USER MOD reduce.3.24.130724 H: found=0, std=0, add=1234, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1234 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 465 ASN : amide:sc= 0.158 K(o=-1.3,f=-5.1!) USER MOD Set 1.2: A 466 LYS NZ :NH3+ 159:sc= -1.47 (180deg=-2.94!) USER MOD Set 2.1: A 79 LYS NZ :NH3+ 180:sc= 0.88 (180deg=-0.0418) USER MOD Set 2.2: A 451 ASN : amide:sc= 0.778 K(o=1.7,f=-2.9) USER MOD Set 3.1: A 52 THR OG1 : rot 135:sc= 0.209 USER MOD Set 3.2: A 460 GLN : amide:sc= -0.0547 X(o=0.15,f=-0.0097) USER MOD Set 4.1: A 36 GLN : amide:sc=-0.00808 K(o=-0.38,f=-2.7!) USER MOD Set 4.2: A 39 SER OG : rot 178:sc= -0.374 USER MOD Set 5.1: A 18 SER OG : rot -14:sc= 0.259 USER MOD Set 5.2: A 40 TYR OH : rot 4:sc= 1.17 USER MOD Set 5.3: A 71 THR OG1 : rot 96:sc= 0.458 USER MOD Single : A 1 MET CE :methyl -154:sc= -0.0244 (180deg=-1.02) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot -151:sc= 0.395 USER MOD Single : A 9 ASN : amide:sc= -0.145 X(o=-0.15,f=-0.35) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 19 GLN : amide:sc= -0.522 K(o=-0.52,f=0) USER MOD Single : A 20 SER OG : rot 77:sc= 1.24 USER MOD Single : A 26 GLN : amide:sc= -0.61 K(o=-0.61,f=0) USER MOD Single : A 35 GLN : amide:sc= -0.358 X(o=-0.36,f=-0.0091) USER MOD Single : A 42 GLN : amide:sc= -0.491 X(o=-0.49,f=0) USER MOD Single : A 43 SER OG : rot 71:sc= 1.12 USER MOD Single : A 46 THR OG1 : rot 47:sc= 0.075 USER MOD Single : A 48 MET CE :methyl -126:sc= -1.91 (180deg=-2.96!) USER MOD Single : A 50 LYS NZ :NH3+ -160:sc= 0.66 (180deg=0.228) USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0.00193 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= -0.0645 X(o=-0.065,f=-0.065) USER MOD Single : A 63 MET CE :methyl 169:sc= -2.02 (180deg=-2.29!) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 GLN : amide:sc= -0.847 K(o=-0.85,f=-0.011) USER MOD Single : A 74 ASN : amide:sc= -2.94! C(o=-2.9!,f=-3.1!) USER MOD Single : A 76 GLN : amide:sc= -0.912 K(o=-0.91,f=-0.013) USER MOD Single : A 83 GLN : amide:sc= -0.551 K(o=-0.55,f=0) USER MOD Single : A 84 GLN : amide:sc= -0.256 X(o=-0.26,f=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 GLN : amide:sc= -0.062 X(o=-0.062,f=-0.46) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 428 SER OG : rot 66:sc= 0.241 USER MOD Single : A 432 THR OG1 : rot 180:sc= 0 USER MOD Single : A 436 TYR OH : rot 180:sc= 0 USER MOD Single : A 437 LYS NZ :NH3+ -169:sc=-0.00283 (180deg=-0.0991) USER MOD Single : A 439 GLN : amide:sc=-0.00767 K(o=-0.0077,f=-0.93) USER MOD Single : A 441 THR OG1 : rot 80:sc= 0.887 USER MOD Single : A 442 GLN : amide:sc= -0.77 K(o=-0.77,f=-0.0027) USER MOD Single : A 445 THR OG1 : rot 180:sc= 0 USER MOD Single : A 446 MET CE :methyl 160:sc= 0 (180deg=-0.505) USER MOD Single : A 447 MET CE :methyl 164:sc= -2.89! (180deg=-3.15) USER MOD Single : A 448 SER OG : rot 73:sc= 0.826 USER MOD Single : A 449 LYS NZ :NH3+ 171:sc= 0.382 (180deg=0.243) USER MOD Single : A 452 ASN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 453 THR OG1 : rot 152:sc= -1.47! USER MOD Single : A 454 SER OG : rot -86:sc= 0.641 USER MOD Single : A 455 SER OG : rot 180:sc= 0 USER MOD Single : A 456 TYR OH : rot 180:sc= -0.819 USER MOD Single : A 458 THR OG1 : rot 180:sc= 0 USER MOD Single : A 459 GLN : amide:sc= -1.86 K(o=-1.9,f=-0.2) USER MOD Single : A 462 THR OG1 : rot 76:sc= 0.395 USER MOD Single : A 464 MET CE :methyl -134:sc= -0.247 (180deg=-0.52) USER MOD Single : A 467 SER OG : rot 5:sc= 0.705 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.572 21.682 21.389 1.00 60.42 N ATOM 2 CA MET A 1 1.117 21.031 20.178 1.00 51.21 C ATOM 3 C MET A 1 -0.020 20.324 19.383 1.00 62.34 C ATOM 4 O MET A 1 -0.245 19.117 19.506 1.00 62.12 O ATOM 5 CB MET A 1 2.294 20.069 20.560 1.00 72.50 C ATOM 6 CG MET A 1 1.940 18.936 21.544 1.00 54.03 C ATOM 7 SD MET A 1 3.318 17.819 21.885 1.00 52.43 S ATOM 8 CE MET A 1 2.502 16.577 22.901 1.00 44.12 C ATOM 0 H1 MET A 1 1.342 22.149 21.909 1.00 60.42 H new ATOM 0 H2 MET A 1 -0.138 22.390 21.113 1.00 60.42 H new ATOM 0 H3 MET A 1 0.128 20.966 21.998 1.00 60.42 H new ATOM 0 HA MET A 1 1.536 21.787 19.513 1.00 51.21 H new ATOM 0 HB2 MET A 1 2.685 19.622 19.646 1.00 72.50 H new ATOM 0 HB3 MET A 1 3.098 20.663 20.993 1.00 72.50 H new ATOM 0 HG2 MET A 1 1.597 19.374 22.482 1.00 54.03 H new ATOM 0 HG3 MET A 1 1.108 18.360 21.138 1.00 54.03 H new ATOM 0 HE1 MET A 1 3.234 16.103 23.554 1.00 44.12 H new ATOM 0 HE2 MET A 1 1.730 17.052 23.506 1.00 44.12 H new ATOM 0 HE3 MET A 1 2.047 15.823 22.259 1.00 44.12 H new ATOM 20 N THR A 2 -0.769 21.116 18.584 1.00 34.14 N ATOM 21 CA THR A 2 -1.920 20.614 17.792 1.00 0.35 C ATOM 22 C THR A 2 -1.444 19.799 16.571 1.00 33.41 C ATOM 23 O THR A 2 -1.920 18.680 16.329 1.00 21.11 O ATOM 24 CB THR A 2 -2.840 21.794 17.324 1.00 43.31 C ATOM 25 OG1 THR A 2 -2.072 22.745 16.574 1.00 13.42 O ATOM 26 CG2 THR A 2 -3.509 22.514 18.513 1.00 51.01 C ATOM 0 H THR A 2 -0.597 22.115 18.469 1.00 34.14 H new ATOM 0 HA THR A 2 -2.500 19.958 18.441 1.00 0.35 H new ATOM 0 HB THR A 2 -3.625 21.364 16.701 1.00 43.31 H new ATOM 0 HG1 THR A 2 -2.653 23.479 16.283 1.00 13.42 H new ATOM 0 HG21 THR A 2 -4.137 23.324 18.141 1.00 51.01 H new ATOM 0 HG22 THR A 2 -4.123 21.805 19.069 1.00 51.01 H new ATOM 0 HG23 THR A 2 -2.741 22.922 19.170 1.00 51.01 H new ATOM 34 N SER A 3 -0.476 20.367 15.829 1.00 15.25 N ATOM 35 CA SER A 3 0.119 19.721 14.646 1.00 21.43 C ATOM 36 C SER A 3 0.860 18.420 15.054 1.00 22.43 C ATOM 37 O SER A 3 0.884 17.433 14.301 1.00 32.24 O ATOM 38 CB SER A 3 1.082 20.707 13.936 1.00 42.33 C ATOM 39 OG SER A 3 0.441 21.943 13.643 1.00 30.44 O ATOM 0 H SER A 3 -0.085 21.287 16.033 1.00 15.25 H new ATOM 0 HA SER A 3 -0.676 19.451 13.951 1.00 21.43 H new ATOM 0 HB2 SER A 3 1.951 20.888 14.569 1.00 42.33 H new ATOM 0 HB3 SER A 3 1.448 20.258 13.013 1.00 42.33 H new ATOM 0 HG SER A 3 1.075 22.543 13.197 1.00 30.44 H new ATOM 45 N THR A 4 1.428 18.426 16.270 1.00 71.31 N ATOM 46 CA THR A 4 2.195 17.293 16.805 1.00 20.34 C ATOM 47 C THR A 4 1.272 16.194 17.382 1.00 63.32 C ATOM 48 O THR A 4 1.607 15.015 17.276 1.00 61.21 O ATOM 49 CB THR A 4 3.232 17.763 17.872 1.00 52.32 C ATOM 50 OG1 THR A 4 4.058 18.801 17.309 1.00 5.13 O ATOM 51 CG2 THR A 4 4.129 16.612 18.376 1.00 33.54 C ATOM 0 H THR A 4 1.368 19.218 16.910 1.00 71.31 H new ATOM 0 HA THR A 4 2.743 16.857 15.970 1.00 20.34 H new ATOM 0 HB THR A 4 2.671 18.137 18.729 1.00 52.32 H new ATOM 0 HG1 THR A 4 4.939 18.787 17.738 1.00 5.13 H new ATOM 0 HG21 THR A 4 4.831 16.995 19.116 1.00 33.54 H new ATOM 0 HG22 THR A 4 3.509 15.840 18.830 1.00 33.54 H new ATOM 0 HG23 THR A 4 4.681 16.187 17.538 1.00 33.54 H new ATOM 59 N VAL A 5 0.112 16.559 17.978 1.00 51.20 N ATOM 60 CA VAL A 5 -0.813 15.546 18.549 1.00 74.24 C ATOM 61 C VAL A 5 -1.457 14.716 17.419 1.00 1.13 C ATOM 62 O VAL A 5 -1.537 13.488 17.521 1.00 2.15 O ATOM 63 CB VAL A 5 -1.924 16.147 19.510 1.00 71.54 C ATOM 64 CG1 VAL A 5 -2.937 17.050 18.777 1.00 73.30 C ATOM 65 CG2 VAL A 5 -2.657 15.025 20.288 1.00 43.52 C ATOM 0 H VAL A 5 -0.203 17.524 18.076 1.00 51.20 H new ATOM 0 HA VAL A 5 -0.202 14.901 19.180 1.00 74.24 H new ATOM 0 HB VAL A 5 -1.396 16.782 20.221 1.00 71.54 H new ATOM 0 HG11 VAL A 5 -3.669 17.429 19.490 1.00 73.30 H new ATOM 0 HG12 VAL A 5 -2.412 17.887 18.317 1.00 73.30 H new ATOM 0 HG13 VAL A 5 -3.447 16.473 18.005 1.00 73.30 H new ATOM 0 HG21 VAL A 5 -3.412 15.467 20.938 1.00 43.52 H new ATOM 0 HG22 VAL A 5 -3.137 14.347 19.582 1.00 43.52 H new ATOM 0 HG23 VAL A 5 -1.938 14.471 20.891 1.00 43.52 H new ATOM 75 N GLU A 6 -1.863 15.394 16.318 1.00 42.13 N ATOM 76 CA GLU A 6 -2.431 14.718 15.129 1.00 20.01 C ATOM 77 C GLU A 6 -1.343 13.897 14.402 1.00 63.53 C ATOM 78 O GLU A 6 -1.635 12.847 13.838 1.00 61.31 O ATOM 79 CB GLU A 6 -3.085 15.750 14.175 1.00 32.13 C ATOM 80 CG GLU A 6 -2.120 16.838 13.681 1.00 61.13 C ATOM 81 CD GLU A 6 -2.757 17.909 12.789 1.00 21.52 C ATOM 82 OE1 GLU A 6 -3.482 18.780 13.312 1.00 22.31 O ATOM 83 OE2 GLU A 6 -2.503 17.906 11.568 1.00 4.43 O ATOM 0 H GLU A 6 -1.807 16.409 16.230 1.00 42.13 H new ATOM 0 HA GLU A 6 -3.208 14.029 15.459 1.00 20.01 H new ATOM 0 HB2 GLU A 6 -3.496 15.224 13.313 1.00 32.13 H new ATOM 0 HB3 GLU A 6 -3.921 16.225 14.688 1.00 32.13 H new ATOM 0 HG2 GLU A 6 -1.672 17.326 14.547 1.00 61.13 H new ATOM 0 HG3 GLU A 6 -1.310 16.361 13.129 1.00 61.13 H new ATOM 90 N PHE A 7 -0.092 14.412 14.420 1.00 70.14 N ATOM 91 CA PHE A 7 1.113 13.684 13.965 1.00 55.02 C ATOM 92 C PHE A 7 1.229 12.305 14.679 1.00 71.53 C ATOM 93 O PHE A 7 1.294 11.271 14.008 1.00 31.42 O ATOM 94 CB PHE A 7 2.346 14.599 14.219 1.00 70.05 C ATOM 95 CG PHE A 7 3.739 13.995 14.047 1.00 64.14 C ATOM 96 CD1 PHE A 7 4.396 14.021 12.817 1.00 70.20 C ATOM 97 CD2 PHE A 7 4.411 13.438 15.136 1.00 2.01 C ATOM 98 CE1 PHE A 7 5.680 13.526 12.689 1.00 44.53 C ATOM 99 CE2 PHE A 7 5.688 12.936 14.997 1.00 72.11 C ATOM 100 CZ PHE A 7 6.317 12.975 13.773 1.00 62.04 C ATOM 0 H PHE A 7 0.110 15.354 14.754 1.00 70.14 H new ATOM 0 HA PHE A 7 1.053 13.461 12.900 1.00 55.02 H new ATOM 0 HB2 PHE A 7 2.269 15.455 13.549 1.00 70.05 H new ATOM 0 HB3 PHE A 7 2.272 14.983 15.237 1.00 70.05 H new ATOM 0 HD1 PHE A 7 3.895 14.433 11.954 1.00 70.20 H new ATOM 0 HD2 PHE A 7 3.925 13.400 16.100 1.00 2.01 H new ATOM 0 HE1 PHE A 7 6.183 13.573 11.734 1.00 44.53 H new ATOM 0 HE2 PHE A 7 6.196 12.511 15.850 1.00 72.11 H new ATOM 0 HZ PHE A 7 7.313 12.572 13.665 1.00 62.04 H new ATOM 110 N ILE A 8 1.188 12.318 16.037 1.00 31.42 N ATOM 111 CA ILE A 8 1.255 11.093 16.886 1.00 75.14 C ATOM 112 C ILE A 8 0.173 10.083 16.470 1.00 35.50 C ATOM 113 O ILE A 8 0.472 8.934 16.104 1.00 52.12 O ATOM 114 CB ILE A 8 1.026 11.435 18.418 1.00 42.42 C ATOM 115 CG1 ILE A 8 2.118 12.399 18.956 1.00 3.30 C ATOM 116 CG2 ILE A 8 0.942 10.148 19.288 1.00 31.02 C ATOM 117 CD1 ILE A 8 1.845 12.954 20.346 1.00 51.14 C ATOM 0 H ILE A 8 1.107 13.179 16.578 1.00 31.42 H new ATOM 0 HA ILE A 8 2.250 10.670 16.746 1.00 75.14 H new ATOM 0 HB ILE A 8 0.066 11.946 18.491 1.00 42.42 H new ATOM 0 HG12 ILE A 8 3.073 11.873 18.970 1.00 3.30 H new ATOM 0 HG13 ILE A 8 2.223 13.232 18.261 1.00 3.30 H new ATOM 0 HG21 ILE A 8 0.785 10.423 20.331 1.00 31.02 H new ATOM 0 HG22 ILE A 8 0.111 9.531 18.946 1.00 31.02 H new ATOM 0 HG23 ILE A 8 1.872 9.586 19.197 1.00 31.02 H new ATOM 0 HD11 ILE A 8 2.659 13.617 20.640 1.00 51.14 H new ATOM 0 HD12 ILE A 8 0.908 13.512 20.338 1.00 51.14 H new ATOM 0 HD13 ILE A 8 1.772 12.132 21.058 1.00 51.14 H new ATOM 129 N ASN A 9 -1.083 10.571 16.531 1.00 22.54 N ATOM 130 CA ASN A 9 -2.294 9.762 16.337 1.00 63.34 C ATOM 131 C ASN A 9 -2.306 9.092 14.965 1.00 62.01 C ATOM 132 O ASN A 9 -2.545 7.894 14.866 1.00 71.40 O ATOM 133 CB ASN A 9 -3.570 10.634 16.509 1.00 15.13 C ATOM 134 CG ASN A 9 -3.671 11.296 17.882 1.00 33.41 C ATOM 135 OD1 ASN A 9 -3.173 10.778 18.882 1.00 51.42 O ATOM 136 ND2 ASN A 9 -4.313 12.454 17.940 1.00 52.01 N ATOM 0 H ASN A 9 -1.282 11.553 16.719 1.00 22.54 H new ATOM 0 HA ASN A 9 -2.289 8.982 17.098 1.00 63.34 H new ATOM 0 HB2 ASN A 9 -3.580 11.406 15.740 1.00 15.13 H new ATOM 0 HB3 ASN A 9 -4.451 10.012 16.348 1.00 15.13 H new ATOM 0 HD21 ASN A 9 -4.405 12.942 18.831 1.00 52.01 H new ATOM 0 HD22 ASN A 9 -4.715 12.857 17.094 1.00 52.01 H new ATOM 143 N ARG A 10 -2.008 9.873 13.912 1.00 74.12 N ATOM 144 CA ARG A 10 -2.085 9.392 12.523 1.00 32.22 C ATOM 145 C ARG A 10 -0.949 8.419 12.190 1.00 60.22 C ATOM 146 O ARG A 10 -1.181 7.484 11.443 1.00 13.41 O ATOM 147 CB ARG A 10 -2.127 10.562 11.521 1.00 31.44 C ATOM 148 CG ARG A 10 -3.394 11.434 11.637 1.00 3.43 C ATOM 149 CD ARG A 10 -3.407 12.571 10.617 1.00 61.31 C ATOM 150 NE ARG A 10 -2.197 13.413 10.703 1.00 14.14 N ATOM 151 CZ ARG A 10 -2.179 14.745 10.607 1.00 53.21 C ATOM 152 NH1 ARG A 10 -3.301 15.428 10.421 1.00 14.11 N ATOM 153 NH2 ARG A 10 -1.028 15.389 10.715 1.00 5.21 N ATOM 0 H ARG A 10 -1.710 10.845 13.998 1.00 74.12 H new ATOM 0 HA ARG A 10 -3.021 8.841 12.430 1.00 32.22 H new ATOM 0 HB2 ARG A 10 -1.249 11.190 11.673 1.00 31.44 H new ATOM 0 HB3 ARG A 10 -2.062 10.164 10.508 1.00 31.44 H new ATOM 0 HG2 ARG A 10 -4.277 10.810 11.495 1.00 3.43 H new ATOM 0 HG3 ARG A 10 -3.456 11.850 12.643 1.00 3.43 H new ATOM 0 HD2 ARG A 10 -3.487 12.155 9.613 1.00 61.31 H new ATOM 0 HD3 ARG A 10 -4.290 13.190 10.777 1.00 61.31 H new ATOM 0 HE ARG A 10 -1.305 12.940 10.847 1.00 14.14 H new ATOM 0 HH11 ARG A 10 -4.192 14.936 10.350 1.00 14.11 H new ATOM 0 HH12 ARG A 10 -3.273 16.445 10.349 1.00 14.11 H new ATOM 0 HH21 ARG A 10 -0.165 14.868 10.870 1.00 5.21 H new ATOM 0 HH22 ARG A 10 -1.004 16.406 10.643 1.00 5.21 H new ATOM 167 N TRP A 11 0.267 8.623 12.751 1.00 42.13 N ATOM 168 CA TRP A 11 1.380 7.645 12.586 1.00 31.33 C ATOM 169 C TRP A 11 1.047 6.317 13.279 1.00 34.34 C ATOM 170 O TRP A 11 1.405 5.240 12.777 1.00 55.32 O ATOM 171 CB TRP A 11 2.736 8.186 13.109 1.00 55.51 C ATOM 172 CG TRP A 11 3.420 9.151 12.165 1.00 40.22 C ATOM 173 CD1 TRP A 11 3.676 10.468 12.375 1.00 31.32 C ATOM 174 CD2 TRP A 11 3.941 8.858 10.855 1.00 52.11 C ATOM 175 NE1 TRP A 11 4.307 11.009 11.294 1.00 13.54 N ATOM 176 CE2 TRP A 11 4.489 10.050 10.354 1.00 4.11 C ATOM 177 CE3 TRP A 11 4.009 7.710 10.064 1.00 24.51 C ATOM 178 CZ2 TRP A 11 5.094 10.134 9.111 1.00 13.44 C ATOM 179 CZ3 TRP A 11 4.599 7.795 8.816 1.00 42.34 C ATOM 180 CH2 TRP A 11 5.139 9.003 8.356 1.00 4.41 C ATOM 0 H TRP A 11 0.504 9.440 13.313 1.00 42.13 H new ATOM 0 HA TRP A 11 1.486 7.479 11.514 1.00 31.33 H new ATOM 0 HB2 TRP A 11 2.572 8.684 14.065 1.00 55.51 H new ATOM 0 HB3 TRP A 11 3.403 7.344 13.298 1.00 55.51 H new ATOM 0 HD1 TRP A 11 3.416 11.011 13.272 1.00 31.32 H new ATOM 0 HE1 TRP A 11 4.597 11.983 11.207 1.00 13.54 H new ATOM 0 HE3 TRP A 11 3.608 6.772 10.420 1.00 24.51 H new ATOM 0 HZ2 TRP A 11 5.514 11.063 8.754 1.00 13.44 H new ATOM 0 HZ3 TRP A 11 4.644 6.918 8.187 1.00 42.34 H new ATOM 0 HH2 TRP A 11 5.601 9.037 7.381 1.00 4.41 H new ATOM 191 N GLN A 12 0.359 6.414 14.435 1.00 74.25 N ATOM 192 CA GLN A 12 -0.203 5.248 15.130 1.00 63.22 C ATOM 193 C GLN A 12 -1.183 4.512 14.200 1.00 1.25 C ATOM 194 O GLN A 12 -1.118 3.286 14.075 1.00 73.40 O ATOM 195 CB GLN A 12 -0.917 5.674 16.443 1.00 50.24 C ATOM 196 CG GLN A 12 -1.560 4.514 17.227 1.00 70.53 C ATOM 197 CD GLN A 12 -2.368 4.957 18.448 1.00 13.40 C ATOM 198 OE1 GLN A 12 -2.952 6.044 18.468 1.00 30.12 O ATOM 199 NE2 GLN A 12 -2.412 4.115 19.469 1.00 54.21 N ATOM 0 H GLN A 12 0.180 7.300 14.907 1.00 74.25 H new ATOM 0 HA GLN A 12 0.612 4.575 15.396 1.00 63.22 H new ATOM 0 HB2 GLN A 12 -0.195 6.175 17.088 1.00 50.24 H new ATOM 0 HB3 GLN A 12 -1.689 6.404 16.201 1.00 50.24 H new ATOM 0 HG2 GLN A 12 -2.212 3.954 16.557 1.00 70.53 H new ATOM 0 HG3 GLN A 12 -0.776 3.831 17.552 1.00 70.53 H new ATOM 0 HE21 GLN A 12 -1.917 3.225 19.418 1.00 54.21 H new ATOM 0 HE22 GLN A 12 -2.941 4.357 20.307 1.00 54.21 H new ATOM 208 N ARG A 13 -2.057 5.290 13.510 1.00 75.12 N ATOM 209 CA ARG A 13 -3.047 4.727 12.576 1.00 25.10 C ATOM 210 C ARG A 13 -2.340 4.042 11.395 1.00 63.24 C ATOM 211 O ARG A 13 -2.718 2.953 11.019 1.00 30.15 O ATOM 212 CB ARG A 13 -4.045 5.799 12.033 1.00 0.11 C ATOM 213 CG ARG A 13 -4.743 6.659 13.104 1.00 52.04 C ATOM 214 CD ARG A 13 -5.416 5.853 14.231 1.00 55.12 C ATOM 215 NE ARG A 13 -5.832 6.723 15.347 1.00 70.33 N ATOM 216 CZ ARG A 13 -6.000 6.331 16.622 1.00 52.13 C ATOM 217 NH1 ARG A 13 -5.804 5.067 16.993 1.00 64.44 N ATOM 218 NH2 ARG A 13 -6.364 7.224 17.530 1.00 12.32 N ATOM 0 H ARG A 13 -2.090 6.306 13.588 1.00 75.12 H new ATOM 0 HA ARG A 13 -3.625 3.996 13.141 1.00 25.10 H new ATOM 0 HB2 ARG A 13 -3.506 6.461 11.355 1.00 0.11 H new ATOM 0 HB3 ARG A 13 -4.810 5.293 11.444 1.00 0.11 H new ATOM 0 HG2 ARG A 13 -4.009 7.334 13.545 1.00 52.04 H new ATOM 0 HG3 ARG A 13 -5.496 7.280 12.619 1.00 52.04 H new ATOM 0 HD2 ARG A 13 -6.285 5.328 13.835 1.00 55.12 H new ATOM 0 HD3 ARG A 13 -4.725 5.094 14.599 1.00 55.12 H new ATOM 0 HE ARG A 13 -6.007 7.705 15.133 1.00 70.33 H new ATOM 0 HH11 ARG A 13 -5.520 4.371 16.303 1.00 64.44 H new ATOM 0 HH12 ARG A 13 -5.938 4.795 17.967 1.00 64.44 H new ATOM 0 HH21 ARG A 13 -6.513 8.196 17.258 1.00 12.32 H new ATOM 0 HH22 ARG A 13 -6.495 6.940 18.501 1.00 12.32 H new ATOM 232 N ILE A 14 -1.274 4.689 10.868 1.00 11.30 N ATOM 233 CA ILE A 14 -0.511 4.204 9.692 1.00 32.35 C ATOM 234 C ILE A 14 0.109 2.816 9.976 1.00 43.14 C ATOM 235 O ILE A 14 0.012 1.908 9.144 1.00 11.33 O ATOM 236 CB ILE A 14 0.603 5.261 9.267 1.00 60.15 C ATOM 237 CG1 ILE A 14 -0.059 6.573 8.742 1.00 62.12 C ATOM 238 CG2 ILE A 14 1.581 4.700 8.210 1.00 21.35 C ATOM 239 CD1 ILE A 14 0.889 7.731 8.473 1.00 71.44 C ATOM 0 H ILE A 14 -0.917 5.566 11.248 1.00 11.30 H new ATOM 0 HA ILE A 14 -1.201 4.095 8.856 1.00 32.35 H new ATOM 0 HB ILE A 14 1.185 5.481 10.162 1.00 60.15 H new ATOM 0 HG12 ILE A 14 -0.594 6.344 7.820 1.00 62.12 H new ATOM 0 HG13 ILE A 14 -0.803 6.898 9.469 1.00 62.12 H new ATOM 0 HG21 ILE A 14 2.319 5.461 7.957 1.00 21.35 H new ATOM 0 HG22 ILE A 14 2.088 3.823 8.613 1.00 21.35 H new ATOM 0 HG23 ILE A 14 1.027 4.419 7.314 1.00 21.35 H new ATOM 0 HD11 ILE A 14 0.322 8.589 8.113 1.00 71.44 H new ATOM 0 HD12 ILE A 14 1.407 7.999 9.394 1.00 71.44 H new ATOM 0 HD13 ILE A 14 1.619 7.436 7.719 1.00 71.44 H new ATOM 251 N ALA A 15 0.691 2.648 11.179 1.00 13.32 N ATOM 252 CA ALA A 15 1.311 1.372 11.595 1.00 53.40 C ATOM 253 C ALA A 15 0.255 0.269 11.814 1.00 41.43 C ATOM 254 O ALA A 15 0.459 -0.886 11.414 1.00 10.14 O ATOM 255 CB ALA A 15 2.140 1.568 12.864 1.00 71.43 C ATOM 0 H ALA A 15 0.745 3.383 11.884 1.00 13.32 H new ATOM 0 HA ALA A 15 1.968 1.049 10.787 1.00 53.40 H new ATOM 0 HB1 ALA A 15 2.589 0.618 13.156 1.00 71.43 H new ATOM 0 HB2 ALA A 15 2.927 2.299 12.675 1.00 71.43 H new ATOM 0 HB3 ALA A 15 1.496 1.927 13.667 1.00 71.43 H new ATOM 261 N LEU A 16 -0.877 0.641 12.450 1.00 62.30 N ATOM 262 CA LEU A 16 -1.991 -0.293 12.720 1.00 31.34 C ATOM 263 C LEU A 16 -2.685 -0.725 11.412 1.00 13.32 C ATOM 264 O LEU A 16 -3.102 -1.875 11.284 1.00 22.21 O ATOM 265 CB LEU A 16 -3.022 0.340 13.704 1.00 21.11 C ATOM 266 CG LEU A 16 -2.502 0.623 15.153 1.00 73.42 C ATOM 267 CD1 LEU A 16 -3.589 1.305 16.019 1.00 50.14 C ATOM 268 CD2 LEU A 16 -1.971 -0.669 15.823 1.00 73.14 C ATOM 0 H LEU A 16 -1.043 1.589 12.788 1.00 62.30 H new ATOM 0 HA LEU A 16 -1.571 -1.183 13.189 1.00 31.34 H new ATOM 0 HB2 LEU A 16 -3.374 1.278 13.276 1.00 21.11 H new ATOM 0 HB3 LEU A 16 -3.884 -0.323 13.772 1.00 21.11 H new ATOM 0 HG LEU A 16 -1.666 1.317 15.073 1.00 73.42 H new ATOM 0 HD11 LEU A 16 -3.196 1.488 17.019 1.00 50.14 H new ATOM 0 HD12 LEU A 16 -3.876 2.253 15.563 1.00 50.14 H new ATOM 0 HD13 LEU A 16 -4.462 0.655 16.085 1.00 50.14 H new ATOM 0 HD21 LEU A 16 -1.617 -0.439 16.828 1.00 73.14 H new ATOM 0 HD22 LEU A 16 -2.773 -1.405 15.880 1.00 73.14 H new ATOM 0 HD23 LEU A 16 -1.149 -1.073 15.233 1.00 73.14 H new ATOM 280 N LEU A 17 -2.766 0.206 10.440 1.00 61.02 N ATOM 281 CA LEU A 17 -3.417 -0.030 9.137 1.00 42.03 C ATOM 282 C LEU A 17 -2.563 -0.946 8.272 1.00 24.22 C ATOM 283 O LEU A 17 -3.078 -1.936 7.761 1.00 12.04 O ATOM 284 CB LEU A 17 -3.719 1.308 8.394 1.00 4.34 C ATOM 285 CG LEU A 17 -4.873 2.160 9.006 1.00 33.31 C ATOM 286 CD1 LEU A 17 -4.953 3.562 8.368 1.00 33.13 C ATOM 287 CD2 LEU A 17 -6.214 1.411 8.901 1.00 13.43 C ATOM 0 H LEU A 17 -2.380 1.145 10.538 1.00 61.02 H new ATOM 0 HA LEU A 17 -4.371 -0.521 9.328 1.00 42.03 H new ATOM 0 HB2 LEU A 17 -2.811 1.911 8.381 1.00 4.34 H new ATOM 0 HB3 LEU A 17 -3.966 1.082 7.357 1.00 4.34 H new ATOM 0 HG LEU A 17 -4.652 2.310 10.063 1.00 33.31 H new ATOM 0 HD11 LEU A 17 -5.770 4.123 8.823 1.00 33.13 H new ATOM 0 HD12 LEU A 17 -4.014 4.091 8.533 1.00 33.13 H new ATOM 0 HD13 LEU A 17 -5.132 3.465 7.297 1.00 33.13 H new ATOM 0 HD21 LEU A 17 -7.007 2.022 9.333 1.00 13.43 H new ATOM 0 HD22 LEU A 17 -6.439 1.213 7.853 1.00 13.43 H new ATOM 0 HD23 LEU A 17 -6.147 0.467 9.442 1.00 13.43 H new ATOM 299 N SER A 18 -1.251 -0.629 8.154 1.00 2.31 N ATOM 300 CA SER A 18 -0.288 -1.452 7.390 1.00 32.34 C ATOM 301 C SER A 18 -0.281 -2.892 7.912 1.00 5.34 C ATOM 302 O SER A 18 -0.238 -3.835 7.133 1.00 3.14 O ATOM 303 CB SER A 18 1.139 -0.866 7.471 1.00 62.31 C ATOM 304 OG SER A 18 1.558 -0.678 8.810 1.00 74.21 O ATOM 0 H SER A 18 -0.835 0.198 8.583 1.00 2.31 H new ATOM 0 HA SER A 18 -0.606 -1.447 6.347 1.00 32.34 H new ATOM 0 HB2 SER A 18 1.835 -1.534 6.963 1.00 62.31 H new ATOM 0 HB3 SER A 18 1.170 0.087 6.944 1.00 62.31 H new ATOM 0 HG SER A 18 0.784 -0.747 9.408 1.00 74.21 H new ATOM 310 N GLN A 19 -0.358 -3.018 9.251 1.00 61.14 N ATOM 311 CA GLN A 19 -0.409 -4.310 9.953 1.00 71.30 C ATOM 312 C GLN A 19 -1.695 -5.080 9.611 1.00 31.40 C ATOM 313 O GLN A 19 -1.643 -6.269 9.267 1.00 52.44 O ATOM 314 CB GLN A 19 -0.285 -4.073 11.479 1.00 13.02 C ATOM 315 CG GLN A 19 -0.101 -5.345 12.327 1.00 73.32 C ATOM 316 CD GLN A 19 0.014 -5.077 13.834 1.00 52.41 C ATOM 317 OE1 GLN A 19 0.706 -5.802 14.549 1.00 72.24 O ATOM 318 NE2 GLN A 19 -0.683 -4.054 14.339 1.00 32.31 N ATOM 0 H GLN A 19 -0.387 -2.216 9.880 1.00 61.14 H new ATOM 0 HA GLN A 19 0.428 -4.925 9.622 1.00 71.30 H new ATOM 0 HB2 GLN A 19 0.561 -3.409 11.660 1.00 13.02 H new ATOM 0 HB3 GLN A 19 -1.178 -3.552 11.823 1.00 13.02 H new ATOM 0 HG2 GLN A 19 -0.944 -6.013 12.150 1.00 73.32 H new ATOM 0 HG3 GLN A 19 0.795 -5.867 11.991 1.00 73.32 H new ATOM 0 HE21 GLN A 19 -1.248 -3.469 13.724 1.00 32.31 H new ATOM 0 HE22 GLN A 19 -0.649 -3.858 15.340 1.00 32.31 H new ATOM 327 N SER A 20 -2.841 -4.365 9.672 1.00 52.13 N ATOM 328 CA SER A 20 -4.171 -4.938 9.391 1.00 25.00 C ATOM 329 C SER A 20 -4.233 -5.519 7.970 1.00 14.21 C ATOM 330 O SER A 20 -4.485 -6.715 7.789 1.00 34.41 O ATOM 331 CB SER A 20 -5.278 -3.868 9.574 1.00 21.34 C ATOM 332 OG SER A 20 -5.322 -3.382 10.907 1.00 31.32 O ATOM 0 H SER A 20 -2.867 -3.375 9.918 1.00 52.13 H new ATOM 0 HA SER A 20 -4.341 -5.746 10.102 1.00 25.00 H new ATOM 0 HB2 SER A 20 -5.099 -3.039 8.890 1.00 21.34 H new ATOM 0 HB3 SER A 20 -6.245 -4.296 9.310 1.00 21.34 H new ATOM 0 HG SER A 20 -4.582 -2.756 11.051 1.00 31.32 H new ATOM 338 N LEU A 21 -3.943 -4.668 6.971 1.00 22.43 N ATOM 339 CA LEU A 21 -4.059 -5.030 5.553 1.00 53.22 C ATOM 340 C LEU A 21 -2.921 -5.960 5.099 1.00 61.01 C ATOM 341 O LEU A 21 -3.054 -6.616 4.077 1.00 2.53 O ATOM 342 CB LEU A 21 -4.213 -3.753 4.677 1.00 22.32 C ATOM 343 CG LEU A 21 -3.097 -2.656 4.773 1.00 33.42 C ATOM 344 CD1 LEU A 21 -1.822 -3.032 4.018 1.00 10.52 C ATOM 345 CD2 LEU A 21 -3.611 -1.282 4.314 1.00 4.34 C ATOM 0 H LEU A 21 -3.622 -3.712 7.126 1.00 22.43 H new ATOM 0 HA LEU A 21 -4.969 -5.615 5.417 1.00 53.22 H new ATOM 0 HB2 LEU A 21 -4.282 -4.069 3.636 1.00 22.32 H new ATOM 0 HB3 LEU A 21 -5.164 -3.285 4.933 1.00 22.32 H new ATOM 0 HG LEU A 21 -2.835 -2.592 5.829 1.00 33.42 H new ATOM 0 HD11 LEU A 21 -1.088 -2.233 4.122 1.00 10.52 H new ATOM 0 HD12 LEU A 21 -1.414 -3.955 4.430 1.00 10.52 H new ATOM 0 HD13 LEU A 21 -2.053 -3.177 2.963 1.00 10.52 H new ATOM 0 HD21 LEU A 21 -2.809 -0.548 4.395 1.00 4.34 H new ATOM 0 HD22 LEU A 21 -3.942 -1.345 3.277 1.00 4.34 H new ATOM 0 HD23 LEU A 21 -4.447 -0.977 4.944 1.00 4.34 H new ATOM 357 N LEU A 22 -1.805 -5.993 5.863 1.00 24.34 N ATOM 358 CA LEU A 22 -0.727 -6.988 5.663 1.00 60.22 C ATOM 359 C LEU A 22 -1.286 -8.397 5.902 1.00 71.12 C ATOM 360 O LEU A 22 -1.087 -9.309 5.088 1.00 5.13 O ATOM 361 CB LEU A 22 0.467 -6.743 6.628 1.00 61.54 C ATOM 362 CG LEU A 22 1.671 -7.729 6.495 1.00 22.21 C ATOM 363 CD1 LEU A 22 2.380 -7.568 5.135 1.00 20.24 C ATOM 364 CD2 LEU A 22 2.657 -7.567 7.667 1.00 21.40 C ATOM 0 H LEU A 22 -1.628 -5.340 6.626 1.00 24.34 H new ATOM 0 HA LEU A 22 -0.363 -6.889 4.640 1.00 60.22 H new ATOM 0 HB2 LEU A 22 0.834 -5.729 6.469 1.00 61.54 H new ATOM 0 HB3 LEU A 22 0.096 -6.790 7.652 1.00 61.54 H new ATOM 0 HG LEU A 22 1.274 -8.743 6.538 1.00 22.21 H new ATOM 0 HD11 LEU A 22 3.213 -8.268 5.074 1.00 20.24 H new ATOM 0 HD12 LEU A 22 1.674 -7.773 4.330 1.00 20.24 H new ATOM 0 HD13 LEU A 22 2.755 -6.549 5.038 1.00 20.24 H new ATOM 0 HD21 LEU A 22 3.484 -8.267 7.546 1.00 21.40 H new ATOM 0 HD22 LEU A 22 3.043 -6.548 7.680 1.00 21.40 H new ATOM 0 HD23 LEU A 22 2.143 -7.772 8.606 1.00 21.40 H new ATOM 376 N GLU A 23 -2.012 -8.529 7.037 1.00 44.33 N ATOM 377 CA GLU A 23 -2.715 -9.765 7.417 1.00 73.20 C ATOM 378 C GLU A 23 -3.773 -10.131 6.357 1.00 64.50 C ATOM 379 O GLU A 23 -3.877 -11.284 5.957 1.00 52.24 O ATOM 380 CB GLU A 23 -3.381 -9.602 8.810 1.00 42.41 C ATOM 381 CG GLU A 23 -2.399 -9.309 9.964 1.00 21.21 C ATOM 382 CD GLU A 23 -3.117 -9.027 11.296 1.00 33.44 C ATOM 383 OE1 GLU A 23 -3.374 -9.989 12.057 1.00 41.21 O ATOM 384 OE2 GLU A 23 -3.457 -7.848 11.573 1.00 4.20 O ATOM 0 H GLU A 23 -2.123 -7.774 7.714 1.00 44.33 H new ATOM 0 HA GLU A 23 -1.986 -10.574 7.472 1.00 73.20 H new ATOM 0 HB2 GLU A 23 -4.110 -8.793 8.757 1.00 42.41 H new ATOM 0 HB3 GLU A 23 -3.933 -10.513 9.043 1.00 42.41 H new ATOM 0 HG2 GLU A 23 -1.728 -10.159 10.090 1.00 21.21 H new ATOM 0 HG3 GLU A 23 -1.780 -8.451 9.700 1.00 21.21 H new ATOM 391 N LEU A 24 -4.511 -9.111 5.880 1.00 61.01 N ATOM 392 CA LEU A 24 -5.599 -9.273 4.885 1.00 4.21 C ATOM 393 C LEU A 24 -5.041 -9.673 3.495 1.00 41.21 C ATOM 394 O LEU A 24 -5.687 -10.419 2.749 1.00 34.34 O ATOM 395 CB LEU A 24 -6.427 -7.954 4.809 1.00 33.12 C ATOM 396 CG LEU A 24 -7.068 -7.486 6.163 1.00 31.13 C ATOM 397 CD1 LEU A 24 -7.647 -6.057 6.069 1.00 4.31 C ATOM 398 CD2 LEU A 24 -8.126 -8.488 6.659 1.00 45.32 C ATOM 0 H LEU A 24 -4.372 -8.144 6.173 1.00 61.01 H new ATOM 0 HA LEU A 24 -6.253 -10.084 5.204 1.00 4.21 H new ATOM 0 HB2 LEU A 24 -5.780 -7.159 4.438 1.00 33.12 H new ATOM 0 HB3 LEU A 24 -7.223 -8.085 4.076 1.00 33.12 H new ATOM 0 HG LEU A 24 -6.266 -7.456 6.901 1.00 31.13 H new ATOM 0 HD11 LEU A 24 -8.080 -5.776 7.029 1.00 4.31 H new ATOM 0 HD12 LEU A 24 -6.851 -5.358 5.811 1.00 4.31 H new ATOM 0 HD13 LEU A 24 -8.419 -6.027 5.300 1.00 4.31 H new ATOM 0 HD21 LEU A 24 -8.550 -8.134 7.599 1.00 45.32 H new ATOM 0 HD22 LEU A 24 -8.917 -8.579 5.915 1.00 45.32 H new ATOM 0 HD23 LEU A 24 -7.661 -9.461 6.815 1.00 45.32 H new ATOM 410 N ALA A 25 -3.821 -9.190 3.178 1.00 5.04 N ATOM 411 CA ALA A 25 -3.130 -9.476 1.904 1.00 31.14 C ATOM 412 C ALA A 25 -2.624 -10.925 1.864 1.00 42.25 C ATOM 413 O ALA A 25 -2.858 -11.645 0.886 1.00 43.11 O ATOM 414 CB ALA A 25 -1.958 -8.497 1.690 1.00 15.42 C ATOM 0 H ALA A 25 -3.285 -8.587 3.803 1.00 5.04 H new ATOM 0 HA ALA A 25 -3.850 -9.343 1.096 1.00 31.14 H new ATOM 0 HB1 ALA A 25 -1.462 -8.724 0.746 1.00 15.42 H new ATOM 0 HB2 ALA A 25 -2.337 -7.475 1.664 1.00 15.42 H new ATOM 0 HB3 ALA A 25 -1.245 -8.598 2.508 1.00 15.42 H new ATOM 420 N GLN A 26 -1.940 -11.354 2.948 1.00 33.20 N ATOM 421 CA GLN A 26 -1.375 -12.718 3.048 1.00 72.42 C ATOM 422 C GLN A 26 -2.490 -13.768 3.212 1.00 31.11 C ATOM 423 O GLN A 26 -2.324 -14.924 2.822 1.00 64.23 O ATOM 424 CB GLN A 26 -0.336 -12.812 4.204 1.00 12.51 C ATOM 425 CG GLN A 26 -0.888 -12.555 5.625 1.00 25.23 C ATOM 426 CD GLN A 26 0.169 -12.537 6.738 1.00 52.23 C ATOM 427 OE1 GLN A 26 -0.109 -12.919 7.871 1.00 63.31 O ATOM 428 NE2 GLN A 26 1.374 -12.059 6.444 1.00 63.44 N ATOM 0 H GLN A 26 -1.766 -10.773 3.768 1.00 33.20 H new ATOM 0 HA GLN A 26 -0.852 -12.932 2.116 1.00 72.42 H new ATOM 0 HB2 GLN A 26 0.114 -13.804 4.183 1.00 12.51 H new ATOM 0 HB3 GLN A 26 0.462 -12.096 4.009 1.00 12.51 H new ATOM 0 HG2 GLN A 26 -1.413 -11.600 5.627 1.00 25.23 H new ATOM 0 HG3 GLN A 26 -1.625 -13.324 5.857 1.00 25.23 H new ATOM 0 HE21 GLN A 26 1.582 -11.748 5.495 1.00 63.44 H new ATOM 0 HE22 GLN A 26 2.091 -12.004 7.167 1.00 63.44 H new ATOM 437 N ARG A 27 -3.624 -13.336 3.785 1.00 24.44 N ATOM 438 CA ARG A 27 -4.829 -14.173 3.963 1.00 44.10 C ATOM 439 C ARG A 27 -5.650 -14.291 2.660 1.00 52.35 C ATOM 440 O ARG A 27 -6.457 -15.218 2.523 1.00 15.42 O ATOM 441 CB ARG A 27 -5.712 -13.595 5.113 1.00 45.35 C ATOM 442 CG ARG A 27 -5.505 -14.248 6.502 1.00 35.00 C ATOM 443 CD ARG A 27 -5.974 -15.717 6.523 1.00 41.34 C ATOM 444 NE ARG A 27 -7.276 -15.861 5.842 1.00 40.01 N ATOM 445 CZ ARG A 27 -7.783 -16.989 5.335 1.00 63.12 C ATOM 446 NH1 ARG A 27 -7.136 -18.144 5.431 1.00 40.10 N ATOM 447 NH2 ARG A 27 -8.918 -16.929 4.645 1.00 62.45 N ATOM 0 H ARG A 27 -3.735 -12.387 4.143 1.00 24.44 H new ATOM 0 HA ARG A 27 -4.500 -15.178 4.228 1.00 44.10 H new ATOM 0 HB2 ARG A 27 -5.513 -12.527 5.199 1.00 45.35 H new ATOM 0 HB3 ARG A 27 -6.760 -13.702 4.833 1.00 45.35 H new ATOM 0 HG2 ARG A 27 -4.450 -14.200 6.772 1.00 35.00 H new ATOM 0 HG3 ARG A 27 -6.053 -13.681 7.255 1.00 35.00 H new ATOM 0 HD2 ARG A 27 -5.231 -16.348 6.035 1.00 41.34 H new ATOM 0 HD3 ARG A 27 -6.057 -16.062 7.554 1.00 41.34 H new ATOM 0 HE ARG A 27 -7.843 -15.018 5.749 1.00 40.01 H new ATOM 0 HH11 ARG A 27 -6.231 -18.184 5.900 1.00 40.10 H new ATOM 0 HH12 ARG A 27 -7.544 -18.991 5.036 1.00 40.10 H new ATOM 0 HH21 ARG A 27 -9.386 -16.033 4.510 1.00 62.45 H new ATOM 0 HH22 ARG A 27 -9.320 -17.779 4.250 1.00 62.45 H new ATOM 461 N GLY A 28 -5.458 -13.336 1.729 1.00 13.23 N ATOM 462 CA GLY A 28 -6.153 -13.354 0.437 1.00 54.01 C ATOM 463 C GLY A 28 -7.500 -12.633 0.454 1.00 41.30 C ATOM 464 O GLY A 28 -8.243 -12.686 -0.536 1.00 12.21 O ATOM 0 H GLY A 28 -4.826 -12.545 1.852 1.00 13.23 H new ATOM 0 HA2 GLY A 28 -5.514 -12.893 -0.316 1.00 54.01 H new ATOM 0 HA3 GLY A 28 -6.309 -14.389 0.133 1.00 54.01 H new ATOM 468 N GLU A 29 -7.829 -11.964 1.579 1.00 53.32 N ATOM 469 CA GLU A 29 -9.017 -11.091 1.678 1.00 45.41 C ATOM 470 C GLU A 29 -8.703 -9.735 1.029 1.00 41.02 C ATOM 471 O GLU A 29 -8.361 -8.753 1.711 1.00 73.54 O ATOM 472 CB GLU A 29 -9.484 -10.911 3.163 1.00 42.32 C ATOM 473 CG GLU A 29 -10.355 -12.056 3.724 1.00 25.21 C ATOM 474 CD GLU A 29 -9.606 -13.385 3.921 1.00 61.11 C ATOM 475 OE1 GLU A 29 -9.625 -14.254 3.020 1.00 21.53 O ATOM 476 OE2 GLU A 29 -9.017 -13.576 5.000 1.00 5.11 O ATOM 0 H GLU A 29 -7.282 -12.013 2.439 1.00 53.32 H new ATOM 0 HA GLU A 29 -9.842 -11.564 1.146 1.00 45.41 H new ATOM 0 HB2 GLU A 29 -8.601 -10.805 3.794 1.00 42.32 H new ATOM 0 HB3 GLU A 29 -10.044 -9.979 3.240 1.00 42.32 H new ATOM 0 HG2 GLU A 29 -10.773 -11.743 4.681 1.00 25.21 H new ATOM 0 HG3 GLU A 29 -11.194 -12.222 3.049 1.00 25.21 H new ATOM 483 N TRP A 30 -8.790 -9.718 -0.311 1.00 61.20 N ATOM 484 CA TRP A 30 -8.435 -8.552 -1.130 1.00 30.13 C ATOM 485 C TRP A 30 -9.415 -7.405 -0.923 1.00 51.51 C ATOM 486 O TRP A 30 -9.009 -6.261 -0.868 1.00 43.22 O ATOM 487 CB TRP A 30 -8.371 -8.925 -2.626 1.00 15.30 C ATOM 488 CG TRP A 30 -7.472 -10.104 -2.920 1.00 44.11 C ATOM 489 CD1 TRP A 30 -7.818 -11.276 -3.535 1.00 10.45 C ATOM 490 CD2 TRP A 30 -6.085 -10.228 -2.587 1.00 22.55 C ATOM 491 NE1 TRP A 30 -6.734 -12.112 -3.598 1.00 62.43 N ATOM 492 CE2 TRP A 30 -5.659 -11.490 -3.028 1.00 52.35 C ATOM 493 CE3 TRP A 30 -5.162 -9.391 -1.966 1.00 35.14 C ATOM 494 CZ2 TRP A 30 -4.353 -11.931 -2.859 1.00 43.24 C ATOM 495 CZ3 TRP A 30 -3.870 -9.825 -1.796 1.00 34.42 C ATOM 496 CH2 TRP A 30 -3.473 -11.083 -2.241 1.00 11.22 C ATOM 0 H TRP A 30 -9.110 -10.518 -0.857 1.00 61.20 H new ATOM 0 HA TRP A 30 -7.448 -8.221 -0.807 1.00 30.13 H new ATOM 0 HB2 TRP A 30 -9.378 -9.150 -2.979 1.00 15.30 H new ATOM 0 HB3 TRP A 30 -8.020 -8.062 -3.192 1.00 15.30 H new ATOM 0 HD1 TRP A 30 -8.802 -11.508 -3.915 1.00 10.45 H new ATOM 0 HE1 TRP A 30 -6.730 -13.047 -4.005 1.00 62.43 H new ATOM 0 HE3 TRP A 30 -5.459 -8.411 -1.622 1.00 35.14 H new ATOM 0 HZ2 TRP A 30 -4.043 -12.907 -3.202 1.00 43.24 H new ATOM 0 HZ3 TRP A 30 -3.152 -9.181 -1.310 1.00 34.42 H new ATOM 0 HH2 TRP A 30 -2.450 -11.397 -2.096 1.00 11.22 H new ATOM 507 N ASP A 31 -10.704 -7.743 -0.792 1.00 34.21 N ATOM 508 CA ASP A 31 -11.791 -6.763 -0.573 1.00 12.22 C ATOM 509 C ASP A 31 -11.522 -5.901 0.680 1.00 33.23 C ATOM 510 O ASP A 31 -11.775 -4.693 0.692 1.00 22.05 O ATOM 511 CB ASP A 31 -13.141 -7.507 -0.426 1.00 43.24 C ATOM 512 CG ASP A 31 -13.497 -8.355 -1.660 1.00 51.02 C ATOM 513 OD1 ASP A 31 -14.272 -7.882 -2.526 1.00 51.54 O ATOM 514 OD2 ASP A 31 -12.984 -9.491 -1.782 1.00 41.32 O ATOM 0 H ASP A 31 -11.031 -8.708 -0.834 1.00 34.21 H new ATOM 0 HA ASP A 31 -11.833 -6.098 -1.436 1.00 12.22 H new ATOM 0 HB2 ASP A 31 -13.101 -8.152 0.452 1.00 43.24 H new ATOM 0 HB3 ASP A 31 -13.934 -6.779 -0.251 1.00 43.24 H new ATOM 519 N LEU A 32 -10.968 -6.550 1.718 1.00 45.21 N ATOM 520 CA LEU A 32 -10.628 -5.899 2.995 1.00 14.33 C ATOM 521 C LEU A 32 -9.286 -5.145 2.891 1.00 22.23 C ATOM 522 O LEU A 32 -9.105 -4.107 3.532 1.00 30.41 O ATOM 523 CB LEU A 32 -10.604 -6.951 4.128 1.00 3.05 C ATOM 524 CG LEU A 32 -11.921 -7.763 4.332 1.00 43.31 C ATOM 525 CD1 LEU A 32 -11.777 -8.764 5.496 1.00 14.03 C ATOM 526 CD2 LEU A 32 -13.141 -6.830 4.535 1.00 3.41 C ATOM 0 H LEU A 32 -10.743 -7.544 1.695 1.00 45.21 H new ATOM 0 HA LEU A 32 -11.393 -5.159 3.230 1.00 14.33 H new ATOM 0 HB2 LEU A 32 -9.794 -7.653 3.929 1.00 3.05 H new ATOM 0 HB3 LEU A 32 -10.364 -6.445 5.063 1.00 3.05 H new ATOM 0 HG LEU A 32 -12.102 -8.334 3.421 1.00 43.31 H new ATOM 0 HD11 LEU A 32 -12.708 -9.317 5.617 1.00 14.03 H new ATOM 0 HD12 LEU A 32 -10.967 -9.460 5.279 1.00 14.03 H new ATOM 0 HD13 LEU A 32 -11.554 -8.223 6.416 1.00 14.03 H new ATOM 0 HD21 LEU A 32 -14.040 -7.431 4.674 1.00 3.41 H new ATOM 0 HD22 LEU A 32 -12.981 -6.208 5.416 1.00 3.41 H new ATOM 0 HD23 LEU A 32 -13.262 -6.193 3.658 1.00 3.41 H new ATOM 538 N LEU A 33 -8.354 -5.684 2.071 1.00 50.14 N ATOM 539 CA LEU A 33 -7.081 -5.007 1.719 1.00 0.45 C ATOM 540 C LEU A 33 -7.367 -3.662 1.008 1.00 14.01 C ATOM 541 O LEU A 33 -6.686 -2.663 1.246 1.00 63.33 O ATOM 542 CB LEU A 33 -6.219 -5.925 0.794 1.00 32.42 C ATOM 543 CG LEU A 33 -4.887 -5.308 0.229 1.00 74.54 C ATOM 544 CD1 LEU A 33 -3.836 -5.107 1.332 1.00 73.20 C ATOM 545 CD2 LEU A 33 -4.314 -6.144 -0.927 1.00 53.35 C ATOM 0 H LEU A 33 -8.462 -6.600 1.634 1.00 50.14 H new ATOM 0 HA LEU A 33 -6.528 -4.810 2.637 1.00 0.45 H new ATOM 0 HB2 LEU A 33 -5.967 -6.828 1.350 1.00 32.42 H new ATOM 0 HB3 LEU A 33 -6.836 -6.233 -0.050 1.00 32.42 H new ATOM 0 HG LEU A 33 -5.143 -4.325 -0.168 1.00 74.54 H new ATOM 0 HD11 LEU A 33 -2.932 -4.679 0.899 1.00 73.20 H new ATOM 0 HD12 LEU A 33 -4.230 -4.431 2.091 1.00 73.20 H new ATOM 0 HD13 LEU A 33 -3.600 -6.068 1.789 1.00 73.20 H new ATOM 0 HD21 LEU A 33 -3.395 -5.683 -1.288 1.00 53.35 H new ATOM 0 HD22 LEU A 33 -4.100 -7.153 -0.575 1.00 53.35 H new ATOM 0 HD23 LEU A 33 -5.040 -6.189 -1.738 1.00 53.35 H new ATOM 557 N LEU A 34 -8.415 -3.666 0.159 1.00 61.24 N ATOM 558 CA LEU A 34 -8.849 -2.504 -0.646 1.00 62.30 C ATOM 559 C LEU A 34 -9.633 -1.508 0.212 1.00 64.33 C ATOM 560 O LEU A 34 -9.587 -0.292 -0.027 1.00 32.35 O ATOM 561 CB LEU A 34 -9.716 -2.996 -1.831 1.00 15.41 C ATOM 562 CG LEU A 34 -8.982 -3.925 -2.841 1.00 72.32 C ATOM 563 CD1 LEU A 34 -9.955 -4.544 -3.861 1.00 62.42 C ATOM 564 CD2 LEU A 34 -7.823 -3.183 -3.521 1.00 12.34 C ATOM 0 H LEU A 34 -8.995 -4.492 0.010 1.00 61.24 H new ATOM 0 HA LEU A 34 -7.967 -1.991 -1.031 1.00 62.30 H new ATOM 0 HB2 LEU A 34 -10.580 -3.528 -1.433 1.00 15.41 H new ATOM 0 HB3 LEU A 34 -10.096 -2.127 -2.369 1.00 15.41 H new ATOM 0 HG LEU A 34 -8.554 -4.757 -2.281 1.00 72.32 H new ATOM 0 HD11 LEU A 34 -9.403 -5.186 -4.548 1.00 62.42 H new ATOM 0 HD12 LEU A 34 -10.705 -5.135 -3.336 1.00 62.42 H new ATOM 0 HD13 LEU A 34 -10.447 -3.750 -4.423 1.00 62.42 H new ATOM 0 HD21 LEU A 34 -7.325 -3.852 -4.223 1.00 12.34 H new ATOM 0 HD22 LEU A 34 -8.210 -2.317 -4.058 1.00 12.34 H new ATOM 0 HD23 LEU A 34 -7.110 -2.852 -2.766 1.00 12.34 H new ATOM 576 N GLN A 35 -10.359 -2.048 1.205 1.00 1.44 N ATOM 577 CA GLN A 35 -11.058 -1.245 2.216 1.00 21.20 C ATOM 578 C GLN A 35 -10.040 -0.395 2.993 1.00 44.10 C ATOM 579 O GLN A 35 -10.251 0.797 3.226 1.00 24.21 O ATOM 580 CB GLN A 35 -11.847 -2.170 3.190 1.00 42.30 C ATOM 581 CG GLN A 35 -12.662 -1.432 4.279 1.00 63.55 C ATOM 582 CD GLN A 35 -13.748 -0.487 3.737 1.00 5.14 C ATOM 583 OE1 GLN A 35 -14.068 0.525 4.356 1.00 20.50 O ATOM 584 NE2 GLN A 35 -14.337 -0.803 2.590 1.00 60.31 N ATOM 0 H GLN A 35 -10.476 -3.054 1.327 1.00 1.44 H new ATOM 0 HA GLN A 35 -11.768 -0.584 1.719 1.00 21.20 H new ATOM 0 HB2 GLN A 35 -12.527 -2.790 2.606 1.00 42.30 H new ATOM 0 HB3 GLN A 35 -11.142 -2.843 3.679 1.00 42.30 H new ATOM 0 HG2 GLN A 35 -13.133 -2.172 4.926 1.00 63.55 H new ATOM 0 HG3 GLN A 35 -11.976 -0.857 4.900 1.00 63.55 H new ATOM 0 HE21 GLN A 35 -14.059 -1.647 2.089 1.00 60.31 H new ATOM 0 HE22 GLN A 35 -15.068 -0.202 2.209 1.00 60.31 H new ATOM 593 N GLN A 36 -8.920 -1.032 3.364 1.00 75.04 N ATOM 594 CA GLN A 36 -7.860 -0.393 4.144 1.00 35.21 C ATOM 595 C GLN A 36 -6.814 0.297 3.259 1.00 43.05 C ATOM 596 O GLN A 36 -5.989 1.030 3.781 1.00 21.30 O ATOM 597 CB GLN A 36 -7.214 -1.423 5.104 1.00 43.15 C ATOM 598 CG GLN A 36 -8.221 -2.069 6.078 1.00 72.10 C ATOM 599 CD GLN A 36 -9.025 -1.046 6.901 1.00 11.25 C ATOM 600 OE1 GLN A 36 -8.533 0.021 7.260 1.00 41.25 O ATOM 601 NE2 GLN A 36 -10.279 -1.348 7.169 1.00 24.40 N ATOM 0 H GLN A 36 -8.727 -2.006 3.129 1.00 75.04 H new ATOM 0 HA GLN A 36 -8.315 0.399 4.740 1.00 35.21 H new ATOM 0 HB2 GLN A 36 -6.735 -2.206 4.516 1.00 43.15 H new ATOM 0 HB3 GLN A 36 -6.429 -0.931 5.678 1.00 43.15 H new ATOM 0 HG2 GLN A 36 -8.913 -2.692 5.512 1.00 72.10 H new ATOM 0 HG3 GLN A 36 -7.683 -2.729 6.759 1.00 72.10 H new ATOM 0 HE21 GLN A 36 -10.666 -2.240 6.861 1.00 24.40 H new ATOM 0 HE22 GLN A 36 -10.863 -0.690 7.685 1.00 24.40 H new ATOM 610 N GLU A 37 -6.858 0.062 1.929 1.00 32.03 N ATOM 611 CA GLU A 37 -5.998 0.773 0.951 1.00 22.13 C ATOM 612 C GLU A 37 -6.221 2.292 1.055 1.00 54.34 C ATOM 613 O GLU A 37 -5.278 3.063 1.296 1.00 75.43 O ATOM 614 CB GLU A 37 -6.304 0.305 -0.506 1.00 35.50 C ATOM 615 CG GLU A 37 -5.611 1.145 -1.616 1.00 33.32 C ATOM 616 CD GLU A 37 -6.016 0.811 -3.064 1.00 1.13 C ATOM 617 OE1 GLU A 37 -6.980 0.043 -3.283 1.00 74.14 O ATOM 618 OE2 GLU A 37 -5.387 1.364 -4.000 1.00 60.24 O ATOM 0 H GLU A 37 -7.485 -0.620 1.503 1.00 32.03 H new ATOM 0 HA GLU A 37 -4.959 0.538 1.184 1.00 22.13 H new ATOM 0 HB2 GLU A 37 -5.997 -0.735 -0.611 1.00 35.50 H new ATOM 0 HB3 GLU A 37 -7.382 0.337 -0.665 1.00 35.50 H new ATOM 0 HG2 GLU A 37 -5.824 2.198 -1.434 1.00 33.32 H new ATOM 0 HG3 GLU A 37 -4.533 1.017 -1.522 1.00 33.32 H new ATOM 625 N VAL A 38 -7.500 2.688 0.902 1.00 13.13 N ATOM 626 CA VAL A 38 -7.910 4.096 0.854 1.00 22.13 C ATOM 627 C VAL A 38 -7.566 4.831 2.163 1.00 41.43 C ATOM 628 O VAL A 38 -7.047 5.941 2.125 1.00 41.12 O ATOM 629 CB VAL A 38 -9.446 4.254 0.512 1.00 51.22 C ATOM 630 CG1 VAL A 38 -9.752 3.700 -0.901 1.00 12.43 C ATOM 631 CG2 VAL A 38 -10.357 3.589 1.571 1.00 12.41 C ATOM 0 H VAL A 38 -8.277 2.034 0.808 1.00 13.13 H new ATOM 0 HA VAL A 38 -7.343 4.559 0.047 1.00 22.13 H new ATOM 0 HB VAL A 38 -9.668 5.321 0.526 1.00 51.22 H new ATOM 0 HG11 VAL A 38 -10.814 3.818 -1.116 1.00 12.43 H new ATOM 0 HG12 VAL A 38 -9.169 4.248 -1.641 1.00 12.43 H new ATOM 0 HG13 VAL A 38 -9.489 2.643 -0.942 1.00 12.43 H new ATOM 0 HG21 VAL A 38 -11.401 3.726 1.290 1.00 12.41 H new ATOM 0 HG22 VAL A 38 -10.133 2.524 1.627 1.00 12.41 H new ATOM 0 HG23 VAL A 38 -10.180 4.048 2.543 1.00 12.41 H new ATOM 641 N SER A 39 -7.793 4.157 3.307 1.00 45.01 N ATOM 642 CA SER A 39 -7.601 4.735 4.649 1.00 65.40 C ATOM 643 C SER A 39 -6.104 4.893 4.975 1.00 12.23 C ATOM 644 O SER A 39 -5.680 5.931 5.494 1.00 74.25 O ATOM 645 CB SER A 39 -8.302 3.835 5.695 1.00 43.11 C ATOM 646 OG SER A 39 -7.837 2.498 5.617 1.00 22.43 O ATOM 0 H SER A 39 -8.117 3.190 3.325 1.00 45.01 H new ATOM 0 HA SER A 39 -8.045 5.730 4.675 1.00 65.40 H new ATOM 0 HB2 SER A 39 -8.121 4.228 6.696 1.00 43.11 H new ATOM 0 HB3 SER A 39 -9.380 3.858 5.534 1.00 43.11 H new ATOM 0 HG SER A 39 -8.276 1.958 6.307 1.00 22.43 H new ATOM 652 N TYR A 40 -5.327 3.851 4.640 1.00 13.14 N ATOM 653 CA TYR A 40 -3.881 3.766 4.918 1.00 21.10 C ATOM 654 C TYR A 40 -3.094 4.825 4.148 1.00 45.11 C ATOM 655 O TYR A 40 -2.358 5.629 4.747 1.00 51.24 O ATOM 656 CB TYR A 40 -3.386 2.346 4.554 1.00 41.24 C ATOM 657 CG TYR A 40 -1.880 2.110 4.672 1.00 41.14 C ATOM 658 CD1 TYR A 40 -1.196 2.403 5.850 1.00 64.32 C ATOM 659 CD2 TYR A 40 -1.150 1.568 3.608 1.00 52.24 C ATOM 660 CE1 TYR A 40 0.152 2.169 5.960 1.00 62.12 C ATOM 661 CE2 TYR A 40 0.202 1.335 3.720 1.00 73.13 C ATOM 662 CZ TYR A 40 0.845 1.636 4.897 1.00 3.14 C ATOM 663 OH TYR A 40 2.192 1.391 5.023 1.00 70.13 O ATOM 0 H TYR A 40 -5.691 3.028 4.160 1.00 13.14 H new ATOM 0 HA TYR A 40 -3.715 3.957 5.978 1.00 21.10 H new ATOM 0 HB2 TYR A 40 -3.897 1.629 5.196 1.00 41.24 H new ATOM 0 HB3 TYR A 40 -3.688 2.129 3.530 1.00 41.24 H new ATOM 0 HD1 TYR A 40 -1.734 2.820 6.688 1.00 64.32 H new ATOM 0 HD2 TYR A 40 -1.656 1.329 2.684 1.00 52.24 H new ATOM 0 HE1 TYR A 40 0.668 2.403 6.879 1.00 62.12 H new ATOM 0 HE2 TYR A 40 0.753 0.919 2.890 1.00 73.13 H new ATOM 0 HH TYR A 40 2.476 1.586 5.941 1.00 70.13 H new ATOM 673 N LEU A 41 -3.260 4.811 2.818 1.00 44.11 N ATOM 674 CA LEU A 41 -2.555 5.725 1.917 1.00 42.03 C ATOM 675 C LEU A 41 -2.974 7.180 2.191 1.00 74.11 C ATOM 676 O LEU A 41 -2.125 8.059 2.183 1.00 54.40 O ATOM 677 CB LEU A 41 -2.797 5.309 0.444 1.00 23.13 C ATOM 678 CG LEU A 41 -2.255 3.889 0.063 1.00 63.31 C ATOM 679 CD1 LEU A 41 -2.667 3.486 -1.371 1.00 2.34 C ATOM 680 CD2 LEU A 41 -0.719 3.808 0.253 1.00 73.23 C ATOM 0 H LEU A 41 -3.887 4.165 2.339 1.00 44.11 H new ATOM 0 HA LEU A 41 -1.483 5.663 2.102 1.00 42.03 H new ATOM 0 HB2 LEU A 41 -3.868 5.339 0.244 1.00 23.13 H new ATOM 0 HB3 LEU A 41 -2.331 6.047 -0.208 1.00 23.13 H new ATOM 0 HG LEU A 41 -2.713 3.171 0.743 1.00 63.31 H new ATOM 0 HD11 LEU A 41 -2.272 2.496 -1.598 1.00 2.34 H new ATOM 0 HD12 LEU A 41 -3.754 3.469 -1.446 1.00 2.34 H new ATOM 0 HD13 LEU A 41 -2.265 4.208 -2.082 1.00 2.34 H new ATOM 0 HD21 LEU A 41 -0.371 2.812 -0.019 1.00 73.23 H new ATOM 0 HD22 LEU A 41 -0.234 4.548 -0.384 1.00 73.23 H new ATOM 0 HD23 LEU A 41 -0.470 4.007 1.295 1.00 73.23 H new ATOM 692 N GLN A 42 -4.277 7.393 2.502 1.00 63.13 N ATOM 693 CA GLN A 42 -4.806 8.708 2.942 1.00 22.44 C ATOM 694 C GLN A 42 -4.038 9.247 4.164 1.00 52.23 C ATOM 695 O GLN A 42 -3.647 10.418 4.191 1.00 14.40 O ATOM 696 CB GLN A 42 -6.303 8.577 3.302 1.00 43.13 C ATOM 697 CG GLN A 42 -6.983 9.854 3.839 1.00 13.51 C ATOM 698 CD GLN A 42 -8.451 9.652 4.242 1.00 21.31 C ATOM 699 OE1 GLN A 42 -8.942 10.296 5.170 1.00 10.42 O ATOM 700 NE2 GLN A 42 -9.172 8.783 3.536 1.00 13.52 N ATOM 0 H GLN A 42 -4.987 6.662 2.455 1.00 63.13 H new ATOM 0 HA GLN A 42 -4.677 9.409 2.118 1.00 22.44 H new ATOM 0 HB2 GLN A 42 -6.843 8.248 2.414 1.00 43.13 H new ATOM 0 HB3 GLN A 42 -6.409 7.791 4.049 1.00 43.13 H new ATOM 0 HG2 GLN A 42 -6.425 10.215 4.703 1.00 13.51 H new ATOM 0 HG3 GLN A 42 -6.929 10.631 3.077 1.00 13.51 H new ATOM 0 HE21 GLN A 42 -8.740 8.263 2.772 1.00 13.52 H new ATOM 0 HE22 GLN A 42 -10.157 8.637 3.759 1.00 13.52 H new ATOM 709 N SER A 43 -3.826 8.362 5.164 1.00 64.11 N ATOM 710 CA SER A 43 -3.130 8.707 6.418 1.00 31.22 C ATOM 711 C SER A 43 -1.675 9.162 6.150 1.00 25.23 C ATOM 712 O SER A 43 -1.198 10.150 6.743 1.00 72.33 O ATOM 713 CB SER A 43 -3.147 7.507 7.389 1.00 43.31 C ATOM 714 OG SER A 43 -4.469 7.110 7.712 1.00 3.32 O ATOM 0 H SER A 43 -4.133 7.390 5.122 1.00 64.11 H new ATOM 0 HA SER A 43 -3.662 9.541 6.876 1.00 31.22 H new ATOM 0 HB2 SER A 43 -2.615 6.668 6.940 1.00 43.31 H new ATOM 0 HB3 SER A 43 -2.613 7.771 8.302 1.00 43.31 H new ATOM 0 HG SER A 43 -4.882 6.684 6.932 1.00 3.32 H new ATOM 720 N ILE A 44 -0.989 8.444 5.236 1.00 61.44 N ATOM 721 CA ILE A 44 0.390 8.782 4.828 1.00 53.44 C ATOM 722 C ILE A 44 0.410 10.126 4.066 1.00 40.34 C ATOM 723 O ILE A 44 1.279 10.968 4.287 1.00 22.12 O ATOM 724 CB ILE A 44 1.044 7.661 3.932 1.00 12.44 C ATOM 725 CG1 ILE A 44 0.967 6.269 4.637 1.00 32.31 C ATOM 726 CG2 ILE A 44 2.514 8.024 3.589 1.00 13.14 C ATOM 727 CD1 ILE A 44 1.482 5.102 3.806 1.00 3.51 C ATOM 0 H ILE A 44 -1.370 7.623 4.765 1.00 61.44 H new ATOM 0 HA ILE A 44 0.979 8.863 5.742 1.00 53.44 H new ATOM 0 HB ILE A 44 0.481 7.598 3.001 1.00 12.44 H new ATOM 0 HG12 ILE A 44 1.537 6.315 5.565 1.00 32.31 H new ATOM 0 HG13 ILE A 44 -0.070 6.073 4.910 1.00 32.31 H new ATOM 0 HG21 ILE A 44 2.948 7.238 2.970 1.00 13.14 H new ATOM 0 HG22 ILE A 44 2.538 8.969 3.046 1.00 13.14 H new ATOM 0 HG23 ILE A 44 3.089 8.120 4.510 1.00 13.14 H new ATOM 0 HD11 ILE A 44 1.388 4.179 4.378 1.00 3.51 H new ATOM 0 HD12 ILE A 44 0.897 5.022 2.890 1.00 3.51 H new ATOM 0 HD13 ILE A 44 2.529 5.269 3.555 1.00 3.51 H new ATOM 739 N GLU A 45 -0.587 10.322 3.193 1.00 23.25 N ATOM 740 CA GLU A 45 -0.706 11.529 2.355 1.00 44.14 C ATOM 741 C GLU A 45 -1.009 12.773 3.200 1.00 41.35 C ATOM 742 O GLU A 45 -0.579 13.864 2.846 1.00 23.14 O ATOM 743 CB GLU A 45 -1.801 11.334 1.268 1.00 21.52 C ATOM 744 CG GLU A 45 -1.444 10.285 0.197 1.00 44.31 C ATOM 745 CD GLU A 45 -2.579 10.025 -0.804 1.00 11.12 C ATOM 746 OE1 GLU A 45 -2.495 10.484 -1.967 1.00 55.33 O ATOM 747 OE2 GLU A 45 -3.567 9.356 -0.433 1.00 44.14 O ATOM 0 H GLU A 45 -1.338 9.647 3.045 1.00 23.25 H new ATOM 0 HA GLU A 45 0.254 11.685 1.863 1.00 44.14 H new ATOM 0 HB2 GLU A 45 -2.732 11.040 1.753 1.00 21.52 H new ATOM 0 HB3 GLU A 45 -1.986 12.290 0.778 1.00 21.52 H new ATOM 0 HG2 GLU A 45 -0.560 10.618 -0.346 1.00 44.31 H new ATOM 0 HG3 GLU A 45 -1.182 9.348 0.689 1.00 44.31 H new ATOM 754 N THR A 46 -1.748 12.602 4.318 1.00 31.20 N ATOM 755 CA THR A 46 -2.178 13.735 5.160 1.00 4.22 C ATOM 756 C THR A 46 -1.089 14.143 6.182 1.00 41.02 C ATOM 757 O THR A 46 -1.025 15.313 6.582 1.00 11.01 O ATOM 758 CB THR A 46 -3.567 13.471 5.846 1.00 11.30 C ATOM 759 OG1 THR A 46 -4.097 14.693 6.395 1.00 72.32 O ATOM 760 CG2 THR A 46 -3.490 12.411 6.951 1.00 11.41 C ATOM 0 H THR A 46 -2.058 11.691 4.656 1.00 31.20 H new ATOM 0 HA THR A 46 -2.318 14.586 4.494 1.00 4.22 H new ATOM 0 HB THR A 46 -4.229 13.091 5.068 1.00 11.30 H new ATOM 0 HG1 THR A 46 -4.015 15.411 5.734 1.00 72.32 H new ATOM 0 HG21 THR A 46 -4.478 12.270 7.389 1.00 11.41 H new ATOM 0 HG22 THR A 46 -3.143 11.469 6.528 1.00 11.41 H new ATOM 0 HG23 THR A 46 -2.794 12.740 7.723 1.00 11.41 H new ATOM 768 N VAL A 47 -0.219 13.195 6.608 1.00 75.25 N ATOM 769 CA VAL A 47 0.974 13.557 7.417 1.00 44.24 C ATOM 770 C VAL A 47 2.066 14.189 6.516 1.00 1.25 C ATOM 771 O VAL A 47 2.804 15.090 6.943 1.00 31.45 O ATOM 772 CB VAL A 47 1.569 12.339 8.239 1.00 32.43 C ATOM 773 CG1 VAL A 47 0.549 11.797 9.264 1.00 10.44 C ATOM 774 CG2 VAL A 47 2.079 11.205 7.324 1.00 63.13 C ATOM 0 H VAL A 47 -0.315 12.199 6.412 1.00 75.25 H new ATOM 0 HA VAL A 47 0.639 14.289 8.152 1.00 44.24 H new ATOM 0 HB VAL A 47 2.430 12.726 8.785 1.00 32.43 H new ATOM 0 HG11 VAL A 47 0.990 10.963 9.810 1.00 10.44 H new ATOM 0 HG12 VAL A 47 0.282 12.588 9.964 1.00 10.44 H new ATOM 0 HG13 VAL A 47 -0.345 11.457 8.742 1.00 10.44 H new ATOM 0 HG21 VAL A 47 2.476 10.395 7.936 1.00 63.13 H new ATOM 0 HG22 VAL A 47 1.256 10.830 6.716 1.00 63.13 H new ATOM 0 HG23 VAL A 47 2.865 11.588 6.674 1.00 63.13 H new ATOM 784 N MET A 48 2.132 13.722 5.248 1.00 21.14 N ATOM 785 CA MET A 48 3.175 14.124 4.277 1.00 41.24 C ATOM 786 C MET A 48 2.714 15.215 3.297 1.00 74.33 C ATOM 787 O MET A 48 3.488 15.613 2.427 1.00 32.43 O ATOM 788 CB MET A 48 3.701 12.887 3.508 1.00 62.34 C ATOM 789 CG MET A 48 4.519 11.924 4.378 1.00 1.02 C ATOM 790 SD MET A 48 5.917 12.754 5.166 1.00 4.34 S ATOM 791 CE MET A 48 6.862 11.370 5.793 1.00 31.21 C ATOM 0 H MET A 48 1.461 13.054 4.869 1.00 21.14 H new ATOM 0 HA MET A 48 3.985 14.563 4.860 1.00 41.24 H new ATOM 0 HB2 MET A 48 2.855 12.348 3.081 1.00 62.34 H new ATOM 0 HB3 MET A 48 4.318 13.223 2.675 1.00 62.34 H new ATOM 0 HG2 MET A 48 3.876 11.490 5.143 1.00 1.02 H new ATOM 0 HG3 MET A 48 4.884 11.101 3.764 1.00 1.02 H new ATOM 0 HE1 MET A 48 7.041 11.505 6.860 1.00 31.21 H new ATOM 0 HE2 MET A 48 6.305 10.447 5.633 1.00 31.21 H new ATOM 0 HE3 MET A 48 7.816 11.314 5.269 1.00 31.21 H new ATOM 801 N GLU A 49 1.462 15.686 3.404 1.00 42.13 N ATOM 802 CA GLU A 49 1.032 16.923 2.699 1.00 53.21 C ATOM 803 C GLU A 49 1.654 18.134 3.407 1.00 73.14 C ATOM 804 O GLU A 49 1.962 19.154 2.790 1.00 1.24 O ATOM 805 CB GLU A 49 -0.519 17.069 2.658 1.00 44.13 C ATOM 806 CG GLU A 49 -1.202 17.268 4.029 1.00 32.03 C ATOM 807 CD GLU A 49 -2.715 17.520 3.924 1.00 2.34 C ATOM 808 OE1 GLU A 49 -3.130 18.698 3.900 1.00 3.22 O ATOM 809 OE2 GLU A 49 -3.497 16.547 3.858 1.00 74.32 O ATOM 0 H GLU A 49 0.732 15.243 3.962 1.00 42.13 H new ATOM 0 HA GLU A 49 1.374 16.865 1.666 1.00 53.21 H new ATOM 0 HB2 GLU A 49 -0.771 17.916 2.019 1.00 44.13 H new ATOM 0 HB3 GLU A 49 -0.938 16.180 2.188 1.00 44.13 H new ATOM 0 HG2 GLU A 49 -1.030 16.385 4.645 1.00 32.03 H new ATOM 0 HG3 GLU A 49 -0.735 18.110 4.541 1.00 32.03 H new ATOM 816 N LYS A 50 1.834 17.969 4.724 1.00 71.34 N ATOM 817 CA LYS A 50 2.461 18.955 5.600 1.00 54.32 C ATOM 818 C LYS A 50 3.991 18.694 5.625 1.00 24.11 C ATOM 819 O LYS A 50 4.784 19.637 5.708 1.00 3.21 O ATOM 820 CB LYS A 50 1.831 18.841 7.037 1.00 12.51 C ATOM 821 CG LYS A 50 1.612 20.190 7.779 1.00 50.31 C ATOM 822 CD LYS A 50 2.896 21.018 7.957 1.00 52.43 C ATOM 823 CE LYS A 50 3.959 20.290 8.793 1.00 61.02 C ATOM 824 NZ LYS A 50 5.276 20.978 8.727 1.00 2.51 N ATOM 0 H LYS A 50 1.540 17.126 5.217 1.00 71.34 H new ATOM 0 HA LYS A 50 2.289 19.968 5.235 1.00 54.32 H new ATOM 0 HB2 LYS A 50 0.871 18.331 6.955 1.00 12.51 H new ATOM 0 HB3 LYS A 50 2.476 18.210 7.649 1.00 12.51 H new ATOM 0 HG2 LYS A 50 0.882 20.783 7.227 1.00 50.31 H new ATOM 0 HG3 LYS A 50 1.182 19.988 8.760 1.00 50.31 H new ATOM 0 HD2 LYS A 50 3.310 21.255 6.977 1.00 52.43 H new ATOM 0 HD3 LYS A 50 2.649 21.966 8.436 1.00 52.43 H new ATOM 0 HE2 LYS A 50 3.630 20.233 9.831 1.00 61.02 H new ATOM 0 HE3 LYS A 50 4.065 19.266 8.435 1.00 61.02 H new ATOM 0 HZ1 LYS A 50 6.029 20.314 9.000 1.00 2.51 H new ATOM 0 HZ2 LYS A 50 5.445 21.312 7.757 1.00 2.51 H new ATOM 0 HZ3 LYS A 50 5.277 21.789 9.378 1.00 2.51 H new ATOM 838 N GLN A 51 4.358 17.390 5.567 1.00 71.13 N ATOM 839 CA GLN A 51 5.756 16.897 5.563 1.00 54.54 C ATOM 840 C GLN A 51 6.421 17.118 6.943 1.00 72.24 C ATOM 841 O GLN A 51 7.419 17.841 7.048 1.00 11.43 O ATOM 842 CB GLN A 51 6.612 17.526 4.415 1.00 35.24 C ATOM 843 CG GLN A 51 5.991 17.431 3.009 1.00 35.33 C ATOM 844 CD GLN A 51 6.830 18.084 1.905 1.00 14.21 C ATOM 845 OE1 GLN A 51 7.594 19.023 2.150 1.00 21.12 O ATOM 846 NE2 GLN A 51 6.655 17.621 0.679 1.00 11.34 N ATOM 0 H GLN A 51 3.674 16.635 5.521 1.00 71.13 H new ATOM 0 HA GLN A 51 5.715 15.826 5.367 1.00 54.54 H new ATOM 0 HB2 GLN A 51 6.787 18.576 4.647 1.00 35.24 H new ATOM 0 HB3 GLN A 51 7.586 17.036 4.399 1.00 35.24 H new ATOM 0 HG2 GLN A 51 5.840 16.380 2.761 1.00 35.33 H new ATOM 0 HG3 GLN A 51 5.007 17.899 3.027 1.00 35.33 H new ATOM 0 HE21 GLN A 51 6.016 16.844 0.514 1.00 11.34 H new ATOM 0 HE22 GLN A 51 7.159 18.041 -0.102 1.00 11.34 H new ATOM 855 N THR A 52 5.806 16.512 7.986 1.00 2.31 N ATOM 856 CA THR A 52 6.320 16.496 9.381 1.00 15.12 C ATOM 857 C THR A 52 6.364 17.916 10.030 1.00 14.03 C ATOM 858 O THR A 52 7.102 18.792 9.568 1.00 52.03 O ATOM 859 CB THR A 52 7.732 15.807 9.475 1.00 42.12 C ATOM 860 OG1 THR A 52 7.644 14.475 8.936 1.00 70.31 O ATOM 861 CG2 THR A 52 8.261 15.739 10.925 1.00 32.43 C ATOM 0 H THR A 52 4.923 16.011 7.882 1.00 2.31 H new ATOM 0 HA THR A 52 5.606 15.902 9.951 1.00 15.12 H new ATOM 0 HB THR A 52 8.433 16.412 8.901 1.00 42.12 H new ATOM 0 HG1 THR A 52 8.410 14.309 8.348 1.00 70.31 H new ATOM 0 HG21 THR A 52 9.238 15.255 10.934 1.00 32.43 H new ATOM 0 HG22 THR A 52 8.353 16.748 11.327 1.00 32.43 H new ATOM 0 HG23 THR A 52 7.566 15.166 11.539 1.00 32.43 H new ATOM 869 N PRO A 53 5.538 18.185 11.095 1.00 42.01 N ATOM 870 CA PRO A 53 5.648 19.433 11.902 1.00 65.05 C ATOM 871 C PRO A 53 6.971 19.478 12.716 1.00 21.12 C ATOM 872 O PRO A 53 7.310 18.498 13.383 1.00 3.44 O ATOM 873 CB PRO A 53 4.402 19.366 12.829 1.00 73.42 C ATOM 874 CG PRO A 53 4.082 17.905 12.934 1.00 73.31 C ATOM 875 CD PRO A 53 4.420 17.322 11.580 1.00 23.13 C ATOM 0 HA PRO A 53 5.673 20.334 11.290 1.00 65.05 H new ATOM 0 HB2 PRO A 53 4.614 19.796 13.808 1.00 73.42 H new ATOM 0 HB3 PRO A 53 3.566 19.925 12.409 1.00 73.42 H new ATOM 0 HG2 PRO A 53 4.666 17.431 13.723 1.00 73.31 H new ATOM 0 HG3 PRO A 53 3.031 17.749 13.178 1.00 73.31 H new ATOM 0 HD2 PRO A 53 4.724 16.278 11.658 1.00 23.13 H new ATOM 0 HD3 PRO A 53 3.565 17.356 10.904 1.00 23.13 H new ATOM 883 N PRO A 54 7.767 20.591 12.643 1.00 51.53 N ATOM 884 CA PRO A 54 8.938 20.797 13.521 1.00 14.34 C ATOM 885 C PRO A 54 8.470 21.192 14.942 1.00 34.54 C ATOM 886 O PRO A 54 8.076 22.341 15.186 1.00 63.42 O ATOM 887 CB PRO A 54 9.749 21.932 12.815 1.00 64.11 C ATOM 888 CG PRO A 54 9.050 22.167 11.497 1.00 2.53 C ATOM 889 CD PRO A 54 7.619 21.724 11.700 1.00 11.35 C ATOM 0 HA PRO A 54 9.549 19.904 13.656 1.00 14.34 H new ATOM 0 HB2 PRO A 54 9.762 22.839 13.419 1.00 64.11 H new ATOM 0 HB3 PRO A 54 10.787 21.636 12.662 1.00 64.11 H new ATOM 0 HG2 PRO A 54 9.096 23.218 11.213 1.00 2.53 H new ATOM 0 HG3 PRO A 54 9.525 21.599 10.697 1.00 2.53 H new ATOM 0 HD2 PRO A 54 7.002 22.521 12.116 1.00 11.35 H new ATOM 0 HD3 PRO A 54 7.153 21.415 10.764 1.00 11.35 H new ATOM 897 N GLY A 55 8.452 20.202 15.839 1.00 54.05 N ATOM 898 CA GLY A 55 8.006 20.381 17.222 1.00 74.41 C ATOM 899 C GLY A 55 7.798 19.034 17.883 1.00 23.21 C ATOM 900 O GLY A 55 6.809 18.812 18.592 1.00 55.12 O ATOM 0 H GLY A 55 8.748 19.250 15.624 1.00 54.05 H new ATOM 0 HA2 GLY A 55 8.745 20.957 17.779 1.00 74.41 H new ATOM 0 HA3 GLY A 55 7.077 20.951 17.241 1.00 74.41 H new ATOM 904 N ILE A 56 8.742 18.122 17.622 1.00 23.54 N ATOM 905 CA ILE A 56 8.666 16.716 18.034 1.00 51.33 C ATOM 906 C ILE A 56 9.720 16.469 19.126 1.00 43.01 C ATOM 907 O ILE A 56 10.918 16.618 18.860 1.00 2.42 O ATOM 908 CB ILE A 56 8.937 15.760 16.796 1.00 23.44 C ATOM 909 CG1 ILE A 56 8.149 16.220 15.517 1.00 75.12 C ATOM 910 CG2 ILE A 56 8.603 14.293 17.139 1.00 64.32 C ATOM 911 CD1 ILE A 56 6.638 16.314 15.677 1.00 12.05 C ATOM 0 H ILE A 56 9.595 18.345 17.109 1.00 23.54 H new ATOM 0 HA ILE A 56 7.669 16.501 18.419 1.00 51.33 H new ATOM 0 HB ILE A 56 10.001 15.827 16.571 1.00 23.44 H new ATOM 0 HG12 ILE A 56 8.526 17.196 15.211 1.00 75.12 H new ATOM 0 HG13 ILE A 56 8.369 15.525 14.707 1.00 75.12 H new ATOM 0 HG21 ILE A 56 8.799 13.663 16.271 1.00 64.32 H new ATOM 0 HG22 ILE A 56 9.222 13.964 17.973 1.00 64.32 H new ATOM 0 HG23 ILE A 56 7.551 14.214 17.415 1.00 64.32 H new ATOM 0 HD11 ILE A 56 6.192 16.640 14.737 1.00 12.05 H new ATOM 0 HD12 ILE A 56 6.239 15.336 15.948 1.00 12.05 H new ATOM 0 HD13 ILE A 56 6.399 17.033 16.460 1.00 12.05 H new ATOM 923 N THR A 57 9.285 16.126 20.352 1.00 23.52 N ATOM 924 CA THR A 57 10.211 15.789 21.454 1.00 13.51 C ATOM 925 C THR A 57 10.793 14.373 21.261 1.00 54.11 C ATOM 926 O THR A 57 10.365 13.643 20.368 1.00 52.42 O ATOM 927 CB THR A 57 9.510 15.900 22.848 1.00 25.41 C ATOM 928 OG1 THR A 57 10.487 15.825 23.900 1.00 74.33 O ATOM 929 CG2 THR A 57 8.458 14.804 23.076 1.00 60.20 C ATOM 0 H THR A 57 8.299 16.074 20.607 1.00 23.52 H new ATOM 0 HA THR A 57 11.026 16.512 21.430 1.00 13.51 H new ATOM 0 HB THR A 57 9.000 16.863 22.861 1.00 25.41 H new ATOM 0 HG1 THR A 57 10.039 15.897 24.768 1.00 74.33 H new ATOM 0 HG21 THR A 57 8.006 14.933 24.059 1.00 60.20 H new ATOM 0 HG22 THR A 57 7.686 14.875 22.310 1.00 60.20 H new ATOM 0 HG23 THR A 57 8.934 13.825 23.021 1.00 60.20 H new ATOM 937 N ARG A 58 11.719 13.975 22.155 1.00 73.34 N ATOM 938 CA ARG A 58 12.436 12.684 22.071 1.00 71.12 C ATOM 939 C ARG A 58 11.487 11.483 22.269 1.00 35.13 C ATOM 940 O ARG A 58 11.717 10.424 21.699 1.00 20.23 O ATOM 941 CB ARG A 58 13.618 12.659 23.107 1.00 4.44 C ATOM 942 CG ARG A 58 13.278 13.173 24.542 1.00 31.01 C ATOM 943 CD ARG A 58 12.510 12.169 25.441 1.00 23.12 C ATOM 944 NE ARG A 58 11.923 12.814 26.631 1.00 44.13 N ATOM 945 CZ ARG A 58 11.079 12.222 27.500 1.00 35.12 C ATOM 946 NH1 ARG A 58 10.708 10.950 27.343 1.00 32.35 N ATOM 947 NH2 ARG A 58 10.598 12.919 28.519 1.00 63.44 N ATOM 0 H ARG A 58 11.993 14.540 22.959 1.00 73.34 H new ATOM 0 HA ARG A 58 12.850 12.590 21.067 1.00 71.12 H new ATOM 0 HB2 ARG A 58 13.985 11.636 23.186 1.00 4.44 H new ATOM 0 HB3 ARG A 58 14.436 13.261 22.711 1.00 4.44 H new ATOM 0 HG2 ARG A 58 14.207 13.446 25.042 1.00 31.01 H new ATOM 0 HG3 ARG A 58 12.685 14.083 24.453 1.00 31.01 H new ATOM 0 HD2 ARG A 58 11.718 11.697 24.859 1.00 23.12 H new ATOM 0 HD3 ARG A 58 13.188 11.377 25.758 1.00 23.12 H new ATOM 0 HE ARG A 58 12.176 13.786 26.811 1.00 44.13 H new ATOM 0 HH11 ARG A 58 11.064 10.408 26.555 1.00 32.35 H new ATOM 0 HH12 ARG A 58 10.069 10.519 28.011 1.00 32.35 H new ATOM 0 HH21 ARG A 58 10.867 13.895 28.641 1.00 63.44 H new ATOM 0 HH22 ARG A 58 9.959 12.479 29.181 1.00 63.44 H new ATOM 961 N SER A 59 10.410 11.681 23.059 1.00 35.44 N ATOM 962 CA SER A 59 9.431 10.619 23.374 1.00 53.52 C ATOM 963 C SER A 59 8.535 10.329 22.160 1.00 23.55 C ATOM 964 O SER A 59 8.296 9.172 21.814 1.00 13.00 O ATOM 965 CB SER A 59 8.586 11.028 24.601 1.00 42.22 C ATOM 966 OG SER A 59 7.676 10.008 24.976 1.00 41.15 O ATOM 0 H SER A 59 10.195 12.578 23.495 1.00 35.44 H new ATOM 0 HA SER A 59 9.970 9.703 23.615 1.00 53.52 H new ATOM 0 HB2 SER A 59 9.246 11.252 25.439 1.00 42.22 H new ATOM 0 HB3 SER A 59 8.036 11.941 24.375 1.00 42.22 H new ATOM 0 HG SER A 59 7.160 10.301 25.756 1.00 41.15 H new ATOM 972 N ILE A 60 8.074 11.410 21.507 1.00 30.35 N ATOM 973 CA ILE A 60 7.183 11.336 20.336 1.00 51.10 C ATOM 974 C ILE A 60 7.960 10.845 19.107 1.00 72.24 C ATOM 975 O ILE A 60 7.466 10.015 18.350 1.00 12.52 O ATOM 976 CB ILE A 60 6.516 12.732 20.058 1.00 32.05 C ATOM 977 CG1 ILE A 60 5.647 13.150 21.286 1.00 10.42 C ATOM 978 CG2 ILE A 60 5.679 12.720 18.750 1.00 2.02 C ATOM 979 CD1 ILE A 60 5.097 14.556 21.223 1.00 34.04 C ATOM 0 H ILE A 60 8.310 12.364 21.778 1.00 30.35 H new ATOM 0 HA ILE A 60 6.388 10.621 20.548 1.00 51.10 H new ATOM 0 HB ILE A 60 7.305 13.470 19.916 1.00 32.05 H new ATOM 0 HG12 ILE A 60 4.814 12.453 21.378 1.00 10.42 H new ATOM 0 HG13 ILE A 60 6.248 13.050 22.190 1.00 10.42 H new ATOM 0 HG21 ILE A 60 5.235 13.703 18.593 1.00 2.02 H new ATOM 0 HG22 ILE A 60 6.325 12.475 17.907 1.00 2.02 H new ATOM 0 HG23 ILE A 60 4.889 11.973 18.830 1.00 2.02 H new ATOM 0 HD11 ILE A 60 4.507 14.756 22.118 1.00 34.04 H new ATOM 0 HD12 ILE A 60 5.921 15.267 21.165 1.00 34.04 H new ATOM 0 HD13 ILE A 60 4.465 14.660 20.341 1.00 34.04 H new ATOM 991 N GLN A 61 9.191 11.363 18.959 1.00 24.13 N ATOM 992 CA GLN A 61 10.134 10.970 17.895 1.00 71.44 C ATOM 993 C GLN A 61 10.476 9.473 18.005 1.00 61.42 C ATOM 994 O GLN A 61 10.614 8.783 16.993 1.00 71.52 O ATOM 995 CB GLN A 61 11.407 11.844 18.012 1.00 14.55 C ATOM 996 CG GLN A 61 12.489 11.585 16.961 1.00 73.43 C ATOM 997 CD GLN A 61 13.687 12.520 17.126 1.00 20.12 C ATOM 998 OE1 GLN A 61 14.648 12.207 17.833 1.00 62.23 O ATOM 999 NE2 GLN A 61 13.633 13.676 16.484 1.00 60.35 N ATOM 0 H GLN A 61 9.566 12.077 19.584 1.00 24.13 H new ATOM 0 HA GLN A 61 9.678 11.129 16.918 1.00 71.44 H new ATOM 0 HB2 GLN A 61 11.113 12.892 17.953 1.00 14.55 H new ATOM 0 HB3 GLN A 61 11.842 11.690 19.000 1.00 14.55 H new ATOM 0 HG2 GLN A 61 12.824 10.550 17.034 1.00 73.43 H new ATOM 0 HG3 GLN A 61 12.064 11.713 15.965 1.00 73.43 H new ATOM 0 HE21 GLN A 61 12.822 13.902 15.908 1.00 60.35 H new ATOM 0 HE22 GLN A 61 14.402 14.341 16.565 1.00 60.35 H new ATOM 1008 N ASP A 62 10.587 8.994 19.261 1.00 2.31 N ATOM 1009 CA ASP A 62 10.813 7.574 19.577 1.00 13.12 C ATOM 1010 C ASP A 62 9.609 6.727 19.111 1.00 41.23 C ATOM 1011 O ASP A 62 9.781 5.741 18.383 1.00 14.32 O ATOM 1012 CB ASP A 62 11.041 7.407 21.103 1.00 75.44 C ATOM 1013 CG ASP A 62 11.469 5.987 21.520 1.00 21.50 C ATOM 1014 OD1 ASP A 62 10.605 5.089 21.619 1.00 22.34 O ATOM 1015 OD2 ASP A 62 12.677 5.763 21.767 1.00 21.14 O ATOM 0 H ASP A 62 10.521 9.588 20.088 1.00 2.31 H new ATOM 0 HA ASP A 62 11.701 7.226 19.050 1.00 13.12 H new ATOM 0 HB2 ASP A 62 11.804 8.115 21.426 1.00 75.44 H new ATOM 0 HB3 ASP A 62 10.122 7.668 21.628 1.00 75.44 H new ATOM 1020 N MET A 63 8.390 7.157 19.520 1.00 41.42 N ATOM 1021 CA MET A 63 7.131 6.438 19.218 1.00 51.53 C ATOM 1022 C MET A 63 6.928 6.298 17.707 1.00 51.12 C ATOM 1023 O MET A 63 6.800 5.182 17.192 1.00 31.24 O ATOM 1024 CB MET A 63 5.888 7.149 19.825 1.00 4.25 C ATOM 1025 CG MET A 63 5.827 7.191 21.350 1.00 64.41 C ATOM 1026 SD MET A 63 4.224 7.779 21.951 1.00 63.35 S ATOM 1027 CE MET A 63 4.035 9.352 21.093 1.00 21.03 C ATOM 0 H MET A 63 8.254 8.008 20.066 1.00 41.42 H new ATOM 0 HA MET A 63 7.226 5.452 19.673 1.00 51.53 H new ATOM 0 HB2 MET A 63 5.859 8.172 19.450 1.00 4.25 H new ATOM 0 HB3 MET A 63 4.991 6.650 19.458 1.00 4.25 H new ATOM 0 HG2 MET A 63 6.020 6.195 21.748 1.00 64.41 H new ATOM 0 HG3 MET A 63 6.616 7.842 21.726 1.00 64.41 H new ATOM 0 HE1 MET A 63 3.016 9.717 21.222 1.00 21.03 H new ATOM 0 HE2 MET A 63 4.735 10.078 21.506 1.00 21.03 H new ATOM 0 HE3 MET A 63 4.239 9.214 20.031 1.00 21.03 H new ATOM 1037 N VAL A 64 6.915 7.446 17.008 1.00 62.11 N ATOM 1038 CA VAL A 64 6.632 7.494 15.568 1.00 11.40 C ATOM 1039 C VAL A 64 7.748 6.848 14.743 1.00 2.11 C ATOM 1040 O VAL A 64 7.472 6.343 13.679 1.00 31.23 O ATOM 1041 CB VAL A 64 6.332 8.943 15.051 1.00 71.41 C ATOM 1042 CG1 VAL A 64 5.137 9.561 15.820 1.00 32.01 C ATOM 1043 CG2 VAL A 64 7.589 9.839 15.106 1.00 40.20 C ATOM 0 H VAL A 64 7.099 8.359 17.424 1.00 62.11 H new ATOM 0 HA VAL A 64 5.723 6.909 15.429 1.00 11.40 H new ATOM 0 HB VAL A 64 6.047 8.877 14.001 1.00 71.41 H new ATOM 0 HG11 VAL A 64 4.945 10.567 15.446 1.00 32.01 H new ATOM 0 HG12 VAL A 64 4.251 8.944 15.672 1.00 32.01 H new ATOM 0 HG13 VAL A 64 5.374 9.608 16.883 1.00 32.01 H new ATOM 0 HG21 VAL A 64 7.342 10.835 14.740 1.00 40.20 H new ATOM 0 HG22 VAL A 64 7.942 9.908 16.135 1.00 40.20 H new ATOM 0 HG23 VAL A 64 8.371 9.407 14.482 1.00 40.20 H new ATOM 1053 N ALA A 65 9.000 6.838 15.255 1.00 14.23 N ATOM 1054 CA ALA A 65 10.099 6.077 14.615 1.00 61.20 C ATOM 1055 C ALA A 65 9.779 4.575 14.648 1.00 23.04 C ATOM 1056 O ALA A 65 10.034 3.857 13.681 1.00 52.24 O ATOM 1057 CB ALA A 65 11.445 6.349 15.290 1.00 71.32 C ATOM 0 H ALA A 65 9.273 7.341 16.099 1.00 14.23 H new ATOM 0 HA ALA A 65 10.180 6.409 13.580 1.00 61.20 H new ATOM 0 HB1 ALA A 65 12.225 5.773 14.792 1.00 71.32 H new ATOM 0 HB2 ALA A 65 11.679 7.411 15.221 1.00 71.32 H new ATOM 0 HB3 ALA A 65 11.392 6.057 16.339 1.00 71.32 H new ATOM 1063 N GLY A 66 9.181 4.128 15.772 1.00 22.41 N ATOM 1064 CA GLY A 66 8.673 2.764 15.899 1.00 63.22 C ATOM 1065 C GLY A 66 7.533 2.481 14.927 1.00 15.23 C ATOM 1066 O GLY A 66 7.548 1.461 14.245 1.00 61.23 O ATOM 0 H GLY A 66 9.042 4.702 16.603 1.00 22.41 H new ATOM 0 HA2 GLY A 66 9.484 2.058 15.720 1.00 63.22 H new ATOM 0 HA3 GLY A 66 8.327 2.601 16.920 1.00 63.22 H new ATOM 1070 N TYR A 67 6.577 3.429 14.832 1.00 43.02 N ATOM 1071 CA TYR A 67 5.394 3.310 13.949 1.00 71.32 C ATOM 1072 C TYR A 67 5.783 3.297 12.453 1.00 72.30 C ATOM 1073 O TYR A 67 5.175 2.568 11.651 1.00 72.21 O ATOM 1074 CB TYR A 67 4.383 4.459 14.222 1.00 4.42 C ATOM 1075 CG TYR A 67 3.673 4.374 15.587 1.00 20.41 C ATOM 1076 CD1 TYR A 67 3.683 5.442 16.491 1.00 12.52 C ATOM 1077 CD2 TYR A 67 2.972 3.221 15.960 1.00 65.01 C ATOM 1078 CE1 TYR A 67 3.025 5.360 17.706 1.00 13.12 C ATOM 1079 CE2 TYR A 67 2.319 3.138 17.172 1.00 13.43 C ATOM 1080 CZ TYR A 67 2.346 4.205 18.039 1.00 34.03 C ATOM 1081 OH TYR A 67 1.674 4.121 19.239 1.00 13.03 O ATOM 0 H TYR A 67 6.602 4.299 15.364 1.00 43.02 H new ATOM 0 HA TYR A 67 4.923 2.355 14.180 1.00 71.32 H new ATOM 0 HB2 TYR A 67 4.909 5.412 14.159 1.00 4.42 H new ATOM 0 HB3 TYR A 67 3.630 4.458 13.434 1.00 4.42 H new ATOM 0 HD1 TYR A 67 4.214 6.347 16.236 1.00 12.52 H new ATOM 0 HD2 TYR A 67 2.942 2.379 15.285 1.00 65.01 H new ATOM 0 HE1 TYR A 67 3.043 6.195 18.390 1.00 13.12 H new ATOM 0 HE2 TYR A 67 1.787 2.237 17.440 1.00 13.43 H new ATOM 0 HH TYR A 67 1.249 3.241 19.315 1.00 13.03 H new ATOM 1091 N ILE A 68 6.803 4.101 12.090 1.00 71.12 N ATOM 1092 CA ILE A 68 7.311 4.172 10.708 1.00 15.44 C ATOM 1093 C ILE A 68 8.081 2.879 10.399 1.00 15.35 C ATOM 1094 O ILE A 68 7.926 2.313 9.333 1.00 50.22 O ATOM 1095 CB ILE A 68 8.237 5.432 10.434 1.00 60.32 C ATOM 1096 CG1 ILE A 68 7.474 6.765 10.696 1.00 21.54 C ATOM 1097 CG2 ILE A 68 8.779 5.417 8.979 1.00 33.23 C ATOM 1098 CD1 ILE A 68 8.322 8.032 10.607 1.00 33.43 C ATOM 0 H ILE A 68 7.293 4.714 12.742 1.00 71.12 H new ATOM 0 HA ILE A 68 6.449 4.284 10.051 1.00 15.44 H new ATOM 0 HB ILE A 68 9.077 5.371 11.126 1.00 60.32 H new ATOM 0 HG12 ILE A 68 6.657 6.844 9.979 1.00 21.54 H new ATOM 0 HG13 ILE A 68 7.024 6.718 11.688 1.00 21.54 H new ATOM 0 HG21 ILE A 68 9.410 6.291 8.817 1.00 33.23 H new ATOM 0 HG22 ILE A 68 9.364 4.512 8.818 1.00 33.23 H new ATOM 0 HG23 ILE A 68 7.944 5.438 8.279 1.00 33.23 H new ATOM 0 HD11 ILE A 68 7.697 8.903 10.805 1.00 33.43 H new ATOM 0 HD12 ILE A 68 9.124 7.986 11.344 1.00 33.43 H new ATOM 0 HD13 ILE A 68 8.751 8.113 9.608 1.00 33.43 H new ATOM 1110 N LYS A 69 8.873 2.403 11.377 1.00 1.24 N ATOM 1111 CA LYS A 69 9.647 1.147 11.258 1.00 30.54 C ATOM 1112 C LYS A 69 8.715 -0.055 10.976 1.00 33.24 C ATOM 1113 O LYS A 69 9.021 -0.913 10.124 1.00 11.23 O ATOM 1114 CB LYS A 69 10.470 0.916 12.553 1.00 61.41 C ATOM 1115 CG LYS A 69 11.329 -0.370 12.573 1.00 42.12 C ATOM 1116 CD LYS A 69 12.165 -0.519 13.870 1.00 71.12 C ATOM 1117 CE LYS A 69 11.309 -0.504 15.154 1.00 52.34 C ATOM 1118 NZ LYS A 69 10.297 -1.597 15.190 1.00 2.14 N ATOM 0 H LYS A 69 8.997 2.875 12.273 1.00 1.24 H new ATOM 0 HA LYS A 69 10.332 1.236 10.415 1.00 30.54 H new ATOM 0 HB2 LYS A 69 11.126 1.773 12.704 1.00 61.41 H new ATOM 0 HB3 LYS A 69 9.784 0.887 13.399 1.00 61.41 H new ATOM 0 HG2 LYS A 69 10.678 -1.237 12.465 1.00 42.12 H new ATOM 0 HG3 LYS A 69 11.999 -0.366 11.713 1.00 42.12 H new ATOM 0 HD2 LYS A 69 12.726 -1.452 13.827 1.00 71.12 H new ATOM 0 HD3 LYS A 69 12.894 0.290 13.919 1.00 71.12 H new ATOM 0 HE2 LYS A 69 11.963 -0.593 16.021 1.00 52.34 H new ATOM 0 HE3 LYS A 69 10.801 0.457 15.235 1.00 52.34 H new ATOM 0 HZ1 LYS A 69 9.753 -1.537 16.074 1.00 2.14 H new ATOM 0 HZ2 LYS A 69 9.653 -1.500 14.379 1.00 2.14 H new ATOM 0 HZ3 LYS A 69 10.778 -2.518 15.142 1.00 2.14 H new ATOM 1132 N GLN A 70 7.556 -0.074 11.678 1.00 32.23 N ATOM 1133 CA GLN A 70 6.508 -1.091 11.475 1.00 2.32 C ATOM 1134 C GLN A 70 5.953 -0.990 10.056 1.00 12.00 C ATOM 1135 O GLN A 70 5.941 -1.973 9.308 1.00 51.31 O ATOM 1136 CB GLN A 70 5.334 -0.923 12.478 1.00 70.21 C ATOM 1137 CG GLN A 70 5.688 -1.092 13.965 1.00 25.11 C ATOM 1138 CD GLN A 70 4.460 -1.078 14.885 1.00 5.44 C ATOM 1139 OE1 GLN A 70 4.524 -0.593 16.009 1.00 4.25 O ATOM 1140 NE2 GLN A 70 3.337 -1.643 14.430 1.00 75.43 N ATOM 0 H GLN A 70 7.327 0.613 12.396 1.00 32.23 H new ATOM 0 HA GLN A 70 6.969 -2.065 11.639 1.00 2.32 H new ATOM 0 HB2 GLN A 70 4.902 0.068 12.338 1.00 70.21 H new ATOM 0 HB3 GLN A 70 4.560 -1.647 12.225 1.00 70.21 H new ATOM 0 HG2 GLN A 70 6.224 -2.032 14.100 1.00 25.11 H new ATOM 0 HG3 GLN A 70 6.366 -0.293 14.263 1.00 25.11 H new ATOM 0 HE21 GLN A 70 3.310 -2.039 13.491 1.00 75.43 H new ATOM 0 HE22 GLN A 70 2.507 -1.678 15.022 1.00 75.43 H new ATOM 1149 N THR A 71 5.528 0.235 9.699 1.00 43.51 N ATOM 1150 CA THR A 71 4.812 0.490 8.454 1.00 55.14 C ATOM 1151 C THR A 71 5.723 0.256 7.233 1.00 61.34 C ATOM 1152 O THR A 71 5.240 -0.136 6.193 1.00 21.43 O ATOM 1153 CB THR A 71 4.158 1.922 8.440 1.00 64.13 C ATOM 1154 OG1 THR A 71 2.979 1.900 7.638 1.00 11.24 O ATOM 1155 CG2 THR A 71 5.082 3.040 7.915 1.00 21.31 C ATOM 0 H THR A 71 5.675 1.068 10.269 1.00 43.51 H new ATOM 0 HA THR A 71 3.993 -0.226 8.390 1.00 55.14 H new ATOM 0 HB THR A 71 3.939 2.155 9.482 1.00 64.13 H new ATOM 0 HG1 THR A 71 2.196 1.759 8.211 1.00 11.24 H new ATOM 0 HG21 THR A 71 4.552 3.992 7.940 1.00 21.31 H new ATOM 0 HG22 THR A 71 5.970 3.103 8.543 1.00 21.31 H new ATOM 0 HG23 THR A 71 5.378 2.816 6.890 1.00 21.31 H new ATOM 1163 N LEU A 72 7.052 0.445 7.408 1.00 44.52 N ATOM 1164 CA LEU A 72 8.059 0.193 6.358 1.00 30.33 C ATOM 1165 C LEU A 72 8.204 -1.304 6.099 1.00 14.13 C ATOM 1166 O LEU A 72 8.225 -1.733 4.947 1.00 74.12 O ATOM 1167 CB LEU A 72 9.451 0.774 6.747 1.00 72.13 C ATOM 1168 CG LEU A 72 9.573 2.320 6.738 1.00 1.11 C ATOM 1169 CD1 LEU A 72 10.939 2.766 7.302 1.00 52.44 C ATOM 1170 CD2 LEU A 72 9.325 2.878 5.322 1.00 3.41 C ATOM 0 H LEU A 72 7.454 0.777 8.285 1.00 44.52 H new ATOM 0 HA LEU A 72 7.709 0.692 5.455 1.00 30.33 H new ATOM 0 HB2 LEU A 72 9.705 0.416 7.745 1.00 72.13 H new ATOM 0 HB3 LEU A 72 10.196 0.367 6.063 1.00 72.13 H new ATOM 0 HG LEU A 72 8.803 2.733 7.390 1.00 1.11 H new ATOM 0 HD11 LEU A 72 11.002 3.854 7.286 1.00 52.44 H new ATOM 0 HD12 LEU A 72 11.042 2.412 8.328 1.00 52.44 H new ATOM 0 HD13 LEU A 72 11.739 2.347 6.691 1.00 52.44 H new ATOM 0 HD21 LEU A 72 9.415 3.964 5.338 1.00 3.41 H new ATOM 0 HD22 LEU A 72 10.061 2.463 4.633 1.00 3.41 H new ATOM 0 HD23 LEU A 72 8.323 2.602 4.992 1.00 3.41 H new ATOM 1182 N ASP A 73 8.353 -2.076 7.200 1.00 64.43 N ATOM 1183 CA ASP A 73 8.466 -3.545 7.150 1.00 41.21 C ATOM 1184 C ASP A 73 7.263 -4.145 6.415 1.00 62.23 C ATOM 1185 O ASP A 73 7.420 -4.842 5.415 1.00 70.31 O ATOM 1186 CB ASP A 73 8.569 -4.139 8.586 1.00 70.00 C ATOM 1187 CG ASP A 73 8.481 -5.682 8.603 1.00 64.45 C ATOM 1188 OD1 ASP A 73 7.408 -6.236 8.945 1.00 52.43 O ATOM 1189 OD2 ASP A 73 9.481 -6.346 8.255 1.00 51.55 O ATOM 0 H ASP A 73 8.398 -1.695 8.145 1.00 64.43 H new ATOM 0 HA ASP A 73 9.375 -3.800 6.606 1.00 41.21 H new ATOM 0 HB2 ASP A 73 9.512 -3.828 9.036 1.00 70.00 H new ATOM 0 HB3 ASP A 73 7.770 -3.727 9.203 1.00 70.00 H new ATOM 1194 N ASN A 74 6.066 -3.779 6.900 1.00 14.24 N ATOM 1195 CA ASN A 74 4.778 -4.318 6.429 1.00 33.24 C ATOM 1196 C ASN A 74 4.523 -3.943 4.960 1.00 13.23 C ATOM 1197 O ASN A 74 4.102 -4.782 4.164 1.00 15.33 O ATOM 1198 CB ASN A 74 3.635 -3.793 7.342 1.00 1.42 C ATOM 1199 CG ASN A 74 3.696 -4.289 8.808 1.00 43.35 C ATOM 1200 OD1 ASN A 74 2.682 -4.315 9.491 1.00 33.54 O ATOM 1201 ND2 ASN A 74 4.851 -4.755 9.294 1.00 44.20 N ATOM 0 H ASN A 74 5.963 -3.088 7.643 1.00 14.24 H new ATOM 0 HA ASN A 74 4.809 -5.406 6.485 1.00 33.24 H new ATOM 0 HB2 ASN A 74 3.659 -2.703 7.340 1.00 1.42 H new ATOM 0 HB3 ASN A 74 2.679 -4.091 6.912 1.00 1.42 H new ATOM 0 HD21 ASN A 74 4.890 -5.135 10.240 1.00 44.20 H new ATOM 0 HD22 ASN A 74 5.693 -4.730 8.719 1.00 44.20 H new ATOM 1208 N GLU A 75 4.833 -2.686 4.617 1.00 11.54 N ATOM 1209 CA GLU A 75 4.614 -2.119 3.268 1.00 60.45 C ATOM 1210 C GLU A 75 5.652 -2.646 2.258 1.00 11.44 C ATOM 1211 O GLU A 75 5.376 -2.729 1.054 1.00 74.21 O ATOM 1212 CB GLU A 75 4.626 -0.584 3.385 1.00 30.41 C ATOM 1213 CG GLU A 75 4.379 0.221 2.111 1.00 11.05 C ATOM 1214 CD GLU A 75 4.133 1.710 2.407 1.00 61.04 C ATOM 1215 OE1 GLU A 75 2.990 2.188 2.233 1.00 4.31 O ATOM 1216 OE2 GLU A 75 5.060 2.402 2.866 1.00 1.33 O ATOM 0 H GLU A 75 5.248 -2.022 5.271 1.00 11.54 H new ATOM 0 HA GLU A 75 3.646 -2.436 2.880 1.00 60.45 H new ATOM 0 HB2 GLU A 75 3.871 -0.296 4.117 1.00 30.41 H new ATOM 0 HB3 GLU A 75 5.593 -0.285 3.790 1.00 30.41 H new ATOM 0 HG2 GLU A 75 5.238 0.121 1.447 1.00 11.05 H new ATOM 0 HG3 GLU A 75 3.518 -0.190 1.584 1.00 11.05 H new ATOM 1223 N GLN A 76 6.832 -3.031 2.763 1.00 2.14 N ATOM 1224 CA GLN A 76 7.870 -3.717 1.967 1.00 24.34 C ATOM 1225 C GLN A 76 7.422 -5.158 1.659 1.00 14.22 C ATOM 1226 O GLN A 76 7.640 -5.669 0.558 1.00 73.11 O ATOM 1227 CB GLN A 76 9.209 -3.735 2.736 1.00 44.12 C ATOM 1228 CG GLN A 76 10.377 -4.431 2.003 1.00 33.55 C ATOM 1229 CD GLN A 76 11.624 -4.639 2.869 1.00 25.45 C ATOM 1230 OE1 GLN A 76 12.752 -4.599 2.377 1.00 25.04 O ATOM 1231 NE2 GLN A 76 11.435 -4.908 4.157 1.00 51.03 N ATOM 0 H GLN A 76 7.098 -2.877 3.736 1.00 2.14 H new ATOM 0 HA GLN A 76 8.012 -3.177 1.031 1.00 24.34 H new ATOM 0 HB2 GLN A 76 9.499 -2.707 2.954 1.00 44.12 H new ATOM 0 HB3 GLN A 76 9.054 -4.232 3.693 1.00 44.12 H new ATOM 0 HG2 GLN A 76 10.036 -5.400 1.637 1.00 33.55 H new ATOM 0 HG3 GLN A 76 10.649 -3.838 1.130 1.00 33.55 H new ATOM 0 HE21 GLN A 76 10.490 -4.935 4.539 1.00 51.03 H new ATOM 0 HE22 GLN A 76 12.235 -5.087 4.763 1.00 51.03 H new ATOM 1240 N LEU A 77 6.788 -5.802 2.657 1.00 71.55 N ATOM 1241 CA LEU A 77 6.225 -7.153 2.501 1.00 22.33 C ATOM 1242 C LEU A 77 5.043 -7.125 1.518 1.00 55.33 C ATOM 1243 O LEU A 77 4.843 -8.077 0.777 1.00 31.45 O ATOM 1244 CB LEU A 77 5.795 -7.739 3.872 1.00 62.21 C ATOM 1245 CG LEU A 77 6.923 -7.910 4.939 1.00 61.53 C ATOM 1246 CD1 LEU A 77 6.361 -8.488 6.256 1.00 11.22 C ATOM 1247 CD2 LEU A 77 8.098 -8.756 4.397 1.00 72.52 C ATOM 0 H LEU A 77 6.653 -5.403 3.586 1.00 71.55 H new ATOM 0 HA LEU A 77 6.998 -7.804 2.093 1.00 22.33 H new ATOM 0 HB2 LEU A 77 5.023 -7.095 4.292 1.00 62.21 H new ATOM 0 HB3 LEU A 77 5.338 -8.713 3.699 1.00 62.21 H new ATOM 0 HG LEU A 77 7.321 -6.919 5.159 1.00 61.53 H new ATOM 0 HD11 LEU A 77 7.169 -8.596 6.980 1.00 11.22 H new ATOM 0 HD12 LEU A 77 5.604 -7.814 6.655 1.00 11.22 H new ATOM 0 HD13 LEU A 77 5.913 -9.463 6.064 1.00 11.22 H new ATOM 0 HD21 LEU A 77 8.863 -8.853 5.168 1.00 72.52 H new ATOM 0 HD22 LEU A 77 7.736 -9.746 4.119 1.00 72.52 H new ATOM 0 HD23 LEU A 77 8.525 -8.267 3.522 1.00 72.52 H new ATOM 1259 N LEU A 78 4.280 -6.006 1.514 1.00 65.33 N ATOM 1260 CA LEU A 78 3.213 -5.756 0.520 1.00 72.05 C ATOM 1261 C LEU A 78 3.814 -5.650 -0.881 1.00 41.32 C ATOM 1262 O LEU A 78 3.290 -6.219 -1.823 1.00 4.40 O ATOM 1263 CB LEU A 78 2.448 -4.443 0.824 1.00 53.15 C ATOM 1264 CG LEU A 78 1.658 -4.392 2.156 1.00 20.45 C ATOM 1265 CD1 LEU A 78 1.150 -2.961 2.417 1.00 64.13 C ATOM 1266 CD2 LEU A 78 0.511 -5.430 2.169 1.00 54.11 C ATOM 0 H LEU A 78 4.387 -5.256 2.197 1.00 65.33 H new ATOM 0 HA LEU A 78 2.518 -6.594 0.575 1.00 72.05 H new ATOM 0 HB2 LEU A 78 3.166 -3.623 0.822 1.00 53.15 H new ATOM 0 HB3 LEU A 78 1.750 -4.258 0.007 1.00 53.15 H new ATOM 0 HG LEU A 78 2.329 -4.661 2.972 1.00 20.45 H new ATOM 0 HD11 LEU A 78 0.596 -2.937 3.356 1.00 64.13 H new ATOM 0 HD12 LEU A 78 1.998 -2.279 2.479 1.00 64.13 H new ATOM 0 HD13 LEU A 78 0.495 -2.653 1.602 1.00 64.13 H new ATOM 0 HD21 LEU A 78 -0.024 -5.369 3.117 1.00 54.11 H new ATOM 0 HD22 LEU A 78 -0.177 -5.222 1.350 1.00 54.11 H new ATOM 0 HD23 LEU A 78 0.925 -6.431 2.050 1.00 54.11 H new ATOM 1278 N LYS A 79 4.926 -4.904 -0.986 1.00 74.51 N ATOM 1279 CA LYS A 79 5.643 -4.695 -2.251 1.00 13.41 C ATOM 1280 C LYS A 79 5.989 -6.049 -2.909 1.00 62.41 C ATOM 1281 O LYS A 79 5.577 -6.305 -4.039 1.00 11.42 O ATOM 1282 CB LYS A 79 6.923 -3.858 -1.998 1.00 34.22 C ATOM 1283 CG LYS A 79 7.827 -3.658 -3.232 1.00 22.22 C ATOM 1284 CD LYS A 79 9.092 -2.834 -2.911 1.00 13.14 C ATOM 1285 CE LYS A 79 10.044 -2.732 -4.110 1.00 43.01 C ATOM 1286 NZ LYS A 79 9.400 -2.094 -5.291 1.00 0.34 N ATOM 0 H LYS A 79 5.353 -4.428 -0.192 1.00 74.51 H new ATOM 0 HA LYS A 79 4.999 -4.146 -2.937 1.00 13.41 H new ATOM 0 HB2 LYS A 79 6.630 -2.879 -1.619 1.00 34.22 H new ATOM 0 HB3 LYS A 79 7.506 -4.342 -1.214 1.00 34.22 H new ATOM 0 HG2 LYS A 79 8.121 -4.631 -3.624 1.00 22.22 H new ATOM 0 HG3 LYS A 79 7.260 -3.156 -4.016 1.00 22.22 H new ATOM 0 HD2 LYS A 79 8.800 -1.832 -2.597 1.00 13.14 H new ATOM 0 HD3 LYS A 79 9.617 -3.291 -2.072 1.00 13.14 H new ATOM 0 HE2 LYS A 79 10.924 -2.156 -3.824 1.00 43.01 H new ATOM 0 HE3 LYS A 79 10.390 -3.729 -4.382 1.00 43.01 H new ATOM 0 HZ1 LYS A 79 10.082 -2.047 -6.075 1.00 0.34 H new ATOM 0 HZ2 LYS A 79 8.575 -2.656 -5.582 1.00 0.34 H new ATOM 0 HZ3 LYS A 79 9.093 -1.132 -5.042 1.00 0.34 H new ATOM 1300 N GLY A 80 6.678 -6.924 -2.145 1.00 31.40 N ATOM 1301 CA GLY A 80 7.108 -8.238 -2.636 1.00 65.23 C ATOM 1302 C GLY A 80 5.951 -9.203 -2.902 1.00 34.22 C ATOM 1303 O GLY A 80 5.871 -9.802 -3.984 1.00 73.41 O ATOM 0 H GLY A 80 6.947 -6.736 -1.179 1.00 31.40 H new ATOM 0 HA2 GLY A 80 7.677 -8.104 -3.556 1.00 65.23 H new ATOM 0 HA3 GLY A 80 7.783 -8.686 -1.906 1.00 65.23 H new ATOM 1307 N LEU A 81 5.045 -9.319 -1.911 1.00 22.41 N ATOM 1308 CA LEU A 81 3.907 -10.267 -1.936 1.00 40.32 C ATOM 1309 C LEU A 81 2.958 -9.916 -3.093 1.00 34.22 C ATOM 1310 O LEU A 81 2.670 -10.765 -3.946 1.00 41.20 O ATOM 1311 CB LEU A 81 3.188 -10.251 -0.544 1.00 35.41 C ATOM 1312 CG LEU A 81 2.148 -11.391 -0.206 1.00 70.31 C ATOM 1313 CD1 LEU A 81 1.889 -11.459 1.319 1.00 70.10 C ATOM 1314 CD2 LEU A 81 0.794 -11.218 -0.944 1.00 50.12 C ATOM 0 H LEU A 81 5.080 -8.754 -1.063 1.00 22.41 H new ATOM 0 HA LEU A 81 4.263 -11.282 -2.112 1.00 40.32 H new ATOM 0 HB2 LEU A 81 3.960 -10.271 0.225 1.00 35.41 H new ATOM 0 HB3 LEU A 81 2.671 -9.296 -0.452 1.00 35.41 H new ATOM 0 HG LEU A 81 2.598 -12.321 -0.554 1.00 70.31 H new ATOM 0 HD11 LEU A 81 1.170 -12.250 1.531 1.00 70.10 H new ATOM 0 HD12 LEU A 81 2.824 -11.670 1.838 1.00 70.10 H new ATOM 0 HD13 LEU A 81 1.490 -10.505 1.663 1.00 70.10 H new ATOM 0 HD21 LEU A 81 0.123 -12.032 -0.670 1.00 50.12 H new ATOM 0 HD22 LEU A 81 0.344 -10.266 -0.661 1.00 50.12 H new ATOM 0 HD23 LEU A 81 0.962 -11.233 -2.021 1.00 50.12 H new ATOM 1326 N LEU A 82 2.497 -8.651 -3.125 1.00 34.04 N ATOM 1327 CA LEU A 82 1.562 -8.163 -4.154 1.00 31.33 C ATOM 1328 C LEU A 82 2.231 -8.115 -5.542 1.00 24.04 C ATOM 1329 O LEU A 82 1.537 -8.187 -6.540 1.00 4.24 O ATOM 1330 CB LEU A 82 0.961 -6.772 -3.777 1.00 33.20 C ATOM 1331 CG LEU A 82 0.213 -6.690 -2.401 1.00 1.51 C ATOM 1332 CD1 LEU A 82 -0.346 -5.269 -2.143 1.00 22.32 C ATOM 1333 CD2 LEU A 82 -0.892 -7.761 -2.291 1.00 22.20 C ATOM 0 H LEU A 82 2.762 -7.942 -2.441 1.00 34.04 H new ATOM 0 HA LEU A 82 0.738 -8.875 -4.201 1.00 31.33 H new ATOM 0 HB2 LEU A 82 1.769 -6.040 -3.772 1.00 33.20 H new ATOM 0 HB3 LEU A 82 0.266 -6.475 -4.563 1.00 33.20 H new ATOM 0 HG LEU A 82 0.945 -6.899 -1.621 1.00 1.51 H new ATOM 0 HD11 LEU A 82 -0.858 -5.249 -1.181 1.00 22.32 H new ATOM 0 HD12 LEU A 82 0.475 -4.552 -2.133 1.00 22.32 H new ATOM 0 HD13 LEU A 82 -1.049 -5.005 -2.934 1.00 22.32 H new ATOM 0 HD21 LEU A 82 -1.388 -7.674 -1.325 1.00 22.20 H new ATOM 0 HD22 LEU A 82 -1.621 -7.615 -3.088 1.00 22.20 H new ATOM 0 HD23 LEU A 82 -0.448 -8.752 -2.383 1.00 22.20 H new ATOM 1345 N GLN A 83 3.578 -7.989 -5.601 1.00 3.21 N ATOM 1346 CA GLN A 83 4.328 -8.063 -6.886 1.00 31.15 C ATOM 1347 C GLN A 83 4.197 -9.452 -7.513 1.00 2.44 C ATOM 1348 O GLN A 83 3.973 -9.575 -8.722 1.00 51.42 O ATOM 1349 CB GLN A 83 5.814 -7.702 -6.677 1.00 61.14 C ATOM 1350 CG GLN A 83 6.706 -7.781 -7.934 1.00 35.23 C ATOM 1351 CD GLN A 83 8.157 -7.357 -7.688 1.00 50.25 C ATOM 1352 OE1 GLN A 83 8.817 -6.828 -8.582 1.00 10.12 O ATOM 1353 NE2 GLN A 83 8.677 -7.609 -6.487 1.00 13.14 N ATOM 0 H GLN A 83 4.167 -7.837 -4.783 1.00 3.21 H new ATOM 0 HA GLN A 83 3.893 -7.335 -7.571 1.00 31.15 H new ATOM 0 HB2 GLN A 83 5.870 -6.689 -6.278 1.00 61.14 H new ATOM 0 HB3 GLN A 83 6.227 -8.367 -5.919 1.00 61.14 H new ATOM 0 HG2 GLN A 83 6.695 -8.803 -8.313 1.00 35.23 H new ATOM 0 HG3 GLN A 83 6.279 -7.148 -8.712 1.00 35.23 H new ATOM 0 HE21 GLN A 83 8.105 -8.049 -5.766 1.00 13.14 H new ATOM 0 HE22 GLN A 83 9.647 -7.362 -6.289 1.00 13.14 H new ATOM 1362 N GLN A 84 4.323 -10.490 -6.663 1.00 75.22 N ATOM 1363 CA GLN A 84 4.106 -11.891 -7.064 1.00 13.44 C ATOM 1364 C GLN A 84 2.670 -12.059 -7.591 1.00 13.45 C ATOM 1365 O GLN A 84 2.465 -12.576 -8.692 1.00 25.34 O ATOM 1366 CB GLN A 84 4.354 -12.841 -5.866 1.00 12.32 C ATOM 1367 CG GLN A 84 5.781 -12.781 -5.279 1.00 42.34 C ATOM 1368 CD GLN A 84 5.971 -13.584 -3.982 1.00 0.11 C ATOM 1369 OE1 GLN A 84 6.771 -13.211 -3.124 1.00 3.44 O ATOM 1370 NE2 GLN A 84 5.258 -14.695 -3.824 1.00 44.35 N ATOM 0 H GLN A 84 4.578 -10.380 -5.681 1.00 75.22 H new ATOM 0 HA GLN A 84 4.810 -12.148 -7.855 1.00 13.44 H new ATOM 0 HB2 GLN A 84 3.641 -12.602 -5.077 1.00 12.32 H new ATOM 0 HB3 GLN A 84 4.149 -13.864 -6.182 1.00 12.32 H new ATOM 0 HG2 GLN A 84 6.483 -13.150 -6.026 1.00 42.34 H new ATOM 0 HG3 GLN A 84 6.038 -11.739 -5.087 1.00 42.34 H new ATOM 0 HE21 GLN A 84 4.600 -14.986 -4.547 1.00 44.35 H new ATOM 0 HE22 GLN A 84 5.368 -15.256 -2.979 1.00 44.35 H new ATOM 1379 N ARG A 85 1.702 -11.544 -6.800 1.00 73.31 N ATOM 1380 CA ARG A 85 0.259 -11.622 -7.100 1.00 3.43 C ATOM 1381 C ARG A 85 -0.075 -10.985 -8.457 1.00 63.00 C ATOM 1382 O ARG A 85 -0.713 -11.608 -9.287 1.00 64.12 O ATOM 1383 CB ARG A 85 -0.552 -10.926 -5.979 1.00 21.53 C ATOM 1384 CG ARG A 85 -0.356 -11.512 -4.564 1.00 52.20 C ATOM 1385 CD ARG A 85 -1.141 -12.808 -4.291 1.00 52.23 C ATOM 1386 NE ARG A 85 -0.677 -14.002 -5.032 1.00 53.34 N ATOM 1387 CZ ARG A 85 -0.932 -15.274 -4.652 1.00 34.53 C ATOM 1388 NH1 ARG A 85 -1.630 -15.528 -3.546 1.00 2.11 N ATOM 1389 NH2 ARG A 85 -0.518 -16.288 -5.400 1.00 52.34 N ATOM 0 H ARG A 85 1.905 -11.058 -5.927 1.00 73.31 H new ATOM 0 HA ARG A 85 -0.013 -12.676 -7.150 1.00 3.43 H new ATOM 0 HB2 ARG A 85 -0.281 -9.870 -5.958 1.00 21.53 H new ATOM 0 HB3 ARG A 85 -1.611 -10.978 -6.233 1.00 21.53 H new ATOM 0 HG2 ARG A 85 0.705 -11.707 -4.410 1.00 52.20 H new ATOM 0 HG3 ARG A 85 -0.652 -10.762 -3.831 1.00 52.20 H new ATOM 0 HD2 ARG A 85 -1.093 -13.023 -3.224 1.00 52.23 H new ATOM 0 HD3 ARG A 85 -2.189 -12.635 -4.535 1.00 52.23 H new ATOM 0 HE ARG A 85 -0.131 -13.856 -5.881 1.00 53.34 H new ATOM 0 HH11 ARG A 85 -1.979 -14.758 -2.975 1.00 2.11 H new ATOM 0 HH12 ARG A 85 -1.816 -16.492 -3.270 1.00 2.11 H new ATOM 0 HH21 ARG A 85 -0.006 -16.109 -6.264 1.00 52.34 H new ATOM 0 HH22 ARG A 85 -0.711 -17.247 -5.111 1.00 52.34 H new ATOM 1403 N LEU A 86 0.400 -9.746 -8.665 1.00 4.31 N ATOM 1404 CA LEU A 86 0.110 -8.943 -9.874 1.00 65.22 C ATOM 1405 C LEU A 86 0.836 -9.475 -11.111 1.00 55.03 C ATOM 1406 O LEU A 86 0.392 -9.239 -12.230 1.00 1.22 O ATOM 1407 CB LEU A 86 0.478 -7.456 -9.634 1.00 1.01 C ATOM 1408 CG LEU A 86 -0.370 -6.734 -8.548 1.00 74.14 C ATOM 1409 CD1 LEU A 86 0.140 -5.308 -8.292 1.00 22.34 C ATOM 1410 CD2 LEU A 86 -1.855 -6.736 -8.928 1.00 31.44 C ATOM 0 H LEU A 86 1.001 -9.266 -7.996 1.00 4.31 H new ATOM 0 HA LEU A 86 -0.960 -9.024 -10.066 1.00 65.22 H new ATOM 0 HB2 LEU A 86 1.529 -7.399 -9.350 1.00 1.01 H new ATOM 0 HB3 LEU A 86 0.372 -6.915 -10.574 1.00 1.01 H new ATOM 0 HG LEU A 86 -0.260 -7.288 -7.616 1.00 74.14 H new ATOM 0 HD11 LEU A 86 -0.475 -4.833 -7.528 1.00 22.34 H new ATOM 0 HD12 LEU A 86 1.175 -5.347 -7.952 1.00 22.34 H new ATOM 0 HD13 LEU A 86 0.083 -4.730 -9.214 1.00 22.34 H new ATOM 0 HD21 LEU A 86 -2.429 -6.226 -8.155 1.00 31.44 H new ATOM 0 HD22 LEU A 86 -1.988 -6.220 -9.879 1.00 31.44 H new ATOM 0 HD23 LEU A 86 -2.205 -7.764 -9.021 1.00 31.44 H new ATOM 1422 N ASP A 87 1.961 -10.174 -10.897 1.00 3.34 N ATOM 1423 CA ASP A 87 2.702 -10.847 -11.981 1.00 11.23 C ATOM 1424 C ASP A 87 1.897 -12.067 -12.473 1.00 40.22 C ATOM 1425 O ASP A 87 1.842 -12.343 -13.672 1.00 54.41 O ATOM 1426 CB ASP A 87 4.117 -11.269 -11.495 1.00 71.24 C ATOM 1427 CG ASP A 87 4.971 -11.943 -12.589 1.00 13.23 C ATOM 1428 OD1 ASP A 87 5.396 -11.247 -13.539 1.00 51.33 O ATOM 1429 OD2 ASP A 87 5.241 -13.163 -12.499 1.00 32.44 O ATOM 0 H ASP A 87 2.382 -10.290 -9.975 1.00 3.34 H new ATOM 0 HA ASP A 87 2.832 -10.155 -12.813 1.00 11.23 H new ATOM 0 HB2 ASP A 87 4.643 -10.388 -11.127 1.00 71.24 H new ATOM 0 HB3 ASP A 87 4.014 -11.954 -10.653 1.00 71.24 H new ATOM 1434 N GLU A 88 1.246 -12.764 -11.514 1.00 51.01 N ATOM 1435 CA GLU A 88 0.352 -13.910 -11.791 1.00 65.12 C ATOM 1436 C GLU A 88 -0.932 -13.432 -12.482 1.00 22.31 C ATOM 1437 O GLU A 88 -1.323 -13.987 -13.506 1.00 70.12 O ATOM 1438 CB GLU A 88 0.023 -14.656 -10.472 1.00 14.02 C ATOM 1439 CG GLU A 88 1.251 -15.298 -9.795 1.00 75.21 C ATOM 1440 CD GLU A 88 0.971 -15.749 -8.357 1.00 14.33 C ATOM 1441 OE1 GLU A 88 0.658 -16.933 -8.124 1.00 61.52 O ATOM 1442 OE2 GLU A 88 1.058 -14.909 -7.442 1.00 52.05 O ATOM 0 H GLU A 88 1.327 -12.545 -10.521 1.00 51.01 H new ATOM 0 HA GLU A 88 0.860 -14.602 -12.463 1.00 65.12 H new ATOM 0 HB2 GLU A 88 -0.439 -13.956 -9.776 1.00 14.02 H new ATOM 0 HB3 GLU A 88 -0.713 -15.433 -10.679 1.00 14.02 H new ATOM 0 HG2 GLU A 88 1.576 -16.156 -10.383 1.00 75.21 H new ATOM 0 HG3 GLU A 88 2.074 -14.583 -9.793 1.00 75.21 H new ATOM 1449 N LEU A 89 -1.545 -12.362 -11.927 1.00 13.15 N ATOM 1450 CA LEU A 89 -2.798 -11.773 -12.444 1.00 0.53 C ATOM 1451 C LEU A 89 -2.594 -11.245 -13.871 1.00 73.13 C ATOM 1452 O LEU A 89 -3.408 -11.508 -14.740 1.00 3.01 O ATOM 1453 CB LEU A 89 -3.316 -10.636 -11.508 1.00 65.13 C ATOM 1454 CG LEU A 89 -3.739 -11.081 -10.071 1.00 73.20 C ATOM 1455 CD1 LEU A 89 -4.113 -9.865 -9.196 1.00 43.12 C ATOM 1456 CD2 LEU A 89 -4.885 -12.120 -10.117 1.00 54.40 C ATOM 0 H LEU A 89 -1.181 -11.882 -11.104 1.00 13.15 H new ATOM 0 HA LEU A 89 -3.554 -12.558 -12.467 1.00 0.53 H new ATOM 0 HB2 LEU A 89 -2.536 -9.880 -11.419 1.00 65.13 H new ATOM 0 HB3 LEU A 89 -4.171 -10.158 -11.987 1.00 65.13 H new ATOM 0 HG LEU A 89 -2.879 -11.565 -9.609 1.00 73.20 H new ATOM 0 HD11 LEU A 89 -4.403 -10.207 -8.202 1.00 43.12 H new ATOM 0 HD12 LEU A 89 -3.255 -9.198 -9.114 1.00 43.12 H new ATOM 0 HD13 LEU A 89 -4.946 -9.330 -9.653 1.00 43.12 H new ATOM 0 HD21 LEU A 89 -5.155 -12.409 -9.101 1.00 54.40 H new ATOM 0 HD22 LEU A 89 -5.752 -11.684 -10.613 1.00 54.40 H new ATOM 0 HD23 LEU A 89 -4.556 -13.000 -10.669 1.00 54.40 H new ATOM 1468 N SER A 90 -1.467 -10.549 -14.100 1.00 64.02 N ATOM 1469 CA SER A 90 -1.117 -9.989 -15.425 1.00 54.15 C ATOM 1470 C SER A 90 -0.778 -11.106 -16.434 1.00 13.21 C ATOM 1471 O SER A 90 -1.040 -10.961 -17.633 1.00 11.33 O ATOM 1472 CB SER A 90 0.071 -9.013 -15.295 1.00 10.32 C ATOM 1473 OG SER A 90 0.358 -8.359 -16.520 1.00 1.04 O ATOM 0 H SER A 90 -0.773 -10.357 -13.378 1.00 64.02 H new ATOM 0 HA SER A 90 -1.985 -9.447 -15.800 1.00 54.15 H new ATOM 0 HB2 SER A 90 -0.153 -8.269 -14.531 1.00 10.32 H new ATOM 0 HB3 SER A 90 0.953 -9.558 -14.960 1.00 10.32 H new ATOM 0 HG SER A 90 1.115 -7.749 -16.396 1.00 1.04 H new ATOM 1479 N SER A 91 -0.185 -12.214 -15.928 1.00 62.51 N ATOM 1480 CA SER A 91 0.105 -13.420 -16.733 1.00 2.51 C ATOM 1481 C SER A 91 -1.210 -14.063 -17.218 1.00 54.44 C ATOM 1482 O SER A 91 -1.297 -14.544 -18.357 1.00 30.34 O ATOM 1483 CB SER A 91 0.932 -14.438 -15.901 1.00 55.12 C ATOM 1484 OG SER A 91 1.228 -15.616 -16.635 1.00 41.13 O ATOM 0 H SER A 91 0.104 -12.295 -14.953 1.00 62.51 H new ATOM 0 HA SER A 91 0.692 -13.128 -17.604 1.00 2.51 H new ATOM 0 HB2 SER A 91 1.862 -13.970 -15.578 1.00 55.12 H new ATOM 0 HB3 SER A 91 0.379 -14.703 -15.000 1.00 55.12 H new ATOM 0 HG SER A 91 1.750 -16.228 -16.075 1.00 41.13 H new ATOM 1490 N LEU A 92 -2.230 -14.039 -16.334 1.00 34.14 N ATOM 1491 CA LEU A 92 -3.576 -14.545 -16.636 1.00 44.41 C ATOM 1492 C LEU A 92 -4.272 -13.620 -17.658 1.00 11.23 C ATOM 1493 O LEU A 92 -4.765 -14.098 -18.680 1.00 42.11 O ATOM 1494 CB LEU A 92 -4.416 -14.678 -15.327 1.00 12.04 C ATOM 1495 CG LEU A 92 -3.859 -15.681 -14.258 1.00 52.42 C ATOM 1496 CD1 LEU A 92 -4.680 -15.641 -12.950 1.00 35.40 C ATOM 1497 CD2 LEU A 92 -3.769 -17.117 -14.822 1.00 4.51 C ATOM 0 H LEU A 92 -2.138 -13.666 -15.389 1.00 34.14 H new ATOM 0 HA LEU A 92 -3.492 -15.538 -17.078 1.00 44.41 H new ATOM 0 HB2 LEU A 92 -4.495 -13.693 -14.867 1.00 12.04 H new ATOM 0 HB3 LEU A 92 -5.426 -14.987 -15.596 1.00 12.04 H new ATOM 0 HG LEU A 92 -2.847 -15.359 -14.014 1.00 52.42 H new ATOM 0 HD11 LEU A 92 -4.261 -16.350 -12.236 1.00 35.40 H new ATOM 0 HD12 LEU A 92 -4.643 -14.637 -12.528 1.00 35.40 H new ATOM 0 HD13 LEU A 92 -5.715 -15.908 -13.162 1.00 35.40 H new ATOM 0 HD21 LEU A 92 -3.379 -17.786 -14.054 1.00 4.51 H new ATOM 0 HD22 LEU A 92 -4.761 -17.452 -15.125 1.00 4.51 H new ATOM 0 HD23 LEU A 92 -3.103 -17.128 -15.685 1.00 4.51 H new ATOM 1509 N ILE A 93 -4.232 -12.290 -17.388 1.00 24.20 N ATOM 1510 CA ILE A 93 -4.880 -11.242 -18.219 1.00 34.22 C ATOM 1511 C ILE A 93 -4.315 -11.246 -19.649 1.00 43.05 C ATOM 1512 O ILE A 93 -5.066 -11.135 -20.617 1.00 33.42 O ATOM 1513 CB ILE A 93 -4.714 -9.796 -17.582 1.00 74.53 C ATOM 1514 CG1 ILE A 93 -5.453 -9.704 -16.208 1.00 42.03 C ATOM 1515 CG2 ILE A 93 -5.207 -8.672 -18.536 1.00 42.42 C ATOM 1516 CD1 ILE A 93 -5.214 -8.413 -15.442 1.00 40.51 C ATOM 0 H ILE A 93 -3.743 -11.911 -16.577 1.00 24.20 H new ATOM 0 HA ILE A 93 -5.943 -11.479 -18.254 1.00 34.22 H new ATOM 0 HB ILE A 93 -3.647 -9.643 -17.420 1.00 74.53 H new ATOM 0 HG12 ILE A 93 -6.524 -9.816 -16.379 1.00 42.03 H new ATOM 0 HG13 ILE A 93 -5.140 -10.543 -15.586 1.00 42.03 H new ATOM 0 HG21 ILE A 93 -5.073 -7.703 -18.056 1.00 42.42 H new ATOM 0 HG22 ILE A 93 -4.631 -8.702 -19.461 1.00 42.42 H new ATOM 0 HG23 ILE A 93 -6.263 -8.823 -18.761 1.00 42.42 H new ATOM 0 HD11 ILE A 93 -5.766 -8.440 -14.503 1.00 40.51 H new ATOM 0 HD12 ILE A 93 -4.149 -8.305 -15.234 1.00 40.51 H new ATOM 0 HD13 ILE A 93 -5.555 -7.567 -16.039 1.00 40.51 H new ATOM 1528 N GLY A 94 -2.986 -11.424 -19.762 1.00 4.43 N ATOM 1529 CA GLY A 94 -2.303 -11.426 -21.060 1.00 31.01 C ATOM 1530 C GLY A 94 -2.790 -12.528 -22.009 1.00 14.13 C ATOM 1531 O GLY A 94 -2.694 -12.391 -23.233 1.00 12.00 O ATOM 0 H GLY A 94 -2.366 -11.568 -18.965 1.00 4.43 H new ATOM 0 HA2 GLY A 94 -2.447 -10.457 -21.538 1.00 31.01 H new ATOM 0 HA3 GLY A 94 -1.232 -11.546 -20.897 1.00 31.01 H new ATOM 1535 N GLN A 95 -3.324 -13.621 -21.426 1.00 72.00 N ATOM 1536 CA GLN A 95 -3.878 -14.761 -22.180 1.00 22.14 C ATOM 1537 C GLN A 95 -5.404 -14.590 -22.391 1.00 54.12 C ATOM 1538 O GLN A 95 -5.906 -14.692 -23.519 1.00 54.13 O ATOM 1539 CB GLN A 95 -3.595 -16.091 -21.421 1.00 2.13 C ATOM 1540 CG GLN A 95 -2.116 -16.349 -21.071 1.00 4.21 C ATOM 1541 CD GLN A 95 -1.175 -16.395 -22.284 1.00 4.42 C ATOM 1542 OE1 GLN A 95 -0.596 -15.388 -22.682 1.00 21.24 O ATOM 1543 NE2 GLN A 95 -1.019 -17.567 -22.884 1.00 21.41 N ATOM 0 H GLN A 95 -3.383 -13.737 -20.414 1.00 72.00 H new ATOM 0 HA GLN A 95 -3.394 -14.794 -23.156 1.00 22.14 H new ATOM 0 HB2 GLN A 95 -4.175 -16.094 -20.498 1.00 2.13 H new ATOM 0 HB3 GLN A 95 -3.957 -16.921 -22.028 1.00 2.13 H new ATOM 0 HG2 GLN A 95 -1.775 -15.568 -20.391 1.00 4.21 H new ATOM 0 HG3 GLN A 95 -2.042 -17.294 -20.533 1.00 4.21 H new ATOM 0 HE21 GLN A 95 -1.511 -18.389 -22.534 1.00 21.41 H new ATOM 0 HE22 GLN A 95 -0.407 -17.647 -23.696 1.00 21.41 H new ATOM 1552 N VAL A 96 -6.128 -14.312 -21.286 1.00 4.23 N ATOM 1553 CA VAL A 96 -7.610 -14.374 -21.241 1.00 34.24 C ATOM 1554 C VAL A 96 -8.271 -13.116 -21.849 1.00 22.01 C ATOM 1555 O VAL A 96 -9.409 -13.180 -22.336 1.00 11.41 O ATOM 1556 CB VAL A 96 -8.137 -14.639 -19.775 1.00 73.20 C ATOM 1557 CG1 VAL A 96 -7.536 -15.948 -19.206 1.00 42.32 C ATOM 1558 CG2 VAL A 96 -7.867 -13.445 -18.825 1.00 62.03 C ATOM 0 H VAL A 96 -5.705 -14.038 -20.399 1.00 4.23 H new ATOM 0 HA VAL A 96 -7.902 -15.221 -21.862 1.00 34.24 H new ATOM 0 HB VAL A 96 -9.219 -14.751 -19.839 1.00 73.20 H new ATOM 0 HG11 VAL A 96 -7.912 -16.112 -18.196 1.00 42.32 H new ATOM 0 HG12 VAL A 96 -7.824 -16.786 -19.841 1.00 42.32 H new ATOM 0 HG13 VAL A 96 -6.449 -15.868 -19.180 1.00 42.32 H new ATOM 0 HG21 VAL A 96 -8.248 -13.678 -17.831 1.00 62.03 H new ATOM 0 HG22 VAL A 96 -6.794 -13.260 -18.768 1.00 62.03 H new ATOM 0 HG23 VAL A 96 -8.368 -12.556 -19.207 1.00 62.03 H new ATOM 1568 N LEU A 97 -7.559 -11.982 -21.812 1.00 62.04 N ATOM 1569 CA LEU A 97 -7.998 -10.732 -22.465 1.00 42.35 C ATOM 1570 C LEU A 97 -7.402 -10.724 -23.883 1.00 43.43 C ATOM 1571 O LEU A 97 -6.174 -10.674 -24.051 1.00 2.22 O ATOM 1572 CB LEU A 97 -7.548 -9.481 -21.631 1.00 23.43 C ATOM 1573 CG LEU A 97 -8.255 -8.097 -21.925 1.00 11.25 C ATOM 1574 CD1 LEU A 97 -7.909 -7.047 -20.838 1.00 70.22 C ATOM 1575 CD2 LEU A 97 -7.928 -7.527 -23.329 1.00 45.40 C ATOM 0 H LEU A 97 -6.663 -11.901 -21.331 1.00 62.04 H new ATOM 0 HA LEU A 97 -9.085 -10.683 -22.523 1.00 42.35 H new ATOM 0 HB2 LEU A 97 -7.695 -9.713 -20.576 1.00 23.43 H new ATOM 0 HB3 LEU A 97 -6.477 -9.347 -21.782 1.00 23.43 H new ATOM 0 HG LEU A 97 -9.325 -8.303 -21.902 1.00 11.25 H new ATOM 0 HD11 LEU A 97 -8.410 -6.107 -21.068 1.00 70.22 H new ATOM 0 HD12 LEU A 97 -8.243 -7.407 -19.865 1.00 70.22 H new ATOM 0 HD13 LEU A 97 -6.831 -6.888 -20.816 1.00 70.22 H new ATOM 0 HD21 LEU A 97 -8.445 -6.577 -23.465 1.00 45.40 H new ATOM 0 HD22 LEU A 97 -6.853 -7.371 -23.417 1.00 45.40 H new ATOM 0 HD23 LEU A 97 -8.256 -8.232 -24.093 1.00 45.40 H new ATOM 1587 N PHE A 98 -8.284 -10.789 -24.893 1.00 54.10 N ATOM 1588 CA PHE A 98 -7.900 -10.722 -26.308 1.00 41.41 C ATOM 1589 C PHE A 98 -7.800 -9.237 -26.709 1.00 53.00 C ATOM 1590 O PHE A 98 -8.811 -8.593 -26.998 1.00 0.25 O ATOM 1591 CB PHE A 98 -8.935 -11.476 -27.183 1.00 43.20 C ATOM 1592 CG PHE A 98 -9.290 -12.872 -26.675 1.00 65.23 C ATOM 1593 CD1 PHE A 98 -8.407 -13.937 -26.839 1.00 3.44 C ATOM 1594 CD2 PHE A 98 -10.499 -13.109 -26.010 1.00 3.35 C ATOM 1595 CE1 PHE A 98 -8.728 -15.202 -26.377 1.00 31.20 C ATOM 1596 CE2 PHE A 98 -10.816 -14.371 -25.550 1.00 13.34 C ATOM 1597 CZ PHE A 98 -9.927 -15.414 -25.723 1.00 40.42 C ATOM 0 H PHE A 98 -9.289 -10.890 -24.748 1.00 54.10 H new ATOM 0 HA PHE A 98 -6.935 -11.204 -26.464 1.00 41.41 H new ATOM 0 HB2 PHE A 98 -9.846 -10.881 -27.241 1.00 43.20 H new ATOM 0 HB3 PHE A 98 -8.544 -11.560 -28.197 1.00 43.20 H new ATOM 0 HD1 PHE A 98 -7.460 -13.774 -27.333 1.00 3.44 H new ATOM 0 HD2 PHE A 98 -11.192 -12.295 -25.855 1.00 3.35 H new ATOM 0 HE1 PHE A 98 -8.042 -16.022 -26.528 1.00 31.20 H new ATOM 0 HE2 PHE A 98 -11.760 -14.543 -25.054 1.00 13.34 H new ATOM 0 HZ PHE A 98 -10.169 -16.397 -25.347 1.00 40.42 H new ATOM 1607 N GLN A 99 -6.582 -8.688 -26.640 1.00 74.53 N ATOM 1608 CA GLN A 99 -6.328 -7.255 -26.901 1.00 15.33 C ATOM 1609 C GLN A 99 -6.093 -6.975 -28.399 1.00 32.44 C ATOM 1610 O GLN A 99 -6.153 -5.815 -28.820 1.00 10.01 O ATOM 1611 CB GLN A 99 -5.150 -6.742 -26.001 1.00 2.14 C ATOM 1612 CG GLN A 99 -3.906 -7.669 -25.908 1.00 12.14 C ATOM 1613 CD GLN A 99 -3.053 -7.738 -27.179 1.00 43.23 C ATOM 1614 OE1 GLN A 99 -2.946 -6.765 -27.927 1.00 55.03 O ATOM 1615 NE2 GLN A 99 -2.456 -8.887 -27.446 1.00 33.14 N ATOM 0 H GLN A 99 -5.743 -9.217 -26.403 1.00 74.53 H new ATOM 0 HA GLN A 99 -7.222 -6.692 -26.631 1.00 15.33 H new ATOM 0 HB2 GLN A 99 -4.827 -5.772 -26.379 1.00 2.14 H new ATOM 0 HB3 GLN A 99 -5.533 -6.580 -24.994 1.00 2.14 H new ATOM 0 HG2 GLN A 99 -3.278 -7.328 -25.085 1.00 12.14 H new ATOM 0 HG3 GLN A 99 -4.240 -8.676 -25.658 1.00 12.14 H new ATOM 0 HE21 GLN A 99 -2.562 -9.677 -26.809 1.00 33.14 H new ATOM 0 HE22 GLN A 99 -1.890 -8.984 -28.289 1.00 33.14 H new ATOM 1624 N GLY A 100 -5.841 -8.034 -29.190 1.00 71.34 N ATOM 1625 CA GLY A 100 -5.604 -7.895 -30.630 1.00 73.34 C ATOM 1626 C GLY A 100 -5.701 -9.238 -31.346 1.00 41.54 C ATOM 1627 O GLY A 100 -6.731 -9.521 -31.978 1.00 74.41 O ATOM 0 H GLY A 100 -5.797 -8.995 -28.851 1.00 71.34 H new ATOM 0 HA2 GLY A 100 -6.331 -7.202 -31.054 1.00 73.34 H new ATOM 0 HA3 GLY A 100 -4.617 -7.463 -30.797 1.00 73.34 H new ATOM 1631 N PRO A 101 -4.636 -10.105 -31.261 1.00 3.44 N ATOM 1632 CA PRO A 101 -4.648 -11.471 -31.833 1.00 21.03 C ATOM 1633 C PRO A 101 -5.426 -12.465 -30.936 1.00 11.11 C ATOM 1634 O PRO A 101 -6.142 -12.051 -30.005 1.00 54.21 O ATOM 1635 CB PRO A 101 -3.125 -11.832 -31.939 1.00 22.24 C ATOM 1636 CG PRO A 101 -2.375 -10.599 -31.497 1.00 4.22 C ATOM 1637 CD PRO A 101 -3.329 -9.839 -30.612 1.00 43.05 C ATOM 0 HA PRO A 101 -5.158 -11.525 -32.795 1.00 21.03 H new ATOM 0 HB2 PRO A 101 -2.881 -12.685 -31.306 1.00 22.24 H new ATOM 0 HB3 PRO A 101 -2.859 -12.106 -32.960 1.00 22.24 H new ATOM 0 HG2 PRO A 101 -1.467 -10.866 -30.956 1.00 4.22 H new ATOM 0 HG3 PRO A 101 -2.071 -9.997 -32.353 1.00 4.22 H new ATOM 0 HD2 PRO A 101 -3.304 -10.198 -29.583 1.00 43.05 H new ATOM 0 HD3 PRO A 101 -3.098 -8.774 -30.583 1.00 43.05 H new ATOM 1645 N SER A 102 -5.285 -13.779 -31.256 1.00 3.21 N ATOM 1646 CA SER A 102 -5.965 -14.893 -30.547 1.00 33.31 C ATOM 1647 C SER A 102 -7.501 -14.833 -30.755 1.00 73.33 C ATOM 1648 O SER A 102 -8.277 -15.433 -29.997 1.00 32.00 O ATOM 1649 CB SER A 102 -5.588 -14.905 -29.042 1.00 14.33 C ATOM 1650 OG SER A 102 -4.183 -14.948 -28.859 1.00 53.40 O ATOM 0 H SER A 102 -4.690 -14.096 -32.021 1.00 3.21 H new ATOM 0 HA SER A 102 -5.617 -15.832 -30.978 1.00 33.31 H new ATOM 0 HB2 SER A 102 -5.992 -14.016 -28.557 1.00 14.33 H new ATOM 0 HB3 SER A 102 -6.046 -15.768 -28.558 1.00 14.33 H new ATOM 0 HG SER A 102 -3.978 -14.953 -27.901 1.00 53.40 H new ATOM 1656 N ALA A 103 -7.906 -14.145 -31.840 1.00 13.21 N ATOM 1657 CA ALA A 103 -9.315 -13.907 -32.203 1.00 33.01 C ATOM 1658 C ALA A 103 -9.431 -13.642 -33.714 1.00 64.44 C ATOM 1659 O ALA A 103 -8.412 -13.583 -34.418 1.00 61.23 O ATOM 1660 CB ALA A 103 -9.882 -12.732 -31.382 1.00 43.43 C ATOM 0 H ALA A 103 -7.249 -13.731 -32.501 1.00 13.21 H new ATOM 0 HA ALA A 103 -9.903 -14.794 -31.970 1.00 33.01 H new ATOM 0 HB1 ALA A 103 -10.923 -12.564 -31.658 1.00 43.43 H new ATOM 0 HB2 ALA A 103 -9.821 -12.968 -30.320 1.00 43.43 H new ATOM 0 HB3 ALA A 103 -9.303 -11.832 -31.587 1.00 43.43 H new ATOM 1666 N GLY A 104 -10.676 -13.508 -34.203 1.00 74.11 N ATOM 1667 CA GLY A 104 -10.927 -13.170 -35.608 1.00 63.20 C ATOM 1668 C GLY A 104 -10.654 -11.699 -35.899 1.00 23.44 C ATOM 1669 O GLY A 104 -9.924 -11.361 -36.842 1.00 32.22 O ATOM 0 H GLY A 104 -11.521 -13.629 -33.644 1.00 74.11 H new ATOM 0 HA2 GLY A 104 -10.298 -13.789 -36.248 1.00 63.20 H new ATOM 0 HA3 GLY A 104 -11.962 -13.403 -35.858 1.00 63.20 H new ATOM 1673 N LEU A 105 -11.230 -10.825 -35.055 1.00 5.30 N ATOM 1674 CA LEU A 105 -11.038 -9.365 -35.112 1.00 21.33 C ATOM 1675 C LEU A 105 -10.169 -8.905 -33.926 1.00 20.40 C ATOM 1676 O LEU A 105 -9.677 -9.739 -33.156 1.00 2.23 O ATOM 1677 CB LEU A 105 -12.431 -8.641 -35.167 1.00 1.45 C ATOM 1678 CG LEU A 105 -13.555 -9.111 -34.160 1.00 72.20 C ATOM 1679 CD1 LEU A 105 -13.273 -8.717 -32.687 1.00 12.32 C ATOM 1680 CD2 LEU A 105 -14.946 -8.593 -34.605 1.00 4.21 C ATOM 0 H LEU A 105 -11.852 -11.118 -34.302 1.00 5.30 H new ATOM 0 HA LEU A 105 -10.505 -9.093 -36.023 1.00 21.33 H new ATOM 0 HB2 LEU A 105 -12.260 -7.577 -35.003 1.00 1.45 H new ATOM 0 HB3 LEU A 105 -12.823 -8.749 -36.178 1.00 1.45 H new ATOM 0 HG LEU A 105 -13.549 -10.201 -34.192 1.00 72.20 H new ATOM 0 HD11 LEU A 105 -14.086 -9.072 -32.053 1.00 12.32 H new ATOM 0 HD12 LEU A 105 -12.336 -9.169 -32.362 1.00 12.32 H new ATOM 0 HD13 LEU A 105 -13.199 -7.632 -32.608 1.00 12.32 H new ATOM 0 HD21 LEU A 105 -15.703 -8.929 -33.897 1.00 4.21 H new ATOM 0 HD22 LEU A 105 -14.936 -7.503 -34.635 1.00 4.21 H new ATOM 0 HD23 LEU A 105 -15.179 -8.982 -35.596 1.00 4.21 H new ATOM 1692 N VAL A 106 -9.949 -7.581 -33.815 1.00 40.34 N ATOM 1693 CA VAL A 106 -9.243 -6.961 -32.679 1.00 10.44 C ATOM 1694 C VAL A 106 -10.291 -6.546 -31.609 1.00 65.14 C ATOM 1695 O VAL A 106 -10.982 -5.540 -31.782 1.00 33.21 O ATOM 1696 CB VAL A 106 -8.391 -5.716 -33.151 1.00 64.52 C ATOM 1697 CG1 VAL A 106 -7.691 -5.005 -31.966 1.00 34.45 C ATOM 1698 CG2 VAL A 106 -7.360 -6.140 -34.228 1.00 5.25 C ATOM 0 H VAL A 106 -10.258 -6.908 -34.516 1.00 40.34 H new ATOM 0 HA VAL A 106 -8.547 -7.680 -32.247 1.00 10.44 H new ATOM 0 HB VAL A 106 -9.081 -4.997 -33.591 1.00 64.52 H new ATOM 0 HG11 VAL A 106 -7.118 -4.156 -32.338 1.00 34.45 H new ATOM 0 HG12 VAL A 106 -8.441 -4.653 -31.258 1.00 34.45 H new ATOM 0 HG13 VAL A 106 -7.021 -5.705 -31.467 1.00 34.45 H new ATOM 0 HG21 VAL A 106 -6.782 -5.270 -34.541 1.00 5.25 H new ATOM 0 HG22 VAL A 106 -6.688 -6.891 -33.813 1.00 5.25 H new ATOM 0 HG23 VAL A 106 -7.883 -6.557 -35.088 1.00 5.25 H new ATOM 1708 N PRO A 107 -10.461 -7.343 -30.498 1.00 0.44 N ATOM 1709 CA PRO A 107 -11.466 -7.070 -29.423 1.00 53.40 C ATOM 1710 C PRO A 107 -10.991 -6.012 -28.395 1.00 52.23 C ATOM 1711 O PRO A 107 -11.431 -6.018 -27.238 1.00 52.15 O ATOM 1712 CB PRO A 107 -11.671 -8.484 -28.772 1.00 0.03 C ATOM 1713 CG PRO A 107 -10.849 -9.437 -29.607 1.00 41.01 C ATOM 1714 CD PRO A 107 -9.739 -8.598 -30.191 1.00 2.11 C ATOM 0 HA PRO A 107 -12.386 -6.635 -29.814 1.00 53.40 H new ATOM 0 HB2 PRO A 107 -11.342 -8.489 -27.733 1.00 0.03 H new ATOM 0 HB3 PRO A 107 -12.723 -8.768 -28.774 1.00 0.03 H new ATOM 0 HG2 PRO A 107 -10.450 -10.249 -28.999 1.00 41.01 H new ATOM 0 HG3 PRO A 107 -11.452 -9.893 -30.392 1.00 41.01 H new ATOM 0 HD2 PRO A 107 -8.925 -8.442 -29.483 1.00 2.11 H new ATOM 0 HD3 PRO A 107 -9.305 -9.052 -31.082 1.00 2.11 H new ATOM 1722 N ARG A 108 -10.098 -5.109 -28.839 1.00 3.14 N ATOM 1723 CA ARG A 108 -9.659 -3.944 -28.061 1.00 43.33 C ATOM 1724 C ARG A 108 -10.793 -2.894 -28.008 1.00 4.34 C ATOM 1725 O ARG A 108 -10.947 -2.066 -28.921 1.00 23.02 O ATOM 1726 CB ARG A 108 -8.356 -3.368 -28.690 1.00 1.35 C ATOM 1727 CG ARG A 108 -7.854 -2.033 -28.101 1.00 13.54 C ATOM 1728 CD ARG A 108 -6.582 -1.511 -28.804 1.00 41.21 C ATOM 1729 NE ARG A 108 -6.695 -1.545 -30.281 1.00 75.22 N ATOM 1730 CZ ARG A 108 -7.404 -0.690 -31.046 1.00 25.40 C ATOM 1731 NH1 ARG A 108 -8.098 0.313 -30.513 1.00 14.03 N ATOM 1732 NH2 ARG A 108 -7.430 -0.860 -32.358 1.00 43.54 N ATOM 0 H ARG A 108 -9.659 -5.171 -29.757 1.00 3.14 H new ATOM 0 HA ARG A 108 -9.436 -4.235 -27.035 1.00 43.33 H new ATOM 0 HB2 ARG A 108 -7.565 -4.110 -28.582 1.00 1.35 H new ATOM 0 HB3 ARG A 108 -8.521 -3.232 -29.759 1.00 1.35 H new ATOM 0 HG2 ARG A 108 -8.643 -1.285 -28.184 1.00 13.54 H new ATOM 0 HG3 ARG A 108 -7.649 -2.164 -27.038 1.00 13.54 H new ATOM 0 HD2 ARG A 108 -6.386 -0.488 -28.481 1.00 41.21 H new ATOM 0 HD3 ARG A 108 -5.727 -2.112 -28.494 1.00 41.21 H new ATOM 0 HE ARG A 108 -6.188 -2.286 -30.765 1.00 75.22 H new ATOM 0 HH11 ARG A 108 -8.102 0.450 -29.502 1.00 14.03 H new ATOM 0 HH12 ARG A 108 -8.626 0.945 -31.115 1.00 14.03 H new ATOM 0 HH21 ARG A 108 -6.917 -1.632 -32.782 1.00 43.54 H new ATOM 0 HH22 ARG A 108 -7.963 -0.219 -32.945 1.00 43.54 H new ATOM 1746 N GLY A 109 -11.617 -2.987 -26.958 1.00 62.20 N ATOM 1747 CA GLY A 109 -12.725 -2.058 -26.729 1.00 22.31 C ATOM 1748 C GLY A 109 -13.020 -1.930 -25.246 1.00 44.13 C ATOM 1749 O GLY A 109 -13.543 -2.875 -24.636 1.00 21.02 O ATOM 0 H GLY A 109 -11.533 -3.710 -26.243 1.00 62.20 H new ATOM 0 HA2 GLY A 109 -12.477 -1.080 -27.141 1.00 22.31 H new ATOM 0 HA3 GLY A 109 -13.614 -2.409 -27.253 1.00 22.31 H new ATOM 1753 N SER A 110 -12.666 -0.773 -24.653 1.00 45.12 N ATOM 1754 CA SER A 110 -12.839 -0.518 -23.217 1.00 55.43 C ATOM 1755 C SER A 110 -14.326 -0.230 -22.902 1.00 50.42 C ATOM 1756 O SER A 110 -14.772 0.922 -22.917 1.00 55.44 O ATOM 1757 CB SER A 110 -11.925 0.649 -22.773 1.00 34.31 C ATOM 1758 OG SER A 110 -10.574 0.411 -23.139 1.00 41.15 O ATOM 0 H SER A 110 -12.252 0.009 -25.160 1.00 45.12 H new ATOM 0 HA SER A 110 -12.547 -1.404 -22.654 1.00 55.43 H new ATOM 0 HB2 SER A 110 -12.270 1.578 -23.228 1.00 34.31 H new ATOM 0 HB3 SER A 110 -11.995 0.778 -21.693 1.00 34.31 H new ATOM 0 HG SER A 110 -10.019 1.164 -22.848 1.00 41.15 H new ATOM 1764 N GLY A 111 -15.088 -1.306 -22.688 1.00 42.12 N ATOM 1765 CA GLY A 111 -16.501 -1.219 -22.351 1.00 11.22 C ATOM 1766 C GLY A 111 -17.028 -2.575 -21.918 1.00 20.24 C ATOM 1767 O GLY A 111 -17.471 -2.738 -20.773 1.00 10.41 O ATOM 0 H GLY A 111 -14.736 -2.262 -22.745 1.00 42.12 H new ATOM 0 HA2 GLY A 111 -16.646 -0.493 -21.551 1.00 11.22 H new ATOM 0 HA3 GLY A 111 -17.065 -0.861 -23.212 1.00 11.22 H new ATOM 1771 N GLY A 112 -16.946 -3.563 -22.832 1.00 24.35 N ATOM 1772 CA GLY A 112 -17.374 -4.933 -22.544 1.00 14.23 C ATOM 1773 C GLY A 112 -17.097 -5.913 -23.683 1.00 43.15 C ATOM 1774 O GLY A 112 -17.062 -5.522 -24.854 1.00 55.52 O ATOM 0 H GLY A 112 -16.585 -3.430 -23.777 1.00 24.35 H new ATOM 0 HA2 GLY A 112 -16.867 -5.282 -21.645 1.00 14.23 H new ATOM 0 HA3 GLY A 112 -18.442 -4.933 -22.328 1.00 14.23 H new ATOM 1778 N ILE A 113 -16.860 -7.185 -23.315 1.00 24.42 N ATOM 1779 CA ILE A 113 -16.725 -8.322 -24.252 1.00 21.01 C ATOM 1780 C ILE A 113 -17.984 -9.203 -24.081 1.00 25.44 C ATOM 1781 O ILE A 113 -18.517 -9.286 -22.973 1.00 55.35 O ATOM 1782 CB ILE A 113 -15.423 -9.203 -23.967 1.00 22.24 C ATOM 1783 CG1 ILE A 113 -14.113 -8.331 -23.832 1.00 22.14 C ATOM 1784 CG2 ILE A 113 -15.241 -10.287 -25.071 1.00 1.02 C ATOM 1785 CD1 ILE A 113 -13.891 -7.680 -22.464 1.00 24.22 C ATOM 0 H ILE A 113 -16.754 -7.460 -22.338 1.00 24.42 H new ATOM 0 HA ILE A 113 -16.625 -7.934 -25.266 1.00 21.01 H new ATOM 0 HB ILE A 113 -15.580 -9.692 -23.006 1.00 22.24 H new ATOM 0 HG12 ILE A 113 -13.253 -8.962 -24.058 1.00 22.14 H new ATOM 0 HG13 ILE A 113 -14.141 -7.546 -24.588 1.00 22.14 H new ATOM 0 HG21 ILE A 113 -14.349 -10.876 -24.859 1.00 1.02 H new ATOM 0 HG22 ILE A 113 -16.113 -10.941 -25.086 1.00 1.02 H new ATOM 0 HG23 ILE A 113 -15.134 -9.803 -26.042 1.00 1.02 H new ATOM 0 HD11 ILE A 113 -12.965 -7.105 -22.480 1.00 24.22 H new ATOM 0 HD12 ILE A 113 -14.726 -7.017 -22.237 1.00 24.22 H new ATOM 0 HD13 ILE A 113 -13.824 -8.454 -21.699 1.00 24.22 H new ATOM 1797 N GLU A 114 -18.471 -9.849 -25.158 1.00 3.20 N ATOM 1798 CA GLU A 114 -19.624 -10.778 -25.060 1.00 74.10 C ATOM 1799 C GLU A 114 -19.224 -12.085 -24.333 1.00 54.11 C ATOM 1800 O GLU A 114 -18.137 -12.623 -24.564 1.00 10.35 O ATOM 1801 CB GLU A 114 -20.274 -11.049 -26.463 1.00 60.41 C ATOM 1802 CG GLU A 114 -19.314 -11.282 -27.662 1.00 14.03 C ATOM 1803 CD GLU A 114 -18.527 -12.601 -27.642 1.00 61.32 C ATOM 1804 OE1 GLU A 114 -17.283 -12.576 -27.757 1.00 42.14 O ATOM 1805 OE2 GLU A 114 -19.155 -13.676 -27.528 1.00 2.00 O ATOM 0 H GLU A 114 -18.091 -9.749 -26.099 1.00 3.20 H new ATOM 0 HA GLU A 114 -20.391 -10.295 -24.455 1.00 74.10 H new ATOM 0 HB2 GLU A 114 -20.918 -11.923 -26.373 1.00 60.41 H new ATOM 0 HB3 GLU A 114 -20.917 -10.203 -26.706 1.00 60.41 H new ATOM 0 HG2 GLU A 114 -19.897 -11.242 -28.582 1.00 14.03 H new ATOM 0 HG3 GLU A 114 -18.603 -10.457 -27.699 1.00 14.03 H new ATOM 1812 N GLY A 115 -20.106 -12.560 -23.425 1.00 61.51 N ATOM 1813 CA GLY A 115 -19.879 -13.793 -22.657 1.00 5.34 C ATOM 1814 C GLY A 115 -19.362 -13.529 -21.239 1.00 23.32 C ATOM 1815 O GLY A 115 -19.046 -12.386 -20.881 1.00 71.34 O ATOM 0 H GLY A 115 -20.989 -12.098 -23.209 1.00 61.51 H new ATOM 0 HA2 GLY A 115 -20.811 -14.355 -22.599 1.00 5.34 H new ATOM 0 HA3 GLY A 115 -19.162 -14.419 -23.189 1.00 5.34 H new ATOM 1819 N SER A 428 -19.267 -14.614 -20.437 1.00 31.14 N ATOM 1820 CA SER A 428 -18.805 -14.579 -19.022 1.00 64.24 C ATOM 1821 C SER A 428 -17.283 -14.332 -18.916 1.00 24.00 C ATOM 1822 O SER A 428 -16.750 -14.104 -17.811 1.00 55.23 O ATOM 1823 CB SER A 428 -19.194 -15.894 -18.306 1.00 2.54 C ATOM 1824 OG SER A 428 -18.874 -15.857 -16.924 1.00 63.33 O ATOM 0 H SER A 428 -19.511 -15.552 -20.754 1.00 31.14 H new ATOM 0 HA SER A 428 -19.301 -13.742 -18.531 1.00 64.24 H new ATOM 0 HB2 SER A 428 -20.263 -16.071 -18.427 1.00 2.54 H new ATOM 0 HB3 SER A 428 -18.677 -16.730 -18.776 1.00 2.54 H new ATOM 0 HG SER A 428 -19.426 -15.181 -16.478 1.00 63.33 H new ATOM 1830 N ILE A 429 -16.598 -14.392 -20.079 1.00 44.32 N ATOM 1831 CA ILE A 429 -15.199 -13.943 -20.238 1.00 51.31 C ATOM 1832 C ILE A 429 -15.044 -12.499 -19.718 1.00 42.31 C ATOM 1833 O ILE A 429 -14.060 -12.182 -19.055 1.00 51.11 O ATOM 1834 CB ILE A 429 -14.738 -14.063 -21.750 1.00 12.32 C ATOM 1835 CG1 ILE A 429 -13.235 -13.620 -21.999 1.00 30.30 C ATOM 1836 CG2 ILE A 429 -15.707 -13.302 -22.680 1.00 42.33 C ATOM 1837 CD1 ILE A 429 -12.999 -12.159 -22.408 1.00 41.04 C ATOM 0 H ILE A 429 -17.005 -14.757 -20.940 1.00 44.32 H new ATOM 0 HA ILE A 429 -14.553 -14.591 -19.646 1.00 51.31 H new ATOM 0 HB ILE A 429 -14.774 -15.125 -21.993 1.00 12.32 H new ATOM 0 HG12 ILE A 429 -12.669 -13.812 -21.087 1.00 30.30 H new ATOM 0 HG13 ILE A 429 -12.817 -14.261 -22.775 1.00 30.30 H new ATOM 0 HG21 ILE A 429 -15.371 -13.398 -23.712 1.00 42.33 H new ATOM 0 HG22 ILE A 429 -16.708 -13.721 -22.584 1.00 42.33 H new ATOM 0 HG23 ILE A 429 -15.727 -12.248 -22.401 1.00 42.33 H new ATOM 0 HD11 ILE A 429 -11.931 -11.988 -22.547 1.00 41.04 H new ATOM 0 HD12 ILE A 429 -13.524 -11.953 -23.341 1.00 41.04 H new ATOM 0 HD13 ILE A 429 -13.374 -11.497 -21.627 1.00 41.04 H new ATOM 1849 N ASP A 430 -16.067 -11.662 -19.981 1.00 63.23 N ATOM 1850 CA ASP A 430 -16.110 -10.262 -19.543 1.00 13.13 C ATOM 1851 C ASP A 430 -16.009 -10.160 -18.015 1.00 15.41 C ATOM 1852 O ASP A 430 -15.270 -9.327 -17.496 1.00 11.23 O ATOM 1853 CB ASP A 430 -17.419 -9.603 -20.025 1.00 42.42 C ATOM 1854 CG ASP A 430 -17.492 -8.110 -19.680 1.00 64.02 C ATOM 1855 OD1 ASP A 430 -16.731 -7.331 -20.284 1.00 33.41 O ATOM 1856 OD2 ASP A 430 -18.308 -7.703 -18.819 1.00 35.12 O ATOM 0 H ASP A 430 -16.892 -11.946 -20.509 1.00 63.23 H new ATOM 0 HA ASP A 430 -15.257 -9.741 -19.978 1.00 13.13 H new ATOM 0 HB2 ASP A 430 -17.507 -9.727 -21.104 1.00 42.42 H new ATOM 0 HB3 ASP A 430 -18.268 -10.118 -19.574 1.00 42.42 H new ATOM 1861 N GLU A 431 -16.747 -11.052 -17.319 1.00 23.43 N ATOM 1862 CA GLU A 431 -16.796 -11.099 -15.851 1.00 73.51 C ATOM 1863 C GLU A 431 -15.428 -11.468 -15.267 1.00 43.43 C ATOM 1864 O GLU A 431 -14.866 -10.696 -14.489 1.00 52.43 O ATOM 1865 CB GLU A 431 -17.877 -12.102 -15.369 1.00 21.01 C ATOM 1866 CG GLU A 431 -19.312 -11.720 -15.757 1.00 3.32 C ATOM 1867 CD GLU A 431 -20.344 -12.720 -15.219 1.00 5.44 C ATOM 1868 OE1 GLU A 431 -20.777 -13.609 -15.978 1.00 0.45 O ATOM 1869 OE2 GLU A 431 -20.703 -12.634 -14.023 1.00 43.45 O ATOM 0 H GLU A 431 -17.327 -11.761 -17.767 1.00 23.43 H new ATOM 0 HA GLU A 431 -17.063 -10.104 -15.494 1.00 73.51 H new ATOM 0 HB2 GLU A 431 -17.652 -13.086 -15.780 1.00 21.01 H new ATOM 0 HB3 GLU A 431 -17.817 -12.189 -14.284 1.00 21.01 H new ATOM 0 HG2 GLU A 431 -19.538 -10.725 -15.373 1.00 3.32 H new ATOM 0 HG3 GLU A 431 -19.391 -11.668 -16.843 1.00 3.32 H new ATOM 1876 N THR A 432 -14.883 -12.632 -15.685 1.00 75.11 N ATOM 1877 CA THR A 432 -13.630 -13.170 -15.117 1.00 43.24 C ATOM 1878 C THR A 432 -12.425 -12.234 -15.382 1.00 12.44 C ATOM 1879 O THR A 432 -11.609 -12.006 -14.479 1.00 45.21 O ATOM 1880 CB THR A 432 -13.321 -14.622 -15.621 1.00 52.04 C ATOM 1881 OG1 THR A 432 -12.181 -15.157 -14.919 1.00 2.32 O ATOM 1882 CG2 THR A 432 -13.067 -14.688 -17.136 1.00 35.40 C ATOM 0 H THR A 432 -15.293 -13.216 -16.414 1.00 75.11 H new ATOM 0 HA THR A 432 -13.786 -13.222 -14.039 1.00 43.24 H new ATOM 0 HB THR A 432 -14.208 -15.221 -15.414 1.00 52.04 H new ATOM 0 HG1 THR A 432 -11.996 -16.065 -15.239 1.00 2.32 H new ATOM 0 HG21 THR A 432 -12.859 -15.718 -17.425 1.00 35.40 H new ATOM 0 HG22 THR A 432 -13.949 -14.333 -17.669 1.00 35.40 H new ATOM 0 HG23 THR A 432 -12.213 -14.060 -17.389 1.00 35.40 H new ATOM 1890 N VAL A 433 -12.353 -11.662 -16.606 1.00 51.10 N ATOM 1891 CA VAL A 433 -11.289 -10.715 -16.984 1.00 4.52 C ATOM 1892 C VAL A 433 -11.433 -9.410 -16.186 1.00 12.21 C ATOM 1893 O VAL A 433 -10.435 -8.833 -15.773 1.00 3.42 O ATOM 1894 CB VAL A 433 -11.284 -10.412 -18.535 1.00 54.03 C ATOM 1895 CG1 VAL A 433 -10.254 -9.320 -18.914 1.00 0.14 C ATOM 1896 CG2 VAL A 433 -11.028 -11.700 -19.349 1.00 31.01 C ATOM 0 H VAL A 433 -13.026 -11.844 -17.350 1.00 51.10 H new ATOM 0 HA VAL A 433 -10.335 -11.183 -16.743 1.00 4.52 H new ATOM 0 HB VAL A 433 -12.273 -10.029 -18.786 1.00 54.03 H new ATOM 0 HG11 VAL A 433 -10.287 -9.146 -19.990 1.00 0.14 H new ATOM 0 HG12 VAL A 433 -10.494 -8.395 -18.389 1.00 0.14 H new ATOM 0 HG13 VAL A 433 -9.254 -9.649 -18.630 1.00 0.14 H new ATOM 0 HG21 VAL A 433 -11.029 -11.464 -20.413 1.00 31.01 H new ATOM 0 HG22 VAL A 433 -10.061 -12.120 -19.072 1.00 31.01 H new ATOM 0 HG23 VAL A 433 -11.813 -12.426 -19.137 1.00 31.01 H new ATOM 1906 N ALA A 434 -12.692 -8.984 -15.949 1.00 61.22 N ATOM 1907 CA ALA A 434 -13.001 -7.782 -15.154 1.00 42.33 C ATOM 1908 C ALA A 434 -12.537 -7.938 -13.703 1.00 0.02 C ATOM 1909 O ALA A 434 -12.095 -6.966 -13.092 1.00 21.30 O ATOM 1910 CB ALA A 434 -14.504 -7.469 -15.188 1.00 53.13 C ATOM 0 H ALA A 434 -13.519 -9.464 -16.304 1.00 61.22 H new ATOM 0 HA ALA A 434 -12.458 -6.951 -15.604 1.00 42.33 H new ATOM 0 HB1 ALA A 434 -14.704 -6.578 -14.593 1.00 53.13 H new ATOM 0 HB2 ALA A 434 -14.816 -7.296 -16.218 1.00 53.13 H new ATOM 0 HB3 ALA A 434 -15.060 -8.311 -14.777 1.00 53.13 H new ATOM 1916 N ARG A 435 -12.648 -9.174 -13.159 1.00 21.51 N ATOM 1917 CA ARG A 435 -12.220 -9.478 -11.781 1.00 42.43 C ATOM 1918 C ARG A 435 -10.691 -9.385 -11.681 1.00 21.14 C ATOM 1919 O ARG A 435 -10.169 -8.728 -10.785 1.00 4.41 O ATOM 1920 CB ARG A 435 -12.710 -10.883 -11.318 1.00 43.32 C ATOM 1921 CG ARG A 435 -14.234 -11.119 -11.441 1.00 62.41 C ATOM 1922 CD ARG A 435 -15.091 -10.036 -10.753 1.00 22.24 C ATOM 1923 NE ARG A 435 -16.537 -10.257 -10.957 1.00 31.15 N ATOM 1924 CZ ARG A 435 -17.463 -9.296 -11.096 1.00 73.12 C ATOM 1925 NH1 ARG A 435 -17.136 -8.000 -11.053 1.00 30.31 N ATOM 1926 NH2 ARG A 435 -18.729 -9.635 -11.274 1.00 50.21 N ATOM 0 H ARG A 435 -13.032 -9.976 -13.659 1.00 21.51 H new ATOM 0 HA ARG A 435 -12.674 -8.742 -11.117 1.00 42.43 H new ATOM 0 HB2 ARG A 435 -12.192 -11.643 -11.903 1.00 43.32 H new ATOM 0 HB3 ARG A 435 -12.418 -11.028 -10.278 1.00 43.32 H new ATOM 0 HG2 ARG A 435 -14.501 -11.163 -12.497 1.00 62.41 H new ATOM 0 HG3 ARG A 435 -14.478 -12.090 -11.009 1.00 62.41 H new ATOM 0 HD2 ARG A 435 -14.874 -10.027 -9.685 1.00 22.24 H new ATOM 0 HD3 ARG A 435 -14.816 -9.056 -11.143 1.00 22.24 H new ATOM 0 HE ARG A 435 -16.860 -11.224 -10.996 1.00 31.15 H new ATOM 0 HH11 ARG A 435 -16.164 -7.724 -10.912 1.00 30.31 H new ATOM 0 HH12 ARG A 435 -17.858 -7.288 -11.161 1.00 30.31 H new ATOM 0 HH21 ARG A 435 -18.994 -10.620 -11.305 1.00 50.21 H new ATOM 0 HH22 ARG A 435 -19.440 -8.912 -11.381 1.00 50.21 H new ATOM 1940 N TYR A 436 -9.987 -10.015 -12.645 1.00 40.13 N ATOM 1941 CA TYR A 436 -8.508 -9.976 -12.710 1.00 64.32 C ATOM 1942 C TYR A 436 -7.998 -8.544 -12.943 1.00 43.34 C ATOM 1943 O TYR A 436 -6.973 -8.156 -12.389 1.00 0.13 O ATOM 1944 CB TYR A 436 -7.966 -10.904 -13.824 1.00 63.24 C ATOM 1945 CG TYR A 436 -8.186 -12.398 -13.573 1.00 73.32 C ATOM 1946 CD1 TYR A 436 -7.801 -12.986 -12.364 1.00 71.51 C ATOM 1947 CD2 TYR A 436 -8.753 -13.224 -14.543 1.00 62.43 C ATOM 1948 CE1 TYR A 436 -7.977 -14.337 -12.136 1.00 42.23 C ATOM 1949 CE2 TYR A 436 -8.932 -14.573 -14.316 1.00 55.12 C ATOM 1950 CZ TYR A 436 -8.544 -15.125 -13.116 1.00 14.32 C ATOM 1951 OH TYR A 436 -8.723 -16.477 -12.892 1.00 53.52 O ATOM 0 H TYR A 436 -10.419 -10.559 -13.392 1.00 40.13 H new ATOM 0 HA TYR A 436 -8.139 -10.331 -11.748 1.00 64.32 H new ATOM 0 HB2 TYR A 436 -8.441 -10.634 -14.767 1.00 63.24 H new ATOM 0 HB3 TYR A 436 -6.898 -10.722 -13.942 1.00 63.24 H new ATOM 0 HD1 TYR A 436 -7.358 -12.372 -11.594 1.00 71.51 H new ATOM 0 HD2 TYR A 436 -9.057 -12.800 -15.489 1.00 62.43 H new ATOM 0 HE1 TYR A 436 -7.673 -14.774 -11.196 1.00 42.23 H new ATOM 0 HE2 TYR A 436 -9.376 -15.195 -15.079 1.00 55.12 H new ATOM 0 HH TYR A 436 -9.135 -16.887 -13.681 1.00 53.52 H new ATOM 1961 N LYS A 437 -8.736 -7.785 -13.768 1.00 74.50 N ATOM 1962 CA LYS A 437 -8.411 -6.390 -14.126 1.00 24.24 C ATOM 1963 C LYS A 437 -8.655 -5.463 -12.929 1.00 73.41 C ATOM 1964 O LYS A 437 -7.926 -4.488 -12.736 1.00 13.53 O ATOM 1965 CB LYS A 437 -9.252 -5.948 -15.361 1.00 60.33 C ATOM 1966 CG LYS A 437 -9.044 -4.489 -15.834 1.00 2.52 C ATOM 1967 CD LYS A 437 -9.904 -4.143 -17.081 1.00 3.52 C ATOM 1968 CE LYS A 437 -9.871 -2.645 -17.429 1.00 64.15 C ATOM 1969 NZ LYS A 437 -10.521 -1.809 -16.383 1.00 75.15 N ATOM 0 H LYS A 437 -9.588 -8.125 -14.213 1.00 74.50 H new ATOM 0 HA LYS A 437 -7.356 -6.325 -14.391 1.00 24.24 H new ATOM 0 HB2 LYS A 437 -9.020 -6.615 -16.191 1.00 60.33 H new ATOM 0 HB3 LYS A 437 -10.307 -6.086 -15.126 1.00 60.33 H new ATOM 0 HG2 LYS A 437 -9.296 -3.807 -15.022 1.00 2.52 H new ATOM 0 HG3 LYS A 437 -7.991 -4.332 -16.067 1.00 2.52 H new ATOM 0 HD2 LYS A 437 -9.546 -4.718 -17.935 1.00 3.52 H new ATOM 0 HD3 LYS A 437 -10.935 -4.447 -16.902 1.00 3.52 H new ATOM 0 HE2 LYS A 437 -8.836 -2.326 -17.555 1.00 64.15 H new ATOM 0 HE3 LYS A 437 -10.373 -2.485 -18.383 1.00 64.15 H new ATOM 0 HZ1 LYS A 437 -10.642 -0.840 -16.739 1.00 75.15 H new ATOM 0 HZ2 LYS A 437 -11.451 -2.210 -16.146 1.00 75.15 H new ATOM 0 HZ3 LYS A 437 -9.924 -1.793 -15.531 1.00 75.15 H new ATOM 1983 N ALA A 438 -9.681 -5.793 -12.120 1.00 11.05 N ATOM 1984 CA ALA A 438 -9.978 -5.069 -10.880 1.00 51.13 C ATOM 1985 C ALA A 438 -8.832 -5.257 -9.889 1.00 1.13 C ATOM 1986 O ALA A 438 -8.211 -4.290 -9.462 1.00 43.34 O ATOM 1987 CB ALA A 438 -11.308 -5.538 -10.266 1.00 32.14 C ATOM 0 H ALA A 438 -10.320 -6.565 -12.311 1.00 11.05 H new ATOM 0 HA ALA A 438 -10.080 -4.009 -11.113 1.00 51.13 H new ATOM 0 HB1 ALA A 438 -11.501 -4.983 -9.348 1.00 32.14 H new ATOM 0 HB2 ALA A 438 -12.118 -5.361 -10.974 1.00 32.14 H new ATOM 0 HB3 ALA A 438 -11.249 -6.603 -10.041 1.00 32.14 H new ATOM 1993 N GLN A 439 -8.520 -6.530 -9.594 1.00 75.30 N ATOM 1994 CA GLN A 439 -7.476 -6.902 -8.623 1.00 64.52 C ATOM 1995 C GLN A 439 -6.099 -6.385 -9.080 1.00 51.41 C ATOM 1996 O GLN A 439 -5.285 -5.949 -8.255 1.00 31.32 O ATOM 1997 CB GLN A 439 -7.461 -8.444 -8.426 1.00 52.03 C ATOM 1998 CG GLN A 439 -8.812 -9.052 -7.998 1.00 72.25 C ATOM 1999 CD GLN A 439 -9.383 -8.456 -6.715 1.00 43.33 C ATOM 2000 OE1 GLN A 439 -9.136 -8.950 -5.628 1.00 34.51 O ATOM 2001 NE2 GLN A 439 -10.150 -7.383 -6.838 1.00 21.35 N ATOM 0 H GLN A 439 -8.984 -7.331 -10.022 1.00 75.30 H new ATOM 0 HA GLN A 439 -7.702 -6.435 -7.664 1.00 64.52 H new ATOM 0 HB2 GLN A 439 -7.146 -8.913 -9.358 1.00 52.03 H new ATOM 0 HB3 GLN A 439 -6.712 -8.693 -7.675 1.00 52.03 H new ATOM 0 HG2 GLN A 439 -9.533 -8.912 -8.803 1.00 72.25 H new ATOM 0 HG3 GLN A 439 -8.689 -10.127 -7.864 1.00 72.25 H new ATOM 0 HE21 GLN A 439 -10.338 -6.994 -7.762 1.00 21.35 H new ATOM 0 HE22 GLN A 439 -10.553 -6.946 -6.009 1.00 21.35 H new ATOM 2010 N PHE A 440 -5.876 -6.391 -10.416 1.00 33.22 N ATOM 2011 CA PHE A 440 -4.633 -5.888 -11.007 1.00 25.41 C ATOM 2012 C PHE A 440 -4.500 -4.381 -10.757 1.00 2.51 C ATOM 2013 O PHE A 440 -3.629 -3.971 -10.003 1.00 45.41 O ATOM 2014 CB PHE A 440 -4.544 -6.186 -12.526 1.00 64.33 C ATOM 2015 CG PHE A 440 -3.217 -5.756 -13.158 1.00 61.14 C ATOM 2016 CD1 PHE A 440 -2.030 -6.408 -12.817 1.00 53.23 C ATOM 2017 CD2 PHE A 440 -3.148 -4.696 -14.072 1.00 51.11 C ATOM 2018 CE1 PHE A 440 -0.825 -6.018 -13.367 1.00 51.44 C ATOM 2019 CE2 PHE A 440 -1.937 -4.310 -14.623 1.00 13.14 C ATOM 2020 CZ PHE A 440 -0.777 -4.970 -14.267 1.00 24.43 C ATOM 0 H PHE A 440 -6.548 -6.742 -11.098 1.00 33.22 H new ATOM 0 HA PHE A 440 -3.809 -6.412 -10.523 1.00 25.41 H new ATOM 0 HB2 PHE A 440 -4.684 -7.255 -12.687 1.00 64.33 H new ATOM 0 HB3 PHE A 440 -5.362 -5.677 -13.036 1.00 64.33 H new ATOM 0 HD1 PHE A 440 -2.055 -7.228 -12.114 1.00 53.23 H new ATOM 0 HD2 PHE A 440 -4.051 -4.173 -14.351 1.00 51.11 H new ATOM 0 HE1 PHE A 440 0.083 -6.534 -13.093 1.00 51.44 H new ATOM 0 HE2 PHE A 440 -1.900 -3.494 -15.330 1.00 13.14 H new ATOM 0 HZ PHE A 440 0.168 -4.667 -14.692 1.00 24.43 H new ATOM 2030 N THR A 441 -5.434 -3.587 -11.328 1.00 41.11 N ATOM 2031 CA THR A 441 -5.368 -2.113 -11.328 1.00 63.15 C ATOM 2032 C THR A 441 -5.367 -1.531 -9.901 1.00 74.31 C ATOM 2033 O THR A 441 -4.625 -0.593 -9.611 1.00 4.23 O ATOM 2034 CB THR A 441 -6.570 -1.507 -12.130 1.00 5.21 C ATOM 2035 OG1 THR A 441 -6.617 -2.084 -13.445 1.00 43.04 O ATOM 2036 CG2 THR A 441 -6.503 0.029 -12.257 1.00 42.51 C ATOM 0 H THR A 441 -6.258 -3.956 -11.803 1.00 41.11 H new ATOM 0 HA THR A 441 -4.428 -1.841 -11.808 1.00 63.15 H new ATOM 0 HB THR A 441 -7.472 -1.747 -11.567 1.00 5.21 H new ATOM 0 HG1 THR A 441 -7.039 -2.967 -13.400 1.00 43.04 H new ATOM 0 HG21 THR A 441 -7.364 0.385 -12.823 1.00 42.51 H new ATOM 0 HG22 THR A 441 -6.511 0.477 -11.263 1.00 42.51 H new ATOM 0 HG23 THR A 441 -5.586 0.312 -12.775 1.00 42.51 H new ATOM 2044 N GLN A 442 -6.192 -2.126 -9.027 1.00 44.01 N ATOM 2045 CA GLN A 442 -6.368 -1.674 -7.633 1.00 33.04 C ATOM 2046 C GLN A 442 -5.098 -1.920 -6.801 1.00 34.21 C ATOM 2047 O GLN A 442 -4.593 -0.995 -6.163 1.00 4.21 O ATOM 2048 CB GLN A 442 -7.595 -2.374 -7.007 1.00 45.31 C ATOM 2049 CG GLN A 442 -8.955 -1.912 -7.583 1.00 72.10 C ATOM 2050 CD GLN A 442 -10.156 -2.761 -7.134 1.00 44.42 C ATOM 2051 OE1 GLN A 442 -11.258 -2.249 -6.952 1.00 62.31 O ATOM 2052 NE2 GLN A 442 -9.973 -4.070 -7.008 1.00 13.43 N ATOM 0 H GLN A 442 -6.760 -2.939 -9.266 1.00 44.01 H new ATOM 0 HA GLN A 442 -6.545 -0.598 -7.635 1.00 33.04 H new ATOM 0 HB2 GLN A 442 -7.499 -3.450 -7.153 1.00 45.31 H new ATOM 0 HB3 GLN A 442 -7.590 -2.197 -5.932 1.00 45.31 H new ATOM 0 HG2 GLN A 442 -9.127 -0.877 -7.289 1.00 72.10 H new ATOM 0 HG3 GLN A 442 -8.900 -1.930 -8.671 1.00 72.10 H new ATOM 0 HE21 GLN A 442 -9.049 -4.473 -7.164 1.00 13.43 H new ATOM 0 HE22 GLN A 442 -10.756 -4.672 -6.755 1.00 13.43 H new ATOM 2061 N LEU A 443 -4.564 -3.162 -6.841 1.00 21.22 N ATOM 2062 CA LEU A 443 -3.318 -3.505 -6.115 1.00 50.54 C ATOM 2063 C LEU A 443 -2.078 -2.861 -6.800 1.00 5.13 C ATOM 2064 O LEU A 443 -1.037 -2.707 -6.163 1.00 42.12 O ATOM 2065 CB LEU A 443 -3.136 -5.055 -5.984 1.00 34.24 C ATOM 2066 CG LEU A 443 -3.992 -5.817 -4.905 1.00 2.23 C ATOM 2067 CD1 LEU A 443 -5.513 -5.605 -5.082 1.00 14.33 C ATOM 2068 CD2 LEU A 443 -3.649 -7.331 -4.906 1.00 14.44 C ATOM 0 H LEU A 443 -4.971 -3.938 -7.363 1.00 21.22 H new ATOM 0 HA LEU A 443 -3.404 -3.095 -5.109 1.00 50.54 H new ATOM 0 HB2 LEU A 443 -3.354 -5.499 -6.955 1.00 34.24 H new ATOM 0 HB3 LEU A 443 -2.085 -5.250 -5.773 1.00 34.24 H new ATOM 0 HG LEU A 443 -3.727 -5.389 -3.938 1.00 2.23 H new ATOM 0 HD11 LEU A 443 -6.049 -6.155 -4.309 1.00 14.33 H new ATOM 0 HD12 LEU A 443 -5.744 -4.543 -4.999 1.00 14.33 H new ATOM 0 HD13 LEU A 443 -5.819 -5.967 -6.063 1.00 14.33 H new ATOM 0 HD21 LEU A 443 -4.251 -7.841 -4.154 1.00 14.44 H new ATOM 0 HD22 LEU A 443 -3.863 -7.752 -5.888 1.00 14.44 H new ATOM 0 HD23 LEU A 443 -2.592 -7.465 -4.677 1.00 14.44 H new ATOM 2080 N ASP A 444 -2.212 -2.490 -8.097 1.00 64.22 N ATOM 2081 CA ASP A 444 -1.130 -1.856 -8.895 1.00 23.42 C ATOM 2082 C ASP A 444 -0.991 -0.370 -8.550 1.00 54.51 C ATOM 2083 O ASP A 444 0.127 0.125 -8.387 1.00 60.13 O ATOM 2084 CB ASP A 444 -1.384 -2.035 -10.423 1.00 21.01 C ATOM 2085 CG ASP A 444 -0.411 -1.256 -11.330 1.00 14.32 C ATOM 2086 OD1 ASP A 444 -0.846 -0.335 -12.054 1.00 3.54 O ATOM 2087 OD2 ASP A 444 0.800 -1.545 -11.305 1.00 42.43 O ATOM 0 H ASP A 444 -3.076 -2.622 -8.622 1.00 64.22 H new ATOM 0 HA ASP A 444 -0.196 -2.357 -8.641 1.00 23.42 H new ATOM 0 HB2 ASP A 444 -1.318 -3.095 -10.667 1.00 21.01 H new ATOM 0 HB3 ASP A 444 -2.402 -1.719 -10.648 1.00 21.01 H new ATOM 2092 N THR A 445 -2.131 0.344 -8.445 1.00 44.02 N ATOM 2093 CA THR A 445 -2.129 1.764 -8.048 1.00 34.03 C ATOM 2094 C THR A 445 -1.797 1.878 -6.554 1.00 64.21 C ATOM 2095 O THR A 445 -1.126 2.830 -6.140 1.00 61.02 O ATOM 2096 CB THR A 445 -3.471 2.516 -8.381 1.00 73.23 C ATOM 2097 OG1 THR A 445 -3.341 3.921 -8.077 1.00 24.20 O ATOM 2098 CG2 THR A 445 -4.687 1.958 -7.623 1.00 13.32 C ATOM 0 H THR A 445 -3.059 -0.038 -8.629 1.00 44.02 H new ATOM 0 HA THR A 445 -1.361 2.259 -8.642 1.00 34.03 H new ATOM 0 HB THR A 445 -3.648 2.362 -9.445 1.00 73.23 H new ATOM 0 HG1 THR A 445 -4.180 4.381 -8.289 1.00 24.20 H new ATOM 0 HG21 THR A 445 -5.578 2.522 -7.899 1.00 13.32 H new ATOM 0 HG22 THR A 445 -4.827 0.908 -7.882 1.00 13.32 H new ATOM 0 HG23 THR A 445 -4.519 2.048 -6.550 1.00 13.32 H new ATOM 2106 N MET A 446 -2.238 0.865 -5.769 1.00 60.24 N ATOM 2107 CA MET A 446 -1.861 0.723 -4.359 1.00 24.54 C ATOM 2108 C MET A 446 -0.344 0.558 -4.254 1.00 31.03 C ATOM 2109 O MET A 446 0.279 1.198 -3.420 1.00 72.13 O ATOM 2110 CB MET A 446 -2.565 -0.494 -3.690 1.00 10.15 C ATOM 2111 CG MET A 446 -2.310 -0.599 -2.180 1.00 21.30 C ATOM 2112 SD MET A 446 -3.089 -2.031 -1.405 1.00 2.05 S ATOM 2113 CE MET A 446 -2.710 -1.732 0.326 1.00 41.20 C ATOM 0 H MET A 446 -2.862 0.131 -6.103 1.00 60.24 H new ATOM 0 HA MET A 446 -2.182 1.622 -3.833 1.00 24.54 H new ATOM 0 HB2 MET A 446 -3.639 -0.423 -3.864 1.00 10.15 H new ATOM 0 HB3 MET A 446 -2.224 -1.410 -4.172 1.00 10.15 H new ATOM 0 HG2 MET A 446 -1.235 -0.643 -2.005 1.00 21.30 H new ATOM 0 HG3 MET A 446 -2.675 0.307 -1.696 1.00 21.30 H new ATOM 0 HE1 MET A 446 -3.396 -2.302 0.952 1.00 41.20 H new ATOM 0 HE2 MET A 446 -1.686 -2.043 0.533 1.00 41.20 H new ATOM 0 HE3 MET A 446 -2.817 -0.669 0.544 1.00 41.20 H new ATOM 2123 N MET A 447 0.229 -0.287 -5.148 1.00 51.12 N ATOM 2124 CA MET A 447 1.675 -0.584 -5.176 1.00 44.42 C ATOM 2125 C MET A 447 2.498 0.652 -5.531 1.00 15.45 C ATOM 2126 O MET A 447 3.481 0.939 -4.863 1.00 3.42 O ATOM 2127 CB MET A 447 2.029 -1.737 -6.147 1.00 5.20 C ATOM 2128 CG MET A 447 3.545 -2.013 -6.272 1.00 1.31 C ATOM 2129 SD MET A 447 3.911 -3.474 -7.251 1.00 75.00 S ATOM 2130 CE MET A 447 3.164 -4.724 -6.221 1.00 23.52 C ATOM 0 H MET A 447 -0.302 -0.779 -5.867 1.00 51.12 H new ATOM 0 HA MET A 447 1.929 -0.904 -4.166 1.00 44.42 H new ATOM 0 HB2 MET A 447 1.531 -2.647 -5.811 1.00 5.20 H new ATOM 0 HB3 MET A 447 1.631 -1.502 -7.134 1.00 5.20 H new ATOM 0 HG2 MET A 447 4.031 -1.148 -6.724 1.00 1.31 H new ATOM 0 HG3 MET A 447 3.971 -2.133 -5.276 1.00 1.31 H new ATOM 0 HE1 MET A 447 3.042 -5.643 -6.794 1.00 23.52 H new ATOM 0 HE2 MET A 447 3.804 -4.916 -5.360 1.00 23.52 H new ATOM 0 HE3 MET A 447 2.189 -4.378 -5.879 1.00 23.52 H new ATOM 2140 N SER A 448 2.084 1.375 -6.589 1.00 41.12 N ATOM 2141 CA SER A 448 2.789 2.580 -7.064 1.00 62.05 C ATOM 2142 C SER A 448 2.859 3.642 -5.947 1.00 53.42 C ATOM 2143 O SER A 448 3.907 4.279 -5.726 1.00 53.03 O ATOM 2144 CB SER A 448 2.075 3.156 -8.307 1.00 30.14 C ATOM 2145 OG SER A 448 1.909 2.162 -9.311 1.00 21.45 O ATOM 0 H SER A 448 1.255 1.141 -7.136 1.00 41.12 H new ATOM 0 HA SER A 448 3.807 2.302 -7.339 1.00 62.05 H new ATOM 0 HB2 SER A 448 1.101 3.552 -8.019 1.00 30.14 H new ATOM 0 HB3 SER A 448 2.652 3.989 -8.708 1.00 30.14 H new ATOM 0 HG SER A 448 1.216 1.528 -9.032 1.00 21.45 H new ATOM 2151 N LYS A 449 1.729 3.781 -5.224 1.00 50.33 N ATOM 2152 CA LYS A 449 1.623 4.692 -4.085 1.00 71.33 C ATOM 2153 C LYS A 449 2.477 4.193 -2.911 1.00 51.45 C ATOM 2154 O LYS A 449 3.293 4.945 -2.407 1.00 25.13 O ATOM 2155 CB LYS A 449 0.139 4.904 -3.664 1.00 42.10 C ATOM 2156 CG LYS A 449 -0.708 5.635 -4.732 1.00 22.30 C ATOM 2157 CD LYS A 449 -2.151 5.960 -4.267 1.00 42.35 C ATOM 2158 CE LYS A 449 -2.199 6.973 -3.104 1.00 22.14 C ATOM 2159 NZ LYS A 449 -3.597 7.378 -2.773 1.00 1.02 N ATOM 0 H LYS A 449 0.872 3.263 -5.419 1.00 50.33 H new ATOM 0 HA LYS A 449 2.011 5.663 -4.392 1.00 71.33 H new ATOM 0 HB2 LYS A 449 -0.313 3.934 -3.455 1.00 42.10 H new ATOM 0 HB3 LYS A 449 0.111 5.475 -2.736 1.00 42.10 H new ATOM 0 HG2 LYS A 449 -0.207 6.563 -5.008 1.00 22.30 H new ATOM 0 HG3 LYS A 449 -0.755 5.019 -5.630 1.00 22.30 H new ATOM 0 HD2 LYS A 449 -2.717 6.357 -5.110 1.00 42.35 H new ATOM 0 HD3 LYS A 449 -2.643 5.038 -3.958 1.00 42.35 H new ATOM 0 HE2 LYS A 449 -1.730 6.536 -2.223 1.00 22.14 H new ATOM 0 HE3 LYS A 449 -1.618 7.857 -3.369 1.00 22.14 H new ATOM 0 HZ1 LYS A 449 -3.598 7.936 -1.895 1.00 1.02 H new ATOM 0 HZ2 LYS A 449 -3.985 7.952 -3.549 1.00 1.02 H new ATOM 0 HZ3 LYS A 449 -4.183 6.529 -2.644 1.00 1.02 H new ATOM 2173 N LEU A 450 2.341 2.897 -2.538 1.00 24.12 N ATOM 2174 CA LEU A 450 3.010 2.340 -1.335 1.00 44.11 C ATOM 2175 C LEU A 450 4.530 2.183 -1.551 1.00 3.03 C ATOM 2176 O LEU A 450 5.294 2.080 -0.593 1.00 44.32 O ATOM 2177 CB LEU A 450 2.328 1.020 -0.818 1.00 53.22 C ATOM 2178 CG LEU A 450 2.470 -0.325 -1.633 1.00 5.30 C ATOM 2179 CD1 LEU A 450 3.843 -1.029 -1.462 1.00 63.41 C ATOM 2180 CD2 LEU A 450 1.324 -1.306 -1.277 1.00 74.11 C ATOM 0 H LEU A 450 1.776 2.219 -3.050 1.00 24.12 H new ATOM 0 HA LEU A 450 2.880 3.069 -0.535 1.00 44.11 H new ATOM 0 HB2 LEU A 450 2.711 0.831 0.185 1.00 53.22 H new ATOM 0 HB3 LEU A 450 1.262 1.226 -0.719 1.00 53.22 H new ATOM 0 HG LEU A 450 2.402 -0.037 -2.682 1.00 5.30 H new ATOM 0 HD11 LEU A 450 3.859 -1.944 -2.054 1.00 63.41 H new ATOM 0 HD12 LEU A 450 4.638 -0.364 -1.801 1.00 63.41 H new ATOM 0 HD13 LEU A 450 3.998 -1.274 -0.411 1.00 63.41 H new ATOM 0 HD21 LEU A 450 1.441 -2.226 -1.850 1.00 74.11 H new ATOM 0 HD22 LEU A 450 1.359 -1.535 -0.212 1.00 74.11 H new ATOM 0 HD23 LEU A 450 0.365 -0.848 -1.519 1.00 74.11 H new ATOM 2192 N ASN A 451 4.947 2.164 -2.826 1.00 72.21 N ATOM 2193 CA ASN A 451 6.366 2.125 -3.226 1.00 32.44 C ATOM 2194 C ASN A 451 6.983 3.520 -3.039 1.00 64.24 C ATOM 2195 O ASN A 451 8.064 3.663 -2.446 1.00 31.43 O ATOM 2196 CB ASN A 451 6.497 1.645 -4.702 1.00 50.42 C ATOM 2197 CG ASN A 451 7.936 1.666 -5.235 1.00 15.40 C ATOM 2198 OD1 ASN A 451 8.675 0.691 -5.101 1.00 70.41 O ATOM 2199 ND2 ASN A 451 8.342 2.775 -5.831 1.00 15.21 N ATOM 0 H ASN A 451 4.304 2.175 -3.618 1.00 72.21 H new ATOM 0 HA ASN A 451 6.906 1.416 -2.598 1.00 32.44 H new ATOM 0 HB2 ASN A 451 6.105 0.631 -4.781 1.00 50.42 H new ATOM 0 HB3 ASN A 451 5.875 2.277 -5.336 1.00 50.42 H new ATOM 0 HD21 ASN A 451 9.292 2.839 -6.195 1.00 15.21 H new ATOM 0 HD22 ASN A 451 7.705 3.566 -5.926 1.00 15.21 H new ATOM 2206 N ASN A 452 6.264 4.545 -3.561 1.00 34.33 N ATOM 2207 CA ASN A 452 6.671 5.960 -3.452 1.00 34.40 C ATOM 2208 C ASN A 452 6.669 6.410 -1.979 1.00 1.11 C ATOM 2209 O ASN A 452 7.563 7.158 -1.544 1.00 41.24 O ATOM 2210 CB ASN A 452 5.735 6.870 -4.297 1.00 61.00 C ATOM 2211 CG ASN A 452 6.140 8.357 -4.293 1.00 42.12 C ATOM 2212 OD1 ASN A 452 7.321 8.701 -4.199 1.00 60.23 O ATOM 2213 ND2 ASN A 452 5.164 9.248 -4.395 1.00 52.41 N ATOM 0 H ASN A 452 5.389 4.410 -4.067 1.00 34.33 H new ATOM 0 HA ASN A 452 7.684 6.053 -3.843 1.00 34.40 H new ATOM 0 HB2 ASN A 452 5.725 6.509 -5.325 1.00 61.00 H new ATOM 0 HB3 ASN A 452 4.717 6.780 -3.918 1.00 61.00 H new ATOM 0 HD21 ASN A 452 5.381 10.245 -4.397 1.00 52.41 H new ATOM 0 HD22 ASN A 452 4.196 8.937 -4.472 1.00 52.41 H new ATOM 2220 N THR A 453 5.672 5.929 -1.207 1.00 33.41 N ATOM 2221 CA THR A 453 5.547 6.256 0.212 1.00 11.24 C ATOM 2222 C THR A 453 6.729 5.660 0.977 1.00 53.44 C ATOM 2223 O THR A 453 7.520 6.421 1.505 1.00 23.01 O ATOM 2224 CB THR A 453 4.198 5.785 0.846 1.00 62.43 C ATOM 2225 OG1 THR A 453 4.050 4.399 0.641 1.00 73.43 O ATOM 2226 CG2 THR A 453 2.974 6.512 0.266 1.00 25.21 C ATOM 0 H THR A 453 4.941 5.309 -1.555 1.00 33.41 H new ATOM 0 HA THR A 453 5.552 7.343 0.289 1.00 11.24 H new ATOM 0 HB THR A 453 4.242 6.025 1.908 1.00 62.43 H new ATOM 0 HG1 THR A 453 3.502 4.019 1.359 1.00 73.43 H new ATOM 0 HG21 THR A 453 2.069 6.141 0.747 1.00 25.21 H new ATOM 0 HG22 THR A 453 3.068 7.583 0.446 1.00 25.21 H new ATOM 0 HG23 THR A 453 2.916 6.329 -0.807 1.00 25.21 H new ATOM 2234 N SER A 454 6.889 4.306 0.946 1.00 72.23 N ATOM 2235 CA SER A 454 7.975 3.590 1.669 1.00 42.31 C ATOM 2236 C SER A 454 9.365 4.170 1.350 1.00 74.44 C ATOM 2237 O SER A 454 10.262 4.136 2.198 1.00 34.30 O ATOM 2238 CB SER A 454 7.953 2.076 1.354 1.00 75.14 C ATOM 2239 OG SER A 454 8.113 1.833 -0.031 1.00 31.55 O ATOM 0 H SER A 454 6.272 3.686 0.422 1.00 72.23 H new ATOM 0 HA SER A 454 7.786 3.734 2.733 1.00 42.31 H new ATOM 0 HB2 SER A 454 8.749 1.577 1.907 1.00 75.14 H new ATOM 0 HB3 SER A 454 7.011 1.646 1.694 1.00 75.14 H new ATOM 0 HG SER A 454 7.240 1.881 -0.474 1.00 31.55 H new ATOM 2245 N SER A 455 9.514 4.709 0.118 1.00 32.33 N ATOM 2246 CA SER A 455 10.701 5.466 -0.294 1.00 31.31 C ATOM 2247 C SER A 455 10.914 6.694 0.630 1.00 63.23 C ATOM 2248 O SER A 455 11.872 6.722 1.420 1.00 2.02 O ATOM 2249 CB SER A 455 10.571 5.901 -1.774 1.00 41.31 C ATOM 2250 OG SER A 455 11.683 6.667 -2.195 1.00 14.25 O ATOM 0 H SER A 455 8.809 4.627 -0.614 1.00 32.33 H new ATOM 0 HA SER A 455 11.576 4.822 -0.202 1.00 31.31 H new ATOM 0 HB2 SER A 455 10.478 5.018 -2.406 1.00 41.31 H new ATOM 0 HB3 SER A 455 9.659 6.483 -1.903 1.00 41.31 H new ATOM 0 HG SER A 455 11.568 6.922 -3.134 1.00 14.25 H new ATOM 2256 N TYR A 456 9.991 7.686 0.580 1.00 54.44 N ATOM 2257 CA TYR A 456 10.158 8.931 1.366 1.00 14.03 C ATOM 2258 C TYR A 456 9.955 8.717 2.886 1.00 34.32 C ATOM 2259 O TYR A 456 10.422 9.529 3.686 1.00 33.40 O ATOM 2260 CB TYR A 456 9.309 10.120 0.818 1.00 62.41 C ATOM 2261 CG TYR A 456 7.777 9.964 0.727 1.00 62.12 C ATOM 2262 CD1 TYR A 456 6.981 9.791 1.865 1.00 74.41 C ATOM 2263 CD2 TYR A 456 7.118 10.073 -0.504 1.00 50.21 C ATOM 2264 CE1 TYR A 456 5.604 9.730 1.773 1.00 33.43 C ATOM 2265 CE2 TYR A 456 5.743 9.999 -0.594 1.00 64.10 C ATOM 2266 CZ TYR A 456 4.993 9.829 0.547 1.00 64.42 C ATOM 2267 OH TYR A 456 3.621 9.781 0.463 1.00 64.42 O ATOM 0 H TYR A 456 9.142 7.650 0.016 1.00 54.44 H new ATOM 0 HA TYR A 456 11.201 9.218 1.234 1.00 14.03 H new ATOM 0 HB2 TYR A 456 9.515 10.988 1.444 1.00 62.41 H new ATOM 0 HB3 TYR A 456 9.676 10.354 -0.181 1.00 62.41 H new ATOM 0 HD1 TYR A 456 7.452 9.704 2.833 1.00 74.41 H new ATOM 0 HD2 TYR A 456 7.699 10.218 -1.403 1.00 50.21 H new ATOM 0 HE1 TYR A 456 5.008 9.604 2.665 1.00 33.43 H new ATOM 0 HE2 TYR A 456 5.258 10.074 -1.556 1.00 64.10 H new ATOM 0 HH TYR A 456 3.347 9.866 -0.474 1.00 64.42 H new ATOM 2277 N LEU A 457 9.266 7.622 3.265 1.00 62.14 N ATOM 2278 CA LEU A 457 9.013 7.260 4.673 1.00 10.00 C ATOM 2279 C LEU A 457 10.301 6.737 5.331 1.00 52.21 C ATOM 2280 O LEU A 457 10.570 7.062 6.482 1.00 23.34 O ATOM 2281 CB LEU A 457 7.890 6.182 4.815 1.00 44.22 C ATOM 2282 CG LEU A 457 6.436 6.593 4.410 1.00 50.50 C ATOM 2283 CD1 LEU A 457 5.433 5.436 4.666 1.00 41.41 C ATOM 2284 CD2 LEU A 457 6.005 7.882 5.116 1.00 12.22 C ATOM 0 H LEU A 457 8.867 6.961 2.599 1.00 62.14 H new ATOM 0 HA LEU A 457 8.677 8.167 5.176 1.00 10.00 H new ATOM 0 HB2 LEU A 457 8.175 5.319 4.213 1.00 44.22 H new ATOM 0 HB3 LEU A 457 7.869 5.854 5.854 1.00 44.22 H new ATOM 0 HG LEU A 457 6.434 6.794 3.339 1.00 50.50 H new ATOM 0 HD11 LEU A 457 4.431 5.752 4.375 1.00 41.41 H new ATOM 0 HD12 LEU A 457 5.724 4.565 4.078 1.00 41.41 H new ATOM 0 HD13 LEU A 457 5.438 5.177 5.725 1.00 41.41 H new ATOM 0 HD21 LEU A 457 4.990 8.141 4.813 1.00 12.22 H new ATOM 0 HD22 LEU A 457 6.035 7.733 6.195 1.00 12.22 H new ATOM 0 HD23 LEU A 457 6.683 8.691 4.842 1.00 12.22 H new ATOM 2296 N THR A 458 11.081 5.906 4.593 1.00 13.11 N ATOM 2297 CA THR A 458 12.346 5.338 5.114 1.00 2.11 C ATOM 2298 C THR A 458 13.436 6.420 5.179 1.00 13.35 C ATOM 2299 O THR A 458 14.276 6.408 6.083 1.00 35.41 O ATOM 2300 CB THR A 458 12.852 4.084 4.300 1.00 72.14 C ATOM 2301 OG1 THR A 458 13.870 3.396 5.048 1.00 42.44 O ATOM 2302 CG2 THR A 458 13.417 4.433 2.911 1.00 33.31 C ATOM 0 H THR A 458 10.856 5.617 3.641 1.00 13.11 H new ATOM 0 HA THR A 458 12.132 4.981 6.121 1.00 2.11 H new ATOM 0 HB THR A 458 11.976 3.454 4.145 1.00 72.14 H new ATOM 0 HG1 THR A 458 14.180 2.618 4.539 1.00 42.44 H new ATOM 0 HG21 THR A 458 13.744 3.521 2.412 1.00 33.31 H new ATOM 0 HG22 THR A 458 12.643 4.916 2.314 1.00 33.31 H new ATOM 0 HG23 THR A 458 14.264 5.110 3.022 1.00 33.31 H new ATOM 2310 N GLN A 459 13.394 7.365 4.218 1.00 22.14 N ATOM 2311 CA GLN A 459 14.290 8.539 4.215 1.00 60.42 C ATOM 2312 C GLN A 459 13.987 9.435 5.435 1.00 52.21 C ATOM 2313 O GLN A 459 14.904 9.893 6.135 1.00 42.14 O ATOM 2314 CB GLN A 459 14.126 9.330 2.891 1.00 75.50 C ATOM 2315 CG GLN A 459 14.452 8.521 1.616 1.00 20.21 C ATOM 2316 CD GLN A 459 14.208 9.277 0.299 1.00 31.30 C ATOM 2317 OE1 GLN A 459 14.895 9.046 -0.697 1.00 65.45 O ATOM 2318 NE2 GLN A 459 13.214 10.167 0.270 1.00 55.23 N ATOM 0 H GLN A 459 12.746 7.337 3.431 1.00 22.14 H new ATOM 0 HA GLN A 459 15.324 8.203 4.285 1.00 60.42 H new ATOM 0 HB2 GLN A 459 13.100 9.692 2.824 1.00 75.50 H new ATOM 0 HB3 GLN A 459 14.772 10.207 2.924 1.00 75.50 H new ATOM 0 HG2 GLN A 459 15.497 8.212 1.654 1.00 20.21 H new ATOM 0 HG3 GLN A 459 13.851 7.612 1.615 1.00 20.21 H new ATOM 0 HE21 GLN A 459 12.660 10.340 1.109 1.00 55.23 H new ATOM 0 HE22 GLN A 459 13.008 10.674 -0.591 1.00 55.23 H new ATOM 2327 N GLN A 460 12.678 9.638 5.691 1.00 3.12 N ATOM 2328 CA GLN A 460 12.184 10.419 6.837 1.00 5.25 C ATOM 2329 C GLN A 460 12.433 9.669 8.155 1.00 72.12 C ATOM 2330 O GLN A 460 12.657 10.294 9.182 1.00 72.52 O ATOM 2331 CB GLN A 460 10.672 10.744 6.664 1.00 41.22 C ATOM 2332 CG GLN A 460 10.043 11.596 7.795 1.00 51.50 C ATOM 2333 CD GLN A 460 10.673 12.988 7.942 1.00 2.23 C ATOM 2334 OE1 GLN A 460 10.241 13.948 7.301 1.00 71.44 O ATOM 2335 NE2 GLN A 460 11.679 13.112 8.800 1.00 34.01 N ATOM 0 H GLN A 460 11.933 9.262 5.104 1.00 3.12 H new ATOM 0 HA GLN A 460 12.734 11.359 6.874 1.00 5.25 H new ATOM 0 HB2 GLN A 460 10.536 11.269 5.718 1.00 41.22 H new ATOM 0 HB3 GLN A 460 10.122 9.806 6.590 1.00 41.22 H new ATOM 0 HG2 GLN A 460 8.976 11.708 7.603 1.00 51.50 H new ATOM 0 HG3 GLN A 460 10.142 11.060 8.739 1.00 51.50 H new ATOM 0 HE21 GLN A 460 12.013 12.298 9.315 1.00 34.01 H new ATOM 0 HE22 GLN A 460 12.117 14.022 8.944 1.00 34.01 H new ATOM 2344 N PHE A 461 12.405 8.325 8.102 1.00 1.51 N ATOM 2345 CA PHE A 461 12.665 7.466 9.272 1.00 44.43 C ATOM 2346 C PHE A 461 14.103 7.667 9.750 1.00 44.53 C ATOM 2347 O PHE A 461 14.325 8.040 10.898 1.00 1.10 O ATOM 2348 CB PHE A 461 12.411 5.968 8.928 1.00 43.21 C ATOM 2349 CG PHE A 461 12.812 4.960 10.019 1.00 0.41 C ATOM 2350 CD1 PHE A 461 12.401 5.122 11.345 1.00 72.10 C ATOM 2351 CD2 PHE A 461 13.608 3.848 9.714 1.00 53.24 C ATOM 2352 CE1 PHE A 461 12.777 4.215 12.320 1.00 72.20 C ATOM 2353 CE2 PHE A 461 13.977 2.943 10.694 1.00 14.30 C ATOM 2354 CZ PHE A 461 13.563 3.130 11.996 1.00 54.13 C ATOM 0 H PHE A 461 12.202 7.804 7.249 1.00 1.51 H new ATOM 0 HA PHE A 461 11.980 7.748 10.071 1.00 44.43 H new ATOM 0 HB2 PHE A 461 11.351 5.838 8.710 1.00 43.21 H new ATOM 0 HB3 PHE A 461 12.956 5.725 8.016 1.00 43.21 H new ATOM 0 HD1 PHE A 461 11.782 5.966 11.612 1.00 72.10 H new ATOM 0 HD2 PHE A 461 13.939 3.695 8.698 1.00 53.24 H new ATOM 0 HE1 PHE A 461 12.453 4.358 13.340 1.00 72.20 H new ATOM 0 HE2 PHE A 461 14.589 2.090 10.439 1.00 14.30 H new ATOM 0 HZ PHE A 461 13.855 2.426 12.762 1.00 54.13 H new ATOM 2364 N THR A 462 15.062 7.447 8.836 1.00 64.01 N ATOM 2365 CA THR A 462 16.494 7.541 9.132 1.00 1.24 C ATOM 2366 C THR A 462 16.905 8.981 9.529 1.00 12.44 C ATOM 2367 O THR A 462 17.785 9.159 10.367 1.00 71.11 O ATOM 2368 CB THR A 462 17.339 7.037 7.911 1.00 41.02 C ATOM 2369 OG1 THR A 462 16.863 5.742 7.503 1.00 14.20 O ATOM 2370 CG2 THR A 462 18.845 6.937 8.230 1.00 45.44 C ATOM 0 H THR A 462 14.861 7.198 7.868 1.00 64.01 H new ATOM 0 HA THR A 462 16.699 6.898 9.988 1.00 1.24 H new ATOM 0 HB THR A 462 17.218 7.769 7.113 1.00 41.02 H new ATOM 0 HG1 THR A 462 16.021 5.843 7.012 1.00 14.20 H new ATOM 0 HG21 THR A 462 19.381 6.583 7.349 1.00 45.44 H new ATOM 0 HG22 THR A 462 19.223 7.919 8.514 1.00 45.44 H new ATOM 0 HG23 THR A 462 18.997 6.238 9.052 1.00 45.44 H new ATOM 2378 N ALA A 463 16.231 9.997 8.946 1.00 64.34 N ATOM 2379 CA ALA A 463 16.502 11.419 9.257 1.00 3.03 C ATOM 2380 C ALA A 463 15.977 11.791 10.663 1.00 44.05 C ATOM 2381 O ALA A 463 16.726 12.309 11.511 1.00 13.44 O ATOM 2382 CB ALA A 463 15.870 12.316 8.182 1.00 20.24 C ATOM 0 H ALA A 463 15.493 9.858 8.255 1.00 64.34 H new ATOM 0 HA ALA A 463 17.581 11.576 9.258 1.00 3.03 H new ATOM 0 HB1 ALA A 463 16.072 13.361 8.415 1.00 20.24 H new ATOM 0 HB2 ALA A 463 16.296 12.073 7.209 1.00 20.24 H new ATOM 0 HB3 ALA A 463 14.793 12.151 8.158 1.00 20.24 H new ATOM 2388 N MET A 464 14.693 11.462 10.906 1.00 20.40 N ATOM 2389 CA MET A 464 13.991 11.784 12.172 1.00 54.52 C ATOM 2390 C MET A 464 14.631 11.033 13.350 1.00 32.44 C ATOM 2391 O MET A 464 14.734 11.563 14.453 1.00 24.01 O ATOM 2392 CB MET A 464 12.487 11.401 12.049 1.00 74.13 C ATOM 2393 CG MET A 464 11.615 11.719 13.274 1.00 53.22 C ATOM 2394 SD MET A 464 9.899 11.184 13.075 1.00 71.14 S ATOM 2395 CE MET A 464 9.356 12.137 11.655 1.00 3.04 C ATOM 0 H MET A 464 14.110 10.965 10.232 1.00 20.40 H new ATOM 0 HA MET A 464 14.077 12.854 12.359 1.00 54.52 H new ATOM 0 HB2 MET A 464 12.069 11.918 11.185 1.00 74.13 H new ATOM 0 HB3 MET A 464 12.419 10.332 11.845 1.00 74.13 H new ATOM 0 HG2 MET A 464 12.041 11.235 14.153 1.00 53.22 H new ATOM 0 HG3 MET A 464 11.636 12.793 13.460 1.00 53.22 H new ATOM 0 HE1 MET A 464 8.379 12.573 11.862 1.00 3.04 H new ATOM 0 HE2 MET A 464 10.073 12.933 11.455 1.00 3.04 H new ATOM 0 HE3 MET A 464 9.286 11.485 10.784 1.00 3.04 H new ATOM 2405 N ASN A 465 15.103 9.807 13.069 1.00 64.31 N ATOM 2406 CA ASN A 465 15.766 8.943 14.058 1.00 52.22 C ATOM 2407 C ASN A 465 17.203 9.466 14.290 1.00 23.33 C ATOM 2408 O ASN A 465 17.511 9.990 15.365 1.00 33.02 O ATOM 2409 CB ASN A 465 15.749 7.455 13.570 1.00 13.13 C ATOM 2410 CG ASN A 465 16.173 6.421 14.627 1.00 32.54 C ATOM 2411 OD1 ASN A 465 16.988 6.693 15.505 1.00 32.21 O ATOM 2412 ND2 ASN A 465 15.636 5.214 14.529 1.00 22.43 N ATOM 0 H ASN A 465 15.034 9.385 12.143 1.00 64.31 H new ATOM 0 HA ASN A 465 15.233 8.971 15.008 1.00 52.22 H new ATOM 0 HB2 ASN A 465 14.743 7.212 13.228 1.00 13.13 H new ATOM 0 HB3 ASN A 465 16.410 7.363 12.708 1.00 13.13 H new ATOM 0 HD21 ASN A 465 15.897 4.484 15.192 1.00 22.43 H new ATOM 0 HD22 ASN A 465 14.961 5.014 13.790 1.00 22.43 H new ATOM 2419 N LYS A 466 18.066 9.348 13.260 1.00 62.45 N ATOM 2420 CA LYS A 466 19.461 9.841 13.305 1.00 2.15 C ATOM 2421 C LYS A 466 19.736 10.847 12.163 1.00 44.34 C ATOM 2422 O LYS A 466 20.207 10.467 11.092 1.00 74.40 O ATOM 2423 CB LYS A 466 20.492 8.651 13.306 1.00 31.30 C ATOM 2424 CG LYS A 466 20.343 7.582 12.176 1.00 34.12 C ATOM 2425 CD LYS A 466 19.254 6.499 12.443 1.00 72.41 C ATOM 2426 CE LYS A 466 19.655 5.439 13.502 1.00 75.41 C ATOM 2427 NZ LYS A 466 19.821 6.000 14.873 1.00 52.51 N ATOM 0 H LYS A 466 17.817 8.909 12.374 1.00 62.45 H new ATOM 0 HA LYS A 466 19.595 10.377 14.244 1.00 2.15 H new ATOM 0 HB2 LYS A 466 21.495 9.072 13.244 1.00 31.30 H new ATOM 0 HB3 LYS A 466 20.420 8.141 14.267 1.00 31.30 H new ATOM 0 HG2 LYS A 466 20.108 8.091 11.241 1.00 34.12 H new ATOM 0 HG3 LYS A 466 21.303 7.085 12.036 1.00 34.12 H new ATOM 0 HD2 LYS A 466 18.339 6.993 12.769 1.00 72.41 H new ATOM 0 HD3 LYS A 466 19.026 5.991 11.506 1.00 72.41 H new ATOM 0 HE2 LYS A 466 18.896 4.657 13.528 1.00 75.41 H new ATOM 0 HE3 LYS A 466 20.588 4.967 13.196 1.00 75.41 H new ATOM 0 HZ1 LYS A 466 19.734 5.236 15.573 1.00 52.51 H new ATOM 0 HZ2 LYS A 466 20.759 6.441 14.956 1.00 52.51 H new ATOM 0 HZ3 LYS A 466 19.086 6.715 15.047 1.00 52.51 H new ATOM 2441 N SER A 467 19.317 12.110 12.362 1.00 72.33 N ATOM 2442 CA SER A 467 19.784 13.272 11.576 1.00 51.03 C ATOM 2443 C SER A 467 21.314 13.193 11.252 1.00 73.51 C ATOM 2444 O SER A 467 22.140 13.405 12.166 1.00 75.51 O ATOM 2445 CB SER A 467 19.437 14.573 12.347 1.00 21.24 C ATOM 2446 OG SER A 467 18.030 14.722 12.507 1.00 25.34 O ATOM 2447 OXT SER A 467 21.673 12.898 10.088 1.00 37.65 O ATOM 0 H SER A 467 18.637 12.358 13.081 1.00 72.33 H new ATOM 0 HA SER A 467 19.272 13.269 10.614 1.00 51.03 H new ATOM 0 HB2 SER A 467 19.916 14.557 13.326 1.00 21.24 H new ATOM 0 HB3 SER A 467 19.837 15.433 11.811 1.00 21.24 H new ATOM 0 HG SER A 467 17.575 13.926 12.161 1.00 25.34 H new TER 2453 SER A 467