USER MOD reduce.3.24.130724 H: found=0, std=0, add=1738, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1732 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: B 74 THR OG1 : rot 58:sc= 0.0206 USER MOD Set 1.2: B 79 HIS : no HD1:sc= -0.401 X(o=-0.38,f=-0.85) USER MOD Set 2.1: B 57 THR OG1 : rot 73:sc= -1.13! USER MOD Set 2.2: B 58 HIS : no HD1:sc= -9.42! C(o=-11!,f=-27!) USER MOD Set 3.1: B 48 SER OG : rot 180:sc= 0 USER MOD Set 3.2: B 49 HIS : no HD1:sc= -0.811 K(o=-0.81,f=-4!) USER MOD Set 4.1: B 8 HIS : no HD1:sc= -4.75! C(o=-4.8!,f=-4.1!) USER MOD Set 4.2: B 70 TYR OH : rot 180:sc= -0.0302 USER MOD Set 5.1: A 74 THR OG1 : rot 58:sc= 0.0176 USER MOD Set 5.2: A 79 HIS : no HD1:sc= -0.41 X(o=-0.39,f=-0.83) USER MOD Set 6.1: A 8 HIS : no HD1:sc= -4.85! C(o=-4.9!,f=-3.8!) USER MOD Set 6.2: A 70 TYR OH : rot 180:sc= -0.0412 USER MOD Set 7.1: A 57 THR OG1 : rot 76:sc= -1.5! USER MOD Set 7.2: A 58 HIS : no HD1:sc= -9.33! C(o=-11!,f=-28!) USER MOD Set 8.1: A 48 SER OG : rot 180:sc= 0 USER MOD Set 8.2: A 49 HIS : no HD1:sc= -0.814 K(o=-0.81,f=-3.9!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -164:sc= -0.009 (180deg=-0.308) USER MOD Single : A 3 THR OG1 : rot -37:sc= 0.0163 USER MOD Single : A 4 SER OG : rot -80:sc= 0.07 USER MOD Single : A 7 LYS NZ :NH3+ 177:sc= -1.88! (180deg=-1.95!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 THR OG1 : rot -86:sc= -1.18 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -14.2! C(o=-14!,f=-18!) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -2.71 X(o=-2.7,f=-2.8!) USER MOD Single : A 36 THR OG1 : rot -171:sc= 1.89 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 66:sc= 0.18 USER MOD Single : A 46 LYS NZ :NH3+ -171:sc= -8.68! (180deg=-9.31!) USER MOD Single : A 51 MET CE :methyl -147:sc= 0 (180deg=-1.26) USER MOD Single : A 54 GLN : amide:sc= -4.83! K(o=-4.8!,f=-3) USER MOD Single : A 61 SER OG : rot 178:sc= 0.557 USER MOD Single : A 62 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -6.93! K(o=-6.9!,f=-1.2) USER MOD Single : A 67 LYS NZ :NH3+ -152:sc= -1.39 (180deg=-2.05) USER MOD Single : A 75 SER OG : rot 102:sc= 0.739 USER MOD Single : A 76 HIS : no HE2:sc= 0.743 K(o=0.74,f=-2.3!) USER MOD Single : A 83 SER OG : rot -66:sc= 1.16 USER MOD Single : A 87 THR OG1 : rot 77:sc= 0.311 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 170:sc= -0.242 (180deg=-0.991) USER MOD Single : A 105 SER OG : rot 83:sc= 0.361 USER MOD Single : A 106 SER OG : rot -90:sc= -0.762 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -165:sc= -0.0232 (180deg=-0.327) USER MOD Single : B 3 THR OG1 : rot -33:sc= 0.0411 USER MOD Single : B 4 SER OG : rot -80:sc= 0.0586 USER MOD Single : B 7 LYS NZ :NH3+ -174:sc= -1.96 (180deg=-2.1!) USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 THR OG1 : rot -85:sc= -1.23 USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 ASN : amide:sc= -13.8! C(o=-14!,f=-18!) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 33 GLN : amide:sc= -2.67 X(o=-2.7,f=-2.6!) USER MOD Single : B 36 THR OG1 : rot -171:sc= 1.75 USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 SER OG : rot 77:sc= 0.219 USER MOD Single : B 46 LYS NZ :NH3+ -174:sc= -8.45! (180deg=-8.9!) USER MOD Single : B 51 MET CE :methyl -148:sc= 0 (180deg=-1.28) USER MOD Single : B 54 GLN : amide:sc= -4.97! K(o=-5!,f=-3) USER MOD Single : B 61 SER OG : rot -174:sc= 0.521 USER MOD Single : B 62 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 63 THR OG1 : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= -7.02! K(o=-7!,f=-1.1) USER MOD Single : B 67 LYS NZ :NH3+ -155:sc= -1.29 (180deg=-1.91) USER MOD Single : B 75 SER OG : rot 60:sc= 0.637 USER MOD Single : B 76 HIS : no HE2:sc= 0.753 K(o=0.75,f=-2.4!) USER MOD Single : B 83 SER OG : rot -61:sc= 1.19 USER MOD Single : B 87 THR OG1 : rot 78:sc= 0.317 USER MOD Single : B 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 104 LYS NZ :NH3+ 168:sc= -0.258 (180deg=-0.82) USER MOD Single : B 105 SER OG : rot 82:sc= 0.337 USER MOD Single : B 106 SER OG : rot -90:sc= -0.76 USER MOD Single : B 110 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.236 7.382 -20.024 1.00 0.00 N ATOM 2 CA MET A 1 -6.129 8.782 -20.523 1.00 0.00 C ATOM 3 C MET A 1 -5.065 8.853 -21.620 1.00 0.00 C ATOM 4 O MET A 1 -5.364 9.084 -22.775 1.00 0.00 O ATOM 5 CB MET A 1 -5.735 9.705 -19.368 1.00 0.00 C ATOM 6 CG MET A 1 -6.856 9.730 -18.328 1.00 0.00 C ATOM 7 SD MET A 1 -6.454 10.932 -17.037 1.00 0.00 S ATOM 8 CE MET A 1 -7.890 10.619 -15.979 1.00 0.00 C ATOM 0 H1 MET A 1 -7.121 7.271 -19.489 1.00 0.00 H new ATOM 0 H2 MET A 1 -6.234 6.725 -20.830 1.00 0.00 H new ATOM 0 H3 MET A 1 -5.428 7.172 -19.404 1.00 0.00 H new ATOM 0 HA MET A 1 -7.090 9.098 -20.929 1.00 0.00 H new ATOM 0 HB2 MET A 1 -4.808 9.358 -18.911 1.00 0.00 H new ATOM 0 HB3 MET A 1 -5.548 10.712 -19.741 1.00 0.00 H new ATOM 0 HG2 MET A 1 -7.801 9.993 -18.803 1.00 0.00 H new ATOM 0 HG3 MET A 1 -6.983 8.740 -17.891 1.00 0.00 H new ATOM 0 HE1 MET A 1 -7.845 11.267 -15.104 1.00 0.00 H new ATOM 0 HE2 MET A 1 -8.804 10.825 -16.536 1.00 0.00 H new ATOM 0 HE3 MET A 1 -7.886 9.577 -15.660 1.00 0.00 H new ATOM 17 N ALA A 2 -3.824 8.656 -21.269 1.00 0.00 N ATOM 18 CA ALA A 2 -2.741 8.714 -22.293 1.00 0.00 C ATOM 19 C ALA A 2 -2.830 10.039 -23.051 1.00 0.00 C ATOM 20 O ALA A 2 -2.960 10.070 -24.259 1.00 0.00 O ATOM 21 CB ALA A 2 -2.906 7.553 -23.273 1.00 0.00 C ATOM 0 H ALA A 2 -3.512 8.457 -20.318 1.00 0.00 H new ATOM 0 HA ALA A 2 -1.770 8.640 -21.803 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -2.115 7.594 -24.022 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -2.845 6.609 -22.732 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -3.876 7.627 -23.765 1.00 0.00 H new ATOM 27 N THR A 3 -2.760 11.139 -22.350 1.00 0.00 N ATOM 28 CA THR A 3 -2.843 12.464 -23.027 1.00 0.00 C ATOM 29 C THR A 3 -1.432 13.014 -23.226 1.00 0.00 C ATOM 30 O THR A 3 -1.214 13.963 -23.954 1.00 0.00 O ATOM 31 CB THR A 3 -3.639 13.430 -22.150 1.00 0.00 C ATOM 32 OG1 THR A 3 -3.988 14.578 -22.908 1.00 0.00 O ATOM 33 CG2 THR A 3 -2.792 13.848 -20.945 1.00 0.00 C ATOM 0 H THR A 3 -2.649 11.176 -21.337 1.00 0.00 H new ATOM 0 HA THR A 3 -3.336 12.353 -23.993 1.00 0.00 H new ATOM 0 HB THR A 3 -4.546 12.937 -21.799 1.00 0.00 H new ATOM 0 HG1 THR A 3 -3.251 14.808 -23.511 1.00 0.00 H new ATOM 0 HG21 THR A 3 -3.362 14.537 -20.321 1.00 0.00 H new ATOM 0 HG22 THR A 3 -2.527 12.965 -20.363 1.00 0.00 H new ATOM 0 HG23 THR A 3 -1.883 14.340 -21.292 1.00 0.00 H new ATOM 41 N SER A 4 -0.472 12.408 -22.587 1.00 0.00 N ATOM 42 CA SER A 4 0.934 12.877 -22.714 1.00 0.00 C ATOM 43 C SER A 4 1.813 11.695 -23.097 1.00 0.00 C ATOM 44 O SER A 4 2.125 11.492 -24.252 1.00 0.00 O ATOM 45 CB SER A 4 1.416 13.441 -21.384 1.00 0.00 C ATOM 46 OG SER A 4 0.501 14.424 -20.921 1.00 0.00 O ATOM 0 H SER A 4 -0.603 11.601 -21.977 1.00 0.00 H new ATOM 0 HA SER A 4 0.989 13.655 -23.476 1.00 0.00 H new ATOM 0 HB2 SER A 4 1.507 12.640 -20.650 1.00 0.00 H new ATOM 0 HB3 SER A 4 2.407 13.879 -21.502 1.00 0.00 H new ATOM 0 HG SER A 4 0.668 15.271 -21.385 1.00 0.00 H new ATOM 52 N GLY A 5 2.209 10.901 -22.147 1.00 0.00 N ATOM 53 CA GLY A 5 3.062 9.729 -22.485 1.00 0.00 C ATOM 54 C GLY A 5 2.839 8.614 -21.455 1.00 0.00 C ATOM 55 O GLY A 5 1.938 8.673 -20.641 1.00 0.00 O ATOM 0 H GLY A 5 1.982 11.009 -21.158 1.00 0.00 H new ATOM 0 HA2 GLY A 5 2.821 9.368 -23.485 1.00 0.00 H new ATOM 0 HA3 GLY A 5 4.112 10.022 -22.497 1.00 0.00 H new ATOM 59 N PHE A 6 3.666 7.609 -21.475 1.00 0.00 N ATOM 60 CA PHE A 6 3.526 6.504 -20.490 1.00 0.00 C ATOM 61 C PHE A 6 4.757 6.517 -19.584 1.00 0.00 C ATOM 62 O PHE A 6 5.875 6.612 -20.049 1.00 0.00 O ATOM 63 CB PHE A 6 3.419 5.171 -21.231 1.00 0.00 C ATOM 64 CG PHE A 6 2.040 5.047 -21.842 1.00 0.00 C ATOM 65 CD1 PHE A 6 0.976 4.549 -21.079 1.00 0.00 C ATOM 66 CD2 PHE A 6 1.823 5.435 -23.173 1.00 0.00 C ATOM 67 CE1 PHE A 6 -0.301 4.439 -21.645 1.00 0.00 C ATOM 68 CE2 PHE A 6 0.546 5.324 -23.736 1.00 0.00 C ATOM 69 CZ PHE A 6 -0.516 4.826 -22.973 1.00 0.00 C ATOM 0 H PHE A 6 4.437 7.505 -22.135 1.00 0.00 H new ATOM 0 HA PHE A 6 2.626 6.634 -19.889 1.00 0.00 H new ATOM 0 HB2 PHE A 6 4.180 5.112 -22.009 1.00 0.00 H new ATOM 0 HB3 PHE A 6 3.600 4.344 -20.544 1.00 0.00 H new ATOM 0 HD1 PHE A 6 1.140 4.250 -20.054 1.00 0.00 H new ATOM 0 HD2 PHE A 6 2.642 5.819 -23.763 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -1.121 4.055 -21.056 1.00 0.00 H new ATOM 0 HE2 PHE A 6 0.380 5.623 -24.760 1.00 0.00 H new ATOM 0 HZ PHE A 6 -1.501 4.740 -23.408 1.00 0.00 H new ATOM 79 N LYS A 7 4.569 6.473 -18.291 1.00 0.00 N ATOM 80 CA LYS A 7 5.746 6.556 -17.375 1.00 0.00 C ATOM 81 C LYS A 7 6.167 5.196 -16.828 1.00 0.00 C ATOM 82 O LYS A 7 5.388 4.454 -16.263 1.00 0.00 O ATOM 83 CB LYS A 7 5.408 7.460 -16.184 1.00 0.00 C ATOM 84 CG LYS A 7 6.677 7.699 -15.354 1.00 0.00 C ATOM 85 CD LYS A 7 6.322 8.437 -14.058 1.00 0.00 C ATOM 86 CE LYS A 7 5.925 7.424 -12.981 1.00 0.00 C ATOM 87 NZ LYS A 7 5.144 8.112 -11.917 1.00 0.00 N ATOM 0 H LYS A 7 3.662 6.384 -17.833 1.00 0.00 H new ATOM 0 HA LYS A 7 6.571 6.959 -17.963 1.00 0.00 H new ATOM 0 HB2 LYS A 7 5.005 8.410 -16.536 1.00 0.00 H new ATOM 0 HB3 LYS A 7 4.638 6.996 -15.567 1.00 0.00 H new ATOM 0 HG2 LYS A 7 7.155 6.747 -15.122 1.00 0.00 H new ATOM 0 HG3 LYS A 7 7.394 8.283 -15.930 1.00 0.00 H new ATOM 0 HD2 LYS A 7 7.173 9.028 -13.719 1.00 0.00 H new ATOM 0 HD3 LYS A 7 5.502 9.133 -14.237 1.00 0.00 H new ATOM 0 HE2 LYS A 7 5.332 6.622 -13.421 1.00 0.00 H new ATOM 0 HE3 LYS A 7 6.816 6.964 -12.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 4.831 7.416 -11.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 5.741 8.828 -11.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 4.314 8.574 -12.340 1.00 0.00 H new ATOM 101 N HIS A 8 7.433 4.916 -16.948 1.00 0.00 N ATOM 102 CA HIS A 8 8.025 3.695 -16.343 1.00 0.00 C ATOM 103 C HIS A 8 9.120 4.184 -15.402 1.00 0.00 C ATOM 104 O HIS A 8 10.046 4.849 -15.822 1.00 0.00 O ATOM 105 CB HIS A 8 8.647 2.798 -17.416 1.00 0.00 C ATOM 106 CG HIS A 8 7.720 1.643 -17.705 1.00 0.00 C ATOM 107 ND1 HIS A 8 8.154 0.324 -17.682 1.00 0.00 N ATOM 108 CD2 HIS A 8 6.384 1.593 -18.027 1.00 0.00 C ATOM 109 CE1 HIS A 8 7.098 -0.456 -17.983 1.00 0.00 C ATOM 110 NE2 HIS A 8 5.999 0.267 -18.200 1.00 0.00 N ATOM 0 H HIS A 8 8.099 5.500 -17.454 1.00 0.00 H new ATOM 0 HA HIS A 8 7.263 3.111 -15.828 1.00 0.00 H new ATOM 0 HB2 HIS A 8 8.826 3.371 -18.326 1.00 0.00 H new ATOM 0 HB3 HIS A 8 9.614 2.426 -17.078 1.00 0.00 H new ATOM 0 HD2 HIS A 8 5.734 2.450 -18.130 1.00 0.00 H new ATOM 0 HE1 HIS A 8 7.137 -1.534 -18.041 1.00 0.00 H new ATOM 0 HE2 HIS A 8 5.071 -0.079 -18.442 1.00 0.00 H new ATOM 119 N LEU A 9 9.031 3.895 -14.139 1.00 0.00 N ATOM 120 CA LEU A 9 10.059 4.422 -13.204 1.00 0.00 C ATOM 121 C LEU A 9 10.547 3.301 -12.304 1.00 0.00 C ATOM 122 O LEU A 9 9.789 2.451 -11.881 1.00 0.00 O ATOM 123 CB LEU A 9 9.465 5.550 -12.355 1.00 0.00 C ATOM 124 CG LEU A 9 10.576 6.198 -11.522 1.00 0.00 C ATOM 125 CD1 LEU A 9 10.383 7.715 -11.498 1.00 0.00 C ATOM 126 CD2 LEU A 9 10.519 5.659 -10.090 1.00 0.00 C ATOM 0 H LEU A 9 8.300 3.323 -13.715 1.00 0.00 H new ATOM 0 HA LEU A 9 10.898 4.817 -13.777 1.00 0.00 H new ATOM 0 HB2 LEU A 9 8.995 6.295 -12.997 1.00 0.00 H new ATOM 0 HB3 LEU A 9 8.687 5.157 -11.701 1.00 0.00 H new ATOM 0 HG LEU A 9 11.543 5.962 -11.965 1.00 0.00 H new ATOM 0 HD11 LEU A 9 11.174 8.173 -10.905 1.00 0.00 H new ATOM 0 HD12 LEU A 9 10.422 8.103 -12.516 1.00 0.00 H new ATOM 0 HD13 LEU A 9 9.415 7.952 -11.056 1.00 0.00 H new ATOM 0 HD21 LEU A 9 11.309 6.119 -9.496 1.00 0.00 H new ATOM 0 HD22 LEU A 9 9.550 5.896 -9.650 1.00 0.00 H new ATOM 0 HD23 LEU A 9 10.657 4.578 -10.102 1.00 0.00 H new ATOM 138 N VAL A 10 11.812 3.287 -12.018 1.00 0.00 N ATOM 139 CA VAL A 10 12.364 2.229 -11.141 1.00 0.00 C ATOM 140 C VAL A 10 13.193 2.870 -10.026 1.00 0.00 C ATOM 141 O VAL A 10 13.989 3.754 -10.264 1.00 0.00 O ATOM 142 CB VAL A 10 13.253 1.305 -11.981 1.00 0.00 C ATOM 143 CG1 VAL A 10 14.499 2.073 -12.428 1.00 0.00 C ATOM 144 CG2 VAL A 10 13.677 0.091 -11.152 1.00 0.00 C ATOM 0 H VAL A 10 12.492 3.968 -12.356 1.00 0.00 H new ATOM 0 HA VAL A 10 11.552 1.654 -10.695 1.00 0.00 H new ATOM 0 HB VAL A 10 12.694 0.965 -12.853 1.00 0.00 H new ATOM 0 HG11 VAL A 10 15.134 1.419 -13.026 1.00 0.00 H new ATOM 0 HG12 VAL A 10 14.201 2.935 -13.025 1.00 0.00 H new ATOM 0 HG13 VAL A 10 15.051 2.413 -11.552 1.00 0.00 H new ATOM 0 HG21 VAL A 10 14.308 -0.560 -11.757 1.00 0.00 H new ATOM 0 HG22 VAL A 10 14.234 0.425 -10.276 1.00 0.00 H new ATOM 0 HG23 VAL A 10 12.792 -0.458 -10.832 1.00 0.00 H new ATOM 154 N VAL A 11 13.035 2.409 -8.818 1.00 0.00 N ATOM 155 CA VAL A 11 13.797 3.005 -7.686 1.00 0.00 C ATOM 156 C VAL A 11 14.770 1.938 -7.222 1.00 0.00 C ATOM 157 O VAL A 11 14.400 0.793 -7.061 1.00 0.00 O ATOM 158 CB VAL A 11 12.863 3.398 -6.540 1.00 0.00 C ATOM 159 CG1 VAL A 11 13.534 4.490 -5.708 1.00 0.00 C ATOM 160 CG2 VAL A 11 11.542 3.927 -7.106 1.00 0.00 C ATOM 0 H VAL A 11 12.410 1.644 -8.565 1.00 0.00 H new ATOM 0 HA VAL A 11 14.312 3.912 -8.002 1.00 0.00 H new ATOM 0 HB VAL A 11 12.660 2.527 -5.917 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.877 4.778 -4.888 1.00 0.00 H new ATOM 0 HG12 VAL A 11 14.474 4.114 -5.305 1.00 0.00 H new ATOM 0 HG13 VAL A 11 13.730 5.358 -6.337 1.00 0.00 H new ATOM 0 HG21 VAL A 11 10.880 4.205 -6.286 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.737 4.801 -7.728 1.00 0.00 H new ATOM 0 HG23 VAL A 11 11.068 3.152 -7.708 1.00 0.00 H new ATOM 170 N VAL A 12 16.017 2.259 -7.058 1.00 0.00 N ATOM 171 CA VAL A 12 16.954 1.195 -6.626 1.00 0.00 C ATOM 172 C VAL A 12 17.967 1.674 -5.586 1.00 0.00 C ATOM 173 O VAL A 12 18.387 2.815 -5.562 1.00 0.00 O ATOM 174 CB VAL A 12 17.696 0.708 -7.859 1.00 0.00 C ATOM 175 CG1 VAL A 12 16.687 0.106 -8.839 1.00 0.00 C ATOM 176 CG2 VAL A 12 18.399 1.895 -8.524 1.00 0.00 C ATOM 0 H VAL A 12 16.420 3.185 -7.199 1.00 0.00 H new ATOM 0 HA VAL A 12 16.375 0.402 -6.154 1.00 0.00 H new ATOM 0 HB VAL A 12 18.433 -0.044 -7.577 1.00 0.00 H new ATOM 0 HG11 VAL A 12 17.209 -0.247 -9.728 1.00 0.00 H new ATOM 0 HG12 VAL A 12 16.173 -0.730 -8.364 1.00 0.00 H new ATOM 0 HG13 VAL A 12 15.959 0.865 -9.124 1.00 0.00 H new ATOM 0 HG21 VAL A 12 18.933 1.552 -9.410 1.00 0.00 H new ATOM 0 HG22 VAL A 12 17.659 2.641 -8.813 1.00 0.00 H new ATOM 0 HG23 VAL A 12 19.106 2.338 -7.823 1.00 0.00 H new ATOM 186 N LYS A 13 18.382 0.761 -4.750 1.00 0.00 N ATOM 187 CA LYS A 13 19.401 1.064 -3.713 1.00 0.00 C ATOM 188 C LYS A 13 20.503 0.011 -3.851 1.00 0.00 C ATOM 189 O LYS A 13 20.270 -1.067 -4.363 1.00 0.00 O ATOM 190 CB LYS A 13 18.762 0.999 -2.322 1.00 0.00 C ATOM 191 CG LYS A 13 17.920 2.259 -2.092 1.00 0.00 C ATOM 192 CD LYS A 13 17.199 2.155 -0.746 1.00 0.00 C ATOM 193 CE LYS A 13 18.202 2.355 0.389 1.00 0.00 C ATOM 194 NZ LYS A 13 17.472 2.662 1.653 1.00 0.00 N ATOM 0 H LYS A 13 18.048 -0.203 -4.745 1.00 0.00 H new ATOM 0 HA LYS A 13 19.812 2.066 -3.841 1.00 0.00 H new ATOM 0 HB2 LYS A 13 18.137 0.110 -2.237 1.00 0.00 H new ATOM 0 HB3 LYS A 13 19.535 0.920 -1.557 1.00 0.00 H new ATOM 0 HG2 LYS A 13 18.558 3.143 -2.107 1.00 0.00 H new ATOM 0 HG3 LYS A 13 17.194 2.376 -2.897 1.00 0.00 H new ATOM 0 HD2 LYS A 13 16.411 2.906 -0.685 1.00 0.00 H new ATOM 0 HD3 LYS A 13 16.719 1.181 -0.653 1.00 0.00 H new ATOM 0 HE2 LYS A 13 18.807 1.457 0.515 1.00 0.00 H new ATOM 0 HE3 LYS A 13 18.885 3.168 0.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 18.156 2.798 2.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 16.913 3.530 1.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 16.837 1.872 1.888 1.00 0.00 H new ATOM 208 N PHE A 14 21.703 0.309 -3.439 1.00 0.00 N ATOM 209 CA PHE A 14 22.817 -0.671 -3.629 1.00 0.00 C ATOM 210 C PHE A 14 23.324 -1.219 -2.286 1.00 0.00 C ATOM 211 O PHE A 14 23.190 -0.594 -1.253 1.00 0.00 O ATOM 212 CB PHE A 14 23.962 0.036 -4.349 1.00 0.00 C ATOM 213 CG PHE A 14 24.657 0.972 -3.388 1.00 0.00 C ATOM 214 CD1 PHE A 14 25.586 0.467 -2.472 1.00 0.00 C ATOM 215 CD2 PHE A 14 24.374 2.345 -3.413 1.00 0.00 C ATOM 216 CE1 PHE A 14 26.232 1.333 -1.580 1.00 0.00 C ATOM 217 CE2 PHE A 14 25.019 3.209 -2.522 1.00 0.00 C ATOM 218 CZ PHE A 14 25.948 2.702 -1.605 1.00 0.00 C ATOM 0 H PHE A 14 21.963 1.182 -2.981 1.00 0.00 H new ATOM 0 HA PHE A 14 22.446 -1.513 -4.214 1.00 0.00 H new ATOM 0 HB2 PHE A 14 24.670 -0.697 -4.737 1.00 0.00 H new ATOM 0 HB3 PHE A 14 23.580 0.593 -5.204 1.00 0.00 H new ATOM 0 HD1 PHE A 14 25.805 -0.590 -2.452 1.00 0.00 H new ATOM 0 HD2 PHE A 14 23.658 2.736 -4.121 1.00 0.00 H new ATOM 0 HE1 PHE A 14 26.949 0.943 -0.873 1.00 0.00 H new ATOM 0 HE2 PHE A 14 24.801 4.267 -2.541 1.00 0.00 H new ATOM 0 HZ PHE A 14 26.446 3.369 -0.916 1.00 0.00 H new ATOM 228 N LYS A 15 23.935 -2.381 -2.310 1.00 0.00 N ATOM 229 CA LYS A 15 24.511 -2.961 -1.058 1.00 0.00 C ATOM 230 C LYS A 15 25.961 -3.368 -1.334 1.00 0.00 C ATOM 231 O LYS A 15 26.758 -3.516 -0.428 1.00 0.00 O ATOM 232 CB LYS A 15 23.701 -4.185 -0.615 1.00 0.00 C ATOM 233 CG LYS A 15 23.922 -5.335 -1.596 1.00 0.00 C ATOM 234 CD LYS A 15 22.975 -6.488 -1.253 1.00 0.00 C ATOM 235 CE LYS A 15 23.447 -7.758 -1.961 1.00 0.00 C ATOM 236 NZ LYS A 15 22.472 -8.860 -1.719 1.00 0.00 N ATOM 0 H LYS A 15 24.059 -2.952 -3.146 1.00 0.00 H new ATOM 0 HA LYS A 15 24.474 -2.220 -0.260 1.00 0.00 H new ATOM 0 HB2 LYS A 15 24.002 -4.488 0.388 1.00 0.00 H new ATOM 0 HB3 LYS A 15 22.641 -3.934 -0.568 1.00 0.00 H new ATOM 0 HG2 LYS A 15 23.744 -4.996 -2.617 1.00 0.00 H new ATOM 0 HG3 LYS A 15 24.957 -5.674 -1.548 1.00 0.00 H new ATOM 0 HD2 LYS A 15 22.952 -6.646 -0.175 1.00 0.00 H new ATOM 0 HD3 LYS A 15 21.959 -6.243 -1.561 1.00 0.00 H new ATOM 0 HE2 LYS A 15 23.545 -7.574 -3.031 1.00 0.00 H new ATOM 0 HE3 LYS A 15 24.433 -8.045 -1.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 22.796 -9.722 -2.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 22.400 -9.041 -0.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 21.539 -8.586 -2.089 1.00 0.00 H new ATOM 250 N GLU A 16 26.315 -3.512 -2.583 1.00 0.00 N ATOM 251 CA GLU A 16 27.721 -3.858 -2.929 1.00 0.00 C ATOM 252 C GLU A 16 28.467 -2.538 -3.148 1.00 0.00 C ATOM 253 O GLU A 16 29.489 -2.266 -2.550 1.00 0.00 O ATOM 254 CB GLU A 16 27.751 -4.685 -4.225 1.00 0.00 C ATOM 255 CG GLU A 16 27.005 -6.007 -4.024 1.00 0.00 C ATOM 256 CD GLU A 16 27.087 -6.846 -5.303 1.00 0.00 C ATOM 257 OE1 GLU A 16 27.554 -6.324 -6.303 1.00 0.00 O ATOM 258 OE2 GLU A 16 26.682 -7.997 -5.264 1.00 0.00 O ATOM 0 H GLU A 16 25.688 -3.404 -3.380 1.00 0.00 H new ATOM 0 HA GLU A 16 28.183 -4.444 -2.135 1.00 0.00 H new ATOM 0 HB2 GLU A 16 27.293 -4.120 -5.037 1.00 0.00 H new ATOM 0 HB3 GLU A 16 28.783 -4.882 -4.516 1.00 0.00 H new ATOM 0 HG2 GLU A 16 27.438 -6.557 -3.189 1.00 0.00 H new ATOM 0 HG3 GLU A 16 25.963 -5.813 -3.771 1.00 0.00 H new ATOM 265 N ASP A 17 27.924 -1.718 -4.006 1.00 0.00 N ATOM 266 CA ASP A 17 28.504 -0.379 -4.303 1.00 0.00 C ATOM 267 C ASP A 17 28.160 -0.070 -5.757 1.00 0.00 C ATOM 268 O ASP A 17 29.014 -0.031 -6.620 1.00 0.00 O ATOM 269 CB ASP A 17 30.022 -0.390 -4.116 1.00 0.00 C ATOM 270 CG ASP A 17 30.635 0.819 -4.830 1.00 0.00 C ATOM 271 OD1 ASP A 17 29.906 1.767 -5.077 1.00 0.00 O ATOM 272 OD2 ASP A 17 31.819 0.774 -5.120 1.00 0.00 O ATOM 0 H ASP A 17 27.075 -1.929 -4.530 1.00 0.00 H new ATOM 0 HA ASP A 17 28.100 0.375 -3.627 1.00 0.00 H new ATOM 0 HB2 ASP A 17 30.268 -0.362 -3.055 1.00 0.00 H new ATOM 0 HB3 ASP A 17 30.441 -1.313 -4.516 1.00 0.00 H new ATOM 277 N THR A 18 26.897 0.091 -6.038 1.00 0.00 N ATOM 278 CA THR A 18 26.463 0.350 -7.440 1.00 0.00 C ATOM 279 C THR A 18 27.181 1.536 -8.071 1.00 0.00 C ATOM 280 O THR A 18 26.954 2.683 -7.733 1.00 0.00 O ATOM 281 CB THR A 18 24.961 0.614 -7.492 1.00 0.00 C ATOM 282 OG1 THR A 18 24.264 -0.516 -6.992 1.00 0.00 O ATOM 283 CG2 THR A 18 24.559 0.868 -8.944 1.00 0.00 C ATOM 0 H THR A 18 26.142 0.054 -5.353 1.00 0.00 H new ATOM 0 HA THR A 18 26.718 -0.545 -8.007 1.00 0.00 H new ATOM 0 HB THR A 18 24.712 1.483 -6.882 1.00 0.00 H new ATOM 0 HG1 THR A 18 24.121 -1.159 -7.717 1.00 0.00 H new ATOM 0 HG21 THR A 18 23.487 1.058 -8.997 1.00 0.00 H new ATOM 0 HG22 THR A 18 25.101 1.734 -9.325 1.00 0.00 H new ATOM 0 HG23 THR A 18 24.802 -0.007 -9.547 1.00 0.00 H new ATOM 291 N LYS A 19 28.003 1.257 -9.040 1.00 0.00 N ATOM 292 CA LYS A 19 28.703 2.338 -9.766 1.00 0.00 C ATOM 293 C LYS A 19 27.651 2.983 -10.660 1.00 0.00 C ATOM 294 O LYS A 19 27.469 2.601 -11.796 1.00 0.00 O ATOM 295 CB LYS A 19 29.826 1.743 -10.621 1.00 0.00 C ATOM 296 CG LYS A 19 29.417 0.342 -11.090 1.00 0.00 C ATOM 297 CD LYS A 19 29.915 -0.702 -10.085 1.00 0.00 C ATOM 298 CE LYS A 19 29.140 -2.011 -10.272 1.00 0.00 C ATOM 299 NZ LYS A 19 29.874 -3.130 -9.618 1.00 0.00 N ATOM 0 H LYS A 19 28.220 0.313 -9.361 1.00 0.00 H new ATOM 0 HA LYS A 19 29.151 3.062 -9.086 1.00 0.00 H new ATOM 0 HB2 LYS A 19 30.023 2.384 -11.481 1.00 0.00 H new ATOM 0 HB3 LYS A 19 30.749 1.691 -10.044 1.00 0.00 H new ATOM 0 HG2 LYS A 19 28.333 0.282 -11.185 1.00 0.00 H new ATOM 0 HG3 LYS A 19 29.836 0.141 -12.076 1.00 0.00 H new ATOM 0 HD2 LYS A 19 30.982 -0.877 -10.226 1.00 0.00 H new ATOM 0 HD3 LYS A 19 29.784 -0.333 -9.068 1.00 0.00 H new ATOM 0 HE2 LYS A 19 28.142 -1.918 -9.843 1.00 0.00 H new ATOM 0 HE3 LYS A 19 29.012 -2.220 -11.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 29.344 -4.015 -9.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 30.817 -3.225 -10.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 29.974 -2.932 -8.602 1.00 0.00 H new ATOM 313 N VAL A 20 26.925 3.929 -10.134 1.00 0.00 N ATOM 314 CA VAL A 20 25.843 4.580 -10.927 1.00 0.00 C ATOM 315 C VAL A 20 26.425 5.276 -12.160 1.00 0.00 C ATOM 316 O VAL A 20 25.877 5.209 -13.242 1.00 0.00 O ATOM 317 CB VAL A 20 25.149 5.619 -10.055 1.00 0.00 C ATOM 318 CG1 VAL A 20 24.547 4.935 -8.826 1.00 0.00 C ATOM 319 CG2 VAL A 20 26.173 6.664 -9.604 1.00 0.00 C ATOM 0 H VAL A 20 27.035 4.282 -9.183 1.00 0.00 H new ATOM 0 HA VAL A 20 25.135 3.818 -11.252 1.00 0.00 H new ATOM 0 HB VAL A 20 24.356 6.103 -10.625 1.00 0.00 H new ATOM 0 HG11 VAL A 20 24.051 5.679 -8.202 1.00 0.00 H new ATOM 0 HG12 VAL A 20 23.822 4.186 -9.145 1.00 0.00 H new ATOM 0 HG13 VAL A 20 25.339 4.452 -8.254 1.00 0.00 H new ATOM 0 HG21 VAL A 20 25.681 7.410 -8.980 1.00 0.00 H new ATOM 0 HG22 VAL A 20 26.963 6.176 -9.033 1.00 0.00 H new ATOM 0 HG23 VAL A 20 26.605 7.151 -10.478 1.00 0.00 H new ATOM 329 N ASP A 21 27.524 5.952 -11.998 1.00 0.00 N ATOM 330 CA ASP A 21 28.149 6.660 -13.151 1.00 0.00 C ATOM 331 C ASP A 21 28.590 5.657 -14.223 1.00 0.00 C ATOM 332 O ASP A 21 28.341 5.853 -15.397 1.00 0.00 O ATOM 333 CB ASP A 21 29.354 7.446 -12.650 1.00 0.00 C ATOM 334 CG ASP A 21 28.872 8.547 -11.703 1.00 0.00 C ATOM 335 OD1 ASP A 21 27.686 8.827 -11.701 1.00 0.00 O ATOM 336 OD2 ASP A 21 29.703 9.100 -10.998 1.00 0.00 O ATOM 0 H ASP A 21 28.021 6.047 -11.112 1.00 0.00 H new ATOM 0 HA ASP A 21 27.421 7.338 -13.596 1.00 0.00 H new ATOM 0 HB2 ASP A 21 30.048 6.783 -12.134 1.00 0.00 H new ATOM 0 HB3 ASP A 21 29.895 7.882 -13.490 1.00 0.00 H new ATOM 341 N GLU A 22 29.223 4.578 -13.847 1.00 0.00 N ATOM 342 CA GLU A 22 29.624 3.574 -14.873 1.00 0.00 C ATOM 343 C GLU A 22 28.346 2.933 -15.396 1.00 0.00 C ATOM 344 O GLU A 22 28.215 2.613 -16.562 1.00 0.00 O ATOM 345 CB GLU A 22 30.522 2.510 -14.245 1.00 0.00 C ATOM 346 CG GLU A 22 31.219 1.721 -15.352 1.00 0.00 C ATOM 347 CD GLU A 22 32.017 0.571 -14.735 1.00 0.00 C ATOM 348 OE1 GLU A 22 31.999 0.447 -13.522 1.00 0.00 O ATOM 349 OE2 GLU A 22 32.633 -0.165 -15.489 1.00 0.00 O ATOM 0 H GLU A 22 29.477 4.350 -12.886 1.00 0.00 H new ATOM 0 HA GLU A 22 30.180 4.049 -15.681 1.00 0.00 H new ATOM 0 HB2 GLU A 22 31.261 2.979 -13.596 1.00 0.00 H new ATOM 0 HB3 GLU A 22 29.930 1.840 -13.622 1.00 0.00 H new ATOM 0 HG2 GLU A 22 30.482 1.331 -16.054 1.00 0.00 H new ATOM 0 HG3 GLU A 22 31.882 2.376 -15.917 1.00 0.00 H new ATOM 356 N ILE A 23 27.386 2.792 -14.534 1.00 0.00 N ATOM 357 CA ILE A 23 26.079 2.240 -14.945 1.00 0.00 C ATOM 358 C ILE A 23 25.441 3.277 -15.865 1.00 0.00 C ATOM 359 O ILE A 23 24.886 2.965 -16.901 1.00 0.00 O ATOM 360 CB ILE A 23 25.230 2.043 -13.686 1.00 0.00 C ATOM 361 CG1 ILE A 23 25.646 0.743 -12.996 1.00 0.00 C ATOM 362 CG2 ILE A 23 23.746 1.985 -14.048 1.00 0.00 C ATOM 363 CD1 ILE A 23 24.922 -0.437 -13.642 1.00 0.00 C ATOM 0 H ILE A 23 27.456 3.041 -13.547 1.00 0.00 H new ATOM 0 HA ILE A 23 26.170 1.284 -15.460 1.00 0.00 H new ATOM 0 HB ILE A 23 25.390 2.885 -13.012 1.00 0.00 H new ATOM 0 HG12 ILE A 23 26.725 0.607 -13.074 1.00 0.00 H new ATOM 0 HG13 ILE A 23 25.407 0.791 -11.934 1.00 0.00 H new ATOM 0 HG21 ILE A 23 23.156 1.845 -13.142 1.00 0.00 H new ATOM 0 HG22 ILE A 23 23.453 2.917 -14.531 1.00 0.00 H new ATOM 0 HG23 ILE A 23 23.570 1.152 -14.729 1.00 0.00 H new ATOM 0 HD11 ILE A 23 25.221 -1.362 -13.148 1.00 0.00 H new ATOM 0 HD12 ILE A 23 23.845 -0.303 -13.541 1.00 0.00 H new ATOM 0 HD13 ILE A 23 25.183 -0.490 -14.699 1.00 0.00 H new ATOM 375 N LEU A 24 25.561 4.519 -15.489 1.00 0.00 N ATOM 376 CA LEU A 24 25.032 5.627 -16.322 1.00 0.00 C ATOM 377 C LEU A 24 25.701 5.578 -17.698 1.00 0.00 C ATOM 378 O LEU A 24 25.064 5.788 -18.712 1.00 0.00 O ATOM 379 CB LEU A 24 25.361 6.947 -15.626 1.00 0.00 C ATOM 380 CG LEU A 24 24.685 8.108 -16.349 1.00 0.00 C ATOM 381 CD1 LEU A 24 23.200 8.139 -15.985 1.00 0.00 C ATOM 382 CD2 LEU A 24 25.346 9.416 -15.912 1.00 0.00 C ATOM 0 H LEU A 24 26.012 4.815 -14.623 1.00 0.00 H new ATOM 0 HA LEU A 24 23.953 5.536 -16.448 1.00 0.00 H new ATOM 0 HB2 LEU A 24 25.028 6.912 -14.589 1.00 0.00 H new ATOM 0 HB3 LEU A 24 26.440 7.098 -15.610 1.00 0.00 H new ATOM 0 HG LEU A 24 24.788 7.984 -17.427 1.00 0.00 H new ATOM 0 HD11 LEU A 24 22.716 8.968 -16.501 1.00 0.00 H new ATOM 0 HD12 LEU A 24 22.732 7.202 -16.286 1.00 0.00 H new ATOM 0 HD13 LEU A 24 23.092 8.269 -14.908 1.00 0.00 H new ATOM 0 HD21 LEU A 24 24.870 10.253 -16.423 1.00 0.00 H new ATOM 0 HD22 LEU A 24 25.234 9.538 -14.835 1.00 0.00 H new ATOM 0 HD23 LEU A 24 26.406 9.391 -16.166 1.00 0.00 H new ATOM 394 N LYS A 25 26.977 5.281 -17.752 1.00 0.00 N ATOM 395 CA LYS A 25 27.647 5.187 -19.080 1.00 0.00 C ATOM 396 C LYS A 25 26.952 4.076 -19.858 1.00 0.00 C ATOM 397 O LYS A 25 26.767 4.160 -21.057 1.00 0.00 O ATOM 398 CB LYS A 25 29.133 4.846 -18.911 1.00 0.00 C ATOM 399 CG LYS A 25 29.799 4.794 -20.290 1.00 0.00 C ATOM 400 CD LYS A 25 30.709 3.566 -20.380 1.00 0.00 C ATOM 401 CE LYS A 25 29.863 2.295 -20.298 1.00 0.00 C ATOM 402 NZ LYS A 25 30.410 1.269 -21.232 1.00 0.00 N ATOM 0 H LYS A 25 27.574 5.102 -16.944 1.00 0.00 H new ATOM 0 HA LYS A 25 27.579 6.139 -19.606 1.00 0.00 H new ATOM 0 HB2 LYS A 25 29.621 5.594 -18.286 1.00 0.00 H new ATOM 0 HB3 LYS A 25 29.243 3.887 -18.405 1.00 0.00 H new ATOM 0 HG2 LYS A 25 29.039 4.753 -21.070 1.00 0.00 H new ATOM 0 HG3 LYS A 25 30.379 5.701 -20.458 1.00 0.00 H new ATOM 0 HD2 LYS A 25 31.269 3.583 -21.315 1.00 0.00 H new ATOM 0 HD3 LYS A 25 31.439 3.582 -19.571 1.00 0.00 H new ATOM 0 HE2 LYS A 25 29.864 1.910 -19.278 1.00 0.00 H new ATOM 0 HE3 LYS A 25 28.827 2.518 -20.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 29.834 0.405 -21.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 30.387 1.637 -22.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 31.392 1.048 -20.969 1.00 0.00 H new ATOM 416 N GLY A 26 26.541 3.047 -19.171 1.00 0.00 N ATOM 417 CA GLY A 26 25.817 1.944 -19.850 1.00 0.00 C ATOM 418 C GLY A 26 24.513 2.510 -20.405 1.00 0.00 C ATOM 419 O GLY A 26 24.216 2.386 -21.577 1.00 0.00 O ATOM 0 H GLY A 26 26.677 2.925 -18.167 1.00 0.00 H new ATOM 0 HA2 GLY A 26 26.424 1.527 -20.653 1.00 0.00 H new ATOM 0 HA3 GLY A 26 25.614 1.133 -19.150 1.00 0.00 H new ATOM 423 N LEU A 27 23.739 3.149 -19.568 1.00 0.00 N ATOM 424 CA LEU A 27 22.460 3.749 -20.036 1.00 0.00 C ATOM 425 C LEU A 27 22.708 4.465 -21.368 1.00 0.00 C ATOM 426 O LEU A 27 21.918 4.368 -22.287 1.00 0.00 O ATOM 427 CB LEU A 27 21.951 4.743 -18.987 1.00 0.00 C ATOM 428 CG LEU A 27 20.459 5.016 -19.207 1.00 0.00 C ATOM 429 CD1 LEU A 27 19.815 5.423 -17.878 1.00 0.00 C ATOM 430 CD2 LEU A 27 20.295 6.155 -20.216 1.00 0.00 C ATOM 0 H LEU A 27 23.940 3.280 -18.577 1.00 0.00 H new ATOM 0 HA LEU A 27 21.709 2.972 -20.178 1.00 0.00 H new ATOM 0 HB2 LEU A 27 22.113 4.343 -17.986 1.00 0.00 H new ATOM 0 HB3 LEU A 27 22.514 5.674 -19.053 1.00 0.00 H new ATOM 0 HG LEU A 27 19.976 4.116 -19.588 1.00 0.00 H new ATOM 0 HD11 LEU A 27 18.754 5.618 -18.032 1.00 0.00 H new ATOM 0 HD12 LEU A 27 19.934 4.617 -17.154 1.00 0.00 H new ATOM 0 HD13 LEU A 27 20.298 6.324 -17.501 1.00 0.00 H new ATOM 0 HD21 LEU A 27 19.235 6.351 -20.374 1.00 0.00 H new ATOM 0 HD22 LEU A 27 20.777 7.054 -19.831 1.00 0.00 H new ATOM 0 HD23 LEU A 27 20.757 5.872 -21.162 1.00 0.00 H new ATOM 442 N GLU A 28 23.807 5.166 -21.493 1.00 0.00 N ATOM 443 CA GLU A 28 24.098 5.842 -22.790 1.00 0.00 C ATOM 444 C GLU A 28 23.978 4.793 -23.888 1.00 0.00 C ATOM 445 O GLU A 28 23.446 5.042 -24.952 1.00 0.00 O ATOM 446 CB GLU A 28 25.519 6.420 -22.777 1.00 0.00 C ATOM 447 CG GLU A 28 25.682 7.363 -21.581 1.00 0.00 C ATOM 448 CD GLU A 28 27.045 8.057 -21.661 1.00 0.00 C ATOM 449 OE1 GLU A 28 27.842 7.660 -22.494 1.00 0.00 O ATOM 450 OE2 GLU A 28 27.267 8.971 -20.885 1.00 0.00 O ATOM 0 H GLU A 28 24.506 5.298 -20.762 1.00 0.00 H new ATOM 0 HA GLU A 28 23.399 6.661 -22.959 1.00 0.00 H new ATOM 0 HB2 GLU A 28 26.250 5.613 -22.718 1.00 0.00 H new ATOM 0 HB3 GLU A 28 25.712 6.958 -23.705 1.00 0.00 H new ATOM 0 HG2 GLU A 28 24.884 8.105 -21.578 1.00 0.00 H new ATOM 0 HG3 GLU A 28 25.601 6.803 -20.649 1.00 0.00 H new ATOM 457 N ASN A 29 24.438 3.603 -23.615 1.00 0.00 N ATOM 458 CA ASN A 29 24.312 2.506 -24.609 1.00 0.00 C ATOM 459 C ASN A 29 22.818 2.238 -24.820 1.00 0.00 C ATOM 460 O ASN A 29 22.346 2.109 -25.931 1.00 0.00 O ATOM 461 CB ASN A 29 25.020 1.263 -24.052 1.00 0.00 C ATOM 462 CG ASN A 29 24.052 0.425 -23.219 1.00 0.00 C ATOM 463 OD1 ASN A 29 23.013 0.017 -23.697 1.00 0.00 O ATOM 464 ND2 ASN A 29 24.361 0.138 -21.984 1.00 0.00 N ATOM 0 H ASN A 29 24.897 3.345 -22.742 1.00 0.00 H new ATOM 0 HA ASN A 29 24.770 2.769 -25.563 1.00 0.00 H new ATOM 0 HB2 ASN A 29 25.416 0.664 -24.872 1.00 0.00 H new ATOM 0 HB3 ASN A 29 25.869 1.565 -23.439 1.00 0.00 H new ATOM 0 HD21 ASN A 29 23.729 -0.430 -21.419 1.00 0.00 H new ATOM 0 HD22 ASN A 29 25.234 0.481 -21.584 1.00 0.00 H new ATOM 471 N LEU A 30 22.072 2.184 -23.745 1.00 0.00 N ATOM 472 CA LEU A 30 20.596 1.984 -23.848 1.00 0.00 C ATOM 473 C LEU A 30 20.048 2.941 -24.909 1.00 0.00 C ATOM 474 O LEU A 30 19.306 2.553 -25.791 1.00 0.00 O ATOM 475 CB LEU A 30 19.962 2.303 -22.488 1.00 0.00 C ATOM 476 CG LEU A 30 18.596 1.619 -22.337 1.00 0.00 C ATOM 477 CD1 LEU A 30 17.666 2.042 -23.475 1.00 0.00 C ATOM 478 CD2 LEU A 30 18.766 0.098 -22.356 1.00 0.00 C ATOM 0 H LEU A 30 22.427 2.271 -22.793 1.00 0.00 H new ATOM 0 HA LEU A 30 20.365 0.956 -24.127 1.00 0.00 H new ATOM 0 HB2 LEU A 30 20.626 1.975 -21.688 1.00 0.00 H new ATOM 0 HB3 LEU A 30 19.845 3.382 -22.383 1.00 0.00 H new ATOM 0 HG LEU A 30 18.159 1.921 -21.385 1.00 0.00 H new ATOM 0 HD11 LEU A 30 16.700 1.551 -23.357 1.00 0.00 H new ATOM 0 HD12 LEU A 30 17.529 3.123 -23.450 1.00 0.00 H new ATOM 0 HD13 LEU A 30 18.106 1.754 -24.430 1.00 0.00 H new ATOM 0 HD21 LEU A 30 17.792 -0.378 -22.248 1.00 0.00 H new ATOM 0 HD22 LEU A 30 19.216 -0.206 -23.301 1.00 0.00 H new ATOM 0 HD23 LEU A 30 19.412 -0.206 -21.532 1.00 0.00 H new ATOM 490 N VAL A 31 20.421 4.196 -24.837 1.00 0.00 N ATOM 491 CA VAL A 31 19.931 5.185 -25.844 1.00 0.00 C ATOM 492 C VAL A 31 20.281 4.682 -27.240 1.00 0.00 C ATOM 493 O VAL A 31 19.637 5.014 -28.216 1.00 0.00 O ATOM 494 CB VAL A 31 20.599 6.541 -25.607 1.00 0.00 C ATOM 495 CG1 VAL A 31 20.116 7.546 -26.656 1.00 0.00 C ATOM 496 CG2 VAL A 31 20.230 7.044 -24.213 1.00 0.00 C ATOM 0 H VAL A 31 21.043 4.577 -24.124 1.00 0.00 H new ATOM 0 HA VAL A 31 18.851 5.300 -25.750 1.00 0.00 H new ATOM 0 HB VAL A 31 21.681 6.433 -25.686 1.00 0.00 H new ATOM 0 HG11 VAL A 31 20.594 8.510 -26.483 1.00 0.00 H new ATOM 0 HG12 VAL A 31 20.375 7.186 -27.652 1.00 0.00 H new ATOM 0 HG13 VAL A 31 19.034 7.659 -26.581 1.00 0.00 H new ATOM 0 HG21 VAL A 31 20.703 8.010 -24.038 1.00 0.00 H new ATOM 0 HG22 VAL A 31 19.148 7.151 -24.140 1.00 0.00 H new ATOM 0 HG23 VAL A 31 20.575 6.330 -23.465 1.00 0.00 H new ATOM 506 N SER A 32 21.290 3.864 -27.340 1.00 0.00 N ATOM 507 CA SER A 32 21.681 3.332 -28.668 1.00 0.00 C ATOM 508 C SER A 32 20.415 2.928 -29.425 1.00 0.00 C ATOM 509 O SER A 32 20.274 3.184 -30.603 1.00 0.00 O ATOM 510 CB SER A 32 22.575 2.104 -28.475 1.00 0.00 C ATOM 511 OG SER A 32 23.034 1.651 -29.741 1.00 0.00 O ATOM 0 H SER A 32 21.860 3.542 -26.557 1.00 0.00 H new ATOM 0 HA SER A 32 22.225 4.090 -29.232 1.00 0.00 H new ATOM 0 HB2 SER A 32 23.422 2.354 -27.837 1.00 0.00 H new ATOM 0 HB3 SER A 32 22.020 1.312 -27.972 1.00 0.00 H new ATOM 0 HG SER A 32 23.608 0.866 -29.619 1.00 0.00 H new ATOM 517 N GLN A 33 19.500 2.280 -28.754 1.00 0.00 N ATOM 518 CA GLN A 33 18.237 1.857 -29.422 1.00 0.00 C ATOM 519 C GLN A 33 17.157 2.950 -29.327 1.00 0.00 C ATOM 520 O GLN A 33 16.123 2.841 -29.953 1.00 0.00 O ATOM 521 CB GLN A 33 17.724 0.582 -28.748 1.00 0.00 C ATOM 522 CG GLN A 33 17.011 0.939 -27.439 1.00 0.00 C ATOM 523 CD GLN A 33 16.959 -0.290 -26.530 1.00 0.00 C ATOM 524 OE1 GLN A 33 17.384 -1.362 -26.914 1.00 0.00 O ATOM 525 NE2 GLN A 33 16.450 -0.180 -25.334 1.00 0.00 N ATOM 0 H GLN A 33 19.574 2.025 -27.769 1.00 0.00 H new ATOM 0 HA GLN A 33 18.447 1.678 -30.477 1.00 0.00 H new ATOM 0 HB2 GLN A 33 17.039 0.057 -29.414 1.00 0.00 H new ATOM 0 HB3 GLN A 33 18.555 -0.094 -28.548 1.00 0.00 H new ATOM 0 HG2 GLN A 33 17.536 1.752 -26.938 1.00 0.00 H new ATOM 0 HG3 GLN A 33 16.001 1.292 -27.648 1.00 0.00 H new ATOM 0 HE21 GLN A 33 16.094 0.720 -25.012 1.00 0.00 H new ATOM 0 HE22 GLN A 33 16.409 -0.994 -24.721 1.00 0.00 H new ATOM 534 N ILE A 34 17.347 3.990 -28.548 1.00 0.00 N ATOM 535 CA ILE A 34 16.277 5.037 -28.485 1.00 0.00 C ATOM 536 C ILE A 34 16.545 6.140 -29.501 1.00 0.00 C ATOM 537 O ILE A 34 16.135 7.268 -29.318 1.00 0.00 O ATOM 538 CB ILE A 34 16.168 5.659 -27.096 1.00 0.00 C ATOM 539 CG1 ILE A 34 15.955 4.565 -26.052 1.00 0.00 C ATOM 540 CG2 ILE A 34 14.964 6.609 -27.077 1.00 0.00 C ATOM 541 CD1 ILE A 34 16.010 5.185 -24.654 1.00 0.00 C ATOM 0 H ILE A 34 18.170 4.157 -27.970 1.00 0.00 H new ATOM 0 HA ILE A 34 15.335 4.539 -28.717 1.00 0.00 H new ATOM 0 HB ILE A 34 17.085 6.201 -26.866 1.00 0.00 H new ATOM 0 HG12 ILE A 34 14.992 4.078 -26.209 1.00 0.00 H new ATOM 0 HG13 ILE A 34 16.721 3.796 -26.152 1.00 0.00 H new ATOM 0 HG21 ILE A 34 14.873 7.062 -26.090 1.00 0.00 H new ATOM 0 HG22 ILE A 34 15.106 7.391 -27.823 1.00 0.00 H new ATOM 0 HG23 ILE A 34 14.056 6.050 -27.305 1.00 0.00 H new ATOM 0 HD11 ILE A 34 15.858 4.408 -23.905 1.00 0.00 H new ATOM 0 HD12 ILE A 34 16.983 5.652 -24.501 1.00 0.00 H new ATOM 0 HD13 ILE A 34 15.228 5.938 -24.559 1.00 0.00 H new ATOM 553 N ASP A 35 17.188 5.836 -30.592 1.00 0.00 N ATOM 554 CA ASP A 35 17.406 6.901 -31.596 1.00 0.00 C ATOM 555 C ASP A 35 16.014 7.366 -32.000 1.00 0.00 C ATOM 556 O ASP A 35 15.830 8.341 -32.698 1.00 0.00 O ATOM 557 CB ASP A 35 18.141 6.327 -32.809 1.00 0.00 C ATOM 558 CG ASP A 35 19.561 5.929 -32.411 1.00 0.00 C ATOM 559 OD1 ASP A 35 19.982 6.311 -31.330 1.00 0.00 O ATOM 560 OD2 ASP A 35 20.209 5.257 -33.195 1.00 0.00 O ATOM 0 H ASP A 35 17.563 4.917 -30.826 1.00 0.00 H new ATOM 0 HA ASP A 35 18.009 7.719 -31.202 1.00 0.00 H new ATOM 0 HB2 ASP A 35 17.605 5.460 -33.194 1.00 0.00 H new ATOM 0 HB3 ASP A 35 18.171 7.065 -33.611 1.00 0.00 H new ATOM 565 N THR A 36 15.032 6.645 -31.529 1.00 0.00 N ATOM 566 CA THR A 36 13.623 6.975 -31.831 1.00 0.00 C ATOM 567 C THR A 36 13.266 8.295 -31.150 1.00 0.00 C ATOM 568 O THR A 36 12.230 8.874 -31.398 1.00 0.00 O ATOM 569 CB THR A 36 12.722 5.859 -31.284 1.00 0.00 C ATOM 570 OG1 THR A 36 12.864 5.784 -29.870 1.00 0.00 O ATOM 571 CG2 THR A 36 13.135 4.526 -31.910 1.00 0.00 C ATOM 0 H THR A 36 15.158 5.825 -30.936 1.00 0.00 H new ATOM 0 HA THR A 36 13.481 7.067 -32.908 1.00 0.00 H new ATOM 0 HB THR A 36 11.682 6.073 -31.532 1.00 0.00 H new ATOM 0 HG1 THR A 36 12.404 4.985 -29.537 1.00 0.00 H new ATOM 0 HG21 THR A 36 12.498 3.730 -31.524 1.00 0.00 H new ATOM 0 HG22 THR A 36 13.028 4.584 -32.993 1.00 0.00 H new ATOM 0 HG23 THR A 36 14.174 4.313 -31.659 1.00 0.00 H new ATOM 579 N VAL A 37 14.121 8.780 -30.295 1.00 0.00 N ATOM 580 CA VAL A 37 13.820 10.066 -29.610 1.00 0.00 C ATOM 581 C VAL A 37 12.319 10.155 -29.345 1.00 0.00 C ATOM 582 O VAL A 37 11.727 11.214 -29.390 1.00 0.00 O ATOM 583 CB VAL A 37 14.234 11.231 -30.502 1.00 0.00 C ATOM 584 CG1 VAL A 37 15.735 11.166 -30.785 1.00 0.00 C ATOM 585 CG2 VAL A 37 13.461 11.154 -31.818 1.00 0.00 C ATOM 0 H VAL A 37 15.009 8.346 -30.042 1.00 0.00 H new ATOM 0 HA VAL A 37 14.369 10.111 -28.670 1.00 0.00 H new ATOM 0 HB VAL A 37 14.010 12.170 -29.997 1.00 0.00 H new ATOM 0 HG11 VAL A 37 16.022 12.002 -31.423 1.00 0.00 H new ATOM 0 HG12 VAL A 37 16.285 11.221 -29.846 1.00 0.00 H new ATOM 0 HG13 VAL A 37 15.970 10.228 -31.289 1.00 0.00 H new ATOM 0 HG21 VAL A 37 13.753 11.985 -32.460 1.00 0.00 H new ATOM 0 HG22 VAL A 37 13.687 10.212 -32.318 1.00 0.00 H new ATOM 0 HG23 VAL A 37 12.391 11.210 -31.616 1.00 0.00 H new ATOM 595 N LYS A 38 11.705 9.045 -29.059 1.00 0.00 N ATOM 596 CA LYS A 38 10.250 9.048 -28.765 1.00 0.00 C ATOM 597 C LYS A 38 10.067 8.552 -27.338 1.00 0.00 C ATOM 598 O LYS A 38 9.215 7.739 -27.046 1.00 0.00 O ATOM 599 CB LYS A 38 9.511 8.118 -29.731 1.00 0.00 C ATOM 600 CG LYS A 38 9.133 8.888 -30.995 1.00 0.00 C ATOM 601 CD LYS A 38 8.471 7.939 -31.994 1.00 0.00 C ATOM 602 CE LYS A 38 8.432 8.599 -33.372 1.00 0.00 C ATOM 603 NZ LYS A 38 7.598 7.777 -34.293 1.00 0.00 N ATOM 0 H LYS A 38 12.152 8.129 -29.016 1.00 0.00 H new ATOM 0 HA LYS A 38 9.845 10.053 -28.882 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.142 7.267 -29.987 1.00 0.00 H new ATOM 0 HB3 LYS A 38 8.615 7.719 -29.254 1.00 0.00 H new ATOM 0 HG2 LYS A 38 8.453 9.703 -30.747 1.00 0.00 H new ATOM 0 HG3 LYS A 38 10.021 9.338 -31.439 1.00 0.00 H new ATOM 0 HD2 LYS A 38 9.025 7.001 -32.043 1.00 0.00 H new ATOM 0 HD3 LYS A 38 7.460 7.696 -31.666 1.00 0.00 H new ATOM 0 HE2 LYS A 38 8.022 9.606 -33.293 1.00 0.00 H new ATOM 0 HE3 LYS A 38 9.442 8.697 -33.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 7.571 8.226 -35.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 8.008 6.825 -34.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 6.632 7.706 -33.916 1.00 0.00 H new ATOM 617 N SER A 39 10.885 9.034 -26.446 1.00 0.00 N ATOM 618 CA SER A 39 10.809 8.579 -25.038 1.00 0.00 C ATOM 619 C SER A 39 11.818 9.376 -24.199 1.00 0.00 C ATOM 620 O SER A 39 12.524 10.215 -24.719 1.00 0.00 O ATOM 621 CB SER A 39 11.137 7.092 -24.995 1.00 0.00 C ATOM 622 OG SER A 39 11.350 6.690 -23.652 1.00 0.00 O ATOM 0 H SER A 39 11.607 9.729 -26.637 1.00 0.00 H new ATOM 0 HA SER A 39 9.810 8.741 -24.632 1.00 0.00 H new ATOM 0 HB2 SER A 39 10.321 6.517 -25.432 1.00 0.00 H new ATOM 0 HB3 SER A 39 12.026 6.888 -25.592 1.00 0.00 H new ATOM 0 HG SER A 39 10.512 6.768 -23.150 1.00 0.00 H new ATOM 628 N PHE A 40 11.878 9.161 -22.912 1.00 0.00 N ATOM 629 CA PHE A 40 12.859 9.942 -22.102 1.00 0.00 C ATOM 630 C PHE A 40 13.387 9.137 -20.913 1.00 0.00 C ATOM 631 O PHE A 40 12.752 8.226 -20.421 1.00 0.00 O ATOM 632 CB PHE A 40 12.157 11.199 -21.584 1.00 0.00 C ATOM 633 CG PHE A 40 13.192 12.214 -21.189 1.00 0.00 C ATOM 634 CD1 PHE A 40 13.895 12.914 -22.175 1.00 0.00 C ATOM 635 CD2 PHE A 40 13.450 12.455 -19.837 1.00 0.00 C ATOM 636 CE1 PHE A 40 14.858 13.858 -21.807 1.00 0.00 C ATOM 637 CE2 PHE A 40 14.413 13.397 -19.466 1.00 0.00 C ATOM 638 CZ PHE A 40 15.119 14.099 -20.452 1.00 0.00 C ATOM 0 H PHE A 40 11.305 8.494 -22.395 1.00 0.00 H new ATOM 0 HA PHE A 40 13.710 10.194 -22.735 1.00 0.00 H new ATOM 0 HB2 PHE A 40 11.503 11.609 -22.354 1.00 0.00 H new ATOM 0 HB3 PHE A 40 11.527 10.952 -20.729 1.00 0.00 H new ATOM 0 HD1 PHE A 40 13.694 12.725 -23.219 1.00 0.00 H new ATOM 0 HD2 PHE A 40 12.905 11.913 -19.078 1.00 0.00 H new ATOM 0 HE1 PHE A 40 15.400 14.401 -22.567 1.00 0.00 H new ATOM 0 HE2 PHE A 40 14.613 13.584 -18.421 1.00 0.00 H new ATOM 0 HZ PHE A 40 15.865 14.826 -20.167 1.00 0.00 H new ATOM 648 N GLU A 41 14.558 9.503 -20.438 1.00 0.00 N ATOM 649 CA GLU A 41 15.189 8.772 -19.297 1.00 0.00 C ATOM 650 C GLU A 41 16.152 9.703 -18.536 1.00 0.00 C ATOM 651 O GLU A 41 17.074 10.258 -19.101 1.00 0.00 O ATOM 652 CB GLU A 41 15.976 7.586 -19.828 1.00 0.00 C ATOM 653 CG GLU A 41 15.097 6.761 -20.767 1.00 0.00 C ATOM 654 CD GLU A 41 15.811 5.456 -21.122 1.00 0.00 C ATOM 655 OE1 GLU A 41 16.991 5.353 -20.833 1.00 0.00 O ATOM 656 OE2 GLU A 41 15.163 4.581 -21.676 1.00 0.00 O ATOM 0 H GLU A 41 15.105 10.285 -20.798 1.00 0.00 H new ATOM 0 HA GLU A 41 14.403 8.431 -18.623 1.00 0.00 H new ATOM 0 HB2 GLU A 41 16.863 7.934 -20.357 1.00 0.00 H new ATOM 0 HB3 GLU A 41 16.321 6.967 -19.000 1.00 0.00 H new ATOM 0 HG2 GLU A 41 14.140 6.546 -20.291 1.00 0.00 H new ATOM 0 HG3 GLU A 41 14.882 7.328 -21.673 1.00 0.00 H new ATOM 663 N TRP A 42 15.955 9.862 -17.252 1.00 0.00 N ATOM 664 CA TRP A 42 16.889 10.696 -16.441 1.00 0.00 C ATOM 665 C TRP A 42 17.348 9.862 -15.253 1.00 0.00 C ATOM 666 O TRP A 42 16.807 8.806 -14.998 1.00 0.00 O ATOM 667 CB TRP A 42 16.158 11.952 -15.952 1.00 0.00 C ATOM 668 CG TRP A 42 15.395 11.651 -14.698 1.00 0.00 C ATOM 669 CD1 TRP A 42 14.730 10.499 -14.456 1.00 0.00 C ATOM 670 CD2 TRP A 42 15.198 12.492 -13.522 1.00 0.00 C ATOM 671 NE1 TRP A 42 14.150 10.570 -13.203 1.00 0.00 N ATOM 672 CE2 TRP A 42 14.410 11.779 -12.587 1.00 0.00 C ATOM 673 CE3 TRP A 42 15.630 13.785 -13.174 1.00 0.00 C ATOM 674 CZ2 TRP A 42 14.062 12.328 -11.352 1.00 0.00 C ATOM 675 CZ3 TRP A 42 15.276 14.344 -11.935 1.00 0.00 C ATOM 676 CH2 TRP A 42 14.493 13.617 -11.026 1.00 0.00 C ATOM 0 H TRP A 42 15.183 9.448 -16.729 1.00 0.00 H new ATOM 0 HA TRP A 42 17.748 11.004 -17.037 1.00 0.00 H new ATOM 0 HB2 TRP A 42 16.876 12.751 -15.767 1.00 0.00 H new ATOM 0 HB3 TRP A 42 15.477 12.309 -16.724 1.00 0.00 H new ATOM 0 HD1 TRP A 42 14.663 9.659 -15.132 1.00 0.00 H new ATOM 0 HE1 TRP A 42 13.598 9.821 -12.785 1.00 0.00 H new ATOM 0 HE3 TRP A 42 16.238 14.351 -13.864 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 13.464 11.761 -10.654 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 15.609 15.340 -11.681 1.00 0.00 H new ATOM 0 HH2 TRP A 42 14.224 14.053 -10.075 1.00 0.00 H new ATOM 687 N GLY A 43 18.333 10.300 -14.517 1.00 0.00 N ATOM 688 CA GLY A 43 18.790 9.471 -13.355 1.00 0.00 C ATOM 689 C GLY A 43 19.403 10.352 -12.266 1.00 0.00 C ATOM 690 O GLY A 43 20.151 11.270 -12.541 1.00 0.00 O ATOM 0 H GLY A 43 18.835 11.176 -14.661 1.00 0.00 H new ATOM 0 HA2 GLY A 43 17.947 8.914 -12.946 1.00 0.00 H new ATOM 0 HA3 GLY A 43 19.523 8.738 -13.692 1.00 0.00 H new ATOM 694 N GLU A 44 19.103 10.072 -11.027 1.00 0.00 N ATOM 695 CA GLU A 44 19.681 10.880 -9.920 1.00 0.00 C ATOM 696 C GLU A 44 20.394 9.955 -8.939 1.00 0.00 C ATOM 697 O GLU A 44 20.302 8.749 -9.025 1.00 0.00 O ATOM 698 CB GLU A 44 18.574 11.629 -9.172 1.00 0.00 C ATOM 699 CG GLU A 44 17.658 12.345 -10.166 1.00 0.00 C ATOM 700 CD GLU A 44 16.755 11.317 -10.845 1.00 0.00 C ATOM 701 OE1 GLU A 44 15.950 10.715 -10.154 1.00 0.00 O ATOM 702 OE2 GLU A 44 16.885 11.146 -12.047 1.00 0.00 O ATOM 0 H GLU A 44 18.482 9.318 -10.735 1.00 0.00 H new ATOM 0 HA GLU A 44 20.382 11.600 -10.342 1.00 0.00 H new ATOM 0 HB2 GLU A 44 17.994 10.930 -8.570 1.00 0.00 H new ATOM 0 HB3 GLU A 44 19.014 12.352 -8.485 1.00 0.00 H new ATOM 0 HG2 GLU A 44 17.055 13.092 -9.650 1.00 0.00 H new ATOM 0 HG3 GLU A 44 18.252 12.874 -10.911 1.00 0.00 H new ATOM 709 N ASP A 45 21.076 10.529 -7.996 1.00 0.00 N ATOM 710 CA ASP A 45 21.775 9.732 -6.952 1.00 0.00 C ATOM 711 C ASP A 45 22.194 10.715 -5.858 1.00 0.00 C ATOM 712 O ASP A 45 23.229 11.343 -5.965 1.00 0.00 O ATOM 713 CB ASP A 45 22.997 9.031 -7.550 1.00 0.00 C ATOM 714 CG ASP A 45 23.704 8.213 -6.469 1.00 0.00 C ATOM 715 OD1 ASP A 45 23.395 8.419 -5.303 1.00 0.00 O ATOM 716 OD2 ASP A 45 24.542 7.400 -6.816 1.00 0.00 O ATOM 0 H ASP A 45 21.182 11.539 -7.900 1.00 0.00 H new ATOM 0 HA ASP A 45 21.126 8.956 -6.546 1.00 0.00 H new ATOM 0 HB2 ASP A 45 22.690 8.381 -8.369 1.00 0.00 H new ATOM 0 HB3 ASP A 45 23.682 9.768 -7.968 1.00 0.00 H new ATOM 721 N LYS A 46 21.421 10.887 -4.824 1.00 0.00 N ATOM 722 CA LYS A 46 21.855 11.834 -3.757 1.00 0.00 C ATOM 723 C LYS A 46 22.695 11.092 -2.717 1.00 0.00 C ATOM 724 O LYS A 46 22.792 9.880 -2.734 1.00 0.00 O ATOM 725 CB LYS A 46 20.641 12.471 -3.086 1.00 0.00 C ATOM 726 CG LYS A 46 19.571 11.400 -2.854 1.00 0.00 C ATOM 727 CD LYS A 46 20.084 10.382 -1.836 1.00 0.00 C ATOM 728 CE LYS A 46 18.896 9.685 -1.167 1.00 0.00 C ATOM 729 NZ LYS A 46 17.912 10.710 -0.710 1.00 0.00 N ATOM 0 H LYS A 46 20.525 10.424 -4.671 1.00 0.00 H new ATOM 0 HA LYS A 46 22.457 12.622 -4.210 1.00 0.00 H new ATOM 0 HB2 LYS A 46 20.931 12.923 -2.138 1.00 0.00 H new ATOM 0 HB3 LYS A 46 20.243 13.270 -3.712 1.00 0.00 H new ATOM 0 HG2 LYS A 46 18.652 11.861 -2.492 1.00 0.00 H new ATOM 0 HG3 LYS A 46 19.330 10.902 -3.793 1.00 0.00 H new ATOM 0 HD2 LYS A 46 20.720 9.647 -2.330 1.00 0.00 H new ATOM 0 HD3 LYS A 46 20.697 10.880 -1.085 1.00 0.00 H new ATOM 0 HE2 LYS A 46 18.422 8.997 -1.868 1.00 0.00 H new ATOM 0 HE3 LYS A 46 19.239 9.091 -0.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 17.183 10.255 -0.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 18.402 11.437 -0.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 17.464 11.154 -1.537 1.00 0.00 H new ATOM 743 N GLU A 47 23.302 11.816 -1.817 1.00 0.00 N ATOM 744 CA GLU A 47 24.107 11.169 -0.738 1.00 0.00 C ATOM 745 C GLU A 47 24.550 12.234 0.270 1.00 0.00 C ATOM 746 O GLU A 47 25.594 12.836 0.132 1.00 0.00 O ATOM 747 CB GLU A 47 25.343 10.480 -1.338 1.00 0.00 C ATOM 748 CG GLU A 47 25.220 8.963 -1.181 1.00 0.00 C ATOM 749 CD GLU A 47 26.505 8.293 -1.669 1.00 0.00 C ATOM 750 OE1 GLU A 47 27.356 8.995 -2.191 1.00 0.00 O ATOM 751 OE2 GLU A 47 26.619 7.088 -1.511 1.00 0.00 O ATOM 0 H GLU A 47 23.276 12.835 -1.781 1.00 0.00 H new ATOM 0 HA GLU A 47 23.496 10.419 -0.236 1.00 0.00 H new ATOM 0 HB2 GLU A 47 25.439 10.739 -2.393 1.00 0.00 H new ATOM 0 HB3 GLU A 47 26.245 10.834 -0.840 1.00 0.00 H new ATOM 0 HG2 GLU A 47 25.039 8.708 -0.137 1.00 0.00 H new ATOM 0 HG3 GLU A 47 24.367 8.596 -1.751 1.00 0.00 H new ATOM 758 N SER A 48 23.760 12.473 1.287 1.00 0.00 N ATOM 759 CA SER A 48 24.135 13.506 2.297 1.00 0.00 C ATOM 760 C SER A 48 22.908 13.902 3.128 1.00 0.00 C ATOM 761 O SER A 48 21.796 13.905 2.643 1.00 0.00 O ATOM 762 CB SER A 48 24.675 14.743 1.577 1.00 0.00 C ATOM 763 OG SER A 48 24.329 15.905 2.320 1.00 0.00 O ATOM 0 H SER A 48 22.874 11.998 1.460 1.00 0.00 H new ATOM 0 HA SER A 48 24.898 13.096 2.959 1.00 0.00 H new ATOM 0 HB2 SER A 48 25.758 14.673 1.471 1.00 0.00 H new ATOM 0 HB3 SER A 48 24.260 14.803 0.571 1.00 0.00 H new ATOM 0 HG SER A 48 24.674 16.700 1.863 1.00 0.00 H new ATOM 769 N HIS A 49 23.104 14.243 4.374 1.00 0.00 N ATOM 770 CA HIS A 49 21.956 14.686 5.220 1.00 0.00 C ATOM 771 C HIS A 49 20.895 13.585 5.267 1.00 0.00 C ATOM 772 O HIS A 49 20.278 13.259 4.273 1.00 0.00 O ATOM 773 CB HIS A 49 21.351 15.967 4.635 1.00 0.00 C ATOM 774 CG HIS A 49 22.388 17.056 4.632 1.00 0.00 C ATOM 775 ND1 HIS A 49 22.252 18.205 3.866 1.00 0.00 N ATOM 776 CD2 HIS A 49 23.583 17.188 5.298 1.00 0.00 C ATOM 777 CE1 HIS A 49 23.336 18.972 4.087 1.00 0.00 C ATOM 778 NE2 HIS A 49 24.175 18.397 4.950 1.00 0.00 N ATOM 0 H HIS A 49 24.010 14.234 4.843 1.00 0.00 H new ATOM 0 HA HIS A 49 22.308 14.885 6.232 1.00 0.00 H new ATOM 0 HB2 HIS A 49 20.997 15.784 3.620 1.00 0.00 H new ATOM 0 HB3 HIS A 49 20.487 16.275 5.223 1.00 0.00 H new ATOM 0 HD2 HIS A 49 23.998 16.465 5.985 1.00 0.00 H new ATOM 0 HE1 HIS A 49 23.505 19.933 3.624 1.00 0.00 H new ATOM 0 HE2 HIS A 49 25.065 18.767 5.285 1.00 0.00 H new ATOM 787 N ASP A 50 20.686 13.004 6.415 1.00 0.00 N ATOM 788 CA ASP A 50 19.656 11.930 6.541 1.00 0.00 C ATOM 789 C ASP A 50 18.304 12.405 5.993 1.00 0.00 C ATOM 790 O ASP A 50 17.614 11.677 5.310 1.00 0.00 O ATOM 791 CB ASP A 50 19.497 11.552 8.014 1.00 0.00 C ATOM 792 CG ASP A 50 18.958 12.752 8.798 1.00 0.00 C ATOM 793 OD1 ASP A 50 19.159 13.867 8.346 1.00 0.00 O ATOM 794 OD2 ASP A 50 18.352 12.535 9.833 1.00 0.00 O ATOM 0 H ASP A 50 21.185 13.226 7.276 1.00 0.00 H new ATOM 0 HA ASP A 50 19.983 11.065 5.964 1.00 0.00 H new ATOM 0 HB2 ASP A 50 18.816 10.706 8.111 1.00 0.00 H new ATOM 0 HB3 ASP A 50 20.457 11.238 8.425 1.00 0.00 H new ATOM 799 N MET A 51 17.910 13.609 6.305 1.00 0.00 N ATOM 800 CA MET A 51 16.602 14.120 5.799 1.00 0.00 C ATOM 801 C MET A 51 16.602 14.191 4.266 1.00 0.00 C ATOM 802 O MET A 51 15.592 13.954 3.633 1.00 0.00 O ATOM 803 CB MET A 51 16.331 15.509 6.378 1.00 0.00 C ATOM 804 CG MET A 51 14.906 15.937 6.024 1.00 0.00 C ATOM 805 SD MET A 51 14.610 17.612 6.641 1.00 0.00 S ATOM 806 CE MET A 51 12.838 17.679 6.281 1.00 0.00 C ATOM 0 H MET A 51 18.435 14.261 6.887 1.00 0.00 H new ATOM 0 HA MET A 51 15.817 13.433 6.115 1.00 0.00 H new ATOM 0 HB2 MET A 51 16.460 15.496 7.460 1.00 0.00 H new ATOM 0 HB3 MET A 51 17.048 16.227 5.980 1.00 0.00 H new ATOM 0 HG2 MET A 51 14.763 15.905 4.944 1.00 0.00 H new ATOM 0 HG3 MET A 51 14.187 15.244 6.462 1.00 0.00 H new ATOM 0 HE1 MET A 51 12.558 18.699 6.019 1.00 0.00 H new ATOM 0 HE2 MET A 51 12.611 17.015 5.447 1.00 0.00 H new ATOM 0 HE3 MET A 51 12.276 17.363 7.160 1.00 0.00 H new ATOM 816 N LEU A 52 17.713 14.509 3.657 1.00 0.00 N ATOM 817 CA LEU A 52 17.752 14.522 2.163 1.00 0.00 C ATOM 818 C LEU A 52 18.140 13.129 1.654 1.00 0.00 C ATOM 819 O LEU A 52 17.912 12.789 0.510 1.00 0.00 O ATOM 820 CB LEU A 52 18.790 15.539 1.675 1.00 0.00 C ATOM 821 CG LEU A 52 18.676 16.837 2.484 1.00 0.00 C ATOM 822 CD1 LEU A 52 19.735 17.831 2.001 1.00 0.00 C ATOM 823 CD2 LEU A 52 17.286 17.446 2.286 1.00 0.00 C ATOM 0 H LEU A 52 18.586 14.758 4.121 1.00 0.00 H new ATOM 0 HA LEU A 52 16.768 14.798 1.783 1.00 0.00 H new ATOM 0 HB2 LEU A 52 19.793 15.124 1.777 1.00 0.00 H new ATOM 0 HB3 LEU A 52 18.637 15.747 0.616 1.00 0.00 H new ATOM 0 HG LEU A 52 18.830 16.619 3.541 1.00 0.00 H new ATOM 0 HD11 LEU A 52 19.656 18.754 2.575 1.00 0.00 H new ATOM 0 HD12 LEU A 52 20.727 17.402 2.140 1.00 0.00 H new ATOM 0 HD13 LEU A 52 19.577 18.046 0.944 1.00 0.00 H new ATOM 0 HD21 LEU A 52 17.207 18.368 2.862 1.00 0.00 H new ATOM 0 HD22 LEU A 52 17.131 17.664 1.229 1.00 0.00 H new ATOM 0 HD23 LEU A 52 16.528 16.740 2.626 1.00 0.00 H new ATOM 835 N ARG A 53 18.742 12.330 2.494 1.00 0.00 N ATOM 836 CA ARG A 53 19.144 10.952 2.079 1.00 0.00 C ATOM 837 C ARG A 53 17.975 9.968 2.215 1.00 0.00 C ATOM 838 O ARG A 53 18.139 8.861 2.686 1.00 0.00 O ATOM 839 CB ARG A 53 20.299 10.489 2.968 1.00 0.00 C ATOM 840 CG ARG A 53 21.041 9.332 2.288 1.00 0.00 C ATOM 841 CD ARG A 53 22.158 8.847 3.208 1.00 0.00 C ATOM 842 NE ARG A 53 23.039 7.900 2.459 1.00 0.00 N ATOM 843 CZ ARG A 53 22.566 6.784 1.988 1.00 0.00 C ATOM 844 NH1 ARG A 53 21.343 6.434 2.259 1.00 0.00 N ATOM 845 NH2 ARG A 53 23.315 6.022 1.234 1.00 0.00 N ATOM 0 H ARG A 53 18.975 12.574 3.457 1.00 0.00 H new ATOM 0 HA ARG A 53 19.449 10.976 1.033 1.00 0.00 H new ATOM 0 HB2 ARG A 53 20.985 11.316 3.151 1.00 0.00 H new ATOM 0 HB3 ARG A 53 19.919 10.170 3.938 1.00 0.00 H new ATOM 0 HG2 ARG A 53 20.350 8.517 2.073 1.00 0.00 H new ATOM 0 HG3 ARG A 53 21.455 9.659 1.334 1.00 0.00 H new ATOM 0 HD2 ARG A 53 22.740 9.694 3.570 1.00 0.00 H new ATOM 0 HD3 ARG A 53 21.735 8.354 4.083 1.00 0.00 H new ATOM 0 HE ARG A 53 24.022 8.132 2.316 1.00 0.00 H new ATOM 0 HH11 ARG A 53 20.757 7.034 2.840 1.00 0.00 H new ATOM 0 HH12 ARG A 53 20.969 5.559 1.891 1.00 0.00 H new ATOM 0 HH21 ARG A 53 24.271 6.303 1.015 1.00 0.00 H new ATOM 0 HH22 ARG A 53 22.943 5.147 0.865 1.00 0.00 H new ATOM 859 N GLN A 54 16.796 10.356 1.822 1.00 0.00 N ATOM 860 CA GLN A 54 15.641 9.409 1.875 1.00 0.00 C ATOM 861 C GLN A 54 16.126 7.967 1.650 1.00 0.00 C ATOM 862 O GLN A 54 15.419 7.012 1.908 1.00 0.00 O ATOM 863 CB GLN A 54 14.607 9.785 0.809 1.00 0.00 C ATOM 864 CG GLN A 54 13.260 9.144 1.161 1.00 0.00 C ATOM 865 CD GLN A 54 12.300 9.289 -0.022 1.00 0.00 C ATOM 866 OE1 GLN A 54 12.629 8.932 -1.135 1.00 0.00 O ATOM 867 NE2 GLN A 54 11.118 9.802 0.177 1.00 0.00 N ATOM 0 H GLN A 54 16.578 11.287 1.466 1.00 0.00 H new ATOM 0 HA GLN A 54 15.178 9.475 2.859 1.00 0.00 H new ATOM 0 HB2 GLN A 54 14.503 10.869 0.753 1.00 0.00 H new ATOM 0 HB3 GLN A 54 14.939 9.445 -0.172 1.00 0.00 H new ATOM 0 HG2 GLN A 54 13.399 8.090 1.403 1.00 0.00 H new ATOM 0 HG3 GLN A 54 12.838 9.621 2.046 1.00 0.00 H new ATOM 0 HE21 GLN A 54 10.843 10.101 1.112 1.00 0.00 H new ATOM 0 HE22 GLN A 54 10.468 9.904 -0.603 1.00 0.00 H new ATOM 876 N GLY A 55 17.346 7.811 1.208 1.00 0.00 N ATOM 877 CA GLY A 55 17.946 6.448 1.049 1.00 0.00 C ATOM 878 C GLY A 55 18.040 6.002 -0.421 1.00 0.00 C ATOM 879 O GLY A 55 18.974 5.322 -0.794 1.00 0.00 O ATOM 0 H GLY A 55 17.963 8.580 0.946 1.00 0.00 H new ATOM 0 HA2 GLY A 55 18.943 6.442 1.490 1.00 0.00 H new ATOM 0 HA3 GLY A 55 17.348 5.726 1.605 1.00 0.00 H new ATOM 883 N PHE A 56 17.097 6.342 -1.258 1.00 0.00 N ATOM 884 CA PHE A 56 17.192 5.888 -2.683 1.00 0.00 C ATOM 885 C PHE A 56 18.530 6.335 -3.287 1.00 0.00 C ATOM 886 O PHE A 56 18.712 7.486 -3.628 1.00 0.00 O ATOM 887 CB PHE A 56 16.026 6.461 -3.496 1.00 0.00 C ATOM 888 CG PHE A 56 16.489 7.673 -4.258 1.00 0.00 C ATOM 889 CD1 PHE A 56 16.533 8.917 -3.623 1.00 0.00 C ATOM 890 CD2 PHE A 56 16.874 7.554 -5.599 1.00 0.00 C ATOM 891 CE1 PHE A 56 16.963 10.045 -4.329 1.00 0.00 C ATOM 892 CE2 PHE A 56 17.304 8.681 -6.304 1.00 0.00 C ATOM 893 CZ PHE A 56 17.347 9.928 -5.669 1.00 0.00 C ATOM 0 H PHE A 56 16.278 6.904 -1.027 1.00 0.00 H new ATOM 0 HA PHE A 56 17.138 4.800 -2.713 1.00 0.00 H new ATOM 0 HB2 PHE A 56 15.646 5.708 -4.187 1.00 0.00 H new ATOM 0 HB3 PHE A 56 15.204 6.728 -2.832 1.00 0.00 H new ATOM 0 HD1 PHE A 56 16.235 9.007 -2.589 1.00 0.00 H new ATOM 0 HD2 PHE A 56 16.839 6.592 -6.088 1.00 0.00 H new ATOM 0 HE1 PHE A 56 16.999 11.007 -3.839 1.00 0.00 H new ATOM 0 HE2 PHE A 56 17.603 8.590 -7.338 1.00 0.00 H new ATOM 0 HZ PHE A 56 17.677 10.800 -6.214 1.00 0.00 H new ATOM 903 N THR A 57 19.470 5.431 -3.408 1.00 0.00 N ATOM 904 CA THR A 57 20.813 5.803 -3.950 1.00 0.00 C ATOM 905 C THR A 57 20.700 6.316 -5.390 1.00 0.00 C ATOM 906 O THR A 57 21.447 7.180 -5.804 1.00 0.00 O ATOM 907 CB THR A 57 21.733 4.577 -3.935 1.00 0.00 C ATOM 908 OG1 THR A 57 21.242 3.603 -4.846 1.00 0.00 O ATOM 909 CG2 THR A 57 21.777 3.982 -2.526 1.00 0.00 C ATOM 0 H THR A 57 19.365 4.449 -3.154 1.00 0.00 H new ATOM 0 HA THR A 57 21.224 6.593 -3.322 1.00 0.00 H new ATOM 0 HB THR A 57 22.738 4.878 -4.231 1.00 0.00 H new ATOM 0 HG1 THR A 57 21.452 3.878 -5.763 1.00 0.00 H new ATOM 0 HG21 THR A 57 22.432 3.111 -2.519 1.00 0.00 H new ATOM 0 HG22 THR A 57 22.158 4.728 -1.828 1.00 0.00 H new ATOM 0 HG23 THR A 57 20.773 3.683 -2.226 1.00 0.00 H new ATOM 917 N HIS A 58 19.794 5.785 -6.167 1.00 0.00 N ATOM 918 CA HIS A 58 19.641 6.289 -7.563 1.00 0.00 C ATOM 919 C HIS A 58 18.401 5.674 -8.213 1.00 0.00 C ATOM 920 O HIS A 58 18.014 4.562 -7.914 1.00 0.00 O ATOM 921 CB HIS A 58 20.875 5.891 -8.380 1.00 0.00 C ATOM 922 CG HIS A 58 21.065 4.397 -8.311 1.00 0.00 C ATOM 923 ND1 HIS A 58 21.471 3.755 -7.150 1.00 0.00 N ATOM 924 CD2 HIS A 58 20.914 3.406 -9.253 1.00 0.00 C ATOM 925 CE1 HIS A 58 21.553 2.439 -7.419 1.00 0.00 C ATOM 926 NE2 HIS A 58 21.224 2.176 -8.685 1.00 0.00 N ATOM 0 H HIS A 58 19.160 5.032 -5.900 1.00 0.00 H new ATOM 0 HA HIS A 58 19.536 7.374 -7.539 1.00 0.00 H new ATOM 0 HB2 HIS A 58 20.754 6.205 -9.417 1.00 0.00 H new ATOM 0 HB3 HIS A 58 21.759 6.399 -7.994 1.00 0.00 H new ATOM 0 HD2 HIS A 58 20.603 3.560 -10.276 1.00 0.00 H new ATOM 0 HE1 HIS A 58 21.848 1.689 -6.700 1.00 0.00 H new ATOM 0 HE2 HIS A 58 21.204 1.264 -9.140 1.00 0.00 H new ATOM 935 N ALA A 59 17.786 6.389 -9.115 1.00 0.00 N ATOM 936 CA ALA A 59 16.556 5.869 -9.769 1.00 0.00 C ATOM 937 C ALA A 59 16.545 6.298 -11.235 1.00 0.00 C ATOM 938 O ALA A 59 17.353 7.097 -11.666 1.00 0.00 O ATOM 939 CB ALA A 59 15.313 6.417 -9.067 1.00 0.00 C ATOM 0 H ALA A 59 18.085 7.313 -9.427 1.00 0.00 H new ATOM 0 HA ALA A 59 16.548 4.781 -9.702 1.00 0.00 H new ATOM 0 HB1 ALA A 59 14.419 6.029 -9.555 1.00 0.00 H new ATOM 0 HB2 ALA A 59 15.319 6.108 -8.022 1.00 0.00 H new ATOM 0 HB3 ALA A 59 15.314 7.506 -9.123 1.00 0.00 H new ATOM 945 N PHE A 60 15.631 5.775 -12.000 1.00 0.00 N ATOM 946 CA PHE A 60 15.545 6.159 -13.430 1.00 0.00 C ATOM 947 C PHE A 60 14.078 6.331 -13.814 1.00 0.00 C ATOM 948 O PHE A 60 13.242 5.511 -13.486 1.00 0.00 O ATOM 949 CB PHE A 60 16.158 5.052 -14.293 1.00 0.00 C ATOM 950 CG PHE A 60 17.630 4.917 -13.987 1.00 0.00 C ATOM 951 CD1 PHE A 60 18.533 5.876 -14.460 1.00 0.00 C ATOM 952 CD2 PHE A 60 18.092 3.837 -13.224 1.00 0.00 C ATOM 953 CE1 PHE A 60 19.898 5.757 -14.172 1.00 0.00 C ATOM 954 CE2 PHE A 60 19.456 3.717 -12.935 1.00 0.00 C ATOM 955 CZ PHE A 60 20.358 4.676 -13.409 1.00 0.00 C ATOM 0 H PHE A 60 14.937 5.094 -11.692 1.00 0.00 H new ATOM 0 HA PHE A 60 16.085 7.092 -13.590 1.00 0.00 H new ATOM 0 HB2 PHE A 60 15.650 4.107 -14.102 1.00 0.00 H new ATOM 0 HB3 PHE A 60 16.017 5.282 -15.349 1.00 0.00 H new ATOM 0 HD1 PHE A 60 18.176 6.709 -15.048 1.00 0.00 H new ATOM 0 HD2 PHE A 60 17.396 3.097 -12.859 1.00 0.00 H new ATOM 0 HE1 PHE A 60 20.595 6.497 -14.537 1.00 0.00 H new ATOM 0 HE2 PHE A 60 19.812 2.885 -12.346 1.00 0.00 H new ATOM 0 HZ PHE A 60 21.411 4.583 -13.186 1.00 0.00 H new ATOM 965 N SER A 61 13.755 7.376 -14.516 1.00 0.00 N ATOM 966 CA SER A 61 12.333 7.598 -14.905 1.00 0.00 C ATOM 967 C SER A 61 12.218 7.408 -16.419 1.00 0.00 C ATOM 968 O SER A 61 12.678 8.222 -17.194 1.00 0.00 O ATOM 969 CB SER A 61 11.899 9.009 -14.517 1.00 0.00 C ATOM 970 OG SER A 61 10.485 9.109 -14.633 1.00 0.00 O ATOM 0 H SER A 61 14.411 8.087 -14.839 1.00 0.00 H new ATOM 0 HA SER A 61 11.686 6.889 -14.389 1.00 0.00 H new ATOM 0 HB2 SER A 61 12.209 9.230 -13.496 1.00 0.00 H new ATOM 0 HB3 SER A 61 12.382 9.742 -15.163 1.00 0.00 H new ATOM 0 HG SER A 61 10.197 10.004 -14.356 1.00 0.00 H new ATOM 976 N MET A 62 11.646 6.317 -16.847 1.00 0.00 N ATOM 977 CA MET A 62 11.487 6.090 -18.306 1.00 0.00 C ATOM 978 C MET A 62 10.110 6.529 -18.774 1.00 0.00 C ATOM 979 O MET A 62 9.097 6.013 -18.347 1.00 0.00 O ATOM 980 CB MET A 62 11.676 4.601 -18.611 1.00 0.00 C ATOM 981 CG MET A 62 13.114 4.194 -18.294 1.00 0.00 C ATOM 982 SD MET A 62 13.326 2.428 -18.620 1.00 0.00 S ATOM 983 CE MET A 62 15.026 2.287 -18.017 1.00 0.00 C ATOM 0 H MET A 62 11.283 5.575 -16.249 1.00 0.00 H new ATOM 0 HA MET A 62 12.237 6.679 -18.834 1.00 0.00 H new ATOM 0 HB2 MET A 62 10.980 4.007 -18.019 1.00 0.00 H new ATOM 0 HB3 MET A 62 11.453 4.403 -19.659 1.00 0.00 H new ATOM 0 HG2 MET A 62 13.810 4.773 -18.902 1.00 0.00 H new ATOM 0 HG3 MET A 62 13.344 4.412 -17.251 1.00 0.00 H new ATOM 0 HE1 MET A 62 15.366 1.257 -18.126 1.00 0.00 H new ATOM 0 HE2 MET A 62 15.673 2.946 -18.595 1.00 0.00 H new ATOM 0 HE3 MET A 62 15.064 2.572 -16.966 1.00 0.00 H new ATOM 993 N THR A 63 10.080 7.462 -19.678 1.00 0.00 N ATOM 994 CA THR A 63 8.788 7.981 -20.198 1.00 0.00 C ATOM 995 C THR A 63 8.721 7.643 -21.698 1.00 0.00 C ATOM 996 O THR A 63 9.723 7.667 -22.388 1.00 0.00 O ATOM 997 CB THR A 63 8.728 9.494 -19.971 1.00 0.00 C ATOM 998 OG1 THR A 63 8.988 9.762 -18.598 1.00 0.00 O ATOM 999 CG2 THR A 63 7.341 10.029 -20.335 1.00 0.00 C ATOM 0 H THR A 63 10.909 7.894 -20.086 1.00 0.00 H new ATOM 0 HA THR A 63 7.940 7.529 -19.684 1.00 0.00 H new ATOM 0 HB THR A 63 9.472 9.983 -20.600 1.00 0.00 H new ATOM 0 HG1 THR A 63 8.954 10.729 -18.441 1.00 0.00 H new ATOM 0 HG21 THR A 63 7.311 11.106 -20.169 1.00 0.00 H new ATOM 0 HG22 THR A 63 7.133 9.818 -21.384 1.00 0.00 H new ATOM 0 HG23 THR A 63 6.589 9.545 -19.712 1.00 0.00 H new ATOM 1007 N PHE A 64 7.576 7.281 -22.200 1.00 0.00 N ATOM 1008 CA PHE A 64 7.486 6.932 -23.649 1.00 0.00 C ATOM 1009 C PHE A 64 6.472 7.841 -24.346 1.00 0.00 C ATOM 1010 O PHE A 64 5.525 8.300 -23.743 1.00 0.00 O ATOM 1011 CB PHE A 64 7.017 5.473 -23.769 1.00 0.00 C ATOM 1012 CG PHE A 64 7.839 4.594 -22.858 1.00 0.00 C ATOM 1013 CD1 PHE A 64 9.211 4.444 -23.086 1.00 0.00 C ATOM 1014 CD2 PHE A 64 7.230 3.930 -21.786 1.00 0.00 C ATOM 1015 CE1 PHE A 64 9.975 3.630 -22.241 1.00 0.00 C ATOM 1016 CE2 PHE A 64 7.994 3.116 -20.942 1.00 0.00 C ATOM 1017 CZ PHE A 64 9.368 2.967 -21.169 1.00 0.00 C ATOM 0 H PHE A 64 6.703 7.211 -21.677 1.00 0.00 H new ATOM 0 HA PHE A 64 8.461 7.062 -24.118 1.00 0.00 H new ATOM 0 HB2 PHE A 64 5.962 5.398 -23.506 1.00 0.00 H new ATOM 0 HB3 PHE A 64 7.114 5.134 -24.800 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.681 4.956 -23.913 1.00 0.00 H new ATOM 0 HD2 PHE A 64 6.171 4.046 -21.611 1.00 0.00 H new ATOM 0 HE1 PHE A 64 11.034 3.514 -22.417 1.00 0.00 H new ATOM 0 HE2 PHE A 64 7.524 2.603 -20.116 1.00 0.00 H new ATOM 0 HZ PHE A 64 9.959 2.341 -20.517 1.00 0.00 H new ATOM 1027 N GLU A 65 6.639 8.077 -25.624 1.00 0.00 N ATOM 1028 CA GLU A 65 5.668 8.953 -26.340 1.00 0.00 C ATOM 1029 C GLU A 65 4.509 8.075 -26.801 1.00 0.00 C ATOM 1030 O GLU A 65 3.401 8.531 -27.001 1.00 0.00 O ATOM 1031 CB GLU A 65 6.324 9.593 -27.564 1.00 0.00 C ATOM 1032 CG GLU A 65 5.349 10.595 -28.188 1.00 0.00 C ATOM 1033 CD GLU A 65 5.999 11.262 -29.401 1.00 0.00 C ATOM 1034 OE1 GLU A 65 7.212 11.201 -29.507 1.00 0.00 O ATOM 1035 OE2 GLU A 65 5.270 11.820 -30.207 1.00 0.00 O ATOM 0 H GLU A 65 7.398 7.705 -26.195 1.00 0.00 H new ATOM 0 HA GLU A 65 5.326 9.747 -25.676 1.00 0.00 H new ATOM 0 HB2 GLU A 65 7.247 10.096 -27.276 1.00 0.00 H new ATOM 0 HB3 GLU A 65 6.592 8.826 -28.291 1.00 0.00 H new ATOM 0 HG2 GLU A 65 4.433 10.086 -28.488 1.00 0.00 H new ATOM 0 HG3 GLU A 65 5.068 11.350 -27.453 1.00 0.00 H new ATOM 1042 N ASN A 66 4.771 6.807 -26.947 1.00 0.00 N ATOM 1043 CA ASN A 66 3.720 5.857 -27.387 1.00 0.00 C ATOM 1044 C ASN A 66 4.179 4.437 -27.048 1.00 0.00 C ATOM 1045 O ASN A 66 5.328 4.209 -26.725 1.00 0.00 O ATOM 1046 CB ASN A 66 3.511 5.992 -28.893 1.00 0.00 C ATOM 1047 CG ASN A 66 4.812 5.667 -29.622 1.00 0.00 C ATOM 1048 OD1 ASN A 66 4.860 5.673 -30.836 1.00 0.00 O ATOM 1049 ND2 ASN A 66 5.880 5.380 -28.930 1.00 0.00 N ATOM 0 H ASN A 66 5.684 6.385 -26.777 1.00 0.00 H new ATOM 0 HA ASN A 66 2.779 6.072 -26.881 1.00 0.00 H new ATOM 0 HB2 ASN A 66 2.720 5.318 -29.222 1.00 0.00 H new ATOM 0 HB3 ASN A 66 3.189 7.005 -29.136 1.00 0.00 H new ATOM 0 HD21 ASN A 66 6.754 5.161 -29.408 1.00 0.00 H new ATOM 0 HD22 ASN A 66 5.841 5.375 -27.911 1.00 0.00 H new ATOM 1056 N LYS A 67 3.289 3.486 -27.094 1.00 0.00 N ATOM 1057 CA LYS A 67 3.669 2.082 -26.762 1.00 0.00 C ATOM 1058 C LYS A 67 4.592 1.483 -27.831 1.00 0.00 C ATOM 1059 O LYS A 67 5.337 0.560 -27.565 1.00 0.00 O ATOM 1060 CB LYS A 67 2.400 1.232 -26.660 1.00 0.00 C ATOM 1061 CG LYS A 67 1.507 1.783 -25.547 1.00 0.00 C ATOM 1062 CD LYS A 67 0.393 0.778 -25.235 1.00 0.00 C ATOM 1063 CE LYS A 67 -0.409 0.495 -26.506 1.00 0.00 C ATOM 1064 NZ LYS A 67 -0.607 1.763 -27.266 1.00 0.00 N ATOM 0 H LYS A 67 2.310 3.620 -27.348 1.00 0.00 H new ATOM 0 HA LYS A 67 4.205 2.087 -25.813 1.00 0.00 H new ATOM 0 HB2 LYS A 67 1.865 1.243 -27.609 1.00 0.00 H new ATOM 0 HB3 LYS A 67 2.660 0.194 -26.452 1.00 0.00 H new ATOM 0 HG2 LYS A 67 2.100 1.973 -24.652 1.00 0.00 H new ATOM 0 HG3 LYS A 67 1.075 2.736 -25.852 1.00 0.00 H new ATOM 0 HD2 LYS A 67 0.821 -0.147 -24.849 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -0.262 1.174 -24.459 1.00 0.00 H new ATOM 0 HE2 LYS A 67 0.116 -0.233 -27.124 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -1.374 0.059 -26.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -1.485 1.702 -27.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -0.671 2.560 -26.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 0.197 1.912 -27.908 1.00 0.00 H new ATOM 1078 N ASP A 68 4.542 1.976 -29.040 1.00 0.00 N ATOM 1079 CA ASP A 68 5.406 1.392 -30.115 1.00 0.00 C ATOM 1080 C ASP A 68 6.888 1.582 -29.778 1.00 0.00 C ATOM 1081 O ASP A 68 7.695 0.700 -29.989 1.00 0.00 O ATOM 1082 CB ASP A 68 5.093 2.061 -31.455 1.00 0.00 C ATOM 1083 CG ASP A 68 3.660 1.718 -31.869 1.00 0.00 C ATOM 1084 OD1 ASP A 68 3.091 0.819 -31.269 1.00 0.00 O ATOM 1085 OD2 ASP A 68 3.154 2.358 -32.776 1.00 0.00 O ATOM 0 H ASP A 68 3.947 2.751 -29.331 1.00 0.00 H new ATOM 0 HA ASP A 68 5.197 0.324 -30.185 1.00 0.00 H new ATOM 0 HB2 ASP A 68 5.211 3.141 -31.371 1.00 0.00 H new ATOM 0 HB3 ASP A 68 5.795 1.722 -32.217 1.00 0.00 H new ATOM 1090 N GLY A 69 7.261 2.719 -29.260 1.00 0.00 N ATOM 1091 CA GLY A 69 8.693 2.925 -28.904 1.00 0.00 C ATOM 1092 C GLY A 69 9.022 2.089 -27.668 1.00 0.00 C ATOM 1093 O GLY A 69 10.120 1.592 -27.511 1.00 0.00 O ATOM 0 H GLY A 69 6.643 3.508 -29.069 1.00 0.00 H new ATOM 0 HA2 GLY A 69 9.334 2.635 -29.737 1.00 0.00 H new ATOM 0 HA3 GLY A 69 8.884 3.980 -28.707 1.00 0.00 H new ATOM 1097 N TYR A 70 8.070 1.934 -26.790 1.00 0.00 N ATOM 1098 CA TYR A 70 8.308 1.141 -25.551 1.00 0.00 C ATOM 1099 C TYR A 70 8.541 -0.338 -25.895 1.00 0.00 C ATOM 1100 O TYR A 70 9.431 -0.963 -25.354 1.00 0.00 O ATOM 1101 CB TYR A 70 7.101 1.280 -24.624 1.00 0.00 C ATOM 1102 CG TYR A 70 7.215 0.304 -23.477 1.00 0.00 C ATOM 1103 CD1 TYR A 70 8.348 0.313 -22.653 1.00 0.00 C ATOM 1104 CD2 TYR A 70 6.183 -0.610 -23.235 1.00 0.00 C ATOM 1105 CE1 TYR A 70 8.445 -0.589 -21.586 1.00 0.00 C ATOM 1106 CE2 TYR A 70 6.280 -1.510 -22.169 1.00 0.00 C ATOM 1107 CZ TYR A 70 7.410 -1.502 -21.346 1.00 0.00 C ATOM 1108 OH TYR A 70 7.504 -2.390 -20.293 1.00 0.00 O ATOM 0 H TYR A 70 7.132 2.325 -26.878 1.00 0.00 H new ATOM 0 HA TYR A 70 9.199 1.520 -25.050 1.00 0.00 H new ATOM 0 HB2 TYR A 70 7.042 2.299 -24.241 1.00 0.00 H new ATOM 0 HB3 TYR A 70 6.182 1.095 -25.180 1.00 0.00 H new ATOM 0 HD1 TYR A 70 9.147 1.015 -22.841 1.00 0.00 H new ATOM 0 HD2 TYR A 70 5.311 -0.620 -23.872 1.00 0.00 H new ATOM 0 HE1 TYR A 70 9.317 -0.581 -20.949 1.00 0.00 H new ATOM 0 HE2 TYR A 70 5.481 -2.212 -21.981 1.00 0.00 H new ATOM 0 HH TYR A 70 6.702 -2.952 -20.266 1.00 0.00 H new ATOM 1118 N VAL A 71 7.776 -0.912 -26.790 1.00 0.00 N ATOM 1119 CA VAL A 71 8.019 -2.350 -27.122 1.00 0.00 C ATOM 1120 C VAL A 71 9.329 -2.457 -27.904 1.00 0.00 C ATOM 1121 O VAL A 71 10.024 -3.450 -27.839 1.00 0.00 O ATOM 1122 CB VAL A 71 6.866 -2.929 -27.951 1.00 0.00 C ATOM 1123 CG1 VAL A 71 5.535 -2.765 -27.212 1.00 0.00 C ATOM 1124 CG2 VAL A 71 6.789 -2.187 -29.289 1.00 0.00 C ATOM 0 H VAL A 71 7.012 -0.461 -27.294 1.00 0.00 H new ATOM 0 HA VAL A 71 8.083 -2.923 -26.197 1.00 0.00 H new ATOM 0 HB VAL A 71 7.050 -3.991 -28.115 1.00 0.00 H new ATOM 0 HG11 VAL A 71 4.729 -3.182 -27.816 1.00 0.00 H new ATOM 0 HG12 VAL A 71 5.582 -3.290 -26.258 1.00 0.00 H new ATOM 0 HG13 VAL A 71 5.345 -1.706 -27.035 1.00 0.00 H new ATOM 0 HG21 VAL A 71 5.971 -2.594 -29.884 1.00 0.00 H new ATOM 0 HG22 VAL A 71 6.614 -1.127 -29.107 1.00 0.00 H new ATOM 0 HG23 VAL A 71 7.728 -2.312 -29.829 1.00 0.00 H new ATOM 1134 N ALA A 72 9.679 -1.430 -28.627 1.00 0.00 N ATOM 1135 CA ALA A 72 10.940 -1.470 -29.417 1.00 0.00 C ATOM 1136 C ALA A 72 12.135 -1.552 -28.463 1.00 0.00 C ATOM 1137 O ALA A 72 12.910 -2.487 -28.502 1.00 0.00 O ATOM 1138 CB ALA A 72 11.054 -0.190 -30.248 1.00 0.00 C ATOM 0 H ALA A 72 9.145 -0.564 -28.705 1.00 0.00 H new ATOM 0 HA ALA A 72 10.932 -2.340 -30.073 1.00 0.00 H new ATOM 0 HB1 ALA A 72 11.976 -0.214 -30.829 1.00 0.00 H new ATOM 0 HB2 ALA A 72 10.202 -0.118 -30.923 1.00 0.00 H new ATOM 0 HB3 ALA A 72 11.066 0.675 -29.585 1.00 0.00 H new ATOM 1144 N PHE A 73 12.302 -0.568 -27.621 1.00 0.00 N ATOM 1145 CA PHE A 73 13.486 -0.546 -26.712 1.00 0.00 C ATOM 1146 C PHE A 73 13.577 -1.845 -25.889 1.00 0.00 C ATOM 1147 O PHE A 73 14.656 -2.322 -25.596 1.00 0.00 O ATOM 1148 CB PHE A 73 13.364 0.651 -25.765 1.00 0.00 C ATOM 1149 CG PHE A 73 12.733 1.815 -26.498 1.00 0.00 C ATOM 1150 CD1 PHE A 73 13.074 2.070 -27.832 1.00 0.00 C ATOM 1151 CD2 PHE A 73 11.807 2.638 -25.844 1.00 0.00 C ATOM 1152 CE1 PHE A 73 12.491 3.147 -28.512 1.00 0.00 C ATOM 1153 CE2 PHE A 73 11.225 3.715 -26.524 1.00 0.00 C ATOM 1154 CZ PHE A 73 11.566 3.969 -27.858 1.00 0.00 C ATOM 0 H PHE A 73 11.668 0.225 -27.523 1.00 0.00 H new ATOM 0 HA PHE A 73 14.389 -0.461 -27.316 1.00 0.00 H new ATOM 0 HB2 PHE A 73 12.759 0.382 -24.899 1.00 0.00 H new ATOM 0 HB3 PHE A 73 14.348 0.934 -25.391 1.00 0.00 H new ATOM 0 HD1 PHE A 73 13.787 1.436 -28.337 1.00 0.00 H new ATOM 0 HD2 PHE A 73 11.542 2.442 -24.816 1.00 0.00 H new ATOM 0 HE1 PHE A 73 12.755 3.343 -29.541 1.00 0.00 H new ATOM 0 HE2 PHE A 73 10.512 4.350 -26.019 1.00 0.00 H new ATOM 0 HZ PHE A 73 11.115 4.799 -28.382 1.00 0.00 H new ATOM 1164 N THR A 74 12.468 -2.412 -25.497 1.00 0.00 N ATOM 1165 CA THR A 74 12.525 -3.637 -24.640 1.00 0.00 C ATOM 1166 C THR A 74 12.661 -4.890 -25.511 1.00 0.00 C ATOM 1167 O THR A 74 13.207 -5.892 -25.089 1.00 0.00 O ATOM 1168 CB THR A 74 11.241 -3.748 -23.808 1.00 0.00 C ATOM 1169 OG1 THR A 74 11.258 -4.964 -23.073 1.00 0.00 O ATOM 1170 CG2 THR A 74 10.021 -3.721 -24.730 1.00 0.00 C ATOM 0 H THR A 74 11.530 -2.085 -25.730 1.00 0.00 H new ATOM 0 HA THR A 74 13.390 -3.558 -23.981 1.00 0.00 H new ATOM 0 HB THR A 74 11.185 -2.906 -23.118 1.00 0.00 H new ATOM 0 HG1 THR A 74 12.052 -4.988 -22.499 1.00 0.00 H new ATOM 0 HG21 THR A 74 9.112 -3.800 -24.133 1.00 0.00 H new ATOM 0 HG22 THR A 74 10.008 -2.785 -25.289 1.00 0.00 H new ATOM 0 HG23 THR A 74 10.072 -4.558 -25.426 1.00 0.00 H new ATOM 1178 N SER A 75 12.151 -4.855 -26.712 1.00 0.00 N ATOM 1179 CA SER A 75 12.233 -6.056 -27.594 1.00 0.00 C ATOM 1180 C SER A 75 13.687 -6.359 -27.976 1.00 0.00 C ATOM 1181 O SER A 75 14.068 -7.504 -28.118 1.00 0.00 O ATOM 1182 CB SER A 75 11.418 -5.799 -28.863 1.00 0.00 C ATOM 1183 OG SER A 75 10.045 -5.662 -28.519 1.00 0.00 O ATOM 0 H SER A 75 11.681 -4.047 -27.121 1.00 0.00 H new ATOM 0 HA SER A 75 11.834 -6.915 -27.054 1.00 0.00 H new ATOM 0 HB2 SER A 75 11.772 -4.896 -29.360 1.00 0.00 H new ATOM 0 HB3 SER A 75 11.548 -6.622 -29.566 1.00 0.00 H new ATOM 0 HG SER A 75 9.803 -4.712 -28.512 1.00 0.00 H new ATOM 1189 N HIS A 76 14.506 -5.356 -28.149 1.00 0.00 N ATOM 1190 CA HIS A 76 15.931 -5.617 -28.514 1.00 0.00 C ATOM 1191 C HIS A 76 16.608 -6.430 -27.400 1.00 0.00 C ATOM 1192 O HIS A 76 16.239 -6.335 -26.249 1.00 0.00 O ATOM 1193 CB HIS A 76 16.667 -4.284 -28.680 1.00 0.00 C ATOM 1194 CG HIS A 76 16.355 -3.695 -30.029 1.00 0.00 C ATOM 1195 ND1 HIS A 76 15.212 -2.942 -30.261 1.00 0.00 N ATOM 1196 CD2 HIS A 76 17.026 -3.736 -31.227 1.00 0.00 C ATOM 1197 CE1 HIS A 76 15.228 -2.565 -31.553 1.00 0.00 C ATOM 1198 NE2 HIS A 76 16.311 -3.021 -32.182 1.00 0.00 N ATOM 0 H HIS A 76 14.253 -4.372 -28.054 1.00 0.00 H new ATOM 0 HA HIS A 76 15.966 -6.177 -29.449 1.00 0.00 H new ATOM 0 HB2 HIS A 76 16.368 -3.592 -27.893 1.00 0.00 H new ATOM 0 HB3 HIS A 76 17.742 -4.436 -28.579 1.00 0.00 H new ATOM 0 HD1 HIS A 76 14.491 -2.715 -29.576 1.00 0.00 H new ATOM 0 HD2 HIS A 76 17.963 -4.244 -31.400 1.00 0.00 H new ATOM 0 HE1 HIS A 76 14.460 -1.968 -32.021 1.00 0.00 H new ATOM 1207 N PRO A 77 17.598 -7.218 -27.737 1.00 0.00 N ATOM 1208 CA PRO A 77 18.345 -8.048 -26.740 1.00 0.00 C ATOM 1209 C PRO A 77 19.183 -7.191 -25.773 1.00 0.00 C ATOM 1210 O PRO A 77 19.746 -7.690 -24.821 1.00 0.00 O ATOM 1211 CB PRO A 77 19.249 -8.906 -27.629 1.00 0.00 C ATOM 1212 CG PRO A 77 19.440 -8.092 -28.865 1.00 0.00 C ATOM 1213 CD PRO A 77 18.111 -7.369 -29.115 1.00 0.00 C ATOM 0 HA PRO A 77 17.681 -8.623 -26.094 1.00 0.00 H new ATOM 0 HB2 PRO A 77 20.201 -9.116 -27.141 1.00 0.00 H new ATOM 0 HB3 PRO A 77 18.787 -9.867 -27.854 1.00 0.00 H new ATOM 0 HG2 PRO A 77 20.253 -7.377 -28.738 1.00 0.00 H new ATOM 0 HG3 PRO A 77 19.703 -8.726 -29.712 1.00 0.00 H new ATOM 0 HD2 PRO A 77 18.253 -6.407 -29.608 1.00 0.00 H new ATOM 0 HD3 PRO A 77 17.437 -7.953 -29.742 1.00 0.00 H new ATOM 1221 N LEU A 78 19.271 -5.910 -26.022 1.00 0.00 N ATOM 1222 CA LEU A 78 20.061 -5.004 -25.124 1.00 0.00 C ATOM 1223 C LEU A 78 19.291 -4.692 -23.833 1.00 0.00 C ATOM 1224 O LEU A 78 19.878 -4.400 -22.809 1.00 0.00 O ATOM 1225 CB LEU A 78 20.323 -3.693 -25.867 1.00 0.00 C ATOM 1226 CG LEU A 78 21.268 -2.804 -25.056 1.00 0.00 C ATOM 1227 CD1 LEU A 78 22.236 -2.103 -26.009 1.00 0.00 C ATOM 1228 CD2 LEU A 78 20.456 -1.750 -24.298 1.00 0.00 C ATOM 0 H LEU A 78 18.827 -5.446 -26.814 1.00 0.00 H new ATOM 0 HA LEU A 78 20.994 -5.501 -24.859 1.00 0.00 H new ATOM 0 HB2 LEU A 78 20.758 -3.901 -26.844 1.00 0.00 H new ATOM 0 HB3 LEU A 78 19.382 -3.171 -26.042 1.00 0.00 H new ATOM 0 HG LEU A 78 21.824 -3.415 -24.345 1.00 0.00 H new ATOM 0 HD11 LEU A 78 22.913 -1.467 -25.438 1.00 0.00 H new ATOM 0 HD12 LEU A 78 22.813 -2.849 -26.555 1.00 0.00 H new ATOM 0 HD13 LEU A 78 21.673 -1.492 -26.715 1.00 0.00 H new ATOM 0 HD21 LEU A 78 21.130 -1.117 -23.721 1.00 0.00 H new ATOM 0 HD22 LEU A 78 19.902 -1.137 -25.009 1.00 0.00 H new ATOM 0 HD23 LEU A 78 19.757 -2.245 -23.624 1.00 0.00 H new ATOM 1240 N HIS A 79 17.987 -4.717 -23.878 1.00 0.00 N ATOM 1241 CA HIS A 79 17.195 -4.359 -22.661 1.00 0.00 C ATOM 1242 C HIS A 79 17.103 -5.560 -21.720 1.00 0.00 C ATOM 1243 O HIS A 79 17.103 -5.418 -20.512 1.00 0.00 O ATOM 1244 CB HIS A 79 15.784 -3.944 -23.079 1.00 0.00 C ATOM 1245 CG HIS A 79 14.968 -3.639 -21.853 1.00 0.00 C ATOM 1246 ND1 HIS A 79 14.152 -4.588 -21.251 1.00 0.00 N ATOM 1247 CD2 HIS A 79 14.835 -2.499 -21.101 1.00 0.00 C ATOM 1248 CE1 HIS A 79 13.570 -4.005 -20.186 1.00 0.00 C ATOM 1249 NE2 HIS A 79 13.953 -2.734 -20.052 1.00 0.00 N ATOM 0 H HIS A 79 17.436 -4.968 -24.699 1.00 0.00 H new ATOM 0 HA HIS A 79 17.690 -3.536 -22.146 1.00 0.00 H new ATOM 0 HB2 HIS A 79 15.828 -3.069 -23.727 1.00 0.00 H new ATOM 0 HB3 HIS A 79 15.313 -4.742 -23.653 1.00 0.00 H new ATOM 0 HD2 HIS A 79 15.338 -1.563 -21.294 1.00 0.00 H new ATOM 0 HE1 HIS A 79 12.879 -4.504 -19.523 1.00 0.00 H new ATOM 0 HE2 HIS A 79 13.660 -2.074 -19.332 1.00 0.00 H new ATOM 1258 N VAL A 80 17.014 -6.738 -22.261 1.00 0.00 N ATOM 1259 CA VAL A 80 16.889 -7.947 -21.403 1.00 0.00 C ATOM 1260 C VAL A 80 18.206 -8.208 -20.672 1.00 0.00 C ATOM 1261 O VAL A 80 18.250 -8.283 -19.459 1.00 0.00 O ATOM 1262 CB VAL A 80 16.547 -9.144 -22.285 1.00 0.00 C ATOM 1263 CG1 VAL A 80 17.601 -9.289 -23.381 1.00 0.00 C ATOM 1264 CG2 VAL A 80 16.521 -10.409 -21.424 1.00 0.00 C ATOM 0 H VAL A 80 17.022 -6.918 -23.265 1.00 0.00 H new ATOM 0 HA VAL A 80 16.102 -7.791 -20.665 1.00 0.00 H new ATOM 0 HB VAL A 80 15.570 -8.995 -22.746 1.00 0.00 H new ATOM 0 HG11 VAL A 80 17.356 -10.144 -24.011 1.00 0.00 H new ATOM 0 HG12 VAL A 80 17.620 -8.385 -23.989 1.00 0.00 H new ATOM 0 HG13 VAL A 80 18.580 -9.442 -22.927 1.00 0.00 H new ATOM 0 HG21 VAL A 80 16.277 -11.269 -22.048 1.00 0.00 H new ATOM 0 HG22 VAL A 80 17.499 -10.558 -20.967 1.00 0.00 H new ATOM 0 HG23 VAL A 80 15.768 -10.302 -20.643 1.00 0.00 H new ATOM 1274 N GLU A 81 19.278 -8.354 -21.398 1.00 0.00 N ATOM 1275 CA GLU A 81 20.592 -8.606 -20.744 1.00 0.00 C ATOM 1276 C GLU A 81 20.911 -7.466 -19.777 1.00 0.00 C ATOM 1277 O GLU A 81 21.391 -7.682 -18.682 1.00 0.00 O ATOM 1278 CB GLU A 81 21.683 -8.690 -21.811 1.00 0.00 C ATOM 1279 CG GLU A 81 23.002 -9.110 -21.160 1.00 0.00 C ATOM 1280 CD GLU A 81 24.113 -9.103 -22.209 1.00 0.00 C ATOM 1281 OE1 GLU A 81 23.829 -8.743 -23.340 1.00 0.00 O ATOM 1282 OE2 GLU A 81 25.230 -9.455 -21.865 1.00 0.00 O ATOM 0 H GLU A 81 19.301 -8.310 -22.417 1.00 0.00 H new ATOM 0 HA GLU A 81 20.548 -9.545 -20.193 1.00 0.00 H new ATOM 0 HB2 GLU A 81 21.400 -9.409 -22.580 1.00 0.00 H new ATOM 0 HB3 GLU A 81 21.800 -7.725 -22.304 1.00 0.00 H new ATOM 0 HG2 GLU A 81 23.251 -8.429 -20.346 1.00 0.00 H new ATOM 0 HG3 GLU A 81 22.905 -10.105 -20.725 1.00 0.00 H new ATOM 1289 N PHE A 82 20.651 -6.251 -20.174 1.00 0.00 N ATOM 1290 CA PHE A 82 20.930 -5.098 -19.272 1.00 0.00 C ATOM 1291 C PHE A 82 20.136 -5.252 -17.973 1.00 0.00 C ATOM 1292 O PHE A 82 20.641 -5.006 -16.895 1.00 0.00 O ATOM 1293 CB PHE A 82 20.522 -3.798 -19.967 1.00 0.00 C ATOM 1294 CG PHE A 82 20.885 -2.624 -19.089 1.00 0.00 C ATOM 1295 CD1 PHE A 82 22.175 -2.085 -19.139 1.00 0.00 C ATOM 1296 CD2 PHE A 82 19.928 -2.075 -18.225 1.00 0.00 C ATOM 1297 CE1 PHE A 82 22.510 -0.996 -18.325 1.00 0.00 C ATOM 1298 CE2 PHE A 82 20.263 -0.986 -17.412 1.00 0.00 C ATOM 1299 CZ PHE A 82 21.554 -0.446 -17.462 1.00 0.00 C ATOM 0 H PHE A 82 20.258 -6.007 -21.083 1.00 0.00 H new ATOM 0 HA PHE A 82 21.995 -5.071 -19.041 1.00 0.00 H new ATOM 0 HB2 PHE A 82 21.025 -3.715 -20.931 1.00 0.00 H new ATOM 0 HB3 PHE A 82 19.450 -3.800 -20.166 1.00 0.00 H new ATOM 0 HD1 PHE A 82 22.912 -2.509 -19.805 1.00 0.00 H new ATOM 0 HD2 PHE A 82 18.932 -2.492 -18.186 1.00 0.00 H new ATOM 0 HE1 PHE A 82 23.506 -0.580 -18.363 1.00 0.00 H new ATOM 0 HE2 PHE A 82 19.526 -0.562 -16.746 1.00 0.00 H new ATOM 0 HZ PHE A 82 21.812 0.395 -16.835 1.00 0.00 H new ATOM 1309 N SER A 83 18.894 -5.647 -18.062 1.00 0.00 N ATOM 1310 CA SER A 83 18.070 -5.807 -16.829 1.00 0.00 C ATOM 1311 C SER A 83 18.629 -6.941 -15.966 1.00 0.00 C ATOM 1312 O SER A 83 18.524 -6.914 -14.755 1.00 0.00 O ATOM 1313 CB SER A 83 16.626 -6.123 -17.213 1.00 0.00 C ATOM 1314 OG SER A 83 16.569 -7.412 -17.805 1.00 0.00 O ATOM 0 H SER A 83 18.415 -5.866 -18.935 1.00 0.00 H new ATOM 0 HA SER A 83 18.101 -4.878 -16.260 1.00 0.00 H new ATOM 0 HB2 SER A 83 15.987 -6.087 -16.331 1.00 0.00 H new ATOM 0 HB3 SER A 83 16.251 -5.373 -17.910 1.00 0.00 H new ATOM 0 HG SER A 83 17.054 -7.403 -18.656 1.00 0.00 H new ATOM 1320 N ALA A 84 19.224 -7.935 -16.568 1.00 0.00 N ATOM 1321 CA ALA A 84 19.783 -9.054 -15.757 1.00 0.00 C ATOM 1322 C ALA A 84 20.866 -8.498 -14.838 1.00 0.00 C ATOM 1323 O ALA A 84 20.817 -8.650 -13.633 1.00 0.00 O ATOM 1324 CB ALA A 84 20.397 -10.110 -16.675 1.00 0.00 C ATOM 0 H ALA A 84 19.347 -8.021 -17.577 1.00 0.00 H new ATOM 0 HA ALA A 84 18.987 -9.512 -15.171 1.00 0.00 H new ATOM 0 HB1 ALA A 84 20.803 -10.923 -16.074 1.00 0.00 H new ATOM 0 HB2 ALA A 84 19.630 -10.501 -17.344 1.00 0.00 H new ATOM 0 HB3 ALA A 84 21.197 -9.660 -17.263 1.00 0.00 H new ATOM 1330 N ALA A 85 21.837 -7.837 -15.402 1.00 0.00 N ATOM 1331 CA ALA A 85 22.914 -7.245 -14.569 1.00 0.00 C ATOM 1332 C ALA A 85 22.315 -6.133 -13.714 1.00 0.00 C ATOM 1333 O ALA A 85 22.647 -5.982 -12.554 1.00 0.00 O ATOM 1334 CB ALA A 85 24.002 -6.667 -15.471 1.00 0.00 C ATOM 0 H ALA A 85 21.930 -7.682 -16.406 1.00 0.00 H new ATOM 0 HA ALA A 85 23.352 -8.011 -13.930 1.00 0.00 H new ATOM 0 HB1 ALA A 85 24.791 -6.233 -14.857 1.00 0.00 H new ATOM 0 HB2 ALA A 85 24.420 -7.460 -16.091 1.00 0.00 H new ATOM 0 HB3 ALA A 85 23.573 -5.895 -16.109 1.00 0.00 H new ATOM 1340 N PHE A 86 21.416 -5.361 -14.266 1.00 0.00 N ATOM 1341 CA PHE A 86 20.791 -4.278 -13.459 1.00 0.00 C ATOM 1342 C PHE A 86 20.387 -4.863 -12.110 1.00 0.00 C ATOM 1343 O PHE A 86 20.308 -4.165 -11.118 1.00 0.00 O ATOM 1344 CB PHE A 86 19.552 -3.735 -14.174 1.00 0.00 C ATOM 1345 CG PHE A 86 19.163 -2.405 -13.571 1.00 0.00 C ATOM 1346 CD1 PHE A 86 20.022 -1.304 -13.691 1.00 0.00 C ATOM 1347 CD2 PHE A 86 17.948 -2.271 -12.890 1.00 0.00 C ATOM 1348 CE1 PHE A 86 19.664 -0.074 -13.130 1.00 0.00 C ATOM 1349 CE2 PHE A 86 17.589 -1.040 -12.331 1.00 0.00 C ATOM 1350 CZ PHE A 86 18.447 0.058 -12.450 1.00 0.00 C ATOM 0 H PHE A 86 21.092 -5.434 -15.230 1.00 0.00 H new ATOM 0 HA PHE A 86 21.499 -3.460 -13.324 1.00 0.00 H new ATOM 0 HB2 PHE A 86 19.756 -3.618 -15.238 1.00 0.00 H new ATOM 0 HB3 PHE A 86 18.728 -4.442 -14.083 1.00 0.00 H new ATOM 0 HD1 PHE A 86 20.960 -1.405 -14.217 1.00 0.00 H new ATOM 0 HD2 PHE A 86 17.286 -3.119 -12.796 1.00 0.00 H new ATOM 0 HE1 PHE A 86 20.326 0.774 -13.221 1.00 0.00 H new ATOM 0 HE2 PHE A 86 16.650 -0.938 -11.808 1.00 0.00 H new ATOM 0 HZ PHE A 86 18.171 1.008 -12.017 1.00 0.00 H new ATOM 1360 N THR A 87 20.153 -6.147 -12.056 1.00 0.00 N ATOM 1361 CA THR A 87 19.775 -6.763 -10.760 1.00 0.00 C ATOM 1362 C THR A 87 21.057 -7.053 -9.988 1.00 0.00 C ATOM 1363 O THR A 87 21.308 -6.496 -8.940 1.00 0.00 O ATOM 1364 CB THR A 87 19.030 -8.076 -11.004 1.00 0.00 C ATOM 1365 OG1 THR A 87 18.091 -7.897 -12.054 1.00 0.00 O ATOM 1366 CG2 THR A 87 18.294 -8.501 -9.733 1.00 0.00 C ATOM 0 H THR A 87 20.208 -6.788 -12.848 1.00 0.00 H new ATOM 0 HA THR A 87 19.127 -6.089 -10.200 1.00 0.00 H new ATOM 0 HB THR A 87 19.747 -8.849 -11.279 1.00 0.00 H new ATOM 0 HG1 THR A 87 18.558 -7.905 -12.915 1.00 0.00 H new ATOM 0 HG21 THR A 87 17.766 -9.437 -9.914 1.00 0.00 H new ATOM 0 HG22 THR A 87 19.013 -8.641 -8.926 1.00 0.00 H new ATOM 0 HG23 THR A 87 17.578 -7.729 -9.452 1.00 0.00 H new ATOM 1374 N ALA A 88 21.876 -7.917 -10.518 1.00 0.00 N ATOM 1375 CA ALA A 88 23.157 -8.254 -9.842 1.00 0.00 C ATOM 1376 C ALA A 88 23.798 -6.988 -9.271 1.00 0.00 C ATOM 1377 O ALA A 88 24.458 -7.023 -8.253 1.00 0.00 O ATOM 1378 CB ALA A 88 24.118 -8.864 -10.861 1.00 0.00 C ATOM 0 H ALA A 88 21.711 -8.407 -11.397 1.00 0.00 H new ATOM 0 HA ALA A 88 22.956 -8.960 -9.036 1.00 0.00 H new ATOM 0 HB1 ALA A 88 25.059 -9.113 -10.370 1.00 0.00 H new ATOM 0 HB2 ALA A 88 23.677 -9.768 -11.281 1.00 0.00 H new ATOM 0 HB3 ALA A 88 24.304 -8.147 -11.660 1.00 0.00 H new ATOM 1384 N VAL A 89 23.626 -5.875 -9.928 1.00 0.00 N ATOM 1385 CA VAL A 89 24.248 -4.617 -9.435 1.00 0.00 C ATOM 1386 C VAL A 89 23.275 -3.845 -8.529 1.00 0.00 C ATOM 1387 O VAL A 89 23.487 -2.681 -8.241 1.00 0.00 O ATOM 1388 CB VAL A 89 24.633 -3.751 -10.636 1.00 0.00 C ATOM 1389 CG1 VAL A 89 25.438 -4.597 -11.625 1.00 0.00 C ATOM 1390 CG2 VAL A 89 23.367 -3.239 -11.331 1.00 0.00 C ATOM 0 H VAL A 89 23.081 -5.783 -10.785 1.00 0.00 H new ATOM 0 HA VAL A 89 25.134 -4.864 -8.851 1.00 0.00 H new ATOM 0 HB VAL A 89 25.229 -2.904 -10.296 1.00 0.00 H new ATOM 0 HG11 VAL A 89 25.716 -3.986 -12.484 1.00 0.00 H new ATOM 0 HG12 VAL A 89 26.339 -4.968 -11.137 1.00 0.00 H new ATOM 0 HG13 VAL A 89 24.833 -5.440 -11.960 1.00 0.00 H new ATOM 0 HG21 VAL A 89 23.645 -2.623 -12.186 1.00 0.00 H new ATOM 0 HG22 VAL A 89 22.772 -4.086 -11.673 1.00 0.00 H new ATOM 0 HG23 VAL A 89 22.782 -2.644 -10.630 1.00 0.00 H new ATOM 1400 N ILE A 90 22.218 -4.463 -8.069 1.00 0.00 N ATOM 1401 CA ILE A 90 21.271 -3.728 -7.182 1.00 0.00 C ATOM 1402 C ILE A 90 20.934 -4.567 -5.951 1.00 0.00 C ATOM 1403 O ILE A 90 21.144 -5.763 -5.914 1.00 0.00 O ATOM 1404 CB ILE A 90 19.983 -3.410 -7.948 1.00 0.00 C ATOM 1405 CG1 ILE A 90 20.276 -2.352 -9.015 1.00 0.00 C ATOM 1406 CG2 ILE A 90 18.937 -2.873 -6.966 1.00 0.00 C ATOM 1407 CD1 ILE A 90 20.767 -1.070 -8.343 1.00 0.00 C ATOM 0 H ILE A 90 21.972 -5.433 -8.267 1.00 0.00 H new ATOM 0 HA ILE A 90 21.745 -2.800 -6.861 1.00 0.00 H new ATOM 0 HB ILE A 90 19.605 -4.312 -8.428 1.00 0.00 H new ATOM 0 HG12 ILE A 90 21.029 -2.721 -9.711 1.00 0.00 H new ATOM 0 HG13 ILE A 90 19.377 -2.149 -9.597 1.00 0.00 H new ATOM 0 HG21 ILE A 90 18.017 -2.644 -7.504 1.00 0.00 H new ATOM 0 HG22 ILE A 90 18.734 -3.625 -6.203 1.00 0.00 H new ATOM 0 HG23 ILE A 90 19.315 -1.967 -6.491 1.00 0.00 H new ATOM 0 HD11 ILE A 90 20.975 -0.317 -9.103 1.00 0.00 H new ATOM 0 HD12 ILE A 90 19.999 -0.698 -7.665 1.00 0.00 H new ATOM 0 HD13 ILE A 90 21.677 -1.279 -7.781 1.00 0.00 H new ATOM 1419 N ASP A 91 20.385 -3.928 -4.950 1.00 0.00 N ATOM 1420 CA ASP A 91 20.024 -4.628 -3.684 1.00 0.00 C ATOM 1421 C ASP A 91 18.500 -4.617 -3.539 1.00 0.00 C ATOM 1422 O ASP A 91 17.897 -5.544 -3.035 1.00 0.00 O ATOM 1423 CB ASP A 91 20.631 -3.849 -2.519 1.00 0.00 C ATOM 1424 CG ASP A 91 20.198 -4.454 -1.186 1.00 0.00 C ATOM 1425 OD1 ASP A 91 19.745 -5.584 -1.181 1.00 0.00 O ATOM 1426 OD2 ASP A 91 20.328 -3.766 -0.180 1.00 0.00 O ATOM 0 H ASP A 91 20.168 -2.931 -4.959 1.00 0.00 H new ATOM 0 HA ASP A 91 20.394 -5.653 -3.693 1.00 0.00 H new ATOM 0 HB2 ASP A 91 21.718 -3.860 -2.594 1.00 0.00 H new ATOM 0 HB3 ASP A 91 20.319 -2.806 -2.570 1.00 0.00 H new ATOM 1431 N LYS A 92 17.884 -3.564 -4.004 1.00 0.00 N ATOM 1432 CA LYS A 92 16.404 -3.421 -3.907 1.00 0.00 C ATOM 1433 C LYS A 92 15.858 -2.976 -5.273 1.00 0.00 C ATOM 1434 O LYS A 92 16.353 -2.037 -5.862 1.00 0.00 O ATOM 1435 CB LYS A 92 16.088 -2.345 -2.864 1.00 0.00 C ATOM 1436 CG LYS A 92 14.953 -1.449 -3.381 1.00 0.00 C ATOM 1437 CD LYS A 92 14.412 -0.574 -2.239 1.00 0.00 C ATOM 1438 CE LYS A 92 13.139 0.148 -2.701 1.00 0.00 C ATOM 1439 NZ LYS A 92 12.796 1.236 -1.738 1.00 0.00 N ATOM 0 H LYS A 92 18.355 -2.781 -4.456 1.00 0.00 H new ATOM 0 HA LYS A 92 15.948 -4.368 -3.619 1.00 0.00 H new ATOM 0 HB2 LYS A 92 15.798 -2.810 -1.922 1.00 0.00 H new ATOM 0 HB3 LYS A 92 16.976 -1.746 -2.663 1.00 0.00 H new ATOM 0 HG2 LYS A 92 15.317 -0.818 -4.192 1.00 0.00 H new ATOM 0 HG3 LYS A 92 14.151 -2.064 -3.790 1.00 0.00 H new ATOM 0 HD2 LYS A 92 14.196 -1.190 -1.366 1.00 0.00 H new ATOM 0 HD3 LYS A 92 15.165 0.154 -1.937 1.00 0.00 H new ATOM 0 HE2 LYS A 92 13.288 0.565 -3.697 1.00 0.00 H new ATOM 0 HE3 LYS A 92 12.314 -0.561 -2.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 11.933 1.722 -2.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 12.636 0.827 -0.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 13.580 1.918 -1.691 1.00 0.00 H new ATOM 1453 N ILE A 93 14.856 -3.641 -5.799 1.00 0.00 N ATOM 1454 CA ILE A 93 14.313 -3.219 -7.129 1.00 0.00 C ATOM 1455 C ILE A 93 12.791 -3.054 -7.039 1.00 0.00 C ATOM 1456 O ILE A 93 12.085 -3.919 -6.554 1.00 0.00 O ATOM 1457 CB ILE A 93 14.678 -4.252 -8.212 1.00 0.00 C ATOM 1458 CG1 ILE A 93 14.493 -3.625 -9.602 1.00 0.00 C ATOM 1459 CG2 ILE A 93 13.776 -5.483 -8.098 1.00 0.00 C ATOM 1460 CD1 ILE A 93 15.654 -2.672 -9.902 1.00 0.00 C ATOM 0 H ILE A 93 14.397 -4.446 -5.372 1.00 0.00 H new ATOM 0 HA ILE A 93 14.758 -2.263 -7.405 1.00 0.00 H new ATOM 0 HB ILE A 93 15.716 -4.553 -8.072 1.00 0.00 H new ATOM 0 HG12 ILE A 93 14.447 -4.407 -10.360 1.00 0.00 H new ATOM 0 HG13 ILE A 93 13.547 -3.085 -9.644 1.00 0.00 H new ATOM 0 HG21 ILE A 93 14.045 -6.204 -8.870 1.00 0.00 H new ATOM 0 HG22 ILE A 93 13.904 -5.938 -7.116 1.00 0.00 H new ATOM 0 HG23 ILE A 93 12.736 -5.185 -8.227 1.00 0.00 H new ATOM 0 HD11 ILE A 93 15.517 -2.231 -10.889 1.00 0.00 H new ATOM 0 HD12 ILE A 93 15.679 -1.882 -9.152 1.00 0.00 H new ATOM 0 HD13 ILE A 93 16.593 -3.224 -9.879 1.00 0.00 H new ATOM 1472 N VAL A 94 12.288 -1.940 -7.508 1.00 0.00 N ATOM 1473 CA VAL A 94 10.811 -1.682 -7.485 1.00 0.00 C ATOM 1474 C VAL A 94 10.441 -0.842 -8.720 1.00 0.00 C ATOM 1475 O VAL A 94 11.231 -0.043 -9.178 1.00 0.00 O ATOM 1476 CB VAL A 94 10.467 -0.886 -6.218 1.00 0.00 C ATOM 1477 CG1 VAL A 94 11.128 0.490 -6.263 1.00 0.00 C ATOM 1478 CG2 VAL A 94 8.949 -0.715 -6.105 1.00 0.00 C ATOM 0 H VAL A 94 12.844 -1.186 -7.912 1.00 0.00 H new ATOM 0 HA VAL A 94 10.262 -2.624 -7.493 1.00 0.00 H new ATOM 0 HB VAL A 94 10.838 -1.434 -5.352 1.00 0.00 H new ATOM 0 HG11 VAL A 94 10.876 1.044 -5.359 1.00 0.00 H new ATOM 0 HG12 VAL A 94 12.210 0.372 -6.327 1.00 0.00 H new ATOM 0 HG13 VAL A 94 10.770 1.037 -7.135 1.00 0.00 H new ATOM 0 HG21 VAL A 94 8.713 -0.149 -5.204 1.00 0.00 H new ATOM 0 HG22 VAL A 94 8.577 -0.179 -6.978 1.00 0.00 H new ATOM 0 HG23 VAL A 94 8.475 -1.695 -6.053 1.00 0.00 H new ATOM 1488 N LEU A 95 9.261 -1.000 -9.276 1.00 0.00 N ATOM 1489 CA LEU A 95 8.919 -0.186 -10.491 1.00 0.00 C ATOM 1490 C LEU A 95 7.499 0.392 -10.409 1.00 0.00 C ATOM 1491 O LEU A 95 6.536 -0.310 -10.167 1.00 0.00 O ATOM 1492 CB LEU A 95 9.015 -1.047 -11.749 1.00 0.00 C ATOM 1493 CG LEU A 95 10.078 -2.130 -11.572 1.00 0.00 C ATOM 1494 CD1 LEU A 95 9.450 -3.360 -10.916 1.00 0.00 C ATOM 1495 CD2 LEU A 95 10.633 -2.515 -12.946 1.00 0.00 C ATOM 0 H LEU A 95 8.536 -1.640 -8.952 1.00 0.00 H new ATOM 0 HA LEU A 95 9.634 0.636 -10.535 1.00 0.00 H new ATOM 0 HB2 LEU A 95 8.049 -1.507 -11.957 1.00 0.00 H new ATOM 0 HB3 LEU A 95 9.262 -0.422 -12.607 1.00 0.00 H new ATOM 0 HG LEU A 95 10.883 -1.755 -10.940 1.00 0.00 H new ATOM 0 HD11 LEU A 95 10.209 -4.132 -10.790 1.00 0.00 H new ATOM 0 HD12 LEU A 95 9.046 -3.086 -9.942 1.00 0.00 H new ATOM 0 HD13 LEU A 95 8.647 -3.740 -11.548 1.00 0.00 H new ATOM 0 HD21 LEU A 95 11.393 -3.288 -12.828 1.00 0.00 H new ATOM 0 HD22 LEU A 95 9.825 -2.893 -13.572 1.00 0.00 H new ATOM 0 HD23 LEU A 95 11.077 -1.638 -13.418 1.00 0.00 H new ATOM 1507 N LEU A 96 7.373 1.677 -10.646 1.00 0.00 N ATOM 1508 CA LEU A 96 6.032 2.332 -10.629 1.00 0.00 C ATOM 1509 C LEU A 96 5.673 2.792 -12.048 1.00 0.00 C ATOM 1510 O LEU A 96 6.357 3.609 -12.630 1.00 0.00 O ATOM 1511 CB LEU A 96 6.061 3.571 -9.726 1.00 0.00 C ATOM 1512 CG LEU A 96 6.974 3.343 -8.523 1.00 0.00 C ATOM 1513 CD1 LEU A 96 8.437 3.379 -8.970 1.00 0.00 C ATOM 1514 CD2 LEU A 96 6.731 4.457 -7.502 1.00 0.00 C ATOM 0 H LEU A 96 8.152 2.303 -10.852 1.00 0.00 H new ATOM 0 HA LEU A 96 5.300 1.615 -10.257 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.409 4.433 -10.295 1.00 0.00 H new ATOM 0 HB3 LEU A 96 5.052 3.801 -9.384 1.00 0.00 H new ATOM 0 HG LEU A 96 6.759 2.372 -8.078 1.00 0.00 H new ATOM 0 HD11 LEU A 96 9.085 3.216 -8.109 1.00 0.00 H new ATOM 0 HD12 LEU A 96 8.611 2.596 -9.708 1.00 0.00 H new ATOM 0 HD13 LEU A 96 8.659 4.350 -9.412 1.00 0.00 H new ATOM 0 HD21 LEU A 96 7.377 4.306 -6.638 1.00 0.00 H new ATOM 0 HD22 LEU A 96 6.953 5.422 -7.957 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.689 4.438 -7.184 1.00 0.00 H new ATOM 1526 N ASP A 97 4.597 2.294 -12.603 1.00 0.00 N ATOM 1527 CA ASP A 97 4.217 2.702 -13.990 1.00 0.00 C ATOM 1528 C ASP A 97 2.754 3.161 -13.988 1.00 0.00 C ATOM 1529 O ASP A 97 1.899 2.536 -13.393 1.00 0.00 O ATOM 1530 CB ASP A 97 4.377 1.518 -14.947 1.00 0.00 C ATOM 1531 CG ASP A 97 3.895 1.923 -16.344 1.00 0.00 C ATOM 1532 OD1 ASP A 97 3.488 3.064 -16.503 1.00 0.00 O ATOM 1533 OD2 ASP A 97 3.941 1.088 -17.232 1.00 0.00 O ATOM 0 H ASP A 97 3.968 1.626 -12.158 1.00 0.00 H new ATOM 0 HA ASP A 97 4.864 3.514 -14.321 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.421 1.207 -14.987 1.00 0.00 H new ATOM 0 HB3 ASP A 97 3.803 0.664 -14.586 1.00 0.00 H new ATOM 1538 N PHE A 98 2.458 4.253 -14.643 1.00 0.00 N ATOM 1539 CA PHE A 98 1.046 4.746 -14.675 1.00 0.00 C ATOM 1540 C PHE A 98 0.878 5.828 -15.749 1.00 0.00 C ATOM 1541 O PHE A 98 1.741 6.662 -15.927 1.00 0.00 O ATOM 1542 CB PHE A 98 0.695 5.355 -13.312 1.00 0.00 C ATOM 1543 CG PHE A 98 -0.698 5.936 -13.346 1.00 0.00 C ATOM 1544 CD1 PHE A 98 -0.907 7.223 -13.855 1.00 0.00 C ATOM 1545 CD2 PHE A 98 -1.780 5.186 -12.869 1.00 0.00 C ATOM 1546 CE1 PHE A 98 -2.200 7.762 -13.886 1.00 0.00 C ATOM 1547 CE2 PHE A 98 -3.071 5.724 -12.901 1.00 0.00 C ATOM 1548 CZ PHE A 98 -3.281 7.012 -13.408 1.00 0.00 C ATOM 0 H PHE A 98 3.129 4.824 -15.156 1.00 0.00 H new ATOM 0 HA PHE A 98 0.389 3.907 -14.903 1.00 0.00 H new ATOM 0 HB2 PHE A 98 0.760 4.592 -12.536 1.00 0.00 H new ATOM 0 HB3 PHE A 98 1.415 6.132 -13.056 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -0.072 7.800 -14.224 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -1.618 4.193 -12.477 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -2.362 8.755 -14.278 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -3.906 5.145 -12.534 1.00 0.00 H new ATOM 0 HZ PHE A 98 -4.278 7.427 -13.430 1.00 0.00 H new ATOM 1558 N PRO A 99 -0.224 5.824 -16.459 1.00 0.00 N ATOM 1559 CA PRO A 99 -0.514 6.868 -17.487 1.00 0.00 C ATOM 1560 C PRO A 99 -0.182 8.278 -16.991 1.00 0.00 C ATOM 1561 O PRO A 99 -0.878 8.829 -16.160 1.00 0.00 O ATOM 1562 CB PRO A 99 -2.013 6.718 -17.740 1.00 0.00 C ATOM 1563 CG PRO A 99 -2.304 5.277 -17.492 1.00 0.00 C ATOM 1564 CD PRO A 99 -1.323 4.823 -16.404 1.00 0.00 C ATOM 0 HA PRO A 99 0.091 6.737 -18.384 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -2.592 7.358 -17.074 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -2.272 7.003 -18.760 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -3.336 5.138 -17.168 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -2.174 4.691 -18.402 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -1.797 4.806 -15.423 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -0.954 3.816 -16.597 1.00 0.00 H new ATOM 1572 N VAL A 100 0.876 8.865 -17.483 1.00 0.00 N ATOM 1573 CA VAL A 100 1.265 10.223 -17.008 1.00 0.00 C ATOM 1574 C VAL A 100 0.563 11.292 -17.850 1.00 0.00 C ATOM 1575 O VAL A 100 0.613 11.271 -19.063 1.00 0.00 O ATOM 1576 CB VAL A 100 2.782 10.388 -17.133 1.00 0.00 C ATOM 1577 CG1 VAL A 100 3.246 9.862 -18.493 1.00 0.00 C ATOM 1578 CG2 VAL A 100 3.143 11.870 -17.012 1.00 0.00 C ATOM 0 H VAL A 100 1.487 8.462 -18.193 1.00 0.00 H new ATOM 0 HA VAL A 100 0.967 10.338 -15.966 1.00 0.00 H new ATOM 0 HB VAL A 100 3.274 9.825 -16.340 1.00 0.00 H new ATOM 0 HG11 VAL A 100 4.326 9.980 -18.580 1.00 0.00 H new ATOM 0 HG12 VAL A 100 2.988 8.807 -18.582 1.00 0.00 H new ATOM 0 HG13 VAL A 100 2.754 10.424 -19.287 1.00 0.00 H new ATOM 0 HG21 VAL A 100 4.223 11.990 -17.101 1.00 0.00 H new ATOM 0 HG22 VAL A 100 2.649 12.431 -17.806 1.00 0.00 H new ATOM 0 HG23 VAL A 100 2.815 12.247 -16.043 1.00 0.00 H new ATOM 1588 N ALA A 101 -0.084 12.227 -17.212 1.00 0.00 N ATOM 1589 CA ALA A 101 -0.760 13.324 -17.968 1.00 0.00 C ATOM 1590 C ALA A 101 -0.221 14.681 -17.500 1.00 0.00 C ATOM 1591 O ALA A 101 -0.689 15.246 -16.531 1.00 0.00 O ATOM 1592 CB ALA A 101 -2.265 13.260 -17.708 1.00 0.00 C ATOM 0 H ALA A 101 -0.175 12.281 -16.198 1.00 0.00 H new ATOM 0 HA ALA A 101 -0.564 13.206 -19.034 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -2.763 14.059 -18.257 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.651 12.296 -18.039 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -2.455 13.380 -16.641 1.00 0.00 H new ATOM 1598 N ALA A 102 0.757 15.212 -18.183 1.00 0.00 N ATOM 1599 CA ALA A 102 1.330 16.520 -17.762 1.00 0.00 C ATOM 1600 C ALA A 102 1.994 17.197 -18.960 1.00 0.00 C ATOM 1601 O ALA A 102 2.481 16.546 -19.863 1.00 0.00 O ATOM 1602 CB ALA A 102 2.369 16.296 -16.661 1.00 0.00 C ATOM 0 H ALA A 102 1.182 14.797 -19.012 1.00 0.00 H new ATOM 0 HA ALA A 102 0.532 17.157 -17.381 1.00 0.00 H new ATOM 0 HB1 ALA A 102 2.787 17.255 -16.355 1.00 0.00 H new ATOM 0 HB2 ALA A 102 1.894 15.817 -15.805 1.00 0.00 H new ATOM 0 HB3 ALA A 102 3.167 15.656 -17.038 1.00 0.00 H new ATOM 1608 N VAL A 103 2.019 18.502 -18.973 1.00 0.00 N ATOM 1609 CA VAL A 103 2.654 19.226 -20.110 1.00 0.00 C ATOM 1610 C VAL A 103 3.226 20.550 -19.604 1.00 0.00 C ATOM 1611 O VAL A 103 4.103 21.133 -20.209 1.00 0.00 O ATOM 1612 CB VAL A 103 1.606 19.498 -21.189 1.00 0.00 C ATOM 1613 CG1 VAL A 103 1.368 18.224 -22.000 1.00 0.00 C ATOM 1614 CG2 VAL A 103 0.296 19.933 -20.529 1.00 0.00 C ATOM 0 H VAL A 103 1.627 19.098 -18.244 1.00 0.00 H new ATOM 0 HA VAL A 103 3.455 18.619 -20.532 1.00 0.00 H new ATOM 0 HB VAL A 103 1.961 20.289 -21.849 1.00 0.00 H new ATOM 0 HG11 VAL A 103 0.621 18.417 -22.770 1.00 0.00 H new ATOM 0 HG12 VAL A 103 2.301 17.912 -22.470 1.00 0.00 H new ATOM 0 HG13 VAL A 103 1.013 17.433 -21.339 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -0.452 20.127 -21.298 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -0.059 19.142 -19.869 1.00 0.00 H new ATOM 0 HG23 VAL A 103 0.464 20.841 -19.949 1.00 0.00 H new ATOM 1624 N LYS A 104 2.736 21.031 -18.493 1.00 0.00 N ATOM 1625 CA LYS A 104 3.266 22.304 -17.931 1.00 0.00 C ATOM 1626 C LYS A 104 3.195 23.398 -18.998 1.00 0.00 C ATOM 1627 O LYS A 104 2.253 23.471 -19.762 1.00 0.00 O ATOM 1628 CB LYS A 104 4.723 22.106 -17.506 1.00 0.00 C ATOM 1629 CG LYS A 104 4.860 20.792 -16.737 1.00 0.00 C ATOM 1630 CD LYS A 104 3.818 20.746 -15.615 1.00 0.00 C ATOM 1631 CE LYS A 104 4.162 19.617 -14.644 1.00 0.00 C ATOM 1632 NZ LYS A 104 5.101 20.123 -13.602 1.00 0.00 N ATOM 0 H LYS A 104 1.990 20.595 -17.950 1.00 0.00 H new ATOM 0 HA LYS A 104 2.670 22.596 -17.066 1.00 0.00 H new ATOM 0 HB2 LYS A 104 5.370 22.094 -18.383 1.00 0.00 H new ATOM 0 HB3 LYS A 104 5.047 22.939 -16.882 1.00 0.00 H new ATOM 0 HG2 LYS A 104 4.721 19.947 -17.412 1.00 0.00 H new ATOM 0 HG3 LYS A 104 5.863 20.705 -16.320 1.00 0.00 H new ATOM 0 HD2 LYS A 104 3.795 21.699 -15.087 1.00 0.00 H new ATOM 0 HD3 LYS A 104 2.824 20.589 -16.034 1.00 0.00 H new ATOM 0 HE2 LYS A 104 3.254 19.237 -14.176 1.00 0.00 H new ATOM 0 HE3 LYS A 104 4.615 18.785 -15.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 5.202 19.411 -12.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 6.030 20.307 -14.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 4.727 21.004 -13.196 1.00 0.00 H new ATOM 1646 N SER A 105 4.182 24.251 -19.058 1.00 0.00 N ATOM 1647 CA SER A 105 4.141 25.355 -20.055 1.00 0.00 C ATOM 1648 C SER A 105 2.906 26.216 -19.792 1.00 0.00 C ATOM 1649 O SER A 105 2.768 27.305 -20.314 1.00 0.00 O ATOM 1650 CB SER A 105 4.064 24.764 -21.463 1.00 0.00 C ATOM 1651 OG SER A 105 4.888 23.607 -21.527 1.00 0.00 O ATOM 0 H SER A 105 5.010 24.230 -18.463 1.00 0.00 H new ATOM 0 HA SER A 105 5.040 25.966 -19.970 1.00 0.00 H new ATOM 0 HB2 SER A 105 3.033 24.506 -21.707 1.00 0.00 H new ATOM 0 HB3 SER A 105 4.391 25.500 -22.198 1.00 0.00 H new ATOM 0 HG SER A 105 4.399 22.837 -21.168 1.00 0.00 H new ATOM 1657 N SER A 106 2.004 25.734 -18.981 1.00 0.00 N ATOM 1658 CA SER A 106 0.775 26.517 -18.686 1.00 0.00 C ATOM 1659 C SER A 106 1.166 27.922 -18.232 1.00 0.00 C ATOM 1660 O SER A 106 2.231 28.138 -17.688 1.00 0.00 O ATOM 1661 CB SER A 106 -0.018 25.821 -17.580 1.00 0.00 C ATOM 1662 OG SER A 106 0.700 25.914 -16.355 1.00 0.00 O ATOM 0 H SER A 106 2.067 24.831 -18.511 1.00 0.00 H new ATOM 0 HA SER A 106 0.160 26.585 -19.583 1.00 0.00 H new ATOM 0 HB2 SER A 106 -1.000 26.283 -17.475 1.00 0.00 H new ATOM 0 HB3 SER A 106 -0.184 24.775 -17.839 1.00 0.00 H new ATOM 0 HG SER A 106 1.294 25.140 -16.264 1.00 0.00 H new ATOM 1668 N VAL A 107 0.310 28.879 -18.451 1.00 0.00 N ATOM 1669 CA VAL A 107 0.618 30.276 -18.038 1.00 0.00 C ATOM 1670 C VAL A 107 -0.657 30.907 -17.477 1.00 0.00 C ATOM 1671 O VAL A 107 -1.747 30.394 -17.648 1.00 0.00 O ATOM 1672 CB VAL A 107 1.095 31.074 -19.252 1.00 0.00 C ATOM 1673 CG1 VAL A 107 0.010 31.065 -20.330 1.00 0.00 C ATOM 1674 CG2 VAL A 107 1.388 32.516 -18.836 1.00 0.00 C ATOM 0 H VAL A 107 -0.596 28.753 -18.902 1.00 0.00 H new ATOM 0 HA VAL A 107 1.402 30.280 -17.280 1.00 0.00 H new ATOM 0 HB VAL A 107 2.003 30.619 -19.647 1.00 0.00 H new ATOM 0 HG11 VAL A 107 0.351 31.634 -21.195 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -0.196 30.038 -20.630 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -0.900 31.517 -19.934 1.00 0.00 H new ATOM 0 HG21 VAL A 107 1.728 33.083 -19.703 1.00 0.00 H new ATOM 0 HG22 VAL A 107 0.481 32.971 -18.438 1.00 0.00 H new ATOM 0 HG23 VAL A 107 2.164 32.523 -18.071 1.00 0.00 H new ATOM 1684 N VAL A 108 -0.524 32.023 -16.810 1.00 0.00 N ATOM 1685 CA VAL A 108 -1.714 32.686 -16.207 1.00 0.00 C ATOM 1686 C VAL A 108 -2.724 31.629 -15.779 1.00 0.00 C ATOM 1687 O VAL A 108 -3.763 31.467 -16.388 1.00 0.00 O ATOM 1688 CB VAL A 108 -2.359 33.604 -17.245 1.00 0.00 C ATOM 1689 CG1 VAL A 108 -2.658 32.808 -18.513 1.00 0.00 C ATOM 1690 CG2 VAL A 108 -3.660 34.177 -16.682 1.00 0.00 C ATOM 0 H VAL A 108 0.362 32.505 -16.657 1.00 0.00 H new ATOM 0 HA VAL A 108 -1.405 33.268 -15.339 1.00 0.00 H new ATOM 0 HB VAL A 108 -1.677 34.420 -17.482 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -3.118 33.462 -19.253 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -1.730 32.401 -18.915 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -3.340 31.991 -18.277 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -4.120 34.832 -17.422 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -4.344 33.362 -16.444 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -3.445 34.746 -15.778 1.00 0.00 H new ATOM 1700 N ALA A 109 -2.432 30.913 -14.730 1.00 0.00 N ATOM 1701 CA ALA A 109 -3.379 29.868 -14.266 1.00 0.00 C ATOM 1702 C ALA A 109 -4.764 30.496 -14.118 1.00 0.00 C ATOM 1703 O ALA A 109 -4.930 31.690 -14.271 1.00 0.00 O ATOM 1704 CB ALA A 109 -2.913 29.319 -12.916 1.00 0.00 C ATOM 0 H ALA A 109 -1.580 31.007 -14.177 1.00 0.00 H new ATOM 0 HA ALA A 109 -3.418 29.051 -14.986 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -3.608 28.552 -12.576 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -1.919 28.886 -13.023 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -2.880 30.128 -12.186 1.00 0.00 H new ATOM 1710 N THR A 110 -5.765 29.714 -13.833 1.00 0.00 N ATOM 1711 CA THR A 110 -7.129 30.290 -13.691 1.00 0.00 C ATOM 1712 C THR A 110 -7.206 31.121 -12.410 1.00 0.00 C ATOM 1713 O THR A 110 -6.785 30.687 -11.357 1.00 0.00 O ATOM 1714 CB THR A 110 -8.151 29.153 -13.627 1.00 0.00 C ATOM 1715 OG1 THR A 110 -7.925 28.254 -14.704 1.00 0.00 O ATOM 1716 CG2 THR A 110 -9.565 29.723 -13.726 1.00 0.00 C ATOM 0 H THR A 110 -5.699 28.706 -13.693 1.00 0.00 H new ATOM 0 HA THR A 110 -7.346 30.930 -14.546 1.00 0.00 H new ATOM 0 HB THR A 110 -8.043 28.624 -12.680 1.00 0.00 H new ATOM 0 HG1 THR A 110 -8.578 27.524 -14.663 1.00 0.00 H new ATOM 0 HG21 THR A 110 -10.289 28.910 -13.680 1.00 0.00 H new ATOM 0 HG22 THR A 110 -9.739 30.411 -12.898 1.00 0.00 H new ATOM 0 HG23 THR A 110 -9.677 30.256 -14.670 1.00 0.00 H new ATOM 1724 N PRO A 111 -7.744 32.310 -12.499 1.00 0.00 N ATOM 1725 CA PRO A 111 -7.888 33.218 -11.331 1.00 0.00 C ATOM 1726 C PRO A 111 -9.087 32.847 -10.453 1.00 0.00 C ATOM 1727 CB PRO A 111 -8.102 34.586 -11.977 1.00 0.00 C ATOM 1728 CG PRO A 111 -8.806 34.298 -13.261 1.00 0.00 C ATOM 1729 CD PRO A 111 -8.290 32.940 -13.752 1.00 0.00 C ATOM 0 HA PRO A 111 -7.025 33.174 -10.667 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -8.698 35.236 -11.337 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -7.153 35.093 -12.152 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -9.886 34.271 -13.113 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -8.604 35.077 -13.996 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -9.088 32.340 -14.190 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -7.520 33.053 -14.515 1.00 0.00 H new TER 1737 PRO A 111 ATOM 1738 N MET B 1 30.070 19.726 -7.615 1.00 0.00 N ATOM 1739 CA MET B 1 30.217 19.566 -9.089 1.00 0.00 C ATOM 1740 C MET B 1 29.385 20.633 -9.804 1.00 0.00 C ATOM 1741 O MET B 1 29.912 21.523 -10.440 1.00 0.00 O ATOM 1742 CB MET B 1 29.729 18.175 -9.502 1.00 0.00 C ATOM 1743 CG MET B 1 30.642 17.112 -8.890 1.00 0.00 C ATOM 1744 SD MET B 1 30.154 15.477 -9.498 1.00 0.00 S ATOM 1745 CE MET B 1 31.322 14.509 -8.511 1.00 0.00 C ATOM 0 H1 MET B 1 30.814 19.184 -7.131 1.00 0.00 H new ATOM 0 H2 MET B 1 30.156 20.732 -7.365 1.00 0.00 H new ATOM 0 H3 MET B 1 29.137 19.374 -7.319 1.00 0.00 H new ATOM 0 HA MET B 1 31.266 19.679 -9.364 1.00 0.00 H new ATOM 0 HB2 MET B 1 28.702 18.024 -9.168 1.00 0.00 H new ATOM 0 HB3 MET B 1 29.727 18.086 -10.588 1.00 0.00 H new ATOM 0 HG2 MET B 1 31.681 17.314 -9.152 1.00 0.00 H new ATOM 0 HG3 MET B 1 30.576 17.142 -7.802 1.00 0.00 H new ATOM 0 HE1 MET B 1 31.194 13.449 -8.731 1.00 0.00 H new ATOM 0 HE2 MET B 1 32.341 14.810 -8.755 1.00 0.00 H new ATOM 0 HE3 MET B 1 31.136 14.684 -7.451 1.00 0.00 H new ATOM 1754 N ALA B 2 28.087 20.549 -9.706 1.00 0.00 N ATOM 1755 CA ALA B 2 27.221 21.559 -10.382 1.00 0.00 C ATOM 1756 C ALA B 2 27.598 21.640 -11.862 1.00 0.00 C ATOM 1757 O ALA B 2 27.949 22.687 -12.368 1.00 0.00 O ATOM 1758 CB ALA B 2 27.427 22.925 -9.727 1.00 0.00 C ATOM 0 H ALA B 2 27.588 19.826 -9.188 1.00 0.00 H new ATOM 0 HA ALA B 2 26.175 21.266 -10.288 1.00 0.00 H new ATOM 0 HB1 ALA B 2 26.795 23.664 -10.220 1.00 0.00 H new ATOM 0 HB2 ALA B 2 27.161 22.866 -8.672 1.00 0.00 H new ATOM 0 HB3 ALA B 2 28.472 23.220 -9.822 1.00 0.00 H new ATOM 1764 N THR B 3 27.526 20.540 -12.561 1.00 0.00 N ATOM 1765 CA THR B 3 27.883 20.549 -14.008 1.00 0.00 C ATOM 1766 C THR B 3 26.604 20.644 -14.838 1.00 0.00 C ATOM 1767 O THR B 3 26.633 20.898 -16.026 1.00 0.00 O ATOM 1768 CB THR B 3 28.613 19.252 -14.358 1.00 0.00 C ATOM 1769 OG1 THR B 3 29.227 19.384 -15.629 1.00 0.00 O ATOM 1770 CG2 THR B 3 27.616 18.092 -14.385 1.00 0.00 C ATOM 0 H THR B 3 27.235 19.635 -12.192 1.00 0.00 H new ATOM 0 HA THR B 3 28.528 21.401 -14.222 1.00 0.00 H new ATOM 0 HB THR B 3 29.376 19.051 -13.606 1.00 0.00 H new ATOM 0 HG1 THR B 3 28.675 19.956 -16.201 1.00 0.00 H new ATOM 0 HG21 THR B 3 28.139 17.169 -14.635 1.00 0.00 H new ATOM 0 HG22 THR B 3 27.149 17.991 -13.405 1.00 0.00 H new ATOM 0 HG23 THR B 3 26.849 18.289 -15.134 1.00 0.00 H new ATOM 1778 N SER B 4 25.481 20.451 -14.207 1.00 0.00 N ATOM 1779 CA SER B 4 24.184 20.519 -14.933 1.00 0.00 C ATOM 1780 C SER B 4 23.261 21.480 -14.200 1.00 0.00 C ATOM 1781 O SER B 4 23.145 22.635 -14.555 1.00 0.00 O ATOM 1782 CB SER B 4 23.535 19.141 -14.968 1.00 0.00 C ATOM 1783 OG SER B 4 24.459 18.189 -15.477 1.00 0.00 O ATOM 0 H SER B 4 25.406 20.247 -13.210 1.00 0.00 H new ATOM 0 HA SER B 4 24.358 20.862 -15.953 1.00 0.00 H new ATOM 0 HB2 SER B 4 23.216 18.853 -13.966 1.00 0.00 H new ATOM 0 HB3 SER B 4 22.642 19.165 -15.592 1.00 0.00 H new ATOM 0 HG SER B 4 24.482 18.246 -16.455 1.00 0.00 H new ATOM 1789 N GLY B 5 22.609 21.030 -13.170 1.00 0.00 N ATOM 1790 CA GLY B 5 21.703 21.944 -12.422 1.00 0.00 C ATOM 1791 C GLY B 5 21.607 21.493 -10.959 1.00 0.00 C ATOM 1792 O GLY B 5 22.345 20.642 -10.508 1.00 0.00 O ATOM 0 H GLY B 5 22.662 20.076 -12.813 1.00 0.00 H new ATOM 0 HA2 GLY B 5 22.078 22.966 -12.474 1.00 0.00 H new ATOM 0 HA3 GLY B 5 20.713 21.944 -12.878 1.00 0.00 H new ATOM 1796 N PHE B 6 20.687 22.050 -10.222 1.00 0.00 N ATOM 1797 CA PHE B 6 20.522 21.646 -8.802 1.00 0.00 C ATOM 1798 C PHE B 6 19.155 20.974 -8.657 1.00 0.00 C ATOM 1799 O PHE B 6 18.158 21.477 -9.134 1.00 0.00 O ATOM 1800 CB PHE B 6 20.610 22.881 -7.905 1.00 0.00 C ATOM 1801 CG PHE B 6 22.053 23.321 -7.800 1.00 0.00 C ATOM 1802 CD1 PHE B 6 22.898 22.737 -6.845 1.00 0.00 C ATOM 1803 CD2 PHE B 6 22.553 24.310 -8.659 1.00 0.00 C ATOM 1804 CE1 PHE B 6 24.236 23.143 -6.751 1.00 0.00 C ATOM 1805 CE2 PHE B 6 23.891 24.715 -8.564 1.00 0.00 C ATOM 1806 CZ PHE B 6 24.733 24.131 -7.611 1.00 0.00 C ATOM 0 H PHE B 6 20.041 22.770 -10.545 1.00 0.00 H new ATOM 0 HA PHE B 6 21.308 20.952 -8.504 1.00 0.00 H new ATOM 0 HB2 PHE B 6 20.001 23.687 -8.315 1.00 0.00 H new ATOM 0 HB3 PHE B 6 20.214 22.655 -6.915 1.00 0.00 H new ATOM 0 HD1 PHE B 6 22.517 21.974 -6.182 1.00 0.00 H new ATOM 0 HD2 PHE B 6 21.905 24.761 -9.396 1.00 0.00 H new ATOM 0 HE1 PHE B 6 24.885 22.693 -6.014 1.00 0.00 H new ATOM 0 HE2 PHE B 6 24.273 25.478 -9.226 1.00 0.00 H new ATOM 0 HZ PHE B 6 25.765 24.442 -7.539 1.00 0.00 H new ATOM 1816 N LYS B 7 19.100 19.818 -8.047 1.00 0.00 N ATOM 1817 CA LYS B 7 17.793 19.102 -7.952 1.00 0.00 C ATOM 1818 C LYS B 7 17.129 19.262 -6.591 1.00 0.00 C ATOM 1819 O LYS B 7 17.702 18.995 -5.552 1.00 0.00 O ATOM 1820 CB LYS B 7 18.009 17.604 -8.200 1.00 0.00 C ATOM 1821 CG LYS B 7 16.648 16.905 -8.296 1.00 0.00 C ATOM 1822 CD LYS B 7 16.842 15.385 -8.347 1.00 0.00 C ATOM 1823 CE LYS B 7 16.921 14.828 -6.923 1.00 0.00 C ATOM 1824 NZ LYS B 7 17.564 13.486 -6.950 1.00 0.00 N ATOM 0 H LYS B 7 19.893 19.344 -7.615 1.00 0.00 H new ATOM 0 HA LYS B 7 17.140 19.544 -8.705 1.00 0.00 H new ATOM 0 HB2 LYS B 7 18.574 17.454 -9.120 1.00 0.00 H new ATOM 0 HB3 LYS B 7 18.597 17.171 -7.391 1.00 0.00 H new ATOM 0 HG2 LYS B 7 16.031 17.173 -7.438 1.00 0.00 H new ATOM 0 HG3 LYS B 7 16.119 17.242 -9.187 1.00 0.00 H new ATOM 0 HD2 LYS B 7 16.015 14.921 -8.884 1.00 0.00 H new ATOM 0 HD3 LYS B 7 17.753 15.143 -8.894 1.00 0.00 H new ATOM 0 HE2 LYS B 7 17.493 15.504 -6.288 1.00 0.00 H new ATOM 0 HE3 LYS B 7 15.922 14.756 -6.493 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 17.526 13.064 -6.000 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 17.060 12.873 -7.622 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 18.556 13.582 -7.247 1.00 0.00 H new ATOM 1838 N HIS B 8 15.880 19.638 -6.620 1.00 0.00 N ATOM 1839 CA HIS B 8 15.054 19.705 -5.389 1.00 0.00 C ATOM 1840 C HIS B 8 13.869 18.776 -5.629 1.00 0.00 C ATOM 1841 O HIS B 8 13.115 18.965 -6.563 1.00 0.00 O ATOM 1842 CB HIS B 8 14.540 21.127 -5.151 1.00 0.00 C ATOM 1843 CG HIS B 8 15.365 21.786 -4.075 1.00 0.00 C ATOM 1844 ND1 HIS B 8 14.788 22.396 -2.970 1.00 0.00 N ATOM 1845 CD2 HIS B 8 16.724 21.942 -3.922 1.00 0.00 C ATOM 1846 CE1 HIS B 8 15.786 22.885 -2.207 1.00 0.00 C ATOM 1847 NE2 HIS B 8 16.980 22.635 -2.743 1.00 0.00 N ATOM 0 H HIS B 8 15.388 19.908 -7.471 1.00 0.00 H new ATOM 0 HA HIS B 8 15.639 19.417 -4.515 1.00 0.00 H new ATOM 0 HB2 HIS B 8 14.597 21.705 -6.073 1.00 0.00 H new ATOM 0 HB3 HIS B 8 13.491 21.101 -4.856 1.00 0.00 H new ATOM 0 HD2 HIS B 8 17.475 21.582 -4.610 1.00 0.00 H new ATOM 0 HE1 HIS B 8 15.636 23.414 -1.277 1.00 0.00 H new ATOM 0 HE2 HIS B 8 17.891 22.897 -2.367 1.00 0.00 H new ATOM 1856 N LEU B 9 13.697 17.766 -4.832 1.00 0.00 N ATOM 1857 CA LEU B 9 12.582 16.821 -5.095 1.00 0.00 C ATOM 1858 C LEU B 9 11.813 16.572 -3.810 1.00 0.00 C ATOM 1859 O LEU B 9 12.378 16.486 -2.739 1.00 0.00 O ATOM 1860 CB LEU B 9 13.134 15.498 -5.635 1.00 0.00 C ATOM 1861 CG LEU B 9 11.972 14.599 -6.068 1.00 0.00 C ATOM 1862 CD1 LEU B 9 12.326 13.891 -7.375 1.00 0.00 C ATOM 1863 CD2 LEU B 9 11.704 13.554 -4.983 1.00 0.00 C ATOM 0 H LEU B 9 14.273 17.554 -4.017 1.00 0.00 H new ATOM 0 HA LEU B 9 11.913 17.254 -5.838 1.00 0.00 H new ATOM 0 HB2 LEU B 9 13.797 15.686 -6.480 1.00 0.00 H new ATOM 0 HB3 LEU B 9 13.728 14.999 -4.869 1.00 0.00 H new ATOM 0 HG LEU B 9 11.082 15.210 -6.217 1.00 0.00 H new ATOM 0 HD11 LEU B 9 11.497 13.253 -7.679 1.00 0.00 H new ATOM 0 HD12 LEU B 9 12.516 14.633 -8.151 1.00 0.00 H new ATOM 0 HD13 LEU B 9 13.218 13.282 -7.229 1.00 0.00 H new ATOM 0 HD21 LEU B 9 10.877 12.914 -5.291 1.00 0.00 H new ATOM 0 HD22 LEU B 9 12.597 12.947 -4.834 1.00 0.00 H new ATOM 0 HD23 LEU B 9 11.447 14.056 -4.050 1.00 0.00 H new ATOM 1875 N VAL B 10 10.523 16.468 -3.909 1.00 0.00 N ATOM 1876 CA VAL B 10 9.704 16.215 -2.701 1.00 0.00 C ATOM 1877 C VAL B 10 8.767 15.033 -2.958 1.00 0.00 C ATOM 1878 O VAL B 10 8.136 14.944 -3.991 1.00 0.00 O ATOM 1879 CB VAL B 10 8.880 17.469 -2.392 1.00 0.00 C ATOM 1880 CG1 VAL B 10 7.834 17.671 -3.489 1.00 0.00 C ATOM 1881 CG2 VAL B 10 8.175 17.314 -1.042 1.00 0.00 C ATOM 0 H VAL B 10 9.998 16.548 -4.780 1.00 0.00 H new ATOM 0 HA VAL B 10 10.350 15.980 -1.855 1.00 0.00 H new ATOM 0 HB VAL B 10 9.545 18.332 -2.351 1.00 0.00 H new ATOM 0 HG11 VAL B 10 7.246 18.563 -3.271 1.00 0.00 H new ATOM 0 HG12 VAL B 10 8.334 17.791 -4.450 1.00 0.00 H new ATOM 0 HG13 VAL B 10 7.176 16.803 -3.528 1.00 0.00 H new ATOM 0 HG21 VAL B 10 7.592 18.210 -0.831 1.00 0.00 H new ATOM 0 HG22 VAL B 10 7.512 16.449 -1.075 1.00 0.00 H new ATOM 0 HG23 VAL B 10 8.918 17.172 -0.258 1.00 0.00 H new ATOM 1891 N VAL B 11 8.647 14.144 -2.013 1.00 0.00 N ATOM 1892 CA VAL B 11 7.765 12.961 -2.210 1.00 0.00 C ATOM 1893 C VAL B 11 6.608 13.130 -1.243 1.00 0.00 C ATOM 1894 O VAL B 11 6.809 13.447 -0.088 1.00 0.00 O ATOM 1895 CB VAL B 11 8.513 11.661 -1.912 1.00 0.00 C ATOM 1896 CG1 VAL B 11 7.832 10.513 -2.658 1.00 0.00 C ATOM 1897 CG2 VAL B 11 9.967 11.779 -2.380 1.00 0.00 C ATOM 0 H VAL B 11 9.122 14.186 -1.111 1.00 0.00 H new ATOM 0 HA VAL B 11 7.423 12.901 -3.243 1.00 0.00 H new ATOM 0 HB VAL B 11 8.497 11.469 -0.839 1.00 0.00 H new ATOM 0 HG11 VAL B 11 8.359 9.581 -2.451 1.00 0.00 H new ATOM 0 HG12 VAL B 11 6.798 10.426 -2.326 1.00 0.00 H new ATOM 0 HG13 VAL B 11 7.853 10.712 -3.729 1.00 0.00 H new ATOM 0 HG21 VAL B 11 10.495 10.850 -2.165 1.00 0.00 H new ATOM 0 HG22 VAL B 11 9.990 11.969 -3.453 1.00 0.00 H new ATOM 0 HG23 VAL B 11 10.452 12.602 -1.855 1.00 0.00 H new ATOM 1907 N VAL B 12 5.397 12.985 -1.688 1.00 0.00 N ATOM 1908 CA VAL B 12 4.282 13.175 -0.728 1.00 0.00 C ATOM 1909 C VAL B 12 3.160 12.152 -0.904 1.00 0.00 C ATOM 1910 O VAL B 12 2.880 11.671 -1.985 1.00 0.00 O ATOM 1911 CB VAL B 12 3.722 14.572 -0.945 1.00 0.00 C ATOM 1912 CG1 VAL B 12 4.817 15.597 -0.635 1.00 0.00 C ATOM 1913 CG2 VAL B 12 3.291 14.720 -2.406 1.00 0.00 C ATOM 0 H VAL B 12 5.134 12.750 -2.645 1.00 0.00 H new ATOM 0 HA VAL B 12 4.673 13.040 0.280 1.00 0.00 H new ATOM 0 HB VAL B 12 2.864 14.735 -0.293 1.00 0.00 H new ATOM 0 HG11 VAL B 12 4.427 16.603 -0.787 1.00 0.00 H new ATOM 0 HG12 VAL B 12 5.138 15.485 0.401 1.00 0.00 H new ATOM 0 HG13 VAL B 12 5.667 15.433 -1.298 1.00 0.00 H new ATOM 0 HG21 VAL B 12 2.889 15.720 -2.567 1.00 0.00 H new ATOM 0 HG22 VAL B 12 4.152 14.566 -3.057 1.00 0.00 H new ATOM 0 HG23 VAL B 12 2.525 13.979 -2.636 1.00 0.00 H new ATOM 1923 N LYS B 13 2.496 11.860 0.182 1.00 0.00 N ATOM 1924 CA LYS B 13 1.349 10.919 0.160 1.00 0.00 C ATOM 1925 C LYS B 13 0.175 11.633 0.837 1.00 0.00 C ATOM 1926 O LYS B 13 0.372 12.541 1.621 1.00 0.00 O ATOM 1927 CB LYS B 13 1.711 9.638 0.917 1.00 0.00 C ATOM 1928 CG LYS B 13 2.631 8.777 0.043 1.00 0.00 C ATOM 1929 CD LYS B 13 3.081 7.544 0.831 1.00 0.00 C ATOM 1930 CE LYS B 13 1.920 6.556 0.937 1.00 0.00 C ATOM 1931 NZ LYS B 13 2.442 5.213 1.324 1.00 0.00 N ATOM 0 H LYS B 13 2.709 12.245 1.102 1.00 0.00 H new ATOM 0 HA LYS B 13 1.088 10.636 -0.860 1.00 0.00 H new ATOM 0 HB2 LYS B 13 2.208 9.884 1.856 1.00 0.00 H new ATOM 0 HB3 LYS B 13 0.807 9.084 1.170 1.00 0.00 H new ATOM 0 HG2 LYS B 13 2.107 8.471 -0.863 1.00 0.00 H new ATOM 0 HG3 LYS B 13 3.499 9.357 -0.271 1.00 0.00 H new ATOM 0 HD2 LYS B 13 3.930 7.072 0.336 1.00 0.00 H new ATOM 0 HD3 LYS B 13 3.415 7.837 1.826 1.00 0.00 H new ATOM 0 HE2 LYS B 13 1.199 6.904 1.676 1.00 0.00 H new ATOM 0 HE3 LYS B 13 1.394 6.493 -0.016 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 1.652 4.541 1.396 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 3.114 4.881 0.603 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 2.925 5.280 2.243 1.00 0.00 H new ATOM 1945 N PHE B 14 -1.038 11.268 0.529 1.00 0.00 N ATOM 1946 CA PHE B 14 -2.204 11.997 1.118 1.00 0.00 C ATOM 1947 C PHE B 14 -3.006 11.102 2.073 1.00 0.00 C ATOM 1948 O PHE B 14 -2.994 9.890 1.971 1.00 0.00 O ATOM 1949 CB PHE B 14 -3.108 12.457 -0.022 1.00 0.00 C ATOM 1950 CG PHE B 14 -3.857 11.269 -0.580 1.00 0.00 C ATOM 1951 CD1 PHE B 14 -4.987 10.781 0.084 1.00 0.00 C ATOM 1952 CD2 PHE B 14 -3.419 10.654 -1.762 1.00 0.00 C ATOM 1953 CE1 PHE B 14 -5.682 9.680 -0.431 1.00 0.00 C ATOM 1954 CE2 PHE B 14 -4.114 9.553 -2.277 1.00 0.00 C ATOM 1955 CZ PHE B 14 -5.244 9.067 -1.612 1.00 0.00 C ATOM 0 H PHE B 14 -1.275 10.502 -0.101 1.00 0.00 H new ATOM 0 HA PHE B 14 -1.833 12.847 1.691 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -3.811 13.208 0.338 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -2.513 12.927 -0.806 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -5.324 11.254 0.995 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -2.546 11.030 -2.275 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -6.555 9.304 0.082 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -3.777 9.079 -3.187 1.00 0.00 H new ATOM 0 HZ PHE B 14 -5.780 8.218 -2.009 1.00 0.00 H new ATOM 1965 N LYS B 15 -3.731 11.703 2.988 1.00 0.00 N ATOM 1966 CA LYS B 15 -4.586 10.912 3.923 1.00 0.00 C ATOM 1967 C LYS B 15 -5.999 11.502 3.906 1.00 0.00 C ATOM 1968 O LYS B 15 -6.959 10.852 4.271 1.00 0.00 O ATOM 1969 CB LYS B 15 -4.017 10.962 5.344 1.00 0.00 C ATOM 1970 CG LYS B 15 -4.183 12.368 5.917 1.00 0.00 C ATOM 1971 CD LYS B 15 -3.458 12.460 7.263 1.00 0.00 C ATOM 1972 CE LYS B 15 -3.937 13.705 8.012 1.00 0.00 C ATOM 1973 NZ LYS B 15 -3.150 13.868 9.266 1.00 0.00 N ATOM 0 H LYS B 15 -3.765 12.713 3.126 1.00 0.00 H new ATOM 0 HA LYS B 15 -4.609 9.870 3.603 1.00 0.00 H new ATOM 0 HB2 LYS B 15 -4.530 10.238 5.977 1.00 0.00 H new ATOM 0 HB3 LYS B 15 -2.963 10.685 5.334 1.00 0.00 H new ATOM 0 HG2 LYS B 15 -3.779 13.105 5.223 1.00 0.00 H new ATOM 0 HG3 LYS B 15 -5.241 12.597 6.045 1.00 0.00 H new ATOM 0 HD2 LYS B 15 -3.654 11.567 7.856 1.00 0.00 H new ATOM 0 HD3 LYS B 15 -2.380 12.508 7.106 1.00 0.00 H new ATOM 0 HE2 LYS B 15 -3.823 14.587 7.382 1.00 0.00 H new ATOM 0 HE3 LYS B 15 -4.998 13.615 8.246 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 -3.477 14.715 9.774 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 -3.281 13.031 9.869 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 -2.142 13.972 9.032 1.00 0.00 H new ATOM 1987 N GLU B 16 -6.134 12.717 3.450 1.00 0.00 N ATOM 1988 CA GLU B 16 -7.484 13.340 3.357 1.00 0.00 C ATOM 1989 C GLU B 16 -8.022 13.038 1.954 1.00 0.00 C ATOM 1990 O GLU B 16 -9.096 12.501 1.778 1.00 0.00 O ATOM 1991 CB GLU B 16 -7.371 14.862 3.547 1.00 0.00 C ATOM 1992 CG GLU B 16 -6.828 15.180 4.943 1.00 0.00 C ATOM 1993 CD GLU B 16 -6.777 16.699 5.143 1.00 0.00 C ATOM 1994 OE1 GLU B 16 -6.990 17.413 4.175 1.00 0.00 O ATOM 1995 OE2 GLU B 16 -6.528 17.125 6.260 1.00 0.00 O ATOM 0 H GLU B 16 -5.364 13.307 3.137 1.00 0.00 H new ATOM 0 HA GLU B 16 -8.147 12.945 4.127 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -6.712 15.283 2.788 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -8.348 15.326 3.414 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -7.463 14.724 5.703 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -5.832 14.754 5.062 1.00 0.00 H new ATOM 2002 N ASP B 17 -7.243 13.380 0.966 1.00 0.00 N ATOM 2003 CA ASP B 17 -7.603 13.122 -0.455 1.00 0.00 C ATOM 2004 C ASP B 17 -6.967 14.241 -1.274 1.00 0.00 C ATOM 2005 O ASP B 17 -7.639 15.092 -1.823 1.00 0.00 O ATOM 2006 CB ASP B 17 -9.121 13.136 -0.643 1.00 0.00 C ATOM 2007 CG ASP B 17 -9.454 13.304 -2.129 1.00 0.00 C ATOM 2008 OD1 ASP B 17 -8.585 13.034 -2.942 1.00 0.00 O ATOM 2009 OD2 ASP B 17 -10.566 13.705 -2.427 1.00 0.00 O ATOM 0 H ASP B 17 -6.343 13.843 1.091 1.00 0.00 H new ATOM 0 HA ASP B 17 -7.246 12.142 -0.771 1.00 0.00 H new ATOM 0 HB2 ASP B 17 -9.553 12.209 -0.266 1.00 0.00 H new ATOM 0 HB3 ASP B 17 -9.561 13.950 -0.067 1.00 0.00 H new ATOM 2014 N THR B 18 -5.663 14.274 -1.308 1.00 0.00 N ATOM 2015 CA THR B 18 -4.956 15.358 -2.045 1.00 0.00 C ATOM 2016 C THR B 18 -5.408 15.479 -3.495 1.00 0.00 C ATOM 2017 O THR B 18 -5.119 14.647 -4.334 1.00 0.00 O ATOM 2018 CB THR B 18 -3.449 15.114 -2.031 1.00 0.00 C ATOM 2019 OG1 THR B 18 -2.988 15.081 -0.690 1.00 0.00 O ATOM 2020 CG2 THR B 18 -2.762 16.252 -2.786 1.00 0.00 C ATOM 0 H THR B 18 -5.054 13.593 -0.854 1.00 0.00 H new ATOM 0 HA THR B 18 -5.204 16.287 -1.531 1.00 0.00 H new ATOM 0 HB THR B 18 -3.219 14.162 -2.509 1.00 0.00 H new ATOM 0 HG1 THR B 18 -2.802 15.994 -0.385 1.00 0.00 H new ATOM 0 HG21 THR B 18 -1.684 16.091 -2.784 1.00 0.00 H new ATOM 0 HG22 THR B 18 -3.124 16.277 -3.814 1.00 0.00 H new ATOM 0 HG23 THR B 18 -2.988 17.200 -2.299 1.00 0.00 H new ATOM 2028 N LYS B 19 -6.065 16.560 -3.799 1.00 0.00 N ATOM 2029 CA LYS B 19 -6.493 16.812 -5.192 1.00 0.00 C ATOM 2030 C LYS B 19 -5.227 17.204 -5.948 1.00 0.00 C ATOM 2031 O LYS B 19 -4.885 18.362 -6.046 1.00 0.00 O ATOM 2032 CB LYS B 19 -7.500 17.963 -5.223 1.00 0.00 C ATOM 2033 CG LYS B 19 -7.176 18.951 -4.096 1.00 0.00 C ATOM 2034 CD LYS B 19 -7.965 18.573 -2.837 1.00 0.00 C ATOM 2035 CE LYS B 19 -7.320 19.224 -1.608 1.00 0.00 C ATOM 2036 NZ LYS B 19 -8.285 19.219 -0.473 1.00 0.00 N ATOM 0 H LYS B 19 -6.325 17.286 -3.131 1.00 0.00 H new ATOM 0 HA LYS B 19 -6.972 15.939 -5.635 1.00 0.00 H new ATOM 0 HB2 LYS B 19 -7.462 18.469 -6.188 1.00 0.00 H new ATOM 0 HB3 LYS B 19 -8.513 17.578 -5.105 1.00 0.00 H new ATOM 0 HG2 LYS B 19 -6.107 18.939 -3.884 1.00 0.00 H new ATOM 0 HG3 LYS B 19 -7.428 19.965 -4.405 1.00 0.00 H new ATOM 0 HD2 LYS B 19 -9.000 18.901 -2.933 1.00 0.00 H new ATOM 0 HD3 LYS B 19 -7.983 17.490 -2.719 1.00 0.00 H new ATOM 0 HE2 LYS B 19 -6.415 18.683 -1.331 1.00 0.00 H new ATOM 0 HE3 LYS B 19 -7.022 20.246 -1.840 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 -7.845 19.661 0.359 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 -9.137 19.753 -0.739 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 -8.548 18.239 -0.246 1.00 0.00 H new ATOM 2050 N VAL B 20 -4.508 16.235 -6.441 1.00 0.00 N ATOM 2051 CA VAL B 20 -3.232 16.531 -7.155 1.00 0.00 C ATOM 2052 C VAL B 20 -3.499 17.386 -8.397 1.00 0.00 C ATOM 2053 O VAL B 20 -2.774 18.316 -8.690 1.00 0.00 O ATOM 2054 CB VAL B 20 -2.595 15.217 -7.589 1.00 0.00 C ATOM 2055 CG1 VAL B 20 -2.313 14.354 -6.357 1.00 0.00 C ATOM 2056 CG2 VAL B 20 -3.557 14.473 -8.520 1.00 0.00 C ATOM 0 H VAL B 20 -4.749 15.246 -6.381 1.00 0.00 H new ATOM 0 HA VAL B 20 -2.568 17.077 -6.485 1.00 0.00 H new ATOM 0 HB VAL B 20 -1.660 15.420 -8.112 1.00 0.00 H new ATOM 0 HG11 VAL B 20 -1.857 13.414 -6.668 1.00 0.00 H new ATOM 0 HG12 VAL B 20 -1.633 14.884 -5.690 1.00 0.00 H new ATOM 0 HG13 VAL B 20 -3.248 14.149 -5.835 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -3.105 13.532 -8.833 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -4.489 14.270 -7.993 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -3.762 15.087 -9.397 1.00 0.00 H new ATOM 2066 N ASP B 21 -4.525 17.070 -9.129 1.00 0.00 N ATOM 2067 CA ASP B 21 -4.846 17.855 -10.354 1.00 0.00 C ATOM 2068 C ASP B 21 -5.196 19.302 -9.989 1.00 0.00 C ATOM 2069 O ASP B 21 -4.718 20.233 -10.611 1.00 0.00 O ATOM 2070 CB ASP B 21 -6.025 17.201 -11.063 1.00 0.00 C ATOM 2071 CG ASP B 21 -5.603 15.816 -11.557 1.00 0.00 C ATOM 2072 OD1 ASP B 21 -4.411 15.558 -11.603 1.00 0.00 O ATOM 2073 OD2 ASP B 21 -6.480 15.036 -11.895 1.00 0.00 O ATOM 0 H ASP B 21 -5.161 16.297 -8.933 1.00 0.00 H new ATOM 0 HA ASP B 21 -3.977 17.868 -11.011 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -6.873 17.116 -10.383 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -6.349 17.817 -11.902 1.00 0.00 H new ATOM 2078 N GLU B 22 -6.003 19.516 -8.984 1.00 0.00 N ATOM 2079 CA GLU B 22 -6.321 20.918 -8.592 1.00 0.00 C ATOM 2080 C GLU B 22 -5.049 21.519 -8.010 1.00 0.00 C ATOM 2081 O GLU B 22 -4.740 22.682 -8.197 1.00 0.00 O ATOM 2082 CB GLU B 22 -7.430 20.932 -7.542 1.00 0.00 C ATOM 2083 CG GLU B 22 -8.002 22.344 -7.430 1.00 0.00 C ATOM 2084 CD GLU B 22 -9.030 22.390 -6.298 1.00 0.00 C ATOM 2085 OE1 GLU B 22 -9.240 21.364 -5.672 1.00 0.00 O ATOM 2086 OE2 GLU B 22 -9.590 23.452 -6.078 1.00 0.00 O ATOM 0 H GLU B 22 -6.450 18.790 -8.424 1.00 0.00 H new ATOM 0 HA GLU B 22 -6.665 21.491 -9.453 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -8.217 20.230 -7.818 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -7.038 20.609 -6.578 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -7.201 23.058 -7.237 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -8.469 22.635 -8.371 1.00 0.00 H new ATOM 2093 N ILE B 23 -4.287 20.705 -7.343 1.00 0.00 N ATOM 2094 CA ILE B 23 -2.998 21.166 -6.786 1.00 0.00 C ATOM 2095 C ILE B 23 -2.091 21.456 -7.979 1.00 0.00 C ATOM 2096 O ILE B 23 -1.398 22.453 -8.034 1.00 0.00 O ATOM 2097 CB ILE B 23 -2.419 20.032 -5.934 1.00 0.00 C ATOM 2098 CG1 ILE B 23 -3.099 20.037 -4.563 1.00 0.00 C ATOM 2099 CG2 ILE B 23 -0.909 20.209 -5.765 1.00 0.00 C ATOM 2100 CD1 ILE B 23 -2.408 21.051 -3.652 1.00 0.00 C ATOM 0 H ILE B 23 -4.509 19.726 -7.159 1.00 0.00 H new ATOM 0 HA ILE B 23 -3.101 22.056 -6.165 1.00 0.00 H new ATOM 0 HB ILE B 23 -2.602 19.080 -6.433 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -4.154 20.289 -4.670 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -3.052 19.043 -4.119 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -0.513 19.395 -5.157 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -0.430 20.197 -6.744 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -0.707 21.161 -5.273 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -2.893 21.053 -2.676 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -1.359 20.779 -3.535 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -2.478 22.045 -4.094 1.00 0.00 H new ATOM 2112 N LEU B 24 -2.134 20.586 -8.950 1.00 0.00 N ATOM 2113 CA LEU B 24 -1.340 20.780 -10.188 1.00 0.00 C ATOM 2114 C LEU B 24 -1.749 22.102 -10.840 1.00 0.00 C ATOM 2115 O LEU B 24 -0.918 22.841 -11.332 1.00 0.00 O ATOM 2116 CB LEU B 24 -1.638 19.615 -11.132 1.00 0.00 C ATOM 2117 CG LEU B 24 -0.714 19.671 -12.346 1.00 0.00 C ATOM 2118 CD1 LEU B 24 0.675 19.164 -11.955 1.00 0.00 C ATOM 2119 CD2 LEU B 24 -1.291 18.783 -13.449 1.00 0.00 C ATOM 0 H LEU B 24 -2.697 19.735 -8.934 1.00 0.00 H new ATOM 0 HA LEU B 24 -0.274 20.811 -9.964 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -1.504 18.669 -10.607 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -2.678 19.656 -11.455 1.00 0.00 H new ATOM 0 HG LEU B 24 -0.633 20.698 -12.703 1.00 0.00 H new ATOM 0 HD11 LEU B 24 1.334 19.204 -12.822 1.00 0.00 H new ATOM 0 HD12 LEU B 24 1.081 19.791 -11.161 1.00 0.00 H new ATOM 0 HD13 LEU B 24 0.601 18.135 -11.603 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -0.638 18.816 -14.321 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -1.364 17.757 -13.089 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -2.283 19.142 -13.724 1.00 0.00 H new ATOM 2131 N LYS B 25 -3.019 22.425 -10.833 1.00 0.00 N ATOM 2132 CA LYS B 25 -3.444 23.726 -11.423 1.00 0.00 C ATOM 2133 C LYS B 25 -2.750 24.829 -10.633 1.00 0.00 C ATOM 2134 O LYS B 25 -2.340 25.837 -11.174 1.00 0.00 O ATOM 2135 CB LYS B 25 -4.964 23.896 -11.320 1.00 0.00 C ATOM 2136 CG LYS B 25 -5.370 25.224 -11.968 1.00 0.00 C ATOM 2137 CD LYS B 25 -6.384 25.947 -11.076 1.00 0.00 C ATOM 2138 CE LYS B 25 -5.719 26.338 -9.755 1.00 0.00 C ATOM 2139 NZ LYS B 25 -6.200 27.684 -9.333 1.00 0.00 N ATOM 0 H LYS B 25 -3.769 21.850 -10.449 1.00 0.00 H new ATOM 0 HA LYS B 25 -3.174 23.767 -12.478 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -5.469 23.067 -11.816 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -5.273 23.878 -10.275 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -4.491 25.851 -12.117 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -5.802 25.042 -12.952 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -6.760 26.836 -11.582 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -7.242 25.302 -10.886 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -5.951 25.600 -8.987 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -4.635 26.348 -9.871 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -5.747 27.949 -8.435 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -5.957 28.384 -10.063 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -7.232 27.660 -9.206 1.00 0.00 H new ATOM 2153 N GLY B 26 -2.593 24.622 -9.354 1.00 0.00 N ATOM 2154 CA GLY B 26 -1.887 25.630 -8.524 1.00 0.00 C ATOM 2155 C GLY B 26 -0.449 25.727 -9.023 1.00 0.00 C ATOM 2156 O GLY B 26 0.040 26.792 -9.348 1.00 0.00 O ATOM 0 H GLY B 26 -2.924 23.798 -8.851 1.00 0.00 H new ATOM 0 HA2 GLY B 26 -2.382 26.598 -8.597 1.00 0.00 H new ATOM 0 HA3 GLY B 26 -1.907 25.340 -7.473 1.00 0.00 H new ATOM 2160 N LEU B 27 0.229 24.611 -9.101 1.00 0.00 N ATOM 2161 CA LEU B 27 1.632 24.619 -9.598 1.00 0.00 C ATOM 2162 C LEU B 27 1.713 25.516 -10.836 1.00 0.00 C ATOM 2163 O LEU B 27 2.639 26.287 -10.991 1.00 0.00 O ATOM 2164 CB LEU B 27 2.052 23.188 -9.953 1.00 0.00 C ATOM 2165 CG LEU B 27 3.579 23.092 -10.015 1.00 0.00 C ATOM 2166 CD1 LEU B 27 4.011 21.655 -9.705 1.00 0.00 C ATOM 2167 CD2 LEU B 27 4.056 23.471 -11.418 1.00 0.00 C ATOM 0 H LEU B 27 -0.132 23.693 -8.840 1.00 0.00 H new ATOM 0 HA LEU B 27 2.302 25.003 -8.829 1.00 0.00 H new ATOM 0 HB2 LEU B 27 1.665 22.491 -9.209 1.00 0.00 H new ATOM 0 HB3 LEU B 27 1.622 22.901 -10.913 1.00 0.00 H new ATOM 0 HG LEU B 27 4.016 23.772 -9.284 1.00 0.00 H new ATOM 0 HD11 LEU B 27 5.098 21.584 -9.749 1.00 0.00 H new ATOM 0 HD12 LEU B 27 3.669 21.380 -8.707 1.00 0.00 H new ATOM 0 HD13 LEU B 27 3.574 20.977 -10.438 1.00 0.00 H new ATOM 0 HD21 LEU B 27 5.143 23.403 -11.463 1.00 0.00 H new ATOM 0 HD22 LEU B 27 3.619 22.789 -12.147 1.00 0.00 H new ATOM 0 HD23 LEU B 27 3.746 24.491 -11.644 1.00 0.00 H new ATOM 2179 N GLU B 28 0.741 25.445 -11.712 1.00 0.00 N ATOM 2180 CA GLU B 28 0.768 26.333 -12.909 1.00 0.00 C ATOM 2181 C GLU B 28 0.967 27.760 -12.412 1.00 0.00 C ATOM 2182 O GLU B 28 1.706 28.538 -12.983 1.00 0.00 O ATOM 2183 CB GLU B 28 -0.556 26.229 -13.676 1.00 0.00 C ATOM 2184 CG GLU B 28 -0.820 24.769 -14.053 1.00 0.00 C ATOM 2185 CD GLU B 28 -2.055 24.691 -14.956 1.00 0.00 C ATOM 2186 OE1 GLU B 28 -2.722 25.701 -15.102 1.00 0.00 O ATOM 2187 OE2 GLU B 28 -2.310 23.622 -15.482 1.00 0.00 O ATOM 0 H GLU B 28 -0.060 24.817 -11.649 1.00 0.00 H new ATOM 0 HA GLU B 28 1.573 26.041 -13.583 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -1.373 26.610 -13.064 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -0.517 26.845 -14.574 1.00 0.00 H new ATOM 0 HG2 GLU B 28 0.046 24.352 -14.567 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -0.975 24.172 -13.154 1.00 0.00 H new ATOM 2194 N ASN B 29 0.335 28.095 -11.320 1.00 0.00 N ATOM 2195 CA ASN B 29 0.514 29.448 -10.736 1.00 0.00 C ATOM 2196 C ASN B 29 1.980 29.583 -10.312 1.00 0.00 C ATOM 2197 O ASN B 29 2.628 30.579 -10.571 1.00 0.00 O ATOM 2198 CB ASN B 29 -0.422 29.583 -9.527 1.00 0.00 C ATOM 2199 CG ASN B 29 0.277 29.104 -8.255 1.00 0.00 C ATOM 2200 OD1 ASN B 29 1.327 29.599 -7.899 1.00 0.00 O ATOM 2201 ND2 ASN B 29 -0.275 28.160 -7.544 1.00 0.00 N ATOM 0 H ASN B 29 -0.300 27.484 -10.807 1.00 0.00 H new ATOM 0 HA ASN B 29 0.272 30.233 -11.452 1.00 0.00 H new ATOM 0 HB2 ASN B 29 -0.729 30.622 -9.411 1.00 0.00 H new ATOM 0 HB3 ASN B 29 -1.328 29.000 -9.693 1.00 0.00 H new ATOM 0 HD21 ASN B 29 0.175 27.837 -6.688 1.00 0.00 H new ATOM 0 HD22 ASN B 29 -1.157 27.745 -7.844 1.00 0.00 H new ATOM 2208 N LEU B 30 2.509 28.563 -9.684 1.00 0.00 N ATOM 2209 CA LEU B 30 3.946 28.577 -9.279 1.00 0.00 C ATOM 2210 C LEU B 30 4.785 29.035 -10.473 1.00 0.00 C ATOM 2211 O LEU B 30 5.630 29.898 -10.360 1.00 0.00 O ATOM 2212 CB LEU B 30 4.352 27.152 -8.876 1.00 0.00 C ATOM 2213 CG LEU B 30 5.583 27.165 -7.957 1.00 0.00 C ATOM 2214 CD1 LEU B 30 6.744 27.886 -8.642 1.00 0.00 C ATOM 2215 CD2 LEU B 30 5.249 27.871 -6.642 1.00 0.00 C ATOM 0 H LEU B 30 2.002 27.715 -9.433 1.00 0.00 H new ATOM 0 HA LEU B 30 4.105 29.255 -8.440 1.00 0.00 H new ATOM 0 HB2 LEU B 30 3.520 26.664 -8.368 1.00 0.00 H new ATOM 0 HB3 LEU B 30 4.568 26.566 -9.769 1.00 0.00 H new ATOM 0 HG LEU B 30 5.873 26.135 -7.749 1.00 0.00 H new ATOM 0 HD11 LEU B 30 7.611 27.889 -7.981 1.00 0.00 H new ATOM 0 HD12 LEU B 30 6.996 27.371 -9.569 1.00 0.00 H new ATOM 0 HD13 LEU B 30 6.454 28.913 -8.865 1.00 0.00 H new ATOM 0 HD21 LEU B 30 6.128 27.875 -5.998 1.00 0.00 H new ATOM 0 HD22 LEU B 30 4.945 28.897 -6.847 1.00 0.00 H new ATOM 0 HD23 LEU B 30 4.436 27.345 -6.143 1.00 0.00 H new ATOM 2227 N VAL B 31 4.545 28.463 -11.630 1.00 0.00 N ATOM 2228 CA VAL B 31 5.322 28.868 -12.842 1.00 0.00 C ATOM 2229 C VAL B 31 5.176 30.374 -13.040 1.00 0.00 C ATOM 2230 O VAL B 31 6.017 31.020 -13.632 1.00 0.00 O ATOM 2231 CB VAL B 31 4.782 28.135 -14.072 1.00 0.00 C ATOM 2232 CG1 VAL B 31 5.561 28.569 -15.315 1.00 0.00 C ATOM 2233 CG2 VAL B 31 4.945 26.630 -13.868 1.00 0.00 C ATOM 0 H VAL B 31 3.847 27.736 -11.786 1.00 0.00 H new ATOM 0 HA VAL B 31 6.373 28.611 -12.708 1.00 0.00 H new ATOM 0 HB VAL B 31 3.728 28.377 -14.208 1.00 0.00 H new ATOM 0 HG11 VAL B 31 5.174 28.045 -16.189 1.00 0.00 H new ATOM 0 HG12 VAL B 31 5.449 29.644 -15.458 1.00 0.00 H new ATOM 0 HG13 VAL B 31 6.616 28.328 -15.186 1.00 0.00 H new ATOM 0 HG21 VAL B 31 4.562 26.101 -14.741 1.00 0.00 H new ATOM 0 HG22 VAL B 31 6.001 26.393 -13.734 1.00 0.00 H new ATOM 0 HG23 VAL B 31 4.389 26.320 -12.983 1.00 0.00 H new ATOM 2243 N SER B 32 4.117 30.939 -12.533 1.00 0.00 N ATOM 2244 CA SER B 32 3.916 32.401 -12.685 1.00 0.00 C ATOM 2245 C SER B 32 5.245 33.107 -12.411 1.00 0.00 C ATOM 2246 O SER B 32 5.625 34.028 -13.103 1.00 0.00 O ATOM 2247 CB SER B 32 2.868 32.872 -11.674 1.00 0.00 C ATOM 2248 OG SER B 32 2.600 34.253 -11.880 1.00 0.00 O ATOM 0 H SER B 32 3.383 30.450 -12.020 1.00 0.00 H new ATOM 0 HA SER B 32 3.574 32.632 -13.694 1.00 0.00 H new ATOM 0 HB2 SER B 32 1.952 32.292 -11.786 1.00 0.00 H new ATOM 0 HB3 SER B 32 3.227 32.708 -10.658 1.00 0.00 H new ATOM 0 HG SER B 32 1.928 34.556 -11.234 1.00 0.00 H new ATOM 2254 N GLN B 33 5.943 32.690 -11.388 1.00 0.00 N ATOM 2255 CA GLN B 33 7.250 33.326 -11.062 1.00 0.00 C ATOM 2256 C GLN B 33 8.412 32.636 -11.799 1.00 0.00 C ATOM 2257 O GLN B 33 9.523 33.121 -11.773 1.00 0.00 O ATOM 2258 CB GLN B 33 7.484 33.231 -9.551 1.00 0.00 C ATOM 2259 CG GLN B 33 7.983 31.827 -9.193 1.00 0.00 C ATOM 2260 CD GLN B 33 7.730 31.553 -7.710 1.00 0.00 C ATOM 2261 OE1 GLN B 33 7.272 32.418 -6.991 1.00 0.00 O ATOM 2262 NE2 GLN B 33 8.015 30.378 -7.219 1.00 0.00 N ATOM 0 H GLN B 33 5.662 31.934 -10.763 1.00 0.00 H new ATOM 0 HA GLN B 33 7.216 34.367 -11.383 1.00 0.00 H new ATOM 0 HB2 GLN B 33 8.214 33.978 -9.239 1.00 0.00 H new ATOM 0 HB3 GLN B 33 6.559 33.446 -9.016 1.00 0.00 H new ATOM 0 HG2 GLN B 33 7.472 31.082 -9.803 1.00 0.00 H new ATOM 0 HG3 GLN B 33 9.047 31.742 -9.412 1.00 0.00 H new ATOM 0 HE21 GLN B 33 8.400 29.652 -7.824 1.00 0.00 H new ATOM 0 HE22 GLN B 33 7.853 30.185 -6.231 1.00 0.00 H new ATOM 2271 N ILE B 34 8.203 31.509 -12.437 1.00 0.00 N ATOM 2272 CA ILE B 34 9.354 30.868 -13.148 1.00 0.00 C ATOM 2273 C ILE B 34 9.404 31.319 -14.603 1.00 0.00 C ATOM 2274 O ILE B 34 9.903 30.613 -15.456 1.00 0.00 O ATOM 2275 CB ILE B 34 9.278 29.345 -13.104 1.00 0.00 C ATOM 2276 CG1 ILE B 34 9.165 28.872 -11.656 1.00 0.00 C ATOM 2277 CG2 ILE B 34 10.560 28.772 -13.718 1.00 0.00 C ATOM 2278 CD1 ILE B 34 8.940 27.358 -11.636 1.00 0.00 C ATOM 0 H ILE B 34 7.312 31.017 -12.496 1.00 0.00 H new ATOM 0 HA ILE B 34 10.259 31.184 -12.629 1.00 0.00 H new ATOM 0 HB ILE B 34 8.405 29.007 -13.661 1.00 0.00 H new ATOM 0 HG12 ILE B 34 10.072 29.124 -11.107 1.00 0.00 H new ATOM 0 HG13 ILE B 34 8.340 29.381 -11.158 1.00 0.00 H new ATOM 0 HG21 ILE B 34 10.520 27.683 -13.693 1.00 0.00 H new ATOM 0 HG22 ILE B 34 10.651 29.109 -14.751 1.00 0.00 H new ATOM 0 HG23 ILE B 34 11.422 29.116 -13.147 1.00 0.00 H new ATOM 0 HD11 ILE B 34 8.859 27.016 -10.604 1.00 0.00 H new ATOM 0 HD12 ILE B 34 8.021 27.120 -12.171 1.00 0.00 H new ATOM 0 HD13 ILE B 34 9.780 26.859 -12.119 1.00 0.00 H new ATOM 2290 N ASP B 35 8.939 32.496 -14.904 1.00 0.00 N ATOM 2291 CA ASP B 35 9.030 32.947 -16.311 1.00 0.00 C ATOM 2292 C ASP B 35 10.515 32.943 -16.640 1.00 0.00 C ATOM 2293 O ASP B 35 10.935 33.117 -17.767 1.00 0.00 O ATOM 2294 CB ASP B 35 8.466 34.363 -16.441 1.00 0.00 C ATOM 2295 CG ASP B 35 6.961 34.344 -16.177 1.00 0.00 C ATOM 2296 OD1 ASP B 35 6.396 33.262 -16.152 1.00 0.00 O ATOM 2297 OD2 ASP B 35 6.394 35.412 -16.013 1.00 0.00 O ATOM 0 H ASP B 35 8.509 33.151 -14.251 1.00 0.00 H new ATOM 0 HA ASP B 35 8.463 32.305 -16.985 1.00 0.00 H new ATOM 0 HB2 ASP B 35 8.961 35.028 -15.733 1.00 0.00 H new ATOM 0 HB3 ASP B 35 8.665 34.754 -17.439 1.00 0.00 H new ATOM 2302 N THR B 36 11.308 32.727 -15.624 1.00 0.00 N ATOM 2303 CA THR B 36 12.777 32.690 -15.789 1.00 0.00 C ATOM 2304 C THR B 36 13.152 31.463 -16.615 1.00 0.00 C ATOM 2305 O THR B 36 14.276 31.311 -17.048 1.00 0.00 O ATOM 2306 CB THR B 36 13.430 32.593 -14.404 1.00 0.00 C ATOM 2307 OG1 THR B 36 13.027 31.381 -13.773 1.00 0.00 O ATOM 2308 CG2 THR B 36 12.987 33.783 -13.552 1.00 0.00 C ATOM 0 H THR B 36 10.985 32.572 -14.669 1.00 0.00 H new ATOM 0 HA THR B 36 13.122 33.592 -16.295 1.00 0.00 H new ATOM 0 HB THR B 36 14.515 32.603 -14.510 1.00 0.00 H new ATOM 0 HG1 THR B 36 13.324 31.384 -12.839 1.00 0.00 H new ATOM 0 HG21 THR B 36 13.449 33.717 -12.567 1.00 0.00 H new ATOM 0 HG22 THR B 36 13.293 34.711 -14.035 1.00 0.00 H new ATOM 0 HG23 THR B 36 11.902 33.770 -13.445 1.00 0.00 H new ATOM 2316 N VAL B 37 12.218 30.584 -16.847 1.00 0.00 N ATOM 2317 CA VAL B 37 12.535 29.374 -17.651 1.00 0.00 C ATOM 2318 C VAL B 37 13.964 28.929 -17.346 1.00 0.00 C ATOM 2319 O VAL B 37 14.671 28.438 -18.202 1.00 0.00 O ATOM 2320 CB VAL B 37 12.425 29.701 -19.135 1.00 0.00 C ATOM 2321 CG1 VAL B 37 11.003 30.153 -19.467 1.00 0.00 C ATOM 2322 CG2 VAL B 37 13.409 30.820 -19.476 1.00 0.00 C ATOM 0 H VAL B 37 11.255 30.651 -16.517 1.00 0.00 H new ATOM 0 HA VAL B 37 11.833 28.579 -17.399 1.00 0.00 H new ATOM 0 HB VAL B 37 12.660 28.811 -19.719 1.00 0.00 H new ATOM 0 HG11 VAL B 37 10.934 30.385 -20.530 1.00 0.00 H new ATOM 0 HG12 VAL B 37 10.301 29.355 -19.223 1.00 0.00 H new ATOM 0 HG13 VAL B 37 10.759 31.042 -18.885 1.00 0.00 H new ATOM 0 HG21 VAL B 37 13.335 31.059 -20.537 1.00 0.00 H new ATOM 0 HG22 VAL B 37 13.171 31.706 -18.887 1.00 0.00 H new ATOM 0 HG23 VAL B 37 14.424 30.494 -19.247 1.00 0.00 H new ATOM 2332 N LYS B 38 14.385 29.091 -16.127 1.00 0.00 N ATOM 2333 CA LYS B 38 15.752 28.661 -15.741 1.00 0.00 C ATOM 2334 C LYS B 38 15.613 27.588 -14.671 1.00 0.00 C ATOM 2335 O LYS B 38 16.299 27.590 -13.670 1.00 0.00 O ATOM 2336 CB LYS B 38 16.544 29.846 -15.184 1.00 0.00 C ATOM 2337 CG LYS B 38 17.226 30.590 -16.328 1.00 0.00 C ATOM 2338 CD LYS B 38 17.947 31.823 -15.778 1.00 0.00 C ATOM 2339 CE LYS B 38 18.314 32.754 -16.934 1.00 0.00 C ATOM 2340 NZ LYS B 38 19.201 33.841 -16.432 1.00 0.00 N ATOM 0 H LYS B 38 13.835 29.507 -15.375 1.00 0.00 H new ATOM 0 HA LYS B 38 16.285 28.275 -16.610 1.00 0.00 H new ATOM 0 HB2 LYS B 38 15.878 30.520 -14.645 1.00 0.00 H new ATOM 0 HB3 LYS B 38 17.289 29.495 -14.470 1.00 0.00 H new ATOM 0 HG2 LYS B 38 17.937 29.934 -16.830 1.00 0.00 H new ATOM 0 HG3 LYS B 38 16.488 30.889 -17.072 1.00 0.00 H new ATOM 0 HD2 LYS B 38 17.308 32.344 -15.066 1.00 0.00 H new ATOM 0 HD3 LYS B 38 18.846 31.522 -15.239 1.00 0.00 H new ATOM 0 HE2 LYS B 38 18.818 32.193 -17.721 1.00 0.00 H new ATOM 0 HE3 LYS B 38 17.412 33.180 -17.373 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 19.451 34.475 -17.217 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 18.705 34.382 -15.695 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 20.067 33.426 -16.033 1.00 0.00 H new ATOM 2354 N SER B 39 14.708 26.675 -14.878 1.00 0.00 N ATOM 2355 CA SER B 39 14.474 25.612 -13.871 1.00 0.00 C ATOM 2356 C SER B 39 13.428 24.629 -14.413 1.00 0.00 C ATOM 2357 O SER B 39 12.929 24.803 -15.508 1.00 0.00 O ATOM 2358 CB SER B 39 13.980 26.264 -12.588 1.00 0.00 C ATOM 2359 OG SER B 39 13.484 25.270 -11.707 1.00 0.00 O ATOM 0 H SER B 39 14.118 26.621 -15.708 1.00 0.00 H new ATOM 0 HA SER B 39 15.394 25.065 -13.666 1.00 0.00 H new ATOM 0 HB2 SER B 39 14.792 26.813 -12.112 1.00 0.00 H new ATOM 0 HB3 SER B 39 13.196 26.987 -12.814 1.00 0.00 H new ATOM 0 HG SER B 39 14.235 24.805 -11.282 1.00 0.00 H new ATOM 2365 N PHE B 40 13.108 23.585 -13.696 1.00 0.00 N ATOM 2366 CA PHE B 40 12.093 22.633 -14.230 1.00 0.00 C ATOM 2367 C PHE B 40 11.270 21.987 -13.114 1.00 0.00 C ATOM 2368 O PHE B 40 11.698 21.877 -11.982 1.00 0.00 O ATOM 2369 CB PHE B 40 12.828 21.538 -15.009 1.00 0.00 C ATOM 2370 CG PHE B 40 11.860 20.857 -15.935 1.00 0.00 C ATOM 2371 CD1 PHE B 40 11.437 21.504 -17.098 1.00 0.00 C ATOM 2372 CD2 PHE B 40 11.390 19.577 -15.631 1.00 0.00 C ATOM 2373 CE1 PHE B 40 10.536 20.871 -17.959 1.00 0.00 C ATOM 2374 CE2 PHE B 40 10.490 18.942 -16.490 1.00 0.00 C ATOM 2375 CZ PHE B 40 10.061 19.588 -17.656 1.00 0.00 C ATOM 0 H PHE B 40 13.497 23.353 -12.782 1.00 0.00 H new ATOM 0 HA PHE B 40 11.404 23.184 -14.870 1.00 0.00 H new ATOM 0 HB2 PHE B 40 13.652 21.970 -15.578 1.00 0.00 H new ATOM 0 HB3 PHE B 40 13.262 20.813 -14.320 1.00 0.00 H new ATOM 0 HD1 PHE B 40 11.805 22.492 -17.332 1.00 0.00 H new ATOM 0 HD2 PHE B 40 11.722 19.079 -14.732 1.00 0.00 H new ATOM 0 HE1 PHE B 40 10.206 21.371 -18.858 1.00 0.00 H new ATOM 0 HE2 PHE B 40 10.125 17.953 -16.255 1.00 0.00 H new ATOM 0 HZ PHE B 40 9.365 19.098 -18.321 1.00 0.00 H new ATOM 2385 N GLU B 41 10.081 21.540 -13.453 1.00 0.00 N ATOM 2386 CA GLU B 41 9.174 20.916 -12.442 1.00 0.00 C ATOM 2387 C GLU B 41 8.202 19.938 -13.129 1.00 0.00 C ATOM 2388 O GLU B 41 7.468 20.302 -14.027 1.00 0.00 O ATOM 2389 CB GLU B 41 8.367 22.000 -11.748 1.00 0.00 C ATOM 2390 CG GLU B 41 9.301 23.100 -11.246 1.00 0.00 C ATOM 2391 CD GLU B 41 8.519 24.072 -10.362 1.00 0.00 C ATOM 2392 OE1 GLU B 41 7.303 23.995 -10.362 1.00 0.00 O ATOM 2393 OE2 GLU B 41 9.153 24.878 -9.697 1.00 0.00 O ATOM 0 H GLU B 41 9.700 21.583 -14.398 1.00 0.00 H new ATOM 0 HA GLU B 41 9.780 20.375 -11.716 1.00 0.00 H new ATOM 0 HB2 GLU B 41 7.635 22.419 -12.438 1.00 0.00 H new ATOM 0 HB3 GLU B 41 7.811 21.574 -10.913 1.00 0.00 H new ATOM 0 HG2 GLU B 41 10.125 22.662 -10.682 1.00 0.00 H new ATOM 0 HG3 GLU B 41 9.739 23.632 -12.090 1.00 0.00 H new ATOM 2400 N TRP B 42 8.179 18.704 -12.697 1.00 0.00 N ATOM 2401 CA TRP B 42 7.213 17.720 -13.272 1.00 0.00 C ATOM 2402 C TRP B 42 6.453 17.081 -12.117 1.00 0.00 C ATOM 2403 O TRP B 42 6.815 17.255 -10.971 1.00 0.00 O ATOM 2404 CB TRP B 42 7.983 16.647 -14.052 1.00 0.00 C ATOM 2405 CG TRP B 42 8.462 15.575 -13.122 1.00 0.00 C ATOM 2406 CD1 TRP B 42 8.942 15.790 -11.876 1.00 0.00 C ATOM 2407 CD2 TRP B 42 8.535 14.135 -13.344 1.00 0.00 C ATOM 2408 NE1 TRP B 42 9.284 14.575 -11.309 1.00 0.00 N ATOM 2409 CE2 TRP B 42 9.054 13.525 -12.176 1.00 0.00 C ATOM 2410 CE3 TRP B 42 8.202 13.306 -14.430 1.00 0.00 C ATOM 2411 CZ2 TRP B 42 9.235 12.143 -12.089 1.00 0.00 C ATOM 2412 CZ3 TRP B 42 8.381 11.915 -14.346 1.00 0.00 C ATOM 2413 CH2 TRP B 42 8.898 11.335 -13.178 1.00 0.00 C ATOM 0 H TRP B 42 8.789 18.334 -11.968 1.00 0.00 H new ATOM 0 HA TRP B 42 6.518 18.213 -13.951 1.00 0.00 H new ATOM 0 HB2 TRP B 42 7.341 16.213 -14.819 1.00 0.00 H new ATOM 0 HB3 TRP B 42 8.832 17.099 -14.565 1.00 0.00 H new ATOM 0 HD1 TRP B 42 9.042 16.754 -11.400 1.00 0.00 H new ATOM 0 HE1 TRP B 42 9.660 14.468 -10.367 1.00 0.00 H new ATOM 0 HE3 TRP B 42 7.806 13.742 -15.335 1.00 0.00 H new ATOM 0 HZ2 TRP B 42 9.632 11.702 -11.187 1.00 0.00 H new ATOM 0 HZ3 TRP B 42 8.119 11.288 -15.186 1.00 0.00 H new ATOM 0 HH2 TRP B 42 9.035 10.265 -13.121 1.00 0.00 H new ATOM 2424 N GLY B 43 5.405 16.350 -12.379 1.00 0.00 N ATOM 2425 CA GLY B 43 4.653 15.733 -11.239 1.00 0.00 C ATOM 2426 C GLY B 43 3.956 14.446 -11.683 1.00 0.00 C ATOM 2427 O GLY B 43 3.379 14.373 -12.749 1.00 0.00 O ATOM 0 H GLY B 43 5.039 16.153 -13.310 1.00 0.00 H new ATOM 0 HA2 GLY B 43 5.338 15.517 -10.420 1.00 0.00 H new ATOM 0 HA3 GLY B 43 3.915 16.439 -10.859 1.00 0.00 H new ATOM 2431 N GLU B 44 3.994 13.431 -10.863 1.00 0.00 N ATOM 2432 CA GLU B 44 3.318 12.156 -11.224 1.00 0.00 C ATOM 2433 C GLU B 44 2.338 11.772 -10.122 1.00 0.00 C ATOM 2434 O GLU B 44 2.298 12.375 -9.071 1.00 0.00 O ATOM 2435 CB GLU B 44 4.350 11.032 -11.378 1.00 0.00 C ATOM 2436 CG GLU B 44 5.509 11.498 -12.259 1.00 0.00 C ATOM 2437 CD GLU B 44 6.396 12.450 -11.456 1.00 0.00 C ATOM 2438 OE1 GLU B 44 6.979 12.005 -10.482 1.00 0.00 O ATOM 2439 OE2 GLU B 44 6.473 13.610 -11.829 1.00 0.00 O ATOM 0 H GLU B 44 4.465 13.431 -9.958 1.00 0.00 H new ATOM 0 HA GLU B 44 2.790 12.295 -12.167 1.00 0.00 H new ATOM 0 HB2 GLU B 44 4.725 10.735 -10.398 1.00 0.00 H new ATOM 0 HB3 GLU B 44 3.879 10.153 -11.819 1.00 0.00 H new ATOM 0 HG2 GLU B 44 6.090 10.641 -12.601 1.00 0.00 H new ATOM 0 HG3 GLU B 44 5.127 12.000 -13.148 1.00 0.00 H new ATOM 2446 N ASP B 45 1.572 10.751 -10.360 1.00 0.00 N ATOM 2447 CA ASP B 45 0.608 10.253 -9.342 1.00 0.00 C ATOM 2448 C ASP B 45 0.111 8.895 -9.836 1.00 0.00 C ATOM 2449 O ASP B 45 -0.811 8.832 -10.626 1.00 0.00 O ATOM 2450 CB ASP B 45 -0.555 11.235 -9.189 1.00 0.00 C ATOM 2451 CG ASP B 45 -1.539 10.712 -8.143 1.00 0.00 C ATOM 2452 OD1 ASP B 45 -1.423 9.551 -7.781 1.00 0.00 O ATOM 2453 OD2 ASP B 45 -2.392 11.474 -7.720 1.00 0.00 O ATOM 0 H ASP B 45 1.572 10.228 -11.236 1.00 0.00 H new ATOM 0 HA ASP B 45 1.080 10.158 -8.364 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -0.180 12.214 -8.891 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -1.062 11.365 -10.145 1.00 0.00 H new ATOM 2458 N LYS B 46 0.697 7.810 -9.418 1.00 0.00 N ATOM 2459 CA LYS B 46 0.187 6.493 -9.894 1.00 0.00 C ATOM 2460 C LYS B 46 -0.909 5.991 -8.954 1.00 0.00 C ATOM 2461 O LYS B 46 -1.138 6.551 -7.900 1.00 0.00 O ATOM 2462 CB LYS B 46 1.322 5.473 -9.959 1.00 0.00 C ATOM 2463 CG LYS B 46 2.203 5.620 -8.715 1.00 0.00 C ATOM 2464 CD LYS B 46 1.402 5.220 -7.476 1.00 0.00 C ATOM 2465 CE LYS B 46 2.361 4.793 -6.362 1.00 0.00 C ATOM 2466 NZ LYS B 46 3.356 3.824 -6.906 1.00 0.00 N ATOM 0 H LYS B 46 1.492 7.775 -8.780 1.00 0.00 H new ATOM 0 HA LYS B 46 -0.226 6.619 -10.895 1.00 0.00 H new ATOM 0 HB2 LYS B 46 0.916 4.463 -10.015 1.00 0.00 H new ATOM 0 HB3 LYS B 46 1.915 5.628 -10.860 1.00 0.00 H new ATOM 0 HG2 LYS B 46 3.089 4.992 -8.807 1.00 0.00 H new ATOM 0 HG3 LYS B 46 2.550 6.649 -8.621 1.00 0.00 H new ATOM 0 HD2 LYS B 46 0.789 6.056 -7.141 1.00 0.00 H new ATOM 0 HD3 LYS B 46 0.722 4.403 -7.718 1.00 0.00 H new ATOM 0 HE2 LYS B 46 2.872 5.665 -5.954 1.00 0.00 H new ATOM 0 HE3 LYS B 46 1.804 4.338 -5.543 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 3.943 3.456 -6.130 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 2.857 3.036 -7.366 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 3.963 4.303 -7.602 1.00 0.00 H new ATOM 2480 N GLU B 47 -1.586 4.941 -9.335 1.00 0.00 N ATOM 2481 CA GLU B 47 -2.640 4.357 -8.454 1.00 0.00 C ATOM 2482 C GLU B 47 -3.135 3.041 -9.061 1.00 0.00 C ATOM 2483 O GLU B 47 -4.062 3.018 -9.844 1.00 0.00 O ATOM 2484 CB GLU B 47 -3.817 5.335 -8.314 1.00 0.00 C ATOM 2485 CG GLU B 47 -3.899 5.846 -6.874 1.00 0.00 C ATOM 2486 CD GLU B 47 -5.141 6.726 -6.715 1.00 0.00 C ATOM 2487 OE1 GLU B 47 -5.798 6.978 -7.711 1.00 0.00 O ATOM 2488 OE2 GLU B 47 -5.417 7.132 -5.597 1.00 0.00 O ATOM 0 H GLU B 47 -1.454 4.459 -10.224 1.00 0.00 H new ATOM 0 HA GLU B 47 -2.218 4.171 -7.466 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -3.689 6.172 -9.000 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -4.748 4.839 -8.587 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -3.944 5.006 -6.181 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -3.003 6.415 -6.627 1.00 0.00 H new ATOM 2495 N SER B 48 -2.519 1.941 -8.708 1.00 0.00 N ATOM 2496 CA SER B 48 -2.951 0.628 -9.272 1.00 0.00 C ATOM 2497 C SER B 48 -1.860 -0.426 -9.051 1.00 0.00 C ATOM 2498 O SER B 48 -0.684 -0.123 -9.050 1.00 0.00 O ATOM 2499 CB SER B 48 -3.206 0.783 -10.773 1.00 0.00 C ATOM 2500 OG SER B 48 -2.878 -0.434 -11.431 1.00 0.00 O ATOM 0 H SER B 48 -1.737 1.896 -8.055 1.00 0.00 H new ATOM 0 HA SER B 48 -3.864 0.307 -8.770 1.00 0.00 H new ATOM 0 HB2 SER B 48 -4.251 1.037 -10.952 1.00 0.00 H new ATOM 0 HB3 SER B 48 -2.606 1.600 -11.174 1.00 0.00 H new ATOM 0 HG SER B 48 -3.041 -0.340 -12.393 1.00 0.00 H new ATOM 2506 N HIS B 49 -2.238 -1.664 -8.876 1.00 0.00 N ATOM 2507 CA HIS B 49 -1.220 -2.744 -8.710 1.00 0.00 C ATOM 2508 C HIS B 49 -0.318 -2.423 -7.518 1.00 0.00 C ATOM 2509 O HIS B 49 0.429 -1.465 -7.532 1.00 0.00 O ATOM 2510 CB HIS B 49 -0.378 -2.856 -9.984 1.00 0.00 C ATOM 2511 CG HIS B 49 -1.266 -3.217 -11.144 1.00 0.00 C ATOM 2512 ND1 HIS B 49 -0.863 -3.057 -12.462 1.00 0.00 N ATOM 2513 CD2 HIS B 49 -2.540 -3.732 -11.201 1.00 0.00 C ATOM 2514 CE1 HIS B 49 -1.874 -3.468 -13.250 1.00 0.00 C ATOM 2515 NE2 HIS B 49 -2.916 -3.887 -12.530 1.00 0.00 N ATOM 0 H HIS B 49 -3.209 -1.975 -8.841 1.00 0.00 H new ATOM 0 HA HIS B 49 -1.725 -3.693 -8.530 1.00 0.00 H new ATOM 0 HB2 HIS B 49 0.129 -1.912 -10.181 1.00 0.00 H new ATOM 0 HB3 HIS B 49 0.396 -3.613 -9.856 1.00 0.00 H new ATOM 0 HD2 HIS B 49 -3.153 -3.978 -10.346 1.00 0.00 H new ATOM 0 HE1 HIS B 49 -1.845 -3.460 -14.330 1.00 0.00 H new ATOM 0 HE2 HIS B 49 -3.804 -4.246 -12.882 1.00 0.00 H new ATOM 2524 N ASP B 50 -0.390 -3.213 -6.483 1.00 0.00 N ATOM 2525 CA ASP B 50 0.470 -2.970 -5.287 1.00 0.00 C ATOM 2526 C ASP B 50 1.945 -2.846 -5.693 1.00 0.00 C ATOM 2527 O ASP B 50 2.660 -1.995 -5.205 1.00 0.00 O ATOM 2528 CB ASP B 50 0.315 -4.133 -4.308 1.00 0.00 C ATOM 2529 CG ASP B 50 0.840 -5.421 -4.948 1.00 0.00 C ATOM 2530 OD1 ASP B 50 0.853 -5.488 -6.167 1.00 0.00 O ATOM 2531 OD2 ASP B 50 1.218 -6.316 -4.213 1.00 0.00 O ATOM 0 H ASP B 50 -1.010 -4.020 -6.412 1.00 0.00 H new ATOM 0 HA ASP B 50 0.156 -2.038 -4.817 1.00 0.00 H new ATOM 0 HB2 ASP B 50 0.863 -3.923 -3.389 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -0.733 -4.253 -4.034 1.00 0.00 H new ATOM 2536 N MET B 51 2.412 -3.701 -6.562 1.00 0.00 N ATOM 2537 CA MET B 51 3.839 -3.624 -6.991 1.00 0.00 C ATOM 2538 C MET B 51 4.124 -2.289 -7.692 1.00 0.00 C ATOM 2539 O MET B 51 5.198 -1.735 -7.560 1.00 0.00 O ATOM 2540 CB MET B 51 4.156 -4.780 -7.939 1.00 0.00 C ATOM 2541 CG MET B 51 5.660 -4.818 -8.210 1.00 0.00 C ATOM 2542 SD MET B 51 6.029 -6.143 -9.385 1.00 0.00 S ATOM 2543 CE MET B 51 7.833 -6.055 -9.270 1.00 0.00 C ATOM 0 H MET B 51 1.868 -4.449 -6.993 1.00 0.00 H new ATOM 0 HA MET B 51 4.471 -3.693 -6.105 1.00 0.00 H new ATOM 0 HB2 MET B 51 3.831 -5.724 -7.501 1.00 0.00 H new ATOM 0 HB3 MET B 51 3.610 -4.658 -8.874 1.00 0.00 H new ATOM 0 HG2 MET B 51 5.992 -3.860 -8.610 1.00 0.00 H new ATOM 0 HG3 MET B 51 6.204 -4.981 -7.280 1.00 0.00 H new ATOM 0 HE1 MET B 51 8.272 -6.324 -10.231 1.00 0.00 H new ATOM 0 HE2 MET B 51 8.132 -5.041 -9.005 1.00 0.00 H new ATOM 0 HE3 MET B 51 8.183 -6.748 -8.505 1.00 0.00 H new ATOM 2553 N LEU B 52 3.187 -1.760 -8.432 1.00 0.00 N ATOM 2554 CA LEU B 52 3.421 -0.433 -9.074 1.00 0.00 C ATOM 2555 C LEU B 52 2.975 0.680 -8.117 1.00 0.00 C ATOM 2556 O LEU B 52 3.362 1.823 -8.252 1.00 0.00 O ATOM 2557 CB LEU B 52 2.613 -0.328 -10.372 1.00 0.00 C ATOM 2558 CG LEU B 52 2.725 -1.633 -11.169 1.00 0.00 C ATOM 2559 CD1 LEU B 52 1.897 -1.519 -12.451 1.00 0.00 C ATOM 2560 CD2 LEU B 52 4.190 -1.884 -11.539 1.00 0.00 C ATOM 0 H LEU B 52 2.278 -2.184 -8.619 1.00 0.00 H new ATOM 0 HA LEU B 52 4.482 -0.330 -9.299 1.00 0.00 H new ATOM 0 HB2 LEU B 52 1.568 -0.121 -10.143 1.00 0.00 H new ATOM 0 HB3 LEU B 52 2.979 0.506 -10.971 1.00 0.00 H new ATOM 0 HG LEU B 52 2.354 -2.459 -10.562 1.00 0.00 H new ATOM 0 HD11 LEU B 52 1.976 -2.446 -13.019 1.00 0.00 H new ATOM 0 HD12 LEU B 52 0.853 -1.338 -12.195 1.00 0.00 H new ATOM 0 HD13 LEU B 52 2.272 -0.692 -13.054 1.00 0.00 H new ATOM 0 HD21 LEU B 52 4.268 -2.812 -12.105 1.00 0.00 H new ATOM 0 HD22 LEU B 52 4.559 -1.057 -12.145 1.00 0.00 H new ATOM 0 HD23 LEU B 52 4.787 -1.962 -10.630 1.00 0.00 H new ATOM 2572 N ARG B 53 2.145 0.352 -7.163 1.00 0.00 N ATOM 2573 CA ARG B 53 1.671 1.373 -6.182 1.00 0.00 C ATOM 2574 C ARG B 53 2.677 1.550 -5.035 1.00 0.00 C ATOM 2575 O ARG B 53 2.304 1.635 -3.883 1.00 0.00 O ATOM 2576 CB ARG B 53 0.328 0.919 -5.609 1.00 0.00 C ATOM 2577 CG ARG B 53 -0.404 2.119 -4.998 1.00 0.00 C ATOM 2578 CD ARG B 53 -1.718 1.643 -4.384 1.00 0.00 C ATOM 2579 NE ARG B 53 -2.550 2.828 -4.016 1.00 0.00 N ATOM 2580 CZ ARG B 53 -2.130 3.686 -3.131 1.00 0.00 C ATOM 2581 NH1 ARG B 53 -1.024 3.459 -2.484 1.00 0.00 N ATOM 2582 NH2 ARG B 53 -2.810 4.779 -2.904 1.00 0.00 N ATOM 0 H ARG B 53 1.772 -0.586 -7.020 1.00 0.00 H new ATOM 0 HA ARG B 53 1.567 2.329 -6.695 1.00 0.00 H new ATOM 0 HB2 ARG B 53 -0.281 0.471 -6.394 1.00 0.00 H new ATOM 0 HB3 ARG B 53 0.486 0.152 -4.851 1.00 0.00 H new ATOM 0 HG2 ARG B 53 0.217 2.591 -4.237 1.00 0.00 H new ATOM 0 HG3 ARG B 53 -0.597 2.871 -5.763 1.00 0.00 H new ATOM 0 HD2 ARG B 53 -2.256 1.012 -5.092 1.00 0.00 H new ATOM 0 HD3 ARG B 53 -1.521 1.035 -3.501 1.00 0.00 H new ATOM 0 HE ARG B 53 -3.457 2.966 -4.463 1.00 0.00 H new ATOM 0 HH11 ARG B 53 -0.489 2.611 -2.671 1.00 0.00 H new ATOM 0 HH12 ARG B 53 -0.692 4.129 -1.790 1.00 0.00 H new ATOM 0 HH21 ARG B 53 -3.671 4.961 -3.420 1.00 0.00 H new ATOM 0 HH22 ARG B 53 -2.480 5.450 -2.211 1.00 0.00 H new ATOM 2596 N GLN B 54 3.944 1.596 -5.332 1.00 0.00 N ATOM 2597 CA GLN B 54 4.953 1.834 -4.255 1.00 0.00 C ATOM 2598 C GLN B 54 4.356 2.725 -3.153 1.00 0.00 C ATOM 2599 O GLN B 54 4.890 2.834 -2.068 1.00 0.00 O ATOM 2600 CB GLN B 54 6.200 2.501 -4.849 1.00 0.00 C ATOM 2601 CG GLN B 54 7.379 2.319 -3.885 1.00 0.00 C ATOM 2602 CD GLN B 54 8.549 3.195 -4.334 1.00 0.00 C ATOM 2603 OE1 GLN B 54 8.391 4.383 -4.540 1.00 0.00 O ATOM 2604 NE2 GLN B 54 9.724 2.655 -4.496 1.00 0.00 N ATOM 0 H GLN B 54 4.328 1.480 -6.270 1.00 0.00 H new ATOM 0 HA GLN B 54 5.233 0.876 -3.817 1.00 0.00 H new ATOM 0 HB2 GLN B 54 6.436 2.060 -5.818 1.00 0.00 H new ATOM 0 HB3 GLN B 54 6.014 3.562 -5.018 1.00 0.00 H new ATOM 0 HG2 GLN B 54 7.078 2.587 -2.872 1.00 0.00 H new ATOM 0 HG3 GLN B 54 7.683 1.273 -3.860 1.00 0.00 H new ATOM 0 HE21 GLN B 54 9.856 1.658 -4.323 1.00 0.00 H new ATOM 0 HE22 GLN B 54 10.512 3.229 -4.796 1.00 0.00 H new ATOM 2613 N GLY B 55 3.230 3.329 -3.422 1.00 0.00 N ATOM 2614 CA GLY B 55 2.516 4.140 -2.385 1.00 0.00 C ATOM 2615 C GLY B 55 2.641 5.656 -2.621 1.00 0.00 C ATOM 2616 O GLY B 55 1.715 6.394 -2.348 1.00 0.00 O ATOM 0 H GLY B 55 2.765 3.296 -4.329 1.00 0.00 H new ATOM 0 HA2 GLY B 55 1.462 3.864 -2.378 1.00 0.00 H new ATOM 0 HA3 GLY B 55 2.916 3.896 -1.401 1.00 0.00 H new ATOM 2620 N PHE B 56 3.756 6.145 -3.096 1.00 0.00 N ATOM 2621 CA PHE B 56 3.868 7.625 -3.306 1.00 0.00 C ATOM 2622 C PHE B 56 2.722 8.116 -4.200 1.00 0.00 C ATOM 2623 O PHE B 56 2.736 7.933 -5.400 1.00 0.00 O ATOM 2624 CB PHE B 56 5.219 7.962 -3.946 1.00 0.00 C ATOM 2625 CG PHE B 56 5.042 8.160 -5.427 1.00 0.00 C ATOM 2626 CD1 PHE B 56 5.029 7.051 -6.278 1.00 0.00 C ATOM 2627 CD2 PHE B 56 4.894 9.449 -5.949 1.00 0.00 C ATOM 2628 CE1 PHE B 56 4.865 7.229 -7.655 1.00 0.00 C ATOM 2629 CE2 PHE B 56 4.729 9.629 -7.326 1.00 0.00 C ATOM 2630 CZ PHE B 56 4.716 8.520 -8.179 1.00 0.00 C ATOM 0 H PHE B 56 4.581 5.599 -3.345 1.00 0.00 H new ATOM 0 HA PHE B 56 3.801 8.127 -2.341 1.00 0.00 H new ATOM 0 HB2 PHE B 56 5.631 8.865 -3.495 1.00 0.00 H new ATOM 0 HB3 PHE B 56 5.932 7.159 -3.759 1.00 0.00 H new ATOM 0 HD1 PHE B 56 5.146 6.057 -5.872 1.00 0.00 H new ATOM 0 HD2 PHE B 56 4.907 10.304 -5.290 1.00 0.00 H new ATOM 0 HE1 PHE B 56 4.853 6.373 -8.314 1.00 0.00 H new ATOM 0 HE2 PHE B 56 4.612 10.623 -7.731 1.00 0.00 H new ATOM 0 HZ PHE B 56 4.591 8.659 -9.243 1.00 0.00 H new ATOM 2640 N THR B 57 1.721 8.729 -3.616 1.00 0.00 N ATOM 2641 CA THR B 57 0.551 9.203 -4.418 1.00 0.00 C ATOM 2642 C THR B 57 0.982 10.244 -5.456 1.00 0.00 C ATOM 2643 O THR B 57 0.430 10.316 -6.535 1.00 0.00 O ATOM 2644 CB THR B 57 -0.491 9.833 -3.488 1.00 0.00 C ATOM 2645 OG1 THR B 57 0.042 11.015 -2.909 1.00 0.00 O ATOM 2646 CG2 THR B 57 -0.860 8.844 -2.381 1.00 0.00 C ATOM 0 H THR B 57 1.664 8.922 -2.616 1.00 0.00 H new ATOM 0 HA THR B 57 0.125 8.343 -4.935 1.00 0.00 H new ATOM 0 HB THR B 57 -1.383 10.080 -4.063 1.00 0.00 H new ATOM 0 HG1 THR B 57 0.083 11.722 -3.587 1.00 0.00 H new ATOM 0 HG21 THR B 57 -1.601 9.296 -1.722 1.00 0.00 H new ATOM 0 HG22 THR B 57 -1.273 7.938 -2.825 1.00 0.00 H new ATOM 0 HG23 THR B 57 0.031 8.592 -1.806 1.00 0.00 H new ATOM 2654 N HIS B 58 1.945 11.069 -5.140 1.00 0.00 N ATOM 2655 CA HIS B 58 2.407 12.071 -6.143 1.00 0.00 C ATOM 2656 C HIS B 58 3.669 12.776 -5.641 1.00 0.00 C ATOM 2657 O HIS B 58 3.868 12.950 -4.456 1.00 0.00 O ATOM 2658 CB HIS B 58 1.308 13.117 -6.353 1.00 0.00 C ATOM 2659 CG HIS B 58 0.939 13.736 -5.029 1.00 0.00 C ATOM 2660 ND1 HIS B 58 0.261 13.028 -4.046 1.00 0.00 N ATOM 2661 CD2 HIS B 58 1.141 14.994 -4.512 1.00 0.00 C ATOM 2662 CE1 HIS B 58 0.078 13.856 -3.001 1.00 0.00 C ATOM 2663 NE2 HIS B 58 0.596 15.064 -3.235 1.00 0.00 N ATOM 0 H HIS B 58 2.427 11.093 -4.241 1.00 0.00 H new ATOM 0 HA HIS B 58 2.627 11.559 -7.080 1.00 0.00 H new ATOM 0 HB2 HIS B 58 1.652 13.888 -7.043 1.00 0.00 H new ATOM 0 HB3 HIS B 58 0.432 12.653 -6.806 1.00 0.00 H new ATOM 0 HD2 HIS B 58 1.645 15.803 -5.020 1.00 0.00 H new ATOM 0 HE1 HIS B 58 -0.425 13.578 -2.087 1.00 0.00 H new ATOM 0 HE2 HIS B 58 0.593 15.869 -2.609 1.00 0.00 H new ATOM 2672 N ALA B 59 4.512 13.199 -6.543 1.00 0.00 N ATOM 2673 CA ALA B 59 5.774 13.869 -6.130 1.00 0.00 C ATOM 2674 C ALA B 59 6.100 14.984 -7.121 1.00 0.00 C ATOM 2675 O ALA B 59 5.480 15.111 -8.158 1.00 0.00 O ATOM 2676 CB ALA B 59 6.923 12.860 -6.101 1.00 0.00 C ATOM 0 H ALA B 59 4.379 13.108 -7.550 1.00 0.00 H new ATOM 0 HA ALA B 59 5.646 14.287 -5.131 1.00 0.00 H new ATOM 0 HB1 ALA B 59 7.841 13.363 -5.797 1.00 0.00 H new ATOM 0 HB2 ALA B 59 6.692 12.066 -5.391 1.00 0.00 H new ATOM 0 HB3 ALA B 59 7.056 12.431 -7.094 1.00 0.00 H new ATOM 2682 N PHE B 60 7.072 15.791 -6.808 1.00 0.00 N ATOM 2683 CA PHE B 60 7.462 16.886 -7.732 1.00 0.00 C ATOM 2684 C PHE B 60 8.983 16.983 -7.778 1.00 0.00 C ATOM 2685 O PHE B 60 9.646 16.959 -6.759 1.00 0.00 O ATOM 2686 CB PHE B 60 6.893 18.212 -7.216 1.00 0.00 C ATOM 2687 CG PHE B 60 5.384 18.166 -7.237 1.00 0.00 C ATOM 2688 CD1 PHE B 60 4.698 18.270 -8.452 1.00 0.00 C ATOM 2689 CD2 PHE B 60 4.672 18.011 -6.040 1.00 0.00 C ATOM 2690 CE1 PHE B 60 3.299 18.220 -8.474 1.00 0.00 C ATOM 2691 CE2 PHE B 60 3.273 17.962 -6.061 1.00 0.00 C ATOM 2692 CZ PHE B 60 2.587 18.065 -7.278 1.00 0.00 C ATOM 0 H PHE B 60 7.616 15.738 -5.947 1.00 0.00 H new ATOM 0 HA PHE B 60 7.072 16.680 -8.729 1.00 0.00 H new ATOM 0 HB2 PHE B 60 7.246 18.399 -6.202 1.00 0.00 H new ATOM 0 HB3 PHE B 60 7.249 19.036 -7.834 1.00 0.00 H new ATOM 0 HD1 PHE B 60 5.248 18.389 -9.374 1.00 0.00 H new ATOM 0 HD2 PHE B 60 5.202 17.929 -5.102 1.00 0.00 H new ATOM 0 HE1 PHE B 60 2.770 18.301 -9.412 1.00 0.00 H new ATOM 0 HE2 PHE B 60 2.723 17.845 -5.139 1.00 0.00 H new ATOM 0 HZ PHE B 60 1.508 18.025 -7.294 1.00 0.00 H new ATOM 2702 N SER B 61 9.547 17.109 -8.943 1.00 0.00 N ATOM 2703 CA SER B 61 11.032 17.195 -9.045 1.00 0.00 C ATOM 2704 C SER B 61 11.395 18.615 -9.488 1.00 0.00 C ATOM 2705 O SER B 61 11.180 18.997 -10.621 1.00 0.00 O ATOM 2706 CB SER B 61 11.545 16.178 -10.059 1.00 0.00 C ATOM 2707 OG SER B 61 12.958 16.073 -9.937 1.00 0.00 O ATOM 0 H SER B 61 9.047 17.156 -9.831 1.00 0.00 H new ATOM 0 HA SER B 61 11.492 16.974 -8.082 1.00 0.00 H new ATOM 0 HB2 SER B 61 11.079 15.208 -9.887 1.00 0.00 H new ATOM 0 HB3 SER B 61 11.276 16.486 -11.070 1.00 0.00 H new ATOM 0 HG SER B 61 13.306 15.499 -10.651 1.00 0.00 H new ATOM 2713 N MET B 62 11.906 19.413 -8.593 1.00 0.00 N ATOM 2714 CA MET B 62 12.302 20.792 -8.972 1.00 0.00 C ATOM 2715 C MET B 62 13.782 20.856 -9.308 1.00 0.00 C ATOM 2716 O MET B 62 14.635 20.582 -8.487 1.00 0.00 O ATOM 2717 CB MET B 62 12.003 21.743 -7.809 1.00 0.00 C ATOM 2718 CG MET B 62 10.493 21.809 -7.578 1.00 0.00 C ATOM 2719 SD MET B 62 10.147 22.908 -6.184 1.00 0.00 S ATOM 2720 CE MET B 62 8.362 22.617 -6.104 1.00 0.00 C ATOM 0 H MET B 62 12.066 19.167 -7.616 1.00 0.00 H new ATOM 0 HA MET B 62 11.733 21.088 -9.853 1.00 0.00 H new ATOM 0 HB2 MET B 62 12.505 21.398 -6.905 1.00 0.00 H new ATOM 0 HB3 MET B 62 12.391 22.737 -8.029 1.00 0.00 H new ATOM 0 HG2 MET B 62 9.992 22.173 -8.475 1.00 0.00 H new ATOM 0 HG3 MET B 62 10.101 20.812 -7.376 1.00 0.00 H new ATOM 0 HE1 MET B 62 7.933 23.209 -5.295 1.00 0.00 H new ATOM 0 HE2 MET B 62 7.903 22.907 -7.049 1.00 0.00 H new ATOM 0 HE3 MET B 62 8.174 21.559 -5.919 1.00 0.00 H new ATOM 2730 N THR B 63 14.082 21.252 -10.510 1.00 0.00 N ATOM 2731 CA THR B 63 15.498 21.337 -10.952 1.00 0.00 C ATOM 2732 C THR B 63 15.798 22.813 -11.266 1.00 0.00 C ATOM 2733 O THR B 63 14.951 23.531 -11.760 1.00 0.00 O ATOM 2734 CB THR B 63 15.688 20.460 -12.195 1.00 0.00 C ATOM 2735 OG1 THR B 63 15.215 19.151 -11.907 1.00 0.00 O ATOM 2736 CG2 THR B 63 17.170 20.391 -12.571 1.00 0.00 C ATOM 0 H THR B 63 13.397 21.524 -11.215 1.00 0.00 H new ATOM 0 HA THR B 63 16.180 20.982 -10.180 1.00 0.00 H new ATOM 0 HB THR B 63 15.132 20.888 -13.029 1.00 0.00 H new ATOM 0 HG1 THR B 63 15.330 18.581 -12.696 1.00 0.00 H new ATOM 0 HG21 THR B 63 17.292 19.765 -13.455 1.00 0.00 H new ATOM 0 HG22 THR B 63 17.539 21.395 -12.783 1.00 0.00 H new ATOM 0 HG23 THR B 63 17.736 19.964 -11.743 1.00 0.00 H new ATOM 2744 N PHE B 64 16.967 23.289 -10.942 1.00 0.00 N ATOM 2745 CA PHE B 64 17.278 24.723 -11.218 1.00 0.00 C ATOM 2746 C PHE B 64 18.500 24.828 -12.132 1.00 0.00 C ATOM 2747 O PHE B 64 19.372 23.983 -12.113 1.00 0.00 O ATOM 2748 CB PHE B 64 17.592 25.416 -9.883 1.00 0.00 C ATOM 2749 CG PHE B 64 16.520 25.087 -8.872 1.00 0.00 C ATOM 2750 CD1 PHE B 64 15.205 25.511 -9.083 1.00 0.00 C ATOM 2751 CD2 PHE B 64 16.843 24.355 -7.721 1.00 0.00 C ATOM 2752 CE1 PHE B 64 14.212 25.205 -8.147 1.00 0.00 C ATOM 2753 CE2 PHE B 64 15.850 24.047 -6.785 1.00 0.00 C ATOM 2754 CZ PHE B 64 14.534 24.473 -6.998 1.00 0.00 C ATOM 0 H PHE B 64 17.716 22.755 -10.502 1.00 0.00 H new ATOM 0 HA PHE B 64 16.426 25.195 -11.707 1.00 0.00 H new ATOM 0 HB2 PHE B 64 18.565 25.091 -9.514 1.00 0.00 H new ATOM 0 HB3 PHE B 64 17.650 26.495 -10.027 1.00 0.00 H new ATOM 0 HD1 PHE B 64 14.956 26.075 -9.969 1.00 0.00 H new ATOM 0 HD2 PHE B 64 17.859 24.029 -7.557 1.00 0.00 H new ATOM 0 HE1 PHE B 64 13.196 25.534 -8.311 1.00 0.00 H new ATOM 0 HE2 PHE B 64 16.099 23.481 -5.899 1.00 0.00 H new ATOM 0 HZ PHE B 64 13.767 24.237 -6.276 1.00 0.00 H new ATOM 2764 N GLU B 65 18.593 25.879 -12.911 1.00 0.00 N ATOM 2765 CA GLU B 65 19.773 26.018 -13.813 1.00 0.00 C ATOM 2766 C GLU B 65 20.888 26.682 -13.012 1.00 0.00 C ATOM 2767 O GLU B 65 22.059 26.533 -13.301 1.00 0.00 O ATOM 2768 CB GLU B 65 19.428 26.902 -15.012 1.00 0.00 C ATOM 2769 CG GLU B 65 20.609 26.905 -15.987 1.00 0.00 C ATOM 2770 CD GLU B 65 20.273 27.770 -17.203 1.00 0.00 C ATOM 2771 OE1 GLU B 65 19.101 28.029 -17.418 1.00 0.00 O ATOM 2772 OE2 GLU B 65 21.197 28.162 -17.899 1.00 0.00 O ATOM 0 H GLU B 65 17.911 26.636 -12.960 1.00 0.00 H new ATOM 0 HA GLU B 65 20.077 25.038 -14.181 1.00 0.00 H new ATOM 0 HB2 GLU B 65 18.532 26.530 -15.508 1.00 0.00 H new ATOM 0 HB3 GLU B 65 19.211 27.918 -14.681 1.00 0.00 H new ATOM 0 HG2 GLU B 65 21.501 27.288 -15.491 1.00 0.00 H new ATOM 0 HG3 GLU B 65 20.834 25.887 -16.304 1.00 0.00 H new ATOM 2779 N ASN B 66 20.515 27.399 -11.990 1.00 0.00 N ATOM 2780 CA ASN B 66 21.514 28.089 -11.137 1.00 0.00 C ATOM 2781 C ASN B 66 20.841 28.467 -9.814 1.00 0.00 C ATOM 2782 O ASN B 66 19.635 28.406 -9.684 1.00 0.00 O ATOM 2783 CB ASN B 66 22.007 29.346 -11.849 1.00 0.00 C ATOM 2784 CG ASN B 66 20.831 30.286 -12.102 1.00 0.00 C ATOM 2785 OD1 ASN B 66 21.004 31.365 -12.631 1.00 0.00 O ATOM 2786 ND2 ASN B 66 19.629 29.920 -11.747 1.00 0.00 N ATOM 0 H ASN B 66 19.545 27.537 -11.708 1.00 0.00 H new ATOM 0 HA ASN B 66 22.366 27.436 -10.945 1.00 0.00 H new ATOM 0 HB2 ASN B 66 22.762 29.847 -11.243 1.00 0.00 H new ATOM 0 HB3 ASN B 66 22.482 29.079 -12.793 1.00 0.00 H new ATOM 0 HD21 ASN B 66 18.837 30.540 -11.914 1.00 0.00 H new ATOM 0 HD22 ASN B 66 19.482 29.014 -11.302 1.00 0.00 H new ATOM 2793 N LYS B 67 21.610 28.829 -8.827 1.00 0.00 N ATOM 2794 CA LYS B 67 21.019 29.195 -7.508 1.00 0.00 C ATOM 2795 C LYS B 67 20.243 30.516 -7.588 1.00 0.00 C ATOM 2796 O LYS B 67 19.362 30.770 -6.789 1.00 0.00 O ATOM 2797 CB LYS B 67 22.143 29.334 -6.477 1.00 0.00 C ATOM 2798 CG LYS B 67 22.878 28.000 -6.341 1.00 0.00 C ATOM 2799 CD LYS B 67 23.789 28.037 -5.112 1.00 0.00 C ATOM 2800 CE LYS B 67 24.778 29.196 -5.243 1.00 0.00 C ATOM 2801 NZ LYS B 67 25.252 29.296 -6.654 1.00 0.00 N ATOM 0 H LYS B 67 22.627 28.888 -8.876 1.00 0.00 H new ATOM 0 HA LYS B 67 20.324 28.409 -7.214 1.00 0.00 H new ATOM 0 HB2 LYS B 67 22.839 30.115 -6.785 1.00 0.00 H new ATOM 0 HB3 LYS B 67 21.732 29.635 -5.513 1.00 0.00 H new ATOM 0 HG2 LYS B 67 22.160 27.185 -6.249 1.00 0.00 H new ATOM 0 HG3 LYS B 67 23.467 27.805 -7.237 1.00 0.00 H new ATOM 0 HD2 LYS B 67 23.192 28.155 -4.208 1.00 0.00 H new ATOM 0 HD3 LYS B 67 24.328 27.094 -5.017 1.00 0.00 H new ATOM 0 HE2 LYS B 67 24.301 30.129 -4.942 1.00 0.00 H new ATOM 0 HE3 LYS B 67 25.625 29.041 -4.575 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 26.185 29.756 -6.675 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 25.327 28.343 -7.064 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 24.576 29.859 -7.208 1.00 0.00 H new ATOM 2815 N ASP B 68 20.566 31.369 -8.523 1.00 0.00 N ATOM 2816 CA ASP B 68 19.852 32.682 -8.606 1.00 0.00 C ATOM 2817 C ASP B 68 18.365 32.469 -8.908 1.00 0.00 C ATOM 2818 O ASP B 68 17.515 33.141 -8.359 1.00 0.00 O ATOM 2819 CB ASP B 68 20.480 33.547 -9.702 1.00 0.00 C ATOM 2820 CG ASP B 68 21.918 33.896 -9.308 1.00 0.00 C ATOM 2821 OD1 ASP B 68 22.264 33.679 -8.157 1.00 0.00 O ATOM 2822 OD2 ASP B 68 22.649 34.371 -10.161 1.00 0.00 O ATOM 0 H ASP B 68 21.287 31.218 -9.229 1.00 0.00 H new ATOM 0 HA ASP B 68 19.945 33.188 -7.645 1.00 0.00 H new ATOM 0 HB2 ASP B 68 20.470 33.014 -10.653 1.00 0.00 H new ATOM 0 HB3 ASP B 68 19.897 34.458 -9.841 1.00 0.00 H new ATOM 2827 N GLY B 69 18.036 31.549 -9.770 1.00 0.00 N ATOM 2828 CA GLY B 69 16.597 31.303 -10.064 1.00 0.00 C ATOM 2829 C GLY B 69 15.957 30.612 -8.862 1.00 0.00 C ATOM 2830 O GLY B 69 14.802 30.821 -8.549 1.00 0.00 O ATOM 0 H GLY B 69 18.695 30.961 -10.280 1.00 0.00 H new ATOM 0 HA2 GLY B 69 16.089 32.244 -10.272 1.00 0.00 H new ATOM 0 HA3 GLY B 69 16.495 30.682 -10.954 1.00 0.00 H new ATOM 2834 N TYR B 70 16.708 29.787 -8.186 1.00 0.00 N ATOM 2835 CA TYR B 70 16.160 29.059 -7.006 1.00 0.00 C ATOM 2836 C TYR B 70 15.826 30.045 -5.875 1.00 0.00 C ATOM 2837 O TYR B 70 14.788 29.941 -5.255 1.00 0.00 O ATOM 2838 CB TYR B 70 17.187 28.035 -6.524 1.00 0.00 C ATOM 2839 CG TYR B 70 16.755 27.458 -5.196 1.00 0.00 C ATOM 2840 CD1 TYR B 70 15.500 26.848 -5.068 1.00 0.00 C ATOM 2841 CD2 TYR B 70 17.612 27.530 -4.093 1.00 0.00 C ATOM 2842 CE1 TYR B 70 15.107 26.307 -3.836 1.00 0.00 C ATOM 2843 CE2 TYR B 70 17.221 26.989 -2.864 1.00 0.00 C ATOM 2844 CZ TYR B 70 15.967 26.380 -2.734 1.00 0.00 C ATOM 2845 OH TYR B 70 15.582 25.847 -1.521 1.00 0.00 O ATOM 0 H TYR B 70 17.684 29.584 -8.402 1.00 0.00 H new ATOM 0 HA TYR B 70 15.243 28.546 -7.296 1.00 0.00 H new ATOM 0 HB2 TYR B 70 17.291 27.238 -7.260 1.00 0.00 H new ATOM 0 HB3 TYR B 70 18.165 28.507 -6.424 1.00 0.00 H new ATOM 0 HD1 TYR B 70 14.836 26.795 -5.918 1.00 0.00 H new ATOM 0 HD2 TYR B 70 18.577 28.004 -4.191 1.00 0.00 H new ATOM 0 HE1 TYR B 70 14.141 25.834 -3.737 1.00 0.00 H new ATOM 0 HE2 TYR B 70 17.887 27.041 -2.015 1.00 0.00 H new ATOM 0 HH TYR B 70 16.296 25.982 -0.863 1.00 0.00 H new ATOM 2855 N VAL B 71 16.670 31.007 -5.598 1.00 0.00 N ATOM 2856 CA VAL B 71 16.330 31.963 -4.500 1.00 0.00 C ATOM 2857 C VAL B 71 15.179 32.857 -4.969 1.00 0.00 C ATOM 2858 O VAL B 71 14.376 33.315 -4.184 1.00 0.00 O ATOM 2859 CB VAL B 71 17.540 32.825 -4.121 1.00 0.00 C ATOM 2860 CG1 VAL B 71 18.724 31.942 -3.717 1.00 0.00 C ATOM 2861 CG2 VAL B 71 17.943 33.681 -5.326 1.00 0.00 C ATOM 0 H VAL B 71 17.559 31.170 -6.071 1.00 0.00 H new ATOM 0 HA VAL B 71 16.035 31.398 -3.616 1.00 0.00 H new ATOM 0 HB VAL B 71 17.269 33.460 -3.278 1.00 0.00 H new ATOM 0 HG11 VAL B 71 19.573 32.571 -3.451 1.00 0.00 H new ATOM 0 HG12 VAL B 71 18.445 31.329 -2.860 1.00 0.00 H new ATOM 0 HG13 VAL B 71 18.998 31.296 -4.551 1.00 0.00 H new ATOM 0 HG21 VAL B 71 18.803 34.297 -5.063 1.00 0.00 H new ATOM 0 HG22 VAL B 71 18.203 33.032 -6.163 1.00 0.00 H new ATOM 0 HG23 VAL B 71 17.110 34.324 -5.611 1.00 0.00 H new ATOM 2871 N ALA B 72 15.087 33.089 -6.249 1.00 0.00 N ATOM 2872 CA ALA B 72 13.995 33.954 -6.773 1.00 0.00 C ATOM 2873 C ALA B 72 12.644 33.277 -6.518 1.00 0.00 C ATOM 2874 O ALA B 72 11.787 33.813 -5.843 1.00 0.00 O ATOM 2875 CB ALA B 72 14.181 34.143 -8.279 1.00 0.00 C ATOM 0 H ALA B 72 15.722 32.716 -6.955 1.00 0.00 H new ATOM 0 HA ALA B 72 14.023 34.921 -6.271 1.00 0.00 H new ATOM 0 HB1 ALA B 72 13.383 34.776 -8.668 1.00 0.00 H new ATOM 0 HB2 ALA B 72 15.145 34.615 -8.470 1.00 0.00 H new ATOM 0 HB3 ALA B 72 14.148 33.173 -8.774 1.00 0.00 H new ATOM 2881 N PHE B 73 12.440 32.113 -7.074 1.00 0.00 N ATOM 2882 CA PHE B 73 11.121 31.428 -6.928 1.00 0.00 C ATOM 2883 C PHE B 73 10.735 31.279 -5.444 1.00 0.00 C ATOM 2884 O PHE B 73 9.573 31.353 -5.094 1.00 0.00 O ATOM 2885 CB PHE B 73 11.206 30.043 -7.577 1.00 0.00 C ATOM 2886 CG PHE B 73 12.089 30.112 -8.803 1.00 0.00 C ATOM 2887 CD1 PHE B 73 12.027 31.225 -9.650 1.00 0.00 C ATOM 2888 CD2 PHE B 73 12.969 29.061 -9.094 1.00 0.00 C ATOM 2889 CE1 PHE B 73 12.845 31.289 -10.786 1.00 0.00 C ATOM 2890 CE2 PHE B 73 13.785 29.125 -10.231 1.00 0.00 C ATOM 2891 CZ PHE B 73 13.723 30.239 -11.076 1.00 0.00 C ATOM 0 H PHE B 73 13.132 31.605 -7.625 1.00 0.00 H new ATOM 0 HA PHE B 73 10.357 32.030 -7.419 1.00 0.00 H new ATOM 0 HB2 PHE B 73 11.609 29.321 -6.866 1.00 0.00 H new ATOM 0 HB3 PHE B 73 10.210 29.697 -7.853 1.00 0.00 H new ATOM 0 HD1 PHE B 73 11.348 32.035 -9.428 1.00 0.00 H new ATOM 0 HD2 PHE B 73 13.018 28.202 -8.442 1.00 0.00 H new ATOM 0 HE1 PHE B 73 12.798 32.149 -11.438 1.00 0.00 H new ATOM 0 HE2 PHE B 73 14.462 28.314 -10.456 1.00 0.00 H new ATOM 0 HZ PHE B 73 14.353 30.288 -11.952 1.00 0.00 H new ATOM 2901 N THR B 74 11.682 31.052 -4.575 1.00 0.00 N ATOM 2902 CA THR B 74 11.330 30.837 -3.137 1.00 0.00 C ATOM 2903 C THR B 74 11.213 32.180 -2.411 1.00 0.00 C ATOM 2904 O THR B 74 10.489 32.309 -1.442 1.00 0.00 O ATOM 2905 CB THR B 74 12.421 29.999 -2.457 1.00 0.00 C ATOM 2906 OG1 THR B 74 12.132 29.884 -1.072 1.00 0.00 O ATOM 2907 CG2 THR B 74 13.783 30.666 -2.646 1.00 0.00 C ATOM 0 H THR B 74 12.677 31.006 -4.793 1.00 0.00 H new ATOM 0 HA THR B 74 10.374 30.315 -3.089 1.00 0.00 H new ATOM 0 HB THR B 74 12.447 29.007 -2.907 1.00 0.00 H new ATOM 0 HG1 THR B 74 11.250 29.474 -0.955 1.00 0.00 H new ATOM 0 HG21 THR B 74 14.553 30.066 -2.161 1.00 0.00 H new ATOM 0 HG22 THR B 74 14.004 30.747 -3.710 1.00 0.00 H new ATOM 0 HG23 THR B 74 13.765 31.661 -2.202 1.00 0.00 H new ATOM 2915 N SER B 75 11.936 33.175 -2.851 1.00 0.00 N ATOM 2916 CA SER B 75 11.880 34.499 -2.164 1.00 0.00 C ATOM 2917 C SER B 75 10.494 35.141 -2.316 1.00 0.00 C ATOM 2918 O SER B 75 10.017 35.809 -1.423 1.00 0.00 O ATOM 2919 CB SER B 75 12.935 35.422 -2.775 1.00 0.00 C ATOM 2920 OG SER B 75 14.230 34.899 -2.504 1.00 0.00 O ATOM 0 H SER B 75 12.562 33.129 -3.655 1.00 0.00 H new ATOM 0 HA SER B 75 12.074 34.350 -1.102 1.00 0.00 H new ATOM 0 HB2 SER B 75 12.782 35.506 -3.851 1.00 0.00 H new ATOM 0 HB3 SER B 75 12.841 36.426 -2.360 1.00 0.00 H new ATOM 0 HG SER B 75 14.307 34.001 -2.889 1.00 0.00 H new ATOM 2926 N HIS B 76 9.841 34.949 -3.432 1.00 0.00 N ATOM 2927 CA HIS B 76 8.485 35.552 -3.609 1.00 0.00 C ATOM 2928 C HIS B 76 7.530 34.994 -2.540 1.00 0.00 C ATOM 2929 O HIS B 76 7.696 33.888 -2.074 1.00 0.00 O ATOM 2930 CB HIS B 76 7.948 35.196 -4.998 1.00 0.00 C ATOM 2931 CG HIS B 76 8.565 36.100 -6.029 1.00 0.00 C ATOM 2932 ND1 HIS B 76 9.811 35.844 -6.586 1.00 0.00 N ATOM 2933 CD2 HIS B 76 8.121 37.259 -6.619 1.00 0.00 C ATOM 2934 CE1 HIS B 76 10.073 36.828 -7.466 1.00 0.00 C ATOM 2935 NE2 HIS B 76 9.075 37.712 -7.524 1.00 0.00 N ATOM 0 H HIS B 76 10.184 34.405 -4.224 1.00 0.00 H new ATOM 0 HA HIS B 76 8.555 36.635 -3.507 1.00 0.00 H new ATOM 0 HB2 HIS B 76 8.175 34.156 -5.230 1.00 0.00 H new ATOM 0 HB3 HIS B 76 6.863 35.297 -5.015 1.00 0.00 H new ATOM 0 HD1 HIS B 76 10.418 35.054 -6.368 1.00 0.00 H new ATOM 0 HD2 HIS B 76 7.178 37.743 -6.412 1.00 0.00 H new ATOM 0 HE1 HIS B 76 10.978 36.894 -8.052 1.00 0.00 H new ATOM 2944 N PRO B 77 6.532 35.753 -2.162 1.00 0.00 N ATOM 2945 CA PRO B 77 5.526 35.315 -1.144 1.00 0.00 C ATOM 2946 C PRO B 77 4.630 34.173 -1.655 1.00 0.00 C ATOM 2947 O PRO B 77 3.851 33.609 -0.915 1.00 0.00 O ATOM 2948 CB PRO B 77 4.708 36.588 -0.913 1.00 0.00 C ATOM 2949 CG PRO B 77 4.837 37.355 -2.187 1.00 0.00 C ATOM 2950 CD PRO B 77 6.263 37.105 -2.697 1.00 0.00 C ATOM 0 HA PRO B 77 5.991 34.915 -0.243 1.00 0.00 H new ATOM 0 HB2 PRO B 77 3.666 36.355 -0.694 1.00 0.00 H new ATOM 0 HB3 PRO B 77 5.092 37.158 -0.067 1.00 0.00 H new ATOM 0 HG2 PRO B 77 4.099 37.023 -2.917 1.00 0.00 H new ATOM 0 HG3 PRO B 77 4.664 38.418 -2.020 1.00 0.00 H new ATOM 0 HD2 PRO B 77 6.321 37.135 -3.785 1.00 0.00 H new ATOM 0 HD3 PRO B 77 6.970 37.844 -2.319 1.00 0.00 H new ATOM 2958 N LEU B 78 4.734 33.842 -2.916 1.00 0.00 N ATOM 2959 CA LEU B 78 3.903 32.733 -3.492 1.00 0.00 C ATOM 2960 C LEU B 78 4.455 31.359 -3.089 1.00 0.00 C ATOM 2961 O LEU B 78 3.727 30.387 -3.022 1.00 0.00 O ATOM 2962 CB LEU B 78 3.933 32.846 -5.015 1.00 0.00 C ATOM 2963 CG LEU B 78 2.962 31.840 -5.641 1.00 0.00 C ATOM 2964 CD1 LEU B 78 2.272 32.490 -6.838 1.00 0.00 C ATOM 2965 CD2 LEU B 78 3.738 30.606 -6.115 1.00 0.00 C ATOM 0 H LEU B 78 5.363 34.294 -3.580 1.00 0.00 H new ATOM 0 HA LEU B 78 2.886 32.823 -3.110 1.00 0.00 H new ATOM 0 HB2 LEU B 78 3.664 33.858 -5.317 1.00 0.00 H new ATOM 0 HB3 LEU B 78 4.943 32.663 -5.380 1.00 0.00 H new ATOM 0 HG LEU B 78 2.219 31.541 -4.902 1.00 0.00 H new ATOM 0 HD11 LEU B 78 1.579 31.779 -7.289 1.00 0.00 H new ATOM 0 HD12 LEU B 78 1.723 33.372 -6.507 1.00 0.00 H new ATOM 0 HD13 LEU B 78 3.020 32.784 -7.574 1.00 0.00 H new ATOM 0 HD21 LEU B 78 3.047 29.890 -6.560 1.00 0.00 H new ATOM 0 HD22 LEU B 78 4.479 30.905 -6.857 1.00 0.00 H new ATOM 0 HD23 LEU B 78 4.241 30.144 -5.265 1.00 0.00 H new ATOM 2977 N HIS B 79 5.734 31.258 -2.852 1.00 0.00 N ATOM 2978 CA HIS B 79 6.327 29.928 -2.517 1.00 0.00 C ATOM 2979 C HIS B 79 6.107 29.607 -1.039 1.00 0.00 C ATOM 2980 O HIS B 79 5.901 28.470 -0.662 1.00 0.00 O ATOM 2981 CB HIS B 79 7.828 29.955 -2.802 1.00 0.00 C ATOM 2982 CG HIS B 79 8.436 28.634 -2.416 1.00 0.00 C ATOM 2983 ND1 HIS B 79 9.019 28.423 -1.173 1.00 0.00 N ATOM 2984 CD2 HIS B 79 8.558 27.447 -3.093 1.00 0.00 C ATOM 2985 CE1 HIS B 79 9.459 27.152 -1.143 1.00 0.00 C ATOM 2986 NE2 HIS B 79 9.202 26.517 -2.288 1.00 0.00 N ATOM 0 H HIS B 79 6.394 32.035 -2.875 1.00 0.00 H new ATOM 0 HA HIS B 79 5.844 29.164 -3.126 1.00 0.00 H new ATOM 0 HB2 HIS B 79 8.005 30.154 -3.859 1.00 0.00 H new ATOM 0 HB3 HIS B 79 8.301 30.762 -2.243 1.00 0.00 H new ATOM 0 HD2 HIS B 79 8.207 27.264 -4.098 1.00 0.00 H new ATOM 0 HE1 HIS B 79 9.958 26.702 -0.298 1.00 0.00 H new ATOM 0 HE2 HIS B 79 9.431 25.551 -2.523 1.00 0.00 H new ATOM 2995 N VAL B 80 6.158 30.598 -0.199 1.00 0.00 N ATOM 2996 CA VAL B 80 5.986 30.352 1.257 1.00 0.00 C ATOM 2997 C VAL B 80 4.537 29.968 1.556 1.00 0.00 C ATOM 2998 O VAL B 80 4.264 28.926 2.118 1.00 0.00 O ATOM 2999 CB VAL B 80 6.344 31.626 2.018 1.00 0.00 C ATOM 3000 CG1 VAL B 80 5.495 32.785 1.500 1.00 0.00 C ATOM 3001 CG2 VAL B 80 6.072 31.411 3.509 1.00 0.00 C ATOM 0 H VAL B 80 6.312 31.572 -0.458 1.00 0.00 H new ATOM 0 HA VAL B 80 6.638 29.536 1.568 1.00 0.00 H new ATOM 0 HB VAL B 80 7.398 31.861 1.870 1.00 0.00 H new ATOM 0 HG11 VAL B 80 5.751 33.695 2.043 1.00 0.00 H new ATOM 0 HG12 VAL B 80 5.688 32.931 0.437 1.00 0.00 H new ATOM 0 HG13 VAL B 80 4.439 32.558 1.649 1.00 0.00 H new ATOM 0 HG21 VAL B 80 6.325 32.317 4.059 1.00 0.00 H new ATOM 0 HG22 VAL B 80 5.017 31.180 3.657 1.00 0.00 H new ATOM 0 HG23 VAL B 80 6.680 30.583 3.874 1.00 0.00 H new ATOM 3011 N GLU B 81 3.606 30.802 1.188 1.00 0.00 N ATOM 3012 CA GLU B 81 2.175 30.480 1.447 1.00 0.00 C ATOM 3013 C GLU B 81 1.819 29.153 0.777 1.00 0.00 C ATOM 3014 O GLU B 81 1.127 28.327 1.340 1.00 0.00 O ATOM 3015 CB GLU B 81 1.294 31.591 0.874 1.00 0.00 C ATOM 3016 CG GLU B 81 -0.160 31.351 1.286 1.00 0.00 C ATOM 3017 CD GLU B 81 -1.055 32.408 0.638 1.00 0.00 C ATOM 3018 OE1 GLU B 81 -0.530 33.225 -0.100 1.00 0.00 O ATOM 3019 OE2 GLU B 81 -2.247 32.382 0.889 1.00 0.00 O ATOM 0 H GLU B 81 3.773 31.692 0.719 1.00 0.00 H new ATOM 0 HA GLU B 81 2.010 30.399 2.521 1.00 0.00 H new ATOM 0 HB2 GLU B 81 1.631 32.562 1.238 1.00 0.00 H new ATOM 0 HB3 GLU B 81 1.377 31.612 -0.213 1.00 0.00 H new ATOM 0 HG2 GLU B 81 -0.476 30.354 0.979 1.00 0.00 H new ATOM 0 HG3 GLU B 81 -0.254 31.395 2.371 1.00 0.00 H new ATOM 3026 N PHE B 82 2.284 28.940 -0.423 1.00 0.00 N ATOM 3027 CA PHE B 82 1.980 27.661 -1.123 1.00 0.00 C ATOM 3028 C PHE B 82 2.501 26.481 -0.299 1.00 0.00 C ATOM 3029 O PHE B 82 1.840 25.471 -0.158 1.00 0.00 O ATOM 3030 CB PHE B 82 2.654 27.661 -2.496 1.00 0.00 C ATOM 3031 CG PHE B 82 2.274 26.402 -3.241 1.00 0.00 C ATOM 3032 CD1 PHE B 82 1.084 26.354 -3.975 1.00 0.00 C ATOM 3033 CD2 PHE B 82 3.116 25.284 -3.195 1.00 0.00 C ATOM 3034 CE1 PHE B 82 0.734 25.187 -4.664 1.00 0.00 C ATOM 3035 CE2 PHE B 82 2.765 24.116 -3.885 1.00 0.00 C ATOM 3036 CZ PHE B 82 1.574 24.068 -4.619 1.00 0.00 C ATOM 0 H PHE B 82 2.861 29.596 -0.949 1.00 0.00 H new ATOM 0 HA PHE B 82 0.901 27.565 -1.244 1.00 0.00 H new ATOM 0 HB2 PHE B 82 2.348 28.539 -3.064 1.00 0.00 H new ATOM 0 HB3 PHE B 82 3.737 27.717 -2.382 1.00 0.00 H new ATOM 0 HD1 PHE B 82 0.436 27.217 -4.010 1.00 0.00 H new ATOM 0 HD2 PHE B 82 4.035 25.322 -2.628 1.00 0.00 H new ATOM 0 HE1 PHE B 82 -0.185 25.150 -5.231 1.00 0.00 H new ATOM 0 HE2 PHE B 82 3.413 23.253 -3.851 1.00 0.00 H new ATOM 0 HZ PHE B 82 1.303 23.168 -5.151 1.00 0.00 H new ATOM 3046 N SER B 83 3.686 26.594 0.242 1.00 0.00 N ATOM 3047 CA SER B 83 4.249 25.471 1.048 1.00 0.00 C ATOM 3048 C SER B 83 3.417 25.266 2.316 1.00 0.00 C ATOM 3049 O SER B 83 3.303 24.165 2.816 1.00 0.00 O ATOM 3050 CB SER B 83 5.693 25.788 1.431 1.00 0.00 C ATOM 3051 OG SER B 83 5.709 26.881 2.338 1.00 0.00 O ATOM 0 H SER B 83 4.287 27.414 0.161 1.00 0.00 H new ATOM 0 HA SER B 83 4.222 24.559 0.452 1.00 0.00 H new ATOM 0 HB2 SER B 83 6.160 24.915 1.887 1.00 0.00 H new ATOM 0 HB3 SER B 83 6.273 26.031 0.540 1.00 0.00 H new ATOM 0 HG SER B 83 5.313 27.668 1.909 1.00 0.00 H new ATOM 3057 N ALA B 84 2.830 26.308 2.843 1.00 0.00 N ATOM 3058 CA ALA B 84 2.008 26.142 4.075 1.00 0.00 C ATOM 3059 C ALA B 84 0.846 25.204 3.765 1.00 0.00 C ATOM 3060 O ALA B 84 0.654 24.194 4.415 1.00 0.00 O ATOM 3061 CB ALA B 84 1.459 27.494 4.523 1.00 0.00 C ATOM 0 H ALA B 84 2.884 27.258 2.477 1.00 0.00 H new ATOM 0 HA ALA B 84 2.625 25.728 4.872 1.00 0.00 H new ATOM 0 HB1 ALA B 84 0.860 27.363 5.424 1.00 0.00 H new ATOM 0 HB2 ALA B 84 2.287 28.171 4.733 1.00 0.00 H new ATOM 0 HB3 ALA B 84 0.838 27.915 3.732 1.00 0.00 H new ATOM 3067 N ALA B 85 0.081 25.524 2.761 1.00 0.00 N ATOM 3068 CA ALA B 85 -1.057 24.648 2.387 1.00 0.00 C ATOM 3069 C ALA B 85 -0.503 23.325 1.863 1.00 0.00 C ATOM 3070 O ALA B 85 -1.023 22.266 2.149 1.00 0.00 O ATOM 3071 CB ALA B 85 -1.888 25.322 1.298 1.00 0.00 C ATOM 0 H ALA B 85 0.196 26.357 2.183 1.00 0.00 H new ATOM 0 HA ALA B 85 -1.690 24.469 3.256 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -2.723 24.676 1.025 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -2.271 26.273 1.668 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -1.265 25.498 0.421 1.00 0.00 H new ATOM 3077 N PHE B 86 0.566 23.373 1.110 1.00 0.00 N ATOM 3078 CA PHE B 86 1.150 22.106 0.596 1.00 0.00 C ATOM 3079 C PHE B 86 1.234 21.116 1.753 1.00 0.00 C ATOM 3080 O PHE B 86 1.213 19.918 1.560 1.00 0.00 O ATOM 3081 CB PHE B 86 2.552 22.359 0.037 1.00 0.00 C ATOM 3082 CG PHE B 86 2.973 21.191 -0.824 1.00 0.00 C ATOM 3083 CD1 PHE B 86 2.279 20.911 -2.009 1.00 0.00 C ATOM 3084 CD2 PHE B 86 4.054 20.389 -0.440 1.00 0.00 C ATOM 3085 CE1 PHE B 86 2.668 19.826 -2.806 1.00 0.00 C ATOM 3086 CE2 PHE B 86 4.443 19.309 -1.237 1.00 0.00 C ATOM 3087 CZ PHE B 86 3.749 19.026 -2.419 1.00 0.00 C ATOM 0 H PHE B 86 1.052 24.226 0.833 1.00 0.00 H new ATOM 0 HA PHE B 86 0.525 21.708 -0.203 1.00 0.00 H new ATOM 0 HB2 PHE B 86 2.560 23.278 -0.550 1.00 0.00 H new ATOM 0 HB3 PHE B 86 3.261 22.496 0.854 1.00 0.00 H new ATOM 0 HD1 PHE B 86 1.446 21.530 -2.307 1.00 0.00 H new ATOM 0 HD2 PHE B 86 4.588 20.605 0.473 1.00 0.00 H new ATOM 0 HE1 PHE B 86 2.134 19.607 -3.719 1.00 0.00 H new ATOM 0 HE2 PHE B 86 5.279 18.693 -0.941 1.00 0.00 H new ATOM 0 HZ PHE B 86 4.048 18.189 -3.033 1.00 0.00 H new ATOM 3097 N THR B 87 1.302 21.608 2.962 1.00 0.00 N ATOM 3098 CA THR B 87 1.368 20.682 4.120 1.00 0.00 C ATOM 3099 C THR B 87 -0.057 20.270 4.469 1.00 0.00 C ATOM 3100 O THR B 87 -0.428 19.120 4.369 1.00 0.00 O ATOM 3101 CB THR B 87 1.992 21.392 5.321 1.00 0.00 C ATOM 3102 OG1 THR B 87 3.123 22.136 4.892 1.00 0.00 O ATOM 3103 CG2 THR B 87 2.428 20.367 6.366 1.00 0.00 C ATOM 0 H THR B 87 1.314 22.602 3.192 1.00 0.00 H new ATOM 0 HA THR B 87 1.976 19.812 3.871 1.00 0.00 H new ATOM 0 HB THR B 87 1.254 22.062 5.763 1.00 0.00 H new ATOM 0 HG1 THR B 87 2.825 22.961 4.455 1.00 0.00 H new ATOM 0 HG21 THR B 87 2.871 20.882 7.218 1.00 0.00 H new ATOM 0 HG22 THR B 87 1.562 19.795 6.698 1.00 0.00 H new ATOM 0 HG23 THR B 87 3.163 19.691 5.928 1.00 0.00 H new ATOM 3111 N ALA B 88 -0.859 21.218 4.867 1.00 0.00 N ATOM 3112 CA ALA B 88 -2.272 20.911 5.215 1.00 0.00 C ATOM 3113 C ALA B 88 -2.857 19.919 4.209 1.00 0.00 C ATOM 3114 O ALA B 88 -3.694 19.106 4.542 1.00 0.00 O ATOM 3115 CB ALA B 88 -3.094 22.197 5.157 1.00 0.00 C ATOM 0 H ALA B 88 -0.593 22.198 4.966 1.00 0.00 H new ATOM 0 HA ALA B 88 -2.304 20.481 6.216 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -4.131 21.978 5.411 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -2.691 22.919 5.867 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -3.047 22.613 4.151 1.00 0.00 H new ATOM 3121 N VAL B 89 -2.439 19.991 2.976 1.00 0.00 N ATOM 3122 CA VAL B 89 -2.992 19.070 1.947 1.00 0.00 C ATOM 3123 C VAL B 89 -2.118 17.811 1.814 1.00 0.00 C ATOM 3124 O VAL B 89 -2.243 17.068 0.858 1.00 0.00 O ATOM 3125 CB VAL B 89 -3.050 19.803 0.605 1.00 0.00 C ATOM 3126 CG1 VAL B 89 -3.754 21.147 0.800 1.00 0.00 C ATOM 3127 CG2 VAL B 89 -1.628 20.052 0.090 1.00 0.00 C ATOM 0 H VAL B 89 -1.737 20.649 2.637 1.00 0.00 H new ATOM 0 HA VAL B 89 -3.992 18.760 2.248 1.00 0.00 H new ATOM 0 HB VAL B 89 -3.596 19.196 -0.117 1.00 0.00 H new ATOM 0 HG11 VAL B 89 -3.799 21.676 -0.152 1.00 0.00 H new ATOM 0 HG12 VAL B 89 -4.765 20.978 1.170 1.00 0.00 H new ATOM 0 HG13 VAL B 89 -3.200 21.747 1.522 1.00 0.00 H new ATOM 0 HG21 VAL B 89 -1.673 20.574 -0.866 1.00 0.00 H new ATOM 0 HG22 VAL B 89 -1.081 20.661 0.810 1.00 0.00 H new ATOM 0 HG23 VAL B 89 -1.116 19.099 -0.041 1.00 0.00 H new ATOM 3137 N ILE B 90 -1.241 17.552 2.750 1.00 0.00 N ATOM 3138 CA ILE B 90 -0.396 16.331 2.638 1.00 0.00 C ATOM 3139 C ILE B 90 -0.386 15.564 3.961 1.00 0.00 C ATOM 3140 O ILE B 90 -0.737 16.083 5.002 1.00 0.00 O ATOM 3141 CB ILE B 90 1.039 16.722 2.270 1.00 0.00 C ATOM 3142 CG1 ILE B 90 1.068 17.237 0.828 1.00 0.00 C ATOM 3143 CG2 ILE B 90 1.942 15.491 2.392 1.00 0.00 C ATOM 3144 CD1 ILE B 90 0.609 16.130 -0.120 1.00 0.00 C ATOM 0 H ILE B 90 -1.076 18.127 3.576 1.00 0.00 H new ATOM 0 HA ILE B 90 -0.814 15.693 1.859 1.00 0.00 H new ATOM 0 HB ILE B 90 1.394 17.503 2.942 1.00 0.00 H new ATOM 0 HG12 ILE B 90 0.419 18.107 0.729 1.00 0.00 H new ATOM 0 HG13 ILE B 90 2.076 17.559 0.566 1.00 0.00 H new ATOM 0 HG21 ILE B 90 2.965 15.763 2.131 1.00 0.00 H new ATOM 0 HG22 ILE B 90 1.915 15.120 3.417 1.00 0.00 H new ATOM 0 HG23 ILE B 90 1.590 14.713 1.715 1.00 0.00 H new ATOM 0 HD11 ILE B 90 0.630 16.498 -1.146 1.00 0.00 H new ATOM 0 HD12 ILE B 90 1.276 15.273 -0.028 1.00 0.00 H new ATOM 0 HD13 ILE B 90 -0.407 15.829 0.137 1.00 0.00 H new ATOM 3156 N ASP B 91 0.043 14.331 3.910 1.00 0.00 N ATOM 3157 CA ASP B 91 0.084 13.471 5.127 1.00 0.00 C ATOM 3158 C ASP B 91 1.548 13.162 5.456 1.00 0.00 C ATOM 3159 O ASP B 91 1.939 13.049 6.601 1.00 0.00 O ATOM 3160 CB ASP B 91 -0.633 12.160 4.810 1.00 0.00 C ATOM 3161 CG ASP B 91 -0.522 11.191 5.985 1.00 0.00 C ATOM 3162 OD1 ASP B 91 -0.207 11.633 7.075 1.00 0.00 O ATOM 3163 OD2 ASP B 91 -0.759 10.009 5.771 1.00 0.00 O ATOM 0 H ASP B 91 0.373 13.876 3.059 1.00 0.00 H new ATOM 0 HA ASP B 91 -0.393 13.973 5.968 1.00 0.00 H new ATOM 0 HB2 ASP B 91 -1.683 12.357 4.591 1.00 0.00 H new ATOM 0 HB3 ASP B 91 -0.200 11.709 3.917 1.00 0.00 H new ATOM 3168 N LYS B 92 2.355 13.042 4.435 1.00 0.00 N ATOM 3169 CA LYS B 92 3.798 12.723 4.618 1.00 0.00 C ATOM 3170 C LYS B 92 4.630 13.681 3.750 1.00 0.00 C ATOM 3171 O LYS B 92 4.361 13.848 2.578 1.00 0.00 O ATOM 3172 CB LYS B 92 4.040 11.284 4.152 1.00 0.00 C ATOM 3173 CG LYS B 92 5.342 11.221 3.342 1.00 0.00 C ATOM 3174 CD LYS B 92 5.761 9.756 3.134 1.00 0.00 C ATOM 3175 CE LYS B 92 7.172 9.704 2.532 1.00 0.00 C ATOM 3176 NZ LYS B 92 7.456 8.328 2.028 1.00 0.00 N ATOM 0 H LYS B 92 2.067 13.154 3.463 1.00 0.00 H new ATOM 0 HA LYS B 92 4.083 12.831 5.665 1.00 0.00 H new ATOM 0 HB2 LYS B 92 4.102 10.617 5.012 1.00 0.00 H new ATOM 0 HB3 LYS B 92 3.203 10.942 3.543 1.00 0.00 H new ATOM 0 HG2 LYS B 92 5.204 11.709 2.377 1.00 0.00 H new ATOM 0 HG3 LYS B 92 6.131 11.763 3.863 1.00 0.00 H new ATOM 0 HD2 LYS B 92 5.740 9.223 4.085 1.00 0.00 H new ATOM 0 HD3 LYS B 92 5.054 9.255 2.473 1.00 0.00 H new ATOM 0 HE2 LYS B 92 7.257 10.424 1.718 1.00 0.00 H new ATOM 0 HE3 LYS B 92 7.909 9.985 3.284 1.00 0.00 H new ATOM 0 HZ1 LYS B 92 8.413 8.298 1.621 1.00 0.00 H new ATOM 0 HZ2 LYS B 92 7.393 7.650 2.814 1.00 0.00 H new ATOM 0 HZ3 LYS B 92 6.761 8.076 1.297 1.00 0.00 H new ATOM 3190 N ILE B 93 5.630 14.329 4.304 1.00 0.00 N ATOM 3191 CA ILE B 93 6.449 15.264 3.471 1.00 0.00 C ATOM 3192 C ILE B 93 7.938 14.938 3.638 1.00 0.00 C ATOM 3193 O ILE B 93 8.441 14.806 4.739 1.00 0.00 O ATOM 3194 CB ILE B 93 6.172 16.725 3.874 1.00 0.00 C ATOM 3195 CG1 ILE B 93 6.674 17.665 2.768 1.00 0.00 C ATOM 3196 CG2 ILE B 93 6.890 17.063 5.180 1.00 0.00 C ATOM 3197 CD1 ILE B 93 5.705 17.642 1.582 1.00 0.00 C ATOM 0 H ILE B 93 5.910 14.252 5.282 1.00 0.00 H new ATOM 0 HA ILE B 93 6.174 15.139 2.424 1.00 0.00 H new ATOM 0 HB ILE B 93 5.098 16.852 4.014 1.00 0.00 H new ATOM 0 HG12 ILE B 93 6.764 18.680 3.155 1.00 0.00 H new ATOM 0 HG13 ILE B 93 7.668 17.359 2.442 1.00 0.00 H new ATOM 0 HG21 ILE B 93 6.684 18.099 5.451 1.00 0.00 H new ATOM 0 HG22 ILE B 93 6.535 16.403 5.972 1.00 0.00 H new ATOM 0 HG23 ILE B 93 7.964 16.929 5.050 1.00 0.00 H new ATOM 0 HD11 ILE B 93 6.068 18.311 0.802 1.00 0.00 H new ATOM 0 HD12 ILE B 93 5.637 16.628 1.187 1.00 0.00 H new ATOM 0 HD13 ILE B 93 4.719 17.970 1.911 1.00 0.00 H new ATOM 3209 N VAL B 94 8.640 14.809 2.541 1.00 0.00 N ATOM 3210 CA VAL B 94 10.109 14.504 2.588 1.00 0.00 C ATOM 3211 C VAL B 94 10.790 15.190 1.393 1.00 0.00 C ATOM 3212 O VAL B 94 10.194 15.335 0.347 1.00 0.00 O ATOM 3213 CB VAL B 94 10.305 12.985 2.472 1.00 0.00 C ATOM 3214 CG1 VAL B 94 9.824 12.496 1.108 1.00 0.00 C ATOM 3215 CG2 VAL B 94 11.785 12.634 2.644 1.00 0.00 C ATOM 0 H VAL B 94 8.256 14.903 1.601 1.00 0.00 H new ATOM 0 HA VAL B 94 10.540 14.863 3.523 1.00 0.00 H new ATOM 0 HB VAL B 94 9.724 12.498 3.255 1.00 0.00 H new ATOM 0 HG11 VAL B 94 9.968 11.418 1.037 1.00 0.00 H new ATOM 0 HG12 VAL B 94 8.766 12.730 0.990 1.00 0.00 H new ATOM 0 HG13 VAL B 94 10.395 12.991 0.322 1.00 0.00 H new ATOM 0 HG21 VAL B 94 11.915 11.555 2.560 1.00 0.00 H new ATOM 0 HG22 VAL B 94 12.369 13.131 1.870 1.00 0.00 H new ATOM 0 HG23 VAL B 94 12.126 12.966 3.625 1.00 0.00 H new ATOM 3225 N LEU B 95 12.026 15.621 1.516 1.00 0.00 N ATOM 3226 CA LEU B 95 12.673 16.304 0.346 1.00 0.00 C ATOM 3227 C LEU B 95 14.112 15.814 0.125 1.00 0.00 C ATOM 3228 O LEU B 95 14.928 15.799 1.026 1.00 0.00 O ATOM 3229 CB LEU B 95 12.711 17.815 0.570 1.00 0.00 C ATOM 3230 CG LEU B 95 11.518 18.256 1.417 1.00 0.00 C ATOM 3231 CD1 LEU B 95 11.875 18.143 2.899 1.00 0.00 C ATOM 3232 CD2 LEU B 95 11.181 19.712 1.083 1.00 0.00 C ATOM 0 H LEU B 95 12.602 15.533 2.353 1.00 0.00 H new ATOM 0 HA LEU B 95 12.076 16.062 -0.533 1.00 0.00 H new ATOM 0 HB2 LEU B 95 13.641 18.093 1.067 1.00 0.00 H new ATOM 0 HB3 LEU B 95 12.696 18.332 -0.389 1.00 0.00 H new ATOM 0 HG LEU B 95 10.659 17.620 1.204 1.00 0.00 H new ATOM 0 HD11 LEU B 95 11.024 18.458 3.503 1.00 0.00 H new ATOM 0 HD12 LEU B 95 12.125 17.109 3.135 1.00 0.00 H new ATOM 0 HD13 LEU B 95 12.731 18.782 3.117 1.00 0.00 H new ATOM 0 HD21 LEU B 95 10.330 20.035 1.683 1.00 0.00 H new ATOM 0 HD22 LEU B 95 12.041 20.344 1.303 1.00 0.00 H new ATOM 0 HD23 LEU B 95 10.931 19.794 0.025 1.00 0.00 H new ATOM 3244 N LEU B 96 14.426 15.446 -1.096 1.00 0.00 N ATOM 3245 CA LEU B 96 15.807 14.988 -1.428 1.00 0.00 C ATOM 3246 C LEU B 96 16.469 16.008 -2.365 1.00 0.00 C ATOM 3247 O LEU B 96 16.000 16.241 -3.461 1.00 0.00 O ATOM 3248 CB LEU B 96 15.755 13.641 -2.158 1.00 0.00 C ATOM 3249 CG LEU B 96 14.618 12.775 -1.620 1.00 0.00 C ATOM 3250 CD1 LEU B 96 13.275 13.327 -2.104 1.00 0.00 C ATOM 3251 CD2 LEU B 96 14.795 11.348 -2.144 1.00 0.00 C ATOM 0 H LEU B 96 13.775 15.445 -1.881 1.00 0.00 H new ATOM 0 HA LEU B 96 16.373 14.889 -0.502 1.00 0.00 H new ATOM 0 HB2 LEU B 96 15.617 13.807 -3.227 1.00 0.00 H new ATOM 0 HB3 LEU B 96 16.704 13.119 -2.036 1.00 0.00 H new ATOM 0 HG LEU B 96 14.637 12.780 -0.530 1.00 0.00 H new ATOM 0 HD11 LEU B 96 12.466 12.706 -1.718 1.00 0.00 H new ATOM 0 HD12 LEU B 96 13.151 14.349 -1.745 1.00 0.00 H new ATOM 0 HD13 LEU B 96 13.250 13.319 -3.194 1.00 0.00 H new ATOM 0 HD21 LEU B 96 13.989 10.719 -1.767 1.00 0.00 H new ATOM 0 HD22 LEU B 96 14.770 11.355 -3.234 1.00 0.00 H new ATOM 0 HD23 LEU B 96 15.753 10.952 -1.805 1.00 0.00 H new ATOM 3263 N ASP B 97 17.561 16.600 -1.958 1.00 0.00 N ATOM 3264 CA ASP B 97 18.232 17.611 -2.831 1.00 0.00 C ATOM 3265 C ASP B 97 19.714 17.241 -2.972 1.00 0.00 C ATOM 3266 O ASP B 97 20.368 16.889 -2.011 1.00 0.00 O ATOM 3267 CB ASP B 97 18.114 19.003 -2.207 1.00 0.00 C ATOM 3268 CG ASP B 97 18.882 20.014 -3.064 1.00 0.00 C ATOM 3269 OD1 ASP B 97 19.433 19.609 -4.075 1.00 0.00 O ATOM 3270 OD2 ASP B 97 18.908 21.177 -2.695 1.00 0.00 O ATOM 0 H ASP B 97 18.017 16.429 -1.062 1.00 0.00 H new ATOM 0 HA ASP B 97 17.753 17.619 -3.810 1.00 0.00 H new ATOM 0 HB2 ASP B 97 17.066 19.293 -2.135 1.00 0.00 H new ATOM 0 HB3 ASP B 97 18.512 18.993 -1.192 1.00 0.00 H new ATOM 3275 N PHE B 98 20.247 17.308 -4.164 1.00 0.00 N ATOM 3276 CA PHE B 98 21.688 16.957 -4.359 1.00 0.00 C ATOM 3277 C PHE B 98 22.171 17.418 -5.741 1.00 0.00 C ATOM 3278 O PHE B 98 21.455 17.307 -6.713 1.00 0.00 O ATOM 3279 CB PHE B 98 21.851 15.435 -4.267 1.00 0.00 C ATOM 3280 CG PHE B 98 23.284 15.051 -4.546 1.00 0.00 C ATOM 3281 CD1 PHE B 98 23.729 14.913 -5.867 1.00 0.00 C ATOM 3282 CD2 PHE B 98 24.168 14.830 -3.483 1.00 0.00 C ATOM 3283 CE1 PHE B 98 25.058 14.555 -6.124 1.00 0.00 C ATOM 3284 CE2 PHE B 98 25.497 14.474 -3.741 1.00 0.00 C ATOM 3285 CZ PHE B 98 25.941 14.334 -5.062 1.00 0.00 C ATOM 0 H PHE B 98 19.750 17.589 -5.009 1.00 0.00 H new ATOM 0 HA PHE B 98 22.277 17.454 -3.588 1.00 0.00 H new ATOM 0 HB2 PHE B 98 21.560 15.089 -3.275 1.00 0.00 H new ATOM 0 HB3 PHE B 98 21.189 14.946 -4.982 1.00 0.00 H new ATOM 0 HD1 PHE B 98 23.047 15.083 -6.687 1.00 0.00 H new ATOM 0 HD2 PHE B 98 23.825 14.934 -2.464 1.00 0.00 H new ATOM 0 HE1 PHE B 98 25.401 14.449 -7.143 1.00 0.00 H new ATOM 0 HE2 PHE B 98 26.180 14.307 -2.921 1.00 0.00 H new ATOM 0 HZ PHE B 98 26.965 14.055 -5.261 1.00 0.00 H new ATOM 3295 N PRO B 99 23.375 17.925 -5.833 1.00 0.00 N ATOM 3296 CA PRO B 99 23.965 18.346 -7.138 1.00 0.00 C ATOM 3297 C PRO B 99 23.710 17.321 -8.248 1.00 0.00 C ATOM 3298 O PRO B 99 24.300 16.258 -8.265 1.00 0.00 O ATOM 3299 CB PRO B 99 25.458 18.463 -6.839 1.00 0.00 C ATOM 3300 CG PRO B 99 25.534 18.847 -5.401 1.00 0.00 C ATOM 3301 CD PRO B 99 24.326 18.191 -4.720 1.00 0.00 C ATOM 0 HA PRO B 99 23.524 19.273 -7.504 1.00 0.00 H new ATOM 0 HB2 PRO B 99 25.973 17.520 -7.023 1.00 0.00 H new ATOM 0 HB3 PRO B 99 25.930 19.213 -7.473 1.00 0.00 H new ATOM 0 HG2 PRO B 99 26.467 18.503 -4.955 1.00 0.00 H new ATOM 0 HG3 PRO B 99 25.506 19.930 -5.285 1.00 0.00 H new ATOM 0 HD2 PRO B 99 24.609 17.270 -4.210 1.00 0.00 H new ATOM 0 HD3 PRO B 99 23.887 18.849 -3.970 1.00 0.00 H new ATOM 3309 N VAL B 100 22.833 17.621 -9.168 1.00 0.00 N ATOM 3310 CA VAL B 100 22.523 16.647 -10.250 1.00 0.00 C ATOM 3311 C VAL B 100 23.483 16.844 -11.425 1.00 0.00 C ATOM 3312 O VAL B 100 23.651 17.940 -11.922 1.00 0.00 O ATOM 3313 CB VAL B 100 21.082 16.860 -10.725 1.00 0.00 C ATOM 3314 CG1 VAL B 100 20.818 18.357 -10.908 1.00 0.00 C ATOM 3315 CG2 VAL B 100 20.878 16.140 -12.061 1.00 0.00 C ATOM 0 H VAL B 100 22.318 18.500 -9.216 1.00 0.00 H new ATOM 0 HA VAL B 100 22.638 15.634 -9.864 1.00 0.00 H new ATOM 0 HB VAL B 100 20.391 16.459 -9.983 1.00 0.00 H new ATOM 0 HG11 VAL B 100 19.793 18.507 -11.246 1.00 0.00 H new ATOM 0 HG12 VAL B 100 20.966 18.871 -9.958 1.00 0.00 H new ATOM 0 HG13 VAL B 100 21.507 18.760 -11.650 1.00 0.00 H new ATOM 0 HG21 VAL B 100 19.854 16.289 -12.402 1.00 0.00 H new ATOM 0 HG22 VAL B 100 21.569 16.543 -12.801 1.00 0.00 H new ATOM 0 HG23 VAL B 100 21.066 15.074 -11.932 1.00 0.00 H new ATOM 3325 N ALA B 101 24.107 15.789 -11.873 1.00 0.00 N ATOM 3326 CA ALA B 101 25.030 15.904 -13.043 1.00 0.00 C ATOM 3327 C ALA B 101 24.571 14.951 -14.155 1.00 0.00 C ATOM 3328 O ALA B 101 24.915 13.784 -14.168 1.00 0.00 O ATOM 3329 CB ALA B 101 26.445 15.527 -12.605 1.00 0.00 C ATOM 0 H ALA B 101 24.019 14.851 -11.481 1.00 0.00 H new ATOM 0 HA ALA B 101 25.020 16.928 -13.417 1.00 0.00 H new ATOM 0 HB1 ALA B 101 27.123 15.609 -13.455 1.00 0.00 H new ATOM 0 HB2 ALA B 101 26.772 16.201 -11.813 1.00 0.00 H new ATOM 0 HB3 ALA B 101 26.450 14.502 -12.234 1.00 0.00 H new ATOM 3335 N ALA B 102 23.800 15.438 -15.089 1.00 0.00 N ATOM 3336 CA ALA B 102 23.313 14.553 -16.183 1.00 0.00 C ATOM 3337 C ALA B 102 22.960 15.397 -17.407 1.00 0.00 C ATOM 3338 O ALA B 102 22.575 16.545 -17.292 1.00 0.00 O ATOM 3339 CB ALA B 102 22.073 13.790 -15.713 1.00 0.00 C ATOM 0 H ALA B 102 23.488 16.408 -15.141 1.00 0.00 H new ATOM 0 HA ALA B 102 24.096 13.843 -16.447 1.00 0.00 H new ATOM 0 HB1 ALA B 102 21.718 13.143 -16.515 1.00 0.00 H new ATOM 0 HB2 ALA B 102 22.327 13.184 -14.843 1.00 0.00 H new ATOM 0 HB3 ALA B 102 21.289 14.499 -15.445 1.00 0.00 H new ATOM 3345 N VAL B 103 23.087 14.837 -18.579 1.00 0.00 N ATOM 3346 CA VAL B 103 22.756 15.601 -19.812 1.00 0.00 C ATOM 3347 C VAL B 103 22.253 14.633 -20.884 1.00 0.00 C ATOM 3348 O VAL B 103 21.568 15.015 -21.811 1.00 0.00 O ATOM 3349 CB VAL B 103 24.006 16.322 -20.316 1.00 0.00 C ATOM 3350 CG1 VAL B 103 24.241 17.580 -19.481 1.00 0.00 C ATOM 3351 CG2 VAL B 103 25.215 15.392 -20.190 1.00 0.00 C ATOM 0 H VAL B 103 23.407 13.881 -18.735 1.00 0.00 H new ATOM 0 HA VAL B 103 21.981 16.336 -19.592 1.00 0.00 H new ATOM 0 HB VAL B 103 23.869 16.601 -21.361 1.00 0.00 H new ATOM 0 HG11 VAL B 103 25.132 18.094 -19.840 1.00 0.00 H new ATOM 0 HG12 VAL B 103 23.380 18.242 -19.570 1.00 0.00 H new ATOM 0 HG13 VAL B 103 24.379 17.303 -18.436 1.00 0.00 H new ATOM 0 HG21 VAL B 103 26.107 15.905 -20.549 1.00 0.00 H new ATOM 0 HG22 VAL B 103 25.352 15.113 -19.145 1.00 0.00 H new ATOM 0 HG23 VAL B 103 25.048 14.495 -20.786 1.00 0.00 H new ATOM 3361 N LYS B 104 22.590 13.377 -20.762 1.00 0.00 N ATOM 3362 CA LYS B 104 22.113 12.376 -21.756 1.00 0.00 C ATOM 3363 C LYS B 104 22.502 12.836 -23.163 1.00 0.00 C ATOM 3364 O LYS B 104 23.570 13.374 -23.376 1.00 0.00 O ATOM 3365 CB LYS B 104 20.591 12.254 -21.667 1.00 0.00 C ATOM 3366 CG LYS B 104 20.167 12.164 -20.201 1.00 0.00 C ATOM 3367 CD LYS B 104 20.977 11.068 -19.503 1.00 0.00 C ATOM 3368 CE LYS B 104 20.337 10.742 -18.152 1.00 0.00 C ATOM 3369 NZ LYS B 104 19.286 9.700 -18.337 1.00 0.00 N ATOM 0 H LYS B 104 23.176 13.002 -20.016 1.00 0.00 H new ATOM 0 HA LYS B 104 22.569 11.408 -21.546 1.00 0.00 H new ATOM 0 HB2 LYS B 104 20.119 13.115 -22.140 1.00 0.00 H new ATOM 0 HB3 LYS B 104 20.255 11.369 -22.208 1.00 0.00 H new ATOM 0 HG2 LYS B 104 20.327 13.121 -19.705 1.00 0.00 H new ATOM 0 HG3 LYS B 104 19.102 11.944 -20.132 1.00 0.00 H new ATOM 0 HD2 LYS B 104 21.012 10.174 -20.126 1.00 0.00 H new ATOM 0 HD3 LYS B 104 22.006 11.397 -19.360 1.00 0.00 H new ATOM 0 HE2 LYS B 104 21.096 10.388 -17.454 1.00 0.00 H new ATOM 0 HE3 LYS B 104 19.900 11.641 -17.718 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 18.994 9.332 -17.409 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 18.464 10.118 -18.818 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 19.666 8.922 -18.914 1.00 0.00 H new ATOM 3383 N SER B 105 21.648 12.626 -24.127 1.00 0.00 N ATOM 3384 CA SER B 105 21.995 13.021 -25.519 1.00 0.00 C ATOM 3385 C SER B 105 23.253 12.267 -25.949 1.00 0.00 C ATOM 3386 O SER B 105 23.608 12.238 -27.111 1.00 0.00 O ATOM 3387 CB SER B 105 22.258 14.527 -25.566 1.00 0.00 C ATOM 3388 OG SER B 105 21.332 15.189 -24.717 1.00 0.00 O ATOM 0 H SER B 105 20.729 12.200 -24.011 1.00 0.00 H new ATOM 0 HA SER B 105 21.173 12.777 -26.192 1.00 0.00 H new ATOM 0 HB2 SER B 105 23.278 14.740 -25.248 1.00 0.00 H new ATOM 0 HB3 SER B 105 22.160 14.894 -26.588 1.00 0.00 H new ATOM 0 HG SER B 105 21.653 15.153 -23.792 1.00 0.00 H new ATOM 3394 N SER B 106 23.930 11.653 -25.018 1.00 0.00 N ATOM 3395 CA SER B 106 25.164 10.904 -25.368 1.00 0.00 C ATOM 3396 C SER B 106 24.860 9.925 -26.501 1.00 0.00 C ATOM 3397 O SER B 106 23.746 9.466 -26.660 1.00 0.00 O ATOM 3398 CB SER B 106 25.659 10.135 -24.142 1.00 0.00 C ATOM 3399 OG SER B 106 24.745 9.085 -23.846 1.00 0.00 O ATOM 0 H SER B 106 23.679 11.639 -24.029 1.00 0.00 H new ATOM 0 HA SER B 106 25.936 11.603 -25.691 1.00 0.00 H new ATOM 0 HB2 SER B 106 26.652 9.726 -24.331 1.00 0.00 H new ATOM 0 HB3 SER B 106 25.748 10.807 -23.288 1.00 0.00 H new ATOM 0 HG SER B 106 24.060 9.413 -23.227 1.00 0.00 H new ATOM 3405 N VAL B 107 25.844 9.603 -27.290 1.00 0.00 N ATOM 3406 CA VAL B 107 25.629 8.657 -28.418 1.00 0.00 C ATOM 3407 C VAL B 107 26.843 7.734 -28.515 1.00 0.00 C ATOM 3408 O VAL B 107 27.884 7.987 -27.936 1.00 0.00 O ATOM 3409 CB VAL B 107 25.477 9.442 -29.721 1.00 0.00 C ATOM 3410 CG1 VAL B 107 26.732 10.281 -29.965 1.00 0.00 C ATOM 3411 CG2 VAL B 107 25.280 8.471 -30.887 1.00 0.00 C ATOM 0 H VAL B 107 26.796 9.958 -27.201 1.00 0.00 H new ATOM 0 HA VAL B 107 24.726 8.070 -28.248 1.00 0.00 H new ATOM 0 HB VAL B 107 24.610 10.099 -29.645 1.00 0.00 H new ATOM 0 HG11 VAL B 107 26.621 10.840 -30.894 1.00 0.00 H new ATOM 0 HG12 VAL B 107 26.871 10.977 -29.138 1.00 0.00 H new ATOM 0 HG13 VAL B 107 27.600 9.625 -30.037 1.00 0.00 H new ATOM 0 HG21 VAL B 107 25.172 9.033 -31.814 1.00 0.00 H new ATOM 0 HG22 VAL B 107 26.145 7.811 -30.961 1.00 0.00 H new ATOM 0 HG23 VAL B 107 24.383 7.876 -30.717 1.00 0.00 H new ATOM 3421 N VAL B 108 26.717 6.659 -29.249 1.00 0.00 N ATOM 3422 CA VAL B 108 27.846 5.694 -29.374 1.00 0.00 C ATOM 3423 C VAL B 108 28.634 5.663 -28.072 1.00 0.00 C ATOM 3424 O VAL B 108 29.744 6.154 -27.993 1.00 0.00 O ATOM 3425 CB VAL B 108 28.767 6.142 -30.507 1.00 0.00 C ATOM 3426 CG1 VAL B 108 29.198 7.589 -30.274 1.00 0.00 C ATOM 3427 CG2 VAL B 108 30.002 5.240 -30.549 1.00 0.00 C ATOM 0 H VAL B 108 25.876 6.408 -29.769 1.00 0.00 H new ATOM 0 HA VAL B 108 27.454 4.700 -29.587 1.00 0.00 H new ATOM 0 HB VAL B 108 28.235 6.072 -31.456 1.00 0.00 H new ATOM 0 HG11 VAL B 108 29.855 7.908 -31.083 1.00 0.00 H new ATOM 0 HG12 VAL B 108 28.318 8.231 -30.247 1.00 0.00 H new ATOM 0 HG13 VAL B 108 29.729 7.662 -29.325 1.00 0.00 H new ATOM 0 HG21 VAL B 108 30.659 5.560 -31.358 1.00 0.00 H new ATOM 0 HG22 VAL B 108 30.535 5.308 -29.600 1.00 0.00 H new ATOM 0 HG23 VAL B 108 29.694 4.208 -30.719 1.00 0.00 H new ATOM 3437 N ALA B 109 28.077 5.081 -27.048 1.00 0.00 N ATOM 3438 CA ALA B 109 28.799 5.021 -25.753 1.00 0.00 C ATOM 3439 C ALA B 109 30.196 4.456 -25.999 1.00 0.00 C ATOM 3440 O ALA B 109 30.525 4.052 -27.098 1.00 0.00 O ATOM 3441 CB ALA B 109 28.037 4.111 -24.786 1.00 0.00 C ATOM 0 H ALA B 109 27.155 4.646 -27.054 1.00 0.00 H new ATOM 0 HA ALA B 109 28.874 6.018 -25.319 1.00 0.00 H new ATOM 0 HB1 ALA B 109 28.567 4.066 -23.834 1.00 0.00 H new ATOM 0 HB2 ALA B 109 27.035 4.509 -24.625 1.00 0.00 H new ATOM 0 HB3 ALA B 109 27.966 3.109 -25.209 1.00 0.00 H new ATOM 3447 N THR B 110 31.031 4.429 -25.002 1.00 0.00 N ATOM 3448 CA THR B 110 32.405 3.896 -25.209 1.00 0.00 C ATOM 3449 C THR B 110 32.344 2.379 -25.399 1.00 0.00 C ATOM 3450 O THR B 110 31.695 1.679 -24.647 1.00 0.00 O ATOM 3451 CB THR B 110 33.262 4.223 -23.984 1.00 0.00 C ATOM 3452 OG1 THR B 110 33.134 5.603 -23.674 1.00 0.00 O ATOM 3453 CG2 THR B 110 34.727 3.898 -24.276 1.00 0.00 C ATOM 0 H THR B 110 30.824 4.751 -24.056 1.00 0.00 H new ATOM 0 HA THR B 110 32.844 4.353 -26.096 1.00 0.00 H new ATOM 0 HB THR B 110 32.924 3.626 -23.137 1.00 0.00 H new ATOM 0 HG1 THR B 110 33.681 5.814 -22.889 1.00 0.00 H new ATOM 0 HG21 THR B 110 35.333 4.133 -23.401 1.00 0.00 H new ATOM 0 HG22 THR B 110 34.825 2.838 -24.512 1.00 0.00 H new ATOM 0 HG23 THR B 110 35.069 4.491 -25.124 1.00 0.00 H new ATOM 3461 N PRO B 111 33.019 1.874 -26.398 1.00 0.00 N ATOM 3462 CA PRO B 111 33.052 0.417 -26.693 1.00 0.00 C ATOM 3463 C PRO B 111 34.020 -0.338 -25.779 1.00 0.00 C ATOM 3464 CB PRO B 111 33.534 0.366 -28.143 1.00 0.00 C ATOM 3465 CG PRO B 111 34.424 1.554 -28.294 1.00 0.00 C ATOM 3466 CD PRO B 111 33.852 2.650 -27.386 1.00 0.00 C ATOM 0 HA PRO B 111 32.084 -0.057 -26.533 1.00 0.00 H new ATOM 0 HB2 PRO B 111 34.072 -0.559 -28.348 1.00 0.00 H new ATOM 0 HB3 PRO B 111 32.697 0.409 -28.839 1.00 0.00 H new ATOM 0 HG2 PRO B 111 35.447 1.310 -28.009 1.00 0.00 H new ATOM 0 HG3 PRO B 111 34.453 1.887 -29.332 1.00 0.00 H new ATOM 0 HD2 PRO B 111 34.641 3.216 -26.891 1.00 0.00 H new ATOM 0 HD3 PRO B 111 33.250 3.365 -27.947 1.00 0.00 H new TER 3474 PRO B 111