10.081 -8.622 -0.796 1.00 0.00 H new ATOM 0 HG22 VAL A 345 -9.533 -6.933 -0.675 1.00 0.00 H new ATOM 0 HG23 VAL A 345 -11.272 -7.299 -0.770 1.00 0.00 H new ATOM 672 N ALA A 346 -12.847 -5.682 -3.160 1.00 0.00 N ATOM 673 CA ALA A 346 -14.124 -5.245 -2.644 1.00 0.00 C ATOM 674 C ALA A 346 -14.550 -5.998 -1.392 1.00 0.00 C ATOM 675 O ALA A 346 -14.727 -7.211 -1.422 1.00 0.00 O ATOM 676 CB ALA A 346 -15.160 -5.420 -3.723 1.00 0.00 C ATOM 0 H ALA A 346 -12.892 -6.123 -4.079 1.00 0.00 H new ATOM 0 HA ALA A 346 -14.028 -4.198 -2.356 1.00 0.00 H new ATOM 0 HB1 ALA A 346 -16.131 -5.095 -3.351 1.00 0.00 H new ATOM 0 HB2 ALA A 346 -14.885 -4.822 -4.592 1.00 0.00 H new ATOM 0 HB3 ALA A 346 -15.214 -6.471 -4.009 1.00 0.00 H new ATOM 682 N HIS A 347 -14.716 -5.240 -0.307 1.00 0.00 N ATOM 683 CA HIS A 347 -15.309 -5.744 0.938 1.00 0.00 C ATOM 684 C HIS A 347 -14.709 -7.093 1.356 1.00 0.00 C ATOM 685 O HIS A 347 -15.420 -8.092 1.441 1.00 0.00 O ATOM 686 CB HIS A 347 -16.833 -5.868 0.744 1.00 0.00 C ATOM 687 CG HIS A 347 -17.602 -6.308 1.955 1.00 0.00 C ATOM 688 ND1 HIS A 347 -18.367 -7.453 1.977 1.00 0.00 N ATOM 689 CD2 HIS A 347 -17.744 -5.742 3.174 1.00 0.00 C ATOM 690 CE1 HIS A 347 -18.943 -7.573 3.155 1.00 0.00 C ATOM 691 NE2 HIS A 347 -18.582 -6.548 3.903 1.00 0.00 N ATOM 0 H HIS A 347 -14.444 -4.258 -0.264 1.00 0.00 H new ATOM 0 HA HIS A 347 -15.087 -5.040 1.740 1.00 0.00 H new ATOM 0 HB2 HIS A 347 -17.221 -4.902 0.419 1.00 0.00 H new ATOM 0 HB3 HIS A 347 -17.023 -6.575 -0.063 1.00 0.00 H new ATOM 0 HD2 HIS A 347 -17.283 -4.825 3.512 1.00 0.00 H new ATOM 0 HE1 HIS A 347 -19.600 -8.375 3.458 1.00 0.00 H new ATOM 0 HE2 HIS A 347 -18.877 -6.382 4.865 1.00 0.00 H new ATOM 700 N GLY A 348 -13.411 -7.108 1.662 1.00 0.00 N ATOM 701 CA GLY A 348 -12.711 -8.354 1.952 1.00 0.00 C ATOM 702 C GLY A 348 -13.041 -9.508 1.016 1.00 0.00 C ATOM 703 O GLY A 348 -13.193 -10.646 1.471 1.00 0.00 O ATOM 0 H GLY A 348 -12.827 -6.273 1.715 1.00 0.00 H new ATOM 0 HA2 GLY A 348 -11.638 -8.168 1.912 1.00 0.00 H new ATOM 0 HA3 GLY A 348 -12.944 -8.656 2.973 1.00 0.00 H new ATOM 707 N VAL A 349 -13.139 -9.244 -0.282 1.00 0.00 N ATOM 708 CA VAL A 349 -13.442 -10.279 -1.263 1.00 0.00 C ATOM 709 C VAL A 349 -12.634 -10.012 -2.530 1.00 0.00 C ATOM 710 O VAL A 349 -12.959 -9.104 -3.299 1.00 0.00 O ATOM 711 CB VAL A 349 -14.941 -10.316 -1.651 1.00 0.00 C ATOM 712 CG1 VAL A 349 -15.196 -11.407 -2.678 1.00 0.00 C ATOM 713 CG2 VAL A 349 -15.828 -10.521 -0.434 1.00 0.00 C ATOM 0 H VAL A 349 -13.012 -8.314 -0.682 1.00 0.00 H new ATOM 0 HA VAL A 349 -13.186 -11.236 -0.810 1.00 0.00 H new ATOM 0 HB VAL A 349 -15.193 -9.350 -2.089 1.00 0.00 H new ATOM 0 HG11 VAL A 349 -16.254 -11.420 -2.940 1.00 0.00 H new ATOM 0 HG12 VAL A 349 -14.603 -11.211 -3.572 1.00 0.00 H new ATOM 0 HG13 VAL A 349 -14.914 -12.373 -2.260 1.00 0.00 H new ATOM 0 HG21 VAL A 349 -16.873 -10.542 -0.744 1.00 0.00 H new ATOM 0 HG22 VAL A 349 -15.574 -11.466 0.047 1.00 0.00 H new ATOM 0 HG23 VAL A 349 -15.675 -9.703 0.270 1.00 0.00 H new ATOM 723 N PRO A 350 -11.549 -10.766 -2.753 1.00 0.00 N ATOM 724 CA PRO A 350 -10.712 -10.624 -3.952 1.00 0.00 C ATOM 725 C PRO A 350 -11.383 -11.154 -5.216 1.00 0.00 C ATOM 726 O PRO A 350 -10.802 -11.952 -5.954 1.00 0.00 O ATOM 727 CB PRO A 350 -9.459 -11.454 -3.623 1.00 0.00 C ATOM 728 CG PRO A 350 -9.541 -11.719 -2.157 1.00 0.00 C ATOM 729 CD PRO A 350 -11.006 -11.777 -1.842 1.00 0.00 C ATOM 0 HA PRO A 350 -10.504 -9.576 -4.167 1.00 0.00 H new ATOM 0 HB2 PRO A 350 -9.442 -12.384 -4.191 1.00 0.00 H new ATOM 0 HB3 PRO A 350 -8.549 -10.910 -3.875 1.00 0.00 H new ATOM 0 HG2 PRO A 350 -9.047 -12.656 -1.899 1.00 0.00 H new ATOM 0 HG3 PRO A 350 -9.048 -10.931 -1.588 1.00 0.00 H new ATOM 0 HD2 PRO A 350 -11.426 -12.765 -2.031 1.00 0.00 H new ATOM 0 HD3 PRO A 350 -11.209 -11.538 -0.798 1.00 0.00 H new ATOM 737 N GLU A 351 -12.603 -10.701 -5.468 1.00 0.00 N ATOM 738 CA GLU A 351 -13.370 -11.134 -6.620 1.00 0.00 C ATOM 739 C GLU A 351 -13.325 -10.032 -7.674 1.00 0.00 C ATOM 740 O GLU A 351 -13.759 -10.203 -8.814 1.00 0.00 O ATOM 741 CB GLU A 351 -14.814 -11.424 -6.194 1.00 0.00 C ATOM 742 CG GLU A 351 -15.717 -11.887 -7.318 1.00 0.00 C ATOM 743 CD GLU A 351 -15.223 -13.152 -7.988 1.00 0.00 C ATOM 744 OE1 GLU A 351 -15.432 -14.244 -7.425 1.00 0.00 O ATOM 745 OE2 GLU A 351 -14.634 -13.059 -9.088 1.00 0.00 O ATOM 0 H GLU A 351 -13.086 -10.023 -4.878 1.00 0.00 H new ATOM 0 HA GLU A 351 -12.949 -12.048 -7.039 1.00 0.00 H new ATOM 0 HB2 GLU A 351 -14.804 -12.186 -5.415 1.00 0.00 H new ATOM 0 HB3 GLU A 351 -15.238 -10.522 -5.752 1.00 0.00 H new ATOM 0 HG2 GLU A 351 -16.719 -12.058 -6.925 1.00 0.00 H new ATOM 0 HG3 GLU A 351 -15.797 -11.095 -8.063 1.00 0.00 H new ATOM 752 N VAL A 352 -12.761 -8.901 -7.269 1.00 0.00 N ATOM 753 CA VAL A 352 -12.827 -7.674 -8.043 1.00 0.00 C ATOM 754 C VAL A 352 -11.897 -6.618 -7.435 1.00 0.00 C ATOM 755 O VAL A 352 -12.117 -6.137 -6.318 1.00 0.00 O ATOM 756 CB VAL A 352 -14.280 -7.140 -8.159 1.00 0.00 C ATOM 757 CG1 VAL A 352 -14.977 -7.124 -6.807 1.00 0.00 C ATOM 758 CG2 VAL A 352 -14.299 -5.756 -8.792 1.00 0.00 C ATOM 0 H VAL A 352 -12.245 -8.812 -6.394 1.00 0.00 H new ATOM 0 HA VAL A 352 -12.491 -7.897 -9.056 1.00 0.00 H new ATOM 0 HB VAL A 352 -14.831 -7.822 -8.807 1.00 0.00 H new ATOM 0 HG11 VAL A 352 -15.992 -6.745 -6.925 1.00 0.00 H new ATOM 0 HG12 VAL A 352 -15.013 -8.136 -6.404 1.00 0.00 H new ATOM 0 HG13 VAL A 352 -14.426 -6.480 -6.121 1.00 0.00 H new ATOM 0 HG21 VAL A 352 -15.328 -5.402 -8.863 1.00 0.00 H new ATOM 0 HG22 VAL A 352 -13.720 -5.067 -8.177 1.00 0.00 H new ATOM 0 HG23 VAL A 352 -13.863 -5.806 -9.790 1.00 0.00 H new ATOM 768 N ASN A 353 -10.826 -6.314 -8.154 1.00 0.00 N ATOM 769 CA ASN A 353 -9.863 -5.294 -7.733 1.00 0.00 C ATOM 770 C ASN A 353 -10.501 -3.904 -7.713 1.00 0.00 C ATOM 771 O ASN A 353 -10.794 -3.330 -8.763 1.00 0.00 O ATOM 772 CB ASN A 353 -8.645 -5.293 -8.669 1.00 0.00 C ATOM 773 CG ASN A 353 -7.575 -4.294 -8.251 1.00 0.00 C ATOM 774 OD1 ASN A 353 -7.401 -4.006 -7.068 1.00 0.00 O ATOM 775 ND2 ASN A 353 -6.850 -3.756 -9.222 1.00 0.00 N ATOM 0 H ASN A 353 -10.597 -6.762 -9.041 1.00 0.00 H new ATOM 0 HA ASN A 353 -9.540 -5.538 -6.721 1.00 0.00 H new ATOM 0 HB2 ASN A 353 -8.211 -6.293 -8.693 1.00 0.00 H new ATOM 0 HB3 ASN A 353 -8.973 -5.063 -9.683 1.00 0.00 H new ATOM 0 HD21 ASN A 353 -6.120 -3.080 -8.999 1.00 0.00 H new ATOM 0 HD22 ASN A 353 -7.022 -4.019 -10.192 1.00 0.00 H new ATOM 782 N VAL A 354 -10.718 -3.371 -6.515 1.00 0.00 N ATOM 783 CA VAL A 354 -11.283 -2.034 -6.347 1.00 0.00 C ATOM 784 C VAL A 354 -10.195 -0.978 -6.265 1.00 0.00 C ATOM 785 O VAL A 354 -10.492 0.201 -6.096 1.00 0.00 O ATOM 786 CB VAL A 354 -12.154 -1.925 -5.073 1.00 0.00 C ATOM 787 CG1 VAL A 354 -13.366 -2.830 -5.187 1.00 0.00 C ATOM 788 CG2 VAL A 354 -11.351 -2.276 -3.837 1.00 0.00 C ATOM 0 H VAL A 354 -10.509 -3.848 -5.638 1.00 0.00 H new ATOM 0 HA VAL A 354 -11.905 -1.862 -7.225 1.00 0.00 H new ATOM 0 HB VAL A 354 -12.492 -0.893 -4.978 1.00 0.00 H new ATOM 0 HG11 VAL A 354 -13.971 -2.744 -4.284 1.00 0.00 H new ATOM 0 HG12 VAL A 354 -13.961 -2.535 -6.051 1.00 0.00 H new ATOM 0 HG13 VAL A 354 -13.039 -3.863 -5.308 1.00 0.00 H new ATOM 0 HG21 VAL A 354 -11.986 -2.192 -2.955 1.00 0.00 H new ATOM 0 HG22 VAL A 354 -10.981 -3.298 -3.922 1.00 0.00 H new ATOM 0 HG23 VAL A 354 -10.508 -1.591 -3.744 1.00 0.00 H new ATOM 798 N ALA A 355 -8.935 -1.391 -6.371 1.00 0.00 N ATOM 799 CA ALA A 355 -7.832 -0.454 -6.238 1.00 0.00 C ATOM 800 C ALA A 355 -7.694 0.416 -7.467 1.00 0.00 C ATOM 801 O ALA A 355 -6.904 0.128 -8.363 1.00 0.00 O ATOM 802 CB ALA A 355 -6.525 -1.186 -5.978 1.00 0.00 C ATOM 0 H ALA A 355 -8.658 -2.357 -6.546 1.00 0.00 H new ATOM 0 HA ALA A 355 -8.055 0.187 -5.385 1.00 0.00 H new ATOM 0 HB1 ALA A 355 -5.715 -0.462 -5.882 1.00 0.00 H new ATOM 0 HB2 ALA A 355 -6.608 -1.762 -5.056 1.00 0.00 H new ATOM 0 HB3 ALA A 355 -6.314 -1.859 -6.809 1.00 0.00 H new ATOM 808 N MET A 356 -8.479 1.468 -7.508 1.00 0.00 N ATOM 809 CA MET A 356 -8.298 2.518 -8.472 1.00 0.00 C ATOM 810 C MET A 356 -7.473 3.587 -7.790 1.00 0.00 C ATOM 811 O MET A 356 -7.982 4.390 -7.011 1.00 0.00 O ATOM 812 CB MET A 356 -9.658 3.041 -8.944 1.00 0.00 C ATOM 813 CG MET A 356 -9.578 4.321 -9.755 1.00 0.00 C ATOM 814 SD MET A 356 -11.183 4.842 -10.395 1.00 0.00 S ATOM 815 CE MET A 356 -11.626 3.417 -11.387 1.00 0.00 C ATOM 0 H MET A 356 -9.261 1.616 -6.871 1.00 0.00 H new ATOM 0 HA MET A 356 -7.783 2.169 -9.367 1.00 0.00 H new ATOM 0 HB2 MET A 356 -10.143 2.272 -9.545 1.00 0.00 H new ATOM 0 HB3 MET A 356 -10.292 3.213 -8.074 1.00 0.00 H new ATOM 0 HG2 MET A 356 -9.164 5.115 -9.133 1.00 0.00 H new ATOM 0 HG3 MET A 356 -8.889 4.176 -10.587 1.00 0.00 H new ATOM 0 HE1 MET A 356 -12.334 3.717 -12.160 1.00 0.00 H new ATOM 0 HE2 MET A 356 -10.731 3.006 -11.854 1.00 0.00 H new ATOM 0 HE3 MET A 356 -12.083 2.659 -10.751 1.00 0.00 H new ATOM 825 N LEU A 357 -6.188 3.568 -8.062 1.00 0.00 N ATOM 826 CA LEU A 357 -5.245 4.260 -7.214 1.00 0.00 C ATOM 827 C LEU A 357 -5.210 5.747 -7.525 1.00 0.00 C ATOM 828 O LEU A 357 -5.304 6.162 -8.679 1.00 0.00 O ATOM 829 CB LEU A 357 -3.850 3.630 -7.336 1.00 0.00 C ATOM 830 CG LEU A 357 -3.757 2.150 -6.928 1.00 0.00 C ATOM 831 CD1 LEU A 357 -2.305 1.732 -6.742 1.00 0.00 C ATOM 832 CD2 LEU A 357 -4.545 1.889 -5.657 1.00 0.00 C ATOM 0 H LEU A 357 -5.774 3.084 -8.859 1.00 0.00 H new ATOM 0 HA LEU A 357 -5.576 4.154 -6.181 1.00 0.00 H new ATOM 0 HB2 LEU A 357 -3.515 3.726 -8.369 1.00 0.00 H new ATOM 0 HB3 LEU A 357 -3.156 4.203 -6.721 1.00 0.00 H new ATOM 0 HG LEU A 357 -4.190 1.553 -7.731 1.00 0.00 H new ATOM 0 HD11 LEU A 357 -2.263 0.682 -6.454 1.00 0.00 H new ATOM 0 HD12 LEU A 357 -1.763 1.874 -7.677 1.00 0.00 H new ATOM 0 HD13 LEU A 357 -1.848 2.341 -5.962 1.00 0.00 H new ATOM 0 HD21 LEU A 357 -4.464 0.836 -5.389 1.00 0.00 H new ATOM 0 HD22 LEU A 357 -4.145 2.501 -4.849 1.00 0.00 H new ATOM 0 HD23 LEU A 357 -5.593 2.142 -5.820 1.00 0.00 H new ATOM 844 N ILE A 358 -5.083 6.540 -6.464 1.00 0.00 N ATOM 845 CA ILE A 358 -4.996 7.987 -6.590 1.00 0.00 C ATOM 846 C ILE A 358 -3.561 8.310 -6.968 1.00 0.00 C ATOM 847 O ILE A 358 -3.262 9.331 -7.589 1.00 0.00 O ATOM 848 CB ILE A 358 -5.360 8.742 -5.277 1.00 0.00 C ATOM 849 CG1 ILE A 358 -6.550 8.094 -4.543 1.00 0.00 C ATOM 850 CG2 ILE A 358 -5.676 10.197 -5.582 1.00 0.00 C ATOM 851 CD1 ILE A 358 -7.707 7.744 -5.458 1.00 0.00 C ATOM 0 H ILE A 358 -5.038 6.200 -5.504 1.00 0.00 H new ATOM 0 HA ILE A 358 -5.715 8.315 -7.341 1.00 0.00 H new ATOM 0 HB ILE A 358 -4.494 8.681 -4.619 1.00 0.00 H new ATOM 0 HG12 ILE A 358 -6.208 7.189 -4.041 1.00 0.00 H new ATOM 0 HG13 ILE A 358 -6.903 8.775 -3.768 1.00 0.00 H new ATOM 0 HG21 ILE A 358 -5.929 10.716 -4.657 1.00 0.00 H new ATOM 0 HG22 ILE A 358 -4.806 10.671 -6.037 1.00 0.00 H new ATOM 0 HG23 ILE A 358 -6.520 10.250 -6.270 1.00 0.00 H new ATOM 0 HD11 ILE A 358 -8.509 7.292 -4.874 1.00 0.00 H new ATOM 0 HD12 ILE A 358 -8.076 8.649 -5.941 1.00 0.00 H new ATOM 0 HD13 ILE A 358 -7.370 7.039 -6.218 1.00 0.00 H new ATOM 863 N THR A 359 -2.691 7.387 -6.580 1.00 0.00 N ATOM 864 CA THR A 359 -1.285 7.419 -6.911 1.00 0.00 C ATOM 865 C THR A 359 -0.821 5.996 -7.230 1.00 0.00 C ATOM 866 O THR A 359 -0.553 5.195 -6.332 1.00 0.00 O ATOM 867 CB THR A 359 -0.461 8.026 -5.752 1.00 0.00 C ATOM 868 OG1 THR A 359 -0.665 9.443 -5.706 1.00 0.00 O ATOM 869 CG2 THR A 359 1.023 7.723 -5.887 1.00 0.00 C ATOM 0 H THR A 359 -2.956 6.580 -6.014 1.00 0.00 H new ATOM 0 HA THR A 359 -1.130 8.053 -7.784 1.00 0.00 H new ATOM 0 HB THR A 359 -0.807 7.569 -4.825 1.00 0.00 H new ATOM 0 HG1 THR A 359 -1.108 9.683 -4.866 1.00 0.00 H new ATOM 0 HG21 THR A 359 1.563 8.169 -5.051 1.00 0.00 H new ATOM 0 HG22 THR A 359 1.176 6.644 -5.884 1.00 0.00 H new ATOM 0 HG23 THR A 359 1.396 8.139 -6.823 1.00 0.00 H new ATOM 877 N PRO A 360 -0.756 5.653 -8.524 1.00 0.00 N ATOM 878 CA PRO A 360 -0.430 4.304 -8.972 1.00 0.00 C ATOM 879 C PRO A 360 1.071 4.063 -9.077 1.00 0.00 C ATOM 880 O PRO A 360 1.540 3.318 -9.943 1.00 0.00 O ATOM 881 CB PRO A 360 -1.094 4.235 -10.343 1.00 0.00 C ATOM 882 CG PRO A 360 -1.086 5.640 -10.856 1.00 0.00 C ATOM 883 CD PRO A 360 -1.001 6.559 -9.659 1.00 0.00 C ATOM 0 HA PRO A 360 -0.775 3.541 -8.274 1.00 0.00 H new ATOM 0 HB2 PRO A 360 -0.548 3.569 -11.011 1.00 0.00 H new ATOM 0 HB3 PRO A 360 -2.111 3.849 -10.269 1.00 0.00 H new ATOM 0 HG2 PRO A 360 -0.239 5.800 -11.523 1.00 0.00 H new ATOM 0 HG3 PRO A 360 -1.989 5.843 -11.432 1.00 0.00 H new ATOM 0 HD2 PRO A 360 -0.195 7.285 -9.770 1.00 0.00 H new ATOM 0 HD3 PRO A 360 -1.923 7.125 -9.525 1.00 0.00 H new ATOM 891 N ASN A 361 1.811 4.686 -8.175 1.00 0.00 N ATOM 892 CA ASN A 361 3.260 4.545 -8.122 1.00 0.00 C ATOM 893 C ASN A 361 3.741 4.525 -6.673 1.00 0.00 C ATOM 894 O ASN A 361 4.457 5.425 -6.234 1.00 0.00 O ATOM 895 CB ASN A 361 3.957 5.682 -8.885 1.00 0.00 C ATOM 896 CG ASN A 361 3.796 5.576 -10.391 1.00 0.00 C ATOM 897 OD1 ASN A 361 2.849 6.113 -10.967 1.00 0.00 O ATOM 898 ND2 ASN A 361 4.727 4.889 -11.038 1.00 0.00 N ATOM 0 H ASN A 361 1.427 5.303 -7.459 1.00 0.00 H new ATOM 0 HA ASN A 361 3.519 3.600 -8.599 1.00 0.00 H new ATOM 0 HB2 ASN A 361 3.554 6.637 -8.549 1.00 0.00 H new ATOM 0 HB3 ASN A 361 5.019 5.680 -8.638 1.00 0.00 H new ATOM 0 HD21 ASN A 361 4.675 4.790 -12.052 1.00 0.00 H new ATOM 0 HD22 ASN A 361 5.495 4.460 -10.522 1.00 0.00 H new ATOM 905 N PRO A 362 3.343 3.500 -5.900 1.00 0.00 N ATOM 906 CA PRO A 362 3.771 3.356 -4.515 1.00 0.00 C ATOM 907 C PRO A 362 5.162 2.743 -4.422 1.00 0.00 C ATOM 908 O PRO A 362 5.517 1.844 -5.195 1.00 0.00 O ATOM 909 CB PRO A 362 2.724 2.420 -3.924 1.00 0.00 C ATOM 910 CG PRO A 362 2.296 1.566 -5.067 1.00 0.00 C ATOM 911 CD PRO A 362 2.452 2.398 -6.314 1.00 0.00 C ATOM 0 HA PRO A 362 3.841 4.310 -3.993 1.00 0.00 H new ATOM 0 HB2 PRO A 362 3.140 1.820 -3.115 1.00 0.00 H new ATOM 0 HB3 PRO A 362 1.884 2.977 -3.509 1.00 0.00 H new ATOM 0 HG2 PRO A 362 2.905 0.664 -5.125 1.00 0.00 H new ATOM 0 HG3 PRO A 362 1.262 1.245 -4.944 1.00 0.00 H new ATOM 0 HD2 PRO A 362 2.886 1.818 -7.129 1.00 0.00 H new ATOM 0 HD3 PRO A 362 1.491 2.773 -6.666 1.00 0.00 H new ATOM 919 N THR A 363 5.944 3.204 -3.463 1.00 0.00 N ATOM 920 CA THR A 363 7.323 2.783 -3.347 1.00 0.00 C ATOM 921 C THR A 363 7.691 2.668 -1.874 1.00 0.00 C ATOM 922 O THR A 363 7.150 3.390 -1.032 1.00 0.00 O ATOM 923 CB THR A 363 8.276 3.783 -4.031 1.00 0.00 C ATOM 924 OG1 THR A 363 7.632 4.392 -5.156 1.00 0.00 O ATOM 925 CG2 THR A 363 9.547 3.092 -4.495 1.00 0.00 C ATOM 0 H THR A 363 5.644 3.872 -2.753 1.00 0.00 H new ATOM 0 HA THR A 363 7.427 1.818 -3.842 1.00 0.00 H new ATOM 0 HB THR A 363 8.537 4.549 -3.300 1.00 0.00 H new ATOM 0 HG1 THR A 363 8.247 5.026 -5.581 1.00 0.00 H new ATOM 0 HG21 THR A 363 10.202 3.819 -4.974 1.00 0.00 H new ATOM 0 HG22 THR A 363 10.057 2.654 -3.637 1.00 0.00 H new ATOM 0 HG23 THR A 363 9.295 2.306 -5.207 1.00 0.00 H new ATOM 933 N MET A 364 8.590 1.756 -1.568 1.00 0.00 N ATOM 934 CA MET A 364 9.059 1.607 -0.203 1.00 0.00 C ATOM 935 C MET A 364 10.394 2.268 -0.075 1.00 0.00 C ATOM 936 O MET A 364 11.198 2.192 -0.995 1.00 0.00 O ATOM 937 CB MET A 364 9.173 0.158 0.253 1.00 0.00 C ATOM 938 CG MET A 364 7.846 -0.549 0.419 1.00 0.00 C ATOM 939 SD MET A 364 7.958 -1.938 1.558 1.00 0.00 S ATOM 940 CE MET A 364 9.298 -2.877 0.835 1.00 0.00 C ATOM 0 H MET A 364 9.009 1.111 -2.238 1.00 0.00 H new ATOM 0 HA MET A 364 8.314 2.077 0.439 1.00 0.00 H new ATOM 0 HB2 MET A 364 9.776 -0.392 -0.470 1.00 0.00 H new ATOM 0 HB3 MET A 364 9.708 0.129 1.202 1.00 0.00 H new ATOM 0 HG2 MET A 364 7.101 0.159 0.783 1.00 0.00 H new ATOM 0 HG3 MET A 364 7.501 -0.904 -0.552 1.00 0.00 H new ATOM 0 HE1 MET A 364 9.031 -3.933 0.811 1.00 0.00 H new ATOM 0 HE2 MET A 364 9.482 -2.526 -0.181 1.00 0.00 H new ATOM 0 HE3 MET A 364 10.199 -2.744 1.433 1.00 0.00 H new ATOM 993 N GLY A 368 9.647 2.276 4.889 1.00 0.00 N ATOM 994 CA GLY A 368 8.657 1.394 4.299 1.00 0.00 C ATOM 995 C GLY A 368 7.923 2.101 3.182 1.00 0.00 C ATOM 996 O GLY A 368 8.389 3.135 2.702 1.00 0.00 O ATOM 0 HA2 GLY A 368 9.143 0.497 3.914 1.00 0.00 H new ATOM 0 HA3 GLY A 368 7.948 1.070 5.061 1.00 0.00 H new ATOM 1000 N GLY A 369 6.799 1.549 2.749 1.00 0.00 N ATOM 1001 CA GLY A 369 5.940 2.259 1.830 1.00 0.00 C ATOM 1002 C GLY A 369 5.386 3.505 2.473 1.00 0.00 C ATOM 1003 O GLY A 369 4.507 3.439 3.331 1.00 0.00 O ATOM 0 H GLY A 369 6.468 0.623 3.019 1.00 0.00 H new ATOM 0 HA2 GLY A 369 6.499 2.525 0.933 1.00 0.00 H new ATOM 0 HA3 GLY A 369 5.122 1.611 1.515 1.00 0.00 H new ATOM 1007 N GLY A 370 5.877 4.639 2.028 1.00 0.00 N ATOM 1008 CA GLY A 370 5.606 5.887 2.718 1.00 0.00 C ATOM 1009 C GLY A 370 4.173 6.352 2.555 1.00 0.00 C ATOM 1010 O GLY A 370 3.618 6.997 3.445 1.00 0.00 O ATOM 0 H GLY A 370 6.463 4.727 1.197 1.00 0.00 H new ATOM 0 HA2 GLY A 370 5.824 5.765 3.779 1.00 0.00 H new ATOM 0 HA3 GLY A 370 6.278 6.658 2.341 1.00 0.00 H new ATOM 1014 N PHE A 371 3.574 6.031 1.418 1.00 0.00 N ATOM 1015 CA PHE A 371 2.197 6.412 1.149 1.00 0.00 C ATOM 1016 C PHE A 371 1.639 5.625 -0.020 1.00 0.00 C ATOM 1017 O PHE A 371 2.346 5.336 -0.987 1.00 0.00 O ATOM 1018 CB PHE A 371 2.066 7.918 0.869 1.00 0.00 C ATOM 1019 CG PHE A 371 2.852 8.409 -0.320 1.00 0.00 C ATOM 1020 CD1 PHE A 371 4.195 8.730 -0.197 1.00 0.00 C ATOM 1021 CD2 PHE A 371 2.243 8.554 -1.557 1.00 0.00 C ATOM 1022 CE1 PHE A 371 4.915 9.183 -1.285 1.00 0.00 C ATOM 1023 CE2 PHE A 371 2.958 9.006 -2.649 1.00 0.00 C ATOM 1024 CZ PHE A 371 4.297 9.320 -2.513 1.00 0.00 C ATOM 0 H PHE A 371 4.021 5.507 0.666 1.00 0.00 H new ATOM 0 HA PHE A 371 1.621 6.181 2.045 1.00 0.00 H new ATOM 0 HB2 PHE A 371 1.013 8.155 0.714 1.00 0.00 H new ATOM 0 HB3 PHE A 371 2.389 8.467 1.753 1.00 0.00 H new ATOM 0 HD1 PHE A 371 4.684 8.625 0.760 1.00 0.00 H new ATOM 0 HD2 PHE A 371 1.197 8.311 -1.668 1.00 0.00 H new ATOM 0 HE1 PHE A 371 5.961 9.430 -1.176 1.00 0.00 H new ATOM 0 HE2 PHE A 371 2.472 9.114 -3.607 1.00 0.00 H new ATOM 0 HZ PHE A 371 4.859 9.672 -3.365 1.00 0.00 H new ATOM 1034 N ILE A 372 0.380 5.253 0.094 1.00 0.00 N ATOM 1035 CA ILE A 372 -0.343 4.664 -1.016 1.00 0.00 C ATOM 1036 C ILE A 372 -1.695 5.330 -1.122 1.00 0.00 C ATOM 1037 O ILE A 372 -2.290 5.679 -0.106 1.00 0.00 O ATOM 1038 CB ILE A 372 -0.561 3.153 -0.846 1.00 0.00 C ATOM 1039 CG1 ILE A 372 0.583 2.533 -0.047 1.00 0.00 C ATOM 1040 CG2 ILE A 372 -0.676 2.499 -2.215 1.00 0.00 C ATOM 1041 CD1 ILE A 372 0.445 1.043 0.141 1.00 0.00 C ATOM 0 H ILE A 372 -0.167 5.349 0.950 1.00 0.00 H new ATOM 0 HA ILE A 372 0.256 4.816 -1.914 1.00 0.00 H new ATOM 0 HB ILE A 372 -1.486 2.985 -0.294 1.00 0.00 H new ATOM 0 HG12 ILE A 372 1.525 2.742 -0.554 1.00 0.00 H new ATOM 0 HG13 ILE A 372 0.634 3.012 0.931 1.00 0.00 H new ATOM 0 HG21 ILE A 372 -0.831 1.427 -2.094 1.00 0.00 H new ATOM 0 HG22 ILE A 372 -1.520 2.929 -2.754 1.00 0.00 H new ATOM 0 HG23 ILE A 372 0.241 2.672 -2.779 1.00 0.00 H new ATOM 0 HD11 ILE A 372 1.292 0.669 0.717 1.00 0.00 H new ATOM 0 HD12 ILE A 372 -0.481 0.828 0.675 1.00 0.00 H new ATOM 0 HD13 ILE A 372 0.424 0.554 -0.833 1.00 0.00 H new ATOM 1053 N GLU A 373 -2.182 5.508 -2.335 1.00 0.00 N ATOM 1054 CA GLU A 373 -3.463 6.149 -2.524 1.00 0.00 C ATOM 1055 C GLU A 373 -4.339 5.301 -3.429 1.00 0.00 C ATOM 1056 O GLU A 373 -3.945 4.945 -4.534 1.00 0.00 O ATOM 1057 CB GLU A 373 -3.279 7.556 -3.088 1.00 0.00 C ATOM 1058 CG GLU A 373 -2.421 8.452 -2.207 1.00 0.00 C ATOM 1059 CD GLU A 373 -2.287 9.862 -2.737 1.00 0.00 C ATOM 1060 OE1 GLU A 373 -3.232 10.661 -2.569 1.00 0.00 O ATOM 1061 OE2 GLU A 373 -1.232 10.189 -3.310 1.00 0.00 O ATOM 0 H GLU A 373 -1.714 5.220 -3.194 1.00 0.00 H new ATOM 0 HA GLU A 373 -3.961 6.242 -1.559 1.00 0.00 H new ATOM 0 HB2 GLU A 373 -2.824 7.487 -4.076 1.00 0.00 H new ATOM 0 HB3 GLU A 373 -4.258 8.018 -3.220 1.00 0.00 H new ATOM 0 HG2 GLU A 373 -2.853 8.487 -1.207 1.00 0.00 H new ATOM 0 HG3 GLU A 373 -1.429 8.012 -2.111 1.00 0.00 H new ATOM 1068 N MET A 374 -5.517 4.977 -2.934 1.00 0.00 N ATOM 1069 CA MET A 374 -6.456 4.095 -3.609 1.00 0.00 C ATOM 1070 C MET A 374 -7.865 4.636 -3.423 1.00 0.00 C ATOM 1071 O MET A 374 -8.091 5.458 -2.542 1.00 0.00 O ATOM 1072 CB MET A 374 -6.343 2.671 -3.026 1.00 0.00 C ATOM 1073 CG MET A 374 -6.999 2.485 -1.667 1.00 0.00 C ATOM 1074 SD MET A 374 -8.691 1.867 -1.788 1.00 0.00 S ATOM 1075 CE MET A 374 -9.078 1.569 -0.065 1.00 0.00 C ATOM 0 H MET A 374 -5.857 5.323 -2.037 1.00 0.00 H new ATOM 0 HA MET A 374 -6.227 4.052 -4.674 1.00 0.00 H new ATOM 0 HB2 MET A 374 -6.791 1.969 -3.729 1.00 0.00 H new ATOM 0 HB3 MET A 374 -5.288 2.410 -2.943 1.00 0.00 H new ATOM 0 HG2 MET A 374 -6.405 1.790 -1.073 1.00 0.00 H new ATOM 0 HG3 MET A 374 -7.001 3.437 -1.136 1.00 0.00 H new ATOM 0 HE1 MET A 374 -10.104 1.877 0.136 1.00 0.00 H new ATOM 0 HE2 MET A 374 -8.968 0.507 0.154 1.00 0.00 H new ATOM 0 HE3 MET A 374 -8.398 2.142 0.565 1.00 0.00 H new ATOM 1085 N GLN A 375 -8.792 4.198 -4.259 1.00 0.00 N ATOM 1086 CA GLN A 375 -10.200 4.552 -4.108 1.00 0.00 C ATOM 1087 C GLN A 375 -11.025 3.867 -5.199 1.00 0.00 C ATOM 1088 O GLN A 375 -10.479 3.201 -6.073 1.00 0.00 O ATOM 1089 CB GLN A 375 -10.391 6.088 -4.136 1.00 0.00 C ATOM 1090 CG GLN A 375 -11.770 6.578 -3.696 1.00 0.00 C ATOM 1091 CD GLN A 375 -12.196 6.005 -2.351 1.00 0.00 C ATOM 1092 OE1 GLN A 375 -12.050 6.652 -1.317 1.00 0.00 O ATOM 1093 NE2 GLN A 375 -12.681 4.768 -2.351 1.00 0.00 N ATOM 0 H GLN A 375 -8.596 3.592 -5.056 1.00 0.00 H new ATOM 0 HA GLN A 375 -10.551 4.201 -3.138 1.00 0.00 H new ATOM 0 HB2 GLN A 375 -9.638 6.544 -3.493 1.00 0.00 H new ATOM 0 HB3 GLN A 375 -10.202 6.444 -5.149 1.00 0.00 H new ATOM 0 HG2 GLN A 375 -11.762 7.666 -3.637 1.00 0.00 H new ATOM 0 HG3 GLN A 375 -12.506 6.305 -4.452 1.00 0.00 H new ATOM 0 HE21 GLN A 375 -12.788 4.262 -3.230 1.00 0.00 H new ATOM 0 HE22 GLN A 375 -12.947 4.324 -1.472 1.00 0.00 H new ATOM 1102 N LEU A 376 -12.332 4.028 -5.117 1.00 0.00 N ATOM 1103 CA LEU A 376 -13.286 3.459 -6.039 1.00 0.00 C ATOM 1104 C LEU A 376 -14.600 4.174 -5.761 1.00 0.00 C ATOM 1105 O LEU A 376 -14.744 4.744 -4.676 1.00 0.00 O ATOM 1106 CB LEU A 376 -13.446 1.953 -5.798 1.00 0.00 C ATOM 1107 CG LEU A 376 -14.274 1.212 -6.847 1.00 0.00 C ATOM 1108 CD1 LEU A 376 -13.414 0.848 -8.046 1.00 0.00 C ATOM 1109 CD2 LEU A 376 -14.926 -0.020 -6.247 1.00 0.00 C ATOM 0 H LEU A 376 -12.770 4.579 -4.379 1.00 0.00 H new ATOM 0 HA LEU A 376 -12.962 3.584 -7.072 1.00 0.00 H new ATOM 0 HB2 LEU A 376 -12.455 1.501 -5.754 1.00 0.00 H new ATOM 0 HB3 LEU A 376 -13.908 1.804 -4.822 1.00 0.00 H new ATOM 0 HG LEU A 376 -15.068 1.875 -7.190 1.00 0.00 H new ATOM 0 HD11 LEU A 376 -14.021 0.321 -8.782 1.00 0.00 H new ATOM 0 HD12 LEU A 376 -13.009 1.756 -8.492 1.00 0.00 H new ATOM 0 HD13 LEU A 376 -12.594 0.205 -7.724 1.00 0.00 H new ATOM 0 HD21 LEU A 376 -15.510 -0.532 -7.012 1.00 0.00 H new ATOM 0 HD22 LEU A 376 -14.155 -0.692 -5.869 1.00 0.00 H new ATOM 0 HD23 LEU A 376 -15.581 0.277 -5.428 1.00 0.00 H new ATOM 1121 N PRO A 377 -15.546 4.225 -6.712 1.00 0.00 N ATOM 1122 CA PRO A 377 -16.907 4.671 -6.422 1.00 0.00 C ATOM 1123 C PRO A 377 -17.407 4.084 -5.098 1.00 0.00 C ATOM 1124 O PRO A 377 -17.268 2.881 -4.867 1.00 0.00 O ATOM 1125 CB PRO A 377 -17.696 4.111 -7.601 1.00 0.00 C ATOM 1126 CG PRO A 377 -16.731 4.120 -8.736 1.00 0.00 C ATOM 1127 CD PRO A 377 -15.362 3.906 -8.139 1.00 0.00 C ATOM 0 HA PRO A 377 -16.997 5.752 -6.312 1.00 0.00 H new ATOM 0 HB2 PRO A 377 -18.056 3.103 -7.394 1.00 0.00 H new ATOM 0 HB3 PRO A 377 -18.571 4.723 -7.819 1.00 0.00 H new ATOM 0 HG2 PRO A 377 -16.968 3.334 -9.453 1.00 0.00 H new ATOM 0 HG3 PRO A 377 -16.775 5.067 -9.275 1.00 0.00 H new ATOM 0 HD2 PRO A 377 -15.021 2.880 -8.279 1.00 0.00 H new ATOM 0 HD3 PRO A 377 -14.618 4.555 -8.601 1.00 0.00 H new ATOM 1135 N PRO A 378 -17.988 4.943 -4.224 1.00 0.00 N ATOM 1136 CA PRO A 378 -18.412 4.597 -2.859 1.00 0.00 C ATOM 1137 C PRO A 378 -18.960 3.182 -2.727 1.00 0.00 C ATOM 1138 O PRO A 378 -19.739 2.715 -3.562 1.00 0.00 O ATOM 1139 CB PRO A 378 -19.514 5.624 -2.562 1.00 0.00 C ATOM 1140 CG PRO A 378 -19.512 6.595 -3.705 1.00 0.00 C ATOM 1141 CD PRO A 378 -18.248 6.355 -4.481 1.00 0.00 C ATOM 0 HA PRO A 378 -17.570 4.623 -2.167 1.00 0.00 H new ATOM 0 HB2 PRO A 378 -20.484 5.136 -2.470 1.00 0.00 H new ATOM 0 HB3 PRO A 378 -19.323 6.135 -1.618 1.00 0.00 H new ATOM 0 HG2 PRO A 378 -20.387 6.448 -4.338 1.00 0.00 H new ATOM 0 HG3 PRO A 378 -19.552 7.621 -3.340 1.00 0.00 H new ATOM 0 HD2 PRO A 378 -18.379 6.557 -5.544 1.00 0.00 H new ATOM 0 HD3 PRO A 378 -17.432 6.988 -4.134 1.00 0.00 H new ATOM 1149 N GLY A 379 -18.599 2.533 -1.633 1.00 0.00 N ATOM 1150 CA GLY A 379 -18.721 1.100 -1.525 1.00 0.00 C ATOM 1151 C GLY A 379 -17.719 0.584 -0.516 1.00 0.00 C ATOM 1152 O GLY A 379 -17.179 1.369 0.270 1.00 0.00 O ATOM 0 H GLY A 379 -18.216 2.986 -0.803 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -19.732 0.832 -1.219 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -18.548 0.635 -2.496 1.00 0.00 H new ATOM 1156 N ASP A 380 -17.472 -0.712 -0.499 1.00 0.00 N ATOM 1157 CA ASP A 380 -16.476 -1.265 0.406 1.00 0.00 C ATOM 1158 C ASP A 380 -15.194 -1.586 -0.341 1.00 0.00 C ATOM 1159 O ASP A 380 -15.210 -2.292 -1.351 1.00 0.00 O ATOM 1160 CB ASP A 380 -16.988 -2.541 1.077 1.00 0.00 C ATOM 1161 CG ASP A 380 -18.386 -2.405 1.640 1.00 0.00 C ATOM 1162 OD1 ASP A 380 -18.564 -1.703 2.655 1.00 0.00 O ATOM 1163 OD2 ASP A 380 -19.316 -3.017 1.070 1.00 0.00 O ATOM 0 H ASP A 380 -17.940 -1.397 -1.093 1.00 0.00 H new ATOM 0 HA ASP A 380 -16.278 -0.513 1.170 1.00 0.00 H new ATOM 0 HB2 ASP A 380 -16.974 -3.355 0.352 1.00 0.00 H new ATOM 0 HB3 ASP A 380 -16.306 -2.819 1.881 1.00 0.00 H new ATOM 1168 N ASN A 381 -14.076 -1.108 0.176 1.00 0.00 N ATOM 1169 CA ASN A 381 -12.783 -1.413 -0.414 1.00 0.00 C ATOM 1170 C ASN A 381 -11.884 -2.000 0.671 1.00 0.00 C ATOM 1171 O ASN A 381 -12.220 -1.967 1.846 1.00 0.00 O ATOM 1172 CB ASN A 381 -12.099 -0.169 -1.013 1.00 0.00 C ATOM 1173 CG ASN A 381 -12.925 0.595 -2.043 1.00 0.00 C ATOM 1174 OD1 ASN A 381 -12.701 1.784 -2.258 1.00 0.00 O ATOM 1175 ND2 ASN A 381 -13.883 -0.061 -2.676 1.00 0.00 N ATOM 0 H ASN A 381 -14.036 -0.509 1.001 1.00 0.00 H new ATOM 0 HA ASN A 381 -12.943 -2.120 -1.228 1.00 0.00 H new ATOM 0 HB2 ASN A 381 -11.842 0.511 -0.201 1.00 0.00 H new ATOM 0 HB3 ASN A 381 -11.163 -0.478 -1.478 1.00 0.00 H new ATOM 0 HD21 ASN A 381 -14.461 0.420 -3.365 1.00 0.00 H new ATOM 0 HD22 ASN A 381 -14.044 -1.048 -2.475 1.00 0.00 H new ATOM 1182 N ILE A 382 -10.778 -2.588 0.277 1.00 0.00 N ATOM 1183 CA ILE A 382 -9.728 -2.974 1.217 1.00 0.00 C ATOM 1184 C ILE A 382 -8.443 -3.142 0.452 1.00 0.00 C ATOM 1185 O ILE A 382 -8.457 -3.685 -0.641 1.00 0.00 O ATOM 1186 CB ILE A 382 -10.078 -4.269 2.023 1.00 0.00 C ATOM 1187 CG1 ILE A 382 -8.837 -5.093 2.406 1.00 0.00 C ATOM 1188 CG2 ILE A 382 -11.029 -5.140 1.256 1.00 0.00 C ATOM 1189 CD1 ILE A 382 -8.368 -6.036 1.324 1.00 0.00 C ATOM 0 H ILE A 382 -10.573 -2.815 -0.696 1.00 0.00 H new ATOM 0 HA ILE A 382 -9.625 -2.185 1.962 1.00 0.00 H new ATOM 0 HB ILE A 382 -10.548 -3.927 2.945 1.00 0.00 H new ATOM 0 HG12 ILE A 382 -8.024 -4.411 2.657 1.00 0.00 H new ATOM 0 HG13 ILE A 382 -9.059 -5.669 3.304 1.00 0.00 H new ATOM 0 HG21 ILE A 382 -11.255 -6.033 1.839 1.00 0.00 H new ATOM 0 HG22 ILE A 382 -11.950 -4.590 1.062 1.00 0.00 H new ATOM 0 HG23 ILE A 382 -10.573 -5.431 0.309 1.00 0.00 H new ATOM 0 HD11 ILE A 382 -7.490 -6.580 1.671 1.00 0.00 H new ATOM 0 HD12 ILE A 382 -9.163 -6.743 1.088 1.00 0.00 H new ATOM 0 HD13 ILE A 382 -8.112 -5.466 0.431 1.00 0.00 H new ATOM 1201 N ILE A 383 -7.336 -2.712 1.023 1.00 0.00 N ATOM 1202 CA ILE A 383 -6.087 -2.754 0.287 1.00 0.00 C ATOM 1203 C ILE A 383 -5.313 -4.005 0.654 1.00 0.00 C ATOM 1204 O ILE A 383 -5.246 -4.395 1.828 1.00 0.00 O ATOM 1205 CB ILE A 383 -5.191 -1.516 0.533 1.00 0.00 C ATOM 1206 CG1 ILE A 383 -5.999 -0.222 0.410 1.00 0.00 C ATOM 1207 CG2 ILE A 383 -4.033 -1.493 -0.455 1.00 0.00 C ATOM 1208 CD1 ILE A 383 -5.236 1.011 0.854 1.00 0.00 C ATOM 0 H ILE A 383 -7.273 -2.338 1.970 1.00 0.00 H new ATOM 0 HA ILE A 383 -6.353 -2.758 -0.770 1.00 0.00 H new ATOM 0 HB ILE A 383 -4.796 -1.585 1.547 1.00 0.00 H new ATOM 0 HG12 ILE A 383 -6.309 -0.094 -0.627 1.00 0.00 H new ATOM 0 HG13 ILE A 383 -6.907 -0.312 1.006 1.00 0.00 H new ATOM 0 HG21 ILE A 383 -3.413 -0.616 -0.268 1.00 0.00 H new ATOM 0 HG22 ILE A 383 -3.433 -2.395 -0.333 1.00 0.00 H new ATOM 0 HG23 ILE A 383 -4.423 -1.452 -1.472 1.00 0.00 H new ATOM 0 HD11 ILE A 383 -5.869 1.891 0.740 1.00 0.00 H new ATOM 0 HD12 ILE A 383 -4.949 0.904 1.900 1.00 0.00 H new ATOM 0 HD13 ILE A 383 -4.341 1.125 0.242 1.00 0.00 H new ATOM 1220 N TYR A 384 -4.790 -4.648 -0.371 1.00 0.00 N ATOM 1221 CA TYR A 384 -3.812 -5.687 -0.220 1.00 0.00 C ATOM 1222 C TYR A 384 -2.468 -5.118 -0.619 1.00 0.00 C ATOM 1223 O TYR A 384 -2.324 -4.538 -1.698 1.00 0.00 O ATOM 1224 CB TYR A 384 -4.134 -6.889 -1.105 1.00 0.00 C ATOM 1225 CG TYR A 384 -4.842 -8.028 -0.407 1.00 0.00 C ATOM 1226 CD1 TYR A 384 -6.225 -8.067 -0.314 1.00 0.00 C ATOM 1227 CD2 TYR A 384 -4.117 -9.080 0.139 1.00 0.00 C ATOM 1228 CE1 TYR A 384 -6.867 -9.123 0.303 1.00 0.00 C ATOM 1229 CE2 TYR A 384 -4.751 -10.136 0.761 1.00 0.00 C ATOM 1230 CZ TYR A 384 -6.125 -10.153 0.839 1.00 0.00 C ATOM 1231 OH TYR A 384 -6.762 -11.209 1.447 1.00 0.00 O ATOM 0 H TYR A 384 -5.041 -4.455 -1.341 1.00 0.00 H new ATOM 0 HA TYR A 384 -3.807 -6.029 0.815 1.00 0.00 H new ATOM 0 HB2 TYR A 384 -4.753 -6.553 -1.937 1.00 0.00 H new ATOM 0 HB3 TYR A 384 -3.204 -7.266 -1.531 1.00 0.00 H new ATOM 0 HD1 TYR A 384 -6.809 -7.260 -0.730 1.00 0.00 H new ATOM 0 HD2 TYR A 384 -3.039 -9.071 0.075 1.00 0.00 H new ATOM 0 HE1 TYR A 384 -7.945 -9.141 0.365 1.00 0.00 H new ATOM 0 HE2 TYR A 384 -4.173 -10.944 1.184 1.00 0.00 H new ATOM 0 HH TYR A 384 -6.096 -11.850 1.771 1.00 0.00 H new ATOM 1241 N VAL A 385 -1.493 -5.296 0.230 1.00 0.00 N ATOM 1242 CA VAL A 385 -0.166 -4.804 -0.044 1.00 0.00 C ATOM 1243 C VAL A 385 0.727 -6.009 -0.109 1.00 0.00 C ATOM 1244 O VAL A 385 1.379 -6.379 0.868 1.00 0.00 O ATOM 1245 CB VAL A 385 0.342 -3.812 1.020 1.00 0.00 C ATOM 1246 CG1 VAL A 385 1.568 -3.086 0.504 1.00 0.00 C ATOM 1247 CG2 VAL A 385 -0.742 -2.817 1.390 1.00 0.00 C ATOM 0 H VAL A 385 -1.591 -5.780 1.122 1.00 0.00 H new ATOM 0 HA VAL A 385 -0.170 -4.245 -0.980 1.00 0.00 H new ATOM 0 HB VAL A 385 0.610 -4.371 1.916 1.00 0.00 H new ATOM 0 HG11 VAL A 385 1.922 -2.386 1.261 1.00 0.00 H new ATOM 0 HG12 VAL A 385 2.353 -3.809 0.283 1.00 0.00 H new ATOM 0 HG13 VAL A 385 1.312 -2.540 -0.404 1.00 0.00 H new ATOM 0 HG21 VAL A 385 -0.361 -2.127 2.143 1.00 0.00 H new ATOM 0 HG22 VAL A 385 -1.041 -2.258 0.503 1.00 0.00 H new ATOM 0 HG23 VAL A 385 -1.604 -3.350 1.790 1.00 0.00 H new ATOM 1257 N GLY A 386 0.725 -6.641 -1.263 1.00 0.00 N ATOM 1258 CA GLY A 386 1.197 -7.990 -1.341 1.00 0.00 C ATOM 1259 C GLY A 386 0.291 -8.916 -0.554 1.00 0.00 C ATOM 1260 O GLY A 386 -0.845 -9.173 -0.964 1.00 0.00 O ATOM 0 H GLY A 386 0.404 -6.241 -2.145 1.00 0.00 H new ATOM 0 HA2 GLY A 386 1.236 -8.308 -2.383 1.00 0.00 H new ATOM 0 HA3 GLY A 386 2.213 -8.049 -0.952 1.00 0.00 H new ATOM 1264 N ASP A 387 0.782 -9.411 0.576 1.00 0.00 N ATOM 1265 CA ASP A 387 -0.025 -10.261 1.448 1.00 0.00 C ATOM 1266 C ASP A 387 -0.718 -9.445 2.545 1.00 0.00 C ATOM 1267 O ASP A 387 -1.594 -9.955 3.245 1.00 0.00 O ATOM 1268 CB ASP A 387 0.844 -11.362 2.063 1.00 0.00 C ATOM 1269 CG ASP A 387 0.023 -12.492 2.655 1.00 0.00 C ATOM 1270 OD1 ASP A 387 -0.656 -13.202 1.880 1.00 0.00 O ATOM 1271 OD2 ASP A 387 0.063 -12.686 3.890 1.00 0.00 O ATOM 0 H ASP A 387 1.730 -9.240 0.910 1.00 0.00 H new ATOM 0 HA ASP A 387 -0.804 -10.722 0.841 1.00 0.00 H new ATOM 0 HB2 ASP A 387 1.510 -11.763 1.299 1.00 0.00 H new ATOM 0 HB3 ASP A 387 1.474 -10.930 2.840 1.00 0.00 H new ATOM 1276 N LEU A 388 -0.331 -8.176 2.690 1.00 0.00 N ATOM 1277 CA LEU A 388 -0.983 -7.289 3.657 1.00 0.00 C ATOM 1278 C LEU A 388 -2.432 -7.069 3.237 1.00 0.00 C ATOM 1279 O LEU A 388 -2.731 -7.040 2.049 1.00 0.00 O ATOM 1280 CB LEU A 388 -0.279 -5.927 3.725 1.00 0.00 C ATOM 1281 CG LEU A 388 0.234 -5.477 5.101 1.00 0.00 C ATOM 1282 CD1 LEU A 388 1.336 -6.382 5.618 1.00 0.00 C ATOM 1283 CD2 LEU A 388 0.736 -4.054 5.019 1.00 0.00 C ATOM 0 H LEU A 388 0.423 -7.742 2.157 1.00 0.00 H new ATOM 0 HA LEU A 388 -0.932 -7.759 4.639 1.00 0.00 H new ATOM 0 HB2 LEU A 388 0.567 -5.948 3.038 1.00 0.00 H new ATOM 0 HB3 LEU A 388 -0.970 -5.169 3.356 1.00 0.00 H new ATOM 0 HG LEU A 388 -0.599 -5.537 5.801 1.00 0.00 H new ATOM 0 HD11 LEU A 388 1.670 -6.028 6.593 1.00 0.00 H new ATOM 0 HD12 LEU A 388 0.957 -7.400 5.712 1.00 0.00 H new ATOM 0 HD13 LEU A 388 2.174 -6.370 4.921 1.00 0.00 H new ATOM 0 HD21 LEU A 388 1.099 -3.739 5.997 1.00 0.00 H new ATOM 0 HD22 LEU A 388 1.549 -3.996 4.295 1.00 0.00 H new ATOM 0 HD23 LEU A 388 -0.077 -3.399 4.706 1.00 0.00 H new ATOM 1295 N ASN A 389 -3.318 -6.911 4.202 1.00 0.00 N ATOM 1296 CA ASN A 389 -4.728 -6.660 3.901 1.00 0.00 C ATOM 1297 C ASN A 389 -5.420 -5.977 5.063 1.00 0.00 C ATOM 1298 O ASN A 389 -5.070 -6.203 6.221 1.00 0.00 O ATOM 1299 CB ASN A 389 -5.477 -7.956 3.544 1.00 0.00 C ATOM 1300 CG ASN A 389 -5.504 -8.984 4.668 1.00 0.00 C ATOM 1301 OD1 ASN A 389 -4.590 -9.064 5.490 1.00 0.00 O ATOM 1302 ND2 ASN A 389 -6.561 -9.782 4.710 1.00 0.00 N ATOM 0 H ASN A 389 -3.096 -6.950 5.197 1.00 0.00 H new ATOM 0 HA ASN A 389 -4.751 -6.001 3.033 1.00 0.00 H new ATOM 0 HB2 ASN A 389 -6.502 -7.707 3.268 1.00 0.00 H new ATOM 0 HB3 ASN A 389 -5.010 -8.404 2.667 1.00 0.00 H new ATOM 0 HD21 ASN A 389 -6.636 -10.491 5.440 1.00 0.00 H new ATOM 0 HD22 ASN A 389 -7.299 -9.688 4.013 1.00 0.00 H new ATOM 1309 N HIS A 390 -6.397 -5.135 4.749 1.00 0.00 N ATOM 1310 CA HIS A 390 -7.189 -4.462 5.775 1.00 0.00 C ATOM 1311 C HIS A 390 -8.342 -3.709 5.123 1.00 0.00 C ATOM 1312 O HIS A 390 -8.121 -2.869 4.243 1.00 0.00 O ATOM 1313 CB HIS A 390 -6.332 -3.501 6.598 1.00 0.00 C ATOM 1314 CG HIS A 390 -6.913 -3.224 7.953 1.00 0.00 C ATOM 1315 ND1 HIS A 390 -6.479 -3.847 9.103 1.00 0.00 N ATOM 1316 CD2 HIS A 390 -7.913 -2.394 8.336 1.00 0.00 C ATOM 1317 CE1 HIS A 390 -7.186 -3.415 10.129 1.00 0.00 C ATOM 1318 NE2 HIS A 390 -8.060 -2.532 9.692 1.00 0.00 N ATOM 0 H HIS A 390 -6.661 -4.901 3.792 1.00 0.00 H new ATOM 0 HA HIS A 390 -7.585 -5.219 6.452 1.00 0.00 H new ATOM 0 HB2 HIS A 390 -5.333 -3.920 6.714 1.00 0.00 H new ATOM 0 HB3 HIS A 390 -6.223 -2.562 6.055 1.00 0.00 H new ATOM 0 HD2 HIS A 390 -8.488 -1.744 7.693 1.00 0.00 H new ATOM 0 HE1 HIS A 390 -7.068 -3.732 11.155 1.00 0.00 H new ATOM 0 HE2 HIS A 390 -8.736 -2.032 10.269 1.00 0.00 H new ATOM 1327 N GLN A 391 -9.564 -4.036 5.531 1.00 0.00 N ATOM 1328 CA GLN A 391 -10.762 -3.499 4.903 1.00 0.00 C ATOM 1329 C GLN A 391 -11.078 -2.083 5.372 1.00 0.00 C ATOM 1330 O GLN A 391 -10.758 -1.694 6.497 1.00 0.00 O ATOM 1331 CB GLN A 391 -11.960 -4.414 5.173 1.00 0.00 C ATOM 1332 CG GLN A 391 -13.179 -4.078 4.324 1.00 0.00 C ATOM 1333 CD GLN A 391 -14.426 -4.836 4.730 1.00 0.00 C ATOM 1334 OE1 GLN A 391 -15.535 -4.333 4.578 1.00 0.00 O ATOM 1335 NE2 GLN A 391 -14.261 -6.046 5.233 1.00 0.00 N ATOM 0 H GLN A 391 -9.749 -4.677 6.302 1.00 0.00 H new ATOM 0 HA GLN A 391 -10.567 -3.455 3.831 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -11.669 -5.447 4.985 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -12.230 -4.346 6.227 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -13.376 -3.008 4.392 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -12.955 -4.295 3.280 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -13.322 -6.429 5.343 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -15.073 -6.598 5.511 1.00 0.00 H new ATOM 1344 N TRP A 392 -11.723 -1.335 4.487 1.00 0.00 N ATOM 1345 CA TRP A 392 -12.160 0.022 4.756 1.00 0.00 C ATOM 1346 C TRP A 392 -13.441 0.304 3.975 1.00 0.00 C ATOM 1347 O TRP A 392 -13.532 0.028 2.781 1.00 0.00 O ATOM 1348 CB TRP A 392 -11.062 1.022 4.365 1.00 0.00 C ATOM 1349 CG TRP A 392 -11.532 2.445 4.281 1.00 0.00 C ATOM 1350 CD1 TRP A 392 -11.779 3.155 3.142 1.00 0.00 C ATOM 1351 CD2 TRP A 392 -11.814 3.330 5.373 1.00 0.00 C ATOM 1352 NE1 TRP A 392 -12.191 4.425 3.456 1.00 0.00 N ATOM 1353 CE2 TRP A 392 -12.224 4.557 4.818 1.00 0.00 C ATOM 1354 CE3 TRP A 392 -11.762 3.205 6.762 1.00 0.00 C ATOM 1355 CZ2 TRP A 392 -12.576 5.649 5.605 1.00 0.00 C ATOM 1356 CZ3 TRP A 392 -12.112 4.290 7.542 1.00 0.00 C ATOM 1357 CH2 TRP A 392 -12.517 5.498 6.962 1.00 0.00 C ATOM 0 H TRP A 392 -11.959 -1.661 3.550 1.00 0.00 H new ATOM 0 HA TRP A 392 -12.358 0.133 5.822 1.00 0.00 H new ATOM 0 HB2 TRP A 392 -10.253 0.960 5.093 1.00 0.00 H new ATOM 0 HB3 TRP A 392 -10.646 0.730 3.401 1.00 0.00 H new ATOM 0 HD1 TRP A 392 -11.666 2.772 2.138 1.00 0.00 H new ATOM 0 HE1 TRP A 392 -12.433 5.153 2.784 1.00 0.00 H new ATOM 0 HE3 TRP A 392 -11.454 2.276 7.219 1.00 0.00 H new ATOM 0 HZ2 TRP A 392 -12.885 6.583 5.159 1.00 0.00 H new ATOM 0 HZ3 TRP A 392 -12.073 4.205 8.618 1.00 0.00 H new ATOM 0 HH2 TRP A 392 -12.788 6.327 7.599 1.00 0.00 H new ATOM 1368 N PHE A 393 -14.426 0.864 4.638 1.00 0.00 N ATOM 1369 CA PHE A 393 -15.676 1.173 3.981 1.00 0.00 C ATOM 1370 C PHE A 393 -15.668 2.650 3.625 1.00 0.00 C ATOM 1371 O PHE A 393 -15.721 3.507 4.505 1.00 0.00 O ATOM 1372 CB PHE A 393 -16.879 0.799 4.870 1.00 0.00 C ATOM 1373 CG PHE A 393 -16.923 1.477 6.215 1.00 0.00 C ATOM 1374 CD1 PHE A 393 -16.056 1.105 7.231 1.00 0.00 C ATOM 1375 CD2 PHE A 393 -17.841 2.486 6.462 1.00 0.00 C ATOM 1376 CE1 PHE A 393 -16.104 1.728 8.464 1.00 0.00 C ATOM 1377 CE2 PHE A 393 -17.893 3.112 7.692 1.00 0.00 C ATOM 1378 CZ PHE A 393 -17.023 2.733 8.694 1.00 0.00 C ATOM 0 H PHE A 393 -14.388 1.114 5.626 1.00 0.00 H new ATOM 0 HA PHE A 393 -15.779 0.583 3.070 1.00 0.00 H new ATOM 0 HB2 PHE A 393 -17.796 1.038 4.331 1.00 0.00 H new ATOM 0 HB3 PHE A 393 -16.873 -0.280 5.026 1.00 0.00 H new ATOM 0 HD1 PHE A 393 -15.335 0.320 7.057 1.00 0.00 H new ATOM 0 HD2 PHE A 393 -18.525 2.787 5.682 1.00 0.00 H new ATOM 0 HE1 PHE A 393 -15.423 1.429 9.247 1.00 0.00 H new ATOM 0 HE2 PHE A 393 -18.613 3.897 7.869 1.00 0.00 H new ATOM 0 HZ PHE A 393 -17.061 3.222 9.656 1.00 0.00 H new ATOM 1388 N GLN A 394 -15.559 2.971 2.341 1.00 0.00 N ATOM 1389 CA GLN A 394 -15.329 4.345 1.941 1.00 0.00 C ATOM 1390 C GLN A 394 -16.637 5.010 1.544 1.00 0.00 C ATOM 1391 O GLN A 394 -17.410 4.477 0.744 1.00 0.00 O ATOM 1392 CB GLN A 394 -14.268 4.453 0.816 1.00 0.00 C ATOM 1393 CG GLN A 394 -14.312 3.386 -0.282 1.00 0.00 C ATOM 1394 CD GLN A 394 -15.342 3.694 -1.339 1.00 0.00 C ATOM 1395 OE1 GLN A 394 -15.865 2.799 -1.992 1.00 0.00 O ATOM 1396 NE2 GLN A 394 -15.645 4.975 -1.501 1.00 0.00 N ATOM 0 H GLN A 394 -15.626 2.305 1.571 1.00 0.00 H new ATOM 0 HA GLN A 394 -14.924 4.878 2.801 1.00 0.00 H new ATOM 0 HB2 GLN A 394 -14.372 5.430 0.344 1.00 0.00 H new ATOM 0 HB3 GLN A 394 -13.281 4.425 1.277 1.00 0.00 H new ATOM 0 HG2 GLN A 394 -13.330 3.306 -0.748 1.00 0.00 H new ATOM 0 HG3 GLN A 394 -14.532 2.417 0.165 1.00 0.00 H new ATOM 0 HE21 GLN A 394 -15.182 5.684 -0.933 1.00 0.00 H new ATOM 0 HE22 GLN A 394 -16.341 5.251 -2.194 1.00 0.00 H new ATOM 1405 N LYS A 395 -16.897 6.149 2.151 1.00 0.00 N ATOM 1406 CA LYS A 395 -18.120 6.892 1.910 1.00 0.00 C ATOM 1407 C LYS A 395 -17.869 8.378 2.118 1.00 0.00 C ATOM 1408 O LYS A 395 -17.461 8.753 3.235 1.00 0.00 O ATOM 1409 CB LYS A 395 -19.223 6.392 2.852 1.00 0.00 C ATOM 1410 CG LYS A 395 -20.529 7.162 2.744 1.00 0.00 C ATOM 1411 CD LYS A 395 -21.645 6.493 3.537 1.00 0.00 C ATOM 1412 CE LYS A 395 -21.958 5.102 3.005 1.00 0.00 C ATOM 1413 NZ LYS A 395 -22.379 5.131 1.579 1.00 0.00 N ATOM 1414 OXT LYS A 395 -18.069 9.159 1.166 1.00 0.00 O ATOM 0 H LYS A 395 -16.269 6.587 2.825 1.00 0.00 H new ATOM 0 HA LYS A 395 -18.444 6.736 0.881 1.00 0.00 H new ATOM 0 HB2 LYS A 395 -19.416 5.340 2.642 1.00 0.00 H new ATOM 0 HB3 LYS A 395 -18.863 6.451 3.879 1.00 0.00 H new ATOM 0 HG2 LYS A 395 -20.383 8.179 3.108 1.00 0.00 H new ATOM 0 HG3 LYS A 395 -20.821 7.237 1.697 1.00 0.00 H new ATOM 0 HD2 LYS A 395 -21.356 6.425 4.586 1.00 0.00 H new ATOM 0 HD3 LYS A 395 -22.543 7.110 3.493 1.00 0.00 H new ATOM 0 HE2 LYS A 395 -21.078 4.468 3.110 1.00 0.00 H new ATOM 0 HE3 LYS A 395 -22.748 4.653 3.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 -22.790 4.212 1.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 -23.089 5.879 1.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 -21.553 5.323 0.977 1.00 0.00 H new