USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1229 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 78 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 80 LYS NZ :NH3+ 180:sc= 0.472 (180deg=0.472) USER MOD Set 2.1: A 1 MET CE :methyl -105:sc= -5.26! (180deg=-9.85!) USER MOD Set 2.2: B 35 THR OG1 : rot 81:sc= 0.956 USER MOD Set 3.1: A 45 THR OG1 : rot -160:sc= -0.237 USER MOD Set 3.2: B 3 LYS NZ :NH3+ -142:sc= -0.353 (180deg=-2!) USER MOD Set 4.1: A 43 GLN : amide:sc= -0.306 K(o=-0.69,f=-3.8!) USER MOD Set 4.2: A 49 ASN : amide:sc= -0.385 K(o=-0.69,f=-3.4) USER MOD Set 5.1: A 35 THR OG1 : rot -121:sc= 0.0391! USER MOD Set 5.2: B 1 MET CE :methyl 163:sc= -3.21 (180deg=-4.58!) USER MOD Single : A 1 MET N :NH3+ 145:sc= -0.536 (180deg=-3.25!) USER MOD Single : A 2 ASN : amide:sc= -0.714 K(o=-0.71,f=-4!) USER MOD Single : A 3 LYS NZ :NH3+ -141:sc= -0.594 (180deg=-3.34!) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -0.677 K(o=-0.68,f=-3.6!) USER MOD Single : A 14 THR OG1 : rot -110:sc= -9.52! USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.168 K(o=-0.17,f=-2.7!) USER MOD Single : A 20 SER OG : rot 161:sc= -8.73! USER MOD Single : A 22 SER OG : rot 180:sc= 0.0536 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl -144:sc= -7.82! (180deg=-11.9!) USER MOD Single : A 27 SER OG : rot 160:sc= -1.97 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 97:sc= -1.78! USER MOD Single : A 38 LYS NZ :NH3+ 144:sc= 0 (180deg=-0.0128) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0345) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 SER OG : rot -152:sc= 0.167 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ 148:sc= 0.0612 (180deg=-0.278) USER MOD Single : B 2 ASN : amide:sc= -3.62 K(o=-3.6,f=-14!) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 GLN : amide:sc= -0.152 K(o=-0.15,f=-0.68) USER MOD Single : B 14 THR OG1 : rot -120:sc= -5.79! USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 GLN : amide:sc= 0 X(o=0,f=-0.088) USER MOD Single : B 20 SER OG : rot -164:sc= -4.57! USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 MET CE :methyl -163:sc= -9.99! (180deg=-11!) USER MOD Single : B 27 SER OG : rot 85:sc= -0.422 USER MOD Single : B 30 LYS NZ :NH3+ -129:sc= -0.0845 (180deg=-0.855) USER MOD Single : B 33 THR OG1 : rot 119:sc= -4.87! USER MOD Single : B 38 LYS NZ :NH3+ -135:sc= 0.428 (180deg=0) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 GLN : amide:sc= -0.0972 X(o=-0.097,f=0) USER MOD Single : B 45 THR OG1 : rot -160:sc= -0.573 USER MOD Single : B 49 ASN : amide:sc=-0.00449 X(o=-0.0045,f=0) USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 84 SER OG : rot 180:sc= 0 USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.218 4.011 11.462 1.00 0.00 N ATOM 2 CA MET A 1 4.385 5.223 11.187 1.00 0.00 C ATOM 3 C MET A 1 3.030 4.828 10.624 1.00 0.00 C ATOM 4 O MET A 1 2.716 3.662 10.496 1.00 0.00 O ATOM 5 CB MET A 1 5.131 6.040 10.131 1.00 0.00 C ATOM 6 CG MET A 1 5.601 5.138 8.984 1.00 0.00 C ATOM 7 SD MET A 1 7.187 5.741 8.358 1.00 0.00 S ATOM 8 CE MET A 1 6.559 7.240 7.566 1.00 0.00 C ATOM 0 H1 MET A 1 6.217 4.225 11.267 1.00 0.00 H new ATOM 0 H2 MET A 1 5.111 3.735 12.459 1.00 0.00 H new ATOM 0 H3 MET A 1 4.906 3.229 10.851 1.00 0.00 H new ATOM 0 HA MET A 1 4.225 5.785 12.107 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.480 6.823 9.742 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.989 6.536 10.586 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.702 4.110 9.333 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.860 5.132 8.184 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.538 7.099 6.485 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.551 7.446 7.925 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.209 8.080 7.810 1.00 0.00 H new ATOM 20 N ASN A 2 2.234 5.800 10.257 1.00 0.00 N ATOM 21 CA ASN A 2 0.910 5.484 9.671 1.00 0.00 C ATOM 22 C ASN A 2 0.172 6.757 9.249 1.00 0.00 C ATOM 23 O ASN A 2 0.778 7.767 8.957 1.00 0.00 O ATOM 24 CB ASN A 2 0.137 4.740 10.769 1.00 0.00 C ATOM 25 CG ASN A 2 -0.008 5.641 11.997 1.00 0.00 C ATOM 26 OD1 ASN A 2 0.974 6.090 12.556 1.00 0.00 O ATOM 27 ND2 ASN A 2 -1.200 5.929 12.443 1.00 0.00 N ATOM 0 H ASN A 2 2.449 6.794 10.340 1.00 0.00 H new ATOM 0 HA ASN A 2 1.010 4.879 8.770 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -0.847 4.449 10.401 1.00 0.00 H new ATOM 0 HB3 ASN A 2 0.661 3.823 11.038 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -1.307 6.530 13.260 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -2.024 5.553 11.975 1.00 0.00 H new ATOM 34 N LYS A 3 -1.139 6.712 9.214 1.00 0.00 N ATOM 35 CA LYS A 3 -1.931 7.919 8.806 1.00 0.00 C ATOM 36 C LYS A 3 -1.522 9.154 9.626 1.00 0.00 C ATOM 37 O LYS A 3 -1.945 10.254 9.339 1.00 0.00 O ATOM 38 CB LYS A 3 -3.397 7.558 9.077 1.00 0.00 C ATOM 39 CG LYS A 3 -4.302 8.213 8.018 1.00 0.00 C ATOM 40 CD LYS A 3 -4.869 7.134 7.080 1.00 0.00 C ATOM 41 CE LYS A 3 -6.402 7.265 6.952 1.00 0.00 C ATOM 42 NZ LYS A 3 -6.921 7.368 8.350 1.00 0.00 N ATOM 0 H LYS A 3 -1.696 5.891 9.450 1.00 0.00 H new ATOM 0 HA LYS A 3 -1.759 8.171 7.760 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -3.524 6.476 9.057 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -3.685 7.894 10.073 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -5.116 8.750 8.504 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -3.735 8.946 7.444 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -4.409 7.224 6.096 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -4.615 6.145 7.461 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -6.672 8.146 6.369 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -6.827 6.402 6.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -7.807 6.830 8.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -6.218 6.980 9.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -7.099 8.366 8.581 1.00 0.00 H new ATOM 56 N THR A 4 -0.703 8.984 10.636 1.00 0.00 N ATOM 57 CA THR A 4 -0.268 10.155 11.456 1.00 0.00 C ATOM 58 C THR A 4 1.238 10.381 11.285 1.00 0.00 C ATOM 59 O THR A 4 1.683 11.393 10.759 1.00 0.00 O ATOM 60 CB THR A 4 -0.595 9.771 12.901 1.00 0.00 C ATOM 61 OG1 THR A 4 -1.984 9.493 13.012 1.00 0.00 O ATOM 62 CG2 THR A 4 -0.226 10.925 13.835 1.00 0.00 C ATOM 0 H THR A 4 -0.318 8.085 10.927 1.00 0.00 H new ATOM 0 HA THR A 4 -0.766 11.079 11.161 1.00 0.00 H new ATOM 0 HB THR A 4 -0.024 8.886 13.180 1.00 0.00 H new ATOM 0 HG1 THR A 4 -2.195 9.245 13.936 1.00 0.00 H new ATOM 0 HG21 THR A 4 -0.460 10.650 14.863 1.00 0.00 H new ATOM 0 HG22 THR A 4 0.840 11.136 13.749 1.00 0.00 H new ATOM 0 HG23 THR A 4 -0.795 11.813 13.559 1.00 0.00 H new ATOM 70 N GLU A 5 2.036 9.441 11.712 1.00 0.00 N ATOM 71 CA GLU A 5 3.508 9.607 11.561 1.00 0.00 C ATOM 72 C GLU A 5 3.819 10.020 10.126 1.00 0.00 C ATOM 73 O GLU A 5 4.636 10.887 9.882 1.00 0.00 O ATOM 74 CB GLU A 5 4.119 8.248 11.894 1.00 0.00 C ATOM 75 CG GLU A 5 4.456 8.187 13.388 1.00 0.00 C ATOM 76 CD GLU A 5 5.972 8.096 13.570 1.00 0.00 C ATOM 77 OE1 GLU A 5 6.582 7.285 12.892 1.00 0.00 O ATOM 78 OE2 GLU A 5 6.497 8.838 14.384 1.00 0.00 O ATOM 0 H GLU A 5 1.735 8.573 12.155 1.00 0.00 H new ATOM 0 HA GLU A 5 3.914 10.378 12.216 1.00 0.00 H new ATOM 0 HB2 GLU A 5 3.421 7.451 11.636 1.00 0.00 H new ATOM 0 HB3 GLU A 5 5.019 8.088 11.301 1.00 0.00 H new ATOM 0 HG2 GLU A 5 4.072 9.073 13.894 1.00 0.00 H new ATOM 0 HG3 GLU A 5 3.972 7.324 13.845 1.00 0.00 H new ATOM 85 N LEU A 6 3.148 9.427 9.172 1.00 0.00 N ATOM 86 CA LEU A 6 3.388 9.823 7.756 1.00 0.00 C ATOM 87 C LEU A 6 3.029 11.301 7.567 1.00 0.00 C ATOM 88 O LEU A 6 3.678 12.008 6.817 1.00 0.00 O ATOM 89 CB LEU A 6 2.476 8.932 6.910 1.00 0.00 C ATOM 90 CG LEU A 6 3.030 7.506 6.885 1.00 0.00 C ATOM 91 CD1 LEU A 6 1.910 6.528 6.525 1.00 0.00 C ATOM 92 CD2 LEU A 6 4.142 7.411 5.839 1.00 0.00 C ATOM 0 H LEU A 6 2.452 8.694 9.311 1.00 0.00 H new ATOM 0 HA LEU A 6 4.432 9.701 7.467 1.00 0.00 H new ATOM 0 HB2 LEU A 6 1.466 8.933 7.321 1.00 0.00 H new ATOM 0 HB3 LEU A 6 2.408 9.324 5.895 1.00 0.00 H new ATOM 0 HG LEU A 6 3.430 7.255 7.868 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.305 5.512 6.507 1.00 0.00 H new ATOM 0 HD12 LEU A 6 1.115 6.595 7.268 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.510 6.779 5.543 1.00 0.00 H new ATOM 0 HD21 LEU A 6 4.538 6.396 5.820 1.00 0.00 H new ATOM 0 HD22 LEU A 6 3.741 7.662 4.857 1.00 0.00 H new ATOM 0 HD23 LEU A 6 4.941 8.107 6.093 1.00 0.00 H new ATOM 104 N ILE A 7 2.014 11.794 8.253 1.00 0.00 N ATOM 105 CA ILE A 7 1.672 13.239 8.093 1.00 0.00 C ATOM 106 C ILE A 7 2.910 14.044 8.447 1.00 0.00 C ATOM 107 O ILE A 7 3.242 15.008 7.793 1.00 0.00 O ATOM 108 CB ILE A 7 0.483 13.567 9.029 1.00 0.00 C ATOM 109 CG1 ILE A 7 0.940 13.781 10.482 1.00 0.00 C ATOM 110 CG2 ILE A 7 -0.554 12.448 8.981 1.00 0.00 C ATOM 111 CD1 ILE A 7 0.991 15.280 10.786 1.00 0.00 C ATOM 0 H ILE A 7 1.426 11.268 8.899 1.00 0.00 H new ATOM 0 HA ILE A 7 1.374 13.482 7.073 1.00 0.00 H new ATOM 0 HB ILE A 7 0.038 14.496 8.673 1.00 0.00 H new ATOM 0 HG12 ILE A 7 0.254 13.283 11.167 1.00 0.00 H new ATOM 0 HG13 ILE A 7 1.923 13.335 10.635 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -1.384 12.692 9.644 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -0.924 12.338 7.962 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -0.096 11.513 9.303 1.00 0.00 H new ATOM 0 HD11 ILE A 7 1.315 15.432 11.816 1.00 0.00 H new ATOM 0 HD12 ILE A 7 1.695 15.765 10.109 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -0.000 15.713 10.650 1.00 0.00 H new ATOM 123 N LYS A 8 3.627 13.612 9.450 1.00 0.00 N ATOM 124 CA LYS A 8 4.886 14.321 9.810 1.00 0.00 C ATOM 125 C LYS A 8 5.862 14.142 8.657 1.00 0.00 C ATOM 126 O LYS A 8 6.569 15.052 8.273 1.00 0.00 O ATOM 127 CB LYS A 8 5.453 13.638 11.062 1.00 0.00 C ATOM 128 CG LYS A 8 4.350 13.336 12.084 1.00 0.00 C ATOM 129 CD LYS A 8 4.975 12.690 13.328 1.00 0.00 C ATOM 130 CE LYS A 8 5.797 11.456 12.921 1.00 0.00 C ATOM 131 NZ LYS A 8 7.193 11.766 13.336 1.00 0.00 N ATOM 0 H LYS A 8 3.397 12.805 10.030 1.00 0.00 H new ATOM 0 HA LYS A 8 4.717 15.381 9.998 1.00 0.00 H new ATOM 0 HB2 LYS A 8 5.952 12.711 10.778 1.00 0.00 H new ATOM 0 HB3 LYS A 8 6.207 14.279 11.518 1.00 0.00 H new ATOM 0 HG2 LYS A 8 3.831 14.254 12.359 1.00 0.00 H new ATOM 0 HG3 LYS A 8 3.607 12.668 11.648 1.00 0.00 H new ATOM 0 HD2 LYS A 8 5.613 13.410 13.840 1.00 0.00 H new ATOM 0 HD3 LYS A 8 4.193 12.401 14.030 1.00 0.00 H new ATOM 0 HE2 LYS A 8 5.429 10.557 13.415 1.00 0.00 H new ATOM 0 HE3 LYS A 8 5.735 11.278 11.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 7.813 10.968 13.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 7.519 12.623 12.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 7.223 11.924 14.364 1.00 0.00 H new ATOM 145 N ALA A 9 5.887 12.960 8.092 1.00 0.00 N ATOM 146 CA ALA A 9 6.795 12.690 6.946 1.00 0.00 C ATOM 147 C ALA A 9 6.600 13.761 5.881 1.00 0.00 C ATOM 148 O ALA A 9 7.541 14.216 5.267 1.00 0.00 O ATOM 149 CB ALA A 9 6.363 11.330 6.415 1.00 0.00 C ATOM 0 H ALA A 9 5.312 12.169 8.381 1.00 0.00 H new ATOM 0 HA ALA A 9 7.847 12.699 7.231 1.00 0.00 H new ATOM 0 HB1 ALA A 9 6.987 11.057 5.564 1.00 0.00 H new ATOM 0 HB2 ALA A 9 6.472 10.582 7.200 1.00 0.00 H new ATOM 0 HB3 ALA A 9 5.320 11.377 6.100 1.00 0.00 H new ATOM 155 N ILE A 10 5.384 14.197 5.685 1.00 0.00 N ATOM 156 CA ILE A 10 5.137 15.258 4.702 1.00 0.00 C ATOM 157 C ILE A 10 5.207 16.576 5.452 1.00 0.00 C ATOM 158 O ILE A 10 5.627 17.587 4.939 1.00 0.00 O ATOM 159 CB ILE A 10 3.728 14.964 4.162 1.00 0.00 C ATOM 160 CG1 ILE A 10 3.831 14.178 2.852 1.00 0.00 C ATOM 161 CG2 ILE A 10 2.959 16.266 3.913 1.00 0.00 C ATOM 162 CD1 ILE A 10 4.637 12.896 3.074 1.00 0.00 C ATOM 0 H ILE A 10 4.556 13.854 6.172 1.00 0.00 H new ATOM 0 HA ILE A 10 5.849 15.305 3.878 1.00 0.00 H new ATOM 0 HB ILE A 10 3.190 14.376 4.906 1.00 0.00 H new ATOM 0 HG12 ILE A 10 2.834 13.932 2.486 1.00 0.00 H new ATOM 0 HG13 ILE A 10 4.309 14.790 2.087 1.00 0.00 H new ATOM 0 HG21 ILE A 10 1.965 16.034 3.531 1.00 0.00 H new ATOM 0 HG22 ILE A 10 2.869 16.820 4.848 1.00 0.00 H new ATOM 0 HG23 ILE A 10 3.496 16.872 3.183 1.00 0.00 H new ATOM 0 HD11 ILE A 10 4.706 12.343 2.137 1.00 0.00 H new ATOM 0 HD12 ILE A 10 5.639 13.151 3.419 1.00 0.00 H new ATOM 0 HD13 ILE A 10 4.141 12.280 3.824 1.00 0.00 H new ATOM 174 N ALA A 11 4.843 16.565 6.690 1.00 0.00 N ATOM 175 CA ALA A 11 4.937 17.815 7.463 1.00 0.00 C ATOM 176 C ALA A 11 6.417 18.187 7.608 1.00 0.00 C ATOM 177 O ALA A 11 6.757 19.268 8.048 1.00 0.00 O ATOM 178 CB ALA A 11 4.306 17.479 8.813 1.00 0.00 C ATOM 0 H ALA A 11 4.488 15.754 7.196 1.00 0.00 H new ATOM 0 HA ALA A 11 4.435 18.663 6.997 1.00 0.00 H new ATOM 0 HB1 ALA A 11 4.333 18.358 9.456 1.00 0.00 H new ATOM 0 HB2 ALA A 11 3.271 17.170 8.664 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.862 16.668 9.283 1.00 0.00 H new ATOM 184 N GLN A 12 7.303 17.292 7.228 1.00 0.00 N ATOM 185 CA GLN A 12 8.752 17.590 7.328 1.00 0.00 C ATOM 186 C GLN A 12 9.408 17.530 5.941 1.00 0.00 C ATOM 187 O GLN A 12 10.190 18.392 5.589 1.00 0.00 O ATOM 188 CB GLN A 12 9.316 16.521 8.275 1.00 0.00 C ATOM 189 CG GLN A 12 9.425 15.174 7.552 1.00 0.00 C ATOM 190 CD GLN A 12 9.875 14.097 8.542 1.00 0.00 C ATOM 191 OE1 GLN A 12 9.064 13.361 9.067 1.00 0.00 O ATOM 192 NE2 GLN A 12 11.144 13.975 8.821 1.00 0.00 N ATOM 0 H GLN A 12 7.075 16.371 6.854 1.00 0.00 H new ATOM 0 HA GLN A 12 8.948 18.593 7.707 1.00 0.00 H new ATOM 0 HB2 GLN A 12 10.297 16.828 8.637 1.00 0.00 H new ATOM 0 HB3 GLN A 12 8.671 16.422 9.148 1.00 0.00 H new ATOM 0 HG2 GLN A 12 8.463 14.904 7.117 1.00 0.00 H new ATOM 0 HG3 GLN A 12 10.137 15.247 6.730 1.00 0.00 H new ATOM 0 HE21 GLN A 12 11.825 14.593 8.380 1.00 0.00 H new ATOM 0 HE22 GLN A 12 11.455 13.261 9.480 1.00 0.00 H new ATOM 201 N ASP A 13 9.069 16.557 5.130 1.00 0.00 N ATOM 202 CA ASP A 13 9.658 16.521 3.756 1.00 0.00 C ATOM 203 C ASP A 13 9.049 17.685 2.998 1.00 0.00 C ATOM 204 O ASP A 13 9.667 18.329 2.174 1.00 0.00 O ATOM 205 CB ASP A 13 9.213 15.196 3.138 1.00 0.00 C ATOM 206 CG ASP A 13 10.117 14.067 3.637 1.00 0.00 C ATOM 207 OD1 ASP A 13 11.244 13.990 3.175 1.00 0.00 O ATOM 208 OD2 ASP A 13 9.671 13.300 4.473 1.00 0.00 O ATOM 0 H ASP A 13 8.423 15.800 5.354 1.00 0.00 H new ATOM 0 HA ASP A 13 10.745 16.597 3.741 1.00 0.00 H new ATOM 0 HB2 ASP A 13 8.176 14.989 3.404 1.00 0.00 H new ATOM 0 HB3 ASP A 13 9.257 15.257 2.051 1.00 0.00 H new ATOM 213 N THR A 14 7.825 17.955 3.327 1.00 0.00 N ATOM 214 CA THR A 14 7.079 19.072 2.722 1.00 0.00 C ATOM 215 C THR A 14 7.224 20.278 3.663 1.00 0.00 C ATOM 216 O THR A 14 7.945 21.216 3.384 1.00 0.00 O ATOM 217 CB THR A 14 5.644 18.530 2.673 1.00 0.00 C ATOM 218 OG1 THR A 14 5.661 17.148 2.981 1.00 0.00 O ATOM 219 CG2 THR A 14 5.067 18.666 1.288 1.00 0.00 C ATOM 0 H THR A 14 7.295 17.424 4.018 1.00 0.00 H new ATOM 0 HA THR A 14 7.411 19.397 1.736 1.00 0.00 H new ATOM 0 HB THR A 14 5.044 19.096 3.385 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.449 16.631 2.176 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.049 18.275 1.278 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.055 19.717 1.000 1.00 0.00 H new ATOM 0 HG23 THR A 14 5.679 18.104 0.582 1.00 0.00 H new ATOM 227 N GLY A 15 6.579 20.228 4.800 1.00 0.00 N ATOM 228 CA GLY A 15 6.705 21.333 5.806 1.00 0.00 C ATOM 229 C GLY A 15 6.300 22.675 5.202 1.00 0.00 C ATOM 230 O GLY A 15 6.625 23.725 5.722 1.00 0.00 O ATOM 0 H GLY A 15 5.964 19.464 5.080 1.00 0.00 H new ATOM 0 HA2 GLY A 15 6.077 21.115 6.670 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.733 21.387 6.164 1.00 0.00 H new ATOM 234 N LEU A 16 5.587 22.649 4.121 1.00 0.00 N ATOM 235 CA LEU A 16 5.144 23.928 3.482 1.00 0.00 C ATOM 236 C LEU A 16 4.215 24.677 4.420 1.00 0.00 C ATOM 237 O LEU A 16 4.536 25.728 4.941 1.00 0.00 O ATOM 238 CB LEU A 16 4.372 23.514 2.233 1.00 0.00 C ATOM 239 CG LEU A 16 5.328 22.874 1.243 1.00 0.00 C ATOM 240 CD1 LEU A 16 5.243 21.363 1.364 1.00 0.00 C ATOM 241 CD2 LEU A 16 4.943 23.286 -0.184 1.00 0.00 C ATOM 0 H LEU A 16 5.286 21.799 3.644 1.00 0.00 H new ATOM 0 HA LEU A 16 5.988 24.577 3.250 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.580 22.813 2.497 1.00 0.00 H new ATOM 0 HB3 LEU A 16 3.892 24.383 1.783 1.00 0.00 H new ATOM 0 HG LEU A 16 6.344 23.205 1.458 1.00 0.00 H new ATOM 0 HD11 LEU A 16 5.929 20.902 0.654 1.00 0.00 H new ATOM 0 HD12 LEU A 16 5.514 21.063 2.376 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.225 21.037 1.149 1.00 0.00 H new ATOM 0 HD21 LEU A 16 5.630 22.826 -0.894 1.00 0.00 H new ATOM 0 HD22 LEU A 16 3.926 22.955 -0.397 1.00 0.00 H new ATOM 0 HD23 LEU A 16 4.998 24.371 -0.277 1.00 0.00 H new ATOM 253 N THR A 17 3.061 24.129 4.629 1.00 0.00 N ATOM 254 CA THR A 17 2.073 24.765 5.521 1.00 0.00 C ATOM 255 C THR A 17 1.476 23.704 6.435 1.00 0.00 C ATOM 256 O THR A 17 0.499 23.941 7.121 1.00 0.00 O ATOM 257 CB THR A 17 1.007 25.323 4.563 1.00 0.00 C ATOM 258 OG1 THR A 17 0.544 26.576 5.046 1.00 0.00 O ATOM 259 CG2 THR A 17 -0.172 24.350 4.452 1.00 0.00 C ATOM 0 H THR A 17 2.756 23.250 4.210 1.00 0.00 H new ATOM 0 HA THR A 17 2.495 25.542 6.158 1.00 0.00 H new ATOM 0 HB THR A 17 1.452 25.451 3.576 1.00 0.00 H new ATOM 0 HG1 THR A 17 -0.134 26.932 4.435 1.00 0.00 H new ATOM 0 HG21 THR A 17 -0.918 24.759 3.771 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.182 23.392 4.071 1.00 0.00 H new ATOM 0 HG23 THR A 17 -0.619 24.206 5.436 1.00 0.00 H new ATOM 267 N GLN A 18 2.010 22.509 6.399 1.00 0.00 N ATOM 268 CA GLN A 18 1.411 21.416 7.202 1.00 0.00 C ATOM 269 C GLN A 18 -0.036 21.293 6.744 1.00 0.00 C ATOM 270 O GLN A 18 -0.905 20.879 7.482 1.00 0.00 O ATOM 271 CB GLN A 18 1.504 21.848 8.670 1.00 0.00 C ATOM 272 CG GLN A 18 2.903 22.398 8.953 1.00 0.00 C ATOM 273 CD GLN A 18 3.251 22.191 10.429 1.00 0.00 C ATOM 274 OE1 GLN A 18 2.514 21.559 11.160 1.00 0.00 O ATOM 275 NE2 GLN A 18 4.355 22.703 10.903 1.00 0.00 N ATOM 0 H GLN A 18 2.830 22.250 5.850 1.00 0.00 H new ATOM 0 HA GLN A 18 1.909 20.454 7.084 1.00 0.00 H new ATOM 0 HB2 GLN A 18 0.753 22.608 8.885 1.00 0.00 H new ATOM 0 HB3 GLN A 18 1.296 21.001 9.323 1.00 0.00 H new ATOM 0 HG2 GLN A 18 3.636 21.895 8.323 1.00 0.00 H new ATOM 0 HG3 GLN A 18 2.944 23.459 8.705 1.00 0.00 H new ATOM 0 HE21 GLN A 18 4.975 23.234 10.291 1.00 0.00 H new ATOM 0 HE22 GLN A 18 4.597 22.572 11.885 1.00 0.00 H new ATOM 284 N VAL A 19 -0.265 21.683 5.503 1.00 0.00 N ATOM 285 CA VAL A 19 -1.629 21.653 4.885 1.00 0.00 C ATOM 286 C VAL A 19 -2.622 20.987 5.833 1.00 0.00 C ATOM 287 O VAL A 19 -3.122 21.595 6.761 1.00 0.00 O ATOM 288 CB VAL A 19 -1.436 20.889 3.532 1.00 0.00 C ATOM 289 CG1 VAL A 19 -0.389 19.787 3.675 1.00 0.00 C ATOM 290 CG2 VAL A 19 -2.733 20.234 3.019 1.00 0.00 C ATOM 0 H VAL A 19 0.464 22.030 4.880 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.048 22.642 4.699 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.116 21.645 2.815 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -0.272 19.270 2.722 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.564 20.227 3.969 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -0.710 19.076 4.436 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.534 19.720 2.079 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.094 19.516 3.755 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -3.490 21.002 2.860 1.00 0.00 H new ATOM 300 N SER A 20 -2.876 19.755 5.625 1.00 0.00 N ATOM 301 CA SER A 20 -3.773 19.001 6.480 1.00 0.00 C ATOM 302 C SER A 20 -3.085 17.676 6.733 1.00 0.00 C ATOM 303 O SER A 20 -3.726 16.685 6.958 1.00 0.00 O ATOM 304 CB SER A 20 -5.063 18.879 5.677 1.00 0.00 C ATOM 305 OG SER A 20 -5.055 17.672 4.936 1.00 0.00 O ATOM 0 H SER A 20 -2.476 19.215 4.857 1.00 0.00 H new ATOM 0 HA SER A 20 -4.004 19.445 7.448 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.922 18.899 6.347 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.164 19.730 5.003 1.00 0.00 H new ATOM 0 HG SER A 20 -5.971 17.444 4.673 1.00 0.00 H new ATOM 311 N VAL A 21 -1.764 17.655 6.632 1.00 0.00 N ATOM 312 CA VAL A 21 -0.966 16.401 6.820 1.00 0.00 C ATOM 313 C VAL A 21 -1.777 15.366 7.568 1.00 0.00 C ATOM 314 O VAL A 21 -1.767 14.187 7.263 1.00 0.00 O ATOM 315 CB VAL A 21 0.248 16.842 7.642 1.00 0.00 C ATOM 316 CG1 VAL A 21 1.085 17.830 6.828 1.00 0.00 C ATOM 317 CG2 VAL A 21 -0.216 17.519 8.937 1.00 0.00 C ATOM 0 H VAL A 21 -1.201 18.479 6.422 1.00 0.00 H new ATOM 0 HA VAL A 21 -0.678 15.941 5.875 1.00 0.00 H new ATOM 0 HB VAL A 21 0.849 15.966 7.888 1.00 0.00 H new ATOM 0 HG11 VAL A 21 1.949 18.144 7.414 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.424 17.350 5.910 1.00 0.00 H new ATOM 0 HG13 VAL A 21 0.479 18.702 6.580 1.00 0.00 H new ATOM 0 HG21 VAL A 21 0.653 17.830 9.517 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -0.822 18.392 8.694 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -0.810 16.817 9.522 1.00 0.00 H new ATOM 327 N SER A 22 -2.518 15.830 8.512 1.00 0.00 N ATOM 328 CA SER A 22 -3.392 14.912 9.294 1.00 0.00 C ATOM 329 C SER A 22 -4.649 14.606 8.484 1.00 0.00 C ATOM 330 O SER A 22 -5.170 13.507 8.506 1.00 0.00 O ATOM 331 CB SER A 22 -3.740 15.674 10.572 1.00 0.00 C ATOM 332 OG SER A 22 -4.235 16.962 10.231 1.00 0.00 O ATOM 0 H SER A 22 -2.564 16.811 8.786 1.00 0.00 H new ATOM 0 HA SER A 22 -2.909 13.962 9.522 1.00 0.00 H new ATOM 0 HB2 SER A 22 -4.487 15.125 11.145 1.00 0.00 H new ATOM 0 HB3 SER A 22 -2.858 15.767 11.205 1.00 0.00 H new ATOM 0 HG SER A 22 -4.461 17.453 11.049 1.00 0.00 H new ATOM 338 N LYS A 23 -5.129 15.577 7.765 1.00 0.00 N ATOM 339 CA LYS A 23 -6.340 15.381 6.942 1.00 0.00 C ATOM 340 C LYS A 23 -5.990 14.939 5.519 1.00 0.00 C ATOM 341 O LYS A 23 -6.730 14.188 4.919 1.00 0.00 O ATOM 342 CB LYS A 23 -7.018 16.742 6.939 1.00 0.00 C ATOM 343 CG LYS A 23 -8.034 16.809 8.077 1.00 0.00 C ATOM 344 CD LYS A 23 -7.589 17.845 9.116 1.00 0.00 C ATOM 345 CE LYS A 23 -7.383 19.205 8.439 1.00 0.00 C ATOM 346 NZ LYS A 23 -8.043 20.188 9.341 1.00 0.00 N ATOM 0 H LYS A 23 -4.724 16.512 7.715 1.00 0.00 H new ATOM 0 HA LYS A 23 -6.981 14.595 7.341 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -6.274 17.531 7.055 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.515 16.910 5.984 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.016 17.074 7.684 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -8.132 15.830 8.546 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -8.339 17.930 9.902 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -6.663 17.522 9.592 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -6.323 19.429 8.319 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -7.828 19.222 7.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -7.944 21.144 8.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -9.052 19.953 9.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -7.594 20.154 10.279 1.00 0.00 H new ATOM 360 N MET A 24 -4.881 15.367 4.957 1.00 0.00 N ATOM 361 CA MET A 24 -4.577 14.898 3.576 1.00 0.00 C ATOM 362 C MET A 24 -4.161 13.436 3.655 1.00 0.00 C ATOM 363 O MET A 24 -4.424 12.665 2.753 1.00 0.00 O ATOM 364 CB MET A 24 -3.465 15.775 2.960 1.00 0.00 C ATOM 365 CG MET A 24 -2.699 16.583 4.007 1.00 0.00 C ATOM 366 SD MET A 24 -0.956 16.561 3.564 1.00 0.00 S ATOM 367 CE MET A 24 -0.791 14.789 3.836 1.00 0.00 C ATOM 0 H MET A 24 -4.200 15.997 5.380 1.00 0.00 H new ATOM 0 HA MET A 24 -5.453 14.984 2.933 1.00 0.00 H new ATOM 0 HB2 MET A 24 -2.766 15.139 2.416 1.00 0.00 H new ATOM 0 HB3 MET A 24 -3.907 16.457 2.234 1.00 0.00 H new ATOM 0 HG2 MET A 24 -3.070 17.607 4.043 1.00 0.00 H new ATOM 0 HG3 MET A 24 -2.845 16.156 4.999 1.00 0.00 H new ATOM 0 HE1 MET A 24 0.192 14.575 4.254 1.00 0.00 H new ATOM 0 HE2 MET A 24 -1.561 14.454 4.531 1.00 0.00 H new ATOM 0 HE3 MET A 24 -0.904 14.263 2.888 1.00 0.00 H new ATOM 377 N LEU A 25 -3.560 13.023 4.747 1.00 0.00 N ATOM 378 CA LEU A 25 -3.205 11.585 4.867 1.00 0.00 C ATOM 379 C LEU A 25 -4.449 10.832 5.325 1.00 0.00 C ATOM 380 O LEU A 25 -4.733 9.742 4.871 1.00 0.00 O ATOM 381 CB LEU A 25 -2.089 11.495 5.911 1.00 0.00 C ATOM 382 CG LEU A 25 -0.751 12.005 5.340 1.00 0.00 C ATOM 383 CD1 LEU A 25 0.398 11.227 5.981 1.00 0.00 C ATOM 384 CD2 LEU A 25 -0.688 11.805 3.820 1.00 0.00 C ATOM 0 H LEU A 25 -3.307 13.611 5.541 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.865 11.152 3.926 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -2.360 12.081 6.789 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.977 10.462 6.240 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.669 13.069 5.560 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.347 11.584 5.581 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.381 11.376 7.061 1.00 0.00 H new ATOM 0 HD13 LEU A 25 0.287 10.166 5.759 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.266 12.173 3.444 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.784 10.744 3.588 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.501 12.355 3.347 1.00 0.00 H new ATOM 396 N ALA A 26 -5.222 11.432 6.192 1.00 0.00 N ATOM 397 CA ALA A 26 -6.479 10.774 6.636 1.00 0.00 C ATOM 398 C ALA A 26 -7.428 10.731 5.438 1.00 0.00 C ATOM 399 O ALA A 26 -8.176 9.789 5.241 1.00 0.00 O ATOM 400 CB ALA A 26 -7.041 11.668 7.743 1.00 0.00 C ATOM 0 H ALA A 26 -5.036 12.344 6.608 1.00 0.00 H new ATOM 0 HA ALA A 26 -6.334 9.757 7.001 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -7.971 11.242 8.118 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -6.319 11.736 8.557 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -7.233 12.664 7.344 1.00 0.00 H new ATOM 406 N SER A 27 -7.363 11.741 4.609 1.00 0.00 N ATOM 407 CA SER A 27 -8.220 11.764 3.395 1.00 0.00 C ATOM 408 C SER A 27 -7.539 10.934 2.318 1.00 0.00 C ATOM 409 O SER A 27 -8.184 10.312 1.502 1.00 0.00 O ATOM 410 CB SER A 27 -8.314 13.229 2.972 1.00 0.00 C ATOM 411 OG SER A 27 -7.064 13.644 2.442 1.00 0.00 O ATOM 0 H SER A 27 -6.752 12.549 4.724 1.00 0.00 H new ATOM 0 HA SER A 27 -9.215 11.353 3.569 1.00 0.00 H new ATOM 0 HB2 SER A 27 -9.098 13.355 2.226 1.00 0.00 H new ATOM 0 HB3 SER A 27 -8.584 13.850 3.826 1.00 0.00 H new ATOM 0 HG SER A 27 -7.192 14.443 1.889 1.00 0.00 H new ATOM 417 N PHE A 28 -6.230 10.896 2.336 1.00 0.00 N ATOM 418 CA PHE A 28 -5.486 10.075 1.337 1.00 0.00 C ATOM 419 C PHE A 28 -6.052 8.671 1.379 1.00 0.00 C ATOM 420 O PHE A 28 -6.374 8.098 0.367 1.00 0.00 O ATOM 421 CB PHE A 28 -4.025 10.129 1.799 1.00 0.00 C ATOM 422 CG PHE A 28 -3.268 8.866 1.436 1.00 0.00 C ATOM 423 CD1 PHE A 28 -3.413 7.701 2.205 1.00 0.00 C ATOM 424 CD2 PHE A 28 -2.380 8.874 0.354 1.00 0.00 C ATOM 425 CE1 PHE A 28 -2.681 6.558 1.885 1.00 0.00 C ATOM 426 CE2 PHE A 28 -1.642 7.733 0.042 1.00 0.00 C ATOM 427 CZ PHE A 28 -1.792 6.572 0.806 1.00 0.00 C ATOM 0 H PHE A 28 -5.645 11.400 3.002 1.00 0.00 H new ATOM 0 HA PHE A 28 -5.569 10.427 0.309 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -3.533 10.990 1.346 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -3.991 10.274 2.879 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -4.092 7.690 3.045 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -2.266 9.768 -0.242 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -2.801 5.660 2.472 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -0.954 7.746 -0.790 1.00 0.00 H new ATOM 0 HZ PHE A 28 -1.222 5.687 0.563 1.00 0.00 H new ATOM 437 N GLU A 29 -6.246 8.134 2.541 1.00 0.00 N ATOM 438 CA GLU A 29 -6.858 6.804 2.601 1.00 0.00 C ATOM 439 C GLU A 29 -8.302 6.957 2.174 1.00 0.00 C ATOM 440 O GLU A 29 -8.858 6.123 1.490 1.00 0.00 O ATOM 441 CB GLU A 29 -6.787 6.365 4.046 1.00 0.00 C ATOM 442 CG GLU A 29 -7.376 4.967 4.128 1.00 0.00 C ATOM 443 CD GLU A 29 -8.674 4.993 4.939 1.00 0.00 C ATOM 444 OE1 GLU A 29 -8.595 4.864 6.149 1.00 0.00 O ATOM 445 OE2 GLU A 29 -9.724 5.141 4.336 1.00 0.00 O ATOM 0 H GLU A 29 -6.009 8.557 3.438 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.362 6.076 1.960 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -5.755 6.367 4.397 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -7.342 7.053 4.683 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -7.571 4.586 3.125 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -6.661 4.289 4.593 1.00 0.00 H new ATOM 452 N LYS A 30 -8.905 8.052 2.551 1.00 0.00 N ATOM 453 CA LYS A 30 -10.302 8.284 2.140 1.00 0.00 C ATOM 454 C LYS A 30 -10.350 8.362 0.623 1.00 0.00 C ATOM 455 O LYS A 30 -11.345 8.094 0.028 1.00 0.00 O ATOM 456 CB LYS A 30 -10.720 9.613 2.762 1.00 0.00 C ATOM 457 CG LYS A 30 -12.230 9.780 2.596 1.00 0.00 C ATOM 458 CD LYS A 30 -12.682 11.078 3.266 1.00 0.00 C ATOM 459 CE LYS A 30 -13.904 11.637 2.532 1.00 0.00 C ATOM 460 NZ LYS A 30 -13.593 13.074 2.301 1.00 0.00 N ATOM 0 H LYS A 30 -8.487 8.786 3.122 1.00 0.00 H new ATOM 0 HA LYS A 30 -10.971 7.487 2.465 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -10.451 9.637 3.818 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -10.194 10.437 2.281 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -12.490 9.796 1.537 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -12.750 8.931 3.039 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -12.927 10.893 4.312 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -11.872 11.807 3.252 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -14.072 11.114 1.591 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -14.809 11.520 3.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -14.386 13.525 1.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -13.445 13.548 3.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -12.731 13.154 1.725 1.00 0.00 H new ATOM 474 N ILE A 31 -9.263 8.687 -0.016 1.00 0.00 N ATOM 475 CA ILE A 31 -9.286 8.726 -1.501 1.00 0.00 C ATOM 476 C ILE A 31 -8.592 7.489 -2.044 1.00 0.00 C ATOM 477 O ILE A 31 -8.923 6.991 -3.094 1.00 0.00 O ATOM 478 CB ILE A 31 -8.600 10.009 -1.952 1.00 0.00 C ATOM 479 CG1 ILE A 31 -7.398 10.362 -1.092 1.00 0.00 C ATOM 480 CG2 ILE A 31 -9.615 11.149 -1.915 1.00 0.00 C ATOM 481 CD1 ILE A 31 -6.160 10.379 -1.985 1.00 0.00 C ATOM 0 H ILE A 31 -8.371 8.924 0.419 1.00 0.00 H new ATOM 0 HA ILE A 31 -10.307 8.724 -1.884 1.00 0.00 H new ATOM 0 HB ILE A 31 -8.229 9.853 -2.965 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -7.540 11.335 -0.621 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.278 9.634 -0.290 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -9.135 12.074 -2.236 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -10.445 10.919 -2.584 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -9.991 11.269 -0.899 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.284 10.631 -1.387 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -6.022 9.396 -2.435 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -6.289 11.123 -2.771 1.00 0.00 H new ATOM 493 N ILE A 32 -7.666 6.962 -1.306 1.00 0.00 N ATOM 494 CA ILE A 32 -6.987 5.714 -1.746 1.00 0.00 C ATOM 495 C ILE A 32 -7.964 4.576 -1.584 1.00 0.00 C ATOM 496 O ILE A 32 -8.274 3.859 -2.516 1.00 0.00 O ATOM 497 CB ILE A 32 -5.812 5.503 -0.798 1.00 0.00 C ATOM 498 CG1 ILE A 32 -4.828 6.680 -0.910 1.00 0.00 C ATOM 499 CG2 ILE A 32 -5.110 4.194 -1.172 1.00 0.00 C ATOM 500 CD1 ILE A 32 -3.582 6.255 -1.681 1.00 0.00 C ATOM 0 H ILE A 32 -7.346 7.340 -0.414 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.650 5.768 -2.781 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.170 5.449 0.230 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -5.308 7.518 -1.415 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -4.548 7.025 0.085 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -4.266 4.029 -0.502 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -5.813 3.366 -1.081 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.751 4.254 -2.199 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -2.894 7.097 -1.753 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -3.094 5.432 -1.159 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -3.866 5.932 -2.682 1.00 0.00 H new ATOM 512 N THR A 33 -8.461 4.416 -0.396 1.00 0.00 N ATOM 513 CA THR A 33 -9.429 3.340 -0.157 1.00 0.00 C ATOM 514 C THR A 33 -10.734 3.699 -0.877 1.00 0.00 C ATOM 515 O THR A 33 -11.406 2.843 -1.425 1.00 0.00 O ATOM 516 CB THR A 33 -9.570 3.263 1.373 1.00 0.00 C ATOM 517 OG1 THR A 33 -9.091 2.007 1.823 1.00 0.00 O ATOM 518 CG2 THR A 33 -11.025 3.418 1.790 1.00 0.00 C ATOM 0 H THR A 33 -8.233 4.989 0.417 1.00 0.00 H new ATOM 0 HA THR A 33 -9.128 2.365 -0.541 1.00 0.00 H new ATOM 0 HB THR A 33 -8.990 4.072 1.817 1.00 0.00 H new ATOM 0 HG1 THR A 33 -8.162 2.099 2.122 1.00 0.00 H new ATOM 0 HG21 THR A 33 -11.100 3.360 2.876 1.00 0.00 H new ATOM 0 HG22 THR A 33 -11.400 4.384 1.451 1.00 0.00 H new ATOM 0 HG23 THR A 33 -11.619 2.621 1.342 1.00 0.00 H new ATOM 526 N GLU A 34 -11.092 4.963 -0.904 1.00 0.00 N ATOM 527 CA GLU A 34 -12.339 5.352 -1.611 1.00 0.00 C ATOM 528 C GLU A 34 -12.139 5.301 -3.130 1.00 0.00 C ATOM 529 O GLU A 34 -13.043 4.932 -3.846 1.00 0.00 O ATOM 530 CB GLU A 34 -12.626 6.768 -1.147 1.00 0.00 C ATOM 531 CG GLU A 34 -13.208 6.715 0.278 1.00 0.00 C ATOM 532 CD GLU A 34 -14.584 6.046 0.244 1.00 0.00 C ATOM 533 OE1 GLU A 34 -15.504 6.656 -0.274 1.00 0.00 O ATOM 534 OE2 GLU A 34 -14.693 4.936 0.738 1.00 0.00 O ATOM 0 H GLU A 34 -10.576 5.729 -0.470 1.00 0.00 H new ATOM 0 HA GLU A 34 -13.166 4.677 -1.390 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -11.712 7.362 -1.160 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -13.330 7.252 -1.824 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -12.538 6.160 0.935 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -13.292 7.722 0.686 1.00 0.00 H new ATOM 541 N THR A 35 -10.971 5.643 -3.643 1.00 0.00 N ATOM 542 CA THR A 35 -10.790 5.563 -5.130 1.00 0.00 C ATOM 543 C THR A 35 -11.050 4.140 -5.562 1.00 0.00 C ATOM 544 O THR A 35 -11.850 3.892 -6.440 1.00 0.00 O ATOM 545 CB THR A 35 -9.349 5.948 -5.453 1.00 0.00 C ATOM 546 OG1 THR A 35 -9.223 7.363 -5.430 1.00 0.00 O ATOM 547 CG2 THR A 35 -9.001 5.422 -6.852 1.00 0.00 C ATOM 0 H THR A 35 -10.161 5.964 -3.112 1.00 0.00 H new ATOM 0 HA THR A 35 -11.475 6.233 -5.649 1.00 0.00 H new ATOM 0 HB THR A 35 -8.672 5.516 -4.716 1.00 0.00 H new ATOM 0 HG1 THR A 35 -8.911 7.678 -6.304 1.00 0.00 H new ATOM 0 HG21 THR A 35 -7.973 5.690 -7.096 1.00 0.00 H new ATOM 0 HG22 THR A 35 -9.107 4.337 -6.870 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.675 5.864 -7.585 1.00 0.00 H new ATOM 555 N VAL A 36 -10.411 3.194 -4.935 1.00 0.00 N ATOM 556 CA VAL A 36 -10.689 1.785 -5.310 1.00 0.00 C ATOM 557 C VAL A 36 -12.200 1.586 -5.198 1.00 0.00 C ATOM 558 O VAL A 36 -12.818 0.899 -5.989 1.00 0.00 O ATOM 559 CB VAL A 36 -9.930 0.936 -4.286 1.00 0.00 C ATOM 560 CG1 VAL A 36 -10.807 -0.226 -3.808 1.00 0.00 C ATOM 561 CG2 VAL A 36 -8.664 0.389 -4.941 1.00 0.00 C ATOM 0 H VAL A 36 -9.723 3.332 -4.195 1.00 0.00 H new ATOM 0 HA VAL A 36 -10.378 1.516 -6.320 1.00 0.00 H new ATOM 0 HB VAL A 36 -9.669 1.552 -3.425 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -10.256 -0.822 -3.080 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -11.712 0.168 -3.344 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -11.078 -0.851 -4.659 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -8.115 -0.218 -4.221 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -8.935 -0.224 -5.800 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -8.037 1.218 -5.270 1.00 0.00 H new ATOM 571 N ALA A 37 -12.792 2.231 -4.228 1.00 0.00 N ATOM 572 CA ALA A 37 -14.261 2.143 -4.057 1.00 0.00 C ATOM 573 C ALA A 37 -14.944 3.128 -5.009 1.00 0.00 C ATOM 574 O ALA A 37 -16.154 3.168 -5.125 1.00 0.00 O ATOM 575 CB ALA A 37 -14.513 2.535 -2.618 1.00 0.00 C ATOM 0 H ALA A 37 -12.313 2.818 -3.545 1.00 0.00 H new ATOM 0 HA ALA A 37 -14.652 1.150 -4.278 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -15.583 2.495 -2.412 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -13.989 1.845 -1.956 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -14.149 3.548 -2.448 1.00 0.00 H new ATOM 581 N LYS A 38 -14.168 3.904 -5.712 1.00 0.00 N ATOM 582 CA LYS A 38 -14.750 4.858 -6.690 1.00 0.00 C ATOM 583 C LYS A 38 -14.595 4.240 -8.064 1.00 0.00 C ATOM 584 O LYS A 38 -15.369 4.486 -8.968 1.00 0.00 O ATOM 585 CB LYS A 38 -13.932 6.145 -6.562 1.00 0.00 C ATOM 586 CG LYS A 38 -14.872 7.355 -6.592 1.00 0.00 C ATOM 587 CD LYS A 38 -14.953 7.980 -5.196 1.00 0.00 C ATOM 588 CE LYS A 38 -15.584 6.980 -4.221 1.00 0.00 C ATOM 589 NZ LYS A 38 -17.054 7.159 -4.387 1.00 0.00 N ATOM 0 H LYS A 38 -13.150 3.917 -5.649 1.00 0.00 H new ATOM 0 HA LYS A 38 -15.805 5.073 -6.521 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -13.364 6.136 -5.632 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -13.210 6.212 -7.376 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -14.510 8.091 -7.310 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -15.865 7.049 -6.922 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -13.957 8.259 -4.853 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -15.546 8.894 -5.230 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -15.282 5.959 -4.452 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -15.275 7.180 -3.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -17.529 6.238 -4.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -17.409 7.808 -3.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -17.251 7.556 -5.328 1.00 0.00 H new ATOM 603 N GLY A 39 -13.611 3.401 -8.205 1.00 0.00 N ATOM 604 CA GLY A 39 -13.407 2.714 -9.487 1.00 0.00 C ATOM 605 C GLY A 39 -12.153 3.230 -10.188 1.00 0.00 C ATOM 606 O GLY A 39 -12.133 3.384 -11.394 1.00 0.00 O ATOM 0 H GLY A 39 -12.938 3.166 -7.475 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -13.319 1.641 -9.319 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -14.275 2.866 -10.128 1.00 0.00 H new ATOM 610 N ASP A 40 -11.101 3.491 -9.457 1.00 0.00 N ATOM 611 CA ASP A 40 -9.857 3.984 -10.122 1.00 0.00 C ATOM 612 C ASP A 40 -8.640 3.203 -9.617 1.00 0.00 C ATOM 613 O ASP A 40 -8.473 2.985 -8.434 1.00 0.00 O ATOM 614 CB ASP A 40 -9.754 5.466 -9.757 1.00 0.00 C ATOM 615 CG ASP A 40 -9.852 6.314 -11.028 1.00 0.00 C ATOM 616 OD1 ASP A 40 -10.948 6.445 -11.547 1.00 0.00 O ATOM 617 OD2 ASP A 40 -8.829 6.819 -11.459 1.00 0.00 O ATOM 0 H ASP A 40 -11.048 3.387 -8.444 1.00 0.00 H new ATOM 0 HA ASP A 40 -9.888 3.846 -11.203 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -10.551 5.737 -9.064 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -8.810 5.661 -9.249 1.00 0.00 H new ATOM 622 N LYS A 41 -7.792 2.781 -10.517 1.00 0.00 N ATOM 623 CA LYS A 41 -6.583 2.011 -10.118 1.00 0.00 C ATOM 624 C LYS A 41 -5.493 2.967 -9.639 1.00 0.00 C ATOM 625 O LYS A 41 -4.702 3.466 -10.415 1.00 0.00 O ATOM 626 CB LYS A 41 -6.137 1.279 -11.387 1.00 0.00 C ATOM 627 CG LYS A 41 -6.089 -0.228 -11.124 1.00 0.00 C ATOM 628 CD LYS A 41 -6.489 -0.983 -12.394 1.00 0.00 C ATOM 629 CE LYS A 41 -5.230 -1.424 -13.146 1.00 0.00 C ATOM 630 NZ LYS A 41 -5.730 -2.011 -14.421 1.00 0.00 N ATOM 0 H LYS A 41 -7.888 2.940 -11.520 1.00 0.00 H new ATOM 0 HA LYS A 41 -6.784 1.317 -9.302 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -6.827 1.494 -12.203 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -5.155 1.635 -11.698 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -5.086 -0.522 -10.815 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -6.763 -0.487 -10.307 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -7.095 -1.852 -12.137 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -7.101 -0.345 -13.031 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -4.566 -0.580 -13.333 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -4.662 -2.155 -12.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -4.925 -2.337 -14.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -6.354 -2.816 -14.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -6.261 -1.290 -14.950 1.00 0.00 H new ATOM 644 N VAL A 42 -5.451 3.223 -8.365 1.00 0.00 N ATOM 645 CA VAL A 42 -4.412 4.151 -7.820 1.00 0.00 C ATOM 646 C VAL A 42 -3.015 3.614 -8.141 1.00 0.00 C ATOM 647 O VAL A 42 -2.731 2.447 -7.956 1.00 0.00 O ATOM 648 CB VAL A 42 -4.646 4.176 -6.308 1.00 0.00 C ATOM 649 CG1 VAL A 42 -3.637 5.119 -5.648 1.00 0.00 C ATOM 650 CG2 VAL A 42 -6.064 4.670 -6.017 1.00 0.00 C ATOM 0 H VAL A 42 -6.089 2.832 -7.672 1.00 0.00 H new ATOM 0 HA VAL A 42 -4.480 5.149 -8.253 1.00 0.00 H new ATOM 0 HB VAL A 42 -4.521 3.170 -5.908 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -3.805 5.136 -4.571 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -2.625 4.769 -5.852 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -3.762 6.124 -6.050 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -6.229 4.687 -4.940 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -6.189 5.675 -6.419 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -6.786 4.000 -6.484 1.00 0.00 H new ATOM 660 N GLN A 43 -2.144 4.456 -8.632 1.00 0.00 N ATOM 661 CA GLN A 43 -0.768 3.993 -8.978 1.00 0.00 C ATOM 662 C GLN A 43 0.274 4.922 -8.353 1.00 0.00 C ATOM 663 O GLN A 43 0.704 5.880 -8.963 1.00 0.00 O ATOM 664 CB GLN A 43 -0.684 4.067 -10.507 1.00 0.00 C ATOM 665 CG GLN A 43 -1.985 3.554 -11.131 1.00 0.00 C ATOM 666 CD GLN A 43 -1.676 2.841 -12.448 1.00 0.00 C ATOM 667 OE1 GLN A 43 -0.646 2.213 -12.585 1.00 0.00 O ATOM 668 NE2 GLN A 43 -2.531 2.912 -13.432 1.00 0.00 N ATOM 0 H GLN A 43 -2.326 5.444 -8.808 1.00 0.00 H new ATOM 0 HA GLN A 43 -0.574 2.987 -8.606 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -0.502 5.095 -10.820 1.00 0.00 H new ATOM 0 HB3 GLN A 43 0.158 3.472 -10.862 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -2.485 2.871 -10.444 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -2.668 4.385 -11.307 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -3.397 3.439 -13.318 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -2.333 2.440 -14.314 1.00 0.00 H new ATOM 677 N LEU A 44 0.693 4.641 -7.149 1.00 0.00 N ATOM 678 CA LEU A 44 1.715 5.510 -6.500 1.00 0.00 C ATOM 679 C LEU A 44 2.987 5.520 -7.345 1.00 0.00 C ATOM 680 O LEU A 44 3.704 4.542 -7.394 1.00 0.00 O ATOM 681 CB LEU A 44 1.979 4.863 -5.141 1.00 0.00 C ATOM 682 CG LEU A 44 1.069 5.492 -4.087 1.00 0.00 C ATOM 683 CD1 LEU A 44 1.199 4.728 -2.766 1.00 0.00 C ATOM 684 CD2 LEU A 44 1.483 6.946 -3.876 1.00 0.00 C ATOM 0 H LEU A 44 0.373 3.851 -6.589 1.00 0.00 H new ATOM 0 HA LEU A 44 1.384 6.544 -6.397 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.799 3.789 -5.197 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.024 4.997 -4.860 1.00 0.00 H new ATOM 0 HG LEU A 44 0.034 5.446 -4.425 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.548 5.181 -2.018 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.910 3.688 -2.917 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.232 4.771 -2.421 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.838 7.403 -3.125 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.518 6.984 -3.537 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.388 7.491 -4.815 1.00 0.00 H new ATOM 696 N THR A 45 3.259 6.617 -8.015 1.00 0.00 N ATOM 697 CA THR A 45 4.483 6.719 -8.885 1.00 0.00 C ATOM 698 C THR A 45 4.808 5.365 -9.538 1.00 0.00 C ATOM 699 O THR A 45 4.322 5.057 -10.608 1.00 0.00 O ATOM 700 CB THR A 45 5.631 7.201 -7.971 1.00 0.00 C ATOM 701 OG1 THR A 45 6.870 6.710 -8.467 1.00 0.00 O ATOM 702 CG2 THR A 45 5.434 6.711 -6.531 1.00 0.00 C ATOM 0 H THR A 45 2.680 7.457 -7.997 1.00 0.00 H new ATOM 0 HA THR A 45 4.327 7.419 -9.706 1.00 0.00 H new ATOM 0 HB THR A 45 5.631 8.291 -7.969 1.00 0.00 H new ATOM 0 HG1 THR A 45 7.541 6.736 -7.754 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.257 7.065 -5.910 1.00 0.00 H new ATOM 0 HG22 THR A 45 4.493 7.098 -6.141 1.00 0.00 H new ATOM 0 HG23 THR A 45 5.412 5.621 -6.517 1.00 0.00 H new ATOM 710 N GLY A 46 5.613 4.553 -8.903 1.00 0.00 N ATOM 711 CA GLY A 46 5.949 3.229 -9.489 1.00 0.00 C ATOM 712 C GLY A 46 6.249 2.237 -8.366 1.00 0.00 C ATOM 713 O GLY A 46 7.009 1.305 -8.543 1.00 0.00 O ATOM 0 H GLY A 46 6.051 4.753 -8.004 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.120 2.867 -10.097 1.00 0.00 H new ATOM 0 HA3 GLY A 46 6.812 3.320 -10.149 1.00 0.00 H new ATOM 717 N PHE A 47 5.665 2.426 -7.207 1.00 0.00 N ATOM 718 CA PHE A 47 5.939 1.479 -6.088 1.00 0.00 C ATOM 719 C PHE A 47 4.649 0.973 -5.439 1.00 0.00 C ATOM 720 O PHE A 47 4.622 -0.117 -4.902 1.00 0.00 O ATOM 721 CB PHE A 47 6.855 2.241 -5.120 1.00 0.00 C ATOM 722 CG PHE A 47 6.067 3.055 -4.128 1.00 0.00 C ATOM 723 CD1 PHE A 47 5.483 2.446 -3.016 1.00 0.00 C ATOM 724 CD2 PHE A 47 5.935 4.428 -4.318 1.00 0.00 C ATOM 725 CE1 PHE A 47 4.766 3.215 -2.104 1.00 0.00 C ATOM 726 CE2 PHE A 47 5.220 5.198 -3.402 1.00 0.00 C ATOM 727 CZ PHE A 47 4.634 4.590 -2.294 1.00 0.00 C ATOM 0 H PHE A 47 5.019 3.186 -6.992 1.00 0.00 H new ATOM 0 HA PHE A 47 6.428 0.568 -6.434 1.00 0.00 H new ATOM 0 HB2 PHE A 47 7.490 1.533 -4.587 1.00 0.00 H new ATOM 0 HB3 PHE A 47 7.516 2.898 -5.686 1.00 0.00 H new ATOM 0 HD1 PHE A 47 5.587 1.382 -2.864 1.00 0.00 H new ATOM 0 HD2 PHE A 47 6.388 4.898 -5.178 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.310 2.745 -1.245 1.00 0.00 H new ATOM 0 HE2 PHE A 47 5.121 6.263 -3.551 1.00 0.00 H new ATOM 0 HZ PHE A 47 4.078 5.183 -1.583 1.00 0.00 H new ATOM 737 N LEU A 48 3.574 1.712 -5.496 1.00 0.00 N ATOM 738 CA LEU A 48 2.318 1.188 -4.891 1.00 0.00 C ATOM 739 C LEU A 48 1.158 1.277 -5.882 1.00 0.00 C ATOM 740 O LEU A 48 0.515 2.297 -6.024 1.00 0.00 O ATOM 741 CB LEU A 48 2.066 2.032 -3.649 1.00 0.00 C ATOM 742 CG LEU A 48 2.507 1.262 -2.397 1.00 0.00 C ATOM 743 CD1 LEU A 48 1.902 1.920 -1.168 1.00 0.00 C ATOM 744 CD2 LEU A 48 2.045 -0.199 -2.476 1.00 0.00 C ATOM 0 H LEU A 48 3.511 2.635 -5.925 1.00 0.00 H new ATOM 0 HA LEU A 48 2.407 0.134 -4.630 1.00 0.00 H new ATOM 0 HB2 LEU A 48 2.613 2.972 -3.720 1.00 0.00 H new ATOM 0 HB3 LEU A 48 1.008 2.284 -3.578 1.00 0.00 H new ATOM 0 HG LEU A 48 3.595 1.281 -2.332 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.212 1.377 -0.275 1.00 0.00 H new ATOM 0 HD12 LEU A 48 2.245 2.953 -1.102 1.00 0.00 H new ATOM 0 HD13 LEU A 48 0.815 1.903 -1.244 1.00 0.00 H new ATOM 0 HD21 LEU A 48 2.366 -0.731 -1.580 1.00 0.00 H new ATOM 0 HD22 LEU A 48 0.958 -0.233 -2.549 1.00 0.00 H new ATOM 0 HD23 LEU A 48 2.483 -0.672 -3.355 1.00 0.00 H new ATOM 756 N ASN A 49 0.894 0.199 -6.570 1.00 0.00 N ATOM 757 CA ASN A 49 -0.217 0.189 -7.562 1.00 0.00 C ATOM 758 C ASN A 49 -1.447 -0.521 -6.986 1.00 0.00 C ATOM 759 O ASN A 49 -1.646 -1.701 -7.198 1.00 0.00 O ATOM 760 CB ASN A 49 0.334 -0.589 -8.759 1.00 0.00 C ATOM 761 CG ASN A 49 0.702 0.384 -9.880 1.00 0.00 C ATOM 762 OD1 ASN A 49 1.034 1.525 -9.626 1.00 0.00 O ATOM 763 ND2 ASN A 49 0.654 -0.021 -11.120 1.00 0.00 N ATOM 0 H ASN A 49 1.404 -0.680 -6.486 1.00 0.00 H new ATOM 0 HA ASN A 49 -0.534 1.196 -7.833 1.00 0.00 H new ATOM 0 HB2 ASN A 49 1.211 -1.163 -8.460 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -0.409 -1.304 -9.114 1.00 0.00 H new ATOM 0 HD21 ASN A 49 0.895 0.620 -11.876 1.00 0.00 H new ATOM 0 HD22 ASN A 49 0.375 -0.979 -11.333 1.00 0.00 H new ATOM 770 N ILE A 50 -2.280 0.192 -6.276 1.00 0.00 N ATOM 771 CA ILE A 50 -3.507 -0.444 -5.704 1.00 0.00 C ATOM 772 C ILE A 50 -4.504 -0.695 -6.840 1.00 0.00 C ATOM 773 O ILE A 50 -4.755 0.182 -7.644 1.00 0.00 O ATOM 774 CB ILE A 50 -4.087 0.573 -4.703 1.00 0.00 C ATOM 775 CG1 ILE A 50 -2.979 1.229 -3.863 1.00 0.00 C ATOM 776 CG2 ILE A 50 -5.065 -0.139 -3.767 1.00 0.00 C ATOM 777 CD1 ILE A 50 -2.042 0.163 -3.302 1.00 0.00 C ATOM 0 H ILE A 50 -2.166 1.184 -6.067 1.00 0.00 H new ATOM 0 HA ILE A 50 -3.294 -1.395 -5.215 1.00 0.00 H new ATOM 0 HB ILE A 50 -4.597 1.352 -5.270 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -2.416 1.932 -4.476 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -3.421 1.801 -3.047 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.477 0.578 -3.057 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -5.874 -0.577 -4.351 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -4.542 -0.926 -3.224 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -1.262 0.640 -2.709 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -2.608 -0.524 -2.672 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.586 -0.390 -4.124 1.00 0.00 H new ATOM 789 N LYS A 51 -5.072 -1.874 -6.938 1.00 0.00 N ATOM 790 CA LYS A 51 -6.036 -2.119 -8.059 1.00 0.00 C ATOM 791 C LYS A 51 -7.168 -3.058 -7.620 1.00 0.00 C ATOM 792 O LYS A 51 -6.935 -4.217 -7.340 1.00 0.00 O ATOM 793 CB LYS A 51 -5.205 -2.762 -9.176 1.00 0.00 C ATOM 794 CG LYS A 51 -4.310 -3.865 -8.602 1.00 0.00 C ATOM 795 CD LYS A 51 -4.085 -4.945 -9.662 1.00 0.00 C ATOM 796 CE LYS A 51 -5.342 -5.809 -9.787 1.00 0.00 C ATOM 797 NZ LYS A 51 -5.259 -6.410 -11.148 1.00 0.00 N ATOM 0 H LYS A 51 -4.916 -2.660 -6.307 1.00 0.00 H new ATOM 0 HA LYS A 51 -6.513 -1.195 -8.385 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -5.865 -3.179 -9.937 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -4.593 -2.005 -9.666 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -3.355 -3.445 -8.287 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -4.774 -4.300 -7.717 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -3.851 -4.484 -10.622 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.231 -5.565 -9.389 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -5.371 -6.579 -9.016 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -6.246 -5.211 -9.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -5.967 -7.167 -11.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -5.443 -5.677 -11.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -4.309 -6.806 -11.295 1.00 0.00 H new ATOM 811 N PRO A 52 -8.368 -2.527 -7.579 1.00 0.00 N ATOM 812 CA PRO A 52 -9.539 -3.337 -7.171 1.00 0.00 C ATOM 813 C PRO A 52 -10.013 -4.231 -8.311 1.00 0.00 C ATOM 814 O PRO A 52 -9.987 -3.858 -9.468 1.00 0.00 O ATOM 815 CB PRO A 52 -10.600 -2.299 -6.838 1.00 0.00 C ATOM 816 CG PRO A 52 -10.232 -1.092 -7.640 1.00 0.00 C ATOM 817 CD PRO A 52 -8.745 -1.143 -7.894 1.00 0.00 C ATOM 0 HA PRO A 52 -9.313 -4.003 -6.338 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.596 -2.656 -7.099 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -10.611 -2.075 -5.771 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -10.780 -1.078 -8.582 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -10.497 -0.181 -7.103 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -8.510 -0.893 -8.928 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -8.210 -0.432 -7.264 1.00 0.00 H new ATOM 825 N VAL A 53 -10.456 -5.407 -7.979 1.00 0.00 N ATOM 826 CA VAL A 53 -10.953 -6.345 -9.023 1.00 0.00 C ATOM 827 C VAL A 53 -12.163 -7.122 -8.508 1.00 0.00 C ATOM 828 O VAL A 53 -12.084 -7.856 -7.545 1.00 0.00 O ATOM 829 CB VAL A 53 -9.782 -7.269 -9.329 1.00 0.00 C ATOM 830 CG1 VAL A 53 -8.584 -6.429 -9.782 1.00 0.00 C ATOM 831 CG2 VAL A 53 -9.401 -8.048 -8.071 1.00 0.00 C ATOM 0 H VAL A 53 -10.496 -5.763 -7.024 1.00 0.00 H new ATOM 0 HA VAL A 53 -11.286 -5.824 -9.921 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.066 -7.967 -10.117 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.742 -7.085 -10.003 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.851 -5.868 -10.677 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.305 -5.735 -8.989 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -8.563 -8.709 -8.292 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -9.115 -7.350 -7.284 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -10.253 -8.641 -7.739 1.00 0.00 H new ATOM 841 N ALA A 54 -13.287 -6.931 -9.137 1.00 0.00 N ATOM 842 CA ALA A 54 -14.550 -7.609 -8.699 1.00 0.00 C ATOM 843 C ALA A 54 -14.305 -9.038 -8.208 1.00 0.00 C ATOM 844 O ALA A 54 -13.759 -9.871 -8.903 1.00 0.00 O ATOM 845 CB ALA A 54 -15.456 -7.615 -9.929 1.00 0.00 C ATOM 0 H ALA A 54 -13.391 -6.325 -9.950 1.00 0.00 H new ATOM 0 HA ALA A 54 -14.995 -7.082 -7.855 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -16.402 -8.098 -9.682 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -15.644 -6.590 -10.247 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -14.970 -8.162 -10.737 1.00 0.00 H new ATOM 1164 N VAL A 75 -14.919 -6.023 -3.848 1.00 0.00 N ATOM 1165 CA VAL A 75 -13.943 -6.095 -4.986 1.00 0.00 C ATOM 1166 C VAL A 75 -12.595 -6.636 -4.490 1.00 0.00 C ATOM 1167 O VAL A 75 -12.384 -6.811 -3.306 1.00 0.00 O ATOM 1168 CB VAL A 75 -13.810 -4.654 -5.516 1.00 0.00 C ATOM 1169 CG1 VAL A 75 -12.593 -3.958 -4.895 1.00 0.00 C ATOM 1170 CG2 VAL A 75 -13.642 -4.682 -7.037 1.00 0.00 C ATOM 0 HA VAL A 75 -14.279 -6.769 -5.774 1.00 0.00 H new ATOM 0 HB VAL A 75 -14.711 -4.103 -5.246 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -12.518 -2.942 -5.283 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -12.706 -3.925 -3.811 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -11.689 -4.511 -5.149 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -13.548 -3.663 -7.411 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -12.746 -5.247 -7.294 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -14.512 -5.156 -7.491 1.00 0.00 H new ATOM 1180 N GLY A 76 -11.685 -6.901 -5.382 1.00 0.00 N ATOM 1181 CA GLY A 76 -10.363 -7.432 -4.951 1.00 0.00 C ATOM 1182 C GLY A 76 -9.344 -6.301 -4.979 1.00 0.00 C ATOM 1183 O GLY A 76 -8.551 -6.189 -5.891 1.00 0.00 O ATOM 0 H GLY A 76 -11.798 -6.774 -6.388 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -10.434 -7.850 -3.947 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -10.048 -8.240 -5.611 1.00 0.00 H new ATOM 1187 N VAL A 77 -9.370 -5.454 -3.990 1.00 0.00 N ATOM 1188 CA VAL A 77 -8.410 -4.314 -3.951 1.00 0.00 C ATOM 1189 C VAL A 77 -6.974 -4.831 -3.944 1.00 0.00 C ATOM 1190 O VAL A 77 -6.294 -4.801 -2.938 1.00 0.00 O ATOM 1191 CB VAL A 77 -8.742 -3.560 -2.655 1.00 0.00 C ATOM 1192 CG1 VAL A 77 -8.719 -4.527 -1.464 1.00 0.00 C ATOM 1193 CG2 VAL A 77 -7.718 -2.445 -2.422 1.00 0.00 C ATOM 0 H VAL A 77 -10.017 -5.501 -3.203 1.00 0.00 H new ATOM 0 HA VAL A 77 -8.496 -3.665 -4.823 1.00 0.00 H new ATOM 0 HB VAL A 77 -9.737 -3.125 -2.748 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -8.956 -3.983 -0.549 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -9.457 -5.314 -1.620 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -7.728 -4.972 -1.376 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -7.960 -1.915 -1.501 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.721 -2.878 -2.340 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -7.743 -1.747 -3.259 1.00 0.00 H new ATOM 1203 N SER A 78 -6.508 -5.297 -5.069 1.00 0.00 N ATOM 1204 CA SER A 78 -5.112 -5.807 -5.129 1.00 0.00 C ATOM 1205 C SER A 78 -4.128 -4.649 -4.946 1.00 0.00 C ATOM 1206 O SER A 78 -4.513 -3.502 -4.827 1.00 0.00 O ATOM 1207 CB SER A 78 -4.968 -6.427 -6.520 1.00 0.00 C ATOM 1208 OG SER A 78 -4.918 -7.843 -6.399 1.00 0.00 O ATOM 0 H SER A 78 -7.030 -5.346 -5.944 1.00 0.00 H new ATOM 0 HA SER A 78 -4.901 -6.534 -4.344 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.807 -6.134 -7.150 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.063 -6.059 -7.003 1.00 0.00 H new ATOM 0 HG SER A 78 -4.827 -8.244 -7.288 1.00 0.00 H new ATOM 1214 N VAL A 79 -2.862 -4.950 -4.922 1.00 0.00 N ATOM 1215 CA VAL A 79 -1.817 -3.893 -4.744 1.00 0.00 C ATOM 1216 C VAL A 79 -0.436 -4.564 -4.673 1.00 0.00 C ATOM 1217 O VAL A 79 -0.337 -5.775 -4.637 1.00 0.00 O ATOM 1218 CB VAL A 79 -2.178 -3.211 -3.401 1.00 0.00 C ATOM 1219 CG1 VAL A 79 -2.661 -4.261 -2.395 1.00 0.00 C ATOM 1220 CG2 VAL A 79 -0.963 -2.492 -2.807 1.00 0.00 C ATOM 0 H VAL A 79 -2.496 -5.897 -5.019 1.00 0.00 H new ATOM 0 HA VAL A 79 -1.783 -3.171 -5.560 1.00 0.00 H new ATOM 0 HB VAL A 79 -2.966 -2.484 -3.597 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -2.913 -3.774 -1.453 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.543 -4.765 -2.790 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -1.871 -4.993 -2.225 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -1.243 -2.022 -1.865 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.165 -3.213 -2.629 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -0.615 -1.729 -3.504 1.00 0.00 H new ATOM 1230 N LYS A 80 0.622 -3.795 -4.601 1.00 0.00 N ATOM 1231 CA LYS A 80 1.975 -4.397 -4.475 1.00 0.00 C ATOM 1232 C LYS A 80 3.034 -3.295 -4.339 1.00 0.00 C ATOM 1233 O LYS A 80 2.747 -2.128 -4.509 1.00 0.00 O ATOM 1234 CB LYS A 80 2.194 -5.179 -5.776 1.00 0.00 C ATOM 1235 CG LYS A 80 2.039 -4.240 -6.978 1.00 0.00 C ATOM 1236 CD LYS A 80 3.172 -4.490 -7.974 1.00 0.00 C ATOM 1237 CE LYS A 80 3.029 -5.891 -8.571 1.00 0.00 C ATOM 1238 NZ LYS A 80 3.638 -5.797 -9.927 1.00 0.00 N ATOM 0 H LYS A 80 0.602 -2.775 -4.624 1.00 0.00 H new ATOM 0 HA LYS A 80 2.056 -5.036 -3.595 1.00 0.00 H new ATOM 0 HB2 LYS A 80 3.187 -5.627 -5.779 1.00 0.00 H new ATOM 0 HB3 LYS A 80 1.475 -5.996 -5.846 1.00 0.00 H new ATOM 0 HG2 LYS A 80 1.075 -4.405 -7.459 1.00 0.00 H new ATOM 0 HG3 LYS A 80 2.056 -3.202 -6.646 1.00 0.00 H new ATOM 0 HD2 LYS A 80 3.146 -3.742 -8.766 1.00 0.00 H new ATOM 0 HD3 LYS A 80 4.136 -4.393 -7.475 1.00 0.00 H new ATOM 0 HE2 LYS A 80 3.540 -6.634 -7.960 1.00 0.00 H new ATOM 0 HE3 LYS A 80 1.983 -6.191 -8.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 3.577 -6.721 -10.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 3.127 -5.087 -10.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 4.636 -5.517 -9.841 1.00 0.00 H new ATOM 1252 N PRO A 81 4.232 -3.724 -4.064 1.00 0.00 N ATOM 1253 CA PRO A 81 5.384 -2.820 -3.927 1.00 0.00 C ATOM 1254 C PRO A 81 6.203 -2.796 -5.220 1.00 0.00 C ATOM 1255 O PRO A 81 6.524 -3.828 -5.777 1.00 0.00 O ATOM 1256 CB PRO A 81 6.195 -3.496 -2.828 1.00 0.00 C ATOM 1257 CG PRO A 81 5.819 -4.955 -2.891 1.00 0.00 C ATOM 1258 CD PRO A 81 4.628 -5.093 -3.814 1.00 0.00 C ATOM 0 HA PRO A 81 5.103 -1.789 -3.713 1.00 0.00 H new ATOM 0 HB2 PRO A 81 7.264 -3.359 -2.988 1.00 0.00 H new ATOM 0 HB3 PRO A 81 5.962 -3.072 -1.851 1.00 0.00 H new ATOM 0 HG2 PRO A 81 6.656 -5.548 -3.258 1.00 0.00 H new ATOM 0 HG3 PRO A 81 5.575 -5.329 -1.896 1.00 0.00 H new ATOM 0 HD2 PRO A 81 4.893 -5.609 -4.737 1.00 0.00 H new ATOM 0 HD3 PRO A 81 3.825 -5.664 -3.349 1.00 0.00 H new ATOM 1266 N GLY A 82 6.565 -1.637 -5.686 1.00 0.00 N ATOM 1267 CA GLY A 82 7.391 -1.564 -6.927 1.00 0.00 C ATOM 1268 C GLY A 82 8.866 -1.543 -6.524 1.00 0.00 C ATOM 1269 O GLY A 82 9.191 -1.549 -5.352 1.00 0.00 O ATOM 0 H GLY A 82 6.328 -0.738 -5.266 1.00 0.00 H new ATOM 0 HA2 GLY A 82 7.186 -2.420 -7.570 1.00 0.00 H new ATOM 0 HA3 GLY A 82 7.141 -0.669 -7.497 1.00 0.00 H new ATOM 1273 N GLU A 83 9.763 -1.525 -7.473 1.00 0.00 N ATOM 1274 CA GLU A 83 11.213 -1.509 -7.115 1.00 0.00 C ATOM 1275 C GLU A 83 11.591 -0.184 -6.454 1.00 0.00 C ATOM 1276 O GLU A 83 12.608 -0.084 -5.798 1.00 0.00 O ATOM 1277 CB GLU A 83 11.968 -1.677 -8.431 1.00 0.00 C ATOM 1278 CG GLU A 83 11.548 -0.584 -9.419 1.00 0.00 C ATOM 1279 CD GLU A 83 11.123 -1.224 -10.743 1.00 0.00 C ATOM 1280 OE1 GLU A 83 11.884 -2.022 -11.264 1.00 0.00 O ATOM 1281 OE2 GLU A 83 10.043 -0.904 -11.213 1.00 0.00 O ATOM 0 H GLU A 83 9.559 -1.521 -8.472 1.00 0.00 H new ATOM 0 HA GLU A 83 11.456 -2.300 -6.405 1.00 0.00 H new ATOM 0 HB2 GLU A 83 13.042 -1.625 -8.253 1.00 0.00 H new ATOM 0 HB3 GLU A 83 11.763 -2.660 -8.855 1.00 0.00 H new ATOM 0 HG2 GLU A 83 10.725 -0.002 -9.004 1.00 0.00 H new ATOM 0 HG3 GLU A 83 12.375 0.106 -9.586 1.00 0.00 H new ATOM 1288 N SER A 84 10.786 0.836 -6.614 1.00 0.00 N ATOM 1289 CA SER A 84 11.116 2.148 -5.981 1.00 0.00 C ATOM 1290 C SER A 84 11.399 1.937 -4.491 1.00 0.00 C ATOM 1291 O SER A 84 12.311 2.515 -3.932 1.00 0.00 O ATOM 1292 CB SER A 84 9.878 3.018 -6.180 1.00 0.00 C ATOM 1293 OG SER A 84 10.277 4.313 -6.611 1.00 0.00 O ATOM 0 H SER A 84 9.920 0.817 -7.152 1.00 0.00 H new ATOM 0 HA SER A 84 12.000 2.613 -6.418 1.00 0.00 H new ATOM 0 HB2 SER A 84 9.216 2.565 -6.918 1.00 0.00 H new ATOM 0 HB3 SER A 84 9.316 3.089 -5.249 1.00 0.00 H new ATOM 0 HG SER A 84 9.611 4.973 -6.325 1.00 0.00 H new ATOM 1299 N LEU A 85 10.636 1.089 -3.855 1.00 0.00 N ATOM 1300 CA LEU A 85 10.873 0.814 -2.410 1.00 0.00 C ATOM 1301 C LEU A 85 12.096 -0.086 -2.276 1.00 0.00 C ATOM 1302 O LEU A 85 12.852 0.009 -1.331 1.00 0.00 O ATOM 1303 CB LEU A 85 9.634 0.064 -1.899 1.00 0.00 C ATOM 1304 CG LEU A 85 8.344 0.742 -2.377 1.00 0.00 C ATOM 1305 CD1 LEU A 85 7.398 -0.320 -2.945 1.00 0.00 C ATOM 1306 CD2 LEU A 85 7.664 1.447 -1.196 1.00 0.00 C ATOM 0 H LEU A 85 9.860 0.576 -4.274 1.00 0.00 H new ATOM 0 HA LEU A 85 11.041 1.732 -1.846 1.00 0.00 H new ATOM 0 HB2 LEU A 85 9.658 -0.967 -2.250 1.00 0.00 H new ATOM 0 HB3 LEU A 85 9.649 0.030 -0.810 1.00 0.00 H new ATOM 0 HG LEU A 85 8.582 1.475 -3.148 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.479 0.156 -3.286 1.00 0.00 H new ATOM 0 HD12 LEU A 85 7.878 -0.824 -3.783 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.162 -1.049 -2.170 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.748 1.928 -1.538 1.00 0.00 H new ATOM 0 HD22 LEU A 85 7.424 0.715 -0.425 1.00 0.00 H new ATOM 0 HD23 LEU A 85 8.337 2.199 -0.785 1.00 0.00 H new ATOM 1318 N LYS A 86 12.281 -0.970 -3.222 1.00 0.00 N ATOM 1319 CA LYS A 86 13.441 -1.903 -3.165 1.00 0.00 C ATOM 1320 C LYS A 86 14.739 -1.176 -3.474 1.00 0.00 C ATOM 1321 O LYS A 86 15.734 -1.351 -2.798 1.00 0.00 O ATOM 1322 CB LYS A 86 13.151 -2.968 -4.227 1.00 0.00 C ATOM 1323 CG LYS A 86 13.165 -4.357 -3.584 1.00 0.00 C ATOM 1324 CD LYS A 86 12.408 -5.339 -4.481 1.00 0.00 C ATOM 1325 CE LYS A 86 10.974 -5.498 -3.970 1.00 0.00 C ATOM 1326 NZ LYS A 86 10.297 -6.355 -4.985 1.00 0.00 N ATOM 0 H LYS A 86 11.675 -1.085 -4.034 1.00 0.00 H new ATOM 0 HA LYS A 86 13.562 -2.338 -2.173 1.00 0.00 H new ATOM 0 HB2 LYS A 86 12.181 -2.780 -4.688 1.00 0.00 H new ATOM 0 HB3 LYS A 86 13.897 -2.917 -5.020 1.00 0.00 H new ATOM 0 HG2 LYS A 86 14.192 -4.694 -3.442 1.00 0.00 H new ATOM 0 HG3 LYS A 86 12.703 -4.318 -2.597 1.00 0.00 H new ATOM 0 HD2 LYS A 86 12.401 -4.977 -5.509 1.00 0.00 H new ATOM 0 HD3 LYS A 86 12.912 -6.305 -4.487 1.00 0.00 H new ATOM 0 HE2 LYS A 86 10.955 -5.963 -2.984 1.00 0.00 H new ATOM 0 HE3 LYS A 86 10.479 -4.532 -3.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 9.308 -6.510 -4.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 10.325 -5.883 -5.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 10.786 -7.271 -5.048 1.00 0.00 H new ATOM 1340 N LYS A 87 14.742 -0.344 -4.466 1.00 0.00 N ATOM 1341 CA LYS A 87 15.984 0.404 -4.775 1.00 0.00 C ATOM 1342 C LYS A 87 16.307 1.249 -3.553 1.00 0.00 C ATOM 1343 O LYS A 87 17.438 1.321 -3.079 1.00 0.00 O ATOM 1344 CB LYS A 87 15.648 1.264 -5.997 1.00 0.00 C ATOM 1345 CG LYS A 87 16.843 2.155 -6.347 1.00 0.00 C ATOM 1346 CD LYS A 87 17.639 1.518 -7.488 1.00 0.00 C ATOM 1347 CE LYS A 87 16.876 1.691 -8.804 1.00 0.00 C ATOM 1348 NZ LYS A 87 17.414 2.947 -9.397 1.00 0.00 N ATOM 0 H LYS A 87 13.946 -0.149 -5.074 1.00 0.00 H new ATOM 0 HA LYS A 87 16.848 -0.223 -4.994 1.00 0.00 H new ATOM 0 HB2 LYS A 87 15.397 0.626 -6.845 1.00 0.00 H new ATOM 0 HB3 LYS A 87 14.772 1.879 -5.791 1.00 0.00 H new ATOM 0 HG2 LYS A 87 16.497 3.146 -6.640 1.00 0.00 H new ATOM 0 HG3 LYS A 87 17.481 2.285 -5.473 1.00 0.00 H new ATOM 0 HD2 LYS A 87 18.623 1.982 -7.562 1.00 0.00 H new ATOM 0 HD3 LYS A 87 17.800 0.459 -7.286 1.00 0.00 H new ATOM 0 HE2 LYS A 87 17.035 0.841 -9.468 1.00 0.00 H new ATOM 0 HE3 LYS A 87 15.802 1.764 -8.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 16.939 3.134 -10.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 17.242 3.740 -8.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 18.437 2.845 -9.556 1.00 0.00 H new ATOM 1362 N ALA A 88 15.293 1.820 -2.975 1.00 0.00 N ATOM 1363 CA ALA A 88 15.515 2.585 -1.738 1.00 0.00 C ATOM 1364 C ALA A 88 15.930 1.572 -0.687 1.00 0.00 C ATOM 1365 O ALA A 88 16.785 1.822 0.144 1.00 0.00 O ATOM 1366 CB ALA A 88 14.167 3.216 -1.391 1.00 0.00 C ATOM 0 H ALA A 88 14.329 1.787 -3.307 1.00 0.00 H new ATOM 0 HA ALA A 88 16.276 3.361 -1.817 1.00 0.00 H new ATOM 0 HB1 ALA A 88 14.264 3.801 -0.477 1.00 0.00 H new ATOM 0 HB2 ALA A 88 13.849 3.866 -2.206 1.00 0.00 H new ATOM 0 HB3 ALA A 88 13.425 2.431 -1.243 1.00 0.00 H new ATOM 1372 N ALA A 89 15.344 0.397 -0.754 1.00 0.00 N ATOM 1373 CA ALA A 89 15.705 -0.670 0.216 1.00 0.00 C ATOM 1374 C ALA A 89 17.192 -0.942 0.091 1.00 0.00 C ATOM 1375 O ALA A 89 17.869 -1.180 1.069 1.00 0.00 O ATOM 1376 CB ALA A 89 14.867 -1.885 -0.167 1.00 0.00 C ATOM 0 H ALA A 89 14.634 0.139 -1.439 1.00 0.00 H new ATOM 0 HA ALA A 89 15.507 -0.398 1.253 1.00 0.00 H new ATOM 0 HB1 ALA A 89 15.088 -2.708 0.513 1.00 0.00 H new ATOM 0 HB2 ALA A 89 13.809 -1.633 -0.100 1.00 0.00 H new ATOM 0 HB3 ALA A 89 15.105 -2.184 -1.188 1.00 0.00 H new ATOM 1382 N GLU A 90 17.723 -0.837 -1.099 1.00 0.00 N ATOM 1383 CA GLU A 90 19.190 -1.012 -1.254 1.00 0.00 C ATOM 1384 C GLU A 90 19.834 0.005 -0.310 1.00 0.00 C ATOM 1385 O GLU A 90 20.854 -0.238 0.304 1.00 0.00 O ATOM 1386 CB GLU A 90 19.487 -0.705 -2.734 1.00 0.00 C ATOM 1387 CG GLU A 90 20.202 0.645 -2.879 1.00 0.00 C ATOM 1388 CD GLU A 90 20.477 0.922 -4.358 1.00 0.00 C ATOM 1389 OE1 GLU A 90 19.521 0.997 -5.113 1.00 0.00 O ATOM 1390 OE2 GLU A 90 21.637 1.053 -4.710 1.00 0.00 O ATOM 0 H GLU A 90 17.209 -0.640 -1.958 1.00 0.00 H new ATOM 0 HA GLU A 90 19.568 -2.005 -1.012 1.00 0.00 H new ATOM 0 HB2 GLU A 90 20.106 -1.496 -3.157 1.00 0.00 H new ATOM 0 HB3 GLU A 90 18.556 -0.691 -3.301 1.00 0.00 H new ATOM 0 HG2 GLU A 90 19.588 1.441 -2.457 1.00 0.00 H new ATOM 0 HG3 GLU A 90 21.138 0.635 -2.320 1.00 0.00 H new ATOM 1397 N GLY A 91 19.191 1.139 -0.177 1.00 0.00 N ATOM 1398 CA GLY A 91 19.695 2.194 0.749 1.00 0.00 C ATOM 1399 C GLY A 91 19.715 1.658 2.193 1.00 0.00 C ATOM 1400 O GLY A 91 20.677 1.854 2.910 1.00 0.00 O ATOM 0 H GLY A 91 18.333 1.378 -0.674 1.00 0.00 H new ATOM 0 HA2 GLY A 91 20.698 2.502 0.452 1.00 0.00 H new ATOM 0 HA3 GLY A 91 19.059 3.077 0.688 1.00 0.00 H new ATOM 1404 N LEU A 92 18.671 0.978 2.635 1.00 0.00 N ATOM 1405 CA LEU A 92 18.663 0.438 4.032 1.00 0.00 C ATOM 1406 C LEU A 92 19.853 -0.502 4.271 1.00 0.00 C ATOM 1407 O LEU A 92 20.013 -1.032 5.352 1.00 0.00 O ATOM 1408 CB LEU A 92 17.341 -0.343 4.144 1.00 0.00 C ATOM 1409 CG LEU A 92 17.535 -1.804 3.715 1.00 0.00 C ATOM 1410 CD1 LEU A 92 17.893 -2.659 4.935 1.00 0.00 C ATOM 1411 CD2 LEU A 92 16.238 -2.331 3.091 1.00 0.00 C ATOM 0 H LEU A 92 17.833 0.778 2.088 1.00 0.00 H new ATOM 0 HA LEU A 92 18.745 1.235 4.771 1.00 0.00 H new ATOM 0 HB2 LEU A 92 16.977 -0.306 5.171 1.00 0.00 H new ATOM 0 HB3 LEU A 92 16.581 0.127 3.519 1.00 0.00 H new ATOM 0 HG LEU A 92 18.342 -1.859 2.985 1.00 0.00 H new ATOM 0 HD11 LEU A 92 18.030 -3.695 4.626 1.00 0.00 H new ATOM 0 HD12 LEU A 92 18.816 -2.289 5.381 1.00 0.00 H new ATOM 0 HD13 LEU A 92 17.088 -2.602 5.668 1.00 0.00 H new ATOM 0 HD21 LEU A 92 16.376 -3.368 2.786 1.00 0.00 H new ATOM 0 HD22 LEU A 92 15.432 -2.272 3.822 1.00 0.00 H new ATOM 0 HD23 LEU A 92 15.982 -1.728 2.220 1.00 0.00 H new ATOM 1423 N LYS A 93 20.655 -0.747 3.265 1.00 0.00 N ATOM 1424 CA LYS A 93 21.800 -1.694 3.424 1.00 0.00 C ATOM 1425 C LYS A 93 21.218 -3.092 3.607 1.00 0.00 C ATOM 1426 O LYS A 93 21.427 -3.745 4.609 1.00 0.00 O ATOM 1427 CB LYS A 93 22.588 -1.250 4.666 1.00 0.00 C ATOM 1428 CG LYS A 93 22.896 0.247 4.578 1.00 0.00 C ATOM 1429 CD LYS A 93 23.864 0.503 3.420 1.00 0.00 C ATOM 1430 CE LYS A 93 25.239 -0.077 3.764 1.00 0.00 C ATOM 1431 NZ LYS A 93 26.214 0.967 3.341 1.00 0.00 N ATOM 0 H LYS A 93 20.565 -0.331 2.338 1.00 0.00 H new ATOM 0 HA LYS A 93 22.466 -1.700 2.561 1.00 0.00 H new ATOM 0 HB2 LYS A 93 22.012 -1.460 5.567 1.00 0.00 H new ATOM 0 HB3 LYS A 93 23.516 -1.817 4.741 1.00 0.00 H new ATOM 0 HG2 LYS A 93 21.975 0.810 4.427 1.00 0.00 H new ATOM 0 HG3 LYS A 93 23.332 0.595 5.514 1.00 0.00 H new ATOM 0 HD2 LYS A 93 23.483 0.046 2.506 1.00 0.00 H new ATOM 0 HD3 LYS A 93 23.946 1.573 3.231 1.00 0.00 H new ATOM 0 HE2 LYS A 93 25.323 -0.287 4.830 1.00 0.00 H new ATOM 0 HE3 LYS A 93 25.414 -1.016 3.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 27.181 0.642 3.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 26.115 1.141 2.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 26.028 1.848 3.862 1.00 0.00 H new ATOM 1445 N TYR A 94 20.461 -3.530 2.632 1.00 0.00 N ATOM 1446 CA TYR A 94 19.810 -4.874 2.690 1.00 0.00 C ATOM 1447 C TYR A 94 20.731 -5.909 3.350 1.00 0.00 C ATOM 1448 O TYR A 94 20.276 -6.800 4.042 1.00 0.00 O ATOM 1449 CB TYR A 94 19.545 -5.220 1.224 1.00 0.00 C ATOM 1450 CG TYR A 94 19.241 -6.691 1.090 1.00 0.00 C ATOM 1451 CD1 TYR A 94 18.111 -7.241 1.706 1.00 0.00 C ATOM 1452 CD2 TYR A 94 20.106 -7.503 0.359 1.00 0.00 C ATOM 1453 CE1 TYR A 94 17.857 -8.612 1.587 1.00 0.00 C ATOM 1454 CE2 TYR A 94 19.849 -8.872 0.236 1.00 0.00 C ATOM 1455 CZ TYR A 94 18.726 -9.428 0.854 1.00 0.00 C ATOM 1456 OH TYR A 94 18.473 -10.779 0.741 1.00 0.00 O ATOM 0 H TYR A 94 20.264 -3.002 1.782 1.00 0.00 H new ATOM 0 HA TYR A 94 18.899 -4.873 3.289 1.00 0.00 H new ATOM 0 HB2 TYR A 94 18.708 -4.631 0.848 1.00 0.00 H new ATOM 0 HB3 TYR A 94 20.414 -4.963 0.618 1.00 0.00 H new ATOM 0 HD1 TYR A 94 17.439 -6.611 2.270 1.00 0.00 H new ATOM 0 HD2 TYR A 94 20.977 -7.074 -0.114 1.00 0.00 H new ATOM 0 HE1 TYR A 94 16.988 -9.042 2.062 1.00 0.00 H new ATOM 0 HE2 TYR A 94 20.517 -9.499 -0.336 1.00 0.00 H new ATOM 0 HH TYR A 94 19.173 -11.199 0.198 1.00 0.00 H new ATOM 1466 N GLU A 95 22.018 -5.794 3.156 1.00 0.00 N ATOM 1467 CA GLU A 95 22.953 -6.769 3.794 1.00 0.00 C ATOM 1468 C GLU A 95 22.804 -6.684 5.311 1.00 0.00 C ATOM 1469 O GLU A 95 22.650 -7.682 5.988 1.00 0.00 O ATOM 1470 CB GLU A 95 24.355 -6.345 3.364 1.00 0.00 C ATOM 1471 CG GLU A 95 24.456 -6.368 1.836 1.00 0.00 C ATOM 1472 CD GLU A 95 25.366 -5.230 1.367 1.00 0.00 C ATOM 1473 OE1 GLU A 95 24.954 -4.086 1.474 1.00 0.00 O ATOM 1474 OE2 GLU A 95 26.458 -5.522 0.908 1.00 0.00 O ATOM 0 H GLU A 95 22.461 -5.072 2.587 1.00 0.00 H new ATOM 0 HA GLU A 95 22.750 -7.798 3.497 1.00 0.00 H new ATOM 0 HB2 GLU A 95 24.573 -5.344 3.737 1.00 0.00 H new ATOM 0 HB3 GLU A 95 25.097 -7.016 3.797 1.00 0.00 H new ATOM 0 HG2 GLU A 95 24.853 -7.327 1.502 1.00 0.00 H new ATOM 0 HG3 GLU A 95 23.465 -6.261 1.394 1.00 0.00 H new ATOM 1547 N MET B 1 -5.033 6.826 -10.565 1.00 0.00 N ATOM 1548 CA MET B 1 -4.393 7.966 -9.848 1.00 0.00 C ATOM 1549 C MET B 1 -2.902 7.684 -9.637 1.00 0.00 C ATOM 1550 O MET B 1 -2.419 6.617 -9.961 1.00 0.00 O ATOM 1551 CB MET B 1 -5.118 8.042 -8.505 1.00 0.00 C ATOM 1552 CG MET B 1 -6.294 9.014 -8.611 1.00 0.00 C ATOM 1553 SD MET B 1 -7.476 8.670 -7.289 1.00 0.00 S ATOM 1554 CE MET B 1 -6.379 9.074 -5.909 1.00 0.00 C ATOM 0 H1 MET B 1 -6.020 6.730 -10.253 1.00 0.00 H new ATOM 0 H2 MET B 1 -5.010 7.003 -11.590 1.00 0.00 H new ATOM 0 H3 MET B 1 -4.516 5.949 -10.354 1.00 0.00 H new ATOM 0 HA MET B 1 -4.465 8.900 -10.405 1.00 0.00 H new ATOM 0 HB2 MET B 1 -5.475 7.053 -8.217 1.00 0.00 H new ATOM 0 HB3 MET B 1 -4.430 8.372 -7.727 1.00 0.00 H new ATOM 0 HG2 MET B 1 -5.939 10.042 -8.538 1.00 0.00 H new ATOM 0 HG3 MET B 1 -6.778 8.912 -9.582 1.00 0.00 H new ATOM 0 HE1 MET B 1 -6.971 9.226 -5.006 1.00 0.00 H new ATOM 0 HE2 MET B 1 -5.678 8.255 -5.750 1.00 0.00 H new ATOM 0 HE3 MET B 1 -5.826 9.985 -6.138 1.00 0.00 H new ATOM 1566 N ASN B 2 -2.168 8.623 -9.088 1.00 0.00 N ATOM 1567 CA ASN B 2 -0.710 8.383 -8.856 1.00 0.00 C ATOM 1568 C ASN B 2 -0.066 9.553 -8.107 1.00 0.00 C ATOM 1569 O ASN B 2 -0.740 10.362 -7.509 1.00 0.00 O ATOM 1570 CB ASN B 2 -0.090 8.227 -10.249 1.00 0.00 C ATOM 1571 CG ASN B 2 -0.311 9.507 -11.059 1.00 0.00 C ATOM 1572 OD1 ASN B 2 -1.413 10.014 -11.127 1.00 0.00 O ATOM 1573 ND2 ASN B 2 0.698 10.055 -11.679 1.00 0.00 N ATOM 0 H ASN B 2 -2.512 9.537 -8.793 1.00 0.00 H new ATOM 0 HA ASN B 2 -0.549 7.499 -8.239 1.00 0.00 H new ATOM 0 HB2 ASN B 2 0.977 8.020 -10.162 1.00 0.00 H new ATOM 0 HB3 ASN B 2 -0.538 7.377 -10.764 1.00 0.00 H new ATOM 0 HD21 ASN B 2 0.561 10.909 -12.220 1.00 0.00 H new ATOM 0 HD22 ASN B 2 1.623 9.630 -11.622 1.00 0.00 H new ATOM 1580 N LYS B 3 1.242 9.645 -8.142 1.00 0.00 N ATOM 1581 CA LYS B 3 1.939 10.762 -7.430 1.00 0.00 C ATOM 1582 C LYS B 3 1.431 12.127 -7.922 1.00 0.00 C ATOM 1583 O LYS B 3 1.823 13.156 -7.412 1.00 0.00 O ATOM 1584 CB LYS B 3 3.431 10.587 -7.749 1.00 0.00 C ATOM 1585 CG LYS B 3 4.166 10.025 -6.522 1.00 0.00 C ATOM 1586 CD LYS B 3 5.433 10.848 -6.246 1.00 0.00 C ATOM 1587 CE LYS B 3 6.591 9.918 -5.844 1.00 0.00 C ATOM 1588 NZ LYS B 3 7.449 9.816 -7.060 1.00 0.00 N ATOM 0 H LYS B 3 1.856 8.995 -8.633 1.00 0.00 H new ATOM 0 HA LYS B 3 1.751 10.732 -6.357 1.00 0.00 H new ATOM 0 HB2 LYS B 3 3.554 9.914 -8.597 1.00 0.00 H new ATOM 0 HB3 LYS B 3 3.865 11.545 -8.037 1.00 0.00 H new ATOM 0 HG2 LYS B 3 3.510 10.050 -5.652 1.00 0.00 H new ATOM 0 HG3 LYS B 3 4.430 8.981 -6.693 1.00 0.00 H new ATOM 0 HD2 LYS B 3 5.706 11.418 -7.134 1.00 0.00 H new ATOM 0 HD3 LYS B 3 5.242 11.568 -5.451 1.00 0.00 H new ATOM 0 HE2 LYS B 3 7.149 10.325 -5.001 1.00 0.00 H new ATOM 0 HE3 LYS B 3 6.222 8.939 -5.539 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 7.811 8.845 -7.149 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 6.887 10.054 -7.902 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 8.247 10.477 -6.978 1.00 0.00 H new ATOM 1602 N THR B 4 0.556 12.143 -8.899 1.00 0.00 N ATOM 1603 CA THR B 4 0.010 13.437 -9.406 1.00 0.00 C ATOM 1604 C THR B 4 -1.506 13.467 -9.175 1.00 0.00 C ATOM 1605 O THR B 4 -2.040 14.304 -8.457 1.00 0.00 O ATOM 1606 CB THR B 4 0.329 13.446 -10.902 1.00 0.00 C ATOM 1607 OG1 THR B 4 1.736 13.376 -11.084 1.00 0.00 O ATOM 1608 CG2 THR B 4 -0.206 14.733 -11.533 1.00 0.00 C ATOM 0 H THR B 4 0.197 11.311 -9.367 1.00 0.00 H new ATOM 0 HA THR B 4 0.437 14.304 -8.903 1.00 0.00 H new ATOM 0 HB THR B 4 -0.143 12.588 -11.380 1.00 0.00 H new ATOM 0 HG1 THR B 4 1.943 13.380 -12.042 1.00 0.00 H new ATOM 0 HG21 THR B 4 0.022 14.738 -12.599 1.00 0.00 H new ATOM 0 HG22 THR B 4 -1.286 14.785 -11.393 1.00 0.00 H new ATOM 0 HG23 THR B 4 0.264 15.594 -11.058 1.00 0.00 H new ATOM 1616 N GLU B 5 -2.206 12.542 -9.764 1.00 0.00 N ATOM 1617 CA GLU B 5 -3.680 12.502 -9.570 1.00 0.00 C ATOM 1618 C GLU B 5 -3.986 12.522 -8.072 1.00 0.00 C ATOM 1619 O GLU B 5 -4.841 13.259 -7.610 1.00 0.00 O ATOM 1620 CB GLU B 5 -4.137 11.201 -10.224 1.00 0.00 C ATOM 1621 CG GLU B 5 -4.411 11.437 -11.712 1.00 0.00 C ATOM 1622 CD GLU B 5 -3.113 11.834 -12.418 1.00 0.00 C ATOM 1623 OE1 GLU B 5 -2.702 12.972 -12.264 1.00 0.00 O ATOM 1624 OE2 GLU B 5 -2.553 10.994 -13.103 1.00 0.00 O ATOM 0 H GLU B 5 -1.824 11.815 -10.369 1.00 0.00 H new ATOM 0 HA GLU B 5 -4.196 13.355 -10.012 1.00 0.00 H new ATOM 0 HB2 GLU B 5 -3.372 10.434 -10.103 1.00 0.00 H new ATOM 0 HB3 GLU B 5 -5.038 10.833 -9.733 1.00 0.00 H new ATOM 0 HG2 GLU B 5 -4.821 10.534 -12.164 1.00 0.00 H new ATOM 0 HG3 GLU B 5 -5.158 12.222 -11.834 1.00 0.00 H new ATOM 1631 N LEU B 6 -3.276 11.741 -7.299 1.00 0.00 N ATOM 1632 CA LEU B 6 -3.520 11.757 -5.827 1.00 0.00 C ATOM 1633 C LEU B 6 -3.240 13.156 -5.265 1.00 0.00 C ATOM 1634 O LEU B 6 -3.885 13.590 -4.324 1.00 0.00 O ATOM 1635 CB LEU B 6 -2.554 10.733 -5.230 1.00 0.00 C ATOM 1636 CG LEU B 6 -3.145 9.328 -5.369 1.00 0.00 C ATOM 1637 CD1 LEU B 6 -2.037 8.338 -5.733 1.00 0.00 C ATOM 1638 CD2 LEU B 6 -3.784 8.910 -4.042 1.00 0.00 C ATOM 0 H LEU B 6 -2.548 11.102 -7.618 1.00 0.00 H new ATOM 0 HA LEU B 6 -4.554 11.512 -5.584 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -1.592 10.786 -5.739 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -2.372 10.959 -4.180 1.00 0.00 H new ATOM 0 HG LEU B 6 -3.901 9.330 -6.154 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -2.460 7.338 -5.831 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -1.581 8.634 -6.678 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -1.279 8.336 -4.949 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -4.205 7.909 -4.140 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -3.027 8.910 -3.258 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -4.575 9.613 -3.782 1.00 0.00 H new ATOM 1650 N ILE B 7 -2.301 13.889 -5.835 1.00 0.00 N ATOM 1651 CA ILE B 7 -2.041 15.261 -5.301 1.00 0.00 C ATOM 1652 C ILE B 7 -3.343 16.033 -5.383 1.00 0.00 C ATOM 1653 O ILE B 7 -3.721 16.731 -4.469 1.00 0.00 O ATOM 1654 CB ILE B 7 -0.928 15.926 -6.150 1.00 0.00 C ATOM 1655 CG1 ILE B 7 -1.493 16.585 -7.419 1.00 0.00 C ATOM 1656 CG2 ILE B 7 0.139 14.905 -6.537 1.00 0.00 C ATOM 1657 CD1 ILE B 7 -1.887 18.031 -7.108 1.00 0.00 C ATOM 0 H ILE B 7 -1.722 13.602 -6.624 1.00 0.00 H new ATOM 0 HA ILE B 7 -1.701 15.239 -4.266 1.00 0.00 H new ATOM 0 HB ILE B 7 -0.478 16.704 -5.533 1.00 0.00 H new ATOM 0 HG12 ILE B 7 -0.750 16.562 -8.216 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -2.360 16.029 -7.776 1.00 0.00 H new ATOM 0 HG21 ILE B 7 0.911 15.393 -7.133 1.00 0.00 H new ATOM 0 HG22 ILE B 7 0.587 14.487 -5.635 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -0.317 14.105 -7.120 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -2.288 18.500 -8.006 1.00 0.00 H new ATOM 0 HD12 ILE B 7 -2.645 18.041 -6.324 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -1.009 18.583 -6.771 1.00 0.00 H new ATOM 1669 N LYS B 8 -4.059 15.860 -6.460 1.00 0.00 N ATOM 1670 CA LYS B 8 -5.375 16.545 -6.578 1.00 0.00 C ATOM 1671 C LYS B 8 -6.293 15.980 -5.504 1.00 0.00 C ATOM 1672 O LYS B 8 -7.072 16.688 -4.901 1.00 0.00 O ATOM 1673 CB LYS B 8 -5.947 16.208 -7.961 1.00 0.00 C ATOM 1674 CG LYS B 8 -4.862 16.254 -9.044 1.00 0.00 C ATOM 1675 CD LYS B 8 -5.476 15.864 -10.394 1.00 0.00 C ATOM 1676 CE LYS B 8 -6.193 14.510 -10.273 1.00 0.00 C ATOM 1677 NZ LYS B 8 -7.630 14.811 -10.523 1.00 0.00 N ATOM 0 H LYS B 8 -3.793 15.280 -7.256 1.00 0.00 H new ATOM 0 HA LYS B 8 -5.281 17.624 -6.458 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -6.398 15.216 -7.938 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -6.741 16.913 -8.209 1.00 0.00 H new ATOM 0 HG2 LYS B 8 -4.432 17.254 -9.102 1.00 0.00 H new ATOM 0 HG3 LYS B 8 -4.050 15.573 -8.790 1.00 0.00 H new ATOM 0 HD2 LYS B 8 -6.180 16.630 -10.718 1.00 0.00 H new ATOM 0 HD3 LYS B 8 -4.697 15.806 -11.154 1.00 0.00 H new ATOM 0 HE2 LYS B 8 -5.808 13.793 -10.998 1.00 0.00 H new ATOM 0 HE3 LYS B 8 -6.047 14.073 -9.285 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 -8.185 13.934 -10.457 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 -7.971 15.490 -9.813 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 -7.739 15.219 -11.473 1.00 0.00 H new ATOM 1691 N ALA B 9 -6.193 14.697 -5.256 1.00 0.00 N ATOM 1692 CA ALA B 9 -7.047 14.068 -4.208 1.00 0.00 C ATOM 1693 C ALA B 9 -6.910 14.844 -2.902 1.00 0.00 C ATOM 1694 O ALA B 9 -7.874 15.055 -2.193 1.00 0.00 O ATOM 1695 CB ALA B 9 -6.502 12.657 -4.045 1.00 0.00 C ATOM 0 H ALA B 9 -5.556 14.060 -5.735 1.00 0.00 H new ATOM 0 HA ALA B 9 -8.103 14.065 -4.478 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -7.081 12.129 -3.288 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -6.576 12.126 -4.994 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -5.458 12.704 -3.736 1.00 0.00 H new ATOM 1701 N ILE B 10 -5.724 15.301 -2.594 1.00 0.00 N ATOM 1702 CA ILE B 10 -5.543 16.093 -1.361 1.00 0.00 C ATOM 1703 C ILE B 10 -5.672 17.560 -1.745 1.00 0.00 C ATOM 1704 O ILE B 10 -6.119 18.382 -0.983 1.00 0.00 O ATOM 1705 CB ILE B 10 -4.132 15.736 -0.862 1.00 0.00 C ATOM 1706 CG1 ILE B 10 -4.237 14.706 0.264 1.00 0.00 C ATOM 1707 CG2 ILE B 10 -3.410 16.983 -0.335 1.00 0.00 C ATOM 1708 CD1 ILE B 10 -4.838 13.409 -0.280 1.00 0.00 C ATOM 0 H ILE B 10 -4.880 15.156 -3.148 1.00 0.00 H new ATOM 0 HA ILE B 10 -6.273 15.892 -0.577 1.00 0.00 H new ATOM 0 HB ILE B 10 -3.563 15.326 -1.696 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -3.251 14.512 0.686 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -4.858 15.096 1.070 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -2.414 16.707 0.013 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -3.324 17.719 -1.134 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -3.978 17.410 0.492 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -4.912 12.677 0.524 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -5.832 13.609 -0.681 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -4.200 13.016 -1.071 1.00 0.00 H new ATOM 1720 N ALA B 11 -5.324 17.891 -2.951 1.00 0.00 N ATOM 1721 CA ALA B 11 -5.476 19.299 -3.376 1.00 0.00 C ATOM 1722 C ALA B 11 -6.971 19.628 -3.427 1.00 0.00 C ATOM 1723 O ALA B 11 -7.369 20.777 -3.438 1.00 0.00 O ATOM 1724 CB ALA B 11 -4.839 19.358 -4.763 1.00 0.00 C ATOM 0 H ALA B 11 -4.945 17.255 -3.652 1.00 0.00 H new ATOM 0 HA ALA B 11 -5.007 20.017 -2.704 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -4.909 20.373 -5.153 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -3.791 19.068 -4.695 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -5.362 18.675 -5.433 1.00 0.00 H new ATOM 1730 N GLN B 12 -7.804 18.613 -3.432 1.00 0.00 N ATOM 1731 CA GLN B 12 -9.272 18.844 -3.450 1.00 0.00 C ATOM 1732 C GLN B 12 -9.854 18.472 -2.085 1.00 0.00 C ATOM 1733 O GLN B 12 -10.659 19.194 -1.531 1.00 0.00 O ATOM 1734 CB GLN B 12 -9.815 17.949 -4.575 1.00 0.00 C ATOM 1735 CG GLN B 12 -9.833 16.483 -4.131 1.00 0.00 C ATOM 1736 CD GLN B 12 -10.231 15.595 -5.311 1.00 0.00 C ATOM 1737 OE1 GLN B 12 -9.495 15.473 -6.269 1.00 0.00 O ATOM 1738 NE2 GLN B 12 -11.374 14.966 -5.283 1.00 0.00 N ATOM 0 H GLN B 12 -7.522 17.633 -3.424 1.00 0.00 H new ATOM 0 HA GLN B 12 -9.541 19.884 -3.633 1.00 0.00 H new ATOM 0 HB2 GLN B 12 -10.822 18.266 -4.846 1.00 0.00 H new ATOM 0 HB3 GLN B 12 -9.196 18.058 -5.466 1.00 0.00 H new ATOM 0 HG2 GLN B 12 -8.850 16.193 -3.760 1.00 0.00 H new ATOM 0 HG3 GLN B 12 -10.536 16.350 -3.309 1.00 0.00 H new ATOM 0 HE21 GLN B 12 -11.993 15.068 -4.479 1.00 0.00 H new ATOM 0 HE22 GLN B 12 -11.649 14.372 -6.066 1.00 0.00 H new ATOM 1747 N ASP B 13 -9.410 17.383 -1.507 1.00 0.00 N ATOM 1748 CA ASP B 13 -9.903 17.027 -0.145 1.00 0.00 C ATOM 1749 C ASP B 13 -9.332 18.064 0.812 1.00 0.00 C ATOM 1750 O ASP B 13 -9.842 18.313 1.886 1.00 0.00 O ATOM 1751 CB ASP B 13 -9.324 15.644 0.161 1.00 0.00 C ATOM 1752 CG ASP B 13 -10.096 14.577 -0.617 1.00 0.00 C ATOM 1753 OD1 ASP B 13 -10.316 14.776 -1.799 1.00 0.00 O ATOM 1754 OD2 ASP B 13 -10.454 13.577 -0.014 1.00 0.00 O ATOM 0 H ASP B 13 -8.737 16.734 -1.914 1.00 0.00 H new ATOM 0 HA ASP B 13 -10.990 17.011 -0.060 1.00 0.00 H new ATOM 0 HB2 ASP B 13 -8.269 15.613 -0.110 1.00 0.00 H new ATOM 0 HB3 ASP B 13 -9.384 15.443 1.231 1.00 0.00 H new ATOM 1759 N THR B 14 -8.261 18.673 0.387 1.00 0.00 N ATOM 1760 CA THR B 14 -7.587 19.716 1.183 1.00 0.00 C ATOM 1761 C THR B 14 -7.583 21.015 0.361 1.00 0.00 C ATOM 1762 O THR B 14 -8.446 21.855 0.520 1.00 0.00 O ATOM 1763 CB THR B 14 -6.178 19.157 1.407 1.00 0.00 C ATOM 1764 OG1 THR B 14 -6.121 17.806 0.968 1.00 0.00 O ATOM 1765 CG2 THR B 14 -5.867 19.188 2.884 1.00 0.00 C ATOM 0 H THR B 14 -7.817 18.478 -0.510 1.00 0.00 H new ATOM 0 HA THR B 14 -8.064 19.949 2.135 1.00 0.00 H new ATOM 0 HB THR B 14 -5.460 19.759 0.849 1.00 0.00 H new ATOM 0 HG1 THR B 14 -5.875 17.228 1.720 1.00 0.00 H new ATOM 0 HG21 THR B 14 -4.866 18.792 3.053 1.00 0.00 H new ATOM 0 HG22 THR B 14 -5.917 20.215 3.245 1.00 0.00 H new ATOM 0 HG23 THR B 14 -6.594 18.579 3.422 1.00 0.00 H new ATOM 1773 N GLY B 15 -6.641 21.178 -0.537 1.00 0.00 N ATOM 1774 CA GLY B 15 -6.609 22.410 -1.388 1.00 0.00 C ATOM 1775 C GLY B 15 -6.246 23.637 -0.548 1.00 0.00 C ATOM 1776 O GLY B 15 -5.810 24.643 -1.070 1.00 0.00 O ATOM 0 H GLY B 15 -5.892 20.510 -0.718 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -5.883 22.285 -2.191 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -7.581 22.559 -1.858 1.00 0.00 H new ATOM 1780 N LEU B 16 -6.436 23.555 0.742 1.00 0.00 N ATOM 1781 CA LEU B 16 -6.115 24.721 1.657 1.00 0.00 C ATOM 1782 C LEU B 16 -4.984 25.562 1.081 1.00 0.00 C ATOM 1783 O LEU B 16 -5.126 26.740 0.820 1.00 0.00 O ATOM 1784 CB LEU B 16 -5.661 24.174 3.029 1.00 0.00 C ATOM 1785 CG LEU B 16 -5.753 22.662 3.086 1.00 0.00 C ATOM 1786 CD1 LEU B 16 -4.690 22.058 2.162 1.00 0.00 C ATOM 1787 CD2 LEU B 16 -5.506 22.185 4.523 1.00 0.00 C ATOM 0 H LEU B 16 -6.802 22.730 1.217 1.00 0.00 H new ATOM 0 HA LEU B 16 -7.008 25.338 1.758 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -4.634 24.484 3.223 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -6.279 24.606 3.816 1.00 0.00 H new ATOM 0 HG LEU B 16 -6.745 22.345 2.765 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -4.751 20.970 2.199 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -4.861 22.397 1.140 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -3.700 22.377 2.489 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -5.573 21.098 4.562 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -4.513 22.500 4.845 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -6.256 22.618 5.184 1.00 0.00 H new ATOM 1799 N THR B 17 -3.863 24.944 0.888 1.00 0.00 N ATOM 1800 CA THR B 17 -2.688 25.650 0.335 1.00 0.00 C ATOM 1801 C THR B 17 -2.075 24.811 -0.785 1.00 0.00 C ATOM 1802 O THR B 17 -1.094 25.196 -1.392 1.00 0.00 O ATOM 1803 CB THR B 17 -1.726 25.765 1.530 1.00 0.00 C ATOM 1804 OG1 THR B 17 -1.154 27.065 1.555 1.00 0.00 O ATOM 1805 CG2 THR B 17 -0.616 24.719 1.427 1.00 0.00 C ATOM 0 H THR B 17 -3.709 23.957 1.095 1.00 0.00 H new ATOM 0 HA THR B 17 -2.925 26.624 -0.093 1.00 0.00 H new ATOM 0 HB THR B 17 -2.286 25.591 2.449 1.00 0.00 H new ATOM 0 HG1 THR B 17 -0.543 27.139 2.317 1.00 0.00 H new ATOM 0 HG21 THR B 17 0.055 24.815 2.281 1.00 0.00 H new ATOM 0 HG22 THR B 17 -1.055 23.722 1.421 1.00 0.00 H new ATOM 0 HG23 THR B 17 -0.055 24.873 0.505 1.00 0.00 H new ATOM 1813 N GLN B 18 -2.613 23.640 -1.032 1.00 0.00 N ATOM 1814 CA GLN B 18 -2.010 22.759 -2.066 1.00 0.00 C ATOM 1815 C GLN B 18 -0.560 22.546 -1.672 1.00 0.00 C ATOM 1816 O GLN B 18 0.309 22.391 -2.505 1.00 0.00 O ATOM 1817 CB GLN B 18 -2.123 23.514 -3.395 1.00 0.00 C ATOM 1818 CG GLN B 18 -3.513 24.137 -3.512 1.00 0.00 C ATOM 1819 CD GLN B 18 -3.924 24.206 -4.985 1.00 0.00 C ATOM 1820 OE1 GLN B 18 -4.475 23.265 -5.519 1.00 0.00 O ATOM 1821 NE2 GLN B 18 -3.676 25.290 -5.667 1.00 0.00 N ATOM 0 H GLN B 18 -3.437 23.264 -0.563 1.00 0.00 H new ATOM 0 HA GLN B 18 -2.499 21.789 -2.157 1.00 0.00 H new ATOM 0 HB2 GLN B 18 -1.359 24.290 -3.450 1.00 0.00 H new ATOM 0 HB3 GLN B 18 -1.947 22.833 -4.228 1.00 0.00 H new ATOM 0 HG2 GLN B 18 -4.236 23.546 -2.950 1.00 0.00 H new ATOM 0 HG3 GLN B 18 -3.512 25.137 -3.077 1.00 0.00 H new ATOM 0 HE21 GLN B 18 -3.213 26.080 -5.218 1.00 0.00 H new ATOM 0 HE22 GLN B 18 -3.945 25.347 -6.649 1.00 0.00 H new ATOM 1830 N VAL B 19 -0.321 22.563 -0.376 1.00 0.00 N ATOM 1831 CA VAL B 19 1.055 22.390 0.189 1.00 0.00 C ATOM 1832 C VAL B 19 2.024 21.988 -0.922 1.00 0.00 C ATOM 1833 O VAL B 19 2.491 22.812 -1.684 1.00 0.00 O ATOM 1834 CB VAL B 19 0.900 21.301 1.290 1.00 0.00 C ATOM 1835 CG1 VAL B 19 0.061 20.122 0.776 1.00 0.00 C ATOM 1836 CG2 VAL B 19 2.270 20.769 1.744 1.00 0.00 C ATOM 0 H VAL B 19 -1.046 22.694 0.329 1.00 0.00 H new ATOM 0 HA VAL B 19 1.469 23.303 0.617 1.00 0.00 H new ATOM 0 HB VAL B 19 0.397 21.770 2.136 1.00 0.00 H new ATOM 0 HG11 VAL B 19 -0.034 19.373 1.562 1.00 0.00 H new ATOM 0 HG12 VAL B 19 -0.929 20.477 0.491 1.00 0.00 H new ATOM 0 HG13 VAL B 19 0.550 19.678 -0.091 1.00 0.00 H new ATOM 0 HG21 VAL B 19 2.129 20.010 2.513 1.00 0.00 H new ATOM 0 HG22 VAL B 19 2.790 20.330 0.893 1.00 0.00 H new ATOM 0 HG23 VAL B 19 2.863 21.589 2.148 1.00 0.00 H new ATOM 1846 N SER B 20 2.285 20.738 -1.042 1.00 0.00 N ATOM 1847 CA SER B 20 3.152 20.242 -2.102 1.00 0.00 C ATOM 1848 C SER B 20 2.445 19.062 -2.718 1.00 0.00 C ATOM 1849 O SER B 20 3.075 18.219 -3.286 1.00 0.00 O ATOM 1850 CB SER B 20 4.431 19.807 -1.416 1.00 0.00 C ATOM 1851 OG SER B 20 5.425 20.810 -1.584 1.00 0.00 O ATOM 0 H SER B 20 1.917 20.015 -0.423 1.00 0.00 H new ATOM 0 HA SER B 20 3.373 20.975 -2.878 1.00 0.00 H new ATOM 0 HB2 SER B 20 4.247 19.636 -0.355 1.00 0.00 H new ATOM 0 HB3 SER B 20 4.778 18.863 -1.835 1.00 0.00 H new ATOM 0 HG SER B 20 6.306 20.436 -1.372 1.00 0.00 H new ATOM 1857 N VAL B 21 1.139 18.968 -2.574 1.00 0.00 N ATOM 1858 CA VAL B 21 0.389 17.805 -3.134 1.00 0.00 C ATOM 1859 C VAL B 21 1.241 17.121 -4.191 1.00 0.00 C ATOM 1860 O VAL B 21 1.323 15.911 -4.279 1.00 0.00 O ATOM 1861 CB VAL B 21 -0.869 18.416 -3.752 1.00 0.00 C ATOM 1862 CG1 VAL B 21 -1.713 19.068 -2.655 1.00 0.00 C ATOM 1863 CG2 VAL B 21 -0.482 19.475 -4.791 1.00 0.00 C ATOM 0 H VAL B 21 0.562 19.655 -2.088 1.00 0.00 H new ATOM 0 HA VAL B 21 0.141 17.052 -2.386 1.00 0.00 H new ATOM 0 HB VAL B 21 -1.444 17.628 -4.239 1.00 0.00 H new ATOM 0 HG11 VAL B 21 -2.610 19.503 -3.096 1.00 0.00 H new ATOM 0 HG12 VAL B 21 -1.999 18.315 -1.920 1.00 0.00 H new ATOM 0 HG13 VAL B 21 -1.133 19.850 -2.166 1.00 0.00 H new ATOM 0 HG21 VAL B 21 -1.384 19.905 -5.226 1.00 0.00 H new ATOM 0 HG22 VAL B 21 0.099 20.262 -4.310 1.00 0.00 H new ATOM 0 HG23 VAL B 21 0.115 19.012 -5.577 1.00 0.00 H new ATOM 1873 N SER B 22 1.926 17.923 -4.941 1.00 0.00 N ATOM 1874 CA SER B 22 2.848 17.385 -5.983 1.00 0.00 C ATOM 1875 C SER B 22 4.152 16.930 -5.316 1.00 0.00 C ATOM 1876 O SER B 22 4.659 15.855 -5.579 1.00 0.00 O ATOM 1877 CB SER B 22 3.107 18.554 -6.933 1.00 0.00 C ATOM 1878 OG SER B 22 4.141 18.201 -7.840 1.00 0.00 O ATOM 0 H SER B 22 1.891 18.941 -4.882 1.00 0.00 H new ATOM 0 HA SER B 22 2.433 16.528 -6.513 1.00 0.00 H new ATOM 0 HB2 SER B 22 2.197 18.802 -7.479 1.00 0.00 H new ATOM 0 HB3 SER B 22 3.391 19.441 -6.367 1.00 0.00 H new ATOM 0 HG SER B 22 4.309 18.948 -8.452 1.00 0.00 H new ATOM 1884 N LYS B 23 4.680 17.735 -4.429 1.00 0.00 N ATOM 1885 CA LYS B 23 5.927 17.355 -3.716 1.00 0.00 C ATOM 1886 C LYS B 23 5.582 16.588 -2.435 1.00 0.00 C ATOM 1887 O LYS B 23 6.389 15.840 -1.919 1.00 0.00 O ATOM 1888 CB LYS B 23 6.625 18.677 -3.394 1.00 0.00 C ATOM 1889 CG LYS B 23 7.499 19.106 -4.573 1.00 0.00 C ATOM 1890 CD LYS B 23 7.980 20.548 -4.359 1.00 0.00 C ATOM 1891 CE LYS B 23 6.774 21.475 -4.155 1.00 0.00 C ATOM 1892 NZ LYS B 23 7.035 22.648 -5.035 1.00 0.00 N ATOM 0 H LYS B 23 4.295 18.643 -4.170 1.00 0.00 H new ATOM 0 HA LYS B 23 6.566 16.703 -4.312 1.00 0.00 H new ATOM 0 HB2 LYS B 23 5.884 19.447 -3.181 1.00 0.00 H new ATOM 0 HB3 LYS B 23 7.236 18.567 -2.498 1.00 0.00 H new ATOM 0 HG2 LYS B 23 8.354 18.437 -4.667 1.00 0.00 H new ATOM 0 HG3 LYS B 23 6.934 19.034 -5.503 1.00 0.00 H new ATOM 0 HD2 LYS B 23 8.638 20.596 -3.491 1.00 0.00 H new ATOM 0 HD3 LYS B 23 8.562 20.878 -5.219 1.00 0.00 H new ATOM 0 HE2 LYS B 23 5.843 20.977 -4.427 1.00 0.00 H new ATOM 0 HE3 LYS B 23 6.681 21.777 -3.112 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 6.252 23.327 -4.950 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 7.924 23.106 -4.748 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 7.112 22.331 -6.022 1.00 0.00 H new ATOM 1906 N MET B 24 4.380 16.743 -1.925 1.00 0.00 N ATOM 1907 CA MET B 24 3.983 16.018 -0.725 1.00 0.00 C ATOM 1908 C MET B 24 3.874 14.544 -1.101 1.00 0.00 C ATOM 1909 O MET B 24 4.301 13.677 -0.363 1.00 0.00 O ATOM 1910 CB MET B 24 2.647 16.670 -0.394 1.00 0.00 C ATOM 1911 CG MET B 24 2.075 16.081 0.873 1.00 0.00 C ATOM 1912 SD MET B 24 1.237 14.512 0.525 1.00 0.00 S ATOM 1913 CE MET B 24 0.590 14.961 -1.098 1.00 0.00 C ATOM 0 H MET B 24 3.663 17.356 -2.313 1.00 0.00 H new ATOM 0 HA MET B 24 4.660 16.059 0.128 1.00 0.00 H new ATOM 0 HB2 MET B 24 2.779 17.745 -0.276 1.00 0.00 H new ATOM 0 HB3 MET B 24 1.949 16.523 -1.218 1.00 0.00 H new ATOM 0 HG2 MET B 24 2.873 15.920 1.598 1.00 0.00 H new ATOM 0 HG3 MET B 24 1.372 16.783 1.322 1.00 0.00 H new ATOM 0 HE1 MET B 24 -0.205 14.269 -1.377 1.00 0.00 H new ATOM 0 HE2 MET B 24 0.193 15.975 -1.063 1.00 0.00 H new ATOM 0 HE3 MET B 24 1.391 14.910 -1.836 1.00 0.00 H new ATOM 1923 N LEU B 25 3.365 14.252 -2.276 1.00 0.00 N ATOM 1924 CA LEU B 25 3.315 12.832 -2.705 1.00 0.00 C ATOM 1925 C LEU B 25 4.738 12.427 -3.068 1.00 0.00 C ATOM 1926 O LEU B 25 5.207 11.362 -2.714 1.00 0.00 O ATOM 1927 CB LEU B 25 2.406 12.775 -3.933 1.00 0.00 C ATOM 1928 CG LEU B 25 0.935 12.657 -3.512 1.00 0.00 C ATOM 1929 CD1 LEU B 25 0.102 12.225 -4.716 1.00 0.00 C ATOM 1930 CD2 LEU B 25 0.775 11.608 -2.404 1.00 0.00 C ATOM 0 H LEU B 25 2.990 14.928 -2.941 1.00 0.00 H new ATOM 0 HA LEU B 25 2.933 12.163 -1.934 1.00 0.00 H new ATOM 0 HB2 LEU B 25 2.546 13.671 -4.537 1.00 0.00 H new ATOM 0 HB3 LEU B 25 2.681 11.924 -4.556 1.00 0.00 H new ATOM 0 HG LEU B 25 0.599 13.625 -3.141 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.944 12.139 -4.423 1.00 0.00 H new ATOM 0 HD12 LEU B 25 0.197 12.967 -5.509 1.00 0.00 H new ATOM 0 HD13 LEU B 25 0.458 11.260 -5.077 1.00 0.00 H new ATOM 0 HD21 LEU B 25 -0.274 11.538 -2.118 1.00 0.00 H new ATOM 0 HD22 LEU B 25 1.117 10.639 -2.768 1.00 0.00 H new ATOM 0 HD23 LEU B 25 1.368 11.900 -1.538 1.00 0.00 H new ATOM 1942 N ALA B 26 5.449 13.303 -3.738 1.00 0.00 N ATOM 1943 CA ALA B 26 6.866 13.002 -4.080 1.00 0.00 C ATOM 1944 C ALA B 26 7.614 12.740 -2.775 1.00 0.00 C ATOM 1945 O ALA B 26 8.489 11.901 -2.695 1.00 0.00 O ATOM 1946 CB ALA B 26 7.397 14.261 -4.768 1.00 0.00 C ATOM 0 H ALA B 26 5.107 14.208 -4.059 1.00 0.00 H new ATOM 0 HA ALA B 26 6.983 12.132 -4.727 1.00 0.00 H new ATOM 0 HB1 ALA B 26 8.439 14.110 -5.048 1.00 0.00 H new ATOM 0 HB2 ALA B 26 6.807 14.464 -5.662 1.00 0.00 H new ATOM 0 HB3 ALA B 26 7.324 15.107 -4.085 1.00 0.00 H new ATOM 1952 N SER B 27 7.230 13.440 -1.738 1.00 0.00 N ATOM 1953 CA SER B 27 7.864 13.233 -0.410 1.00 0.00 C ATOM 1954 C SER B 27 7.251 11.989 0.227 1.00 0.00 C ATOM 1955 O SER B 27 7.909 11.241 0.917 1.00 0.00 O ATOM 1956 CB SER B 27 7.524 14.484 0.400 1.00 0.00 C ATOM 1957 OG SER B 27 8.399 15.538 0.025 1.00 0.00 O ATOM 0 H SER B 27 6.498 14.150 -1.759 1.00 0.00 H new ATOM 0 HA SER B 27 8.943 13.087 -0.465 1.00 0.00 H new ATOM 0 HB2 SER B 27 6.489 14.775 0.223 1.00 0.00 H new ATOM 0 HB3 SER B 27 7.620 14.278 1.466 1.00 0.00 H new ATOM 0 HG SER B 27 8.042 15.994 -0.765 1.00 0.00 H new ATOM 1963 N PHE B 28 5.990 11.752 -0.035 1.00 0.00 N ATOM 1964 CA PHE B 28 5.317 10.540 0.516 1.00 0.00 C ATOM 1965 C PHE B 28 6.041 9.319 -0.017 1.00 0.00 C ATOM 1966 O PHE B 28 6.566 8.527 0.733 1.00 0.00 O ATOM 1967 CB PHE B 28 3.876 10.628 -0.003 1.00 0.00 C ATOM 1968 CG PHE B 28 3.201 9.270 -0.011 1.00 0.00 C ATOM 1969 CD1 PHE B 28 3.368 8.401 -1.101 1.00 0.00 C ATOM 1970 CD2 PHE B 28 2.375 8.894 1.055 1.00 0.00 C ATOM 1971 CE1 PHE B 28 2.713 7.169 -1.117 1.00 0.00 C ATOM 1972 CE2 PHE B 28 1.726 7.659 1.038 1.00 0.00 C ATOM 1973 CZ PHE B 28 1.890 6.797 -0.049 1.00 0.00 C ATOM 0 H PHE B 28 5.396 12.350 -0.610 1.00 0.00 H new ATOM 0 HA PHE B 28 5.328 10.474 1.604 1.00 0.00 H new ATOM 0 HB2 PHE B 28 3.305 11.315 0.622 1.00 0.00 H new ATOM 0 HB3 PHE B 28 3.877 11.040 -1.012 1.00 0.00 H new ATOM 0 HD1 PHE B 28 4.003 8.686 -1.927 1.00 0.00 H new ATOM 0 HD2 PHE B 28 2.240 9.562 1.893 1.00 0.00 H new ATOM 0 HE1 PHE B 28 2.842 6.501 -1.956 1.00 0.00 H new ATOM 0 HE2 PHE B 28 1.096 7.369 1.866 1.00 0.00 H new ATOM 0 HZ PHE B 28 1.382 5.844 -0.065 1.00 0.00 H new ATOM 1983 N GLU B 29 6.128 9.175 -1.302 1.00 0.00 N ATOM 1984 CA GLU B 29 6.878 8.017 -1.825 1.00 0.00 C ATOM 1985 C GLU B 29 8.292 8.099 -1.277 1.00 0.00 C ATOM 1986 O GLU B 29 8.936 7.102 -1.020 1.00 0.00 O ATOM 1987 CB GLU B 29 6.899 8.168 -3.334 1.00 0.00 C ATOM 1988 CG GLU B 29 7.741 7.034 -3.904 1.00 0.00 C ATOM 1989 CD GLU B 29 8.684 7.576 -4.981 1.00 0.00 C ATOM 1990 OE1 GLU B 29 9.307 8.597 -4.738 1.00 0.00 O ATOM 1991 OE2 GLU B 29 8.767 6.961 -6.031 1.00 0.00 O ATOM 0 H GLU B 29 5.720 9.797 -2.000 1.00 0.00 H new ATOM 0 HA GLU B 29 6.434 7.063 -1.541 1.00 0.00 H new ATOM 0 HB2 GLU B 29 5.886 8.131 -3.736 1.00 0.00 H new ATOM 0 HB3 GLU B 29 7.318 9.134 -3.615 1.00 0.00 H new ATOM 0 HG2 GLU B 29 8.317 6.562 -3.108 1.00 0.00 H new ATOM 0 HG3 GLU B 29 7.094 6.266 -4.328 1.00 0.00 H new ATOM 1998 N LYS B 30 8.768 9.297 -1.075 1.00 0.00 N ATOM 1999 CA LYS B 30 10.124 9.451 -0.520 1.00 0.00 C ATOM 2000 C LYS B 30 10.119 8.944 0.910 1.00 0.00 C ATOM 2001 O LYS B 30 11.105 8.484 1.395 1.00 0.00 O ATOM 2002 CB LYS B 30 10.447 10.942 -0.570 1.00 0.00 C ATOM 2003 CG LYS B 30 11.911 11.142 -0.178 1.00 0.00 C ATOM 2004 CD LYS B 30 12.254 12.633 -0.201 1.00 0.00 C ATOM 2005 CE LYS B 30 12.250 13.143 -1.646 1.00 0.00 C ATOM 2006 NZ LYS B 30 13.437 12.510 -2.287 1.00 0.00 N ATOM 0 H LYS B 30 8.273 10.167 -1.272 1.00 0.00 H new ATOM 0 HA LYS B 30 10.871 8.887 -1.079 1.00 0.00 H new ATOM 0 HB2 LYS B 30 10.267 11.334 -1.571 1.00 0.00 H new ATOM 0 HB3 LYS B 30 9.796 11.492 0.109 1.00 0.00 H new ATOM 0 HG2 LYS B 30 12.090 10.734 0.817 1.00 0.00 H new ATOM 0 HG3 LYS B 30 12.559 10.600 -0.867 1.00 0.00 H new ATOM 0 HD2 LYS B 30 11.531 13.191 0.394 1.00 0.00 H new ATOM 0 HD3 LYS B 30 13.233 12.798 0.250 1.00 0.00 H new ATOM 0 HE2 LYS B 30 11.330 12.864 -2.159 1.00 0.00 H new ATOM 0 HE3 LYS B 30 12.317 14.230 -1.680 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 14.008 13.240 -2.759 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 14.012 12.036 -1.561 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 13.121 11.811 -2.989 1.00 0.00 H new ATOM 2020 N ILE B 31 9.007 8.978 1.587 1.00 0.00 N ATOM 2021 CA ILE B 31 9.011 8.438 2.975 1.00 0.00 C ATOM 2022 C ILE B 31 8.463 7.019 2.972 1.00 0.00 C ATOM 2023 O ILE B 31 8.874 6.189 3.752 1.00 0.00 O ATOM 2024 CB ILE B 31 8.200 9.367 3.874 1.00 0.00 C ATOM 2025 CG1 ILE B 31 7.075 10.072 3.134 1.00 0.00 C ATOM 2026 CG2 ILE B 31 9.144 10.405 4.479 1.00 0.00 C ATOM 2027 CD1 ILE B 31 5.774 9.771 3.863 1.00 0.00 C ATOM 0 H ILE B 31 8.117 9.346 1.252 1.00 0.00 H new ATOM 0 HA ILE B 31 10.027 8.394 3.367 1.00 0.00 H new ATOM 0 HB ILE B 31 7.734 8.758 4.649 1.00 0.00 H new ATOM 0 HG12 ILE B 31 7.254 11.147 3.102 1.00 0.00 H new ATOM 0 HG13 ILE B 31 7.022 9.727 2.102 1.00 0.00 H new ATOM 0 HG21 ILE B 31 8.579 11.078 5.125 1.00 0.00 H new ATOM 0 HG22 ILE B 31 9.913 9.900 5.064 1.00 0.00 H new ATOM 0 HG23 ILE B 31 9.614 10.979 3.680 1.00 0.00 H new ATOM 0 HD11 ILE B 31 4.948 10.266 3.352 1.00 0.00 H new ATOM 0 HD12 ILE B 31 5.603 8.695 3.872 1.00 0.00 H new ATOM 0 HD13 ILE B 31 5.838 10.137 4.888 1.00 0.00 H new ATOM 2039 N ILE B 32 7.580 6.714 2.068 1.00 0.00 N ATOM 2040 CA ILE B 32 7.072 5.313 1.999 1.00 0.00 C ATOM 2041 C ILE B 32 8.212 4.437 1.546 1.00 0.00 C ATOM 2042 O ILE B 32 8.699 3.582 2.261 1.00 0.00 O ATOM 2043 CB ILE B 32 5.983 5.248 0.924 1.00 0.00 C ATOM 2044 CG1 ILE B 32 4.628 5.693 1.492 1.00 0.00 C ATOM 2045 CG2 ILE B 32 5.834 3.790 0.479 1.00 0.00 C ATOM 2046 CD1 ILE B 32 4.644 7.171 1.836 1.00 0.00 C ATOM 0 H ILE B 32 7.190 7.360 1.382 1.00 0.00 H new ATOM 0 HA ILE B 32 6.682 4.994 2.966 1.00 0.00 H new ATOM 0 HB ILE B 32 6.267 5.902 0.099 1.00 0.00 H new ATOM 0 HG12 ILE B 32 3.841 5.493 0.765 1.00 0.00 H new ATOM 0 HG13 ILE B 32 4.394 5.111 2.383 1.00 0.00 H new ATOM 0 HG21 ILE B 32 5.062 3.721 -0.288 1.00 0.00 H new ATOM 0 HG22 ILE B 32 6.781 3.435 0.073 1.00 0.00 H new ATOM 0 HG23 ILE B 32 5.552 3.176 1.334 1.00 0.00 H new ATOM 0 HD11 ILE B 32 3.673 7.462 2.236 1.00 0.00 H new ATOM 0 HD12 ILE B 32 5.416 7.363 2.581 1.00 0.00 H new ATOM 0 HD13 ILE B 32 4.855 7.751 0.938 1.00 0.00 H new ATOM 2058 N THR B 33 8.620 4.650 0.334 1.00 0.00 N ATOM 2059 CA THR B 33 9.709 3.847 -0.226 1.00 0.00 C ATOM 2060 C THR B 33 10.970 4.050 0.616 1.00 0.00 C ATOM 2061 O THR B 33 11.726 3.124 0.852 1.00 0.00 O ATOM 2062 CB THR B 33 9.855 4.342 -1.672 1.00 0.00 C ATOM 2063 OG1 THR B 33 9.658 3.257 -2.563 1.00 0.00 O ATOM 2064 CG2 THR B 33 11.230 4.942 -1.911 1.00 0.00 C ATOM 0 H THR B 33 8.235 5.357 -0.293 1.00 0.00 H new ATOM 0 HA THR B 33 9.521 2.773 -0.216 1.00 0.00 H new ATOM 0 HB THR B 33 9.106 5.115 -1.846 1.00 0.00 H new ATOM 0 HG1 THR B 33 8.888 3.443 -3.140 1.00 0.00 H new ATOM 0 HG21 THR B 33 11.303 5.284 -2.943 1.00 0.00 H new ATOM 0 HG22 THR B 33 11.381 5.786 -1.238 1.00 0.00 H new ATOM 0 HG23 THR B 33 11.994 4.187 -1.723 1.00 0.00 H new ATOM 2072 N GLU B 34 11.199 5.250 1.085 1.00 0.00 N ATOM 2073 CA GLU B 34 12.402 5.488 1.914 1.00 0.00 C ATOM 2074 C GLU B 34 12.240 4.875 3.306 1.00 0.00 C ATOM 2075 O GLU B 34 13.175 4.308 3.821 1.00 0.00 O ATOM 2076 CB GLU B 34 12.524 6.999 1.992 1.00 0.00 C ATOM 2077 CG GLU B 34 13.061 7.524 0.646 1.00 0.00 C ATOM 2078 CD GLU B 34 14.487 7.012 0.419 1.00 0.00 C ATOM 2079 OE1 GLU B 34 15.077 6.511 1.363 1.00 0.00 O ATOM 2080 OE2 GLU B 34 14.966 7.132 -0.697 1.00 0.00 O ATOM 0 H GLU B 34 10.606 6.065 0.928 1.00 0.00 H new ATOM 0 HA GLU B 34 13.293 5.027 1.487 1.00 0.00 H new ATOM 0 HB2 GLU B 34 11.554 7.445 2.211 1.00 0.00 H new ATOM 0 HB3 GLU B 34 13.196 7.282 2.803 1.00 0.00 H new ATOM 0 HG2 GLU B 34 12.413 7.196 -0.167 1.00 0.00 H new ATOM 0 HG3 GLU B 34 13.051 8.614 0.641 1.00 0.00 H new ATOM 2087 N THR B 35 11.076 4.957 3.930 1.00 0.00 N ATOM 2088 CA THR B 35 10.953 4.338 5.290 1.00 0.00 C ATOM 2089 C THR B 35 11.200 2.847 5.189 1.00 0.00 C ATOM 2090 O THR B 35 11.985 2.295 5.936 1.00 0.00 O ATOM 2091 CB THR B 35 9.536 4.596 5.799 1.00 0.00 C ATOM 2092 OG1 THR B 35 9.373 5.981 6.069 1.00 0.00 O ATOM 2093 CG2 THR B 35 9.330 3.793 7.091 1.00 0.00 C ATOM 0 H THR B 35 10.237 5.410 3.567 1.00 0.00 H new ATOM 0 HA THR B 35 11.683 4.769 5.975 1.00 0.00 H new ATOM 0 HB THR B 35 8.807 4.292 5.048 1.00 0.00 H new ATOM 0 HG1 THR B 35 9.198 6.459 5.232 1.00 0.00 H new ATOM 0 HG21 THR B 35 8.322 3.965 7.470 1.00 0.00 H new ATOM 0 HG22 THR B 35 9.464 2.731 6.885 1.00 0.00 H new ATOM 0 HG23 THR B 35 10.057 4.112 7.838 1.00 0.00 H new ATOM 2101 N VAL B 36 10.552 2.184 4.272 1.00 0.00 N ATOM 2102 CA VAL B 36 10.789 0.723 4.139 1.00 0.00 C ATOM 2103 C VAL B 36 12.293 0.495 4.056 1.00 0.00 C ATOM 2104 O VAL B 36 12.847 -0.386 4.685 1.00 0.00 O ATOM 2105 CB VAL B 36 10.086 0.308 2.835 1.00 0.00 C ATOM 2106 CG1 VAL B 36 11.099 -0.260 1.832 1.00 0.00 C ATOM 2107 CG2 VAL B 36 9.034 -0.753 3.153 1.00 0.00 C ATOM 0 H VAL B 36 9.879 2.584 3.619 1.00 0.00 H new ATOM 0 HA VAL B 36 10.406 0.141 4.978 1.00 0.00 H new ATOM 0 HB VAL B 36 9.614 1.185 2.392 1.00 0.00 H new ATOM 0 HG11 VAL B 36 10.582 -0.548 0.916 1.00 0.00 H new ATOM 0 HG12 VAL B 36 11.848 0.498 1.603 1.00 0.00 H new ATOM 0 HG13 VAL B 36 11.587 -1.134 2.263 1.00 0.00 H new ATOM 0 HG21 VAL B 36 8.531 -1.053 2.234 1.00 0.00 H new ATOM 0 HG22 VAL B 36 9.517 -1.621 3.602 1.00 0.00 H new ATOM 0 HG23 VAL B 36 8.303 -0.343 3.850 1.00 0.00 H new ATOM 2117 N ALA B 37 12.955 1.313 3.294 1.00 0.00 N ATOM 2118 CA ALA B 37 14.421 1.186 3.173 1.00 0.00 C ATOM 2119 C ALA B 37 15.103 2.004 4.269 1.00 0.00 C ATOM 2120 O ALA B 37 16.303 1.960 4.444 1.00 0.00 O ATOM 2121 CB ALA B 37 14.747 1.730 1.804 1.00 0.00 C ATOM 0 H ALA B 37 12.538 2.067 2.748 1.00 0.00 H new ATOM 0 HA ALA B 37 14.767 0.159 3.286 1.00 0.00 H new ATOM 0 HB1 ALA B 37 15.822 1.671 1.636 1.00 0.00 H new ATOM 0 HB2 ALA B 37 14.228 1.143 1.046 1.00 0.00 H new ATOM 0 HB3 ALA B 37 14.426 2.770 1.740 1.00 0.00 H new ATOM 2127 N LYS B 38 14.337 2.713 5.043 1.00 0.00 N ATOM 2128 CA LYS B 38 14.939 3.475 6.169 1.00 0.00 C ATOM 2129 C LYS B 38 14.959 2.528 7.343 1.00 0.00 C ATOM 2130 O LYS B 38 15.793 2.608 8.225 1.00 0.00 O ATOM 2131 CB LYS B 38 14.028 4.673 6.442 1.00 0.00 C ATOM 2132 CG LYS B 38 14.873 5.860 6.920 1.00 0.00 C ATOM 2133 CD LYS B 38 14.951 6.917 5.814 1.00 0.00 C ATOM 2134 CE LYS B 38 15.604 6.312 4.566 1.00 0.00 C ATOM 2135 NZ LYS B 38 16.282 7.454 3.893 1.00 0.00 N ATOM 0 H LYS B 38 13.325 2.799 4.947 1.00 0.00 H new ATOM 0 HA LYS B 38 15.946 3.839 5.966 1.00 0.00 H new ATOM 0 HB2 LYS B 38 13.483 4.942 5.537 1.00 0.00 H new ATOM 0 HB3 LYS B 38 13.285 4.414 7.197 1.00 0.00 H new ATOM 0 HG2 LYS B 38 14.434 6.292 7.819 1.00 0.00 H new ATOM 0 HG3 LYS B 38 15.875 5.522 7.185 1.00 0.00 H new ATOM 0 HD2 LYS B 38 13.952 7.280 5.574 1.00 0.00 H new ATOM 0 HD3 LYS B 38 15.528 7.775 6.158 1.00 0.00 H new ATOM 0 HE2 LYS B 38 16.317 5.532 4.833 1.00 0.00 H new ATOM 0 HE3 LYS B 38 14.860 5.855 3.914 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 16.085 7.422 2.872 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 15.927 8.349 4.286 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 17.308 7.390 4.049 1.00 0.00 H new ATOM 2149 N GLY B 39 14.055 1.591 7.321 1.00 0.00 N ATOM 2150 CA GLY B 39 14.015 0.582 8.380 1.00 0.00 C ATOM 2151 C GLY B 39 12.706 0.663 9.163 1.00 0.00 C ATOM 2152 O GLY B 39 12.693 0.511 10.369 1.00 0.00 O ATOM 0 H GLY B 39 13.340 1.491 6.601 1.00 0.00 H new ATOM 0 HA2 GLY B 39 14.122 -0.412 7.945 1.00 0.00 H new ATOM 0 HA3 GLY B 39 14.857 0.726 9.057 1.00 0.00 H new ATOM 2156 N ASP B 40 11.599 0.891 8.502 1.00 0.00 N ATOM 2157 CA ASP B 40 10.309 0.961 9.254 1.00 0.00 C ATOM 2158 C ASP B 40 9.161 0.391 8.415 1.00 0.00 C ATOM 2159 O ASP B 40 9.257 0.266 7.210 1.00 0.00 O ATOM 2160 CB ASP B 40 10.094 2.447 9.543 1.00 0.00 C ATOM 2161 CG ASP B 40 10.350 2.724 11.026 1.00 0.00 C ATOM 2162 OD1 ASP B 40 9.448 2.495 11.815 1.00 0.00 O ATOM 2163 OD2 ASP B 40 11.443 3.159 11.347 1.00 0.00 O ATOM 0 H ASP B 40 11.531 1.029 7.494 1.00 0.00 H new ATOM 0 HA ASP B 40 10.338 0.373 10.171 1.00 0.00 H new ATOM 0 HB2 ASP B 40 10.765 3.048 8.929 1.00 0.00 H new ATOM 0 HB3 ASP B 40 9.077 2.736 9.279 1.00 0.00 H new ATOM 2168 N LYS B 41 8.076 0.041 9.055 1.00 0.00 N ATOM 2169 CA LYS B 41 6.913 -0.526 8.317 1.00 0.00 C ATOM 2170 C LYS B 41 5.784 0.502 8.249 1.00 0.00 C ATOM 2171 O LYS B 41 5.001 0.641 9.168 1.00 0.00 O ATOM 2172 CB LYS B 41 6.476 -1.742 9.139 1.00 0.00 C ATOM 2173 CG LYS B 41 7.401 -2.924 8.839 1.00 0.00 C ATOM 2174 CD LYS B 41 8.542 -2.951 9.858 1.00 0.00 C ATOM 2175 CE LYS B 41 8.041 -3.554 11.172 1.00 0.00 C ATOM 2176 NZ LYS B 41 9.254 -3.668 12.030 1.00 0.00 N ATOM 0 H LYS B 41 7.947 0.125 10.063 1.00 0.00 H new ATOM 0 HA LYS B 41 7.166 -0.795 7.291 1.00 0.00 H new ATOM 0 HB2 LYS B 41 6.506 -1.505 10.202 1.00 0.00 H new ATOM 0 HB3 LYS B 41 5.445 -2.004 8.900 1.00 0.00 H new ATOM 0 HG2 LYS B 41 6.840 -3.858 8.880 1.00 0.00 H new ATOM 0 HG3 LYS B 41 7.803 -2.838 7.829 1.00 0.00 H new ATOM 0 HD2 LYS B 41 9.375 -3.538 9.471 1.00 0.00 H new ATOM 0 HD3 LYS B 41 8.915 -1.941 10.028 1.00 0.00 H new ATOM 0 HE2 LYS B 41 7.287 -2.918 11.636 1.00 0.00 H new ATOM 0 HE3 LYS B 41 7.580 -4.528 11.009 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 8.991 -4.074 12.951 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 9.951 -4.285 11.566 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 9.668 -2.725 12.174 1.00 0.00 H new ATOM 2190 N VAL B 42 5.696 1.220 7.165 1.00 0.00 N ATOM 2191 CA VAL B 42 4.613 2.244 7.033 1.00 0.00 C ATOM 2192 C VAL B 42 3.243 1.566 7.129 1.00 0.00 C ATOM 2193 O VAL B 42 2.913 0.699 6.343 1.00 0.00 O ATOM 2194 CB VAL B 42 4.817 2.870 5.651 1.00 0.00 C ATOM 2195 CG1 VAL B 42 3.722 3.906 5.389 1.00 0.00 C ATOM 2196 CG2 VAL B 42 6.184 3.556 5.598 1.00 0.00 C ATOM 0 H VAL B 42 6.324 1.145 6.364 1.00 0.00 H new ATOM 0 HA VAL B 42 4.652 2.996 7.821 1.00 0.00 H new ATOM 0 HB VAL B 42 4.769 2.089 4.892 1.00 0.00 H new ATOM 0 HG11 VAL B 42 3.869 4.350 4.405 1.00 0.00 H new ATOM 0 HG12 VAL B 42 2.746 3.421 5.426 1.00 0.00 H new ATOM 0 HG13 VAL B 42 3.769 4.685 6.149 1.00 0.00 H new ATOM 0 HG21 VAL B 42 6.329 4.002 4.614 1.00 0.00 H new ATOM 0 HG22 VAL B 42 6.230 4.335 6.360 1.00 0.00 H new ATOM 0 HG23 VAL B 42 6.967 2.821 5.783 1.00 0.00 H new ATOM 2206 N GLN B 43 2.448 1.945 8.094 1.00 0.00 N ATOM 2207 CA GLN B 43 1.110 1.321 8.254 1.00 0.00 C ATOM 2208 C GLN B 43 0.014 2.318 7.866 1.00 0.00 C ATOM 2209 O GLN B 43 -0.319 3.207 8.623 1.00 0.00 O ATOM 2210 CB GLN B 43 1.044 0.977 9.748 1.00 0.00 C ATOM 2211 CG GLN B 43 -0.392 1.080 10.254 1.00 0.00 C ATOM 2212 CD GLN B 43 -0.585 0.149 11.452 1.00 0.00 C ATOM 2213 OE1 GLN B 43 -0.895 0.595 12.540 1.00 0.00 O ATOM 2214 NE2 GLN B 43 -0.414 -1.135 11.299 1.00 0.00 N ATOM 0 H GLN B 43 2.673 2.665 8.781 1.00 0.00 H new ATOM 0 HA GLN B 43 0.963 0.446 7.621 1.00 0.00 H new ATOM 0 HB2 GLN B 43 1.423 -0.032 9.913 1.00 0.00 H new ATOM 0 HB3 GLN B 43 1.685 1.654 10.312 1.00 0.00 H new ATOM 0 HG2 GLN B 43 -0.614 2.108 10.541 1.00 0.00 H new ATOM 0 HG3 GLN B 43 -1.088 0.814 9.459 1.00 0.00 H new ATOM 0 HE21 GLN B 43 -0.154 -1.510 10.387 1.00 0.00 H new ATOM 0 HE22 GLN B 43 -0.540 -1.764 12.092 1.00 0.00 H new ATOM 2223 N LEU B 44 -0.561 2.174 6.706 1.00 0.00 N ATOM 2224 CA LEU B 44 -1.638 3.114 6.306 1.00 0.00 C ATOM 2225 C LEU B 44 -2.920 2.760 7.055 1.00 0.00 C ATOM 2226 O LEU B 44 -3.621 1.839 6.689 1.00 0.00 O ATOM 2227 CB LEU B 44 -1.811 2.899 4.807 1.00 0.00 C ATOM 2228 CG LEU B 44 -0.880 3.843 4.048 1.00 0.00 C ATOM 2229 CD1 LEU B 44 -0.967 3.562 2.545 1.00 0.00 C ATOM 2230 CD2 LEU B 44 -1.303 5.284 4.318 1.00 0.00 C ATOM 0 H LEU B 44 -0.333 1.451 6.023 1.00 0.00 H new ATOM 0 HA LEU B 44 -1.403 4.153 6.537 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -1.587 1.864 4.549 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -2.846 3.082 4.519 1.00 0.00 H new ATOM 0 HG LEU B 44 0.146 3.688 4.382 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.301 4.238 2.009 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.671 2.531 2.350 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -1.991 3.716 2.205 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -0.643 5.964 3.779 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -2.329 5.431 3.981 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -1.240 5.488 5.387 1.00 0.00 H new ATOM 2242 N THR B 45 -3.221 3.486 8.107 1.00 0.00 N ATOM 2243 CA THR B 45 -4.457 3.212 8.917 1.00 0.00 C ATOM 2244 C THR B 45 -4.759 1.704 8.980 1.00 0.00 C ATOM 2245 O THR B 45 -4.240 1.003 9.826 1.00 0.00 O ATOM 2246 CB THR B 45 -5.601 3.996 8.241 1.00 0.00 C ATOM 2247 OG1 THR B 45 -6.842 3.369 8.538 1.00 0.00 O ATOM 2248 CG2 THR B 45 -5.410 4.044 6.720 1.00 0.00 C ATOM 0 H THR B 45 -2.657 4.266 8.444 1.00 0.00 H new ATOM 0 HA THR B 45 -4.330 3.532 9.951 1.00 0.00 H new ATOM 0 HB THR B 45 -5.593 5.016 8.624 1.00 0.00 H new ATOM 0 HG1 THR B 45 -7.517 3.654 7.887 1.00 0.00 H new ATOM 0 HG21 THR B 45 -6.230 4.602 6.268 1.00 0.00 H new ATOM 0 HG22 THR B 45 -4.465 4.535 6.487 1.00 0.00 H new ATOM 0 HG23 THR B 45 -5.399 3.029 6.322 1.00 0.00 H new ATOM 2256 N GLY B 46 -5.586 1.196 8.100 1.00 0.00 N ATOM 2257 CA GLY B 46 -5.896 -0.260 8.133 1.00 0.00 C ATOM 2258 C GLY B 46 -6.155 -0.777 6.715 1.00 0.00 C ATOM 2259 O GLY B 46 -6.887 -1.728 6.526 1.00 0.00 O ATOM 0 H GLY B 46 -6.056 1.726 7.366 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -5.066 -0.806 8.581 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -6.770 -0.439 8.759 1.00 0.00 H new ATOM 2263 N PHE B 47 -5.563 -0.171 5.713 1.00 0.00 N ATOM 2264 CA PHE B 47 -5.795 -0.663 4.322 1.00 0.00 C ATOM 2265 C PHE B 47 -4.474 -0.888 3.575 1.00 0.00 C ATOM 2266 O PHE B 47 -4.418 -1.683 2.659 1.00 0.00 O ATOM 2267 CB PHE B 47 -6.701 0.380 3.653 1.00 0.00 C ATOM 2268 CG PHE B 47 -5.895 1.491 3.046 1.00 0.00 C ATOM 2269 CD1 PHE B 47 -5.577 2.598 3.817 1.00 0.00 C ATOM 2270 CD2 PHE B 47 -5.476 1.419 1.718 1.00 0.00 C ATOM 2271 CE1 PHE B 47 -4.837 3.644 3.272 1.00 0.00 C ATOM 2272 CE2 PHE B 47 -4.735 2.460 1.169 1.00 0.00 C ATOM 2273 CZ PHE B 47 -4.413 3.576 1.947 1.00 0.00 C ATOM 0 H PHE B 47 -4.939 0.631 5.797 1.00 0.00 H new ATOM 0 HA PHE B 47 -6.278 -1.640 4.312 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -7.303 -0.099 2.881 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -7.393 0.790 4.389 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -5.905 2.649 4.845 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -5.726 0.557 1.117 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -4.592 4.506 3.875 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -4.408 2.406 0.141 1.00 0.00 H new ATOM 0 HZ PHE B 47 -3.836 4.384 1.521 1.00 0.00 H new ATOM 2283 N LEU B 48 -3.403 -0.241 3.959 1.00 0.00 N ATOM 2284 CA LEU B 48 -2.120 -0.503 3.249 1.00 0.00 C ATOM 2285 C LEU B 48 -1.004 -0.826 4.248 1.00 0.00 C ATOM 2286 O LEU B 48 -0.501 0.033 4.945 1.00 0.00 O ATOM 2287 CB LEU B 48 -1.823 0.754 2.443 1.00 0.00 C ATOM 2288 CG LEU B 48 -2.333 0.577 1.006 1.00 0.00 C ATOM 2289 CD1 LEU B 48 -1.859 1.747 0.155 1.00 0.00 C ATOM 2290 CD2 LEU B 48 -1.808 -0.737 0.409 1.00 0.00 C ATOM 0 H LEU B 48 -3.362 0.442 4.716 1.00 0.00 H new ATOM 0 HA LEU B 48 -2.188 -1.370 2.592 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -2.302 1.617 2.906 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -0.751 0.950 2.438 1.00 0.00 H new ATOM 0 HG LEU B 48 -3.422 0.546 1.019 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -2.220 1.624 -0.866 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -2.248 2.678 0.567 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -0.769 1.778 0.154 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -2.179 -0.847 -0.610 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -0.718 -0.722 0.399 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -2.154 -1.575 1.014 1.00 0.00 H new ATOM 2302 N ASN B 49 -0.629 -2.077 4.320 1.00 0.00 N ATOM 2303 CA ASN B 49 0.443 -2.500 5.273 1.00 0.00 C ATOM 2304 C ASN B 49 1.774 -2.681 4.539 1.00 0.00 C ATOM 2305 O ASN B 49 2.115 -3.770 4.121 1.00 0.00 O ATOM 2306 CB ASN B 49 -0.039 -3.846 5.822 1.00 0.00 C ATOM 2307 CG ASN B 49 -0.432 -3.692 7.293 1.00 0.00 C ATOM 2308 OD1 ASN B 49 0.049 -4.416 8.141 1.00 0.00 O ATOM 2309 ND2 ASN B 49 -1.293 -2.772 7.632 1.00 0.00 N ATOM 0 H ASN B 49 -1.022 -2.830 3.755 1.00 0.00 H new ATOM 0 HA ASN B 49 0.611 -1.762 6.057 1.00 0.00 H new ATOM 0 HB2 ASN B 49 -0.891 -4.202 5.243 1.00 0.00 H new ATOM 0 HB3 ASN B 49 0.748 -4.593 5.722 1.00 0.00 H new ATOM 0 HD21 ASN B 49 -1.562 -2.661 8.610 1.00 0.00 H new ATOM 0 HD22 ASN B 49 -1.697 -2.164 6.919 1.00 0.00 H new ATOM 2316 N ILE B 50 2.529 -1.629 4.388 1.00 0.00 N ATOM 2317 CA ILE B 50 3.842 -1.742 3.682 1.00 0.00 C ATOM 2318 C ILE B 50 4.924 -2.206 4.666 1.00 0.00 C ATOM 2319 O ILE B 50 5.084 -1.632 5.725 1.00 0.00 O ATOM 2320 CB ILE B 50 4.155 -0.324 3.174 1.00 0.00 C ATOM 2321 CG1 ILE B 50 2.896 0.337 2.587 1.00 0.00 C ATOM 2322 CG2 ILE B 50 5.238 -0.393 2.097 1.00 0.00 C ATOM 2323 CD1 ILE B 50 2.313 -0.528 1.466 1.00 0.00 C ATOM 0 H ILE B 50 2.296 -0.694 4.722 1.00 0.00 H new ATOM 0 HA ILE B 50 3.810 -2.465 2.867 1.00 0.00 H new ATOM 0 HB ILE B 50 4.504 0.274 4.016 1.00 0.00 H new ATOM 0 HG12 ILE B 50 2.152 0.477 3.371 1.00 0.00 H new ATOM 0 HG13 ILE B 50 3.143 1.326 2.201 1.00 0.00 H new ATOM 0 HG21 ILE B 50 5.459 0.612 1.738 1.00 0.00 H new ATOM 0 HG22 ILE B 50 6.141 -0.835 2.517 1.00 0.00 H new ATOM 0 HG23 ILE B 50 4.887 -1.006 1.267 1.00 0.00 H new ATOM 0 HD11 ILE B 50 1.423 -0.047 1.061 1.00 0.00 H new ATOM 0 HD12 ILE B 50 3.054 -0.646 0.675 1.00 0.00 H new ATOM 0 HD13 ILE B 50 2.047 -1.508 1.863 1.00 0.00 H new ATOM 2335 N LYS B 51 5.671 -3.238 4.338 1.00 0.00 N ATOM 2336 CA LYS B 51 6.730 -3.701 5.295 1.00 0.00 C ATOM 2337 C LYS B 51 7.888 -4.382 4.547 1.00 0.00 C ATOM 2338 O LYS B 51 7.676 -5.323 3.811 1.00 0.00 O ATOM 2339 CB LYS B 51 6.029 -4.697 6.225 1.00 0.00 C ATOM 2340 CG LYS B 51 5.232 -5.716 5.404 1.00 0.00 C ATOM 2341 CD LYS B 51 4.772 -6.855 6.315 1.00 0.00 C ATOM 2342 CE LYS B 51 5.968 -7.742 6.674 1.00 0.00 C ATOM 2343 NZ LYS B 51 6.044 -7.703 8.161 1.00 0.00 N ATOM 0 H LYS B 51 5.596 -3.768 3.470 1.00 0.00 H new ATOM 0 HA LYS B 51 7.166 -2.867 5.845 1.00 0.00 H new ATOM 0 HB2 LYS B 51 6.766 -5.212 6.841 1.00 0.00 H new ATOM 0 HB3 LYS B 51 5.363 -4.165 6.904 1.00 0.00 H new ATOM 0 HG2 LYS B 51 4.370 -5.234 4.943 1.00 0.00 H new ATOM 0 HG3 LYS B 51 5.848 -6.109 4.595 1.00 0.00 H new ATOM 0 HD2 LYS B 51 4.322 -6.450 7.221 1.00 0.00 H new ATOM 0 HD3 LYS B 51 4.005 -7.447 5.815 1.00 0.00 H new ATOM 0 HE2 LYS B 51 5.827 -8.761 6.313 1.00 0.00 H new ATOM 0 HE3 LYS B 51 6.887 -7.368 6.222 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 6.841 -8.289 8.483 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 6.186 -6.722 8.476 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 5.159 -8.071 8.564 1.00 0.00 H new ATOM 2357 N PRO B 52 9.086 -3.881 4.755 1.00 0.00 N ATOM 2358 CA PRO B 52 10.272 -4.454 4.081 1.00 0.00 C ATOM 2359 C PRO B 52 10.829 -5.642 4.850 1.00 0.00 C ATOM 2360 O PRO B 52 10.879 -5.652 6.065 1.00 0.00 O ATOM 2361 CB PRO B 52 11.281 -3.321 4.110 1.00 0.00 C ATOM 2362 CG PRO B 52 10.902 -2.486 5.290 1.00 0.00 C ATOM 2363 CD PRO B 52 9.448 -2.750 5.612 1.00 0.00 C ATOM 0 HA PRO B 52 10.037 -4.814 3.079 1.00 0.00 H new ATOM 0 HB2 PRO B 52 12.298 -3.702 4.208 1.00 0.00 H new ATOM 0 HB3 PRO B 52 11.246 -2.739 3.189 1.00 0.00 H new ATOM 0 HG2 PRO B 52 11.531 -2.731 6.146 1.00 0.00 H new ATOM 0 HG3 PRO B 52 11.057 -1.429 5.073 1.00 0.00 H new ATOM 0 HD2 PRO B 52 9.312 -2.990 6.666 1.00 0.00 H new ATOM 0 HD3 PRO B 52 8.829 -1.878 5.401 1.00 0.00 H new ATOM 2371 N VAL B 53 11.269 -6.633 4.138 1.00 0.00 N ATOM 2372 CA VAL B 53 11.859 -7.826 4.802 1.00 0.00 C ATOM 2373 C VAL B 53 13.023 -8.380 3.981 1.00 0.00 C ATOM 2374 O VAL B 53 12.855 -8.888 2.892 1.00 0.00 O ATOM 2375 CB VAL B 53 10.726 -8.834 4.911 1.00 0.00 C ATOM 2376 CG1 VAL B 53 9.583 -8.218 5.724 1.00 0.00 C ATOM 2377 CG2 VAL B 53 10.213 -9.188 3.514 1.00 0.00 C ATOM 0 H VAL B 53 11.247 -6.671 3.119 1.00 0.00 H new ATOM 0 HA VAL B 53 12.268 -7.586 5.783 1.00 0.00 H new ATOM 0 HB VAL B 53 11.090 -9.736 5.403 1.00 0.00 H new ATOM 0 HG11 VAL B 53 8.767 -8.936 5.806 1.00 0.00 H new ATOM 0 HG12 VAL B 53 9.942 -7.962 6.721 1.00 0.00 H new ATOM 0 HG13 VAL B 53 9.225 -7.318 5.225 1.00 0.00 H new ATOM 0 HG21 VAL B 53 9.401 -9.911 3.597 1.00 0.00 H new ATOM 0 HG22 VAL B 53 9.848 -8.287 3.021 1.00 0.00 H new ATOM 0 HG23 VAL B 53 11.024 -9.619 2.927 1.00 0.00 H new ATOM 2387 N ALA B 54 14.205 -8.271 4.509 1.00 0.00 N ATOM 2388 CA ALA B 54 15.417 -8.762 3.784 1.00 0.00 C ATOM 2389 C ALA B 54 15.256 -10.228 3.380 1.00 0.00 C ATOM 2390 O ALA B 54 15.123 -11.091 4.227 1.00 0.00 O ATOM 2391 CB ALA B 54 16.567 -8.611 4.783 1.00 0.00 C ATOM 0 H ALA B 54 14.391 -7.858 5.423 1.00 0.00 H new ATOM 0 HA ALA B 54 15.590 -8.202 2.865 1.00 0.00 H new ATOM 0 HB1 ALA B 54 17.495 -8.952 4.324 1.00 0.00 H new ATOM 0 HB2 ALA B 54 16.666 -7.564 5.068 1.00 0.00 H new ATOM 0 HB3 ALA B 54 16.360 -9.210 5.670 1.00 0.00 H new ATOM 2710 N VAL B 75 15.808 -7.388 -0.193 1.00 0.00 N ATOM 2711 CA VAL B 75 14.792 -6.916 0.817 1.00 0.00 C ATOM 2712 C VAL B 75 13.402 -7.302 0.320 1.00 0.00 C ATOM 2713 O VAL B 75 13.219 -7.594 -0.843 1.00 0.00 O ATOM 2714 CB VAL B 75 14.908 -5.393 0.928 1.00 0.00 C ATOM 2715 CG1 VAL B 75 14.578 -4.751 -0.424 1.00 0.00 C ATOM 2716 CG2 VAL B 75 13.931 -4.879 1.992 1.00 0.00 C ATOM 0 HA VAL B 75 14.963 -7.369 1.793 1.00 0.00 H new ATOM 0 HB VAL B 75 15.926 -5.129 1.214 1.00 0.00 H new ATOM 0 HG11 VAL B 75 14.661 -3.667 -0.342 1.00 0.00 H new ATOM 0 HG12 VAL B 75 15.276 -5.113 -1.179 1.00 0.00 H new ATOM 0 HG13 VAL B 75 13.561 -5.016 -0.714 1.00 0.00 H new ATOM 0 HG21 VAL B 75 14.015 -3.795 2.070 1.00 0.00 H new ATOM 0 HG22 VAL B 75 12.912 -5.145 1.709 1.00 0.00 H new ATOM 0 HG23 VAL B 75 14.170 -5.331 2.954 1.00 0.00 H new ATOM 2726 N GLY B 76 12.423 -7.311 1.175 1.00 0.00 N ATOM 2727 CA GLY B 76 11.058 -7.688 0.714 1.00 0.00 C ATOM 2728 C GLY B 76 10.065 -6.592 1.089 1.00 0.00 C ATOM 2729 O GLY B 76 9.268 -6.750 1.988 1.00 0.00 O ATOM 0 H GLY B 76 12.504 -7.076 2.164 1.00 0.00 H new ATOM 0 HA2 GLY B 76 11.057 -7.838 -0.366 1.00 0.00 H new ATOM 0 HA3 GLY B 76 10.759 -8.633 1.167 1.00 0.00 H new ATOM 2733 N VAL B 77 10.106 -5.485 0.400 1.00 0.00 N ATOM 2734 CA VAL B 77 9.152 -4.381 0.712 1.00 0.00 C ATOM 2735 C VAL B 77 7.728 -4.868 0.489 1.00 0.00 C ATOM 2736 O VAL B 77 7.071 -4.490 -0.461 1.00 0.00 O ATOM 2737 CB VAL B 77 9.510 -3.242 -0.257 1.00 0.00 C ATOM 2738 CG1 VAL B 77 9.531 -3.768 -1.697 1.00 0.00 C ATOM 2739 CG2 VAL B 77 8.474 -2.117 -0.146 1.00 0.00 C ATOM 0 H VAL B 77 10.756 -5.296 -0.363 1.00 0.00 H new ATOM 0 HA VAL B 77 9.219 -4.046 1.747 1.00 0.00 H new ATOM 0 HB VAL B 77 10.496 -2.856 0.004 1.00 0.00 H new ATOM 0 HG11 VAL B 77 9.785 -2.955 -2.378 1.00 0.00 H new ATOM 0 HG12 VAL B 77 10.274 -4.560 -1.784 1.00 0.00 H new ATOM 0 HG13 VAL B 77 8.548 -4.163 -1.955 1.00 0.00 H new ATOM 0 HG21 VAL B 77 8.734 -1.314 -0.835 1.00 0.00 H new ATOM 0 HG22 VAL B 77 7.487 -2.505 -0.397 1.00 0.00 H new ATOM 0 HG23 VAL B 77 8.464 -1.731 0.873 1.00 0.00 H new ATOM 2749 N SER B 78 7.251 -5.711 1.357 1.00 0.00 N ATOM 2750 CA SER B 78 5.871 -6.227 1.190 1.00 0.00 C ATOM 2751 C SER B 78 4.867 -5.084 1.321 1.00 0.00 C ATOM 2752 O SER B 78 5.220 -3.962 1.618 1.00 0.00 O ATOM 2753 CB SER B 78 5.679 -7.245 2.317 1.00 0.00 C ATOM 2754 OG SER B 78 5.215 -8.470 1.766 1.00 0.00 O ATOM 0 H SER B 78 7.755 -6.063 2.171 1.00 0.00 H new ATOM 0 HA SER B 78 5.716 -6.679 0.210 1.00 0.00 H new ATOM 0 HB2 SER B 78 6.620 -7.403 2.845 1.00 0.00 H new ATOM 0 HB3 SER B 78 4.963 -6.867 3.047 1.00 0.00 H new ATOM 0 HG SER B 78 5.092 -9.126 2.484 1.00 0.00 H new ATOM 2760 N VAL B 79 3.622 -5.393 1.119 1.00 0.00 N ATOM 2761 CA VAL B 79 2.514 -4.392 1.212 1.00 0.00 C ATOM 2762 C VAL B 79 1.193 -5.152 1.104 1.00 0.00 C ATOM 2763 O VAL B 79 1.188 -6.349 0.894 1.00 0.00 O ATOM 2764 CB VAL B 79 2.644 -3.477 -0.023 1.00 0.00 C ATOM 2765 CG1 VAL B 79 3.891 -2.598 0.061 1.00 0.00 C ATOM 2766 CG2 VAL B 79 2.719 -4.336 -1.289 1.00 0.00 C ATOM 0 H VAL B 79 3.309 -6.335 0.883 1.00 0.00 H new ATOM 0 HA VAL B 79 2.554 -3.822 2.140 1.00 0.00 H new ATOM 0 HB VAL B 79 1.769 -2.828 -0.056 1.00 0.00 H new ATOM 0 HG11 VAL B 79 3.951 -1.966 -0.825 1.00 0.00 H new ATOM 0 HG12 VAL B 79 3.835 -1.971 0.951 1.00 0.00 H new ATOM 0 HG13 VAL B 79 4.778 -3.229 0.118 1.00 0.00 H new ATOM 0 HG21 VAL B 79 2.811 -3.690 -2.162 1.00 0.00 H new ATOM 0 HG22 VAL B 79 3.586 -4.994 -1.231 1.00 0.00 H new ATOM 0 HG23 VAL B 79 1.813 -4.936 -1.376 1.00 0.00 H new ATOM 2776 N LYS B 80 0.075 -4.481 1.180 1.00 0.00 N ATOM 2777 CA LYS B 80 -1.218 -5.196 1.005 1.00 0.00 C ATOM 2778 C LYS B 80 -2.402 -4.237 1.147 1.00 0.00 C ATOM 2779 O LYS B 80 -2.252 -3.115 1.574 1.00 0.00 O ATOM 2780 CB LYS B 80 -1.253 -6.235 2.134 1.00 0.00 C ATOM 2781 CG LYS B 80 -1.137 -7.642 1.548 1.00 0.00 C ATOM 2782 CD LYS B 80 -0.368 -8.541 2.520 1.00 0.00 C ATOM 2783 CE LYS B 80 0.571 -9.464 1.737 1.00 0.00 C ATOM 2784 NZ LYS B 80 1.942 -8.971 2.048 1.00 0.00 N ATOM 0 H LYS B 80 0.003 -3.479 1.354 1.00 0.00 H new ATOM 0 HA LYS B 80 -1.294 -5.646 0.015 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -0.436 -6.054 2.833 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -2.181 -6.142 2.698 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -2.130 -8.053 1.364 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -0.624 -7.606 0.587 1.00 0.00 H new ATOM 0 HD2 LYS B 80 0.205 -7.931 3.219 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -1.066 -9.133 3.112 1.00 0.00 H new ATOM 0 HE2 LYS B 80 0.447 -10.503 2.041 1.00 0.00 H new ATOM 0 HE3 LYS B 80 0.368 -9.418 0.667 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 2.643 -9.554 1.547 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 2.033 -7.981 1.742 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 2.109 -9.033 3.073 1.00 0.00 H new ATOM 2798 N PRO B 81 -3.552 -4.753 0.816 1.00 0.00 N ATOM 2799 CA PRO B 81 -4.820 -4.019 0.921 1.00 0.00 C ATOM 2800 C PRO B 81 -5.593 -4.471 2.164 1.00 0.00 C ATOM 2801 O PRO B 81 -5.754 -5.651 2.404 1.00 0.00 O ATOM 2802 CB PRO B 81 -5.562 -4.495 -0.321 1.00 0.00 C ATOM 2803 CG PRO B 81 -4.984 -5.854 -0.633 1.00 0.00 C ATOM 2804 CD PRO B 81 -3.781 -6.065 0.261 1.00 0.00 C ATOM 0 HA PRO B 81 -4.695 -2.939 0.995 1.00 0.00 H new ATOM 0 HB2 PRO B 81 -6.635 -4.556 -0.139 1.00 0.00 H new ATOM 0 HB3 PRO B 81 -5.419 -3.806 -1.153 1.00 0.00 H new ATOM 0 HG2 PRO B 81 -5.727 -6.633 -0.462 1.00 0.00 H new ATOM 0 HG3 PRO B 81 -4.695 -5.914 -1.682 1.00 0.00 H new ATOM 0 HD2 PRO B 81 -3.981 -6.802 1.038 1.00 0.00 H new ATOM 0 HD3 PRO B 81 -2.918 -6.421 -0.302 1.00 0.00 H new ATOM 2812 N GLY B 82 -6.100 -3.555 2.934 1.00 0.00 N ATOM 2813 CA GLY B 82 -6.892 -3.950 4.132 1.00 0.00 C ATOM 2814 C GLY B 82 -8.371 -3.903 3.755 1.00 0.00 C ATOM 2815 O GLY B 82 -8.727 -3.437 2.690 1.00 0.00 O ATOM 0 H GLY B 82 -6.002 -2.550 2.788 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -6.614 -4.952 4.460 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -6.689 -3.275 4.963 1.00 0.00 H new ATOM 2819 N GLU B 83 -9.239 -4.382 4.602 1.00 0.00 N ATOM 2820 CA GLU B 83 -10.691 -4.355 4.257 1.00 0.00 C ATOM 2821 C GLU B 83 -11.164 -2.920 4.025 1.00 0.00 C ATOM 2822 O GLU B 83 -12.185 -2.692 3.408 1.00 0.00 O ATOM 2823 CB GLU B 83 -11.414 -4.966 5.451 1.00 0.00 C ATOM 2824 CG GLU B 83 -11.054 -4.201 6.730 1.00 0.00 C ATOM 2825 CD GLU B 83 -10.290 -5.123 7.683 1.00 0.00 C ATOM 2826 OE1 GLU B 83 -9.333 -5.737 7.241 1.00 0.00 O ATOM 2827 OE2 GLU B 83 -10.674 -5.199 8.838 1.00 0.00 O ATOM 0 H GLU B 83 -9.011 -4.787 5.510 1.00 0.00 H new ATOM 0 HA GLU B 83 -10.892 -4.908 3.339 1.00 0.00 H new ATOM 0 HB2 GLU B 83 -12.491 -4.934 5.289 1.00 0.00 H new ATOM 0 HB3 GLU B 83 -11.138 -6.015 5.555 1.00 0.00 H new ATOM 0 HG2 GLU B 83 -10.446 -3.330 6.486 1.00 0.00 H new ATOM 0 HG3 GLU B 83 -11.959 -3.833 7.212 1.00 0.00 H new ATOM 2834 N SER B 84 -10.433 -1.946 4.507 1.00 0.00 N ATOM 2835 CA SER B 84 -10.853 -0.527 4.296 1.00 0.00 C ATOM 2836 C SER B 84 -11.114 -0.286 2.807 1.00 0.00 C ATOM 2837 O SER B 84 -12.043 0.402 2.431 1.00 0.00 O ATOM 2838 CB SER B 84 -9.680 0.321 4.787 1.00 0.00 C ATOM 2839 OG SER B 84 -10.083 1.063 5.930 1.00 0.00 O ATOM 0 H SER B 84 -9.569 -2.071 5.034 1.00 0.00 H new ATOM 0 HA SER B 84 -11.771 -0.279 4.829 1.00 0.00 H new ATOM 0 HB2 SER B 84 -8.833 -0.318 5.034 1.00 0.00 H new ATOM 0 HB3 SER B 84 -9.350 0.997 3.998 1.00 0.00 H new ATOM 0 HG SER B 84 -9.332 1.607 6.248 1.00 0.00 H new ATOM 2845 N LEU B 85 -10.313 -0.874 1.958 1.00 0.00 N ATOM 2846 CA LEU B 85 -10.528 -0.708 0.492 1.00 0.00 C ATOM 2847 C LEU B 85 -11.668 -1.621 0.052 1.00 0.00 C ATOM 2848 O LEU B 85 -12.415 -1.313 -0.855 1.00 0.00 O ATOM 2849 CB LEU B 85 -9.231 -1.162 -0.183 1.00 0.00 C ATOM 2850 CG LEU B 85 -8.024 -0.439 0.418 1.00 0.00 C ATOM 2851 CD1 LEU B 85 -6.945 -1.465 0.774 1.00 0.00 C ATOM 2852 CD2 LEU B 85 -7.462 0.554 -0.606 1.00 0.00 C ATOM 0 H LEU B 85 -9.520 -1.461 2.217 1.00 0.00 H new ATOM 0 HA LEU B 85 -10.777 0.321 0.232 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -9.112 -2.239 -0.064 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -9.284 -0.963 -1.253 1.00 0.00 H new ATOM 0 HG LEU B 85 -8.330 0.098 1.316 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -6.083 -0.953 1.203 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -7.343 -2.175 1.499 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -6.639 -1.999 -0.126 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -6.602 1.070 -0.179 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -7.154 0.017 -1.503 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -8.230 1.283 -0.865 1.00 0.00 H new ATOM 2864 N LYS B 86 -11.790 -2.755 0.689 1.00 0.00 N ATOM 2865 CA LYS B 86 -12.866 -3.715 0.314 1.00 0.00 C ATOM 2866 C LYS B 86 -14.219 -3.212 0.793 1.00 0.00 C ATOM 2867 O LYS B 86 -15.197 -3.259 0.075 1.00 0.00 O ATOM 2868 CB LYS B 86 -12.489 -5.028 1.004 1.00 0.00 C ATOM 2869 CG LYS B 86 -12.118 -6.078 -0.045 1.00 0.00 C ATOM 2870 CD LYS B 86 -11.501 -7.297 0.647 1.00 0.00 C ATOM 2871 CE LYS B 86 -9.981 -7.266 0.482 1.00 0.00 C ATOM 2872 NZ LYS B 86 -9.725 -7.916 -0.834 1.00 0.00 N ATOM 0 H LYS B 86 -11.188 -3.058 1.455 1.00 0.00 H new ATOM 0 HA LYS B 86 -12.950 -3.839 -0.766 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -11.651 -4.866 1.681 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -13.323 -5.384 1.609 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -13.004 -6.375 -0.606 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -11.412 -5.658 -0.762 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -11.762 -7.298 1.705 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -11.905 -8.214 0.218 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -9.603 -6.244 0.498 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -9.485 -7.802 1.291 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -8.702 -7.933 -1.020 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -10.090 -8.890 -0.817 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -10.204 -7.380 -1.585 1.00 0.00 H new ATOM 2886 N LYS B 87 -14.284 -2.699 1.980 1.00 0.00 N ATOM 2887 CA LYS B 87 -15.579 -2.158 2.458 1.00 0.00 C ATOM 2888 C LYS B 87 -15.914 -0.977 1.559 1.00 0.00 C ATOM 2889 O LYS B 87 -17.037 -0.796 1.096 1.00 0.00 O ATOM 2890 CB LYS B 87 -15.331 -1.723 3.906 1.00 0.00 C ATOM 2891 CG LYS B 87 -16.574 -1.015 4.452 1.00 0.00 C ATOM 2892 CD LYS B 87 -16.784 -1.410 5.916 1.00 0.00 C ATOM 2893 CE LYS B 87 -18.260 -1.239 6.285 1.00 0.00 C ATOM 2894 NZ LYS B 87 -18.888 -2.553 5.969 1.00 0.00 N ATOM 0 H LYS B 87 -13.506 -2.630 2.636 1.00 0.00 H new ATOM 0 HA LYS B 87 -16.408 -2.865 2.426 1.00 0.00 H new ATOM 0 HB2 LYS B 87 -15.095 -2.591 4.521 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -14.470 -1.056 3.953 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -16.456 0.065 4.369 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -17.449 -1.287 3.862 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -16.477 -2.444 6.072 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -16.162 -0.791 6.563 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -18.377 -0.988 7.339 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -18.720 -0.433 5.713 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -19.902 -2.516 6.195 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -18.766 -2.762 4.957 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -18.434 -3.299 6.534 1.00 0.00 H new ATOM 2908 N ALA B 88 -14.911 -0.215 1.232 1.00 0.00 N ATOM 2909 CA ALA B 88 -15.131 0.903 0.304 1.00 0.00 C ATOM 2910 C ALA B 88 -15.476 0.290 -1.050 1.00 0.00 C ATOM 2911 O ALA B 88 -16.287 0.799 -1.800 1.00 0.00 O ATOM 2912 CB ALA B 88 -13.797 1.651 0.260 1.00 0.00 C ATOM 0 H ALA B 88 -13.955 -0.324 1.570 1.00 0.00 H new ATOM 0 HA ALA B 88 -15.933 1.583 0.591 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -13.880 2.503 -0.414 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -13.544 2.003 1.260 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -13.015 0.980 -0.097 1.00 0.00 H new ATOM 2918 N ALA B 89 -14.879 -0.837 -1.351 1.00 0.00 N ATOM 2919 CA ALA B 89 -15.174 -1.510 -2.645 1.00 0.00 C ATOM 2920 C ALA B 89 -16.665 -1.781 -2.739 1.00 0.00 C ATOM 2921 O ALA B 89 -17.288 -1.508 -3.747 1.00 0.00 O ATOM 2922 CB ALA B 89 -14.375 -2.811 -2.634 1.00 0.00 C ATOM 0 H ALA B 89 -14.203 -1.316 -0.756 1.00 0.00 H new ATOM 0 HA ALA B 89 -14.899 -0.900 -3.505 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -14.551 -3.354 -3.563 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -13.313 -2.585 -2.541 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -14.691 -3.425 -1.790 1.00 0.00 H new ATOM 2928 N GLU B 90 -17.256 -2.270 -1.682 1.00 0.00 N ATOM 2929 CA GLU B 90 -18.725 -2.495 -1.712 1.00 0.00 C ATOM 2930 C GLU B 90 -19.370 -1.170 -2.122 1.00 0.00 C ATOM 2931 O GLU B 90 -20.387 -1.128 -2.786 1.00 0.00 O ATOM 2932 CB GLU B 90 -19.105 -2.912 -0.279 1.00 0.00 C ATOM 2933 CG GLU B 90 -19.765 -1.747 0.471 1.00 0.00 C ATOM 2934 CD GLU B 90 -19.967 -2.132 1.937 1.00 0.00 C ATOM 2935 OE1 GLU B 90 -20.547 -3.178 2.180 1.00 0.00 O ATOM 2936 OE2 GLU B 90 -19.537 -1.375 2.793 1.00 0.00 O ATOM 0 H GLU B 90 -16.790 -2.520 -0.810 1.00 0.00 H new ATOM 0 HA GLU B 90 -19.054 -3.262 -2.413 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -19.787 -3.762 -0.312 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -18.214 -3.238 0.258 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -19.141 -0.856 0.401 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -20.723 -1.502 0.013 1.00 0.00 H new ATOM 2943 N GLY B 91 -18.744 -0.083 -1.739 1.00 0.00 N ATOM 2944 CA GLY B 91 -19.269 1.260 -2.111 1.00 0.00 C ATOM 2945 C GLY B 91 -19.159 1.477 -3.633 1.00 0.00 C ATOM 2946 O GLY B 91 -19.994 2.134 -4.224 1.00 0.00 O ATOM 0 H GLY B 91 -17.889 -0.073 -1.183 1.00 0.00 H new ATOM 0 HA2 GLY B 91 -20.309 1.350 -1.799 1.00 0.00 H new ATOM 0 HA3 GLY B 91 -18.710 2.034 -1.585 1.00 0.00 H new ATOM 2950 N LEU B 92 -18.140 0.944 -4.281 1.00 0.00 N ATOM 2951 CA LEU B 92 -18.005 1.149 -5.760 1.00 0.00 C ATOM 2952 C LEU B 92 -18.960 0.242 -6.540 1.00 0.00 C ATOM 2953 O LEU B 92 -18.808 0.067 -7.732 1.00 0.00 O ATOM 2954 CB LEU B 92 -16.542 0.783 -6.071 1.00 0.00 C ATOM 2955 CG LEU B 92 -16.400 -0.701 -6.451 1.00 0.00 C ATOM 2956 CD1 LEU B 92 -16.363 -0.844 -7.977 1.00 0.00 C ATOM 2957 CD2 LEU B 92 -15.099 -1.256 -5.859 1.00 0.00 C ATOM 0 H LEU B 92 -17.405 0.382 -3.851 1.00 0.00 H new ATOM 0 HA LEU B 92 -18.254 2.170 -6.050 1.00 0.00 H new ATOM 0 HB2 LEU B 92 -16.176 1.405 -6.888 1.00 0.00 H new ATOM 0 HB3 LEU B 92 -15.920 0.998 -5.202 1.00 0.00 H new ATOM 0 HG LEU B 92 -17.251 -1.256 -6.056 1.00 0.00 H new ATOM 0 HD11 LEU B 92 -16.262 -1.897 -8.241 1.00 0.00 H new ATOM 0 HD12 LEU B 92 -17.286 -0.450 -8.402 1.00 0.00 H new ATOM 0 HD13 LEU B 92 -15.514 -0.287 -8.374 1.00 0.00 H new ATOM 0 HD21 LEU B 92 -14.997 -2.308 -6.127 1.00 0.00 H new ATOM 0 HD22 LEU B 92 -14.251 -0.696 -6.255 1.00 0.00 H new ATOM 0 HD23 LEU B 92 -15.123 -1.159 -4.774 1.00 0.00 H new ATOM 2969 N LYS B 93 -19.913 -0.367 -5.887 1.00 0.00 N ATOM 2970 CA LYS B 93 -20.824 -1.295 -6.620 1.00 0.00 C ATOM 2971 C LYS B 93 -19.956 -2.383 -7.249 1.00 0.00 C ATOM 2972 O LYS B 93 -20.157 -2.806 -8.372 1.00 0.00 O ATOM 2973 CB LYS B 93 -21.527 -0.455 -7.694 1.00 0.00 C ATOM 2974 CG LYS B 93 -22.263 0.713 -7.033 1.00 0.00 C ATOM 2975 CD LYS B 93 -23.545 0.202 -6.374 1.00 0.00 C ATOM 2976 CE LYS B 93 -24.410 1.390 -5.947 1.00 0.00 C ATOM 2977 NZ LYS B 93 -25.131 0.922 -4.731 1.00 0.00 N ATOM 0 H LYS B 93 -20.100 -0.265 -4.889 1.00 0.00 H new ATOM 0 HA LYS B 93 -21.568 -1.767 -5.979 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -20.797 -0.079 -8.411 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -22.231 -1.073 -8.250 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -21.622 1.185 -6.288 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -22.502 1.473 -7.777 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -24.096 -0.431 -7.069 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -23.301 -0.413 -5.508 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -23.799 2.266 -5.731 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -25.107 1.674 -6.735 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -25.746 1.683 -4.378 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -25.710 0.091 -4.969 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -24.442 0.665 -3.996 1.00 0.00 H new ATOM 2991 N TYR B 94 -18.966 -2.811 -6.509 1.00 0.00 N ATOM 2992 CA TYR B 94 -18.028 -3.857 -7.005 1.00 0.00 C ATOM 2993 C TYR B 94 -18.799 -4.965 -7.739 1.00 0.00 C ATOM 2994 O TYR B 94 -18.316 -5.543 -8.693 1.00 0.00 O ATOM 2995 CB TYR B 94 -17.339 -4.387 -5.738 1.00 0.00 C ATOM 2996 CG TYR B 94 -17.817 -5.781 -5.450 1.00 0.00 C ATOM 2997 CD1 TYR B 94 -19.019 -5.978 -4.768 1.00 0.00 C ATOM 2998 CD2 TYR B 94 -17.073 -6.870 -5.898 1.00 0.00 C ATOM 2999 CE1 TYR B 94 -19.477 -7.279 -4.531 1.00 0.00 C ATOM 3000 CE2 TYR B 94 -17.529 -8.172 -5.668 1.00 0.00 C ATOM 3001 CZ TYR B 94 -18.734 -8.378 -4.985 1.00 0.00 C ATOM 3002 OH TYR B 94 -19.187 -9.660 -4.759 1.00 0.00 O ATOM 0 H TYR B 94 -18.767 -2.473 -5.567 1.00 0.00 H new ATOM 0 HA TYR B 94 -17.305 -3.472 -7.724 1.00 0.00 H new ATOM 0 HB2 TYR B 94 -16.257 -4.383 -5.871 1.00 0.00 H new ATOM 0 HB3 TYR B 94 -17.558 -3.735 -4.893 1.00 0.00 H new ATOM 0 HD1 TYR B 94 -19.593 -5.130 -4.425 1.00 0.00 H new ATOM 0 HD2 TYR B 94 -16.143 -6.709 -6.423 1.00 0.00 H new ATOM 0 HE1 TYR B 94 -20.403 -7.437 -3.998 1.00 0.00 H new ATOM 0 HE2 TYR B 94 -16.953 -9.017 -6.016 1.00 0.00 H new ATOM 0 HH TYR B 94 -18.553 -10.303 -5.140 1.00 0.00 H new ATOM 3012 N GLU B 95 -19.998 -5.255 -7.302 1.00 0.00 N ATOM 3013 CA GLU B 95 -20.800 -6.315 -7.981 1.00 0.00 C ATOM 3014 C GLU B 95 -21.055 -5.910 -9.430 1.00 0.00 C ATOM 3015 O GLU B 95 -20.967 -6.718 -10.333 1.00 0.00 O ATOM 3016 CB GLU B 95 -22.110 -6.422 -7.195 1.00 0.00 C ATOM 3017 CG GLU B 95 -22.823 -5.067 -7.161 1.00 0.00 C ATOM 3018 CD GLU B 95 -23.798 -4.972 -8.336 1.00 0.00 C ATOM 3019 OE1 GLU B 95 -24.433 -5.970 -8.635 1.00 0.00 O ATOM 3020 OE2 GLU B 95 -23.893 -3.903 -8.916 1.00 0.00 O ATOM 0 H GLU B 95 -20.454 -4.806 -6.508 1.00 0.00 H new ATOM 0 HA GLU B 95 -20.285 -7.276 -8.001 1.00 0.00 H new ATOM 0 HB2 GLU B 95 -22.757 -7.169 -7.654 1.00 0.00 H new ATOM 0 HB3 GLU B 95 -21.905 -6.758 -6.179 1.00 0.00 H new ATOM 0 HG2 GLU B 95 -23.360 -4.950 -6.219 1.00 0.00 H new ATOM 0 HG3 GLU B 95 -22.093 -4.259 -7.214 1.00 0.00 H new ATOM 3027 N ASP B 96 -21.329 -4.654 -9.666 1.00 0.00 N ATOM 3028 CA ASP B 96 -21.541 -4.195 -11.067 1.00 0.00 C ATOM 3029 C ASP B 96 -20.245 -4.443 -11.834 1.00 0.00 C ATOM 3030 O ASP B 96 -20.246 -4.796 -12.997 1.00 0.00 O ATOM 3031 CB ASP B 96 -21.836 -2.697 -10.971 1.00 0.00 C ATOM 3032 CG ASP B 96 -23.327 -2.452 -11.216 1.00 0.00 C ATOM 3033 OD1 ASP B 96 -23.834 -2.951 -12.208 1.00 0.00 O ATOM 3034 OD2 ASP B 96 -23.935 -1.771 -10.408 1.00 0.00 O ATOM 0 H ASP B 96 -21.415 -3.931 -8.952 1.00 0.00 H new ATOM 0 HA ASP B 96 -22.354 -4.713 -11.577 1.00 0.00 H new ATOM 0 HB2 ASP B 96 -21.552 -2.322 -9.988 1.00 0.00 H new ATOM 0 HB3 ASP B 96 -21.242 -2.151 -11.704 1.00 0.00 H new ATOM 3039 N PHE B 97 -19.138 -4.286 -11.159 1.00 0.00 N ATOM 3040 CA PHE B 97 -17.819 -4.539 -11.800 1.00 0.00 C ATOM 3041 C PHE B 97 -17.641 -6.048 -11.995 1.00 0.00 C ATOM 3042 O PHE B 97 -16.928 -6.497 -12.872 1.00 0.00 O ATOM 3043 CB PHE B 97 -16.788 -4.002 -10.803 1.00 0.00 C ATOM 3044 CG PHE B 97 -15.792 -3.122 -11.516 1.00 0.00 C ATOM 3045 CD1 PHE B 97 -16.232 -2.016 -12.252 1.00 0.00 C ATOM 3046 CD2 PHE B 97 -14.425 -3.410 -11.433 1.00 0.00 C ATOM 3047 CE1 PHE B 97 -15.304 -1.198 -12.907 1.00 0.00 C ATOM 3048 CE2 PHE B 97 -13.497 -2.593 -12.088 1.00 0.00 C ATOM 3049 CZ PHE B 97 -13.936 -1.486 -12.826 1.00 0.00 C ATOM 0 H PHE B 97 -19.093 -3.991 -10.184 1.00 0.00 H new ATOM 0 HA PHE B 97 -17.720 -4.064 -12.776 1.00 0.00 H new ATOM 0 HB2 PHE B 97 -17.289 -3.436 -10.018 1.00 0.00 H new ATOM 0 HB3 PHE B 97 -16.272 -4.831 -10.318 1.00 0.00 H new ATOM 0 HD1 PHE B 97 -17.287 -1.794 -12.315 1.00 0.00 H new ATOM 0 HD2 PHE B 97 -14.086 -4.263 -10.863 1.00 0.00 H new ATOM 0 HE1 PHE B 97 -15.643 -0.344 -13.475 1.00 0.00 H new ATOM 0 HE2 PHE B 97 -12.442 -2.816 -12.025 1.00 0.00 H new ATOM 0 HZ PHE B 97 -13.220 -0.855 -13.332 1.00 0.00 H new