USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 949 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 19 MET CE :methyl 133:sc= -4.43! (180deg=-4.41!) USER MOD Set 1.2: B 367 THR OG1 : rot 112:sc= -2.34 USER MOD Set 1.3: B 379 SER OG : rot 135:sc= -4.79! USER MOD Set 2.1: B 357 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: B 373 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: B 352 SER OG : rot -82:sc= -3.98! USER MOD Set 3.2: B 355 ASN : amide:sc= -5.03! C(o=-9!,f=-11!) USER MOD Set 4.1: B 333 THR OG1 : rot -145:sc= -2.6! USER MOD Set 4.2: B 336 CYS SG : rot 180:sc= -0.504! USER MOD Set 5.1: B 311 SER OG : rot -120:sc= -0.402 USER MOD Set 5.2: B 395 TYR OH : rot -45:sc= 0.803 USER MOD Single : A 10 GLN :FLIP amide:sc= 0 F(o=-1.3!,f=0) USER MOD Single : A 11 MET CE :methyl -144:sc= -2.28! (180deg=-4.8!) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -160:sc= -4.1! USER MOD Single : A 23 THR OG1 : rot 180:sc= -0.361 USER MOD Single : A 24 GLN :FLIP amide:sc= -0.918 F(o=-2.4!,f=-0.92) USER MOD Single : A 25 SER OG : rot 180:sc= -0.128 USER MOD Single : A 30 THR OG1 : rot -5:sc= 0.334 USER MOD Single : B 308 TYR OH : rot 30:sc= -0.353 USER MOD Single : B 316 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 318 LYS NZ :NH3+ 150:sc= 1.29 (180deg=1.15) USER MOD Single : B 319 MET CE :methyl -102:sc= -2.09! (180deg=-3.12) USER MOD Single : B 320 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 322 LYS NZ :NH3+ -160:sc= -1.01 (180deg=-1.75) USER MOD Single : B 323 ASN : amide:sc= -2.14 K(o=-2.1,f=-4.8!) USER MOD Single : B 324 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 334 LYS NZ :NH3+ -139:sc= -0.497 (180deg=-1.61!) USER MOD Single : B 338 MET CE :methyl -142:sc= -0.237 (180deg=-4.39!) USER MOD Single : B 343 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 344 THR OG1 : rot -150:sc= -0.618 USER MOD Single : B 345 LYS NZ :NH3+ -120:sc= -0.063 (180deg=-0.458) USER MOD Single : B 349 GLN :FLIP amide:sc= -0.143 F(o=-1.4,f=-0.14) USER MOD Single : B 354 THR OG1 : rot -47:sc= -0.194 USER MOD Single : B 362 SER OG : rot -170:sc= -0.714 USER MOD Single : B 364 LYS NZ :NH3+ -113:sc= -0.562 (180deg=-1.47) USER MOD Single : B 365 SER OG : rot 129:sc= 1.37 USER MOD Single : B 374 GLN : amide:sc= -0.0171 X(o=-0.017,f=-0.012) USER MOD Single : B 377 TYR OH : rot 180:sc= -3.16! USER MOD Single : B 378 TYR OH : rot 180:sc= 0 USER MOD Single : B 381 GLN :FLIP amide:sc= -0.182 F(o=-0.68,f=-0.18) USER MOD Single : B 382 THR OG1 : rot 180:sc= 0.59 USER MOD Single : B 383 THR OG1 : rot 180:sc= 0.0683 USER MOD Single : B 387 GLN : amide:sc= -0.0449 K(o=-0.045,f=-2.6!) USER MOD Single : B 390 GLN : amide:sc= -8.01! C(o=-8!,f=-15!) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 7 15.713 11.903 1.118 1.00 0.00 N ATOM 2 CA ASP A 7 15.243 13.307 1.276 1.00 0.00 C ATOM 3 C ASP A 7 14.253 13.378 2.432 1.00 0.00 C ATOM 4 O ASP A 7 14.581 13.870 3.513 1.00 0.00 O ATOM 5 CB ASP A 7 14.566 13.765 -0.018 1.00 0.00 C ATOM 6 CG ASP A 7 13.695 12.644 -0.576 1.00 0.00 C ATOM 7 OD1 ASP A 7 14.248 11.624 -0.952 1.00 0.00 O1- ATOM 8 OD2 ASP A 7 12.489 12.823 -0.620 1.00 0.00 O ATOM 0 HA ASP A 7 16.091 13.959 1.487 1.00 0.00 H new ATOM 0 HB2 ASP A 7 13.957 14.649 0.173 1.00 0.00 H new ATOM 0 HB3 ASP A 7 15.320 14.050 -0.751 1.00 0.00 H new ATOM 15 N ILE A 8 13.045 12.875 2.197 1.00 0.00 N ATOM 16 CA ILE A 8 12.008 12.881 3.222 1.00 0.00 C ATOM 17 C ILE A 8 11.722 14.303 3.686 1.00 0.00 C ATOM 18 O ILE A 8 12.609 15.155 3.693 1.00 0.00 O ATOM 19 CB ILE A 8 12.445 12.038 4.420 1.00 0.00 C ATOM 20 CG1 ILE A 8 13.080 10.739 3.921 1.00 0.00 C ATOM 21 CG2 ILE A 8 11.239 11.712 5.303 1.00 0.00 C ATOM 22 CD1 ILE A 8 13.440 9.852 5.113 1.00 0.00 C ATOM 0 H ILE A 8 12.761 12.460 1.310 1.00 0.00 H new ATOM 0 HA ILE A 8 11.101 12.457 2.790 1.00 0.00 H new ATOM 0 HB ILE A 8 13.171 12.601 5.007 1.00 0.00 H new ATOM 0 HG12 ILE A 8 12.389 10.215 3.261 1.00 0.00 H new ATOM 0 HG13 ILE A 8 13.973 10.960 3.337 1.00 0.00 H new ATOM 0 HG21 ILE A 8 11.562 11.111 6.153 1.00 0.00 H new ATOM 0 HG22 ILE A 8 10.791 12.638 5.663 1.00 0.00 H new ATOM 0 HG23 ILE A 8 10.504 11.154 4.723 1.00 0.00 H new ATOM 0 HD11 ILE A 8 13.892 8.927 4.755 1.00 0.00 H new ATOM 0 HD12 ILE A 8 14.147 10.376 5.756 1.00 0.00 H new ATOM 0 HD13 ILE A 8 12.538 9.619 5.679 1.00 0.00 H new ATOM 34 N ASP A 9 10.479 14.544 4.077 1.00 0.00 N ATOM 35 CA ASP A 9 10.074 15.864 4.548 1.00 0.00 C ATOM 36 C ASP A 9 8.625 15.850 5.030 1.00 0.00 C ATOM 37 O ASP A 9 8.357 15.679 6.220 1.00 0.00 O ATOM 38 CB ASP A 9 10.230 16.887 3.423 1.00 0.00 C ATOM 39 CG ASP A 9 9.658 18.232 3.857 1.00 0.00 C ATOM 40 OD1 ASP A 9 8.444 18.341 3.925 1.00 0.00 O ATOM 41 OD2 ASP A 9 10.440 19.130 4.118 1.00 0.00 O1- ATOM 0 H ASP A 9 9.735 13.847 4.078 1.00 0.00 H new ATOM 0 HA ASP A 9 10.715 16.140 5.385 1.00 0.00 H new ATOM 0 HB2 ASP A 9 11.283 16.997 3.164 1.00 0.00 H new ATOM 0 HB3 ASP A 9 9.717 16.536 2.528 1.00 0.00 H new ATOM 46 N GLN A 10 7.694 16.040 4.099 1.00 0.00 N ATOM 47 CA GLN A 10 6.272 16.059 4.434 1.00 0.00 C ATOM 48 C GLN A 10 5.597 14.762 4.014 1.00 0.00 C ATOM 49 O GLN A 10 4.517 14.441 4.506 1.00 0.00 O ATOM 50 CB GLN A 10 5.588 17.231 3.730 1.00 0.00 C ATOM 51 CG GLN A 10 5.422 18.389 4.714 1.00 0.00 C ATOM 52 CD GLN A 10 4.778 19.581 4.015 1.00 0.00 C ATOM 53 OE1 GLN A 10 4.514 19.513 2.739 1.00 0.00 O flip ATOM 54 NE2 GLN A 10 4.509 20.602 4.648 1.00 0.00 N flip ATOM 0 H GLN A 10 7.897 16.183 3.110 1.00 0.00 H new ATOM 0 HA GLN A 10 6.180 16.170 5.514 1.00 0.00 H new ATOM 0 HB2 GLN A 10 6.181 17.550 2.873 1.00 0.00 H new ATOM 0 HB3 GLN A 10 4.615 16.922 3.348 1.00 0.00 H new ATOM 0 HG2 GLN A 10 4.806 18.075 5.557 1.00 0.00 H new ATOM 0 HG3 GLN A 10 6.393 18.675 5.118 1.00 0.00 H new ATOM 0 HE21 GLN A 10 4.716 20.653 5.645 1.00 0.00 H new ATOM 0 HE22 GLN A 10 4.079 21.397 4.175 1.00 0.00 H new ATOM 63 N MET A 11 6.252 14.040 3.100 1.00 0.00 N ATOM 64 CA MET A 11 5.749 12.768 2.579 1.00 0.00 C ATOM 65 C MET A 11 4.629 12.207 3.432 1.00 0.00 C ATOM 66 O MET A 11 3.501 12.045 2.969 1.00 0.00 O ATOM 67 CB MET A 11 6.893 11.757 2.521 1.00 0.00 C ATOM 68 CG MET A 11 7.990 12.271 1.585 1.00 0.00 C ATOM 69 SD MET A 11 8.998 10.880 1.012 1.00 0.00 S ATOM 70 CE MET A 11 9.250 10.093 2.623 1.00 0.00 C ATOM 0 H MET A 11 7.147 14.323 2.701 1.00 0.00 H new ATOM 0 HA MET A 11 5.349 12.952 1.582 1.00 0.00 H new ATOM 0 HB2 MET A 11 7.300 11.596 3.519 1.00 0.00 H new ATOM 0 HB3 MET A 11 6.523 10.794 2.169 1.00 0.00 H new ATOM 0 HG2 MET A 11 7.544 12.786 0.734 1.00 0.00 H new ATOM 0 HG3 MET A 11 8.615 12.997 2.105 1.00 0.00 H new ATOM 0 HE1 MET A 11 10.252 9.667 2.667 1.00 0.00 H new ATOM 0 HE2 MET A 11 9.137 10.836 3.413 1.00 0.00 H new ATOM 0 HE3 MET A 11 8.513 9.302 2.761 1.00 0.00 H new ATOM 80 N PHE A 12 4.948 11.930 4.680 1.00 0.00 N ATOM 81 CA PHE A 12 3.962 11.404 5.602 1.00 0.00 C ATOM 82 C PHE A 12 2.634 12.117 5.413 1.00 0.00 C ATOM 83 O PHE A 12 1.635 11.502 5.047 1.00 0.00 O ATOM 84 CB PHE A 12 4.445 11.611 7.023 1.00 0.00 C ATOM 85 CG PHE A 12 5.915 11.348 7.064 1.00 0.00 C ATOM 86 CD1 PHE A 12 6.372 10.035 6.988 1.00 0.00 C ATOM 87 CD2 PHE A 12 6.819 12.407 7.174 1.00 0.00 C ATOM 88 CE1 PHE A 12 7.736 9.770 7.023 1.00 0.00 C ATOM 89 CE2 PHE A 12 8.193 12.146 7.210 1.00 0.00 C ATOM 90 CZ PHE A 12 8.653 10.823 7.137 1.00 0.00 C ATOM 0 H PHE A 12 5.878 12.060 5.078 1.00 0.00 H new ATOM 0 HA PHE A 12 3.825 10.340 5.408 1.00 0.00 H new ATOM 0 HB2 PHE A 12 4.232 12.628 7.351 1.00 0.00 H new ATOM 0 HB3 PHE A 12 3.921 10.940 7.703 1.00 0.00 H new ATOM 0 HD1 PHE A 12 5.666 9.222 6.902 1.00 0.00 H new ATOM 0 HD2 PHE A 12 6.459 13.424 7.231 1.00 0.00 H new ATOM 0 HE1 PHE A 12 8.089 8.751 6.962 1.00 0.00 H new ATOM 0 HE2 PHE A 12 8.897 12.961 7.294 1.00 0.00 H new ATOM 0 HZ PHE A 12 9.713 10.616 7.169 1.00 0.00 H new ATOM 100 N SER A 13 2.637 13.425 5.657 1.00 0.00 N ATOM 101 CA SER A 13 1.426 14.219 5.506 1.00 0.00 C ATOM 102 C SER A 13 1.018 14.309 4.038 1.00 0.00 C ATOM 103 O SER A 13 -0.153 14.521 3.721 1.00 0.00 O ATOM 104 CB SER A 13 1.650 15.625 6.060 1.00 0.00 C ATOM 105 OG SER A 13 0.409 16.316 6.094 1.00 0.00 O ATOM 0 H SER A 13 3.457 13.951 5.957 1.00 0.00 H new ATOM 0 HA SER A 13 0.626 13.731 6.063 1.00 0.00 H new ATOM 0 HB2 SER A 13 2.077 15.571 7.061 1.00 0.00 H new ATOM 0 HB3 SER A 13 2.364 16.165 5.438 1.00 0.00 H new ATOM 0 HG SER A 13 0.547 17.219 6.450 1.00 0.00 H new ATOM 111 N THR A 14 1.991 14.155 3.148 1.00 0.00 N ATOM 112 CA THR A 14 1.728 14.233 1.718 1.00 0.00 C ATOM 113 C THR A 14 1.011 12.976 1.226 1.00 0.00 C ATOM 114 O THR A 14 0.340 12.998 0.194 1.00 0.00 O ATOM 115 CB THR A 14 3.048 14.402 0.968 1.00 0.00 C ATOM 116 OG1 THR A 14 4.047 14.840 1.879 1.00 0.00 O ATOM 117 CG2 THR A 14 2.885 15.437 -0.146 1.00 0.00 C ATOM 0 H THR A 14 2.965 13.976 3.391 1.00 0.00 H new ATOM 0 HA THR A 14 1.083 15.091 1.528 1.00 0.00 H new ATOM 0 HB THR A 14 3.340 13.449 0.528 1.00 0.00 H new ATOM 0 HG1 THR A 14 4.786 15.249 1.382 1.00 0.00 H new ATOM 0 HG21 THR A 14 3.830 15.552 -0.677 1.00 0.00 H new ATOM 0 HG22 THR A 14 2.116 15.103 -0.843 1.00 0.00 H new ATOM 0 HG23 THR A 14 2.592 16.394 0.286 1.00 0.00 H new ATOM 125 N LEU A 15 1.145 11.887 1.978 1.00 0.00 N ATOM 126 CA LEU A 15 0.493 10.630 1.611 1.00 0.00 C ATOM 127 C LEU A 15 -0.776 10.465 2.437 1.00 0.00 C ATOM 128 O LEU A 15 -1.774 9.925 1.967 1.00 0.00 O ATOM 129 CB LEU A 15 1.433 9.436 1.874 1.00 0.00 C ATOM 130 CG LEU A 15 2.381 9.157 0.685 1.00 0.00 C ATOM 131 CD1 LEU A 15 1.598 8.849 -0.593 1.00 0.00 C ATOM 132 CD2 LEU A 15 3.287 10.359 0.430 1.00 0.00 C ATOM 0 H LEU A 15 1.693 11.847 2.837 1.00 0.00 H new ATOM 0 HA LEU A 15 0.248 10.656 0.549 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.025 9.633 2.768 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.837 8.546 2.076 1.00 0.00 H new ATOM 0 HG LEU A 15 2.984 8.288 0.949 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.295 8.658 -1.409 1.00 0.00 H new ATOM 0 HD12 LEU A 15 0.974 7.969 -0.434 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.967 9.700 -0.847 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.948 10.145 -0.410 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.677 11.232 0.199 1.00 0.00 H new ATOM 0 HD23 LEU A 15 3.885 10.559 1.319 1.00 0.00 H new ATOM 144 N LEU A 16 -0.738 10.954 3.667 1.00 0.00 N ATOM 145 CA LEU A 16 -1.900 10.874 4.534 1.00 0.00 C ATOM 146 C LEU A 16 -3.043 11.695 3.935 1.00 0.00 C ATOM 147 O LEU A 16 -4.190 11.248 3.881 1.00 0.00 O ATOM 148 CB LEU A 16 -1.535 11.392 5.931 1.00 0.00 C ATOM 149 CG LEU A 16 -1.708 10.281 6.977 1.00 0.00 C ATOM 150 CD1 LEU A 16 -3.169 9.833 7.014 1.00 0.00 C ATOM 151 CD2 LEU A 16 -0.812 9.082 6.631 1.00 0.00 C ATOM 0 H LEU A 16 0.077 11.406 4.083 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.224 9.837 4.621 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.505 11.747 5.936 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -2.167 12.242 6.187 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.420 10.669 7.954 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -3.289 9.045 7.757 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.803 10.680 7.278 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -3.459 9.455 6.034 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -0.944 8.301 7.380 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.086 8.694 5.650 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.231 9.399 6.617 1.00 0.00 H new ATOM 163 N GLY A 17 -2.717 12.887 3.444 1.00 0.00 N ATOM 164 CA GLY A 17 -3.724 13.732 2.813 1.00 0.00 C ATOM 165 C GLY A 17 -4.326 12.999 1.622 1.00 0.00 C ATOM 166 O GLY A 17 -5.521 13.097 1.348 1.00 0.00 O ATOM 0 H GLY A 17 -1.778 13.285 3.470 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -4.504 13.984 3.531 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -3.275 14.670 2.487 1.00 0.00 H new ATOM 170 N GLU A 18 -3.478 12.247 0.930 1.00 0.00 N ATOM 171 CA GLU A 18 -3.908 11.467 -0.218 1.00 0.00 C ATOM 172 C GLU A 18 -4.767 10.301 0.243 1.00 0.00 C ATOM 173 O GLU A 18 -5.768 9.978 -0.381 1.00 0.00 O ATOM 174 CB GLU A 18 -2.676 10.958 -0.969 1.00 0.00 C ATOM 175 CG GLU A 18 -2.037 12.117 -1.733 1.00 0.00 C ATOM 176 CD GLU A 18 -0.871 11.611 -2.574 1.00 0.00 C ATOM 177 OE1 GLU A 18 -0.442 10.492 -2.343 1.00 0.00 O1- ATOM 178 OE2 GLU A 18 -0.423 12.349 -3.435 1.00 0.00 O ATOM 0 H GLU A 18 -2.485 12.163 1.147 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.502 12.091 -0.886 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.959 10.530 -0.268 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.959 10.164 -1.660 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.779 12.593 -2.375 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -1.688 12.876 -1.033 1.00 0.00 H new ATOM 185 N MET A 19 -4.383 9.687 1.351 1.00 0.00 N ATOM 186 CA MET A 19 -5.156 8.574 1.881 1.00 0.00 C ATOM 187 C MET A 19 -6.598 9.011 2.111 1.00 0.00 C ATOM 188 O MET A 19 -7.523 8.217 1.988 1.00 0.00 O ATOM 189 CB MET A 19 -4.554 8.084 3.204 1.00 0.00 C ATOM 190 CG MET A 19 -3.387 7.111 2.963 1.00 0.00 C ATOM 191 SD MET A 19 -3.357 5.879 4.293 1.00 0.00 S ATOM 192 CE MET A 19 -4.911 5.036 3.880 1.00 0.00 C ATOM 0 H MET A 19 -3.555 9.934 1.893 1.00 0.00 H new ATOM 0 HA MET A 19 -5.131 7.759 1.158 1.00 0.00 H new ATOM 0 HB2 MET A 19 -4.204 8.938 3.785 1.00 0.00 H new ATOM 0 HB3 MET A 19 -5.325 7.591 3.796 1.00 0.00 H new ATOM 0 HG2 MET A 19 -3.501 6.619 1.997 1.00 0.00 H new ATOM 0 HG3 MET A 19 -2.443 7.656 2.934 1.00 0.00 H new ATOM 0 HE1 MET A 19 -4.754 3.957 3.891 1.00 0.00 H new ATOM 0 HE2 MET A 19 -5.674 5.299 4.613 1.00 0.00 H new ATOM 0 HE3 MET A 19 -5.240 5.345 2.888 1.00 0.00 H new ATOM 202 N ASP A 20 -6.792 10.278 2.444 1.00 0.00 N ATOM 203 CA ASP A 20 -8.144 10.776 2.671 1.00 0.00 C ATOM 204 C ASP A 20 -9.046 10.432 1.486 1.00 0.00 C ATOM 205 O ASP A 20 -10.255 10.261 1.644 1.00 0.00 O ATOM 206 CB ASP A 20 -8.132 12.293 2.870 1.00 0.00 C ATOM 207 CG ASP A 20 -8.943 12.664 4.107 1.00 0.00 C ATOM 208 OD1 ASP A 20 -10.132 12.393 4.114 1.00 0.00 O1- ATOM 209 OD2 ASP A 20 -8.363 13.216 5.026 1.00 0.00 O ATOM 0 H ASP A 20 -6.050 10.968 2.562 1.00 0.00 H new ATOM 0 HA ASP A 20 -8.531 10.298 3.571 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -7.106 12.646 2.978 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -8.547 12.786 1.991 1.00 0.00 H new ATOM 214 N LEU A 21 -8.454 10.341 0.293 1.00 0.00 N ATOM 215 CA LEU A 21 -9.226 10.031 -0.909 1.00 0.00 C ATOM 216 C LEU A 21 -9.645 8.557 -0.935 1.00 0.00 C ATOM 217 O LEU A 21 -10.468 8.158 -1.760 1.00 0.00 O ATOM 218 CB LEU A 21 -8.403 10.364 -2.165 1.00 0.00 C ATOM 219 CG LEU A 21 -8.467 11.870 -2.462 1.00 0.00 C ATOM 220 CD1 LEU A 21 -9.883 12.274 -2.894 1.00 0.00 C ATOM 221 CD2 LEU A 21 -8.077 12.654 -1.206 1.00 0.00 C ATOM 0 H LEU A 21 -7.455 10.476 0.135 1.00 0.00 H new ATOM 0 HA LEU A 21 -10.129 10.641 -0.896 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -7.367 10.059 -2.020 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -8.785 9.802 -3.017 1.00 0.00 H new ATOM 0 HG LEU A 21 -7.774 12.097 -3.272 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -9.909 13.344 -3.100 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -10.160 11.724 -3.794 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -10.587 12.041 -2.095 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -8.122 13.723 -1.416 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -8.768 12.413 -0.398 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -7.063 12.385 -0.909 1.00 0.00 H new ATOM 233 N LEU A 22 -9.093 7.756 -0.027 1.00 0.00 N ATOM 234 CA LEU A 22 -9.441 6.335 0.039 1.00 0.00 C ATOM 235 C LEU A 22 -10.649 6.134 0.957 1.00 0.00 C ATOM 236 O LEU A 22 -11.221 5.049 1.022 1.00 0.00 O ATOM 237 CB LEU A 22 -8.210 5.516 0.533 1.00 0.00 C ATOM 238 CG LEU A 22 -8.585 4.464 1.607 1.00 0.00 C ATOM 239 CD1 LEU A 22 -7.389 3.541 1.855 1.00 0.00 C ATOM 240 CD2 LEU A 22 -8.952 5.146 2.935 1.00 0.00 C ATOM 0 H LEU A 22 -8.410 8.060 0.667 1.00 0.00 H new ATOM 0 HA LEU A 22 -9.712 5.978 -0.954 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -7.748 5.013 -0.317 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -7.465 6.198 0.943 1.00 0.00 H new ATOM 0 HG LEU A 22 -9.442 3.896 1.244 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.651 2.800 2.610 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -7.122 3.034 0.928 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -6.541 4.130 2.204 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -9.212 4.388 3.674 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -8.101 5.726 3.294 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -9.804 5.809 2.781 1.00 0.00 H new ATOM 252 N THR A 23 -11.048 7.191 1.662 1.00 0.00 N ATOM 253 CA THR A 23 -12.170 7.096 2.576 1.00 0.00 C ATOM 254 C THR A 23 -13.380 7.784 1.990 1.00 0.00 C ATOM 255 O THR A 23 -14.511 7.342 2.189 1.00 0.00 O ATOM 256 CB THR A 23 -11.794 7.743 3.911 1.00 0.00 C ATOM 257 OG1 THR A 23 -10.858 6.915 4.587 1.00 0.00 O ATOM 258 CG2 THR A 23 -13.046 7.911 4.770 1.00 0.00 C ATOM 0 H THR A 23 -10.612 8.112 1.615 1.00 0.00 H new ATOM 0 HA THR A 23 -12.413 6.046 2.738 1.00 0.00 H new ATOM 0 HB THR A 23 -11.350 8.722 3.730 1.00 0.00 H new ATOM 0 HG1 THR A 23 -10.614 7.328 5.442 1.00 0.00 H new ATOM 0 HG21 THR A 23 -12.776 8.372 5.720 1.00 0.00 H new ATOM 0 HG22 THR A 23 -13.762 8.546 4.249 1.00 0.00 H new ATOM 0 HG23 THR A 23 -13.494 6.935 4.955 1.00 0.00 H new ATOM 266 N GLN A 24 -13.132 8.864 1.260 1.00 0.00 N ATOM 267 CA GLN A 24 -14.210 9.600 0.640 1.00 0.00 C ATOM 268 C GLN A 24 -14.206 9.395 -0.870 1.00 0.00 C ATOM 269 O GLN A 24 -13.152 9.420 -1.504 1.00 0.00 O ATOM 270 CB GLN A 24 -14.104 11.084 0.971 1.00 0.00 C ATOM 271 CG GLN A 24 -12.730 11.601 0.572 1.00 0.00 C ATOM 272 CD GLN A 24 -12.866 12.509 -0.630 1.00 0.00 C ATOM 273 OE1 GLN A 24 -13.204 11.987 -1.769 1.00 0.00 O flip ATOM 274 NE2 GLN A 24 -12.661 13.721 -0.532 1.00 0.00 N flip ATOM 0 H GLN A 24 -12.200 9.242 1.088 1.00 0.00 H new ATOM 0 HA GLN A 24 -15.152 9.220 1.037 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -14.880 11.640 0.445 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -14.267 11.241 2.037 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -12.278 12.143 1.402 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -12.069 10.767 0.339 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -12.396 14.122 0.367 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -12.757 14.322 -1.350 1.00 0.00 H new ATOM 283 N SER A 25 -15.388 9.176 -1.447 1.00 0.00 N ATOM 284 CA SER A 25 -15.485 8.960 -2.891 1.00 0.00 C ATOM 285 C SER A 25 -16.854 8.413 -3.290 1.00 0.00 C ATOM 286 O SER A 25 -17.179 8.338 -4.476 1.00 0.00 O ATOM 287 CB SER A 25 -14.399 7.994 -3.332 1.00 0.00 C ATOM 288 OG SER A 25 -14.899 7.174 -4.379 1.00 0.00 O ATOM 0 H SER A 25 -16.277 9.144 -0.948 1.00 0.00 H new ATOM 0 HA SER A 25 -15.354 9.922 -3.386 1.00 0.00 H new ATOM 0 HB2 SER A 25 -13.522 8.545 -3.673 1.00 0.00 H new ATOM 0 HB3 SER A 25 -14.081 7.377 -2.491 1.00 0.00 H new ATOM 0 HG SER A 25 -14.201 6.550 -4.668 1.00 0.00 H new ATOM 294 N LEU A 26 -17.650 8.047 -2.295 1.00 0.00 N ATOM 295 CA LEU A 26 -18.993 7.525 -2.528 1.00 0.00 C ATOM 296 C LEU A 26 -19.727 8.282 -3.620 1.00 0.00 C ATOM 297 O LEU A 26 -20.731 7.817 -4.166 1.00 0.00 O ATOM 298 CB LEU A 26 -19.780 7.598 -1.232 1.00 0.00 C ATOM 299 CG LEU A 26 -20.096 9.045 -0.761 1.00 0.00 C ATOM 300 CD1 LEU A 26 -18.840 9.926 -0.770 1.00 0.00 C ATOM 301 CD2 LEU A 26 -21.203 9.700 -1.615 1.00 0.00 C ATOM 0 H LEU A 26 -17.388 8.102 -1.311 1.00 0.00 H new ATOM 0 HA LEU A 26 -18.900 6.492 -2.864 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -20.717 7.056 -1.358 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -19.219 7.087 -0.450 1.00 0.00 H new ATOM 0 HG LEU A 26 -20.459 8.965 0.264 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -19.098 10.931 -0.435 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -18.093 9.501 -0.100 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -18.436 9.973 -1.781 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -21.393 10.710 -1.252 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -20.882 9.743 -2.656 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -22.117 9.110 -1.541 1.00 0.00 H new ATOM 313 N GLY A 27 -19.217 9.448 -3.908 1.00 0.00 N ATOM 314 CA GLY A 27 -19.789 10.323 -4.926 1.00 0.00 C ATOM 315 C GLY A 27 -19.778 9.644 -6.288 1.00 0.00 C ATOM 316 O GLY A 27 -20.161 10.238 -7.296 1.00 0.00 O ATOM 0 H GLY A 27 -18.390 9.830 -3.449 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -20.811 10.586 -4.654 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -19.222 11.253 -4.973 1.00 0.00 H new ATOM 320 N VAL A 28 -19.337 8.394 -6.302 1.00 0.00 N ATOM 321 CA VAL A 28 -19.277 7.626 -7.530 1.00 0.00 C ATOM 322 C VAL A 28 -19.001 6.160 -7.230 1.00 0.00 C ATOM 323 O VAL A 28 -19.597 5.265 -7.830 1.00 0.00 O ATOM 324 CB VAL A 28 -18.188 8.193 -8.438 1.00 0.00 C ATOM 325 CG1 VAL A 28 -16.808 7.716 -7.974 1.00 0.00 C ATOM 326 CG2 VAL A 28 -18.435 7.730 -9.872 1.00 0.00 C ATOM 0 H VAL A 28 -19.016 7.893 -5.474 1.00 0.00 H new ATOM 0 HA VAL A 28 -20.239 7.696 -8.037 1.00 0.00 H new ATOM 0 HB VAL A 28 -18.217 9.282 -8.392 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -16.041 8.128 -8.630 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -16.631 8.053 -6.953 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -16.769 6.627 -8.009 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -17.659 8.133 -10.523 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -18.412 6.641 -9.912 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -19.410 8.085 -10.206 1.00 0.00 H new ATOM 336 N ASP A 29 -18.095 5.926 -6.294 1.00 0.00 N ATOM 337 CA ASP A 29 -17.738 4.563 -5.910 1.00 0.00 C ATOM 338 C ASP A 29 -18.885 3.898 -5.158 1.00 0.00 C ATOM 339 O ASP A 29 -18.771 2.757 -4.711 1.00 0.00 O ATOM 340 CB ASP A 29 -16.486 4.568 -5.027 1.00 0.00 C ATOM 341 CG ASP A 29 -16.182 3.153 -4.542 1.00 0.00 C ATOM 342 OD1 ASP A 29 -15.587 2.403 -5.299 1.00 0.00 O1- ATOM 343 OD2 ASP A 29 -16.551 2.839 -3.422 1.00 0.00 O ATOM 0 H ASP A 29 -17.594 6.655 -5.787 1.00 0.00 H new ATOM 0 HA ASP A 29 -17.535 3.999 -6.820 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -15.637 4.959 -5.588 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -16.636 5.229 -4.174 1.00 0.00 H new ATOM 348 N THR A 30 -19.993 4.619 -5.023 1.00 0.00 N ATOM 349 CA THR A 30 -21.158 4.091 -4.324 1.00 0.00 C ATOM 350 C THR A 30 -20.759 3.533 -2.962 1.00 0.00 C ATOM 351 O THR A 30 -19.714 3.922 -2.467 1.00 0.00 O ATOM 352 CB THR A 30 -21.812 2.988 -5.159 1.00 0.00 C ATOM 353 OG1 THR A 30 -20.989 1.830 -5.138 1.00 0.00 O ATOM 354 CG2 THR A 30 -21.985 3.469 -6.600 1.00 0.00 C ATOM 355 OXT THR A 30 -21.505 2.725 -2.434 1.00 0.00 O ATOM 0 H THR A 30 -20.108 5.565 -5.386 1.00 0.00 H new ATOM 0 HA THR A 30 -21.869 4.904 -4.176 1.00 0.00 H new ATOM 0 HB THR A 30 -22.789 2.747 -4.741 1.00 0.00 H new ATOM 0 HG1 THR A 30 -20.159 2.028 -4.657 1.00 0.00 H new ATOM 0 HG21 THR A 30 -22.451 2.682 -7.193 1.00 0.00 H new ATOM 0 HG22 THR A 30 -22.618 4.356 -6.614 1.00 0.00 H new ATOM 0 HG23 THR A 30 -21.010 3.712 -7.022 1.00 0.00 H new TER 363 THR A 30 ATOM 364 N TYR B 308 13.414 -11.356 3.859 1.00 0.00 N ATOM 365 CA TYR B 308 13.477 -12.846 3.879 1.00 0.00 C ATOM 366 C TYR B 308 12.852 -13.396 2.601 1.00 0.00 C ATOM 367 O TYR B 308 12.769 -14.610 2.413 1.00 0.00 O ATOM 368 CB TYR B 308 12.716 -13.370 5.099 1.00 0.00 C ATOM 369 CG TYR B 308 11.626 -12.394 5.473 1.00 0.00 C ATOM 370 CD1 TYR B 308 11.953 -11.185 6.098 1.00 0.00 C ATOM 371 CD2 TYR B 308 10.289 -12.699 5.196 1.00 0.00 C ATOM 372 CE1 TYR B 308 10.944 -10.281 6.447 1.00 0.00 C ATOM 373 CE2 TYR B 308 9.278 -11.794 5.544 1.00 0.00 C ATOM 374 CZ TYR B 308 9.606 -10.586 6.170 1.00 0.00 C ATOM 375 OH TYR B 308 8.610 -9.694 6.513 1.00 0.00 O ATOM 0 HA TYR B 308 14.516 -13.170 3.938 1.00 0.00 H new ATOM 0 HB2 TYR B 308 12.284 -14.346 4.879 1.00 0.00 H new ATOM 0 HB3 TYR B 308 13.400 -13.505 5.937 1.00 0.00 H new ATOM 0 HD1 TYR B 308 12.985 -10.950 6.311 1.00 0.00 H new ATOM 0 HD2 TYR B 308 10.036 -13.632 4.714 1.00 0.00 H new ATOM 0 HE1 TYR B 308 11.197 -9.349 6.930 1.00 0.00 H new ATOM 0 HE2 TYR B 308 8.246 -12.028 5.329 1.00 0.00 H new ATOM 0 HH TYR B 308 8.963 -8.780 6.480 1.00 0.00 H new ATOM 387 N GLY B 309 12.414 -12.495 1.726 1.00 0.00 N ATOM 388 CA GLY B 309 11.798 -12.900 0.467 1.00 0.00 C ATOM 389 C GLY B 309 10.530 -12.097 0.198 1.00 0.00 C ATOM 390 O GLY B 309 10.586 -11.011 -0.381 1.00 0.00 O ATOM 0 H GLY B 309 12.474 -11.486 1.864 1.00 0.00 H new ATOM 0 HA2 GLY B 309 12.504 -12.756 -0.351 1.00 0.00 H new ATOM 0 HA3 GLY B 309 11.560 -13.963 0.500 1.00 0.00 H new ATOM 394 N VAL B 310 9.392 -12.642 0.619 1.00 0.00 N ATOM 395 CA VAL B 310 8.110 -11.978 0.419 1.00 0.00 C ATOM 396 C VAL B 310 7.359 -11.840 1.744 1.00 0.00 C ATOM 397 O VAL B 310 7.260 -12.795 2.513 1.00 0.00 O ATOM 398 CB VAL B 310 7.262 -12.773 -0.574 1.00 0.00 C ATOM 399 CG1 VAL B 310 5.866 -12.159 -0.658 1.00 0.00 C ATOM 400 CG2 VAL B 310 7.916 -12.726 -1.955 1.00 0.00 C ATOM 0 H VAL B 310 9.333 -13.540 1.100 1.00 0.00 H new ATOM 0 HA VAL B 310 8.297 -10.981 0.020 1.00 0.00 H new ATOM 0 HB VAL B 310 7.188 -13.807 -0.239 1.00 0.00 H new ATOM 0 HG11 VAL B 310 5.261 -12.726 -1.366 1.00 0.00 H new ATOM 0 HG12 VAL B 310 5.396 -12.188 0.325 1.00 0.00 H new ATOM 0 HG13 VAL B 310 5.943 -11.125 -0.993 1.00 0.00 H new ATOM 0 HG21 VAL B 310 7.312 -13.293 -2.663 1.00 0.00 H new ATOM 0 HG22 VAL B 310 7.989 -11.691 -2.288 1.00 0.00 H new ATOM 0 HG23 VAL B 310 8.914 -13.161 -1.900 1.00 0.00 H new ATOM 410 N SER B 311 6.834 -10.643 1.996 1.00 0.00 N ATOM 411 CA SER B 311 6.092 -10.377 3.223 1.00 0.00 C ATOM 412 C SER B 311 4.614 -10.196 2.912 1.00 0.00 C ATOM 413 O SER B 311 4.261 -9.825 1.801 1.00 0.00 O ATOM 414 CB SER B 311 6.629 -9.116 3.878 1.00 0.00 C ATOM 415 OG SER B 311 7.769 -8.663 3.158 1.00 0.00 O ATOM 0 H SER B 311 6.909 -9.844 1.367 1.00 0.00 H new ATOM 0 HA SER B 311 6.213 -11.222 3.901 1.00 0.00 H new ATOM 0 HB2 SER B 311 5.861 -8.343 3.890 1.00 0.00 H new ATOM 0 HB3 SER B 311 6.896 -9.316 4.916 1.00 0.00 H new ATOM 0 HG SER B 311 8.547 -8.647 3.754 1.00 0.00 H new ATOM 421 N PHE B 312 3.756 -10.489 3.885 1.00 0.00 N ATOM 422 CA PHE B 312 2.313 -10.388 3.690 1.00 0.00 C ATOM 423 C PHE B 312 1.651 -9.581 4.810 1.00 0.00 C ATOM 424 O PHE B 312 1.952 -9.800 5.983 1.00 0.00 O ATOM 425 CB PHE B 312 1.748 -11.806 3.696 1.00 0.00 C ATOM 426 CG PHE B 312 2.072 -12.494 2.389 1.00 0.00 C ATOM 427 CD1 PHE B 312 1.493 -12.047 1.197 1.00 0.00 C ATOM 428 CD2 PHE B 312 2.955 -13.582 2.373 1.00 0.00 C ATOM 429 CE1 PHE B 312 1.795 -12.685 -0.011 1.00 0.00 C ATOM 430 CE2 PHE B 312 3.258 -14.219 1.162 1.00 0.00 C ATOM 431 CZ PHE B 312 2.677 -13.771 -0.029 1.00 0.00 C ATOM 0 H PHE B 312 4.035 -10.798 4.816 1.00 0.00 H new ATOM 0 HA PHE B 312 2.111 -9.878 2.748 1.00 0.00 H new ATOM 0 HB2 PHE B 312 2.168 -12.371 4.528 1.00 0.00 H new ATOM 0 HB3 PHE B 312 0.668 -11.776 3.844 1.00 0.00 H new ATOM 0 HD1 PHE B 312 0.812 -11.209 1.209 1.00 0.00 H new ATOM 0 HD2 PHE B 312 3.402 -13.929 3.293 1.00 0.00 H new ATOM 0 HE1 PHE B 312 1.347 -12.339 -0.931 1.00 0.00 H new ATOM 0 HE2 PHE B 312 3.940 -15.056 1.148 1.00 0.00 H new ATOM 0 HZ PHE B 312 2.909 -14.263 -0.962 1.00 0.00 H new ATOM 441 N PHE B 313 0.731 -8.662 4.461 1.00 0.00 N ATOM 442 CA PHE B 313 0.052 -7.885 5.486 1.00 0.00 C ATOM 443 C PHE B 313 -1.418 -7.739 5.156 1.00 0.00 C ATOM 444 O PHE B 313 -1.784 -7.333 4.055 1.00 0.00 O ATOM 445 CB PHE B 313 0.664 -6.497 5.602 1.00 0.00 C ATOM 446 CG PHE B 313 1.979 -6.578 6.332 1.00 0.00 C ATOM 447 CD1 PHE B 313 3.147 -6.906 5.636 1.00 0.00 C ATOM 448 CD2 PHE B 313 2.031 -6.313 7.704 1.00 0.00 C ATOM 449 CE1 PHE B 313 4.368 -6.969 6.314 1.00 0.00 C ATOM 450 CE2 PHE B 313 3.253 -6.376 8.382 1.00 0.00 C ATOM 451 CZ PHE B 313 4.423 -6.704 7.685 1.00 0.00 C ATOM 0 H PHE B 313 0.454 -8.451 3.502 1.00 0.00 H new ATOM 0 HA PHE B 313 0.166 -8.415 6.432 1.00 0.00 H new ATOM 0 HB2 PHE B 313 0.814 -6.072 4.610 1.00 0.00 H new ATOM 0 HB3 PHE B 313 -0.017 -5.833 6.134 1.00 0.00 H new ATOM 0 HD1 PHE B 313 3.106 -7.110 4.576 1.00 0.00 H new ATOM 0 HD2 PHE B 313 1.128 -6.060 8.240 1.00 0.00 H new ATOM 0 HE1 PHE B 313 5.270 -7.223 5.777 1.00 0.00 H new ATOM 0 HE2 PHE B 313 3.294 -6.172 9.442 1.00 0.00 H new ATOM 0 HZ PHE B 313 5.367 -6.752 8.207 1.00 0.00 H new ATOM 461 N LEU B 314 -2.254 -8.042 6.128 1.00 0.00 N ATOM 462 CA LEU B 314 -3.678 -7.911 5.951 1.00 0.00 C ATOM 463 C LEU B 314 -4.082 -6.476 6.188 1.00 0.00 C ATOM 464 O LEU B 314 -4.075 -5.939 7.283 1.00 0.00 O ATOM 465 CB LEU B 314 -4.457 -8.946 6.790 1.00 0.00 C ATOM 466 CG LEU B 314 -4.948 -8.444 8.162 1.00 0.00 C ATOM 467 CD1 LEU B 314 -3.812 -7.808 8.967 1.00 0.00 C ATOM 468 CD2 LEU B 314 -6.125 -7.463 8.006 1.00 0.00 C ATOM 0 H LEU B 314 -1.968 -8.380 7.047 1.00 0.00 H new ATOM 0 HA LEU B 314 -3.948 -8.147 4.922 1.00 0.00 H new ATOM 0 HB2 LEU B 314 -5.319 -9.282 6.214 1.00 0.00 H new ATOM 0 HB3 LEU B 314 -3.820 -9.817 6.946 1.00 0.00 H new ATOM 0 HG LEU B 314 -5.302 -9.312 8.718 1.00 0.00 H new ATOM 0 HD11 LEU B 314 -4.195 -7.465 9.928 1.00 0.00 H new ATOM 0 HD12 LEU B 314 -3.026 -8.545 9.131 1.00 0.00 H new ATOM 0 HD13 LEU B 314 -3.406 -6.960 8.415 1.00 0.00 H new ATOM 0 HD21 LEU B 314 -6.450 -7.126 8.990 1.00 0.00 H new ATOM 0 HD22 LEU B 314 -5.807 -6.604 7.415 1.00 0.00 H new ATOM 0 HD23 LEU B 314 -6.952 -7.964 7.503 1.00 0.00 H new ATOM 480 N VAL B 315 -4.344 -5.846 5.087 1.00 0.00 N ATOM 481 CA VAL B 315 -4.690 -4.442 5.069 1.00 0.00 C ATOM 482 C VAL B 315 -6.118 -4.261 4.566 1.00 0.00 C ATOM 483 O VAL B 315 -6.648 -5.154 3.933 1.00 0.00 O ATOM 484 CB VAL B 315 -3.713 -3.744 4.140 1.00 0.00 C ATOM 485 CG1 VAL B 315 -2.281 -3.933 4.645 1.00 0.00 C ATOM 486 CG2 VAL B 315 -3.859 -4.330 2.721 1.00 0.00 C ATOM 0 H VAL B 315 -4.327 -6.284 4.166 1.00 0.00 H new ATOM 0 HA VAL B 315 -4.632 -4.019 6.072 1.00 0.00 H new ATOM 0 HB VAL B 315 -3.932 -2.677 4.116 1.00 0.00 H new ATOM 0 HG11 VAL B 315 -1.588 -3.429 3.972 1.00 0.00 H new ATOM 0 HG12 VAL B 315 -2.189 -3.509 5.645 1.00 0.00 H new ATOM 0 HG13 VAL B 315 -2.045 -4.996 4.679 1.00 0.00 H new ATOM 0 HG21 VAL B 315 -3.160 -3.833 2.048 1.00 0.00 H new ATOM 0 HG22 VAL B 315 -3.643 -5.398 2.744 1.00 0.00 H new ATOM 0 HG23 VAL B 315 -4.878 -4.174 2.366 1.00 0.00 H new ATOM 496 N LYS B 316 -6.741 -3.108 4.834 1.00 0.00 N ATOM 497 CA LYS B 316 -8.097 -2.875 4.367 1.00 0.00 C ATOM 498 C LYS B 316 -8.066 -1.947 3.169 1.00 0.00 C ATOM 499 O LYS B 316 -7.226 -1.056 3.085 1.00 0.00 O ATOM 500 CB LYS B 316 -8.948 -2.250 5.458 1.00 0.00 C ATOM 501 CG LYS B 316 -8.675 -2.934 6.800 1.00 0.00 C ATOM 502 CD LYS B 316 -9.494 -2.254 7.897 1.00 0.00 C ATOM 503 CE LYS B 316 -10.352 -3.297 8.615 1.00 0.00 C ATOM 504 NZ LYS B 316 -11.185 -2.629 9.653 1.00 0.00 N1+ ATOM 0 H LYS B 316 -6.330 -2.339 5.363 1.00 0.00 H new ATOM 0 HA LYS B 316 -8.534 -3.834 4.090 1.00 0.00 H new ATOM 0 HB2 LYS B 316 -8.730 -1.185 5.534 1.00 0.00 H new ATOM 0 HB3 LYS B 316 -10.004 -2.342 5.203 1.00 0.00 H new ATOM 0 HG2 LYS B 316 -8.934 -3.991 6.741 1.00 0.00 H new ATOM 0 HG3 LYS B 316 -7.613 -2.879 7.038 1.00 0.00 H new ATOM 0 HD2 LYS B 316 -8.831 -1.761 8.608 1.00 0.00 H new ATOM 0 HD3 LYS B 316 -10.129 -1.481 7.465 1.00 0.00 H new ATOM 0 HE2 LYS B 316 -10.991 -3.813 7.898 1.00 0.00 H new ATOM 0 HE3 LYS B 316 -9.715 -4.052 9.076 1.00 0.00 H new ATOM 0 HZ1 LYS B 316 -11.768 -3.339 10.140 1.00 0.00 H new ATOM 0 HZ2 LYS B 316 -10.567 -2.156 10.343 1.00 0.00 H new ATOM 0 HZ3 LYS B 316 -11.803 -1.925 9.202 1.00 0.00 H new ATOM 518 N GLU B 317 -8.971 -2.177 2.242 1.00 0.00 N ATOM 519 CA GLU B 317 -9.028 -1.380 1.029 1.00 0.00 C ATOM 520 C GLU B 317 -10.430 -0.905 0.706 1.00 0.00 C ATOM 521 O GLU B 317 -11.424 -1.533 1.046 1.00 0.00 O ATOM 522 CB GLU B 317 -8.523 -2.208 -0.135 1.00 0.00 C ATOM 523 CG GLU B 317 -8.145 -1.290 -1.304 1.00 0.00 C ATOM 524 CD GLU B 317 -7.482 -2.097 -2.413 1.00 0.00 C ATOM 525 OE1 GLU B 317 -6.520 -2.788 -2.122 1.00 0.00 O ATOM 526 OE2 GLU B 317 -7.943 -2.007 -3.539 1.00 0.00 O1- ATOM 0 H GLU B 317 -9.679 -2.909 2.302 1.00 0.00 H new ATOM 0 HA GLU B 317 -8.406 -0.500 1.194 1.00 0.00 H new ATOM 0 HB2 GLU B 317 -7.657 -2.794 0.173 1.00 0.00 H new ATOM 0 HB3 GLU B 317 -9.291 -2.915 -0.450 1.00 0.00 H new ATOM 0 HG2 GLU B 317 -9.036 -0.793 -1.688 1.00 0.00 H new ATOM 0 HG3 GLU B 317 -7.468 -0.509 -0.958 1.00 0.00 H new ATOM 533 N LYS B 318 -10.475 0.219 0.029 1.00 0.00 N ATOM 534 CA LYS B 318 -11.733 0.827 -0.369 1.00 0.00 C ATOM 535 C LYS B 318 -12.289 0.170 -1.620 1.00 0.00 C ATOM 536 O LYS B 318 -11.841 0.439 -2.735 1.00 0.00 O ATOM 537 CB LYS B 318 -11.523 2.320 -0.603 1.00 0.00 C ATOM 538 CG LYS B 318 -12.752 2.940 -1.272 1.00 0.00 C ATOM 539 CD LYS B 318 -14.019 2.536 -0.515 1.00 0.00 C ATOM 540 CE LYS B 318 -15.147 3.510 -0.856 1.00 0.00 C ATOM 541 NZ LYS B 318 -15.234 4.558 0.198 1.00 0.00 N1+ ATOM 0 H LYS B 318 -9.647 0.739 -0.262 1.00 0.00 H new ATOM 0 HA LYS B 318 -12.458 0.682 0.431 1.00 0.00 H new ATOM 0 HB2 LYS B 318 -11.329 2.818 0.347 1.00 0.00 H new ATOM 0 HB3 LYS B 318 -10.645 2.475 -1.229 1.00 0.00 H new ATOM 0 HG2 LYS B 318 -12.659 4.026 -1.288 1.00 0.00 H new ATOM 0 HG3 LYS B 318 -12.817 2.610 -2.309 1.00 0.00 H new ATOM 0 HD2 LYS B 318 -14.308 1.520 -0.783 1.00 0.00 H new ATOM 0 HD3 LYS B 318 -13.832 2.541 0.559 1.00 0.00 H new ATOM 0 HE2 LYS B 318 -14.963 3.970 -1.827 1.00 0.00 H new ATOM 0 HE3 LYS B 318 -16.094 2.975 -0.931 1.00 0.00 H new ATOM 0 HZ1 LYS B 318 -15.585 5.443 -0.221 1.00 0.00 H new ATOM 0 HZ2 LYS B 318 -15.887 4.246 0.945 1.00 0.00 H new ATOM 0 HZ3 LYS B 318 -14.291 4.718 0.607 1.00 0.00 H new ATOM 555 N MET B 319 -13.278 -0.690 -1.419 1.00 0.00 N ATOM 556 CA MET B 319 -13.911 -1.384 -2.533 1.00 0.00 C ATOM 557 C MET B 319 -15.219 -0.716 -2.917 1.00 0.00 C ATOM 558 O MET B 319 -15.644 0.253 -2.286 1.00 0.00 O ATOM 559 CB MET B 319 -14.205 -2.827 -2.156 1.00 0.00 C ATOM 560 CG MET B 319 -12.898 -3.559 -1.864 1.00 0.00 C ATOM 561 SD MET B 319 -12.044 -3.894 -3.426 1.00 0.00 S ATOM 562 CE MET B 319 -10.711 -2.677 -3.261 1.00 0.00 C ATOM 0 H MET B 319 -13.658 -0.923 -0.501 1.00 0.00 H new ATOM 0 HA MET B 319 -13.222 -1.347 -3.377 1.00 0.00 H new ATOM 0 HB2 MET B 319 -14.854 -2.859 -1.281 1.00 0.00 H new ATOM 0 HB3 MET B 319 -14.738 -3.324 -2.967 1.00 0.00 H new ATOM 0 HG2 MET B 319 -12.266 -2.955 -1.212 1.00 0.00 H new ATOM 0 HG3 MET B 319 -13.099 -4.492 -1.338 1.00 0.00 H new ATOM 0 HE1 MET B 319 -10.935 -1.806 -3.876 1.00 0.00 H new ATOM 0 HE2 MET B 319 -10.624 -2.372 -2.218 1.00 0.00 H new ATOM 0 HE3 MET B 319 -9.771 -3.120 -3.589 1.00 0.00 H new ATOM 572 N LYS B 320 -15.860 -1.258 -3.944 1.00 0.00 N ATOM 573 CA LYS B 320 -17.126 -0.736 -4.398 1.00 0.00 C ATOM 574 C LYS B 320 -18.255 -1.618 -3.888 1.00 0.00 C ATOM 575 O LYS B 320 -18.055 -2.784 -3.552 1.00 0.00 O ATOM 576 CB LYS B 320 -17.165 -0.652 -5.931 1.00 0.00 C ATOM 577 CG LYS B 320 -17.057 -2.051 -6.562 1.00 0.00 C ATOM 578 CD LYS B 320 -15.624 -2.595 -6.446 1.00 0.00 C ATOM 579 CE LYS B 320 -15.595 -3.839 -5.548 1.00 0.00 C ATOM 580 NZ LYS B 320 -16.126 -5.005 -6.308 1.00 0.00 N1+ ATOM 0 H LYS B 320 -15.517 -2.059 -4.474 1.00 0.00 H new ATOM 0 HA LYS B 320 -17.251 0.272 -4.002 1.00 0.00 H new ATOM 0 HB2 LYS B 320 -18.092 -0.176 -6.249 1.00 0.00 H new ATOM 0 HB3 LYS B 320 -16.347 -0.025 -6.285 1.00 0.00 H new ATOM 0 HG2 LYS B 320 -17.750 -2.732 -6.068 1.00 0.00 H new ATOM 0 HG3 LYS B 320 -17.349 -2.005 -7.611 1.00 0.00 H new ATOM 0 HD2 LYS B 320 -15.242 -2.844 -7.436 1.00 0.00 H new ATOM 0 HD3 LYS B 320 -14.969 -1.827 -6.035 1.00 0.00 H new ATOM 0 HE2 LYS B 320 -14.576 -4.039 -5.217 1.00 0.00 H new ATOM 0 HE3 LYS B 320 -16.194 -3.670 -4.653 1.00 0.00 H new ATOM 0 HZ1 LYS B 320 -16.108 -5.851 -5.703 1.00 0.00 H new ATOM 0 HZ2 LYS B 320 -17.104 -4.811 -6.603 1.00 0.00 H new ATOM 0 HZ3 LYS B 320 -15.537 -5.169 -7.149 1.00 0.00 H new ATOM 594 N GLY B 321 -19.428 -1.040 -3.835 1.00 0.00 N ATOM 595 CA GLY B 321 -20.613 -1.745 -3.369 1.00 0.00 C ATOM 596 C GLY B 321 -21.065 -1.182 -2.036 1.00 0.00 C ATOM 597 O GLY B 321 -22.225 -1.312 -1.648 1.00 0.00 O ATOM 0 H GLY B 321 -19.597 -0.072 -4.110 1.00 0.00 H new ATOM 0 HA2 GLY B 321 -21.414 -1.650 -4.103 1.00 0.00 H new ATOM 0 HA3 GLY B 321 -20.397 -2.809 -3.269 1.00 0.00 H new ATOM 601 N LYS B 322 -20.124 -0.567 -1.335 1.00 0.00 N ATOM 602 CA LYS B 322 -20.408 0.008 -0.031 1.00 0.00 C ATOM 603 C LYS B 322 -19.788 1.396 0.090 1.00 0.00 C ATOM 604 O LYS B 322 -19.813 2.179 -0.858 1.00 0.00 O ATOM 605 CB LYS B 322 -19.837 -0.913 1.036 1.00 0.00 C ATOM 606 CG LYS B 322 -18.351 -1.128 0.751 1.00 0.00 C ATOM 607 CD LYS B 322 -17.774 -2.064 1.808 1.00 0.00 C ATOM 608 CE LYS B 322 -17.682 -3.479 1.234 1.00 0.00 C ATOM 609 NZ LYS B 322 -17.434 -4.446 2.339 1.00 0.00 N1+ ATOM 0 H LYS B 322 -19.160 -0.454 -1.647 1.00 0.00 H new ATOM 0 HA LYS B 322 -21.486 0.108 0.097 1.00 0.00 H new ATOM 0 HB2 LYS B 322 -19.973 -0.476 2.025 1.00 0.00 H new ATOM 0 HB3 LYS B 322 -20.364 -1.867 1.034 1.00 0.00 H new ATOM 0 HG2 LYS B 322 -18.216 -1.554 -0.243 1.00 0.00 H new ATOM 0 HG3 LYS B 322 -17.823 -0.174 0.764 1.00 0.00 H new ATOM 0 HD2 LYS B 322 -16.787 -1.719 2.116 1.00 0.00 H new ATOM 0 HD3 LYS B 322 -18.405 -2.060 2.697 1.00 0.00 H new ATOM 0 HE2 LYS B 322 -18.606 -3.733 0.714 1.00 0.00 H new ATOM 0 HE3 LYS B 322 -16.878 -3.534 0.500 1.00 0.00 H new ATOM 0 HZ1 LYS B 322 -17.041 -5.326 1.948 1.00 0.00 H new ATOM 0 HZ2 LYS B 322 -16.759 -4.035 3.015 1.00 0.00 H new ATOM 0 HZ3 LYS B 322 -18.329 -4.653 2.826 1.00 0.00 H new ATOM 623 N ASN B 323 -19.231 1.694 1.259 1.00 0.00 N ATOM 624 CA ASN B 323 -18.610 2.985 1.484 1.00 0.00 C ATOM 625 C ASN B 323 -17.379 2.840 2.374 1.00 0.00 C ATOM 626 O ASN B 323 -16.549 3.745 2.450 1.00 0.00 O ATOM 627 CB ASN B 323 -19.610 3.931 2.150 1.00 0.00 C ATOM 628 CG ASN B 323 -19.953 5.081 1.209 1.00 0.00 C ATOM 629 OD1 ASN B 323 -20.066 4.881 -0.001 1.00 0.00 O ATOM 630 ND2 ASN B 323 -20.128 6.280 1.694 1.00 0.00 N ATOM 0 H ASN B 323 -19.199 1.061 2.058 1.00 0.00 H new ATOM 0 HA ASN B 323 -18.303 3.394 0.521 1.00 0.00 H new ATOM 0 HB2 ASN B 323 -20.516 3.386 2.416 1.00 0.00 H new ATOM 0 HB3 ASN B 323 -19.190 4.322 3.077 1.00 0.00 H new ATOM 0 HD21 ASN B 323 -20.359 7.054 1.071 1.00 0.00 H new ATOM 0 HD22 ASN B 323 -20.034 6.443 2.696 1.00 0.00 H new ATOM 637 N LYS B 324 -17.272 1.703 3.060 1.00 0.00 N ATOM 638 CA LYS B 324 -16.147 1.470 3.950 1.00 0.00 C ATOM 639 C LYS B 324 -15.059 0.661 3.255 1.00 0.00 C ATOM 640 O LYS B 324 -15.174 0.328 2.074 1.00 0.00 O ATOM 641 CB LYS B 324 -16.620 0.710 5.185 1.00 0.00 C ATOM 642 CG LYS B 324 -17.996 1.233 5.616 1.00 0.00 C ATOM 643 CD LYS B 324 -19.104 0.280 5.149 1.00 0.00 C ATOM 644 CE LYS B 324 -18.970 -1.073 5.852 1.00 0.00 C ATOM 645 NZ LYS B 324 -20.297 -1.489 6.387 1.00 0.00 N1+ ATOM 0 H LYS B 324 -17.946 0.939 3.015 1.00 0.00 H new ATOM 0 HA LYS B 324 -15.735 2.437 4.238 1.00 0.00 H new ATOM 0 HB2 LYS B 324 -16.677 -0.357 4.968 1.00 0.00 H new ATOM 0 HB3 LYS B 324 -15.903 0.833 5.997 1.00 0.00 H new ATOM 0 HG2 LYS B 324 -18.029 1.335 6.701 1.00 0.00 H new ATOM 0 HG3 LYS B 324 -18.162 2.226 5.197 1.00 0.00 H new ATOM 0 HD2 LYS B 324 -20.081 0.714 5.363 1.00 0.00 H new ATOM 0 HD3 LYS B 324 -19.045 0.144 4.069 1.00 0.00 H new ATOM 0 HE2 LYS B 324 -18.596 -1.822 5.154 1.00 0.00 H new ATOM 0 HE3 LYS B 324 -18.245 -1.003 6.663 1.00 0.00 H new ATOM 0 HZ1 LYS B 324 -20.206 -2.408 6.865 1.00 0.00 H new ATOM 0 HZ2 LYS B 324 -20.636 -0.778 7.066 1.00 0.00 H new ATOM 0 HZ3 LYS B 324 -20.977 -1.571 5.604 1.00 0.00 H new ATOM 659 N LEU B 325 -14.010 0.337 4.003 1.00 0.00 N ATOM 660 CA LEU B 325 -12.917 -0.444 3.467 1.00 0.00 C ATOM 661 C LEU B 325 -13.211 -1.912 3.605 1.00 0.00 C ATOM 662 O LEU B 325 -14.123 -2.314 4.329 1.00 0.00 O ATOM 663 CB LEU B 325 -11.617 -0.129 4.196 1.00 0.00 C ATOM 664 CG LEU B 325 -11.379 1.378 4.217 1.00 0.00 C ATOM 665 CD1 LEU B 325 -10.005 1.642 4.805 1.00 0.00 C ATOM 666 CD2 LEU B 325 -11.417 1.927 2.796 1.00 0.00 C ATOM 0 H LEU B 325 -13.900 0.606 4.981 1.00 0.00 H new ATOM 0 HA LEU B 325 -12.807 -0.187 2.413 1.00 0.00 H new ATOM 0 HB2 LEU B 325 -11.661 -0.512 5.215 1.00 0.00 H new ATOM 0 HB3 LEU B 325 -10.784 -0.630 3.703 1.00 0.00 H new ATOM 0 HG LEU B 325 -12.152 1.862 4.814 1.00 0.00 H new ATOM 0 HD11 LEU B 325 -9.819 2.716 4.827 1.00 0.00 H new ATOM 0 HD12 LEU B 325 -9.961 1.245 5.819 1.00 0.00 H new ATOM 0 HD13 LEU B 325 -9.247 1.155 4.191 1.00 0.00 H new ATOM 0 HD21 LEU B 325 -11.247 3.003 2.817 1.00 0.00 H new ATOM 0 HD22 LEU B 325 -10.640 1.448 2.200 1.00 0.00 H new ATOM 0 HD23 LEU B 325 -12.392 1.723 2.353 1.00 0.00 H new ATOM 678 N VAL B 326 -12.442 -2.706 2.888 1.00 0.00 N ATOM 679 CA VAL B 326 -12.624 -4.134 2.906 1.00 0.00 C ATOM 680 C VAL B 326 -11.324 -4.820 3.302 1.00 0.00 C ATOM 681 O VAL B 326 -10.299 -4.574 2.667 1.00 0.00 O ATOM 682 CB VAL B 326 -13.012 -4.562 1.505 1.00 0.00 C ATOM 683 CG1 VAL B 326 -12.745 -6.050 1.324 1.00 0.00 C ATOM 684 CG2 VAL B 326 -14.489 -4.254 1.285 1.00 0.00 C ATOM 0 H VAL B 326 -11.685 -2.381 2.286 1.00 0.00 H new ATOM 0 HA VAL B 326 -13.395 -4.409 3.626 1.00 0.00 H new ATOM 0 HB VAL B 326 -12.417 -4.016 0.773 1.00 0.00 H new ATOM 0 HG11 VAL B 326 -13.026 -6.350 0.315 1.00 0.00 H new ATOM 0 HG12 VAL B 326 -11.685 -6.251 1.480 1.00 0.00 H new ATOM 0 HG13 VAL B 326 -13.332 -6.616 2.048 1.00 0.00 H new ATOM 0 HG21 VAL B 326 -14.778 -4.558 0.279 1.00 0.00 H new ATOM 0 HG22 VAL B 326 -15.087 -4.799 2.015 1.00 0.00 H new ATOM 0 HG23 VAL B 326 -14.659 -3.184 1.403 1.00 0.00 H new ATOM 694 N PRO B 327 -11.315 -5.675 4.306 1.00 0.00 N ATOM 695 CA PRO B 327 -10.071 -6.373 4.689 1.00 0.00 C ATOM 696 C PRO B 327 -9.398 -6.859 3.427 1.00 0.00 C ATOM 697 O PRO B 327 -10.077 -7.195 2.457 1.00 0.00 O ATOM 698 CB PRO B 327 -10.543 -7.529 5.567 1.00 0.00 C ATOM 699 CG PRO B 327 -11.847 -7.080 6.144 1.00 0.00 C ATOM 700 CD PRO B 327 -12.450 -6.070 5.161 1.00 0.00 C ATOM 0 HA PRO B 327 -9.349 -5.753 5.220 1.00 0.00 H new ATOM 0 HB2 PRO B 327 -10.665 -8.442 4.984 1.00 0.00 H new ATOM 0 HB3 PRO B 327 -9.820 -7.747 6.353 1.00 0.00 H new ATOM 0 HG2 PRO B 327 -12.518 -7.927 6.286 1.00 0.00 H new ATOM 0 HG3 PRO B 327 -11.699 -6.624 7.123 1.00 0.00 H new ATOM 0 HD2 PRO B 327 -13.254 -6.516 4.575 1.00 0.00 H new ATOM 0 HD3 PRO B 327 -12.874 -5.211 5.682 1.00 0.00 H new ATOM 708 N ARG B 328 -8.087 -6.857 3.399 1.00 0.00 N ATOM 709 CA ARG B 328 -7.404 -7.253 2.204 1.00 0.00 C ATOM 710 C ARG B 328 -6.086 -7.859 2.580 1.00 0.00 C ATOM 711 O ARG B 328 -5.828 -8.100 3.756 1.00 0.00 O ATOM 712 CB ARG B 328 -7.220 -6.048 1.269 1.00 0.00 C ATOM 713 CG ARG B 328 -6.823 -6.518 -0.134 1.00 0.00 C ATOM 714 CD ARG B 328 -7.633 -5.748 -1.177 1.00 0.00 C ATOM 715 NE ARG B 328 -9.060 -5.957 -0.965 1.00 0.00 N ATOM 716 CZ ARG B 328 -9.645 -7.099 -1.308 1.00 0.00 C ATOM 717 NH1 ARG B 328 -8.941 -8.055 -1.850 1.00 0.00 N ATOM 718 NH2 ARG B 328 -10.924 -7.265 -1.103 1.00 0.00 N1+ ATOM 0 H ARG B 328 -7.486 -6.590 4.178 1.00 0.00 H new ATOM 0 HA ARG B 328 -7.994 -7.995 1.666 1.00 0.00 H new ATOM 0 HB2 ARG B 328 -8.145 -5.474 1.219 1.00 0.00 H new ATOM 0 HB3 ARG B 328 -6.453 -5.384 1.668 1.00 0.00 H new ATOM 0 HG2 ARG B 328 -5.757 -6.358 -0.295 1.00 0.00 H new ATOM 0 HG3 ARG B 328 -7.003 -7.588 -0.235 1.00 0.00 H new ATOM 0 HD2 ARG B 328 -7.401 -4.685 -1.115 1.00 0.00 H new ATOM 0 HD3 ARG B 328 -7.355 -6.077 -2.178 1.00 0.00 H new ATOM 0 HE ARG B 328 -9.619 -5.214 -0.546 1.00 0.00 H new ATOM 0 HH11 ARG B 328 -7.942 -7.925 -2.010 1.00 0.00 H new ATOM 0 HH12 ARG B 328 -9.390 -8.932 -2.114 1.00 0.00 H new ATOM 0 HH21 ARG B 328 -11.474 -6.518 -0.679 1.00 0.00 H new ATOM 0 HH22 ARG B 328 -11.373 -8.142 -1.366 1.00 0.00 H new ATOM 732 N LEU B 329 -5.275 -8.150 1.596 1.00 0.00 N ATOM 733 CA LEU B 329 -4.027 -8.787 1.864 1.00 0.00 C ATOM 734 C LEU B 329 -2.983 -8.255 0.908 1.00 0.00 C ATOM 735 O LEU B 329 -3.153 -8.306 -0.294 1.00 0.00 O ATOM 736 CB LEU B 329 -4.293 -10.292 1.740 1.00 0.00 C ATOM 737 CG LEU B 329 -3.189 -11.170 2.354 1.00 0.00 C ATOM 738 CD1 LEU B 329 -3.177 -12.539 1.661 1.00 0.00 C ATOM 739 CD2 LEU B 329 -1.808 -10.540 2.206 1.00 0.00 C ATOM 0 H LEU B 329 -5.460 -7.955 0.612 1.00 0.00 H new ATOM 0 HA LEU B 329 -3.632 -8.585 2.859 1.00 0.00 H new ATOM 0 HB2 LEU B 329 -5.241 -10.525 2.224 1.00 0.00 H new ATOM 0 HB3 LEU B 329 -4.403 -10.547 0.686 1.00 0.00 H new ATOM 0 HG LEU B 329 -3.408 -11.273 3.417 1.00 0.00 H new ATOM 0 HD11 LEU B 329 -2.395 -13.160 2.097 1.00 0.00 H new ATOM 0 HD12 LEU B 329 -4.144 -13.024 1.797 1.00 0.00 H new ATOM 0 HD13 LEU B 329 -2.984 -12.406 0.596 1.00 0.00 H new ATOM 0 HD21 LEU B 329 -1.060 -11.194 2.654 1.00 0.00 H new ATOM 0 HD22 LEU B 329 -1.583 -10.401 1.149 1.00 0.00 H new ATOM 0 HD23 LEU B 329 -1.793 -9.574 2.710 1.00 0.00 H new ATOM 751 N LEU B 330 -1.916 -7.712 1.467 1.00 0.00 N ATOM 752 CA LEU B 330 -0.847 -7.142 0.684 1.00 0.00 C ATOM 753 C LEU B 330 0.297 -8.114 0.644 1.00 0.00 C ATOM 754 O LEU B 330 0.420 -8.950 1.530 1.00 0.00 O ATOM 755 CB LEU B 330 -0.422 -5.832 1.354 1.00 0.00 C ATOM 756 CG LEU B 330 0.908 -5.304 0.798 1.00 0.00 C ATOM 757 CD1 LEU B 330 0.727 -4.864 -0.650 1.00 0.00 C ATOM 758 CD2 LEU B 330 1.343 -4.121 1.651 1.00 0.00 C ATOM 0 H LEU B 330 -1.771 -7.656 2.475 1.00 0.00 H new ATOM 0 HA LEU B 330 -1.167 -6.941 -0.339 1.00 0.00 H new ATOM 0 HB2 LEU B 330 -1.199 -5.082 1.208 1.00 0.00 H new ATOM 0 HB3 LEU B 330 -0.329 -5.989 2.429 1.00 0.00 H new ATOM 0 HG LEU B 330 1.666 -6.087 0.828 1.00 0.00 H new ATOM 0 HD11 LEU B 330 1.675 -4.491 -1.038 1.00 0.00 H new ATOM 0 HD12 LEU B 330 0.399 -5.713 -1.250 1.00 0.00 H new ATOM 0 HD13 LEU B 330 -0.022 -4.074 -0.699 1.00 0.00 H new ATOM 0 HD21 LEU B 330 2.287 -3.729 1.274 1.00 0.00 H new ATOM 0 HD22 LEU B 330 0.583 -3.341 1.607 1.00 0.00 H new ATOM 0 HD23 LEU B 330 1.471 -4.445 2.684 1.00 0.00 H new ATOM 770 N GLY B 331 1.156 -7.977 -0.353 1.00 0.00 N ATOM 771 CA GLY B 331 2.299 -8.829 -0.434 1.00 0.00 C ATOM 772 C GLY B 331 3.504 -8.048 -0.913 1.00 0.00 C ATOM 773 O GLY B 331 3.611 -7.696 -2.081 1.00 0.00 O ATOM 0 H GLY B 331 1.074 -7.289 -1.102 1.00 0.00 H new ATOM 0 HA2 GLY B 331 2.505 -9.266 0.543 1.00 0.00 H new ATOM 0 HA3 GLY B 331 2.098 -9.655 -1.116 1.00 0.00 H new ATOM 777 N ILE B 332 4.426 -7.804 -0.007 1.00 0.00 N ATOM 778 CA ILE B 332 5.644 -7.115 -0.366 1.00 0.00 C ATOM 779 C ILE B 332 6.651 -8.142 -0.815 1.00 0.00 C ATOM 780 O ILE B 332 6.973 -9.070 -0.082 1.00 0.00 O ATOM 781 CB ILE B 332 6.226 -6.360 0.820 1.00 0.00 C ATOM 782 CG1 ILE B 332 5.161 -5.450 1.434 1.00 0.00 C ATOM 783 CG2 ILE B 332 7.424 -5.524 0.353 1.00 0.00 C ATOM 784 CD1 ILE B 332 4.531 -4.585 0.341 1.00 0.00 C ATOM 0 H ILE B 332 4.356 -8.070 0.975 1.00 0.00 H new ATOM 0 HA ILE B 332 5.419 -6.398 -1.156 1.00 0.00 H new ATOM 0 HB ILE B 332 6.556 -7.073 1.576 1.00 0.00 H new ATOM 0 HG12 ILE B 332 4.394 -6.050 1.924 1.00 0.00 H new ATOM 0 HG13 ILE B 332 5.608 -4.817 2.200 1.00 0.00 H new ATOM 0 HG21 ILE B 332 7.842 -4.982 1.201 1.00 0.00 H new ATOM 0 HG22 ILE B 332 8.184 -6.182 -0.068 1.00 0.00 H new ATOM 0 HG23 ILE B 332 7.098 -4.813 -0.406 1.00 0.00 H new ATOM 0 HD11 ILE B 332 3.773 -3.938 0.781 1.00 0.00 H new ATOM 0 HD12 ILE B 332 5.302 -3.974 -0.129 1.00 0.00 H new ATOM 0 HD13 ILE B 332 4.069 -5.226 -0.410 1.00 0.00 H new ATOM 796 N THR B 333 7.143 -7.958 -2.013 1.00 0.00 N ATOM 797 CA THR B 333 8.109 -8.846 -2.582 1.00 0.00 C ATOM 798 C THR B 333 9.371 -8.070 -2.847 1.00 0.00 C ATOM 799 O THR B 333 9.316 -6.943 -3.321 1.00 0.00 O ATOM 800 CB THR B 333 7.550 -9.411 -3.882 1.00 0.00 C ATOM 801 OG1 THR B 333 7.789 -8.498 -4.938 1.00 0.00 O ATOM 802 CG2 THR B 333 6.045 -9.624 -3.727 1.00 0.00 C ATOM 0 H THR B 333 6.880 -7.182 -2.620 1.00 0.00 H new ATOM 0 HA THR B 333 8.328 -9.670 -1.903 1.00 0.00 H new ATOM 0 HB THR B 333 8.037 -10.360 -4.108 1.00 0.00 H new ATOM 0 HG1 THR B 333 7.041 -8.526 -5.571 1.00 0.00 H new ATOM 0 HG21 THR B 333 5.637 -10.028 -4.654 1.00 0.00 H new ATOM 0 HG22 THR B 333 5.859 -10.324 -2.913 1.00 0.00 H new ATOM 0 HG23 THR B 333 5.564 -8.672 -3.504 1.00 0.00 H new ATOM 810 N LYS B 334 10.504 -8.663 -2.541 1.00 0.00 N ATOM 811 CA LYS B 334 11.782 -7.989 -2.752 1.00 0.00 C ATOM 812 C LYS B 334 11.966 -7.571 -4.204 1.00 0.00 C ATOM 813 O LYS B 334 13.057 -7.221 -4.625 1.00 0.00 O ATOM 814 CB LYS B 334 12.919 -8.902 -2.335 1.00 0.00 C ATOM 815 CG LYS B 334 12.823 -10.228 -3.092 1.00 0.00 C ATOM 816 CD LYS B 334 14.172 -10.540 -3.744 1.00 0.00 C ATOM 817 CE LYS B 334 15.252 -10.647 -2.667 1.00 0.00 C ATOM 818 NZ LYS B 334 16.138 -9.451 -2.730 1.00 0.00 N1+ ATOM 0 H LYS B 334 10.575 -9.602 -2.148 1.00 0.00 H new ATOM 0 HA LYS B 334 11.787 -7.087 -2.141 1.00 0.00 H new ATOM 0 HB2 LYS B 334 13.876 -8.423 -2.541 1.00 0.00 H new ATOM 0 HB3 LYS B 334 12.878 -9.082 -1.261 1.00 0.00 H new ATOM 0 HG2 LYS B 334 12.543 -11.030 -2.409 1.00 0.00 H new ATOM 0 HG3 LYS B 334 12.044 -10.170 -3.852 1.00 0.00 H new ATOM 0 HD2 LYS B 334 14.109 -11.473 -4.304 1.00 0.00 H new ATOM 0 HD3 LYS B 334 14.432 -9.758 -4.457 1.00 0.00 H new ATOM 0 HE2 LYS B 334 14.792 -10.720 -1.682 1.00 0.00 H new ATOM 0 HE3 LYS B 334 15.838 -11.555 -2.813 1.00 0.00 H new ATOM 0 HZ1 LYS B 334 17.127 -9.744 -2.596 1.00 0.00 H new ATOM 0 HZ2 LYS B 334 16.036 -8.992 -3.657 1.00 0.00 H new ATOM 0 HZ3 LYS B 334 15.871 -8.781 -1.981 1.00 0.00 H new ATOM 832 N GLU B 335 10.888 -7.623 -4.951 1.00 0.00 N ATOM 833 CA GLU B 335 10.885 -7.228 -6.351 1.00 0.00 C ATOM 834 C GLU B 335 9.571 -6.555 -6.721 1.00 0.00 C ATOM 835 O GLU B 335 9.383 -6.154 -7.869 1.00 0.00 O ATOM 836 CB GLU B 335 11.095 -8.450 -7.240 1.00 0.00 C ATOM 837 CG GLU B 335 10.098 -9.545 -6.848 1.00 0.00 C ATOM 838 CD GLU B 335 10.251 -10.747 -7.773 1.00 0.00 C ATOM 839 OE1 GLU B 335 10.370 -10.538 -8.969 1.00 0.00 O ATOM 840 OE2 GLU B 335 10.249 -11.859 -7.272 1.00 0.00 O1- ATOM 0 H GLU B 335 9.981 -7.941 -4.609 1.00 0.00 H new ATOM 0 HA GLU B 335 11.699 -6.519 -6.505 1.00 0.00 H new ATOM 0 HB2 GLU B 335 10.960 -8.179 -8.287 1.00 0.00 H new ATOM 0 HB3 GLU B 335 12.116 -8.818 -7.135 1.00 0.00 H new ATOM 0 HG2 GLU B 335 10.266 -9.848 -5.814 1.00 0.00 H new ATOM 0 HG3 GLU B 335 9.080 -9.159 -6.906 1.00 0.00 H new ATOM 847 N CYS B 336 8.634 -6.474 -5.775 1.00 0.00 N ATOM 848 CA CYS B 336 7.340 -5.898 -6.088 1.00 0.00 C ATOM 849 C CYS B 336 6.452 -5.747 -4.877 1.00 0.00 C ATOM 850 O CYS B 336 6.813 -6.092 -3.754 1.00 0.00 O ATOM 851 CB CYS B 336 6.618 -6.755 -7.132 1.00 0.00 C ATOM 852 SG CYS B 336 5.261 -7.665 -6.350 1.00 0.00 S ATOM 0 H CYS B 336 8.748 -6.792 -4.813 1.00 0.00 H new ATOM 0 HA CYS B 336 7.535 -4.900 -6.480 1.00 0.00 H new ATOM 0 HB2 CYS B 336 6.231 -6.122 -7.930 1.00 0.00 H new ATOM 0 HB3 CYS B 336 7.319 -7.453 -7.590 1.00 0.00 H new ATOM 0 HG CYS B 336 4.652 -8.388 -7.243 1.00 0.00 H new ATOM 858 N VAL B 337 5.280 -5.212 -5.152 1.00 0.00 N ATOM 859 CA VAL B 337 4.273 -4.972 -4.143 1.00 0.00 C ATOM 860 C VAL B 337 2.964 -5.396 -4.733 1.00 0.00 C ATOM 861 O VAL B 337 2.802 -5.277 -5.940 1.00 0.00 O ATOM 862 CB VAL B 337 4.259 -3.492 -3.842 1.00 0.00 C ATOM 863 CG1 VAL B 337 3.420 -3.213 -2.601 1.00 0.00 C ATOM 864 CG2 VAL B 337 5.699 -3.070 -3.610 1.00 0.00 C ATOM 0 H VAL B 337 4.999 -4.930 -6.091 1.00 0.00 H new ATOM 0 HA VAL B 337 4.466 -5.520 -3.221 1.00 0.00 H new ATOM 0 HB VAL B 337 3.821 -2.933 -4.669 1.00 0.00 H new ATOM 0 HG11 VAL B 337 3.419 -2.142 -2.396 1.00 0.00 H new ATOM 0 HG12 VAL B 337 2.398 -3.551 -2.769 1.00 0.00 H new ATOM 0 HG13 VAL B 337 3.843 -3.745 -1.749 1.00 0.00 H new ATOM 0 HG21 VAL B 337 5.734 -2.003 -3.388 1.00 0.00 H new ATOM 0 HG22 VAL B 337 6.111 -3.629 -2.770 1.00 0.00 H new ATOM 0 HG23 VAL B 337 6.287 -3.274 -4.505 1.00 0.00 H new ATOM 874 N MET B 338 2.048 -5.941 -3.948 1.00 0.00 N ATOM 875 CA MET B 338 0.825 -6.402 -4.582 1.00 0.00 C ATOM 876 C MET B 338 -0.381 -6.430 -3.665 1.00 0.00 C ATOM 877 O MET B 338 -0.273 -6.697 -2.471 1.00 0.00 O ATOM 878 CB MET B 338 1.042 -7.809 -5.128 1.00 0.00 C ATOM 879 CG MET B 338 1.988 -8.600 -4.221 1.00 0.00 C ATOM 880 SD MET B 338 2.286 -10.236 -4.934 1.00 0.00 S ATOM 881 CE MET B 338 3.054 -10.988 -3.479 1.00 0.00 C ATOM 0 H MET B 338 2.116 -6.070 -2.938 1.00 0.00 H new ATOM 0 HA MET B 338 0.608 -5.682 -5.371 1.00 0.00 H new ATOM 0 HB2 MET B 338 0.086 -8.327 -5.204 1.00 0.00 H new ATOM 0 HB3 MET B 338 1.456 -7.754 -6.135 1.00 0.00 H new ATOM 0 HG2 MET B 338 2.931 -8.065 -4.107 1.00 0.00 H new ATOM 0 HG3 MET B 338 1.555 -8.699 -3.226 1.00 0.00 H new ATOM 0 HE1 MET B 338 3.867 -11.642 -3.794 1.00 0.00 H new ATOM 0 HE2 MET B 338 3.449 -10.206 -2.831 1.00 0.00 H new ATOM 0 HE3 MET B 338 2.310 -11.570 -2.935 1.00 0.00 H new ATOM 891 N ARG B 339 -1.547 -6.227 -4.272 1.00 0.00 N ATOM 892 CA ARG B 339 -2.801 -6.298 -3.542 1.00 0.00 C ATOM 893 C ARG B 339 -3.371 -7.693 -3.687 1.00 0.00 C ATOM 894 O ARG B 339 -3.821 -8.088 -4.766 1.00 0.00 O ATOM 895 CB ARG B 339 -3.803 -5.287 -4.084 1.00 0.00 C ATOM 896 CG ARG B 339 -3.185 -3.888 -4.058 1.00 0.00 C ATOM 897 CD ARG B 339 -4.189 -2.874 -4.614 1.00 0.00 C ATOM 898 NE ARG B 339 -4.828 -3.404 -5.814 1.00 0.00 N ATOM 899 CZ ARG B 339 -5.995 -2.934 -6.241 1.00 0.00 C ATOM 900 NH1 ARG B 339 -6.596 -1.977 -5.586 1.00 0.00 N ATOM 901 NH2 ARG B 339 -6.542 -3.431 -7.317 1.00 0.00 N1+ ATOM 0 H ARG B 339 -1.646 -6.013 -5.264 1.00 0.00 H new ATOM 0 HA ARG B 339 -2.613 -6.068 -2.493 1.00 0.00 H new ATOM 0 HB2 ARG B 339 -4.087 -5.551 -5.103 1.00 0.00 H new ATOM 0 HB3 ARG B 339 -4.713 -5.305 -3.485 1.00 0.00 H new ATOM 0 HG2 ARG B 339 -2.909 -3.620 -3.038 1.00 0.00 H new ATOM 0 HG3 ARG B 339 -2.270 -3.872 -4.651 1.00 0.00 H new ATOM 0 HD2 ARG B 339 -4.944 -2.648 -3.861 1.00 0.00 H new ATOM 0 HD3 ARG B 339 -3.681 -1.938 -4.847 1.00 0.00 H new ATOM 0 HE ARG B 339 -4.369 -4.151 -6.336 1.00 0.00 H new ATOM 0 HH11 ARG B 339 -6.169 -1.589 -4.745 1.00 0.00 H new ATOM 0 HH12 ARG B 339 -7.492 -1.618 -5.916 1.00 0.00 H new ATOM 0 HH21 ARG B 339 -6.074 -4.179 -7.828 1.00 0.00 H new ATOM 0 HH22 ARG B 339 -7.438 -3.071 -7.646 1.00 0.00 H new ATOM 915 N VAL B 340 -3.306 -8.440 -2.602 1.00 0.00 N ATOM 916 CA VAL B 340 -3.776 -9.807 -2.582 1.00 0.00 C ATOM 917 C VAL B 340 -5.163 -9.902 -1.976 1.00 0.00 C ATOM 918 O VAL B 340 -5.545 -9.090 -1.137 1.00 0.00 O ATOM 919 CB VAL B 340 -2.788 -10.676 -1.824 1.00 0.00 C ATOM 920 CG1 VAL B 340 -3.015 -12.125 -2.200 1.00 0.00 C ATOM 921 CG2 VAL B 340 -1.378 -10.274 -2.206 1.00 0.00 C ATOM 0 H VAL B 340 -2.926 -8.115 -1.713 1.00 0.00 H new ATOM 0 HA VAL B 340 -3.847 -10.167 -3.608 1.00 0.00 H new ATOM 0 HB VAL B 340 -2.928 -10.548 -0.751 1.00 0.00 H new ATOM 0 HG11 VAL B 340 -2.309 -12.756 -1.660 1.00 0.00 H new ATOM 0 HG12 VAL B 340 -4.033 -12.413 -1.939 1.00 0.00 H new ATOM 0 HG13 VAL B 340 -2.866 -12.250 -3.273 1.00 0.00 H new ATOM 0 HG21 VAL B 340 -0.664 -10.894 -1.665 1.00 0.00 H new ATOM 0 HG22 VAL B 340 -1.238 -10.411 -3.278 1.00 0.00 H new ATOM 0 HG23 VAL B 340 -1.216 -9.227 -1.950 1.00 0.00 H new ATOM 931 N ASP B 341 -5.922 -10.887 -2.438 1.00 0.00 N ATOM 932 CA ASP B 341 -7.284 -11.072 -1.970 1.00 0.00 C ATOM 933 C ASP B 341 -7.318 -11.987 -0.761 1.00 0.00 C ATOM 934 O ASP B 341 -7.405 -13.195 -0.896 1.00 0.00 O ATOM 935 CB ASP B 341 -8.144 -11.665 -3.087 1.00 0.00 C ATOM 936 CG ASP B 341 -9.621 -11.456 -2.775 1.00 0.00 C ATOM 937 OD1 ASP B 341 -9.924 -11.103 -1.647 1.00 0.00 O ATOM 938 OD2 ASP B 341 -10.429 -11.652 -3.667 1.00 0.00 O1- ATOM 0 H ASP B 341 -5.616 -11.567 -3.134 1.00 0.00 H new ATOM 0 HA ASP B 341 -7.682 -10.099 -1.682 1.00 0.00 H new ATOM 0 HB2 ASP B 341 -7.895 -11.194 -4.038 1.00 0.00 H new ATOM 0 HB3 ASP B 341 -7.933 -12.729 -3.193 1.00 0.00 H new ATOM 943 N GLU B 342 -7.257 -11.385 0.412 1.00 0.00 N ATOM 944 CA GLU B 342 -7.284 -12.127 1.670 1.00 0.00 C ATOM 945 C GLU B 342 -8.194 -13.339 1.561 1.00 0.00 C ATOM 946 O GLU B 342 -7.992 -14.354 2.226 1.00 0.00 O ATOM 947 CB GLU B 342 -7.818 -11.190 2.764 1.00 0.00 C ATOM 948 CG GLU B 342 -7.159 -11.475 4.112 1.00 0.00 C ATOM 949 CD GLU B 342 -8.195 -11.373 5.226 1.00 0.00 C ATOM 950 OE1 GLU B 342 -8.912 -12.339 5.431 1.00 0.00 O ATOM 951 OE2 GLU B 342 -8.255 -10.332 5.859 1.00 0.00 O1- ATOM 0 H GLU B 342 -7.188 -10.374 0.526 1.00 0.00 H new ATOM 0 HA GLU B 342 -6.279 -12.474 1.909 1.00 0.00 H new ATOM 0 HB2 GLU B 342 -7.634 -10.154 2.479 1.00 0.00 H new ATOM 0 HB3 GLU B 342 -8.898 -11.310 2.853 1.00 0.00 H new ATOM 0 HG2 GLU B 342 -6.714 -12.470 4.106 1.00 0.00 H new ATOM 0 HG3 GLU B 342 -6.350 -10.766 4.289 1.00 0.00 H new ATOM 958 N LYS B 343 -9.189 -13.212 0.711 1.00 0.00 N ATOM 959 CA LYS B 343 -10.147 -14.280 0.487 1.00 0.00 C ATOM 960 C LYS B 343 -9.549 -15.407 -0.350 1.00 0.00 C ATOM 961 O LYS B 343 -9.772 -16.584 -0.067 1.00 0.00 O ATOM 962 CB LYS B 343 -11.358 -13.718 -0.246 1.00 0.00 C ATOM 963 CG LYS B 343 -12.035 -12.659 0.622 1.00 0.00 C ATOM 964 CD LYS B 343 -12.977 -11.822 -0.242 1.00 0.00 C ATOM 965 CE LYS B 343 -14.099 -11.251 0.628 1.00 0.00 C ATOM 966 NZ LYS B 343 -14.617 -9.998 0.007 1.00 0.00 N1+ ATOM 0 H LYS B 343 -9.359 -12.372 0.157 1.00 0.00 H new ATOM 0 HA LYS B 343 -10.431 -14.686 1.458 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -11.051 -13.282 -1.196 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -12.061 -14.519 -0.475 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -12.591 -13.136 1.429 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -11.285 -12.019 1.086 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -12.426 -11.012 -0.720 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -13.397 -12.435 -1.039 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -14.903 -11.980 0.728 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -13.727 -11.046 1.632 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 -15.380 -9.608 0.597 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -13.847 -9.303 -0.067 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -14.986 -10.208 -0.942 1.00 0.00 H new ATOM 980 N THR B 344 -8.828 -15.038 -1.405 1.00 0.00 N ATOM 981 CA THR B 344 -8.247 -16.023 -2.307 1.00 0.00 C ATOM 982 C THR B 344 -6.726 -16.102 -2.179 1.00 0.00 C ATOM 983 O THR B 344 -6.112 -17.031 -2.702 1.00 0.00 O ATOM 984 CB THR B 344 -8.620 -15.663 -3.743 1.00 0.00 C ATOM 985 OG1 THR B 344 -7.638 -14.789 -4.282 1.00 0.00 O ATOM 986 CG2 THR B 344 -9.985 -14.973 -3.759 1.00 0.00 C ATOM 0 H THR B 344 -8.634 -14.068 -1.654 1.00 0.00 H new ATOM 0 HA THR B 344 -8.647 -17.000 -2.037 1.00 0.00 H new ATOM 0 HB THR B 344 -8.667 -16.571 -4.345 1.00 0.00 H new ATOM 0 HG1 THR B 344 -8.054 -14.199 -4.945 1.00 0.00 H new ATOM 0 HG21 THR B 344 -10.251 -14.716 -4.784 1.00 0.00 H new ATOM 0 HG22 THR B 344 -10.737 -15.645 -3.347 1.00 0.00 H new ATOM 0 HG23 THR B 344 -9.941 -14.065 -3.157 1.00 0.00 H new ATOM 994 N LYS B 345 -6.119 -15.131 -1.499 1.00 0.00 N ATOM 995 CA LYS B 345 -4.675 -15.122 -1.332 1.00 0.00 C ATOM 996 C LYS B 345 -3.999 -14.900 -2.677 1.00 0.00 C ATOM 997 O LYS B 345 -2.774 -14.822 -2.765 1.00 0.00 O ATOM 998 CB LYS B 345 -4.220 -16.447 -0.732 1.00 0.00 C ATOM 999 CG LYS B 345 -2.869 -16.266 -0.037 1.00 0.00 C ATOM 1000 CD LYS B 345 -2.415 -17.604 0.551 1.00 0.00 C ATOM 1001 CE LYS B 345 -1.876 -17.386 1.967 1.00 0.00 C ATOM 1002 NZ LYS B 345 -2.992 -16.977 2.866 1.00 0.00 N1+ ATOM 0 H LYS B 345 -6.604 -14.348 -1.060 1.00 0.00 H new ATOM 0 HA LYS B 345 -4.396 -14.311 -0.659 1.00 0.00 H new ATOM 0 HB2 LYS B 345 -4.961 -16.807 -0.018 1.00 0.00 H new ATOM 0 HB3 LYS B 345 -4.138 -17.202 -1.514 1.00 0.00 H new ATOM 0 HG2 LYS B 345 -2.129 -15.899 -0.748 1.00 0.00 H new ATOM 0 HG3 LYS B 345 -2.951 -15.519 0.752 1.00 0.00 H new ATOM 0 HD2 LYS B 345 -3.249 -18.305 0.573 1.00 0.00 H new ATOM 0 HD3 LYS B 345 -1.643 -18.046 -0.079 1.00 0.00 H new ATOM 0 HE2 LYS B 345 -1.414 -18.301 2.337 1.00 0.00 H new ATOM 0 HE3 LYS B 345 -1.102 -16.619 1.959 1.00 0.00 H new ATOM 0 HZ1 LYS B 345 -2.788 -16.040 3.269 1.00 0.00 H new ATOM 0 HZ2 LYS B 345 -3.878 -16.935 2.323 1.00 0.00 H new ATOM 0 HZ3 LYS B 345 -3.090 -17.670 3.635 1.00 0.00 H new ATOM 1016 N GLU B 346 -4.813 -14.779 -3.721 1.00 0.00 N ATOM 1017 CA GLU B 346 -4.293 -14.539 -5.054 1.00 0.00 C ATOM 1018 C GLU B 346 -4.071 -13.054 -5.247 1.00 0.00 C ATOM 1019 O GLU B 346 -4.712 -12.229 -4.598 1.00 0.00 O ATOM 1020 CB GLU B 346 -5.264 -15.052 -6.110 1.00 0.00 C ATOM 1021 CG GLU B 346 -5.603 -16.512 -5.820 1.00 0.00 C ATOM 1022 CD GLU B 346 -5.530 -17.331 -7.104 1.00 0.00 C ATOM 1023 OE1 GLU B 346 -6.539 -17.426 -7.782 1.00 0.00 O ATOM 1024 OE2 GLU B 346 -4.464 -17.852 -7.391 1.00 0.00 O1- ATOM 0 H GLU B 346 -5.829 -14.843 -3.666 1.00 0.00 H new ATOM 0 HA GLU B 346 -3.348 -15.072 -5.163 1.00 0.00 H new ATOM 0 HB2 GLU B 346 -6.172 -14.449 -6.109 1.00 0.00 H new ATOM 0 HB3 GLU B 346 -4.822 -14.960 -7.102 1.00 0.00 H new ATOM 0 HG2 GLU B 346 -4.909 -16.915 -5.082 1.00 0.00 H new ATOM 0 HG3 GLU B 346 -6.602 -16.583 -5.390 1.00 0.00 H new ATOM 1031 N VAL B 347 -3.136 -12.722 -6.109 1.00 0.00 N ATOM 1032 CA VAL B 347 -2.807 -11.326 -6.346 1.00 0.00 C ATOM 1033 C VAL B 347 -3.746 -10.674 -7.335 1.00 0.00 C ATOM 1034 O VAL B 347 -4.053 -11.228 -8.390 1.00 0.00 O ATOM 1035 CB VAL B 347 -1.375 -11.182 -6.826 1.00 0.00 C ATOM 1036 CG1 VAL B 347 -1.115 -9.718 -7.189 1.00 0.00 C ATOM 1037 CG2 VAL B 347 -0.446 -11.589 -5.688 1.00 0.00 C ATOM 0 H VAL B 347 -2.592 -13.390 -6.655 1.00 0.00 H new ATOM 0 HA VAL B 347 -2.921 -10.813 -5.391 1.00 0.00 H new ATOM 0 HB VAL B 347 -1.201 -11.811 -7.699 1.00 0.00 H new ATOM 0 HG11 VAL B 347 -0.087 -9.606 -7.535 1.00 0.00 H new ATOM 0 HG12 VAL B 347 -1.800 -9.412 -7.980 1.00 0.00 H new ATOM 0 HG13 VAL B 347 -1.272 -9.092 -6.311 1.00 0.00 H new ATOM 0 HG21 VAL B 347 0.590 -11.493 -6.012 1.00 0.00 H new ATOM 0 HG22 VAL B 347 -0.619 -10.942 -4.828 1.00 0.00 H new ATOM 0 HG23 VAL B 347 -0.644 -12.624 -5.409 1.00 0.00 H new ATOM 1047 N ILE B 348 -4.169 -9.469 -6.987 1.00 0.00 N ATOM 1048 CA ILE B 348 -5.043 -8.702 -7.845 1.00 0.00 C ATOM 1049 C ILE B 348 -4.224 -7.621 -8.517 1.00 0.00 C ATOM 1050 O ILE B 348 -4.528 -7.195 -9.632 1.00 0.00 O ATOM 1051 CB ILE B 348 -6.168 -8.066 -7.027 1.00 0.00 C ATOM 1052 CG1 ILE B 348 -6.839 -9.136 -6.161 1.00 0.00 C ATOM 1053 CG2 ILE B 348 -7.203 -7.455 -7.974 1.00 0.00 C ATOM 1054 CD1 ILE B 348 -7.899 -8.485 -5.270 1.00 0.00 C ATOM 0 H ILE B 348 -3.918 -9.005 -6.114 1.00 0.00 H new ATOM 0 HA ILE B 348 -5.491 -9.356 -8.593 1.00 0.00 H new ATOM 0 HB ILE B 348 -5.755 -7.287 -6.386 1.00 0.00 H new ATOM 0 HG12 ILE B 348 -7.298 -9.895 -6.794 1.00 0.00 H new ATOM 0 HG13 ILE B 348 -6.094 -9.641 -5.547 1.00 0.00 H new ATOM 0 HG21 ILE B 348 -8.005 -7.001 -7.392 1.00 0.00 H new ATOM 0 HG22 ILE B 348 -6.727 -6.693 -8.591 1.00 0.00 H new ATOM 0 HG23 ILE B 348 -7.615 -8.235 -8.614 1.00 0.00 H new ATOM 0 HD11 ILE B 348 -8.375 -9.248 -4.654 1.00 0.00 H new ATOM 0 HD12 ILE B 348 -7.427 -7.742 -4.627 1.00 0.00 H new ATOM 0 HD13 ILE B 348 -8.650 -8.000 -5.893 1.00 0.00 H new ATOM 1066 N GLN B 349 -3.182 -7.168 -7.820 1.00 0.00 N ATOM 1067 CA GLN B 349 -2.335 -6.127 -8.354 1.00 0.00 C ATOM 1068 C GLN B 349 -0.880 -6.378 -8.043 1.00 0.00 C ATOM 1069 O GLN B 349 -0.544 -7.043 -7.064 1.00 0.00 O ATOM 1070 CB GLN B 349 -2.722 -4.821 -7.723 1.00 0.00 C ATOM 1071 CG GLN B 349 -1.875 -3.693 -8.293 1.00 0.00 C ATOM 1072 CD GLN B 349 -2.584 -2.360 -8.086 1.00 0.00 C ATOM 1073 OE1 GLN B 349 -3.865 -2.268 -8.330 1.00 0.00 O flip ATOM 1074 NE2 GLN B 349 -1.959 -1.375 -7.691 1.00 0.00 N flip ATOM 0 H GLN B 349 -2.914 -7.507 -6.896 1.00 0.00 H new ATOM 0 HA GLN B 349 -2.465 -6.108 -9.436 1.00 0.00 H new ATOM 0 HB2 GLN B 349 -3.778 -4.620 -7.903 1.00 0.00 H new ATOM 0 HB3 GLN B 349 -2.588 -4.876 -6.643 1.00 0.00 H new ATOM 0 HG2 GLN B 349 -0.900 -3.676 -7.806 1.00 0.00 H new ATOM 0 HG3 GLN B 349 -1.698 -3.860 -9.355 1.00 0.00 H new ATOM 0 HE21 GLN B 349 -0.960 -1.448 -7.501 1.00 0.00 H new ATOM 0 HE22 GLN B 349 -2.441 -0.487 -7.554 1.00 0.00 H new ATOM 1083 N GLU B 350 -0.025 -5.799 -8.868 1.00 0.00 N ATOM 1084 CA GLU B 350 1.412 -5.914 -8.680 1.00 0.00 C ATOM 1085 C GLU B 350 2.129 -4.648 -9.102 1.00 0.00 C ATOM 1086 O GLU B 350 1.713 -3.954 -10.031 1.00 0.00 O ATOM 1087 CB GLU B 350 2.012 -7.043 -9.509 1.00 0.00 C ATOM 1088 CG GLU B 350 1.422 -8.387 -9.103 1.00 0.00 C ATOM 1089 CD GLU B 350 1.845 -9.479 -10.083 1.00 0.00 C ATOM 1090 OE1 GLU B 350 1.783 -9.233 -11.276 1.00 0.00 O ATOM 1091 OE2 GLU B 350 2.217 -10.545 -9.623 1.00 0.00 O1- ATOM 0 H GLU B 350 -0.301 -5.243 -9.677 1.00 0.00 H new ATOM 0 HA GLU B 350 1.548 -6.108 -7.616 1.00 0.00 H new ATOM 0 HB2 GLU B 350 1.823 -6.863 -10.567 1.00 0.00 H new ATOM 0 HB3 GLU B 350 3.094 -7.061 -9.377 1.00 0.00 H new ATOM 0 HG2 GLU B 350 1.752 -8.646 -8.097 1.00 0.00 H new ATOM 0 HG3 GLU B 350 0.335 -8.319 -9.074 1.00 0.00 H new ATOM 1098 N TRP B 351 3.236 -4.391 -8.437 1.00 0.00 N ATOM 1099 CA TRP B 351 4.065 -3.240 -8.766 1.00 0.00 C ATOM 1100 C TRP B 351 5.452 -3.393 -8.185 1.00 0.00 C ATOM 1101 O TRP B 351 5.609 -3.797 -7.047 1.00 0.00 O ATOM 1102 CB TRP B 351 3.445 -1.963 -8.260 1.00 0.00 C ATOM 1103 CG TRP B 351 4.239 -0.836 -8.801 1.00 0.00 C ATOM 1104 CD1 TRP B 351 5.179 -0.172 -8.117 1.00 0.00 C ATOM 1105 CD2 TRP B 351 4.203 -0.250 -10.130 1.00 0.00 C ATOM 1106 NE1 TRP B 351 5.705 0.810 -8.926 1.00 0.00 N ATOM 1107 CE2 TRP B 351 5.140 0.803 -10.178 1.00 0.00 C ATOM 1108 CE3 TRP B 351 3.450 -0.524 -11.277 1.00 0.00 C ATOM 1109 CZ2 TRP B 351 5.325 1.571 -11.324 1.00 0.00 C ATOM 1110 CZ3 TRP B 351 3.632 0.246 -12.444 1.00 0.00 C ATOM 1111 CH2 TRP B 351 4.571 1.293 -12.464 1.00 0.00 C ATOM 0 H TRP B 351 3.586 -4.960 -7.666 1.00 0.00 H new ATOM 0 HA TRP B 351 4.137 -3.189 -9.852 1.00 0.00 H new ATOM 0 HB2 TRP B 351 2.406 -1.888 -8.581 1.00 0.00 H new ATOM 0 HB3 TRP B 351 3.444 -1.943 -7.170 1.00 0.00 H new ATOM 0 HD1 TRP B 351 5.476 -0.374 -7.098 1.00 0.00 H new ATOM 0 HE1 TRP B 351 6.429 1.465 -8.631 1.00 0.00 H new ATOM 0 HE3 TRP B 351 2.728 -1.327 -11.268 1.00 0.00 H new ATOM 0 HZ2 TRP B 351 6.046 2.375 -11.330 1.00 0.00 H new ATOM 0 HZ3 TRP B 351 3.048 0.031 -13.327 1.00 0.00 H new ATOM 0 HH2 TRP B 351 4.708 1.880 -13.360 1.00 0.00 H new ATOM 1122 N SER B 352 6.453 -3.071 -8.992 1.00 0.00 N ATOM 1123 CA SER B 352 7.832 -3.193 -8.578 1.00 0.00 C ATOM 1124 C SER B 352 8.091 -2.453 -7.287 1.00 0.00 C ATOM 1125 O SER B 352 7.639 -1.327 -7.093 1.00 0.00 O ATOM 1126 CB SER B 352 8.767 -2.650 -9.649 1.00 0.00 C ATOM 1127 OG SER B 352 8.008 -2.033 -10.681 1.00 0.00 O ATOM 0 H SER B 352 6.328 -2.722 -9.942 1.00 0.00 H new ATOM 0 HA SER B 352 8.024 -4.255 -8.423 1.00 0.00 H new ATOM 0 HB2 SER B 352 9.457 -1.929 -9.211 1.00 0.00 H new ATOM 0 HB3 SER B 352 9.371 -3.458 -10.062 1.00 0.00 H new ATOM 0 HG SER B 352 7.681 -2.718 -11.301 1.00 0.00 H new ATOM 1133 N LEU B 353 8.859 -3.087 -6.426 1.00 0.00 N ATOM 1134 CA LEU B 353 9.232 -2.492 -5.179 1.00 0.00 C ATOM 1135 C LEU B 353 10.348 -1.511 -5.486 1.00 0.00 C ATOM 1136 O LEU B 353 10.420 -0.416 -4.928 1.00 0.00 O ATOM 1137 CB LEU B 353 9.698 -3.612 -4.248 1.00 0.00 C ATOM 1138 CG LEU B 353 9.372 -3.304 -2.789 1.00 0.00 C ATOM 1139 CD1 LEU B 353 9.526 -4.564 -1.971 1.00 0.00 C ATOM 1140 CD2 LEU B 353 10.345 -2.280 -2.257 1.00 0.00 C ATOM 0 H LEU B 353 9.235 -4.023 -6.578 1.00 0.00 H new ATOM 0 HA LEU B 353 8.413 -1.965 -4.690 1.00 0.00 H new ATOM 0 HB2 LEU B 353 9.221 -4.548 -4.538 1.00 0.00 H new ATOM 0 HB3 LEU B 353 10.773 -3.754 -4.359 1.00 0.00 H new ATOM 0 HG LEU B 353 8.352 -2.924 -2.723 1.00 0.00 H new ATOM 0 HD11 LEU B 353 9.295 -4.351 -0.927 1.00 0.00 H new ATOM 0 HD12 LEU B 353 8.843 -5.327 -2.346 1.00 0.00 H new ATOM 0 HD13 LEU B 353 10.551 -4.925 -2.049 1.00 0.00 H new ATOM 0 HD21 LEU B 353 10.110 -2.062 -1.215 1.00 0.00 H new ATOM 0 HD22 LEU B 353 11.360 -2.672 -2.326 1.00 0.00 H new ATOM 0 HD23 LEU B 353 10.269 -1.366 -2.845 1.00 0.00 H new ATOM 1152 N THR B 354 11.177 -1.901 -6.447 1.00 0.00 N ATOM 1153 CA THR B 354 12.265 -1.044 -6.899 1.00 0.00 C ATOM 1154 C THR B 354 11.717 0.078 -7.761 1.00 0.00 C ATOM 1155 O THR B 354 12.478 0.806 -8.399 1.00 0.00 O ATOM 1156 CB THR B 354 13.286 -1.858 -7.698 1.00 0.00 C ATOM 1157 OG1 THR B 354 14.506 -1.133 -7.780 1.00 0.00 O ATOM 1158 CG2 THR B 354 12.749 -2.115 -9.106 1.00 0.00 C ATOM 0 H THR B 354 11.117 -2.800 -6.926 1.00 0.00 H new ATOM 0 HA THR B 354 12.759 -0.618 -6.026 1.00 0.00 H new ATOM 0 HB THR B 354 13.461 -2.811 -7.199 1.00 0.00 H new ATOM 0 HG1 THR B 354 14.319 -0.205 -8.035 1.00 0.00 H new ATOM 0 HG21 THR B 354 13.477 -2.695 -9.673 1.00 0.00 H new ATOM 0 HG22 THR B 354 11.813 -2.670 -9.043 1.00 0.00 H new ATOM 0 HG23 THR B 354 12.573 -1.163 -9.608 1.00 0.00 H new ATOM 1166 N ASN B 355 10.394 0.223 -7.761 1.00 0.00 N ATOM 1167 CA ASN B 355 9.761 1.283 -8.538 1.00 0.00 C ATOM 1168 C ASN B 355 9.081 2.272 -7.615 1.00 0.00 C ATOM 1169 O ASN B 355 8.541 3.283 -8.064 1.00 0.00 O ATOM 1170 CB ASN B 355 8.726 0.710 -9.500 1.00 0.00 C ATOM 1171 CG ASN B 355 9.422 0.163 -10.742 1.00 0.00 C ATOM 1172 OD1 ASN B 355 10.623 -0.101 -10.714 1.00 0.00 O ATOM 1173 ND2 ASN B 355 8.737 -0.022 -11.837 1.00 0.00 N ATOM 0 H ASN B 355 9.749 -0.371 -7.240 1.00 0.00 H new ATOM 0 HA ASN B 355 10.539 1.787 -9.111 1.00 0.00 H new ATOM 0 HB2 ASN B 355 8.160 -0.083 -9.010 1.00 0.00 H new ATOM 0 HB3 ASN B 355 8.012 1.483 -9.783 1.00 0.00 H new ATOM 0 HD21 ASN B 355 9.197 -0.386 -12.671 1.00 0.00 H new ATOM 0 HD22 ASN B 355 7.741 0.197 -11.859 1.00 0.00 H new ATOM 1180 N ILE B 356 9.100 1.978 -6.322 1.00 0.00 N ATOM 1181 CA ILE B 356 8.467 2.855 -5.361 1.00 0.00 C ATOM 1182 C ILE B 356 9.059 4.261 -5.432 1.00 0.00 C ATOM 1183 O ILE B 356 10.241 4.430 -5.739 1.00 0.00 O ATOM 1184 CB ILE B 356 8.642 2.262 -3.978 1.00 0.00 C ATOM 1185 CG1 ILE B 356 7.768 1.007 -3.876 1.00 0.00 C ATOM 1186 CG2 ILE B 356 8.212 3.289 -2.944 1.00 0.00 C ATOM 1187 CD1 ILE B 356 8.016 0.289 -2.550 1.00 0.00 C ATOM 0 H ILE B 356 9.542 1.150 -5.923 1.00 0.00 H new ATOM 0 HA ILE B 356 7.405 2.942 -5.589 1.00 0.00 H new ATOM 0 HB ILE B 356 9.684 1.995 -3.800 1.00 0.00 H new ATOM 0 HG12 ILE B 356 6.716 1.282 -3.957 1.00 0.00 H new ATOM 0 HG13 ILE B 356 7.987 0.336 -4.706 1.00 0.00 H new ATOM 0 HG21 ILE B 356 8.334 2.872 -1.944 1.00 0.00 H new ATOM 0 HG22 ILE B 356 8.827 4.183 -3.042 1.00 0.00 H new ATOM 0 HG23 ILE B 356 7.166 3.549 -3.103 1.00 0.00 H new ATOM 0 HD11 ILE B 356 7.387 -0.600 -2.494 1.00 0.00 H new ATOM 0 HD12 ILE B 356 9.064 -0.003 -2.485 1.00 0.00 H new ATOM 0 HD13 ILE B 356 7.774 0.957 -1.724 1.00 0.00 H new ATOM 1199 N LYS B 357 8.232 5.270 -5.142 1.00 0.00 N ATOM 1200 CA LYS B 357 8.691 6.658 -5.175 1.00 0.00 C ATOM 1201 C LYS B 357 8.834 7.166 -3.749 1.00 0.00 C ATOM 1202 O LYS B 357 9.849 7.758 -3.378 1.00 0.00 O ATOM 1203 CB LYS B 357 7.700 7.521 -5.968 1.00 0.00 C ATOM 1204 CG LYS B 357 8.447 8.680 -6.626 1.00 0.00 C ATOM 1205 CD LYS B 357 8.999 8.227 -7.978 1.00 0.00 C ATOM 1206 CE LYS B 357 10.243 9.045 -8.324 1.00 0.00 C ATOM 1207 NZ LYS B 357 10.648 8.762 -9.729 1.00 0.00 N1+ ATOM 0 H LYS B 357 7.252 5.152 -4.885 1.00 0.00 H new ATOM 0 HA LYS B 357 9.660 6.717 -5.672 1.00 0.00 H new ATOM 0 HB2 LYS B 357 7.202 6.918 -6.727 1.00 0.00 H new ATOM 0 HB3 LYS B 357 6.924 7.904 -5.306 1.00 0.00 H new ATOM 0 HG2 LYS B 357 7.777 9.529 -6.761 1.00 0.00 H new ATOM 0 HG3 LYS B 357 9.261 9.015 -5.982 1.00 0.00 H new ATOM 0 HD2 LYS B 357 9.247 7.166 -7.944 1.00 0.00 H new ATOM 0 HD3 LYS B 357 8.242 8.353 -8.752 1.00 0.00 H new ATOM 0 HE2 LYS B 357 10.038 10.108 -8.200 1.00 0.00 H new ATOM 0 HE3 LYS B 357 11.056 8.796 -7.643 1.00 0.00 H new ATOM 0 HZ1 LYS B 357 11.494 9.318 -9.965 1.00 0.00 H new ATOM 0 HZ2 LYS B 357 10.860 7.749 -9.832 1.00 0.00 H new ATOM 0 HZ3 LYS B 357 9.873 9.021 -10.373 1.00 0.00 H new ATOM 1221 N ARG B 358 7.823 6.877 -2.949 1.00 0.00 N ATOM 1222 CA ARG B 358 7.823 7.236 -1.545 1.00 0.00 C ATOM 1223 C ARG B 358 6.577 6.646 -0.898 1.00 0.00 C ATOM 1224 O ARG B 358 5.496 6.677 -1.469 1.00 0.00 O ATOM 1225 CB ARG B 358 7.863 8.753 -1.362 1.00 0.00 C ATOM 1226 CG ARG B 358 6.863 9.419 -2.297 1.00 0.00 C ATOM 1227 CD ARG B 358 7.107 10.921 -2.321 1.00 0.00 C ATOM 1228 NE ARG B 358 5.840 11.629 -2.458 1.00 0.00 N ATOM 1229 CZ ARG B 358 5.779 12.835 -3.014 1.00 0.00 C ATOM 1230 NH1 ARG B 358 6.867 13.415 -3.440 1.00 0.00 N ATOM 1231 NH2 ARG B 358 4.628 13.438 -3.134 1.00 0.00 N1+ ATOM 0 H ARG B 358 6.982 6.388 -3.255 1.00 0.00 H new ATOM 0 HA ARG B 358 8.716 6.833 -1.067 1.00 0.00 H new ATOM 0 HB2 ARG B 358 7.632 9.009 -0.328 1.00 0.00 H new ATOM 0 HB3 ARG B 358 8.867 9.125 -1.566 1.00 0.00 H new ATOM 0 HG2 ARG B 358 6.961 9.009 -3.302 1.00 0.00 H new ATOM 0 HG3 ARG B 358 5.846 9.211 -1.965 1.00 0.00 H new ATOM 0 HD2 ARG B 358 7.609 11.231 -1.405 1.00 0.00 H new ATOM 0 HD3 ARG B 358 7.768 11.177 -3.149 1.00 0.00 H new ATOM 0 HE ARG B 358 4.983 11.190 -2.121 1.00 0.00 H new ATOM 0 HH11 ARG B 358 7.766 12.943 -3.347 1.00 0.00 H new ATOM 0 HH12 ARG B 358 6.818 14.340 -3.866 1.00 0.00 H new ATOM 0 HH21 ARG B 358 3.777 12.984 -2.801 1.00 0.00 H new ATOM 0 HH22 ARG B 358 4.579 14.363 -3.560 1.00 0.00 H new ATOM 1245 N TRP B 359 6.740 6.073 0.270 1.00 0.00 N ATOM 1246 CA TRP B 359 5.636 5.443 0.962 1.00 0.00 C ATOM 1247 C TRP B 359 5.391 6.124 2.293 1.00 0.00 C ATOM 1248 O TRP B 359 6.134 7.029 2.673 1.00 0.00 O ATOM 1249 CB TRP B 359 5.951 3.961 1.129 1.00 0.00 C ATOM 1250 CG TRP B 359 7.252 3.785 1.830 1.00 0.00 C ATOM 1251 CD1 TRP B 359 7.391 3.348 3.091 1.00 0.00 C ATOM 1252 CD2 TRP B 359 8.590 4.025 1.330 1.00 0.00 C ATOM 1253 NE1 TRP B 359 8.737 3.291 3.404 1.00 0.00 N ATOM 1254 CE2 TRP B 359 9.518 3.719 2.350 1.00 0.00 C ATOM 1255 CE3 TRP B 359 9.078 4.479 0.103 1.00 0.00 C ATOM 1256 CZ2 TRP B 359 10.891 3.872 2.158 1.00 0.00 C ATOM 1257 CZ3 TRP B 359 10.456 4.635 -0.099 1.00 0.00 C ATOM 1258 CH2 TRP B 359 11.361 4.335 0.931 1.00 0.00 C ATOM 0 H TRP B 359 7.631 6.029 0.765 1.00 0.00 H new ATOM 0 HA TRP B 359 4.718 5.542 0.383 1.00 0.00 H new ATOM 0 HB2 TRP B 359 5.156 3.475 1.695 1.00 0.00 H new ATOM 0 HB3 TRP B 359 5.988 3.478 0.153 1.00 0.00 H new ATOM 0 HD1 TRP B 359 6.582 3.083 3.755 1.00 0.00 H new ATOM 0 HE1 TRP B 359 9.106 2.973 4.300 1.00 0.00 H new ATOM 0 HE3 TRP B 359 8.389 4.711 -0.696 1.00 0.00 H new ATOM 0 HZ2 TRP B 359 11.583 3.634 2.952 1.00 0.00 H new ATOM 0 HZ3 TRP B 359 10.823 4.988 -1.051 1.00 0.00 H new ATOM 0 HH2 TRP B 359 12.422 4.463 0.772 1.00 0.00 H new ATOM 1269 N ALA B 360 4.335 5.726 2.993 1.00 0.00 N ATOM 1270 CA ALA B 360 4.035 6.382 4.255 1.00 0.00 C ATOM 1271 C ALA B 360 3.205 5.502 5.167 1.00 0.00 C ATOM 1272 O ALA B 360 1.982 5.429 5.054 1.00 0.00 O ATOM 1273 CB ALA B 360 3.292 7.691 4.004 1.00 0.00 C ATOM 0 H ALA B 360 3.695 4.980 2.720 1.00 0.00 H new ATOM 0 HA ALA B 360 4.986 6.582 4.749 1.00 0.00 H new ATOM 0 HB1 ALA B 360 3.073 8.173 4.957 1.00 0.00 H new ATOM 0 HB2 ALA B 360 3.912 8.351 3.397 1.00 0.00 H new ATOM 0 HB3 ALA B 360 2.360 7.485 3.478 1.00 0.00 H new ATOM 1279 N ALA B 361 3.892 4.855 6.080 1.00 0.00 N ATOM 1280 CA ALA B 361 3.252 3.988 7.041 1.00 0.00 C ATOM 1281 C ALA B 361 2.638 4.798 8.179 1.00 0.00 C ATOM 1282 O ALA B 361 3.161 5.849 8.554 1.00 0.00 O ATOM 1283 CB ALA B 361 4.261 3.008 7.606 1.00 0.00 C ATOM 0 H ALA B 361 4.906 4.915 6.177 1.00 0.00 H new ATOM 0 HA ALA B 361 2.457 3.443 6.532 1.00 0.00 H new ATOM 0 HB1 ALA B 361 3.770 2.358 8.330 1.00 0.00 H new ATOM 0 HB2 ALA B 361 4.674 2.405 6.798 1.00 0.00 H new ATOM 0 HB3 ALA B 361 5.065 3.556 8.097 1.00 0.00 H new ATOM 1289 N SER B 362 1.534 4.306 8.730 1.00 0.00 N ATOM 1290 CA SER B 362 0.869 4.993 9.827 1.00 0.00 C ATOM 1291 C SER B 362 0.465 3.978 10.899 1.00 0.00 C ATOM 1292 O SER B 362 0.614 2.773 10.697 1.00 0.00 O ATOM 1293 CB SER B 362 -0.359 5.735 9.293 1.00 0.00 C ATOM 1294 OG SER B 362 -0.306 7.093 9.708 1.00 0.00 O ATOM 0 H SER B 362 1.084 3.439 8.436 1.00 0.00 H new ATOM 0 HA SER B 362 1.548 5.718 10.275 1.00 0.00 H new ATOM 0 HB2 SER B 362 -0.389 5.676 8.205 1.00 0.00 H new ATOM 0 HB3 SER B 362 -1.271 5.265 9.662 1.00 0.00 H new ATOM 0 HG SER B 362 -1.159 7.530 9.506 1.00 0.00 H new ATOM 1300 N PRO B 363 -0.023 4.427 12.027 1.00 0.00 N ATOM 1301 CA PRO B 363 -0.435 3.514 13.128 1.00 0.00 C ATOM 1302 C PRO B 363 -1.772 2.846 12.847 1.00 0.00 C ATOM 1303 O PRO B 363 -2.197 1.953 13.575 1.00 0.00 O ATOM 1304 CB PRO B 363 -0.542 4.424 14.348 1.00 0.00 C ATOM 1305 CG PRO B 363 -0.711 5.816 13.830 1.00 0.00 C ATOM 1306 CD PRO B 363 -0.249 5.838 12.372 1.00 0.00 C ATOM 0 HA PRO B 363 0.276 2.699 13.260 1.00 0.00 H new ATOM 0 HB2 PRO B 363 -1.389 4.137 14.972 1.00 0.00 H new ATOM 0 HB3 PRO B 363 0.351 4.347 14.968 1.00 0.00 H new ATOM 0 HG2 PRO B 363 -1.753 6.126 13.904 1.00 0.00 H new ATOM 0 HG3 PRO B 363 -0.127 6.518 14.425 1.00 0.00 H new ATOM 0 HD2 PRO B 363 -1.003 6.287 11.725 1.00 0.00 H new ATOM 0 HD3 PRO B 363 0.662 6.424 12.255 1.00 0.00 H new ATOM 1314 N LYS B 364 -2.427 3.301 11.792 1.00 0.00 N ATOM 1315 CA LYS B 364 -3.728 2.769 11.406 1.00 0.00 C ATOM 1316 C LYS B 364 -3.756 2.423 9.933 1.00 0.00 C ATOM 1317 O LYS B 364 -4.578 1.630 9.485 1.00 0.00 O ATOM 1318 CB LYS B 364 -4.814 3.799 11.670 1.00 0.00 C ATOM 1319 CG LYS B 364 -4.613 4.400 13.058 1.00 0.00 C ATOM 1320 CD LYS B 364 -5.820 5.266 13.426 1.00 0.00 C ATOM 1321 CE LYS B 364 -5.341 6.668 13.809 1.00 0.00 C ATOM 1322 NZ LYS B 364 -4.339 6.567 14.906 1.00 0.00 N1+ ATOM 0 H LYS B 364 -2.079 4.042 11.183 1.00 0.00 H new ATOM 0 HA LYS B 364 -3.904 1.870 11.997 1.00 0.00 H new ATOM 0 HB2 LYS B 364 -4.779 4.583 10.913 1.00 0.00 H new ATOM 0 HB3 LYS B 364 -5.797 3.333 11.602 1.00 0.00 H new ATOM 0 HG2 LYS B 364 -4.486 3.606 13.794 1.00 0.00 H new ATOM 0 HG3 LYS B 364 -3.703 5.000 13.076 1.00 0.00 H new ATOM 0 HD2 LYS B 364 -6.511 5.323 12.585 1.00 0.00 H new ATOM 0 HD3 LYS B 364 -6.365 4.816 14.256 1.00 0.00 H new ATOM 0 HE2 LYS B 364 -4.900 7.162 12.943 1.00 0.00 H new ATOM 0 HE3 LYS B 364 -6.186 7.278 14.129 1.00 0.00 H new ATOM 0 HZ1 LYS B 364 -4.731 6.984 15.774 1.00 0.00 H new ATOM 0 HZ2 LYS B 364 -4.110 5.567 15.076 1.00 0.00 H new ATOM 0 HZ3 LYS B 364 -3.475 7.079 14.636 1.00 0.00 H new ATOM 1336 N SER B 365 -2.865 3.036 9.177 1.00 0.00 N ATOM 1337 CA SER B 365 -2.825 2.794 7.748 1.00 0.00 C ATOM 1338 C SER B 365 -1.435 2.938 7.196 1.00 0.00 C ATOM 1339 O SER B 365 -0.519 3.399 7.871 1.00 0.00 O ATOM 1340 CB SER B 365 -3.754 3.760 7.024 1.00 0.00 C ATOM 1341 OG SER B 365 -3.310 5.093 7.234 1.00 0.00 O ATOM 0 H SER B 365 -2.168 3.696 9.522 1.00 0.00 H new ATOM 0 HA SER B 365 -3.154 1.768 7.584 1.00 0.00 H new ATOM 0 HB2 SER B 365 -3.770 3.535 5.958 1.00 0.00 H new ATOM 0 HB3 SER B 365 -4.774 3.643 7.390 1.00 0.00 H new ATOM 0 HG SER B 365 -3.232 5.552 6.371 1.00 0.00 H new ATOM 1347 N PHE B 366 -1.293 2.532 5.951 1.00 0.00 N ATOM 1348 CA PHE B 366 -0.015 2.617 5.286 1.00 0.00 C ATOM 1349 C PHE B 366 -0.242 2.989 3.843 1.00 0.00 C ATOM 1350 O PHE B 366 -1.350 2.837 3.333 1.00 0.00 O ATOM 1351 CB PHE B 366 0.729 1.299 5.451 1.00 0.00 C ATOM 1352 CG PHE B 366 1.488 0.928 4.212 1.00 0.00 C ATOM 1353 CD1 PHE B 366 2.767 1.446 3.995 1.00 0.00 C ATOM 1354 CD2 PHE B 366 0.923 0.030 3.300 1.00 0.00 C ATOM 1355 CE1 PHE B 366 3.489 1.053 2.862 1.00 0.00 C ATOM 1356 CE2 PHE B 366 1.638 -0.353 2.167 1.00 0.00 C ATOM 1357 CZ PHE B 366 2.919 0.155 1.947 1.00 0.00 C ATOM 0 H PHE B 366 -2.045 2.142 5.383 1.00 0.00 H new ATOM 0 HA PHE B 366 0.611 3.392 5.730 1.00 0.00 H new ATOM 0 HB2 PHE B 366 1.419 1.374 6.291 1.00 0.00 H new ATOM 0 HB3 PHE B 366 0.018 0.508 5.692 1.00 0.00 H new ATOM 0 HD1 PHE B 366 3.196 2.145 4.697 1.00 0.00 H new ATOM 0 HD2 PHE B 366 -0.067 -0.366 3.474 1.00 0.00 H new ATOM 0 HE1 PHE B 366 4.483 1.440 2.693 1.00 0.00 H new ATOM 0 HE2 PHE B 366 1.201 -1.042 1.460 1.00 0.00 H new ATOM 0 HZ PHE B 366 3.473 -0.144 1.070 1.00 0.00 H new ATOM 1367 N THR B 367 0.765 3.567 3.212 1.00 0.00 N ATOM 1368 CA THR B 367 0.565 4.048 1.861 1.00 0.00 C ATOM 1369 C THR B 367 1.818 3.961 1.018 1.00 0.00 C ATOM 1370 O THR B 367 2.930 3.931 1.529 1.00 0.00 O ATOM 1371 CB THR B 367 0.096 5.495 1.936 1.00 0.00 C ATOM 1372 OG1 THR B 367 -1.201 5.546 2.510 1.00 0.00 O ATOM 1373 CG2 THR B 367 0.067 6.099 0.541 1.00 0.00 C ATOM 0 H THR B 367 1.698 3.711 3.598 1.00 0.00 H new ATOM 0 HA THR B 367 -0.180 3.414 1.380 1.00 0.00 H new ATOM 0 HB THR B 367 0.786 6.066 2.557 1.00 0.00 H new ATOM 0 HG1 THR B 367 -1.154 5.980 3.387 1.00 0.00 H new ATOM 0 HG21 THR B 367 -0.269 7.134 0.600 1.00 0.00 H new ATOM 0 HG22 THR B 367 1.067 6.066 0.109 1.00 0.00 H new ATOM 0 HG23 THR B 367 -0.618 5.530 -0.088 1.00 0.00 H new ATOM 1381 N LEU B 368 1.602 3.910 -0.286 1.00 0.00 N ATOM 1382 CA LEU B 368 2.680 3.806 -1.240 1.00 0.00 C ATOM 1383 C LEU B 368 2.564 4.856 -2.324 1.00 0.00 C ATOM 1384 O LEU B 368 1.461 5.119 -2.781 1.00 0.00 O ATOM 1385 CB LEU B 368 2.570 2.464 -1.918 1.00 0.00 C ATOM 1386 CG LEU B 368 3.380 1.458 -1.149 1.00 0.00 C ATOM 1387 CD1 LEU B 368 2.840 0.060 -1.445 1.00 0.00 C ATOM 1388 CD2 LEU B 368 4.847 1.561 -1.557 1.00 0.00 C ATOM 0 H LEU B 368 0.673 3.940 -0.707 1.00 0.00 H new ATOM 0 HA LEU B 368 3.623 3.937 -0.709 1.00 0.00 H new ATOM 0 HB2 LEU B 368 1.527 2.151 -1.965 1.00 0.00 H new ATOM 0 HB3 LEU B 368 2.929 2.531 -2.945 1.00 0.00 H new ATOM 0 HG LEU B 368 3.304 1.654 -0.079 1.00 0.00 H new ATOM 0 HD11 LEU B 368 3.420 -0.679 -0.892 1.00 0.00 H new ATOM 0 HD12 LEU B 368 1.795 0.002 -1.141 1.00 0.00 H new ATOM 0 HD13 LEU B 368 2.919 -0.142 -2.513 1.00 0.00 H new ATOM 0 HD21 LEU B 368 5.432 0.831 -0.998 1.00 0.00 H new ATOM 0 HD22 LEU B 368 4.943 1.362 -2.624 1.00 0.00 H new ATOM 0 HD23 LEU B 368 5.215 2.564 -1.340 1.00 0.00 H new ATOM 1400 N ASP B 369 3.697 5.398 -2.787 1.00 0.00 N ATOM 1401 CA ASP B 369 3.646 6.354 -3.883 1.00 0.00 C ATOM 1402 C ASP B 369 4.438 5.847 -5.072 1.00 0.00 C ATOM 1403 O ASP B 369 5.651 6.039 -5.160 1.00 0.00 O ATOM 1404 CB ASP B 369 4.220 7.703 -3.487 1.00 0.00 C ATOM 1405 CG ASP B 369 3.793 8.758 -4.498 1.00 0.00 C ATOM 1406 OD1 ASP B 369 3.793 8.447 -5.678 1.00 0.00 O1- ATOM 1407 OD2 ASP B 369 3.474 9.857 -4.081 1.00 0.00 O ATOM 0 H ASP B 369 4.630 5.195 -2.429 1.00 0.00 H new ATOM 0 HA ASP B 369 2.593 6.470 -4.141 1.00 0.00 H new ATOM 0 HB2 ASP B 369 3.873 7.978 -2.491 1.00 0.00 H new ATOM 0 HB3 ASP B 369 5.308 7.647 -3.442 1.00 0.00 H new ATOM 1412 N PHE B 370 3.728 5.230 -5.987 1.00 0.00 N ATOM 1413 CA PHE B 370 4.351 4.737 -7.221 1.00 0.00 C ATOM 1414 C PHE B 370 3.495 5.045 -8.433 1.00 0.00 C ATOM 1415 O PHE B 370 2.609 4.269 -8.793 1.00 0.00 O ATOM 1416 CB PHE B 370 4.591 3.238 -7.184 1.00 0.00 C ATOM 1417 CG PHE B 370 3.307 2.521 -6.900 1.00 0.00 C ATOM 1418 CD1 PHE B 370 2.781 2.583 -5.625 1.00 0.00 C ATOM 1419 CD2 PHE B 370 2.671 1.770 -7.892 1.00 0.00 C ATOM 1420 CE1 PHE B 370 1.601 1.904 -5.316 1.00 0.00 C ATOM 1421 CE2 PHE B 370 1.494 1.082 -7.592 1.00 0.00 C ATOM 1422 CZ PHE B 370 0.959 1.143 -6.299 1.00 0.00 C ATOM 0 H PHE B 370 2.726 5.052 -5.914 1.00 0.00 H new ATOM 0 HA PHE B 370 5.308 5.253 -7.296 1.00 0.00 H new ATOM 0 HB2 PHE B 370 5.001 2.903 -8.137 1.00 0.00 H new ATOM 0 HB3 PHE B 370 5.328 2.998 -6.418 1.00 0.00 H new ATOM 0 HD1 PHE B 370 3.285 3.159 -4.863 1.00 0.00 H new ATOM 0 HD2 PHE B 370 3.088 1.722 -8.887 1.00 0.00 H new ATOM 0 HE1 PHE B 370 1.185 1.966 -4.321 1.00 0.00 H new ATOM 0 HE2 PHE B 370 0.996 0.503 -8.356 1.00 0.00 H new ATOM 0 HZ PHE B 370 0.054 0.604 -6.061 1.00 0.00 H new ATOM 1432 N GLY B 371 3.777 6.169 -9.072 1.00 0.00 N ATOM 1433 CA GLY B 371 3.033 6.557 -10.266 1.00 0.00 C ATOM 1434 C GLY B 371 2.601 8.003 -10.183 1.00 0.00 C ATOM 1435 O GLY B 371 1.767 8.462 -10.955 1.00 0.00 O ATOM 0 H GLY B 371 4.506 6.824 -8.791 1.00 0.00 H new ATOM 0 HA2 GLY B 371 3.653 6.408 -11.150 1.00 0.00 H new ATOM 0 HA3 GLY B 371 2.158 5.917 -10.379 1.00 0.00 H new ATOM 1439 N ASP B 372 3.165 8.700 -9.220 1.00 0.00 N ATOM 1440 CA ASP B 372 2.841 10.101 -9.004 1.00 0.00 C ATOM 1441 C ASP B 372 2.733 10.863 -10.314 1.00 0.00 C ATOM 1442 O ASP B 372 2.170 11.956 -10.354 1.00 0.00 O ATOM 1443 CB ASP B 372 3.919 10.742 -8.132 1.00 0.00 C ATOM 1444 CG ASP B 372 3.405 12.040 -7.523 1.00 0.00 C ATOM 1445 OD1 ASP B 372 2.928 12.876 -8.274 1.00 0.00 O1- ATOM 1446 OD2 ASP B 372 3.495 12.183 -6.315 1.00 0.00 O ATOM 0 H ASP B 372 3.853 8.321 -8.570 1.00 0.00 H new ATOM 0 HA ASP B 372 1.872 10.149 -8.507 1.00 0.00 H new ATOM 0 HB2 ASP B 372 4.213 10.053 -7.341 1.00 0.00 H new ATOM 0 HB3 ASP B 372 4.809 10.940 -8.729 1.00 0.00 H new ATOM 1451 N TYR B 373 3.241 10.286 -11.389 1.00 0.00 N ATOM 1452 CA TYR B 373 3.147 10.943 -12.671 1.00 0.00 C ATOM 1453 C TYR B 373 1.691 11.262 -12.932 1.00 0.00 C ATOM 1454 O TYR B 373 1.338 12.325 -13.440 1.00 0.00 O ATOM 1455 CB TYR B 373 3.704 10.027 -13.747 1.00 0.00 C ATOM 1456 CG TYR B 373 4.809 9.197 -13.139 1.00 0.00 C ATOM 1457 CD1 TYR B 373 5.944 9.827 -12.622 1.00 0.00 C ATOM 1458 CD2 TYR B 373 4.700 7.805 -13.093 1.00 0.00 C ATOM 1459 CE1 TYR B 373 6.977 9.066 -12.060 1.00 0.00 C ATOM 1460 CE2 TYR B 373 5.735 7.040 -12.534 1.00 0.00 C ATOM 1461 CZ TYR B 373 6.873 7.672 -12.019 1.00 0.00 C ATOM 1462 OH TYR B 373 7.892 6.921 -11.467 1.00 0.00 O ATOM 0 H TYR B 373 3.713 9.382 -11.397 1.00 0.00 H new ATOM 0 HA TYR B 373 3.725 11.867 -12.679 1.00 0.00 H new ATOM 0 HB2 TYR B 373 2.918 9.383 -14.141 1.00 0.00 H new ATOM 0 HB3 TYR B 373 4.085 10.612 -14.584 1.00 0.00 H new ATOM 0 HD1 TYR B 373 6.025 10.903 -12.656 1.00 0.00 H new ATOM 0 HD2 TYR B 373 3.820 7.318 -13.487 1.00 0.00 H new ATOM 0 HE1 TYR B 373 7.852 9.555 -11.659 1.00 0.00 H new ATOM 0 HE2 TYR B 373 5.654 5.964 -12.501 1.00 0.00 H new ATOM 0 HH TYR B 373 7.661 5.970 -11.517 1.00 0.00 H new ATOM 1472 N GLN B 374 0.860 10.335 -12.509 1.00 0.00 N ATOM 1473 CA GLN B 374 -0.574 10.481 -12.606 1.00 0.00 C ATOM 1474 C GLN B 374 -1.132 10.266 -11.215 1.00 0.00 C ATOM 1475 O GLN B 374 -1.137 11.177 -10.387 1.00 0.00 O ATOM 1476 CB GLN B 374 -1.148 9.441 -13.567 1.00 0.00 C ATOM 1477 CG GLN B 374 -0.323 8.153 -13.489 1.00 0.00 C ATOM 1478 CD GLN B 374 -1.210 6.953 -13.808 1.00 0.00 C ATOM 1479 OE1 GLN B 374 -1.676 6.808 -14.938 1.00 0.00 O ATOM 1480 NE2 GLN B 374 -1.476 6.081 -12.874 1.00 0.00 N ATOM 0 H GLN B 374 1.161 9.457 -12.087 1.00 0.00 H new ATOM 0 HA GLN B 374 -0.839 11.467 -12.987 1.00 0.00 H new ATOM 0 HB2 GLN B 374 -2.188 9.234 -13.315 1.00 0.00 H new ATOM 0 HB3 GLN B 374 -1.138 9.829 -14.586 1.00 0.00 H new ATOM 0 HG2 GLN B 374 0.509 8.200 -14.192 1.00 0.00 H new ATOM 0 HG3 GLN B 374 0.107 8.045 -12.493 1.00 0.00 H new ATOM 0 HE21 GLN B 374 -1.089 6.202 -11.938 1.00 0.00 H new ATOM 0 HE22 GLN B 374 -2.071 5.278 -13.080 1.00 0.00 H new ATOM 1489 N ASP B 375 -1.501 9.029 -10.938 1.00 0.00 N ATOM 1490 CA ASP B 375 -1.942 8.660 -9.616 1.00 0.00 C ATOM 1491 C ASP B 375 -1.158 7.435 -9.188 1.00 0.00 C ATOM 1492 O ASP B 375 -1.497 6.306 -9.539 1.00 0.00 O ATOM 1493 CB ASP B 375 -3.434 8.351 -9.624 1.00 0.00 C ATOM 1494 CG ASP B 375 -4.015 8.537 -8.226 1.00 0.00 C ATOM 1495 OD1 ASP B 375 -3.738 7.707 -7.375 1.00 0.00 O ATOM 1496 OD2 ASP B 375 -4.728 9.507 -8.026 1.00 0.00 O1- ATOM 0 H ASP B 375 -1.502 8.266 -11.615 1.00 0.00 H new ATOM 0 HA ASP B 375 -1.772 9.481 -8.920 1.00 0.00 H new ATOM 0 HB2 ASP B 375 -3.945 9.006 -10.329 1.00 0.00 H new ATOM 0 HB3 ASP B 375 -3.600 7.328 -9.962 1.00 0.00 H new ATOM 1501 N GLY B 376 -0.105 7.673 -8.445 1.00 0.00 N ATOM 1502 CA GLY B 376 0.749 6.587 -7.981 1.00 0.00 C ATOM 1503 C GLY B 376 0.461 6.206 -6.543 1.00 0.00 C ATOM 1504 O GLY B 376 1.116 5.329 -5.983 1.00 0.00 O ATOM 0 H GLY B 376 0.188 8.603 -8.145 1.00 0.00 H new ATOM 0 HA2 GLY B 376 0.607 5.716 -8.621 1.00 0.00 H new ATOM 0 HA3 GLY B 376 1.794 6.884 -8.074 1.00 0.00 H new ATOM 1508 N TYR B 377 -0.451 6.921 -5.928 1.00 0.00 N ATOM 1509 CA TYR B 377 -0.731 6.700 -4.523 1.00 0.00 C ATOM 1510 C TYR B 377 -1.746 5.611 -4.261 1.00 0.00 C ATOM 1511 O TYR B 377 -2.950 5.816 -4.410 1.00 0.00 O ATOM 1512 CB TYR B 377 -1.204 7.993 -3.887 1.00 0.00 C ATOM 1513 CG TYR B 377 -0.652 9.142 -4.688 1.00 0.00 C ATOM 1514 CD1 TYR B 377 0.677 9.109 -5.116 1.00 0.00 C ATOM 1515 CD2 TYR B 377 -1.469 10.226 -5.017 1.00 0.00 C ATOM 1516 CE1 TYR B 377 1.193 10.155 -5.877 1.00 0.00 C ATOM 1517 CE2 TYR B 377 -0.954 11.282 -5.778 1.00 0.00 C ATOM 1518 CZ TYR B 377 0.378 11.247 -6.208 1.00 0.00 C ATOM 1519 OH TYR B 377 0.882 12.285 -6.963 1.00 0.00 O ATOM 0 H TYR B 377 -1.008 7.653 -6.369 1.00 0.00 H new ATOM 0 HA TYR B 377 0.205 6.363 -4.077 1.00 0.00 H new ATOM 0 HB2 TYR B 377 -2.293 8.031 -3.869 1.00 0.00 H new ATOM 0 HB3 TYR B 377 -0.866 8.054 -2.853 1.00 0.00 H new ATOM 0 HD1 TYR B 377 1.306 8.270 -4.856 1.00 0.00 H new ATOM 0 HD2 TYR B 377 -2.496 10.249 -4.685 1.00 0.00 H new ATOM 0 HE1 TYR B 377 2.219 10.125 -6.212 1.00 0.00 H new ATOM 0 HE2 TYR B 377 -1.583 12.122 -6.033 1.00 0.00 H new ATOM 0 HH TYR B 377 0.184 12.958 -7.101 1.00 0.00 H new ATOM 1529 N TYR B 378 -1.244 4.475 -3.788 1.00 0.00 N ATOM 1530 CA TYR B 378 -2.124 3.372 -3.408 1.00 0.00 C ATOM 1531 C TYR B 378 -1.964 3.109 -1.923 1.00 0.00 C ATOM 1532 O TYR B 378 -0.847 2.954 -1.430 1.00 0.00 O ATOM 1533 CB TYR B 378 -1.814 2.114 -4.201 1.00 0.00 C ATOM 1534 CG TYR B 378 -3.034 1.737 -4.997 1.00 0.00 C ATOM 1535 CD1 TYR B 378 -4.099 1.067 -4.381 1.00 0.00 C ATOM 1536 CD2 TYR B 378 -3.098 2.064 -6.350 1.00 0.00 C ATOM 1537 CE1 TYR B 378 -5.232 0.725 -5.128 1.00 0.00 C ATOM 1538 CE2 TYR B 378 -4.230 1.724 -7.100 1.00 0.00 C ATOM 1539 CZ TYR B 378 -5.297 1.052 -6.488 1.00 0.00 C ATOM 1540 OH TYR B 378 -6.415 0.714 -7.226 1.00 0.00 O ATOM 0 H TYR B 378 -0.249 4.293 -3.659 1.00 0.00 H new ATOM 0 HA TYR B 378 -3.154 3.651 -3.631 1.00 0.00 H new ATOM 0 HB2 TYR B 378 -0.967 2.284 -4.865 1.00 0.00 H new ATOM 0 HB3 TYR B 378 -1.535 1.302 -3.529 1.00 0.00 H new ATOM 0 HD1 TYR B 378 -4.046 0.815 -3.332 1.00 0.00 H new ATOM 0 HD2 TYR B 378 -2.274 2.580 -6.820 1.00 0.00 H new ATOM 0 HE1 TYR B 378 -6.055 0.209 -4.656 1.00 0.00 H new ATOM 0 HE2 TYR B 378 -4.281 1.979 -8.148 1.00 0.00 H new ATOM 0 HH TYR B 378 -6.299 1.014 -8.152 1.00 0.00 H new ATOM 1550 N SER B 379 -3.075 3.118 -1.199 1.00 0.00 N ATOM 1551 CA SER B 379 -3.022 2.935 0.239 1.00 0.00 C ATOM 1552 C SER B 379 -4.114 2.031 0.750 1.00 0.00 C ATOM 1553 O SER B 379 -5.106 1.773 0.070 1.00 0.00 O ATOM 1554 CB SER B 379 -3.153 4.277 0.929 1.00 0.00 C ATOM 1555 OG SER B 379 -3.041 4.087 2.326 1.00 0.00 O ATOM 0 H SER B 379 -4.012 3.249 -1.581 1.00 0.00 H new ATOM 0 HA SER B 379 -2.062 2.468 0.462 1.00 0.00 H new ATOM 0 HB2 SER B 379 -2.378 4.958 0.578 1.00 0.00 H new ATOM 0 HB3 SER B 379 -4.113 4.733 0.686 1.00 0.00 H new ATOM 0 HG SER B 379 -2.443 4.767 2.702 1.00 0.00 H new ATOM 1561 N VAL B 380 -3.919 1.576 1.976 1.00 0.00 N ATOM 1562 CA VAL B 380 -4.878 0.717 2.617 1.00 0.00 C ATOM 1563 C VAL B 380 -4.835 0.925 4.127 1.00 0.00 C ATOM 1564 O VAL B 380 -3.959 1.630 4.631 1.00 0.00 O ATOM 1565 CB VAL B 380 -4.519 -0.711 2.295 1.00 0.00 C ATOM 1566 CG1 VAL B 380 -5.041 -1.101 0.919 1.00 0.00 C ATOM 1567 CG2 VAL B 380 -2.998 -0.839 2.323 1.00 0.00 C ATOM 0 H VAL B 380 -3.099 1.793 2.543 1.00 0.00 H new ATOM 0 HA VAL B 380 -5.882 0.947 2.261 1.00 0.00 H new ATOM 0 HB VAL B 380 -4.973 -1.376 3.030 1.00 0.00 H new ATOM 0 HG11 VAL B 380 -4.771 -2.135 0.707 1.00 0.00 H new ATOM 0 HG12 VAL B 380 -6.126 -0.998 0.899 1.00 0.00 H new ATOM 0 HG13 VAL B 380 -4.601 -0.449 0.165 1.00 0.00 H new ATOM 0 HG21 VAL B 380 -2.715 -1.866 2.092 1.00 0.00 H new ATOM 0 HG22 VAL B 380 -2.563 -0.168 1.583 1.00 0.00 H new ATOM 0 HG23 VAL B 380 -2.629 -0.575 3.314 1.00 0.00 H new ATOM 1577 N GLN B 381 -5.767 0.307 4.856 1.00 0.00 N ATOM 1578 CA GLN B 381 -5.782 0.454 6.308 1.00 0.00 C ATOM 1579 C GLN B 381 -5.150 -0.742 6.983 1.00 0.00 C ATOM 1580 O GLN B 381 -5.526 -1.889 6.756 1.00 0.00 O ATOM 1581 CB GLN B 381 -7.200 0.612 6.809 1.00 0.00 C ATOM 1582 CG GLN B 381 -7.293 1.768 7.802 1.00 0.00 C ATOM 1583 CD GLN B 381 -8.752 2.023 8.165 1.00 0.00 C ATOM 1584 OE1 GLN B 381 -9.412 2.967 7.552 1.00 0.00 O flip ATOM 1585 NE2 GLN B 381 -9.304 1.342 9.030 1.00 0.00 N flip ATOM 0 H GLN B 381 -6.504 -0.286 4.474 1.00 0.00 H new ATOM 0 HA GLN B 381 -5.205 1.346 6.554 1.00 0.00 H new ATOM 0 HB2 GLN B 381 -7.870 0.792 5.969 1.00 0.00 H new ATOM 0 HB3 GLN B 381 -7.528 -0.312 7.286 1.00 0.00 H new ATOM 0 HG2 GLN B 381 -6.721 1.535 8.700 1.00 0.00 H new ATOM 0 HG3 GLN B 381 -6.854 2.667 7.369 1.00 0.00 H new ATOM 0 HE21 GLN B 381 -8.785 0.605 9.507 1.00 0.00 H new ATOM 0 HE22 GLN B 381 -10.280 1.515 9.269 1.00 0.00 H new ATOM 1594 N THR B 382 -4.194 -0.438 7.821 1.00 0.00 N ATOM 1595 CA THR B 382 -3.480 -1.449 8.579 1.00 0.00 C ATOM 1596 C THR B 382 -2.914 -0.833 9.844 1.00 0.00 C ATOM 1597 O THR B 382 -2.346 0.256 9.803 1.00 0.00 O ATOM 1598 CB THR B 382 -2.357 -2.047 7.740 1.00 0.00 C ATOM 1599 OG1 THR B 382 -1.358 -2.577 8.600 1.00 0.00 O ATOM 1600 CG2 THR B 382 -1.744 -0.969 6.849 1.00 0.00 C ATOM 0 H THR B 382 -3.883 0.516 8.002 1.00 0.00 H new ATOM 0 HA THR B 382 -4.174 -2.246 8.847 1.00 0.00 H new ATOM 0 HB THR B 382 -2.760 -2.842 7.113 1.00 0.00 H new ATOM 0 HG1 THR B 382 -0.635 -2.963 8.063 1.00 0.00 H new ATOM 0 HG21 THR B 382 -0.942 -1.403 6.252 1.00 0.00 H new ATOM 0 HG22 THR B 382 -2.510 -0.564 6.188 1.00 0.00 H new ATOM 0 HG23 THR B 382 -1.342 -0.169 7.470 1.00 0.00 H new ATOM 1608 N THR B 383 -3.046 -1.521 10.960 1.00 0.00 N ATOM 1609 CA THR B 383 -2.518 -0.985 12.200 1.00 0.00 C ATOM 1610 C THR B 383 -1.058 -1.348 12.373 1.00 0.00 C ATOM 1611 O THR B 383 -0.481 -1.181 13.448 1.00 0.00 O ATOM 1612 CB THR B 383 -3.363 -1.427 13.382 1.00 0.00 C ATOM 1613 OG1 THR B 383 -3.966 -2.682 13.097 1.00 0.00 O ATOM 1614 CG2 THR B 383 -4.435 -0.360 13.579 1.00 0.00 C ATOM 0 H THR B 383 -3.502 -2.430 11.036 1.00 0.00 H new ATOM 0 HA THR B 383 -2.571 0.103 12.155 1.00 0.00 H new ATOM 0 HB THR B 383 -2.759 -1.541 14.282 1.00 0.00 H new ATOM 0 HG1 THR B 383 -4.509 -2.965 13.862 1.00 0.00 H new ATOM 0 HG21 THR B 383 -5.071 -0.634 14.421 1.00 0.00 H new ATOM 0 HG22 THR B 383 -3.960 0.600 13.780 1.00 0.00 H new ATOM 0 HG23 THR B 383 -5.042 -0.283 12.677 1.00 0.00 H new ATOM 1622 N GLU B 384 -0.449 -1.755 11.271 1.00 0.00 N ATOM 1623 CA GLU B 384 0.977 -2.036 11.263 1.00 0.00 C ATOM 1624 C GLU B 384 1.557 -1.608 9.921 1.00 0.00 C ATOM 1625 O GLU B 384 1.743 -2.408 9.006 1.00 0.00 O ATOM 1626 CB GLU B 384 1.257 -3.529 11.503 1.00 0.00 C ATOM 1627 CG GLU B 384 -0.018 -4.231 11.977 1.00 0.00 C ATOM 1628 CD GLU B 384 0.251 -5.719 12.186 1.00 0.00 C ATOM 1629 OE1 GLU B 384 0.700 -6.073 13.263 1.00 0.00 O1- ATOM 1630 OE2 GLU B 384 0.004 -6.480 11.265 1.00 0.00 O ATOM 0 H GLU B 384 -0.917 -1.897 10.376 1.00 0.00 H new ATOM 0 HA GLU B 384 1.448 -1.477 12.072 1.00 0.00 H new ATOM 0 HB2 GLU B 384 1.617 -3.992 10.584 1.00 0.00 H new ATOM 0 HB3 GLU B 384 2.044 -3.645 12.248 1.00 0.00 H new ATOM 0 HG2 GLU B 384 -0.366 -3.782 12.907 1.00 0.00 H new ATOM 0 HG3 GLU B 384 -0.812 -4.096 11.242 1.00 0.00 H new ATOM 1637 N GLY B 385 1.872 -0.331 9.834 1.00 0.00 N ATOM 1638 CA GLY B 385 2.468 0.221 8.636 1.00 0.00 C ATOM 1639 C GLY B 385 3.973 0.044 8.673 1.00 0.00 C ATOM 1640 O GLY B 385 4.567 -0.566 7.793 1.00 0.00 O ATOM 0 H GLY B 385 1.724 0.346 10.583 1.00 0.00 H new ATOM 0 HA2 GLY B 385 2.058 -0.273 7.755 1.00 0.00 H new ATOM 0 HA3 GLY B 385 2.221 1.279 8.552 1.00 0.00 H new ATOM 1644 N GLU B 386 4.573 0.612 9.709 1.00 0.00 N ATOM 1645 CA GLU B 386 6.016 0.560 9.895 1.00 0.00 C ATOM 1646 C GLU B 386 6.544 -0.828 9.635 1.00 0.00 C ATOM 1647 O GLU B 386 7.714 -1.014 9.355 1.00 0.00 O ATOM 1648 CB GLU B 386 6.359 0.967 11.319 1.00 0.00 C ATOM 1649 CG GLU B 386 5.454 0.214 12.290 1.00 0.00 C ATOM 1650 CD GLU B 386 5.826 0.569 13.726 1.00 0.00 C ATOM 1651 OE1 GLU B 386 6.734 -0.052 14.253 1.00 0.00 O1- ATOM 1652 OE2 GLU B 386 5.202 1.461 14.276 1.00 0.00 O ATOM 0 H GLU B 386 4.076 1.120 10.441 1.00 0.00 H new ATOM 0 HA GLU B 386 6.478 1.247 9.186 1.00 0.00 H new ATOM 0 HB2 GLU B 386 7.405 0.744 11.531 1.00 0.00 H new ATOM 0 HB3 GLU B 386 6.230 2.042 11.443 1.00 0.00 H new ATOM 0 HG2 GLU B 386 4.411 0.469 12.101 1.00 0.00 H new ATOM 0 HG3 GLU B 386 5.553 -0.860 12.134 1.00 0.00 H new ATOM 1659 N GLN B 387 5.669 -1.792 9.715 1.00 0.00 N ATOM 1660 CA GLN B 387 6.067 -3.169 9.472 1.00 0.00 C ATOM 1661 C GLN B 387 6.089 -3.419 7.985 1.00 0.00 C ATOM 1662 O GLN B 387 6.980 -4.079 7.461 1.00 0.00 O ATOM 1663 CB GLN B 387 5.099 -4.135 10.151 1.00 0.00 C ATOM 1664 CG GLN B 387 5.189 -3.977 11.669 1.00 0.00 C ATOM 1665 CD GLN B 387 4.438 -5.115 12.353 1.00 0.00 C ATOM 1666 OE1 GLN B 387 3.568 -5.739 11.746 1.00 0.00 O ATOM 1667 NE2 GLN B 387 4.725 -5.424 13.588 1.00 0.00 N ATOM 0 H GLN B 387 4.683 -1.662 9.943 1.00 0.00 H new ATOM 0 HA GLN B 387 7.061 -3.334 9.888 1.00 0.00 H new ATOM 0 HB2 GLN B 387 4.081 -3.939 9.816 1.00 0.00 H new ATOM 0 HB3 GLN B 387 5.336 -5.161 9.868 1.00 0.00 H new ATOM 0 HG2 GLN B 387 6.233 -3.978 11.983 1.00 0.00 H new ATOM 0 HG3 GLN B 387 4.767 -3.018 11.970 1.00 0.00 H new ATOM 0 HE21 GLN B 387 5.446 -4.905 14.089 1.00 0.00 H new ATOM 0 HE22 GLN B 387 4.228 -6.184 14.052 1.00 0.00 H new ATOM 1676 N ILE B 388 5.111 -2.854 7.320 1.00 0.00 N ATOM 1677 CA ILE B 388 5.007 -2.962 5.880 1.00 0.00 C ATOM 1678 C ILE B 388 6.006 -2.021 5.221 1.00 0.00 C ATOM 1679 O ILE B 388 6.642 -2.348 4.220 1.00 0.00 O ATOM 1680 CB ILE B 388 3.607 -2.534 5.465 1.00 0.00 C ATOM 1681 CG1 ILE B 388 2.591 -3.607 5.829 1.00 0.00 C ATOM 1682 CG2 ILE B 388 3.567 -2.300 3.960 1.00 0.00 C ATOM 1683 CD1 ILE B 388 1.196 -2.983 5.840 1.00 0.00 C ATOM 0 H ILE B 388 4.367 -2.309 7.756 1.00 0.00 H new ATOM 0 HA ILE B 388 5.209 -3.989 5.575 1.00 0.00 H new ATOM 0 HB ILE B 388 3.357 -1.613 5.991 1.00 0.00 H new ATOM 0 HG12 ILE B 388 2.633 -4.425 5.110 1.00 0.00 H new ATOM 0 HG13 ILE B 388 2.823 -4.030 6.807 1.00 0.00 H new ATOM 0 HG21 ILE B 388 2.563 -1.994 3.666 1.00 0.00 H new ATOM 0 HG22 ILE B 388 4.278 -1.517 3.694 1.00 0.00 H new ATOM 0 HG23 ILE B 388 3.832 -3.221 3.441 1.00 0.00 H new ATOM 0 HD11 ILE B 388 0.459 -3.743 6.100 1.00 0.00 H new ATOM 0 HD12 ILE B 388 1.163 -2.179 6.575 1.00 0.00 H new ATOM 0 HD13 ILE B 388 0.970 -2.581 4.853 1.00 0.00 H new ATOM 1695 N ALA B 389 6.081 -0.827 5.787 1.00 0.00 N ATOM 1696 CA ALA B 389 6.934 0.236 5.273 1.00 0.00 C ATOM 1697 C ALA B 389 8.412 0.017 5.548 1.00 0.00 C ATOM 1698 O ALA B 389 9.239 0.285 4.686 1.00 0.00 O ATOM 1699 CB ALA B 389 6.517 1.544 5.918 1.00 0.00 C ATOM 0 H ALA B 389 5.551 -0.566 6.618 1.00 0.00 H new ATOM 0 HA ALA B 389 6.807 0.249 4.190 1.00 0.00 H new ATOM 0 HB1 ALA B 389 7.147 2.351 5.544 1.00 0.00 H new ATOM 0 HB2 ALA B 389 5.475 1.754 5.675 1.00 0.00 H new ATOM 0 HB3 ALA B 389 6.629 1.468 7.000 1.00 0.00 H new ATOM 1705 N GLN B 390 8.756 -0.430 6.745 1.00 0.00 N ATOM 1706 CA GLN B 390 10.175 -0.602 7.069 1.00 0.00 C ATOM 1707 C GLN B 390 10.805 -1.650 6.192 1.00 0.00 C ATOM 1708 O GLN B 390 11.975 -1.572 5.816 1.00 0.00 O ATOM 1709 CB GLN B 390 10.358 -1.024 8.517 1.00 0.00 C ATOM 1710 CG GLN B 390 9.789 -2.430 8.723 1.00 0.00 C ATOM 1711 CD GLN B 390 10.855 -3.476 8.415 1.00 0.00 C ATOM 1712 OE1 GLN B 390 10.620 -4.389 7.624 1.00 0.00 O ATOM 1713 NE2 GLN B 390 12.022 -3.397 8.997 1.00 0.00 N ATOM 0 H GLN B 390 8.103 -0.675 7.490 1.00 0.00 H new ATOM 0 HA GLN B 390 10.657 0.361 6.901 1.00 0.00 H new ATOM 0 HB2 GLN B 390 11.416 -1.008 8.779 1.00 0.00 H new ATOM 0 HB3 GLN B 390 9.855 -0.318 9.178 1.00 0.00 H new ATOM 0 HG2 GLN B 390 9.443 -2.544 9.750 1.00 0.00 H new ATOM 0 HG3 GLN B 390 8.924 -2.579 8.077 1.00 0.00 H new ATOM 0 HE21 GLN B 390 12.215 -2.640 9.652 1.00 0.00 H new ATOM 0 HE22 GLN B 390 12.740 -4.093 8.796 1.00 0.00 H new ATOM 1722 N LEU B 391 10.009 -2.633 5.894 1.00 0.00 N ATOM 1723 CA LEU B 391 10.432 -3.740 5.074 1.00 0.00 C ATOM 1724 C LEU B 391 10.546 -3.269 3.638 1.00 0.00 C ATOM 1725 O LEU B 391 11.603 -3.371 3.018 1.00 0.00 O ATOM 1726 CB LEU B 391 9.411 -4.857 5.291 1.00 0.00 C ATOM 1727 CG LEU B 391 8.592 -5.194 4.039 1.00 0.00 C ATOM 1728 CD1 LEU B 391 9.456 -5.940 3.010 1.00 0.00 C ATOM 1729 CD2 LEU B 391 7.427 -6.072 4.476 1.00 0.00 C ATOM 0 H LEU B 391 9.042 -2.694 6.212 1.00 0.00 H new ATOM 0 HA LEU B 391 11.417 -4.127 5.337 1.00 0.00 H new ATOM 0 HB2 LEU B 391 9.932 -5.754 5.626 1.00 0.00 H new ATOM 0 HB3 LEU B 391 8.731 -4.566 6.092 1.00 0.00 H new ATOM 0 HG LEU B 391 8.232 -4.279 3.568 1.00 0.00 H new ATOM 0 HD11 LEU B 391 8.856 -6.170 2.129 1.00 0.00 H new ATOM 0 HD12 LEU B 391 10.300 -5.313 2.721 1.00 0.00 H new ATOM 0 HD13 LEU B 391 9.826 -6.867 3.449 1.00 0.00 H new ATOM 0 HD21 LEU B 391 6.821 -6.332 3.608 1.00 0.00 H new ATOM 0 HD22 LEU B 391 7.810 -6.983 4.936 1.00 0.00 H new ATOM 0 HD23 LEU B 391 6.814 -5.531 5.197 1.00 0.00 H new ATOM 1741 N ILE B 392 9.472 -2.681 3.142 1.00 0.00 N ATOM 1742 CA ILE B 392 9.468 -2.115 1.827 1.00 0.00 C ATOM 1743 C ILE B 392 10.698 -1.266 1.748 1.00 0.00 C ATOM 1744 O ILE B 392 11.570 -1.466 0.913 1.00 0.00 O ATOM 1745 CB ILE B 392 8.224 -1.241 1.689 1.00 0.00 C ATOM 1746 CG1 ILE B 392 7.087 -2.067 1.088 1.00 0.00 C ATOM 1747 CG2 ILE B 392 8.513 -0.016 0.812 1.00 0.00 C ATOM 1748 CD1 ILE B 392 5.786 -1.273 1.146 1.00 0.00 C ATOM 0 H ILE B 392 8.589 -2.588 3.644 1.00 0.00 H new ATOM 0 HA ILE B 392 9.458 -2.870 1.041 1.00 0.00 H new ATOM 0 HB ILE B 392 7.931 -0.886 2.677 1.00 0.00 H new ATOM 0 HG12 ILE B 392 7.320 -2.326 0.055 1.00 0.00 H new ATOM 0 HG13 ILE B 392 6.977 -3.004 1.635 1.00 0.00 H new ATOM 0 HG21 ILE B 392 7.612 0.592 0.728 1.00 0.00 H new ATOM 0 HG22 ILE B 392 9.309 0.576 1.264 1.00 0.00 H new ATOM 0 HG23 ILE B 392 8.823 -0.344 -0.180 1.00 0.00 H new ATOM 0 HD11 ILE B 392 4.978 -1.866 0.716 1.00 0.00 H new ATOM 0 HD12 ILE B 392 5.550 -1.036 2.184 1.00 0.00 H new ATOM 0 HD13 ILE B 392 5.898 -0.349 0.579 1.00 0.00 H new ATOM 1760 N ALA B 393 10.752 -0.354 2.701 1.00 0.00 N ATOM 1761 CA ALA B 393 11.873 0.555 2.852 1.00 0.00 C ATOM 1762 C ALA B 393 13.181 -0.209 2.899 1.00 0.00 C ATOM 1763 O ALA B 393 14.220 0.279 2.452 1.00 0.00 O ATOM 1764 CB ALA B 393 11.741 1.302 4.160 1.00 0.00 C ATOM 0 H ALA B 393 10.016 -0.222 3.395 1.00 0.00 H new ATOM 0 HA ALA B 393 11.869 1.238 2.002 1.00 0.00 H new ATOM 0 HB1 ALA B 393 12.582 1.985 4.275 1.00 0.00 H new ATOM 0 HB2 ALA B 393 10.810 1.869 4.163 1.00 0.00 H new ATOM 0 HB3 ALA B 393 11.735 0.591 4.986 1.00 0.00 H new ATOM 1770 N GLY B 394 13.127 -1.402 3.480 1.00 0.00 N ATOM 1771 CA GLY B 394 14.325 -2.216 3.623 1.00 0.00 C ATOM 1772 C GLY B 394 14.575 -3.027 2.378 1.00 0.00 C ATOM 1773 O GLY B 394 15.675 -3.523 2.151 1.00 0.00 O ATOM 0 H GLY B 394 12.277 -1.822 3.855 1.00 0.00 H new ATOM 0 HA2 GLY B 394 15.184 -1.575 3.823 1.00 0.00 H new ATOM 0 HA3 GLY B 394 14.218 -2.881 4.480 1.00 0.00 H new ATOM 1777 N TYR B 395 13.541 -3.151 1.583 1.00 0.00 N ATOM 1778 CA TYR B 395 13.619 -3.896 0.355 1.00 0.00 C ATOM 1779 C TYR B 395 14.108 -2.979 -0.755 1.00 0.00 C ATOM 1780 O TYR B 395 14.919 -3.383 -1.582 1.00 0.00 O ATOM 1781 CB TYR B 395 12.244 -4.481 0.073 1.00 0.00 C ATOM 1782 CG TYR B 395 12.029 -5.782 0.861 1.00 0.00 C ATOM 1783 CD1 TYR B 395 12.803 -6.108 2.003 1.00 0.00 C ATOM 1784 CD2 TYR B 395 11.049 -6.682 0.425 1.00 0.00 C ATOM 1785 CE1 TYR B 395 12.583 -7.317 2.676 1.00 0.00 C ATOM 1786 CE2 TYR B 395 10.841 -7.891 1.100 1.00 0.00 C ATOM 1787 CZ TYR B 395 11.607 -8.210 2.222 1.00 0.00 C ATOM 1788 OH TYR B 395 11.400 -9.403 2.883 1.00 0.00 O ATOM 0 H TYR B 395 12.626 -2.740 1.769 1.00 0.00 H new ATOM 0 HA TYR B 395 14.331 -4.719 0.424 1.00 0.00 H new ATOM 0 HB2 TYR B 395 11.475 -3.757 0.342 1.00 0.00 H new ATOM 0 HB3 TYR B 395 12.139 -4.676 -0.994 1.00 0.00 H new ATOM 0 HD1 TYR B 395 13.562 -5.425 2.354 1.00 0.00 H new ATOM 0 HD2 TYR B 395 10.448 -6.442 -0.440 1.00 0.00 H new ATOM 0 HE1 TYR B 395 13.170 -7.561 3.549 1.00 0.00 H new ATOM 0 HE2 TYR B 395 10.085 -8.579 0.751 1.00 0.00 H new ATOM 0 HH TYR B 395 12.264 -9.818 3.088 1.00 0.00 H new ATOM 1798 N ILE B 396 13.680 -1.724 -0.728 1.00 0.00 N ATOM 1799 CA ILE B 396 14.183 -0.770 -1.717 1.00 0.00 C ATOM 1800 C ILE B 396 15.636 -0.500 -1.454 1.00 0.00 C ATOM 1801 O ILE B 396 16.357 0.066 -2.274 1.00 0.00 O ATOM 1802 CB ILE B 396 13.430 0.557 -1.744 1.00 0.00 C ATOM 1803 CG1 ILE B 396 12.235 0.493 -0.821 1.00 0.00 C ATOM 1804 CG2 ILE B 396 12.963 0.830 -3.172 1.00 0.00 C ATOM 1805 CD1 ILE B 396 11.426 1.784 -0.934 1.00 0.00 C ATOM 0 H ILE B 396 13.009 -1.348 -0.058 1.00 0.00 H new ATOM 0 HA ILE B 396 14.030 -1.235 -2.691 1.00 0.00 H new ATOM 0 HB ILE B 396 14.089 1.358 -1.409 1.00 0.00 H new ATOM 0 HG12 ILE B 396 11.610 -0.362 -1.078 1.00 0.00 H new ATOM 0 HG13 ILE B 396 12.565 0.349 0.208 1.00 0.00 H new ATOM 0 HG21 ILE B 396 12.423 1.776 -3.204 1.00 0.00 H new ATOM 0 HG22 ILE B 396 13.828 0.883 -3.834 1.00 0.00 H new ATOM 0 HG23 ILE B 396 12.304 0.026 -3.499 1.00 0.00 H new ATOM 0 HD11 ILE B 396 10.565 1.734 -0.267 1.00 0.00 H new ATOM 0 HD12 ILE B 396 12.052 2.631 -0.655 1.00 0.00 H new ATOM 0 HD13 ILE B 396 11.082 1.909 -1.961 1.00 0.00 H new ATOM 1817 N ASP B 397 16.046 -0.927 -0.292 1.00 0.00 N ATOM 1818 CA ASP B 397 17.417 -0.738 0.145 1.00 0.00 C ATOM 1819 C ASP B 397 18.302 -1.761 -0.518 1.00 0.00 C ATOM 1820 O ASP B 397 19.518 -1.601 -0.625 1.00 0.00 O ATOM 1821 CB ASP B 397 17.487 -0.898 1.660 1.00 0.00 C ATOM 1822 CG ASP B 397 18.433 0.138 2.256 1.00 0.00 C ATOM 1823 OD1 ASP B 397 18.008 1.267 2.432 1.00 0.00 O1- ATOM 1824 OD2 ASP B 397 19.569 -0.213 2.529 1.00 0.00 O ATOM 0 H ASP B 397 15.452 -1.413 0.380 1.00 0.00 H new ATOM 0 HA ASP B 397 17.757 0.260 -0.130 1.00 0.00 H new ATOM 0 HB2 ASP B 397 16.493 -0.784 2.091 1.00 0.00 H new ATOM 0 HB3 ASP B 397 17.830 -1.902 1.911 1.00 0.00 H new ATOM 1829 N ILE B 398 17.664 -2.831 -0.925 1.00 0.00 N ATOM 1830 CA ILE B 398 18.331 -3.937 -1.548 1.00 0.00 C ATOM 1831 C ILE B 398 18.365 -3.804 -3.054 1.00 0.00 C ATOM 1832 O ILE B 398 19.422 -3.774 -3.686 1.00 0.00 O ATOM 1833 CB ILE B 398 17.540 -5.169 -1.179 1.00 0.00 C ATOM 1834 CG1 ILE B 398 17.533 -5.310 0.349 1.00 0.00 C ATOM 1835 CG2 ILE B 398 18.171 -6.383 -1.831 1.00 0.00 C ATOM 1836 CD1 ILE B 398 16.440 -6.281 0.811 1.00 0.00 C ATOM 0 H ILE B 398 16.656 -2.955 -0.830 1.00 0.00 H new ATOM 0 HA ILE B 398 19.366 -3.983 -1.209 1.00 0.00 H new ATOM 0 HB ILE B 398 16.512 -5.085 -1.532 1.00 0.00 H new ATOM 0 HG12 ILE B 398 18.506 -5.665 0.689 1.00 0.00 H new ATOM 0 HG13 ILE B 398 17.373 -4.334 0.806 1.00 0.00 H new ATOM 0 HG21 ILE B 398 17.602 -7.275 -1.567 1.00 0.00 H new ATOM 0 HG22 ILE B 398 18.167 -6.258 -2.914 1.00 0.00 H new ATOM 0 HG23 ILE B 398 19.198 -6.491 -1.482 1.00 0.00 H new ATOM 0 HD11 ILE B 398 16.460 -6.360 1.898 1.00 0.00 H new ATOM 0 HD12 ILE B 398 15.466 -5.911 0.492 1.00 0.00 H new ATOM 0 HD13 ILE B 398 16.617 -7.263 0.372 1.00 0.00 H new ATOM 1848 N ILE B 399 17.171 -3.789 -3.604 1.00 0.00 N ATOM 1849 CA ILE B 399 16.969 -3.732 -5.036 1.00 0.00 C ATOM 1850 C ILE B 399 17.484 -2.437 -5.642 1.00 0.00 C ATOM 1851 O ILE B 399 17.715 -2.369 -6.849 1.00 0.00 O ATOM 1852 CB ILE B 399 15.482 -3.856 -5.294 1.00 0.00 C ATOM 1853 CG1 ILE B 399 14.814 -2.588 -4.781 1.00 0.00 C ATOM 1854 CG2 ILE B 399 14.942 -5.055 -4.514 1.00 0.00 C ATOM 1855 CD1 ILE B 399 13.375 -2.899 -4.335 1.00 0.00 C ATOM 0 H ILE B 399 16.305 -3.816 -3.066 1.00 0.00 H new ATOM 0 HA ILE B 399 17.528 -4.543 -5.503 1.00 0.00 H new ATOM 0 HB ILE B 399 15.284 -3.992 -6.357 1.00 0.00 H new ATOM 0 HG12 ILE B 399 15.383 -2.179 -3.946 1.00 0.00 H new ATOM 0 HG13 ILE B 399 14.806 -1.829 -5.563 1.00 0.00 H new ATOM 0 HG21 ILE B 399 13.871 -5.153 -4.693 1.00 0.00 H new ATOM 0 HG22 ILE B 399 15.450 -5.962 -4.843 1.00 0.00 H new ATOM 0 HG23 ILE B 399 15.120 -4.906 -3.449 1.00 0.00 H new ATOM 0 HD11 ILE B 399 12.903 -1.987 -3.969 1.00 0.00 H new ATOM 0 HD12 ILE B 399 12.808 -3.287 -5.181 1.00 0.00 H new ATOM 0 HD13 ILE B 399 13.394 -3.643 -3.539 1.00 0.00 H new ATOM 1867 N LEU B 400 17.641 -1.399 -4.827 1.00 0.00 N ATOM 1868 CA LEU B 400 18.113 -0.122 -5.375 1.00 0.00 C ATOM 1869 C LEU B 400 19.338 -0.333 -6.262 1.00 0.00 C ATOM 1870 O LEU B 400 19.784 0.634 -6.858 1.00 0.00 O ATOM 1871 CB LEU B 400 18.455 0.879 -4.270 1.00 0.00 C ATOM 1872 CG LEU B 400 19.237 0.193 -3.149 1.00 0.00 C ATOM 1873 CD1 LEU B 400 20.599 -0.286 -3.660 1.00 0.00 C ATOM 1874 CD2 LEU B 400 19.453 1.191 -2.011 1.00 0.00 C ATOM 1875 OXT LEU B 400 19.812 -1.455 -6.334 1.00 0.00 O ATOM 0 H LEU B 400 17.458 -1.407 -3.824 1.00 0.00 H new ATOM 0 HA LEU B 400 17.298 0.288 -5.971 1.00 0.00 H new ATOM 0 HB2 LEU B 400 19.043 1.699 -4.683 1.00 0.00 H new ATOM 0 HB3 LEU B 400 17.539 1.314 -3.869 1.00 0.00 H new ATOM 0 HG LEU B 400 18.670 -0.669 -2.797 1.00 0.00 H new ATOM 0 HD11 LEU B 400 21.142 -0.772 -2.849 1.00 0.00 H new ATOM 0 HD12 LEU B 400 20.453 -0.995 -4.475 1.00 0.00 H new ATOM 0 HD13 LEU B 400 21.173 0.568 -4.021 1.00 0.00 H new ATOM 0 HD21 LEU B 400 20.010 0.711 -1.207 1.00 0.00 H new ATOM 0 HD22 LEU B 400 20.016 2.048 -2.381 1.00 0.00 H new ATOM 0 HD23 LEU B 400 18.487 1.527 -1.633 1.00 0.00 H new TER 1887 LEU B 400