USER MOD reduce.3.24.130724 H: found=0, std=0, add=1290, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1290 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 50 ASN : amide:sc= -0.524 K(o=-4.4,f=-5.5) USER MOD Set 1.2: B 51 LYS NZ :NH3+ -149:sc= -3.83! (180deg=-5.16!) USER MOD Set 2.1: A 45 MET CE :methyl -141:sc= -2.65 (180deg=-4.12!) USER MOD Set 2.2: A 49 GLN : amide:sc= -1.59 K(o=-4.2,f=-7.7!) USER MOD Set 2.3: B 61 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0296) USER MOD Single : A 1 MET CE :methyl 146:sc= -0.536 (180deg=-2.03!) USER MOD Single : A 1 MET N :NH3+ 164:sc= -0.0159 (180deg=-0.154) USER MOD Single : A 4 SER OG : rot 180:sc= -0.0832 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 157:sc= -0.0888 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 HIS : no HD1:sc= -0.305 X(o=-0.3,f=-0.16) USER MOD Single : A 23 THR OG1 : rot -82:sc= 0.541 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot -57:sc= 0.259 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.222 K(o=-0.22,f=-1.7!) USER MOD Single : A 35 MET CE :methyl -138:sc= -1.44 (180deg=-2.77!) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0.00737 USER MOD Single : A 50 ASN : amide:sc= -0.401 X(o=-0.4,f=-0.03) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= -5.08! (180deg=-5.08!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 0.185 X(o=0.19,f=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot -54:sc= 0.619 USER MOD Single : A 67 LYS NZ :NH3+ -148:sc= -0.211 (180deg=-0.788) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ -155:sc= 0.15 (180deg=0) USER MOD Single : B 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 LYS NZ :NH3+ 157:sc= -0.288 (180deg=-0.748) USER MOD Single : B 12 THR OG1 : rot 162:sc= 0.111 USER MOD Single : B 13 THR OG1 : rot 180:sc= 0 USER MOD Single : B 21 TYR OH : rot 180:sc= 0 USER MOD Single : B 22 HIS : no HD1:sc= -0.098 X(o=-0.098,f=-0.19) USER MOD Single : B 23 THR OG1 : rot -75:sc= -0.716 USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 SER OG : rot 107:sc= 1.02 USER MOD Single : B 30 TYR OH : rot 180:sc= 0 USER MOD Single : B 32 ASN : amide:sc= -0.274 K(o=-0.27,f=-2.2!) USER MOD Single : B 35 MET CE :methyl 176:sc= -3.36! (180deg=-3.8!) USER MOD Single : B 36 THR OG1 : rot 180:sc= 0.0967 USER MOD Single : B 45 MET CE :methyl 162:sc= -3.31 (180deg=-5.61!) USER MOD Single : B 49 GLN : amide:sc= -0.168 X(o=-0.17,f=0) USER MOD Single : B 53 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.453) USER MOD Single : B 56 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 SER OG : rot -110:sc= -1.83 USER MOD Single : B 67 LYS NZ :NH3+ 134:sc= -0.248 (180deg=-0.948) USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.934 21.949 -22.752 1.00 0.00 N ATOM 2 CA MET A 1 5.723 22.011 -21.492 1.00 0.00 C ATOM 3 C MET A 1 6.452 20.697 -21.231 1.00 0.00 C ATOM 4 O MET A 1 6.204 19.693 -21.899 1.00 0.00 O ATOM 5 CB MET A 1 4.772 22.332 -20.335 1.00 0.00 C ATOM 6 CG MET A 1 3.820 21.197 -19.988 1.00 0.00 C ATOM 7 SD MET A 1 2.170 21.780 -19.554 1.00 0.00 S ATOM 8 CE MET A 1 1.765 22.759 -20.998 1.00 0.00 C ATOM 0 H1 MET A 1 4.247 22.730 -22.770 1.00 0.00 H new ATOM 0 H2 MET A 1 5.575 22.032 -23.567 1.00 0.00 H new ATOM 0 H3 MET A 1 4.428 21.042 -22.800 1.00 0.00 H new ATOM 0 HA MET A 1 6.480 22.791 -21.582 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.361 22.582 -19.452 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.189 23.217 -20.591 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.749 20.516 -20.836 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.230 20.626 -19.155 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.696 22.685 -21.200 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.029 23.801 -20.817 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.323 22.388 -21.858 1.00 0.00 H new ATOM 20 N VAL A 2 7.355 20.712 -20.256 1.00 0.00 N ATOM 21 CA VAL A 2 8.121 19.522 -19.905 1.00 0.00 C ATOM 22 C VAL A 2 7.612 18.905 -18.606 1.00 0.00 C ATOM 23 O VAL A 2 8.395 18.488 -17.753 1.00 0.00 O ATOM 24 CB VAL A 2 9.621 19.844 -19.757 1.00 0.00 C ATOM 25 CG1 VAL A 2 10.221 20.226 -21.101 1.00 0.00 C ATOM 26 CG2 VAL A 2 9.831 20.951 -18.735 1.00 0.00 C ATOM 0 H VAL A 2 7.574 21.535 -19.695 1.00 0.00 H new ATOM 0 HA VAL A 2 7.990 18.808 -20.718 1.00 0.00 H new ATOM 0 HB VAL A 2 10.132 18.950 -19.399 1.00 0.00 H new ATOM 0 HG11 VAL A 2 11.280 20.450 -20.976 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.105 19.398 -21.800 1.00 0.00 H new ATOM 0 HG13 VAL A 2 9.708 21.105 -21.492 1.00 0.00 H new ATOM 0 HG21 VAL A 2 10.896 21.165 -18.644 1.00 0.00 H new ATOM 0 HG22 VAL A 2 9.307 21.850 -19.059 1.00 0.00 H new ATOM 0 HG23 VAL A 2 9.441 20.633 -17.768 1.00 0.00 H new ATOM 36 N GLU A 3 6.292 18.850 -18.463 1.00 0.00 N ATOM 37 CA GLU A 3 5.674 18.283 -17.270 1.00 0.00 C ATOM 38 C GLU A 3 4.195 17.999 -17.507 1.00 0.00 C ATOM 39 O GLU A 3 3.501 18.774 -18.165 1.00 0.00 O ATOM 40 CB GLU A 3 5.839 19.236 -16.084 1.00 0.00 C ATOM 41 CG GLU A 3 5.449 18.622 -14.749 1.00 0.00 C ATOM 42 CD GLU A 3 6.521 18.794 -13.691 1.00 0.00 C ATOM 43 OE1 GLU A 3 7.365 17.886 -13.547 1.00 0.00 O ATOM 44 OE2 GLU A 3 6.517 19.839 -13.006 1.00 0.00 O ATOM 0 H GLU A 3 5.629 19.191 -19.159 1.00 0.00 H new ATOM 0 HA GLU A 3 6.174 17.341 -17.043 1.00 0.00 H new ATOM 0 HB2 GLU A 3 6.877 19.563 -16.034 1.00 0.00 H new ATOM 0 HB3 GLU A 3 5.232 20.125 -16.256 1.00 0.00 H new ATOM 0 HG2 GLU A 3 4.523 19.079 -14.400 1.00 0.00 H new ATOM 0 HG3 GLU A 3 5.248 17.560 -14.887 1.00 0.00 H new ATOM 51 N SER A 4 3.717 16.881 -16.966 1.00 0.00 N ATOM 52 CA SER A 4 2.317 16.489 -17.116 1.00 0.00 C ATOM 53 C SER A 4 2.021 16.036 -18.543 1.00 0.00 C ATOM 54 O SER A 4 1.645 14.887 -18.774 1.00 0.00 O ATOM 55 CB SER A 4 1.392 17.648 -16.737 1.00 0.00 C ATOM 56 OG SER A 4 1.929 18.402 -15.664 1.00 0.00 O ATOM 0 H SER A 4 4.279 16.229 -16.419 1.00 0.00 H new ATOM 0 HA SER A 4 2.133 15.651 -16.443 1.00 0.00 H new ATOM 0 HB2 SER A 4 1.243 18.295 -17.601 1.00 0.00 H new ATOM 0 HB3 SER A 4 0.413 17.259 -16.457 1.00 0.00 H new ATOM 0 HG SER A 4 1.319 19.137 -15.443 1.00 0.00 H new ATOM 62 N LYS A 5 2.188 16.948 -19.497 1.00 0.00 N ATOM 63 CA LYS A 5 1.934 16.649 -20.904 1.00 0.00 C ATOM 64 C LYS A 5 2.581 15.330 -21.322 1.00 0.00 C ATOM 65 O LYS A 5 1.907 14.430 -21.823 1.00 0.00 O ATOM 66 CB LYS A 5 2.453 17.785 -21.787 1.00 0.00 C ATOM 67 CG LYS A 5 1.581 18.060 -23.001 1.00 0.00 C ATOM 68 CD LYS A 5 0.676 19.261 -22.777 1.00 0.00 C ATOM 69 CE LYS A 5 -0.460 19.297 -23.786 1.00 0.00 C ATOM 70 NZ LYS A 5 -0.883 20.691 -24.097 1.00 0.00 N ATOM 0 H LYS A 5 2.499 17.903 -19.321 1.00 0.00 H new ATOM 0 HA LYS A 5 0.856 16.552 -21.033 1.00 0.00 H new ATOM 0 HB2 LYS A 5 2.526 18.694 -21.190 1.00 0.00 H new ATOM 0 HB3 LYS A 5 3.461 17.542 -22.122 1.00 0.00 H new ATOM 0 HG2 LYS A 5 2.213 18.237 -23.871 1.00 0.00 H new ATOM 0 HG3 LYS A 5 0.974 17.182 -23.221 1.00 0.00 H new ATOM 0 HD2 LYS A 5 0.267 19.226 -21.767 1.00 0.00 H new ATOM 0 HD3 LYS A 5 1.261 20.178 -22.853 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -0.146 18.800 -24.704 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -1.310 18.738 -23.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -1.659 20.672 -24.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -1.207 21.158 -23.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -0.079 21.217 -24.494 1.00 0.00 H new ATOM 84 N LYS A 6 3.890 15.222 -21.119 1.00 0.00 N ATOM 85 CA LYS A 6 4.622 14.012 -21.482 1.00 0.00 C ATOM 86 C LYS A 6 5.031 13.222 -20.243 1.00 0.00 C ATOM 87 O LYS A 6 5.056 11.991 -20.261 1.00 0.00 O ATOM 88 CB LYS A 6 5.859 14.366 -22.311 1.00 0.00 C ATOM 89 CG LYS A 6 6.774 15.379 -21.640 1.00 0.00 C ATOM 90 CD LYS A 6 7.019 16.587 -22.530 1.00 0.00 C ATOM 91 CE LYS A 6 8.456 17.071 -22.432 1.00 0.00 C ATOM 92 NZ LYS A 6 9.373 16.263 -23.283 1.00 0.00 N ATOM 0 H LYS A 6 4.466 15.956 -20.706 1.00 0.00 H new ATOM 0 HA LYS A 6 3.959 13.387 -22.081 1.00 0.00 H new ATOM 0 HB2 LYS A 6 6.424 13.456 -22.511 1.00 0.00 H new ATOM 0 HB3 LYS A 6 5.539 14.761 -23.275 1.00 0.00 H new ATOM 0 HG2 LYS A 6 6.330 15.704 -20.699 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.726 14.906 -21.397 1.00 0.00 H new ATOM 0 HD2 LYS A 6 6.791 16.330 -23.564 1.00 0.00 H new ATOM 0 HD3 LYS A 6 6.343 17.393 -22.245 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.508 18.117 -22.734 1.00 0.00 H new ATOM 0 HE3 LYS A 6 8.786 17.022 -21.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 10.343 16.625 -23.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 9.343 15.269 -22.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 9.074 16.330 -24.277 1.00 0.00 H new ATOM 106 N ILE A 7 5.354 13.934 -19.168 1.00 0.00 N ATOM 107 CA ILE A 7 5.762 13.293 -17.923 1.00 0.00 C ATOM 108 C ILE A 7 4.658 13.383 -16.875 1.00 0.00 C ATOM 109 O ILE A 7 4.362 14.462 -16.364 1.00 0.00 O ATOM 110 CB ILE A 7 7.045 13.932 -17.356 1.00 0.00 C ATOM 111 CG1 ILE A 7 8.121 14.022 -18.440 1.00 0.00 C ATOM 112 CG2 ILE A 7 7.552 13.133 -16.165 1.00 0.00 C ATOM 113 CD1 ILE A 7 9.094 15.162 -18.233 1.00 0.00 C ATOM 0 H ILE A 7 5.341 14.953 -19.134 1.00 0.00 H new ATOM 0 HA ILE A 7 5.958 12.246 -18.154 1.00 0.00 H new ATOM 0 HB ILE A 7 6.811 14.942 -17.020 1.00 0.00 H new ATOM 0 HG12 ILE A 7 8.675 13.084 -18.470 1.00 0.00 H new ATOM 0 HG13 ILE A 7 7.639 14.138 -19.410 1.00 0.00 H new ATOM 0 HG21 ILE A 7 8.458 13.596 -15.775 1.00 0.00 H new ATOM 0 HG22 ILE A 7 6.789 13.117 -15.386 1.00 0.00 H new ATOM 0 HG23 ILE A 7 7.772 12.113 -16.479 1.00 0.00 H new ATOM 0 HD11 ILE A 7 9.828 15.165 -19.039 1.00 0.00 H new ATOM 0 HD12 ILE A 7 8.552 16.108 -18.233 1.00 0.00 H new ATOM 0 HD13 ILE A 7 9.604 15.036 -17.278 1.00 0.00 H new ATOM 125 N ALA A 8 4.047 12.243 -16.561 1.00 0.00 N ATOM 126 CA ALA A 8 2.972 12.204 -15.576 1.00 0.00 C ATOM 127 C ALA A 8 2.815 10.806 -14.976 1.00 0.00 C ATOM 128 O ALA A 8 3.723 9.978 -15.053 1.00 0.00 O ATOM 129 CB ALA A 8 1.667 12.661 -16.213 1.00 0.00 C ATOM 0 H ALA A 8 4.277 11.339 -16.973 1.00 0.00 H new ATOM 0 HA ALA A 8 3.230 12.884 -14.764 1.00 0.00 H new ATOM 0 HB1 ALA A 8 0.869 12.629 -15.471 1.00 0.00 H new ATOM 0 HB2 ALA A 8 1.779 13.681 -16.581 1.00 0.00 H new ATOM 0 HB3 ALA A 8 1.417 12.001 -17.043 1.00 0.00 H new ATOM 135 N LYS A 9 1.656 10.550 -14.378 1.00 0.00 N ATOM 136 CA LYS A 9 1.376 9.259 -13.760 1.00 0.00 C ATOM 137 C LYS A 9 1.124 8.196 -14.820 1.00 0.00 C ATOM 138 O LYS A 9 0.406 8.438 -15.791 1.00 0.00 O ATOM 139 CB LYS A 9 0.159 9.377 -12.852 1.00 0.00 C ATOM 140 CG LYS A 9 -1.058 9.845 -13.600 1.00 0.00 C ATOM 141 CD LYS A 9 -1.906 10.797 -12.769 1.00 0.00 C ATOM 142 CE LYS A 9 -1.673 12.244 -13.169 1.00 0.00 C ATOM 143 NZ LYS A 9 -2.783 13.129 -12.722 1.00 0.00 N ATOM 0 H LYS A 9 0.893 11.223 -14.308 1.00 0.00 H new ATOM 0 HA LYS A 9 2.244 8.962 -13.171 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -0.047 8.410 -12.394 1.00 0.00 H new ATOM 0 HB3 LYS A 9 0.377 10.073 -12.042 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -0.749 10.343 -14.519 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -1.659 8.983 -13.890 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -2.960 10.549 -12.893 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -1.670 10.668 -11.713 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -0.735 12.593 -12.738 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -1.570 12.309 -14.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -2.586 14.107 -13.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -3.675 12.812 -13.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -2.865 13.087 -11.686 1.00 0.00 H new ATOM 157 N LYS A 10 1.713 7.017 -14.635 1.00 0.00 N ATOM 158 CA LYS A 10 1.536 5.931 -15.588 1.00 0.00 C ATOM 159 C LYS A 10 0.877 4.739 -14.910 1.00 0.00 C ATOM 160 O LYS A 10 1.258 4.359 -13.807 1.00 0.00 O ATOM 161 CB LYS A 10 2.887 5.518 -16.178 1.00 0.00 C ATOM 162 CG LYS A 10 3.605 6.633 -16.922 1.00 0.00 C ATOM 163 CD LYS A 10 5.073 6.714 -16.521 1.00 0.00 C ATOM 164 CE LYS A 10 5.945 7.172 -17.678 1.00 0.00 C ATOM 165 NZ LYS A 10 6.828 6.080 -18.173 1.00 0.00 N ATOM 0 H LYS A 10 2.312 6.793 -13.840 1.00 0.00 H new ATOM 0 HA LYS A 10 0.891 6.278 -16.395 1.00 0.00 H new ATOM 0 HB2 LYS A 10 3.529 5.160 -15.373 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.734 4.681 -16.859 1.00 0.00 H new ATOM 0 HG2 LYS A 10 3.529 6.464 -17.996 1.00 0.00 H new ATOM 0 HG3 LYS A 10 3.116 7.585 -16.714 1.00 0.00 H new ATOM 0 HD2 LYS A 10 5.185 7.404 -15.685 1.00 0.00 H new ATOM 0 HD3 LYS A 10 5.411 5.737 -16.175 1.00 0.00 H new ATOM 0 HE2 LYS A 10 5.312 7.525 -18.492 1.00 0.00 H new ATOM 0 HE3 LYS A 10 6.556 8.017 -17.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 7.407 6.432 -18.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 7.450 5.760 -17.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 6.245 5.283 -18.500 1.00 0.00 H new ATOM 179 N LYS A 11 -0.113 4.141 -15.560 1.00 0.00 N ATOM 180 CA LYS A 11 -0.787 2.995 -14.972 1.00 0.00 C ATOM 181 C LYS A 11 0.198 1.854 -14.790 1.00 0.00 C ATOM 182 O LYS A 11 0.629 1.231 -15.761 1.00 0.00 O ATOM 183 CB LYS A 11 -1.957 2.546 -15.844 1.00 0.00 C ATOM 184 CG LYS A 11 -2.910 3.674 -16.206 1.00 0.00 C ATOM 185 CD LYS A 11 -4.300 3.148 -16.531 1.00 0.00 C ATOM 186 CE LYS A 11 -5.366 3.827 -15.684 1.00 0.00 C ATOM 187 NZ LYS A 11 -6.738 3.399 -16.069 1.00 0.00 N ATOM 0 H LYS A 11 -0.461 4.424 -16.476 1.00 0.00 H new ATOM 0 HA LYS A 11 -1.181 3.288 -13.999 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -1.568 2.102 -16.760 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.511 1.766 -15.322 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -2.972 4.380 -15.377 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -2.518 4.222 -17.063 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -4.514 3.312 -17.587 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -4.331 2.072 -16.363 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.196 3.596 -14.633 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -5.280 4.908 -15.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -7.434 3.884 -15.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -6.911 3.642 -17.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -6.829 2.371 -15.943 1.00 0.00 H new ATOM 201 N THR A 12 0.570 1.594 -13.542 1.00 0.00 N ATOM 202 CA THR A 12 1.526 0.539 -13.248 1.00 0.00 C ATOM 203 C THR A 12 0.879 -0.603 -12.472 1.00 0.00 C ATOM 204 O THR A 12 0.266 -0.385 -11.429 1.00 0.00 O ATOM 205 CB THR A 12 2.712 1.101 -12.464 1.00 0.00 C ATOM 206 OG1 THR A 12 3.087 2.371 -12.967 1.00 0.00 O ATOM 207 CG2 THR A 12 3.935 0.211 -12.511 1.00 0.00 C ATOM 0 H THR A 12 0.226 2.097 -12.724 1.00 0.00 H new ATOM 0 HA THR A 12 1.881 0.140 -14.198 1.00 0.00 H new ATOM 0 HB THR A 12 2.371 1.169 -11.431 1.00 0.00 H new ATOM 0 HG1 THR A 12 3.565 2.870 -12.272 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.740 0.668 -11.935 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.693 -0.763 -12.086 1.00 0.00 H new ATOM 0 HG23 THR A 12 4.255 0.086 -13.546 1.00 0.00 H new ATOM 215 N THR A 13 1.022 -1.824 -12.985 1.00 0.00 N ATOM 216 CA THR A 13 0.444 -2.992 -12.326 1.00 0.00 C ATOM 217 C THR A 13 1.364 -3.539 -11.246 1.00 0.00 C ATOM 218 O THR A 13 2.588 -3.504 -11.366 1.00 0.00 O ATOM 219 CB THR A 13 0.136 -4.103 -13.328 1.00 0.00 C ATOM 220 OG1 THR A 13 -0.072 -3.576 -14.627 1.00 0.00 O ATOM 221 CG2 THR A 13 -1.086 -4.907 -12.949 1.00 0.00 C ATOM 0 H THR A 13 1.528 -2.029 -13.847 1.00 0.00 H new ATOM 0 HA THR A 13 -0.485 -2.658 -11.864 1.00 0.00 H new ATOM 0 HB THR A 13 1.007 -4.758 -13.317 1.00 0.00 H new ATOM 0 HG1 THR A 13 -0.266 -4.308 -15.250 1.00 0.00 H new ATOM 0 HG21 THR A 13 -1.258 -5.682 -13.696 1.00 0.00 H new ATOM 0 HG22 THR A 13 -0.929 -5.370 -11.975 1.00 0.00 H new ATOM 0 HG23 THR A 13 -1.954 -4.249 -12.902 1.00 0.00 H new ATOM 229 N LEU A 14 0.745 -4.060 -10.198 1.00 0.00 N ATOM 230 CA LEU A 14 1.459 -4.645 -9.078 1.00 0.00 C ATOM 231 C LEU A 14 0.740 -5.907 -8.636 1.00 0.00 C ATOM 232 O LEU A 14 -0.457 -5.864 -8.351 1.00 0.00 O ATOM 233 CB LEU A 14 1.524 -3.654 -7.912 1.00 0.00 C ATOM 234 CG LEU A 14 1.777 -2.195 -8.303 1.00 0.00 C ATOM 235 CD1 LEU A 14 0.889 -1.266 -7.489 1.00 0.00 C ATOM 236 CD2 LEU A 14 3.243 -1.832 -8.117 1.00 0.00 C ATOM 0 H LEU A 14 -0.270 -4.088 -10.102 1.00 0.00 H new ATOM 0 HA LEU A 14 2.476 -4.886 -9.387 1.00 0.00 H new ATOM 0 HB2 LEU A 14 0.586 -3.707 -7.360 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.313 -3.972 -7.231 1.00 0.00 H new ATOM 0 HG LEU A 14 1.529 -2.075 -9.358 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.081 -0.233 -7.779 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -0.158 -1.507 -7.676 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.106 -1.392 -6.428 1.00 0.00 H new ATOM 0 HD21 LEU A 14 3.399 -0.791 -8.401 1.00 0.00 H new ATOM 0 HD22 LEU A 14 3.522 -1.969 -7.072 1.00 0.00 H new ATOM 0 HD23 LEU A 14 3.860 -2.476 -8.744 1.00 0.00 H new ATOM 248 N ALA A 15 1.443 -7.035 -8.579 1.00 0.00 N ATOM 249 CA ALA A 15 0.785 -8.264 -8.171 1.00 0.00 C ATOM 250 C ALA A 15 0.810 -8.412 -6.666 1.00 0.00 C ATOM 251 O ALA A 15 1.741 -8.972 -6.091 1.00 0.00 O ATOM 252 CB ALA A 15 1.439 -9.465 -8.837 1.00 0.00 C ATOM 0 H ALA A 15 2.435 -7.121 -8.803 1.00 0.00 H new ATOM 0 HA ALA A 15 -0.256 -8.216 -8.491 1.00 0.00 H new ATOM 0 HB1 ALA A 15 0.933 -10.377 -8.520 1.00 0.00 H new ATOM 0 HB2 ALA A 15 1.364 -9.366 -9.920 1.00 0.00 H new ATOM 0 HB3 ALA A 15 2.489 -9.514 -8.549 1.00 0.00 H new ATOM 258 N PHE A 16 -0.257 -7.920 -6.051 1.00 0.00 N ATOM 259 CA PHE A 16 -0.445 -7.987 -4.618 1.00 0.00 C ATOM 260 C PHE A 16 -1.895 -7.752 -4.286 1.00 0.00 C ATOM 261 O PHE A 16 -2.694 -7.410 -5.152 1.00 0.00 O ATOM 262 CB PHE A 16 0.415 -6.972 -3.871 1.00 0.00 C ATOM 263 CG PHE A 16 1.873 -7.016 -4.240 1.00 0.00 C ATOM 264 CD1 PHE A 16 2.328 -6.417 -5.404 1.00 0.00 C ATOM 265 CD2 PHE A 16 2.785 -7.667 -3.426 1.00 0.00 C ATOM 266 CE1 PHE A 16 3.664 -6.468 -5.751 1.00 0.00 C ATOM 267 CE2 PHE A 16 4.124 -7.718 -3.765 1.00 0.00 C ATOM 268 CZ PHE A 16 4.564 -7.119 -4.930 1.00 0.00 C ATOM 0 H PHE A 16 -1.022 -7.459 -6.544 1.00 0.00 H new ATOM 0 HA PHE A 16 -0.136 -8.982 -4.297 1.00 0.00 H new ATOM 0 HB2 PHE A 16 0.031 -5.971 -4.068 1.00 0.00 H new ATOM 0 HB3 PHE A 16 0.316 -7.146 -2.800 1.00 0.00 H new ATOM 0 HD1 PHE A 16 1.629 -5.904 -6.048 1.00 0.00 H new ATOM 0 HD2 PHE A 16 2.446 -8.140 -2.516 1.00 0.00 H new ATOM 0 HE1 PHE A 16 4.004 -6.000 -6.663 1.00 0.00 H new ATOM 0 HE2 PHE A 16 4.826 -8.226 -3.120 1.00 0.00 H new ATOM 0 HZ PHE A 16 5.609 -7.160 -5.198 1.00 0.00 H new ATOM 278 N ASP A 17 -2.216 -7.909 -3.025 1.00 0.00 N ATOM 279 CA ASP A 17 -3.558 -7.690 -2.532 1.00 0.00 C ATOM 280 C ASP A 17 -3.758 -8.473 -1.274 1.00 0.00 C ATOM 281 O ASP A 17 -4.380 -8.006 -0.326 1.00 0.00 O ATOM 282 CB ASP A 17 -4.625 -8.085 -3.545 1.00 0.00 C ATOM 283 CG ASP A 17 -5.175 -6.895 -4.308 1.00 0.00 C ATOM 284 OD1 ASP A 17 -4.497 -5.846 -4.341 1.00 0.00 O ATOM 285 OD2 ASP A 17 -6.283 -7.011 -4.872 1.00 0.00 O ATOM 0 H ASP A 17 -1.551 -8.194 -2.306 1.00 0.00 H new ATOM 0 HA ASP A 17 -3.665 -6.622 -2.344 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.203 -8.801 -4.251 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.442 -8.590 -3.029 1.00 0.00 H new ATOM 290 N GLU A 18 -3.218 -9.668 -1.254 1.00 0.00 N ATOM 291 CA GLU A 18 -3.354 -10.488 -0.080 1.00 0.00 C ATOM 292 C GLU A 18 -3.010 -9.664 1.161 1.00 0.00 C ATOM 293 O GLU A 18 -3.860 -9.420 2.023 1.00 0.00 O ATOM 294 CB GLU A 18 -2.460 -11.724 -0.169 1.00 0.00 C ATOM 295 CG GLU A 18 -2.875 -12.845 0.770 1.00 0.00 C ATOM 296 CD GLU A 18 -3.963 -13.722 0.184 1.00 0.00 C ATOM 297 OE1 GLU A 18 -4.828 -14.191 0.953 1.00 0.00 O ATOM 298 OE2 GLU A 18 -3.951 -13.942 -1.046 1.00 0.00 O ATOM 0 H GLU A 18 -2.691 -10.086 -2.021 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.386 -10.830 -0.008 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -2.471 -12.097 -1.193 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.433 -11.436 0.055 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.005 -13.459 1.004 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -3.225 -12.417 1.709 1.00 0.00 H new ATOM 305 N ASP A 19 -1.765 -9.198 1.219 1.00 0.00 N ATOM 306 CA ASP A 19 -1.317 -8.381 2.340 1.00 0.00 C ATOM 307 C ASP A 19 -1.646 -6.913 2.122 1.00 0.00 C ATOM 308 O ASP A 19 -2.211 -6.262 3.000 1.00 0.00 O ATOM 309 CB ASP A 19 0.186 -8.557 2.563 1.00 0.00 C ATOM 310 CG ASP A 19 0.555 -9.989 2.898 1.00 0.00 C ATOM 311 OD1 ASP A 19 1.564 -10.485 2.354 1.00 0.00 O ATOM 312 OD2 ASP A 19 -0.165 -10.615 3.705 1.00 0.00 O ATOM 0 H ASP A 19 -1.054 -9.371 0.508 1.00 0.00 H new ATOM 0 HA ASP A 19 -1.849 -8.718 3.230 1.00 0.00 H new ATOM 0 HB2 ASP A 19 0.723 -8.246 1.667 1.00 0.00 H new ATOM 0 HB3 ASP A 19 0.510 -7.902 3.372 1.00 0.00 H new ATOM 317 N VAL A 20 -1.293 -6.388 0.955 1.00 0.00 N ATOM 318 CA VAL A 20 -1.563 -4.992 0.658 1.00 0.00 C ATOM 319 C VAL A 20 -3.059 -4.698 0.735 1.00 0.00 C ATOM 320 O VAL A 20 -3.460 -3.724 1.357 1.00 0.00 O ATOM 321 CB VAL A 20 -1.008 -4.567 -0.717 1.00 0.00 C ATOM 322 CG1 VAL A 20 0.458 -4.942 -0.833 1.00 0.00 C ATOM 323 CG2 VAL A 20 -1.803 -5.194 -1.843 1.00 0.00 C ATOM 0 H VAL A 20 -0.825 -6.902 0.209 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.045 -4.405 1.416 1.00 0.00 H new ATOM 0 HB VAL A 20 -1.102 -3.484 -0.800 1.00 0.00 H new ATOM 0 HG11 VAL A 20 0.836 -4.636 -1.809 1.00 0.00 H new ATOM 0 HG12 VAL A 20 1.025 -4.439 -0.050 1.00 0.00 H new ATOM 0 HG13 VAL A 20 0.567 -6.021 -0.724 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.390 -4.877 -2.801 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.749 -6.280 -1.766 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -2.844 -4.877 -1.774 1.00 0.00 H new ATOM 333 N TYR A 21 -3.889 -5.550 0.126 1.00 0.00 N ATOM 334 CA TYR A 21 -5.333 -5.337 0.176 1.00 0.00 C ATOM 335 C TYR A 21 -5.828 -5.455 1.611 1.00 0.00 C ATOM 336 O TYR A 21 -6.599 -4.613 2.071 1.00 0.00 O ATOM 337 CB TYR A 21 -6.098 -6.311 -0.732 1.00 0.00 C ATOM 338 CG TYR A 21 -7.396 -5.745 -1.260 1.00 0.00 C ATOM 339 CD1 TYR A 21 -8.590 -5.938 -0.575 1.00 0.00 C ATOM 340 CD2 TYR A 21 -7.429 -5.016 -2.443 1.00 0.00 C ATOM 341 CE1 TYR A 21 -9.779 -5.422 -1.053 1.00 0.00 C ATOM 342 CE2 TYR A 21 -8.615 -4.497 -2.928 1.00 0.00 C ATOM 343 CZ TYR A 21 -9.787 -4.703 -2.230 1.00 0.00 C ATOM 344 OH TYR A 21 -10.969 -4.187 -2.710 1.00 0.00 O ATOM 0 H TYR A 21 -3.592 -6.375 -0.396 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.527 -4.331 -0.196 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -5.462 -6.588 -1.573 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -6.308 -7.225 -0.177 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -8.588 -6.501 0.347 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -6.513 -4.852 -2.992 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -10.698 -5.581 -0.508 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -8.624 -3.933 -3.849 1.00 0.00 H new ATOM 0 HH TYR A 21 -10.800 -3.707 -3.548 1.00 0.00 H new ATOM 354 N HIS A 22 -5.376 -6.485 2.337 1.00 0.00 N ATOM 355 CA HIS A 22 -5.793 -6.640 3.725 1.00 0.00 C ATOM 356 C HIS A 22 -5.344 -5.431 4.533 1.00 0.00 C ATOM 357 O HIS A 22 -6.150 -4.798 5.216 1.00 0.00 O ATOM 358 CB HIS A 22 -5.221 -7.925 4.327 1.00 0.00 C ATOM 359 CG HIS A 22 -6.143 -9.099 4.221 1.00 0.00 C ATOM 360 ND1 HIS A 22 -5.754 -10.391 4.508 1.00 0.00 N ATOM 361 CD2 HIS A 22 -7.446 -9.173 3.858 1.00 0.00 C ATOM 362 CE1 HIS A 22 -6.776 -11.208 4.324 1.00 0.00 C ATOM 363 NE2 HIS A 22 -7.814 -10.494 3.931 1.00 0.00 N ATOM 0 H HIS A 22 -4.738 -7.203 1.993 1.00 0.00 H new ATOM 0 HA HIS A 22 -6.880 -6.709 3.757 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -4.283 -8.164 3.827 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -4.987 -7.751 5.377 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -8.078 -8.347 3.566 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -6.764 -12.278 4.470 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -8.740 -10.864 3.716 1.00 0.00 H new ATOM 372 N THR A 23 -4.062 -5.090 4.434 1.00 0.00 N ATOM 373 CA THR A 23 -3.544 -3.928 5.145 1.00 0.00 C ATOM 374 C THR A 23 -4.246 -2.672 4.647 1.00 0.00 C ATOM 375 O THR A 23 -4.573 -1.776 5.424 1.00 0.00 O ATOM 376 CB THR A 23 -2.037 -3.791 4.957 1.00 0.00 C ATOM 377 OG1 THR A 23 -1.700 -3.775 3.581 1.00 0.00 O ATOM 378 CG2 THR A 23 -1.245 -4.899 5.615 1.00 0.00 C ATOM 0 H THR A 23 -3.372 -5.594 3.877 1.00 0.00 H new ATOM 0 HA THR A 23 -3.739 -4.061 6.209 1.00 0.00 H new ATOM 0 HB THR A 23 -1.773 -2.848 5.437 1.00 0.00 H new ATOM 0 HG1 THR A 23 -1.654 -4.694 3.245 1.00 0.00 H new ATOM 0 HG21 THR A 23 -0.181 -4.738 5.441 1.00 0.00 H new ATOM 0 HG22 THR A 23 -1.442 -4.900 6.687 1.00 0.00 H new ATOM 0 HG23 THR A 23 -1.541 -5.859 5.191 1.00 0.00 H new ATOM 386 N LEU A 24 -4.507 -2.625 3.342 1.00 0.00 N ATOM 387 CA LEU A 24 -5.208 -1.492 2.753 1.00 0.00 C ATOM 388 C LEU A 24 -6.564 -1.325 3.425 1.00 0.00 C ATOM 389 O LEU A 24 -7.181 -0.267 3.347 1.00 0.00 O ATOM 390 CB LEU A 24 -5.396 -1.685 1.243 1.00 0.00 C ATOM 391 CG LEU A 24 -4.510 -0.806 0.354 1.00 0.00 C ATOM 392 CD1 LEU A 24 -4.578 0.647 0.793 1.00 0.00 C ATOM 393 CD2 LEU A 24 -3.071 -1.294 0.373 1.00 0.00 C ATOM 0 H LEU A 24 -4.245 -3.354 2.679 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.608 -0.596 2.910 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.202 -2.730 1.000 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.439 -1.488 0.996 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.885 -0.877 -0.667 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.941 1.252 0.148 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -5.607 1.001 0.723 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -4.235 0.732 1.824 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.461 -0.654 -0.265 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.688 -1.259 1.393 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.030 -2.319 0.005 1.00 0.00 H new ATOM 405 N LYS A 25 -7.023 -2.389 4.082 1.00 0.00 N ATOM 406 CA LYS A 25 -8.303 -2.368 4.761 1.00 0.00 C ATOM 407 C LYS A 25 -8.308 -1.391 5.930 1.00 0.00 C ATOM 408 O LYS A 25 -9.219 -0.572 6.050 1.00 0.00 O ATOM 409 CB LYS A 25 -8.676 -3.769 5.248 1.00 0.00 C ATOM 410 CG LYS A 25 -10.134 -3.902 5.662 1.00 0.00 C ATOM 411 CD LYS A 25 -11.074 -3.541 4.522 1.00 0.00 C ATOM 412 CE LYS A 25 -11.888 -2.294 4.838 1.00 0.00 C ATOM 413 NZ LYS A 25 -13.316 -2.618 5.114 1.00 0.00 N ATOM 0 H LYS A 25 -6.521 -3.274 4.154 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.047 -2.030 4.039 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.465 -4.488 4.456 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.041 -4.031 6.094 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.329 -4.924 5.986 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.331 -3.254 6.516 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.497 -3.378 3.612 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -11.747 -4.376 4.327 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.457 -1.788 5.702 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.829 -1.600 4.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.836 -1.742 5.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.735 -3.078 4.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.375 -3.260 5.930 1.00 0.00 H new ATOM 427 N LEU A 26 -7.295 -1.465 6.791 1.00 0.00 N ATOM 428 CA LEU A 26 -7.232 -0.559 7.931 1.00 0.00 C ATOM 429 C LEU A 26 -6.954 0.857 7.454 1.00 0.00 C ATOM 430 O LEU A 26 -7.621 1.800 7.865 1.00 0.00 O ATOM 431 CB LEU A 26 -6.184 -1.009 8.949 1.00 0.00 C ATOM 432 CG LEU A 26 -4.780 -1.155 8.390 1.00 0.00 C ATOM 433 CD1 LEU A 26 -4.045 0.172 8.458 1.00 0.00 C ATOM 434 CD2 LEU A 26 -4.014 -2.238 9.135 1.00 0.00 C ATOM 0 H LEU A 26 -6.523 -2.128 6.723 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.198 -0.577 8.435 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.161 -0.291 9.769 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -6.494 -1.965 9.371 1.00 0.00 H new ATOM 0 HG LEU A 26 -4.853 -1.454 7.344 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -3.040 0.052 8.054 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -4.585 0.917 7.874 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -3.982 0.500 9.495 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.011 -2.326 8.718 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -3.947 -1.975 10.191 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -4.535 -3.190 9.030 1.00 0.00 H new ATOM 446 N VAL A 27 -5.983 0.991 6.563 1.00 0.00 N ATOM 447 CA VAL A 27 -5.633 2.296 6.001 1.00 0.00 C ATOM 448 C VAL A 27 -6.797 2.883 5.236 1.00 0.00 C ATOM 449 O VAL A 27 -7.070 4.075 5.329 1.00 0.00 O ATOM 450 CB VAL A 27 -4.430 2.221 5.047 1.00 0.00 C ATOM 451 CG1 VAL A 27 -3.170 2.733 5.711 1.00 0.00 C ATOM 452 CG2 VAL A 27 -4.227 0.823 4.564 1.00 0.00 C ATOM 0 H VAL A 27 -5.421 0.216 6.211 1.00 0.00 H new ATOM 0 HA VAL A 27 -5.374 2.928 6.851 1.00 0.00 H new ATOM 0 HB VAL A 27 -4.646 2.860 4.191 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.337 2.667 5.011 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.312 3.772 6.009 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.952 2.129 6.592 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -3.371 0.792 3.890 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -4.043 0.167 5.415 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.119 0.488 4.034 1.00 0.00 H new ATOM 462 N SER A 28 -7.476 2.055 4.459 1.00 0.00 N ATOM 463 CA SER A 28 -8.590 2.549 3.678 1.00 0.00 C ATOM 464 C SER A 28 -9.710 3.046 4.579 1.00 0.00 C ATOM 465 O SER A 28 -10.323 4.078 4.304 1.00 0.00 O ATOM 466 CB SER A 28 -9.115 1.477 2.722 1.00 0.00 C ATOM 467 OG SER A 28 -9.586 0.345 3.432 1.00 0.00 O ATOM 0 H SER A 28 -7.279 1.060 4.355 1.00 0.00 H new ATOM 0 HA SER A 28 -8.227 3.388 3.084 1.00 0.00 H new ATOM 0 HB2 SER A 28 -9.921 1.890 2.115 1.00 0.00 H new ATOM 0 HB3 SER A 28 -8.322 1.176 2.037 1.00 0.00 H new ATOM 0 HG SER A 28 -8.869 -0.006 4.001 1.00 0.00 H new ATOM 473 N VAL A 29 -9.961 2.311 5.658 1.00 0.00 N ATOM 474 CA VAL A 29 -10.999 2.671 6.606 1.00 0.00 C ATOM 475 C VAL A 29 -10.527 3.801 7.512 1.00 0.00 C ATOM 476 O VAL A 29 -11.247 4.770 7.747 1.00 0.00 O ATOM 477 CB VAL A 29 -11.397 1.437 7.452 1.00 0.00 C ATOM 478 CG1 VAL A 29 -11.072 1.627 8.926 1.00 0.00 C ATOM 479 CG2 VAL A 29 -12.868 1.104 7.259 1.00 0.00 C ATOM 0 H VAL A 29 -9.454 1.458 5.895 1.00 0.00 H new ATOM 0 HA VAL A 29 -11.872 3.016 6.052 1.00 0.00 H new ATOM 0 HB VAL A 29 -10.802 0.595 7.098 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -11.368 0.737 9.481 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -10.001 1.789 9.044 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -11.614 2.491 9.310 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -13.126 0.234 7.862 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -13.477 1.954 7.568 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -13.057 0.886 6.208 1.00 0.00 H new ATOM 489 N TYR A 30 -9.312 3.655 8.022 1.00 0.00 N ATOM 490 CA TYR A 30 -8.737 4.653 8.913 1.00 0.00 C ATOM 491 C TYR A 30 -8.334 5.908 8.153 1.00 0.00 C ATOM 492 O TYR A 30 -8.271 6.992 8.735 1.00 0.00 O ATOM 493 CB TYR A 30 -7.523 4.088 9.654 1.00 0.00 C ATOM 494 CG TYR A 30 -7.876 3.367 10.935 1.00 0.00 C ATOM 495 CD1 TYR A 30 -8.217 2.020 10.927 1.00 0.00 C ATOM 496 CD2 TYR A 30 -7.866 4.034 12.153 1.00 0.00 C ATOM 497 CE1 TYR A 30 -8.539 1.359 12.098 1.00 0.00 C ATOM 498 CE2 TYR A 30 -8.187 3.380 13.328 1.00 0.00 C ATOM 499 CZ TYR A 30 -8.522 2.042 13.295 1.00 0.00 C ATOM 500 OH TYR A 30 -8.842 1.388 14.462 1.00 0.00 O ATOM 0 H TYR A 30 -8.706 2.856 7.834 1.00 0.00 H new ATOM 0 HA TYR A 30 -9.505 4.919 9.639 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -6.993 3.401 8.995 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -6.836 4.903 9.883 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -8.231 1.481 9.991 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -7.603 5.081 12.183 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -8.803 0.312 12.075 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -8.176 3.914 14.267 1.00 0.00 H new ATOM 0 HH TYR A 30 -8.780 2.013 15.215 1.00 0.00 H new ATOM 510 N LEU A 31 -8.059 5.777 6.854 1.00 0.00 N ATOM 511 CA LEU A 31 -7.666 6.931 6.062 1.00 0.00 C ATOM 512 C LEU A 31 -8.754 7.287 5.053 1.00 0.00 C ATOM 513 O LEU A 31 -8.600 8.231 4.278 1.00 0.00 O ATOM 514 CB LEU A 31 -6.336 6.676 5.329 1.00 0.00 C ATOM 515 CG LEU A 31 -5.211 5.980 6.130 1.00 0.00 C ATOM 516 CD1 LEU A 31 -3.861 6.600 5.793 1.00 0.00 C ATOM 517 CD2 LEU A 31 -5.450 6.041 7.636 1.00 0.00 C ATOM 0 H LEU A 31 -8.101 4.897 6.340 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.528 7.769 6.746 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.547 6.071 4.447 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.956 7.634 4.975 1.00 0.00 H new ATOM 0 HG LEU A 31 -5.214 4.929 5.840 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.078 6.100 6.364 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.663 6.484 4.727 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -3.874 7.660 6.046 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -4.633 5.539 8.155 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.497 7.082 7.955 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -6.391 5.545 7.875 1.00 0.00 H new ATOM 529 N ASN A 32 -9.855 6.526 5.062 1.00 0.00 N ATOM 530 CA ASN A 32 -10.959 6.764 4.136 1.00 0.00 C ATOM 531 C ASN A 32 -10.410 7.018 2.740 1.00 0.00 C ATOM 532 O ASN A 32 -10.894 7.881 2.009 1.00 0.00 O ATOM 533 CB ASN A 32 -11.798 7.958 4.606 1.00 0.00 C ATOM 534 CG ASN A 32 -13.197 7.550 5.025 1.00 0.00 C ATOM 535 OD1 ASN A 32 -13.455 6.381 5.314 1.00 0.00 O ATOM 536 ND2 ASN A 32 -14.109 8.514 5.058 1.00 0.00 N ATOM 0 H ASN A 32 -10.001 5.743 5.700 1.00 0.00 H new ATOM 0 HA ASN A 32 -11.600 5.883 4.110 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -11.297 8.443 5.444 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -11.861 8.693 3.803 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -15.068 8.300 5.331 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -13.851 9.469 4.810 1.00 0.00 H new ATOM 543 N ARG A 33 -9.367 6.271 2.396 1.00 0.00 N ATOM 544 CA ARG A 33 -8.711 6.428 1.101 1.00 0.00 C ATOM 545 C ARG A 33 -8.786 5.161 0.260 1.00 0.00 C ATOM 546 O ARG A 33 -9.084 4.078 0.764 1.00 0.00 O ATOM 547 CB ARG A 33 -7.243 6.813 1.310 1.00 0.00 C ATOM 548 CG ARG A 33 -7.056 8.236 1.814 1.00 0.00 C ATOM 549 CD ARG A 33 -5.917 8.942 1.095 1.00 0.00 C ATOM 550 NE ARG A 33 -6.319 10.248 0.584 1.00 0.00 N ATOM 551 CZ ARG A 33 -6.647 11.280 1.361 1.00 0.00 C ATOM 552 NH1 ARG A 33 -6.622 11.158 2.682 1.00 0.00 N ATOM 553 NH2 ARG A 33 -7.000 12.434 0.813 1.00 0.00 N ATOM 0 H ARG A 33 -8.958 5.552 2.993 1.00 0.00 H new ATOM 0 HA ARG A 33 -9.237 7.216 0.562 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -6.792 6.121 2.022 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -6.707 6.696 0.368 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -7.980 8.797 1.671 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -6.855 8.219 2.885 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -5.077 9.063 1.779 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -5.569 8.321 0.269 1.00 0.00 H new ATOM 0 HE ARG A 33 -6.351 10.379 -0.427 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -6.351 10.271 3.107 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -6.874 11.951 3.272 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -7.020 12.531 -0.202 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -7.251 13.225 1.406 1.00 0.00 H new ATOM 567 N ASP A 34 -8.482 5.309 -1.027 1.00 0.00 N ATOM 568 CA ASP A 34 -8.477 4.184 -1.950 1.00 0.00 C ATOM 569 C ASP A 34 -7.148 3.448 -1.836 1.00 0.00 C ATOM 570 O ASP A 34 -6.184 3.989 -1.296 1.00 0.00 O ATOM 571 CB ASP A 34 -8.696 4.663 -3.386 1.00 0.00 C ATOM 572 CG ASP A 34 -10.114 5.144 -3.626 1.00 0.00 C ATOM 573 OD1 ASP A 34 -10.826 4.511 -4.434 1.00 0.00 O ATOM 574 OD2 ASP A 34 -10.513 6.152 -3.006 1.00 0.00 O ATOM 0 H ASP A 34 -8.235 6.202 -1.453 1.00 0.00 H new ATOM 0 HA ASP A 34 -9.291 3.507 -1.692 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -7.999 5.471 -3.607 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -8.470 3.850 -4.076 1.00 0.00 H new ATOM 579 N MET A 35 -7.091 2.221 -2.336 1.00 0.00 N ATOM 580 CA MET A 35 -5.871 1.445 -2.264 1.00 0.00 C ATOM 581 C MET A 35 -4.732 2.158 -2.991 1.00 0.00 C ATOM 582 O MET A 35 -3.621 2.257 -2.472 1.00 0.00 O ATOM 583 CB MET A 35 -6.113 0.045 -2.836 1.00 0.00 C ATOM 584 CG MET A 35 -4.962 -0.483 -3.662 1.00 0.00 C ATOM 585 SD MET A 35 -5.164 -2.215 -4.122 1.00 0.00 S ATOM 586 CE MET A 35 -3.855 -2.976 -3.166 1.00 0.00 C ATOM 0 H MET A 35 -7.872 1.749 -2.792 1.00 0.00 H new ATOM 0 HA MET A 35 -5.575 1.342 -1.220 1.00 0.00 H new ATOM 0 HB2 MET A 35 -6.305 -0.645 -2.014 1.00 0.00 H new ATOM 0 HB3 MET A 35 -7.012 0.065 -3.452 1.00 0.00 H new ATOM 0 HG2 MET A 35 -4.864 0.119 -4.566 1.00 0.00 H new ATOM 0 HG3 MET A 35 -4.035 -0.367 -3.100 1.00 0.00 H new ATOM 0 HE1 MET A 35 -3.349 -3.726 -3.774 1.00 0.00 H new ATOM 0 HE2 MET A 35 -3.138 -2.214 -2.859 1.00 0.00 H new ATOM 0 HE3 MET A 35 -4.280 -3.452 -2.282 1.00 0.00 H new ATOM 596 N THR A 36 -5.011 2.662 -4.190 1.00 0.00 N ATOM 597 CA THR A 36 -3.998 3.370 -4.961 1.00 0.00 C ATOM 598 C THR A 36 -3.576 4.639 -4.230 1.00 0.00 C ATOM 599 O THR A 36 -2.388 4.938 -4.124 1.00 0.00 O ATOM 600 CB THR A 36 -4.517 3.723 -6.363 1.00 0.00 C ATOM 601 OG1 THR A 36 -5.842 4.221 -6.293 1.00 0.00 O ATOM 602 CG2 THR A 36 -4.516 2.558 -7.332 1.00 0.00 C ATOM 0 H THR A 36 -5.922 2.594 -4.644 1.00 0.00 H new ATOM 0 HA THR A 36 -3.135 2.713 -5.071 1.00 0.00 H new ATOM 0 HB THR A 36 -3.824 4.476 -6.738 1.00 0.00 H new ATOM 0 HG1 THR A 36 -6.156 4.442 -7.194 1.00 0.00 H new ATOM 0 HG21 THR A 36 -4.896 2.888 -8.299 1.00 0.00 H new ATOM 0 HG22 THR A 36 -3.499 2.184 -7.451 1.00 0.00 H new ATOM 0 HG23 THR A 36 -5.152 1.762 -6.945 1.00 0.00 H new ATOM 610 N GLU A 37 -4.556 5.375 -3.720 1.00 0.00 N ATOM 611 CA GLU A 37 -4.283 6.607 -2.991 1.00 0.00 C ATOM 612 C GLU A 37 -3.443 6.321 -1.750 1.00 0.00 C ATOM 613 O GLU A 37 -2.497 7.046 -1.448 1.00 0.00 O ATOM 614 CB GLU A 37 -5.592 7.290 -2.590 1.00 0.00 C ATOM 615 CG GLU A 37 -5.535 8.807 -2.667 1.00 0.00 C ATOM 616 CD GLU A 37 -5.763 9.328 -4.072 1.00 0.00 C ATOM 617 OE1 GLU A 37 -4.806 9.866 -4.669 1.00 0.00 O ATOM 618 OE2 GLU A 37 -6.898 9.198 -4.577 1.00 0.00 O ATOM 0 H GLU A 37 -5.546 5.140 -3.798 1.00 0.00 H new ATOM 0 HA GLU A 37 -3.723 7.274 -3.646 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -6.392 6.931 -3.237 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -5.849 6.996 -1.572 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -6.287 9.229 -2.000 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -4.564 9.149 -2.310 1.00 0.00 H new ATOM 625 N ILE A 38 -3.795 5.254 -1.040 1.00 0.00 N ATOM 626 CA ILE A 38 -3.076 4.858 0.167 1.00 0.00 C ATOM 627 C ILE A 38 -1.683 4.334 -0.175 1.00 0.00 C ATOM 628 O ILE A 38 -0.689 4.770 0.406 1.00 0.00 O ATOM 629 CB ILE A 38 -3.844 3.759 0.929 1.00 0.00 C ATOM 630 CG1 ILE A 38 -4.978 4.344 1.776 1.00 0.00 C ATOM 631 CG2 ILE A 38 -2.919 2.945 1.816 1.00 0.00 C ATOM 632 CD1 ILE A 38 -6.277 3.585 1.641 1.00 0.00 C ATOM 0 H ILE A 38 -4.577 4.645 -1.281 1.00 0.00 H new ATOM 0 HA ILE A 38 -2.987 5.744 0.796 1.00 0.00 H new ATOM 0 HB ILE A 38 -4.275 3.103 0.173 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -4.675 4.349 2.823 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -5.140 5.382 1.487 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -3.495 2.180 2.337 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -2.154 2.468 1.203 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -2.444 3.601 2.545 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -7.038 4.052 2.267 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -6.602 3.602 0.601 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -6.130 2.553 1.958 1.00 0.00 H new ATOM 644 N ILE A 39 -1.615 3.386 -1.112 1.00 0.00 N ATOM 645 CA ILE A 39 -0.338 2.811 -1.501 1.00 0.00 C ATOM 646 C ILE A 39 0.539 3.861 -2.165 1.00 0.00 C ATOM 647 O ILE A 39 1.765 3.823 -2.056 1.00 0.00 O ATOM 648 CB ILE A 39 -0.514 1.603 -2.447 1.00 0.00 C ATOM 649 CG1 ILE A 39 -0.974 2.059 -3.831 1.00 0.00 C ATOM 650 CG2 ILE A 39 -1.500 0.608 -1.857 1.00 0.00 C ATOM 651 CD1 ILE A 39 0.067 1.843 -4.904 1.00 0.00 C ATOM 0 H ILE A 39 -2.423 3.008 -1.607 1.00 0.00 H new ATOM 0 HA ILE A 39 0.146 2.457 -0.591 1.00 0.00 H new ATOM 0 HB ILE A 39 0.452 1.111 -2.557 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -1.882 1.520 -4.101 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.231 3.117 -3.791 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.613 -0.238 -2.535 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -1.129 0.254 -0.895 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -2.466 1.093 -1.717 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.322 2.187 -5.862 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.968 2.404 -4.655 1.00 0.00 H new ATOM 0 HD13 ILE A 39 0.307 0.782 -4.970 1.00 0.00 H new ATOM 663 N GLU A 40 -0.099 4.810 -2.841 1.00 0.00 N ATOM 664 CA GLU A 40 0.626 5.877 -3.504 1.00 0.00 C ATOM 665 C GLU A 40 0.932 6.994 -2.518 1.00 0.00 C ATOM 666 O GLU A 40 1.890 7.745 -2.697 1.00 0.00 O ATOM 667 CB GLU A 40 -0.165 6.424 -4.690 1.00 0.00 C ATOM 668 CG GLU A 40 -0.285 5.438 -5.836 1.00 0.00 C ATOM 669 CD GLU A 40 1.032 5.222 -6.556 1.00 0.00 C ATOM 670 OE1 GLU A 40 1.453 4.054 -6.688 1.00 0.00 O ATOM 671 OE2 GLU A 40 1.643 6.223 -6.988 1.00 0.00 O ATOM 0 H GLU A 40 -1.113 4.859 -2.942 1.00 0.00 H new ATOM 0 HA GLU A 40 1.563 5.467 -3.881 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -1.164 6.704 -4.354 1.00 0.00 H new ATOM 0 HB3 GLU A 40 0.316 7.333 -5.051 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -0.647 4.484 -5.454 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -1.029 5.800 -6.546 1.00 0.00 H new ATOM 678 N GLU A 41 0.126 7.089 -1.462 1.00 0.00 N ATOM 679 CA GLU A 41 0.350 8.108 -0.447 1.00 0.00 C ATOM 680 C GLU A 41 1.383 7.610 0.555 1.00 0.00 C ATOM 681 O GLU A 41 2.176 8.387 1.092 1.00 0.00 O ATOM 682 CB GLU A 41 -0.965 8.457 0.261 1.00 0.00 C ATOM 683 CG GLU A 41 -0.787 9.295 1.518 1.00 0.00 C ATOM 684 CD GLU A 41 -2.071 9.431 2.313 1.00 0.00 C ATOM 685 OE1 GLU A 41 -2.954 8.559 2.169 1.00 0.00 O ATOM 686 OE2 GLU A 41 -2.193 10.408 3.082 1.00 0.00 O ATOM 0 H GLU A 41 -0.675 6.481 -1.291 1.00 0.00 H new ATOM 0 HA GLU A 41 0.727 9.012 -0.925 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -1.608 8.996 -0.435 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -1.481 7.533 0.522 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -0.021 8.842 2.147 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -0.428 10.286 1.242 1.00 0.00 H new ATOM 693 N ALA A 42 1.371 6.304 0.791 1.00 0.00 N ATOM 694 CA ALA A 42 2.306 5.688 1.719 1.00 0.00 C ATOM 695 C ALA A 42 3.696 5.595 1.104 1.00 0.00 C ATOM 696 O ALA A 42 4.701 5.838 1.772 1.00 0.00 O ATOM 697 CB ALA A 42 1.813 4.309 2.125 1.00 0.00 C ATOM 0 H ALA A 42 0.722 5.651 0.351 1.00 0.00 H new ATOM 0 HA ALA A 42 2.369 6.314 2.609 1.00 0.00 H new ATOM 0 HB1 ALA A 42 2.522 3.859 2.820 1.00 0.00 H new ATOM 0 HB2 ALA A 42 0.839 4.398 2.607 1.00 0.00 H new ATOM 0 HB3 ALA A 42 1.723 3.679 1.240 1.00 0.00 H new ATOM 703 N VAL A 43 3.744 5.239 -0.176 1.00 0.00 N ATOM 704 CA VAL A 43 5.012 5.111 -0.887 1.00 0.00 C ATOM 705 C VAL A 43 5.829 6.382 -0.787 1.00 0.00 C ATOM 706 O VAL A 43 6.931 6.393 -0.240 1.00 0.00 O ATOM 707 CB VAL A 43 4.799 4.797 -2.388 1.00 0.00 C ATOM 708 CG1 VAL A 43 3.743 5.687 -3.002 1.00 0.00 C ATOM 709 CG2 VAL A 43 6.094 4.947 -3.162 1.00 0.00 C ATOM 0 H VAL A 43 2.920 5.034 -0.742 1.00 0.00 H new ATOM 0 HA VAL A 43 5.544 4.286 -0.413 1.00 0.00 H new ATOM 0 HB VAL A 43 4.459 3.763 -2.449 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.623 5.436 -4.056 1.00 0.00 H new ATOM 0 HG12 VAL A 43 2.796 5.539 -2.483 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.048 6.730 -2.910 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.918 4.721 -4.214 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.458 5.970 -3.067 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.838 4.258 -2.763 1.00 0.00 H new ATOM 719 N VAL A 44 5.275 7.445 -1.334 1.00 0.00 N ATOM 720 CA VAL A 44 5.930 8.736 -1.335 1.00 0.00 C ATOM 721 C VAL A 44 6.306 9.145 0.078 1.00 0.00 C ATOM 722 O VAL A 44 7.458 9.469 0.354 1.00 0.00 O ATOM 723 CB VAL A 44 5.026 9.799 -1.993 1.00 0.00 C ATOM 724 CG1 VAL A 44 5.133 11.159 -1.305 1.00 0.00 C ATOM 725 CG2 VAL A 44 5.342 9.924 -3.475 1.00 0.00 C ATOM 0 H VAL A 44 4.362 7.438 -1.788 1.00 0.00 H new ATOM 0 HA VAL A 44 6.846 8.659 -1.920 1.00 0.00 H new ATOM 0 HB VAL A 44 3.996 9.461 -1.876 1.00 0.00 H new ATOM 0 HG11 VAL A 44 4.478 11.872 -1.805 1.00 0.00 H new ATOM 0 HG12 VAL A 44 4.835 11.063 -0.261 1.00 0.00 H new ATOM 0 HG13 VAL A 44 6.162 11.513 -1.357 1.00 0.00 H new ATOM 0 HG21 VAL A 44 4.695 10.678 -3.923 1.00 0.00 H new ATOM 0 HG22 VAL A 44 6.384 10.219 -3.601 1.00 0.00 H new ATOM 0 HG23 VAL A 44 5.174 8.965 -3.965 1.00 0.00 H new ATOM 735 N MET A 45 5.332 9.119 0.974 1.00 0.00 N ATOM 736 CA MET A 45 5.585 9.487 2.357 1.00 0.00 C ATOM 737 C MET A 45 6.690 8.620 2.947 1.00 0.00 C ATOM 738 O MET A 45 7.448 9.072 3.804 1.00 0.00 O ATOM 739 CB MET A 45 4.314 9.369 3.201 1.00 0.00 C ATOM 740 CG MET A 45 4.538 9.653 4.680 1.00 0.00 C ATOM 741 SD MET A 45 5.388 11.219 4.971 1.00 0.00 S ATOM 742 CE MET A 45 5.368 11.288 6.760 1.00 0.00 C ATOM 0 H MET A 45 4.369 8.850 0.771 1.00 0.00 H new ATOM 0 HA MET A 45 5.908 10.528 2.372 1.00 0.00 H new ATOM 0 HB2 MET A 45 3.566 10.062 2.815 1.00 0.00 H new ATOM 0 HB3 MET A 45 3.906 8.365 3.090 1.00 0.00 H new ATOM 0 HG2 MET A 45 3.576 9.666 5.192 1.00 0.00 H new ATOM 0 HG3 MET A 45 5.121 8.842 5.117 1.00 0.00 H new ATOM 0 HE1 MET A 45 5.182 12.312 7.083 1.00 0.00 H new ATOM 0 HE2 MET A 45 4.579 10.639 7.140 1.00 0.00 H new ATOM 0 HE3 MET A 45 6.331 10.955 7.148 1.00 0.00 H new ATOM 752 N TRP A 46 6.796 7.376 2.477 1.00 0.00 N ATOM 753 CA TRP A 46 7.831 6.484 2.972 1.00 0.00 C ATOM 754 C TRP A 46 9.190 6.950 2.481 1.00 0.00 C ATOM 755 O TRP A 46 10.094 7.192 3.278 1.00 0.00 O ATOM 756 CB TRP A 46 7.571 5.044 2.532 1.00 0.00 C ATOM 757 CG TRP A 46 8.351 4.035 3.321 1.00 0.00 C ATOM 758 CD1 TRP A 46 8.099 3.622 4.597 1.00 0.00 C ATOM 759 CD2 TRP A 46 9.510 3.315 2.887 1.00 0.00 C ATOM 760 NE1 TRP A 46 9.030 2.689 4.984 1.00 0.00 N ATOM 761 CE2 TRP A 46 9.908 2.483 3.952 1.00 0.00 C ATOM 762 CE3 TRP A 46 10.251 3.290 1.702 1.00 0.00 C ATOM 763 CZ2 TRP A 46 11.011 1.639 3.866 1.00 0.00 C ATOM 764 CZ3 TRP A 46 11.347 2.452 1.619 1.00 0.00 C ATOM 765 CH2 TRP A 46 11.717 1.635 2.694 1.00 0.00 C ATOM 0 H TRP A 46 6.186 6.973 1.766 1.00 0.00 H new ATOM 0 HA TRP A 46 7.816 6.509 4.062 1.00 0.00 H new ATOM 0 HB2 TRP A 46 6.507 4.828 2.629 1.00 0.00 H new ATOM 0 HB3 TRP A 46 7.822 4.943 1.476 1.00 0.00 H new ATOM 0 HD1 TRP A 46 7.286 3.977 5.213 1.00 0.00 H new ATOM 0 HE1 TRP A 46 9.063 2.225 5.892 1.00 0.00 H new ATOM 0 HE3 TRP A 46 9.972 3.914 0.866 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 11.300 1.010 4.695 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 11.928 2.427 0.709 1.00 0.00 H new ATOM 0 HH2 TRP A 46 12.577 0.989 2.596 1.00 0.00 H new ATOM 776 N LEU A 47 9.325 7.099 1.170 1.00 0.00 N ATOM 777 CA LEU A 47 10.578 7.571 0.594 1.00 0.00 C ATOM 778 C LEU A 47 10.911 8.942 1.144 1.00 0.00 C ATOM 779 O LEU A 47 12.041 9.223 1.533 1.00 0.00 O ATOM 780 CB LEU A 47 10.500 7.687 -0.928 1.00 0.00 C ATOM 781 CG LEU A 47 9.143 8.095 -1.502 1.00 0.00 C ATOM 782 CD1 LEU A 47 9.133 9.586 -1.793 1.00 0.00 C ATOM 783 CD2 LEU A 47 8.834 7.299 -2.762 1.00 0.00 C ATOM 0 H LEU A 47 8.590 6.902 0.490 1.00 0.00 H new ATOM 0 HA LEU A 47 11.344 6.842 0.857 1.00 0.00 H new ATOM 0 HB2 LEU A 47 11.244 8.414 -1.255 1.00 0.00 H new ATOM 0 HB3 LEU A 47 10.781 6.727 -1.360 1.00 0.00 H new ATOM 0 HG LEU A 47 8.369 7.876 -0.767 1.00 0.00 H new ATOM 0 HD11 LEU A 47 8.163 9.870 -2.202 1.00 0.00 H new ATOM 0 HD12 LEU A 47 9.314 10.138 -0.871 1.00 0.00 H new ATOM 0 HD13 LEU A 47 9.914 9.821 -2.516 1.00 0.00 H new ATOM 0 HD21 LEU A 47 7.864 7.603 -3.156 1.00 0.00 H new ATOM 0 HD22 LEU A 47 9.605 7.487 -3.509 1.00 0.00 H new ATOM 0 HD23 LEU A 47 8.811 6.236 -2.524 1.00 0.00 H new ATOM 795 N ILE A 48 9.908 9.800 1.151 1.00 0.00 N ATOM 796 CA ILE A 48 10.072 11.148 1.623 1.00 0.00 C ATOM 797 C ILE A 48 10.633 11.172 3.036 1.00 0.00 C ATOM 798 O ILE A 48 11.552 11.935 3.334 1.00 0.00 O ATOM 799 CB ILE A 48 8.726 11.897 1.551 1.00 0.00 C ATOM 800 CG1 ILE A 48 8.818 12.997 0.508 1.00 0.00 C ATOM 801 CG2 ILE A 48 8.321 12.461 2.902 1.00 0.00 C ATOM 802 CD1 ILE A 48 8.822 12.490 -0.917 1.00 0.00 C ATOM 0 H ILE A 48 8.966 9.577 0.830 1.00 0.00 H new ATOM 0 HA ILE A 48 10.790 11.655 0.979 1.00 0.00 H new ATOM 0 HB ILE A 48 7.951 11.188 1.261 1.00 0.00 H new ATOM 0 HG12 ILE A 48 7.978 13.679 0.638 1.00 0.00 H new ATOM 0 HG13 ILE A 48 9.727 13.573 0.681 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.368 12.981 2.808 1.00 0.00 H new ATOM 0 HG22 ILE A 48 8.222 11.648 3.621 1.00 0.00 H new ATOM 0 HG23 ILE A 48 9.083 13.160 3.248 1.00 0.00 H new ATOM 0 HD11 ILE A 48 8.890 13.334 -1.603 1.00 0.00 H new ATOM 0 HD12 ILE A 48 9.677 11.831 -1.066 1.00 0.00 H new ATOM 0 HD13 ILE A 48 7.902 11.939 -1.110 1.00 0.00 H new ATOM 814 N GLN A 49 10.076 10.342 3.905 1.00 0.00 N ATOM 815 CA GLN A 49 10.534 10.293 5.278 1.00 0.00 C ATOM 816 C GLN A 49 11.752 9.382 5.440 1.00 0.00 C ATOM 817 O GLN A 49 12.547 9.556 6.363 1.00 0.00 O ATOM 818 CB GLN A 49 9.404 9.823 6.201 1.00 0.00 C ATOM 819 CG GLN A 49 9.147 8.325 6.140 1.00 0.00 C ATOM 820 CD GLN A 49 8.029 7.884 7.065 1.00 0.00 C ATOM 821 OE1 GLN A 49 7.240 8.701 7.540 1.00 0.00 O ATOM 822 NE2 GLN A 49 7.957 6.584 7.325 1.00 0.00 N ATOM 0 H GLN A 49 9.314 9.701 3.684 1.00 0.00 H new ATOM 0 HA GLN A 49 10.833 11.303 5.557 1.00 0.00 H new ATOM 0 HB2 GLN A 49 9.646 10.099 7.227 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.488 10.351 5.937 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.898 8.045 5.117 1.00 0.00 H new ATOM 0 HG3 GLN A 49 10.061 7.793 6.403 1.00 0.00 H new ATOM 0 HE21 GLN A 49 8.632 5.943 6.909 1.00 0.00 H new ATOM 0 HE22 GLN A 49 7.226 6.227 7.940 1.00 0.00 H new ATOM 831 N ASN A 50 11.872 8.384 4.563 1.00 0.00 N ATOM 832 CA ASN A 50 12.974 7.425 4.650 1.00 0.00 C ATOM 833 C ASN A 50 14.132 7.749 3.712 1.00 0.00 C ATOM 834 O ASN A 50 15.257 7.966 4.156 1.00 0.00 O ATOM 835 CB ASN A 50 12.459 6.015 4.357 1.00 0.00 C ATOM 836 CG ASN A 50 13.298 4.943 5.025 1.00 0.00 C ATOM 837 OD1 ASN A 50 13.060 4.580 6.176 1.00 0.00 O ATOM 838 ND2 ASN A 50 14.288 4.431 4.302 1.00 0.00 N ATOM 0 H ASN A 50 11.226 8.219 3.791 1.00 0.00 H new ATOM 0 HA ASN A 50 13.362 7.489 5.667 1.00 0.00 H new ATOM 0 HB2 ASN A 50 11.427 5.930 4.698 1.00 0.00 H new ATOM 0 HB3 ASN A 50 12.454 5.850 3.280 1.00 0.00 H new ATOM 0 HD21 ASN A 50 14.887 3.707 4.698 1.00 0.00 H new ATOM 0 HD22 ASN A 50 14.449 4.762 3.351 1.00 0.00 H new ATOM 845 N LYS A 51 13.858 7.754 2.415 1.00 0.00 N ATOM 846 CA LYS A 51 14.889 8.020 1.412 1.00 0.00 C ATOM 847 C LYS A 51 15.588 9.353 1.657 1.00 0.00 C ATOM 848 O LYS A 51 16.809 9.404 1.802 1.00 0.00 O ATOM 849 CB LYS A 51 14.288 8.000 0.003 1.00 0.00 C ATOM 850 CG LYS A 51 14.093 6.599 -0.555 1.00 0.00 C ATOM 851 CD LYS A 51 15.176 6.240 -1.565 1.00 0.00 C ATOM 852 CE LYS A 51 15.967 5.019 -1.126 1.00 0.00 C ATOM 853 NZ LYS A 51 16.975 5.354 -0.083 1.00 0.00 N ATOM 0 H LYS A 51 12.931 7.577 2.029 1.00 0.00 H new ATOM 0 HA LYS A 51 15.633 7.228 1.498 1.00 0.00 H new ATOM 0 HB2 LYS A 51 13.326 8.513 0.020 1.00 0.00 H new ATOM 0 HB3 LYS A 51 14.937 8.562 -0.668 1.00 0.00 H new ATOM 0 HG2 LYS A 51 14.103 5.877 0.262 1.00 0.00 H new ATOM 0 HG3 LYS A 51 13.114 6.529 -1.030 1.00 0.00 H new ATOM 0 HD2 LYS A 51 14.720 6.049 -2.536 1.00 0.00 H new ATOM 0 HD3 LYS A 51 15.852 7.086 -1.691 1.00 0.00 H new ATOM 0 HE2 LYS A 51 15.283 4.263 -0.740 1.00 0.00 H new ATOM 0 HE3 LYS A 51 16.470 4.583 -1.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 17.493 4.494 0.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 17.644 6.056 -0.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 16.494 5.746 0.751 1.00 0.00 H new ATOM 867 N GLU A 52 14.811 10.432 1.691 1.00 0.00 N ATOM 868 CA GLU A 52 15.361 11.768 1.908 1.00 0.00 C ATOM 869 C GLU A 52 16.369 11.781 3.057 1.00 0.00 C ATOM 870 O GLU A 52 17.320 12.561 3.051 1.00 0.00 O ATOM 871 CB GLU A 52 14.234 12.762 2.193 1.00 0.00 C ATOM 872 CG GLU A 52 14.404 14.096 1.483 1.00 0.00 C ATOM 873 CD GLU A 52 13.185 14.987 1.615 1.00 0.00 C ATOM 874 OE1 GLU A 52 12.081 14.543 1.240 1.00 0.00 O ATOM 875 OE2 GLU A 52 13.336 16.132 2.094 1.00 0.00 O ATOM 0 H GLU A 52 13.798 10.408 1.571 1.00 0.00 H new ATOM 0 HA GLU A 52 15.884 12.063 0.998 1.00 0.00 H new ATOM 0 HB2 GLU A 52 13.285 12.318 1.892 1.00 0.00 H new ATOM 0 HB3 GLU A 52 14.178 12.936 3.267 1.00 0.00 H new ATOM 0 HG2 GLU A 52 15.273 14.612 1.891 1.00 0.00 H new ATOM 0 HG3 GLU A 52 14.606 13.918 0.427 1.00 0.00 H new ATOM 882 N LYS A 53 16.150 10.916 4.042 1.00 0.00 N ATOM 883 CA LYS A 53 17.036 10.835 5.199 1.00 0.00 C ATOM 884 C LYS A 53 17.548 9.412 5.411 1.00 0.00 C ATOM 885 O LYS A 53 17.831 9.015 6.540 1.00 0.00 O ATOM 886 CB LYS A 53 16.314 11.318 6.457 1.00 0.00 C ATOM 887 CG LYS A 53 15.061 10.520 6.783 1.00 0.00 C ATOM 888 CD LYS A 53 15.012 10.127 8.252 1.00 0.00 C ATOM 889 CE LYS A 53 15.289 8.644 8.444 1.00 0.00 C ATOM 890 NZ LYS A 53 14.410 8.043 9.484 1.00 0.00 N ATOM 0 H LYS A 53 15.368 10.262 4.063 1.00 0.00 H new ATOM 0 HA LYS A 53 17.893 11.480 5.004 1.00 0.00 H new ATOM 0 HB2 LYS A 53 16.999 11.264 7.303 1.00 0.00 H new ATOM 0 HB3 LYS A 53 16.045 12.367 6.331 1.00 0.00 H new ATOM 0 HG2 LYS A 53 14.179 11.110 6.534 1.00 0.00 H new ATOM 0 HG3 LYS A 53 15.030 9.623 6.165 1.00 0.00 H new ATOM 0 HD2 LYS A 53 15.745 10.710 8.810 1.00 0.00 H new ATOM 0 HD3 LYS A 53 14.032 10.371 8.662 1.00 0.00 H new ATOM 0 HE2 LYS A 53 15.141 8.122 7.499 1.00 0.00 H new ATOM 0 HE3 LYS A 53 16.333 8.504 8.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 14.631 7.032 9.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 14.569 8.523 10.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 13.415 8.154 9.203 1.00 0.00 H new ATOM 904 N LEU A 54 17.661 8.646 4.325 1.00 0.00 N ATOM 905 CA LEU A 54 18.131 7.263 4.409 1.00 0.00 C ATOM 906 C LEU A 54 19.479 7.185 5.126 1.00 0.00 C ATOM 907 O LEU A 54 20.520 7.479 4.539 1.00 0.00 O ATOM 908 CB LEU A 54 18.261 6.662 3.009 1.00 0.00 C ATOM 909 CG LEU A 54 18.616 5.172 2.976 1.00 0.00 C ATOM 910 CD1 LEU A 54 17.355 4.324 2.933 1.00 0.00 C ATOM 911 CD2 LEU A 54 19.508 4.864 1.782 1.00 0.00 C ATOM 0 H LEU A 54 17.435 8.958 3.381 1.00 0.00 H new ATOM 0 HA LEU A 54 17.398 6.694 4.981 1.00 0.00 H new ATOM 0 HB2 LEU A 54 17.320 6.808 2.478 1.00 0.00 H new ATOM 0 HB3 LEU A 54 19.025 7.215 2.462 1.00 0.00 H new ATOM 0 HG LEU A 54 19.163 4.928 3.887 1.00 0.00 H new ATOM 0 HD11 LEU A 54 17.627 3.269 2.910 1.00 0.00 H new ATOM 0 HD12 LEU A 54 16.752 4.524 3.818 1.00 0.00 H new ATOM 0 HD13 LEU A 54 16.781 4.570 2.040 1.00 0.00 H new ATOM 0 HD21 LEU A 54 19.751 3.801 1.774 1.00 0.00 H new ATOM 0 HD22 LEU A 54 18.986 5.124 0.861 1.00 0.00 H new ATOM 0 HD23 LEU A 54 20.427 5.446 1.855 1.00 0.00 H new ATOM 923 N PRO A 55 19.475 6.791 6.414 1.00 0.00 N ATOM 924 CA PRO A 55 20.694 6.677 7.213 1.00 0.00 C ATOM 925 C PRO A 55 21.460 5.391 6.923 1.00 0.00 C ATOM 926 O PRO A 55 20.885 4.404 6.465 1.00 0.00 O ATOM 927 CB PRO A 55 20.184 6.677 8.666 1.00 0.00 C ATOM 928 CG PRO A 55 18.696 6.835 8.587 1.00 0.00 C ATOM 929 CD PRO A 55 18.297 6.420 7.201 1.00 0.00 C ATOM 0 HA PRO A 55 21.393 7.484 6.995 1.00 0.00 H new ATOM 0 HB2 PRO A 55 20.451 5.749 9.172 1.00 0.00 H new ATOM 0 HB3 PRO A 55 20.632 7.491 9.236 1.00 0.00 H new ATOM 0 HG2 PRO A 55 18.200 6.217 9.335 1.00 0.00 H new ATOM 0 HG3 PRO A 55 18.404 7.867 8.782 1.00 0.00 H new ATOM 0 HD2 PRO A 55 18.087 5.352 7.141 1.00 0.00 H new ATOM 0 HD3 PRO A 55 17.401 6.940 6.862 1.00 0.00 H new ATOM 937 N ASN A 56 22.758 5.408 7.202 1.00 0.00 N ATOM 938 CA ASN A 56 23.600 4.239 6.982 1.00 0.00 C ATOM 939 C ASN A 56 23.352 3.188 8.060 1.00 0.00 C ATOM 940 O ASN A 56 23.533 1.992 7.829 1.00 0.00 O ATOM 941 CB ASN A 56 25.076 4.642 6.974 1.00 0.00 C ATOM 942 CG ASN A 56 25.918 3.737 6.097 1.00 0.00 C ATOM 943 OD1 ASN A 56 26.503 4.180 5.109 1.00 0.00 O ATOM 944 ND2 ASN A 56 25.983 2.460 6.455 1.00 0.00 N ATOM 0 H ASN A 56 23.250 6.218 7.581 1.00 0.00 H new ATOM 0 HA ASN A 56 23.345 3.811 6.013 1.00 0.00 H new ATOM 0 HB2 ASN A 56 25.167 5.670 6.623 1.00 0.00 H new ATOM 0 HB3 ASN A 56 25.462 4.617 7.993 1.00 0.00 H new ATOM 0 HD21 ASN A 56 26.534 1.803 5.903 1.00 0.00 H new ATOM 0 HD22 ASN A 56 25.482 2.136 7.282 1.00 0.00 H new ATOM 951 N GLU A 57 22.936 3.644 9.239 1.00 0.00 N ATOM 952 CA GLU A 57 22.661 2.746 10.355 1.00 0.00 C ATOM 953 C GLU A 57 21.294 2.077 10.205 1.00 0.00 C ATOM 954 O GLU A 57 21.008 1.082 10.870 1.00 0.00 O ATOM 955 CB GLU A 57 22.724 3.511 11.678 1.00 0.00 C ATOM 956 CG GLU A 57 21.883 4.778 11.689 1.00 0.00 C ATOM 957 CD GLU A 57 21.663 5.318 13.089 1.00 0.00 C ATOM 958 OE1 GLU A 57 21.548 6.553 13.236 1.00 0.00 O ATOM 959 OE2 GLU A 57 21.605 4.506 14.036 1.00 0.00 O ATOM 0 H GLU A 57 22.782 4.631 9.445 1.00 0.00 H new ATOM 0 HA GLU A 57 23.424 1.967 10.353 1.00 0.00 H new ATOM 0 HB2 GLU A 57 22.390 2.856 12.483 1.00 0.00 H new ATOM 0 HB3 GLU A 57 23.761 3.772 11.888 1.00 0.00 H new ATOM 0 HG2 GLU A 57 22.372 5.540 11.082 1.00 0.00 H new ATOM 0 HG3 GLU A 57 20.918 4.573 11.226 1.00 0.00 H new ATOM 966 N LEU A 58 20.454 2.628 9.332 1.00 0.00 N ATOM 967 CA LEU A 58 19.123 2.075 9.103 1.00 0.00 C ATOM 968 C LEU A 58 19.161 0.970 8.051 1.00 0.00 C ATOM 969 O LEU A 58 18.264 0.132 7.993 1.00 0.00 O ATOM 970 CB LEU A 58 18.154 3.178 8.666 1.00 0.00 C ATOM 971 CG LEU A 58 17.116 3.585 9.715 1.00 0.00 C ATOM 972 CD1 LEU A 58 16.227 4.702 9.185 1.00 0.00 C ATOM 973 CD2 LEU A 58 16.277 2.384 10.127 1.00 0.00 C ATOM 0 H LEU A 58 20.671 3.454 8.774 1.00 0.00 H new ATOM 0 HA LEU A 58 18.774 1.645 10.042 1.00 0.00 H new ATOM 0 HB2 LEU A 58 18.733 4.059 8.389 1.00 0.00 H new ATOM 0 HB3 LEU A 58 17.631 2.846 7.770 1.00 0.00 H new ATOM 0 HG LEU A 58 17.643 3.956 10.594 1.00 0.00 H new ATOM 0 HD11 LEU A 58 15.496 4.977 9.945 1.00 0.00 H new ATOM 0 HD12 LEU A 58 16.840 5.570 8.940 1.00 0.00 H new ATOM 0 HD13 LEU A 58 15.708 4.360 8.290 1.00 0.00 H new ATOM 0 HD21 LEU A 58 15.544 2.691 10.873 1.00 0.00 H new ATOM 0 HD22 LEU A 58 15.761 1.984 9.254 1.00 0.00 H new ATOM 0 HD23 LEU A 58 16.924 1.615 10.549 1.00 0.00 H new ATOM 985 N LYS A 59 20.204 0.981 7.218 1.00 0.00 N ATOM 986 CA LYS A 59 20.368 -0.017 6.158 1.00 0.00 C ATOM 987 C LYS A 59 19.919 -1.409 6.610 1.00 0.00 C ATOM 988 O LYS A 59 19.166 -2.080 5.908 1.00 0.00 O ATOM 989 CB LYS A 59 21.827 -0.067 5.701 1.00 0.00 C ATOM 990 CG LYS A 59 21.988 -0.311 4.210 1.00 0.00 C ATOM 991 CD LYS A 59 23.440 -0.579 3.844 1.00 0.00 C ATOM 992 CE LYS A 59 23.907 -1.927 4.371 1.00 0.00 C ATOM 993 NZ LYS A 59 25.324 -2.205 4.007 1.00 0.00 N ATOM 0 H LYS A 59 20.951 1.674 7.258 1.00 0.00 H new ATOM 0 HA LYS A 59 19.733 0.285 5.325 1.00 0.00 H new ATOM 0 HB2 LYS A 59 22.313 0.873 5.962 1.00 0.00 H new ATOM 0 HB3 LYS A 59 22.344 -0.856 6.248 1.00 0.00 H new ATOM 0 HG2 LYS A 59 21.373 -1.160 3.910 1.00 0.00 H new ATOM 0 HG3 LYS A 59 21.626 0.556 3.657 1.00 0.00 H new ATOM 0 HD2 LYS A 59 23.554 -0.551 2.760 1.00 0.00 H new ATOM 0 HD3 LYS A 59 24.071 0.211 4.252 1.00 0.00 H new ATOM 0 HE2 LYS A 59 23.800 -1.950 5.455 1.00 0.00 H new ATOM 0 HE3 LYS A 59 23.268 -2.714 3.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 25.604 -3.133 4.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 25.422 -2.209 2.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 25.937 -1.468 4.410 1.00 0.00 H new ATOM 1007 N PRO A 60 20.376 -1.866 7.788 1.00 0.00 N ATOM 1008 CA PRO A 60 20.009 -3.185 8.313 1.00 0.00 C ATOM 1009 C PRO A 60 18.517 -3.295 8.596 1.00 0.00 C ATOM 1010 O PRO A 60 17.931 -4.371 8.470 1.00 0.00 O ATOM 1011 CB PRO A 60 20.813 -3.303 9.617 1.00 0.00 C ATOM 1012 CG PRO A 60 21.871 -2.255 9.521 1.00 0.00 C ATOM 1013 CD PRO A 60 21.281 -1.147 8.698 1.00 0.00 C ATOM 0 HA PRO A 60 20.227 -3.978 7.598 1.00 0.00 H new ATOM 0 HB2 PRO A 60 20.177 -3.142 10.488 1.00 0.00 H new ATOM 0 HB3 PRO A 60 21.251 -4.296 9.721 1.00 0.00 H new ATOM 0 HG2 PRO A 60 22.157 -1.897 10.510 1.00 0.00 H new ATOM 0 HG3 PRO A 60 22.772 -2.652 9.053 1.00 0.00 H new ATOM 0 HD2 PRO A 60 20.745 -0.425 9.315 1.00 0.00 H new ATOM 0 HD3 PRO A 60 22.047 -0.595 8.154 1.00 0.00 H new ATOM 1021 N LYS A 61 17.904 -2.178 8.970 1.00 0.00 N ATOM 1022 CA LYS A 61 16.476 -2.162 9.258 1.00 0.00 C ATOM 1023 C LYS A 61 15.668 -2.321 7.977 1.00 0.00 C ATOM 1024 O LYS A 61 14.541 -2.813 8.004 1.00 0.00 O ATOM 1025 CB LYS A 61 16.074 -0.874 9.974 1.00 0.00 C ATOM 1026 CG LYS A 61 14.692 -0.946 10.608 1.00 0.00 C ATOM 1027 CD LYS A 61 13.623 -0.402 9.675 1.00 0.00 C ATOM 1028 CE LYS A 61 12.937 0.822 10.263 1.00 0.00 C ATOM 1029 NZ LYS A 61 11.754 0.452 11.087 1.00 0.00 N ATOM 0 H LYS A 61 18.370 -1.277 9.080 1.00 0.00 H new ATOM 0 HA LYS A 61 16.261 -3.003 9.917 1.00 0.00 H new ATOM 0 HB2 LYS A 61 16.810 -0.651 10.747 1.00 0.00 H new ATOM 0 HB3 LYS A 61 16.098 -0.048 9.263 1.00 0.00 H new ATOM 0 HG2 LYS A 61 14.461 -1.980 10.864 1.00 0.00 H new ATOM 0 HG3 LYS A 61 14.687 -0.379 11.539 1.00 0.00 H new ATOM 0 HD2 LYS A 61 14.073 -0.142 8.717 1.00 0.00 H new ATOM 0 HD3 LYS A 61 12.882 -1.177 9.479 1.00 0.00 H new ATOM 0 HE2 LYS A 61 13.647 1.377 10.876 1.00 0.00 H new ATOM 0 HE3 LYS A 61 12.625 1.486 9.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 11.314 1.313 11.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.065 -0.056 10.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 12.055 -0.161 11.871 1.00 0.00 H new ATOM 1043 N ILE A 62 16.249 -1.920 6.845 1.00 0.00 N ATOM 1044 CA ILE A 62 15.566 -2.053 5.564 1.00 0.00 C ATOM 1045 C ILE A 62 15.097 -3.494 5.389 1.00 0.00 C ATOM 1046 O ILE A 62 14.066 -3.757 4.768 1.00 0.00 O ATOM 1047 CB ILE A 62 16.474 -1.632 4.383 1.00 0.00 C ATOM 1048 CG1 ILE A 62 16.453 -0.110 4.215 1.00 0.00 C ATOM 1049 CG2 ILE A 62 16.045 -2.310 3.085 1.00 0.00 C ATOM 1050 CD1 ILE A 62 16.655 0.646 5.511 1.00 0.00 C ATOM 0 H ILE A 62 17.180 -1.506 6.792 1.00 0.00 H new ATOM 0 HA ILE A 62 14.706 -1.384 5.563 1.00 0.00 H new ATOM 0 HB ILE A 62 17.491 -1.952 4.611 1.00 0.00 H new ATOM 0 HG12 ILE A 62 17.232 0.180 3.510 1.00 0.00 H new ATOM 0 HG13 ILE A 62 15.500 0.186 3.777 1.00 0.00 H new ATOM 0 HG21 ILE A 62 16.702 -1.994 2.275 1.00 0.00 H new ATOM 0 HG22 ILE A 62 16.108 -3.392 3.202 1.00 0.00 H new ATOM 0 HG23 ILE A 62 15.018 -2.029 2.850 1.00 0.00 H new ATOM 0 HD11 ILE A 62 16.628 1.718 5.315 1.00 0.00 H new ATOM 0 HD12 ILE A 62 15.862 0.385 6.212 1.00 0.00 H new ATOM 0 HD13 ILE A 62 17.621 0.380 5.941 1.00 0.00 H new ATOM 1062 N ASP A 63 15.846 -4.420 5.983 1.00 0.00 N ATOM 1063 CA ASP A 63 15.493 -5.822 5.939 1.00 0.00 C ATOM 1064 C ASP A 63 14.222 -6.012 6.747 1.00 0.00 C ATOM 1065 O ASP A 63 13.300 -6.712 6.330 1.00 0.00 O ATOM 1066 CB ASP A 63 16.629 -6.678 6.507 1.00 0.00 C ATOM 1067 CG ASP A 63 17.053 -7.780 5.557 1.00 0.00 C ATOM 1068 OD1 ASP A 63 17.666 -7.462 4.516 1.00 0.00 O ATOM 1069 OD2 ASP A 63 16.772 -8.961 5.854 1.00 0.00 O ATOM 0 H ASP A 63 16.702 -4.216 6.500 1.00 0.00 H new ATOM 0 HA ASP A 63 15.329 -6.137 4.908 1.00 0.00 H new ATOM 0 HB2 ASP A 63 17.486 -6.041 6.726 1.00 0.00 H new ATOM 0 HB3 ASP A 63 16.311 -7.119 7.452 1.00 0.00 H new ATOM 1074 N GLU A 64 14.175 -5.338 7.896 1.00 0.00 N ATOM 1075 CA GLU A 64 13.013 -5.380 8.766 1.00 0.00 C ATOM 1076 C GLU A 64 11.788 -4.899 8.002 1.00 0.00 C ATOM 1077 O GLU A 64 10.712 -5.486 8.093 1.00 0.00 O ATOM 1078 CB GLU A 64 13.239 -4.512 10.007 1.00 0.00 C ATOM 1079 CG GLU A 64 13.479 -5.313 11.276 1.00 0.00 C ATOM 1080 CD GLU A 64 13.596 -4.435 12.506 1.00 0.00 C ATOM 1081 OE1 GLU A 64 12.768 -4.590 13.428 1.00 0.00 O ATOM 1082 OE2 GLU A 64 14.518 -3.592 12.548 1.00 0.00 O ATOM 0 H GLU A 64 14.937 -4.754 8.242 1.00 0.00 H new ATOM 0 HA GLU A 64 12.852 -6.407 9.093 1.00 0.00 H new ATOM 0 HB2 GLU A 64 14.094 -3.859 9.832 1.00 0.00 H new ATOM 0 HB3 GLU A 64 12.371 -3.868 10.153 1.00 0.00 H new ATOM 0 HG2 GLU A 64 12.661 -6.020 11.415 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.391 -5.899 11.164 1.00 0.00 H new ATOM 1089 N ILE A 65 11.974 -3.836 7.227 1.00 0.00 N ATOM 1090 CA ILE A 65 10.901 -3.274 6.418 1.00 0.00 C ATOM 1091 C ILE A 65 10.338 -4.333 5.477 1.00 0.00 C ATOM 1092 O ILE A 65 9.129 -4.403 5.250 1.00 0.00 O ATOM 1093 CB ILE A 65 11.401 -2.077 5.578 1.00 0.00 C ATOM 1094 CG1 ILE A 65 12.088 -1.042 6.473 1.00 0.00 C ATOM 1095 CG2 ILE A 65 10.247 -1.442 4.812 1.00 0.00 C ATOM 1096 CD1 ILE A 65 11.147 -0.377 7.451 1.00 0.00 C ATOM 0 H ILE A 65 12.864 -3.344 7.143 1.00 0.00 H new ATOM 0 HA ILE A 65 10.123 -2.930 7.100 1.00 0.00 H new ATOM 0 HB ILE A 65 12.131 -2.444 4.856 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.892 -1.527 7.026 1.00 0.00 H new ATOM 0 HG13 ILE A 65 12.548 -0.278 5.846 1.00 0.00 H new ATOM 0 HG21 ILE A 65 10.618 -0.601 4.226 1.00 0.00 H new ATOM 0 HG22 ILE A 65 9.803 -2.181 4.145 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.493 -1.089 5.516 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.699 0.344 8.054 1.00 0.00 H new ATOM 0 HD12 ILE A 65 10.357 0.137 6.904 1.00 0.00 H new ATOM 0 HD13 ILE A 65 10.706 -1.132 8.102 1.00 0.00 H new ATOM 1108 N SER A 66 11.230 -5.154 4.931 1.00 0.00 N ATOM 1109 CA SER A 66 10.839 -6.214 4.008 1.00 0.00 C ATOM 1110 C SER A 66 10.269 -7.419 4.751 1.00 0.00 C ATOM 1111 O SER A 66 9.158 -7.864 4.462 1.00 0.00 O ATOM 1112 CB SER A 66 12.035 -6.646 3.159 1.00 0.00 C ATOM 1113 OG SER A 66 12.979 -7.364 3.934 1.00 0.00 O ATOM 0 H SER A 66 12.232 -5.105 5.113 1.00 0.00 H new ATOM 0 HA SER A 66 10.060 -5.816 3.358 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.692 -7.267 2.332 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.511 -5.768 2.723 1.00 0.00 H new ATOM 0 HG SER A 66 13.236 -6.829 4.714 1.00 0.00 H new ATOM 1119 N LYS A 67 11.033 -7.953 5.702 1.00 0.00 N ATOM 1120 CA LYS A 67 10.585 -9.113 6.465 1.00 0.00 C ATOM 1121 C LYS A 67 9.319 -8.791 7.255 1.00 0.00 C ATOM 1122 O LYS A 67 8.398 -9.604 7.321 1.00 0.00 O ATOM 1123 CB LYS A 67 11.688 -9.613 7.404 1.00 0.00 C ATOM 1124 CG LYS A 67 12.443 -8.504 8.116 1.00 0.00 C ATOM 1125 CD LYS A 67 12.546 -8.765 9.611 1.00 0.00 C ATOM 1126 CE LYS A 67 13.974 -8.611 10.109 1.00 0.00 C ATOM 1127 NZ LYS A 67 14.913 -9.516 9.391 1.00 0.00 N ATOM 0 H LYS A 67 11.956 -7.604 5.960 1.00 0.00 H new ATOM 0 HA LYS A 67 10.354 -9.907 5.755 1.00 0.00 H new ATOM 0 HB2 LYS A 67 11.245 -10.273 8.149 1.00 0.00 H new ATOM 0 HB3 LYS A 67 12.396 -10.210 6.830 1.00 0.00 H new ATOM 0 HG2 LYS A 67 13.443 -8.414 7.692 1.00 0.00 H new ATOM 0 HG3 LYS A 67 11.938 -7.553 7.946 1.00 0.00 H new ATOM 0 HD2 LYS A 67 11.896 -8.073 10.147 1.00 0.00 H new ATOM 0 HD3 LYS A 67 12.190 -9.772 9.831 1.00 0.00 H new ATOM 0 HE2 LYS A 67 14.295 -7.577 9.978 1.00 0.00 H new ATOM 0 HE3 LYS A 67 14.011 -8.823 11.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 15.679 -9.803 10.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 14.400 -10.360 9.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 15.317 -9.018 8.572 1.00 0.00 H new ATOM 1141 N ARG A 68 9.267 -7.596 7.840 1.00 0.00 N ATOM 1142 CA ARG A 68 8.095 -7.181 8.604 1.00 0.00 C ATOM 1143 C ARG A 68 6.921 -6.937 7.667 1.00 0.00 C ATOM 1144 O ARG A 68 5.774 -7.216 8.008 1.00 0.00 O ATOM 1145 CB ARG A 68 8.386 -5.921 9.419 1.00 0.00 C ATOM 1146 CG ARG A 68 9.481 -6.111 10.454 1.00 0.00 C ATOM 1147 CD ARG A 68 10.108 -4.783 10.853 1.00 0.00 C ATOM 1148 NE ARG A 68 9.164 -3.919 11.561 1.00 0.00 N ATOM 1149 CZ ARG A 68 9.014 -3.905 12.883 1.00 0.00 C ATOM 1150 NH1 ARG A 68 9.731 -4.716 13.652 1.00 0.00 N ATOM 1151 NH2 ARG A 68 8.140 -3.078 13.441 1.00 0.00 N ATOM 0 H ARG A 68 10.016 -6.905 7.800 1.00 0.00 H new ATOM 0 HA ARG A 68 7.841 -7.982 9.298 1.00 0.00 H new ATOM 0 HB2 ARG A 68 8.673 -5.117 8.741 1.00 0.00 H new ATOM 0 HB3 ARG A 68 7.472 -5.603 9.922 1.00 0.00 H new ATOM 0 HG2 ARG A 68 9.068 -6.599 11.337 1.00 0.00 H new ATOM 0 HG3 ARG A 68 10.250 -6.772 10.054 1.00 0.00 H new ATOM 0 HD2 ARG A 68 10.975 -4.968 11.487 1.00 0.00 H new ATOM 0 HD3 ARG A 68 10.469 -4.271 9.961 1.00 0.00 H new ATOM 0 HE ARG A 68 8.585 -3.288 11.007 1.00 0.00 H new ATOM 0 HH11 ARG A 68 10.403 -5.357 13.230 1.00 0.00 H new ATOM 0 HH12 ARG A 68 9.609 -4.698 14.665 1.00 0.00 H new ATOM 0 HH21 ARG A 68 7.584 -2.454 12.857 1.00 0.00 H new ATOM 0 HH22 ARG A 68 8.024 -3.066 14.454 1.00 0.00 H new ATOM 1165 N PHE A 69 7.224 -6.432 6.473 1.00 0.00 N ATOM 1166 CA PHE A 69 6.197 -6.175 5.472 1.00 0.00 C ATOM 1167 C PHE A 69 5.530 -7.492 5.090 1.00 0.00 C ATOM 1168 O PHE A 69 4.321 -7.553 4.865 1.00 0.00 O ATOM 1169 CB PHE A 69 6.820 -5.487 4.247 1.00 0.00 C ATOM 1170 CG PHE A 69 6.088 -5.731 2.953 1.00 0.00 C ATOM 1171 CD1 PHE A 69 6.787 -6.035 1.796 1.00 0.00 C ATOM 1172 CD2 PHE A 69 4.706 -5.654 2.896 1.00 0.00 C ATOM 1173 CE1 PHE A 69 6.121 -6.258 0.606 1.00 0.00 C ATOM 1174 CE2 PHE A 69 4.035 -5.876 1.707 1.00 0.00 C ATOM 1175 CZ PHE A 69 4.743 -6.179 0.562 1.00 0.00 C ATOM 0 H PHE A 69 8.171 -6.194 6.178 1.00 0.00 H new ATOM 0 HA PHE A 69 5.438 -5.507 5.879 1.00 0.00 H new ATOM 0 HB2 PHE A 69 6.860 -4.413 4.430 1.00 0.00 H new ATOM 0 HB3 PHE A 69 7.849 -5.830 4.138 1.00 0.00 H new ATOM 0 HD1 PHE A 69 7.865 -6.098 1.825 1.00 0.00 H new ATOM 0 HD2 PHE A 69 4.147 -5.418 3.789 1.00 0.00 H new ATOM 0 HE1 PHE A 69 6.678 -6.494 -0.289 1.00 0.00 H new ATOM 0 HE2 PHE A 69 2.957 -5.812 1.675 1.00 0.00 H new ATOM 0 HZ PHE A 69 4.220 -6.354 -0.367 1.00 0.00 H new ATOM 1185 N PHE A 70 6.334 -8.548 5.052 1.00 0.00 N ATOM 1186 CA PHE A 70 5.847 -9.882 4.738 1.00 0.00 C ATOM 1187 C PHE A 70 5.961 -10.760 5.981 1.00 0.00 C ATOM 1188 O PHE A 70 6.844 -11.613 6.072 1.00 0.00 O ATOM 1189 CB PHE A 70 6.645 -10.492 3.583 1.00 0.00 C ATOM 1190 CG PHE A 70 6.038 -11.752 3.033 1.00 0.00 C ATOM 1191 CD1 PHE A 70 5.005 -11.694 2.110 1.00 0.00 C ATOM 1192 CD2 PHE A 70 6.501 -12.994 3.436 1.00 0.00 C ATOM 1193 CE1 PHE A 70 4.446 -12.851 1.602 1.00 0.00 C ATOM 1194 CE2 PHE A 70 5.945 -14.154 2.932 1.00 0.00 C ATOM 1195 CZ PHE A 70 4.916 -14.083 2.013 1.00 0.00 C ATOM 0 H PHE A 70 7.336 -8.503 5.237 1.00 0.00 H new ATOM 0 HA PHE A 70 4.804 -9.819 4.429 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.727 -9.758 2.781 1.00 0.00 H new ATOM 0 HB3 PHE A 70 7.658 -10.705 3.925 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.633 -10.734 1.784 1.00 0.00 H new ATOM 0 HD2 PHE A 70 7.306 -13.056 4.153 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.642 -12.792 0.884 1.00 0.00 H new ATOM 0 HE2 PHE A 70 6.315 -15.116 3.256 1.00 0.00 H new ATOM 0 HZ PHE A 70 4.480 -14.988 1.617 1.00 0.00 H new ATOM 1205 N PRO A 71 5.072 -10.545 6.965 1.00 0.00 N ATOM 1206 CA PRO A 71 5.082 -11.302 8.221 1.00 0.00 C ATOM 1207 C PRO A 71 4.621 -12.743 8.033 1.00 0.00 C ATOM 1208 O PRO A 71 3.445 -13.001 7.777 1.00 0.00 O ATOM 1209 CB PRO A 71 4.095 -10.531 9.101 1.00 0.00 C ATOM 1210 CG PRO A 71 3.163 -9.883 8.140 1.00 0.00 C ATOM 1211 CD PRO A 71 3.994 -9.537 6.935 1.00 0.00 C ATOM 0 HA PRO A 71 6.083 -11.380 8.646 1.00 0.00 H new ATOM 0 HB2 PRO A 71 3.564 -11.198 9.780 1.00 0.00 H new ATOM 0 HB3 PRO A 71 4.607 -9.792 9.717 1.00 0.00 H new ATOM 0 HG2 PRO A 71 2.347 -10.555 7.873 1.00 0.00 H new ATOM 0 HG3 PRO A 71 2.712 -8.990 8.574 1.00 0.00 H new ATOM 0 HD2 PRO A 71 3.413 -9.597 6.015 1.00 0.00 H new ATOM 0 HD3 PRO A 71 4.389 -8.523 6.997 1.00 0.00 H new ATOM 1219 N ALA A 72 5.556 -13.681 8.160 1.00 0.00 N ATOM 1220 CA ALA A 72 5.244 -15.096 8.002 1.00 0.00 C ATOM 1221 C ALA A 72 5.846 -15.922 9.133 1.00 0.00 C ATOM 1222 O ALA A 72 6.931 -15.619 9.628 1.00 0.00 O ATOM 1223 CB ALA A 72 5.744 -15.599 6.656 1.00 0.00 C ATOM 0 H ALA A 72 6.534 -13.486 8.372 1.00 0.00 H new ATOM 0 HA ALA A 72 4.161 -15.210 8.042 1.00 0.00 H new ATOM 0 HB1 ALA A 72 5.504 -16.657 6.551 1.00 0.00 H new ATOM 0 HB2 ALA A 72 5.262 -15.037 5.856 1.00 0.00 H new ATOM 0 HB3 ALA A 72 6.824 -15.464 6.595 1.00 0.00 H new ATOM 1229 N LYS A 73 5.133 -16.968 9.537 1.00 0.00 N ATOM 1230 CA LYS A 73 5.595 -17.842 10.610 1.00 0.00 C ATOM 1231 C LYS A 73 5.974 -19.216 10.067 1.00 0.00 C ATOM 1232 O LYS A 73 5.468 -19.585 8.987 1.00 0.00 O ATOM 1233 CB LYS A 73 4.513 -17.985 11.681 1.00 0.00 C ATOM 1234 CG LYS A 73 5.065 -18.103 13.092 1.00 0.00 C ATOM 1235 CD LYS A 73 5.053 -16.761 13.807 1.00 0.00 C ATOM 1236 CE LYS A 73 6.424 -16.106 13.783 1.00 0.00 C ATOM 1237 NZ LYS A 73 6.583 -15.109 14.878 1.00 0.00 N ATOM 1238 OXT LYS A 73 6.776 -19.912 10.726 1.00 0.00 O ATOM 0 H LYS A 73 4.232 -17.232 9.137 1.00 0.00 H new ATOM 0 HA LYS A 73 6.481 -17.391 11.057 1.00 0.00 H new ATOM 0 HB2 LYS A 73 3.848 -17.123 11.631 1.00 0.00 H new ATOM 0 HB3 LYS A 73 3.910 -18.866 11.461 1.00 0.00 H new ATOM 0 HG2 LYS A 73 4.473 -18.823 13.657 1.00 0.00 H new ATOM 0 HG3 LYS A 73 6.084 -18.488 13.055 1.00 0.00 H new ATOM 0 HD2 LYS A 73 4.325 -16.102 13.334 1.00 0.00 H new ATOM 0 HD3 LYS A 73 4.733 -16.900 14.840 1.00 0.00 H new ATOM 0 HE2 LYS A 73 7.194 -16.872 13.875 1.00 0.00 H new ATOM 0 HE3 LYS A 73 6.575 -15.616 12.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 7.531 -14.685 14.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 5.865 -14.364 14.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 6.464 -15.581 15.797 1.00 0.00 H new TER 1252 LYS A 73 ATOM 1253 N MET B 1 -3.344 -25.156 -5.124 1.00 0.00 N ATOM 1254 CA MET B 1 -3.084 -23.766 -4.668 1.00 0.00 C ATOM 1255 C MET B 1 -1.862 -23.175 -5.364 1.00 0.00 C ATOM 1256 O MET B 1 -0.740 -23.288 -4.872 1.00 0.00 O ATOM 1257 CB MET B 1 -2.871 -23.781 -3.153 1.00 0.00 C ATOM 1258 CG MET B 1 -2.584 -22.409 -2.564 1.00 0.00 C ATOM 1259 SD MET B 1 -2.131 -22.485 -0.820 1.00 0.00 S ATOM 1260 CE MET B 1 -2.199 -20.751 -0.376 1.00 0.00 C ATOM 0 H1 MET B 1 -4.181 -25.531 -4.634 1.00 0.00 H new ATOM 0 H2 MET B 1 -3.514 -25.159 -6.150 1.00 0.00 H new ATOM 0 H3 MET B 1 -2.520 -25.752 -4.908 1.00 0.00 H new ATOM 0 HA MET B 1 -3.941 -23.142 -4.922 1.00 0.00 H new ATOM 0 HB2 MET B 1 -3.759 -24.194 -2.674 1.00 0.00 H new ATOM 0 HB3 MET B 1 -2.042 -24.449 -2.918 1.00 0.00 H new ATOM 0 HG2 MET B 1 -1.777 -21.938 -3.125 1.00 0.00 H new ATOM 0 HG3 MET B 1 -3.464 -21.776 -2.680 1.00 0.00 H new ATOM 0 HE1 MET B 1 -1.942 -20.635 0.677 1.00 0.00 H new ATOM 0 HE2 MET B 1 -1.490 -20.191 -0.986 1.00 0.00 H new ATOM 0 HE3 MET B 1 -3.206 -20.371 -0.548 1.00 0.00 H new ATOM 1272 N VAL B 2 -2.088 -22.545 -6.512 1.00 0.00 N ATOM 1273 CA VAL B 2 -1.005 -21.936 -7.275 1.00 0.00 C ATOM 1274 C VAL B 2 -0.299 -20.858 -6.459 1.00 0.00 C ATOM 1275 O VAL B 2 -0.643 -19.680 -6.542 1.00 0.00 O ATOM 1276 CB VAL B 2 -1.522 -21.317 -8.588 1.00 0.00 C ATOM 1277 CG1 VAL B 2 -0.364 -20.811 -9.435 1.00 0.00 C ATOM 1278 CG2 VAL B 2 -2.360 -22.323 -9.364 1.00 0.00 C ATOM 0 H VAL B 2 -3.011 -22.443 -6.934 1.00 0.00 H new ATOM 0 HA VAL B 2 -0.297 -22.730 -7.512 1.00 0.00 H new ATOM 0 HB VAL B 2 -2.158 -20.467 -8.338 1.00 0.00 H new ATOM 0 HG11 VAL B 2 -0.750 -20.378 -10.358 1.00 0.00 H new ATOM 0 HG12 VAL B 2 0.188 -20.052 -8.881 1.00 0.00 H new ATOM 0 HG13 VAL B 2 0.301 -21.641 -9.674 1.00 0.00 H new ATOM 0 HG21 VAL B 2 -2.715 -21.865 -10.287 1.00 0.00 H new ATOM 0 HG22 VAL B 2 -1.752 -23.196 -9.602 1.00 0.00 H new ATOM 0 HG23 VAL B 2 -3.214 -22.629 -8.759 1.00 0.00 H new ATOM 1288 N GLU B 3 0.690 -21.270 -5.672 1.00 0.00 N ATOM 1289 CA GLU B 3 1.446 -20.339 -4.840 1.00 0.00 C ATOM 1290 C GLU B 3 2.079 -19.241 -5.691 1.00 0.00 C ATOM 1291 O GLU B 3 2.891 -19.517 -6.573 1.00 0.00 O ATOM 1292 CB GLU B 3 2.528 -21.087 -4.056 1.00 0.00 C ATOM 1293 CG GLU B 3 2.402 -20.932 -2.549 1.00 0.00 C ATOM 1294 CD GLU B 3 3.178 -21.992 -1.789 1.00 0.00 C ATOM 1295 OE1 GLU B 3 2.550 -22.745 -1.016 1.00 0.00 O ATOM 1296 OE2 GLU B 3 4.411 -22.068 -1.969 1.00 0.00 O ATOM 0 H GLU B 3 0.987 -22.243 -5.593 1.00 0.00 H new ATOM 0 HA GLU B 3 0.756 -19.873 -4.136 1.00 0.00 H new ATOM 0 HB2 GLU B 3 2.482 -22.146 -4.309 1.00 0.00 H new ATOM 0 HB3 GLU B 3 3.508 -20.726 -4.370 1.00 0.00 H new ATOM 0 HG2 GLU B 3 2.760 -19.945 -2.257 1.00 0.00 H new ATOM 0 HG3 GLU B 3 1.350 -20.985 -2.268 1.00 0.00 H new ATOM 1303 N SER B 4 1.701 -17.996 -5.420 1.00 0.00 N ATOM 1304 CA SER B 4 2.231 -16.856 -6.162 1.00 0.00 C ATOM 1305 C SER B 4 1.770 -16.896 -7.616 1.00 0.00 C ATOM 1306 O SER B 4 1.357 -17.941 -8.117 1.00 0.00 O ATOM 1307 CB SER B 4 3.760 -16.838 -6.096 1.00 0.00 C ATOM 1308 OG SER B 4 4.240 -15.556 -5.725 1.00 0.00 O ATOM 0 H SER B 4 1.030 -17.750 -4.692 1.00 0.00 H new ATOM 0 HA SER B 4 1.849 -15.945 -5.702 1.00 0.00 H new ATOM 0 HB2 SER B 4 4.105 -17.581 -5.377 1.00 0.00 H new ATOM 0 HB3 SER B 4 4.172 -17.118 -7.066 1.00 0.00 H new ATOM 0 HG SER B 4 5.219 -15.571 -5.688 1.00 0.00 H new ATOM 1314 N LYS B 5 1.838 -15.750 -8.286 1.00 0.00 N ATOM 1315 CA LYS B 5 1.423 -15.653 -9.682 1.00 0.00 C ATOM 1316 C LYS B 5 -0.064 -15.971 -9.837 1.00 0.00 C ATOM 1317 O LYS B 5 -0.535 -16.250 -10.940 1.00 0.00 O ATOM 1318 CB LYS B 5 2.253 -16.600 -10.550 1.00 0.00 C ATOM 1319 CG LYS B 5 2.547 -16.056 -11.938 1.00 0.00 C ATOM 1320 CD LYS B 5 3.034 -17.150 -12.874 1.00 0.00 C ATOM 1321 CE LYS B 5 1.881 -17.995 -13.391 1.00 0.00 C ATOM 1322 NZ LYS B 5 1.427 -17.552 -14.739 1.00 0.00 N ATOM 0 H LYS B 5 2.176 -14.875 -7.885 1.00 0.00 H new ATOM 0 HA LYS B 5 1.590 -14.628 -10.012 1.00 0.00 H new ATOM 0 HB2 LYS B 5 3.196 -16.810 -10.044 1.00 0.00 H new ATOM 0 HB3 LYS B 5 1.724 -17.548 -10.645 1.00 0.00 H new ATOM 0 HG2 LYS B 5 1.647 -15.599 -12.349 1.00 0.00 H new ATOM 0 HG3 LYS B 5 3.301 -15.272 -11.870 1.00 0.00 H new ATOM 0 HD2 LYS B 5 3.564 -16.702 -13.715 1.00 0.00 H new ATOM 0 HD3 LYS B 5 3.747 -17.787 -12.351 1.00 0.00 H new ATOM 0 HE2 LYS B 5 2.189 -19.040 -13.437 1.00 0.00 H new ATOM 0 HE3 LYS B 5 1.048 -17.939 -12.691 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 0.640 -18.154 -15.055 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 1.109 -16.563 -14.691 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 2.215 -17.630 -15.414 1.00 0.00 H new ATOM 1336 N LYS B 6 -0.797 -15.926 -8.727 1.00 0.00 N ATOM 1337 CA LYS B 6 -2.229 -16.208 -8.736 1.00 0.00 C ATOM 1338 C LYS B 6 -2.796 -16.127 -7.324 1.00 0.00 C ATOM 1339 O LYS B 6 -3.731 -15.372 -7.059 1.00 0.00 O ATOM 1340 CB LYS B 6 -2.501 -17.593 -9.327 1.00 0.00 C ATOM 1341 CG LYS B 6 -3.771 -17.660 -10.161 1.00 0.00 C ATOM 1342 CD LYS B 6 -4.013 -19.063 -10.694 1.00 0.00 C ATOM 1343 CE LYS B 6 -4.950 -19.848 -9.791 1.00 0.00 C ATOM 1344 NZ LYS B 6 -5.729 -20.866 -10.549 1.00 0.00 N ATOM 0 H LYS B 6 -0.421 -15.696 -7.807 1.00 0.00 H new ATOM 0 HA LYS B 6 -2.719 -15.459 -9.358 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -1.654 -17.887 -9.946 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -2.570 -18.318 -8.516 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -4.622 -17.348 -9.556 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -3.698 -16.961 -10.994 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -4.437 -19.004 -11.697 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -3.063 -19.590 -10.780 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -4.372 -20.341 -9.009 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -5.636 -19.161 -9.295 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -6.356 -21.380 -9.897 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -6.300 -20.394 -11.278 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -5.076 -21.537 -11.002 1.00 0.00 H new ATOM 1358 N ILE B 7 -2.218 -16.909 -6.417 1.00 0.00 N ATOM 1359 CA ILE B 7 -2.658 -16.925 -5.028 1.00 0.00 C ATOM 1360 C ILE B 7 -1.662 -16.195 -4.134 1.00 0.00 C ATOM 1361 O ILE B 7 -0.475 -16.113 -4.450 1.00 0.00 O ATOM 1362 CB ILE B 7 -2.838 -18.365 -4.511 1.00 0.00 C ATOM 1363 CG1 ILE B 7 -3.695 -19.178 -5.483 1.00 0.00 C ATOM 1364 CG2 ILE B 7 -3.464 -18.355 -3.125 1.00 0.00 C ATOM 1365 CD1 ILE B 7 -3.923 -20.607 -5.040 1.00 0.00 C ATOM 0 H ILE B 7 -1.443 -17.540 -6.621 1.00 0.00 H new ATOM 0 HA ILE B 7 -3.620 -16.414 -4.992 1.00 0.00 H new ATOM 0 HB ILE B 7 -1.857 -18.835 -4.443 1.00 0.00 H new ATOM 0 HG12 ILE B 7 -4.660 -18.685 -5.603 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -3.215 -19.182 -6.462 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -3.585 -19.379 -2.773 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -2.818 -17.809 -2.438 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -4.439 -17.869 -3.170 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -4.538 -21.123 -5.777 1.00 0.00 H new ATOM 0 HD12 ILE B 7 -2.964 -21.117 -4.947 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -4.431 -20.612 -4.076 1.00 0.00 H new ATOM 1377 N ALA B 8 -2.156 -15.662 -3.017 1.00 0.00 N ATOM 1378 CA ALA B 8 -1.319 -14.928 -2.063 1.00 0.00 C ATOM 1379 C ALA B 8 -1.049 -13.505 -2.518 1.00 0.00 C ATOM 1380 O ALA B 8 -0.423 -12.714 -1.811 1.00 0.00 O ATOM 1381 CB ALA B 8 -0.008 -15.651 -1.843 1.00 0.00 C ATOM 0 H ALA B 8 -3.138 -15.725 -2.748 1.00 0.00 H new ATOM 0 HA ALA B 8 -1.871 -14.880 -1.124 1.00 0.00 H new ATOM 0 HB1 ALA B 8 0.601 -15.092 -1.132 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -0.204 -16.648 -1.448 1.00 0.00 H new ATOM 0 HB3 ALA B 8 0.525 -15.734 -2.790 1.00 0.00 H new ATOM 1387 N LYS B 9 -1.523 -13.199 -3.700 1.00 0.00 N ATOM 1388 CA LYS B 9 -1.353 -11.878 -4.293 1.00 0.00 C ATOM 1389 C LYS B 9 -2.260 -11.709 -5.506 1.00 0.00 C ATOM 1390 O LYS B 9 -2.549 -12.672 -6.216 1.00 0.00 O ATOM 1391 CB LYS B 9 0.105 -11.672 -4.702 1.00 0.00 C ATOM 1392 CG LYS B 9 0.882 -10.780 -3.750 1.00 0.00 C ATOM 1393 CD LYS B 9 1.933 -11.563 -2.981 1.00 0.00 C ATOM 1394 CE LYS B 9 2.231 -10.919 -1.638 1.00 0.00 C ATOM 1395 NZ LYS B 9 3.603 -11.243 -1.159 1.00 0.00 N ATOM 0 H LYS B 9 -2.040 -13.854 -4.287 1.00 0.00 H new ATOM 0 HA LYS B 9 -1.627 -11.130 -3.549 1.00 0.00 H new ATOM 0 HB2 LYS B 9 0.598 -12.642 -4.761 1.00 0.00 H new ATOM 0 HB3 LYS B 9 0.136 -11.237 -5.701 1.00 0.00 H new ATOM 0 HG2 LYS B 9 1.363 -9.979 -4.312 1.00 0.00 H new ATOM 0 HG3 LYS B 9 0.193 -10.308 -3.049 1.00 0.00 H new ATOM 0 HD2 LYS B 9 1.587 -12.585 -2.827 1.00 0.00 H new ATOM 0 HD3 LYS B 9 2.849 -11.621 -3.570 1.00 0.00 H new ATOM 0 HE2 LYS B 9 2.122 -9.838 -1.722 1.00 0.00 H new ATOM 0 HE3 LYS B 9 1.501 -11.257 -0.903 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 3.635 -11.171 -0.122 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 3.851 -12.211 -1.446 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 4.283 -10.574 -1.574 1.00 0.00 H new ATOM 1409 N LYS B 10 -2.708 -10.482 -5.734 1.00 0.00 N ATOM 1410 CA LYS B 10 -3.586 -10.190 -6.861 1.00 0.00 C ATOM 1411 C LYS B 10 -2.991 -9.107 -7.756 1.00 0.00 C ATOM 1412 O LYS B 10 -2.431 -8.130 -7.270 1.00 0.00 O ATOM 1413 CB LYS B 10 -4.946 -9.728 -6.346 1.00 0.00 C ATOM 1414 CG LYS B 10 -5.776 -10.830 -5.709 1.00 0.00 C ATOM 1415 CD LYS B 10 -6.503 -10.331 -4.467 1.00 0.00 C ATOM 1416 CE LYS B 10 -7.898 -10.927 -4.358 1.00 0.00 C ATOM 1417 NZ LYS B 10 -8.956 -9.917 -4.637 1.00 0.00 N ATOM 0 H LYS B 10 -2.479 -9.674 -5.155 1.00 0.00 H new ATOM 0 HA LYS B 10 -3.699 -11.101 -7.449 1.00 0.00 H new ATOM 0 HB2 LYS B 10 -4.795 -8.933 -5.615 1.00 0.00 H new ATOM 0 HB3 LYS B 10 -5.509 -9.297 -7.174 1.00 0.00 H new ATOM 0 HG2 LYS B 10 -6.501 -11.205 -6.431 1.00 0.00 H new ATOM 0 HG3 LYS B 10 -5.130 -11.667 -5.443 1.00 0.00 H new ATOM 0 HD2 LYS B 10 -5.926 -10.589 -3.579 1.00 0.00 H new ATOM 0 HD3 LYS B 10 -6.573 -9.244 -4.498 1.00 0.00 H new ATOM 0 HE2 LYS B 10 -7.994 -11.757 -5.058 1.00 0.00 H new ATOM 0 HE3 LYS B 10 -8.041 -11.336 -3.358 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 -9.892 -10.362 -4.553 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 -8.881 -9.137 -3.953 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 -8.835 -9.545 -5.601 1.00 0.00 H new ATOM 1431 N LYS B 11 -3.124 -9.267 -9.068 1.00 0.00 N ATOM 1432 CA LYS B 11 -2.602 -8.270 -9.994 1.00 0.00 C ATOM 1433 C LYS B 11 -3.432 -6.997 -9.906 1.00 0.00 C ATOM 1434 O LYS B 11 -4.574 -6.956 -10.361 1.00 0.00 O ATOM 1435 CB LYS B 11 -2.607 -8.800 -11.426 1.00 0.00 C ATOM 1436 CG LYS B 11 -1.893 -10.134 -11.584 1.00 0.00 C ATOM 1437 CD LYS B 11 -2.852 -11.305 -11.432 1.00 0.00 C ATOM 1438 CE LYS B 11 -2.511 -12.154 -10.217 1.00 0.00 C ATOM 1439 NZ LYS B 11 -1.672 -13.330 -10.578 1.00 0.00 N ATOM 0 H LYS B 11 -3.582 -10.065 -9.509 1.00 0.00 H new ATOM 0 HA LYS B 11 -1.572 -8.048 -9.716 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -3.639 -8.908 -11.761 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -2.135 -8.065 -12.078 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -1.416 -10.178 -12.563 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -1.100 -10.213 -10.840 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -3.872 -10.931 -11.341 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -2.818 -11.923 -12.329 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -1.984 -11.543 -9.484 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -3.431 -12.496 -9.744 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -1.147 -13.652 -9.740 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -2.282 -14.099 -10.921 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -1.001 -13.061 -11.325 1.00 0.00 H new ATOM 1453 N THR B 12 -2.853 -5.963 -9.310 1.00 0.00 N ATOM 1454 CA THR B 12 -3.545 -4.692 -9.152 1.00 0.00 C ATOM 1455 C THR B 12 -2.945 -3.628 -10.064 1.00 0.00 C ATOM 1456 O THR B 12 -1.732 -3.580 -10.253 1.00 0.00 O ATOM 1457 CB THR B 12 -3.478 -4.230 -7.694 1.00 0.00 C ATOM 1458 OG1 THR B 12 -4.264 -3.068 -7.498 1.00 0.00 O ATOM 1459 CG2 THR B 12 -2.073 -3.918 -7.223 1.00 0.00 C ATOM 0 H THR B 12 -1.907 -5.980 -8.929 1.00 0.00 H new ATOM 0 HA THR B 12 -4.588 -4.837 -9.433 1.00 0.00 H new ATOM 0 HB THR B 12 -3.859 -5.069 -7.112 1.00 0.00 H new ATOM 0 HG1 THR B 12 -4.440 -2.950 -6.541 1.00 0.00 H new ATOM 0 HG21 THR B 12 -2.101 -3.597 -6.182 1.00 0.00 H new ATOM 0 HG22 THR B 12 -1.453 -4.810 -7.311 1.00 0.00 H new ATOM 0 HG23 THR B 12 -1.652 -3.122 -7.837 1.00 0.00 H new ATOM 1467 N THR B 13 -3.792 -2.773 -10.626 1.00 0.00 N ATOM 1468 CA THR B 13 -3.309 -1.717 -11.507 1.00 0.00 C ATOM 1469 C THR B 13 -3.280 -0.377 -10.799 1.00 0.00 C ATOM 1470 O THR B 13 -4.299 0.105 -10.305 1.00 0.00 O ATOM 1471 CB THR B 13 -4.164 -1.591 -12.763 1.00 0.00 C ATOM 1472 OG1 THR B 13 -4.540 -2.864 -13.258 1.00 0.00 O ATOM 1473 CG2 THR B 13 -3.454 -0.847 -13.871 1.00 0.00 C ATOM 0 H THR B 13 -4.803 -2.789 -10.490 1.00 0.00 H new ATOM 0 HA THR B 13 -2.296 -1.998 -11.794 1.00 0.00 H new ATOM 0 HB THR B 13 -5.047 -1.026 -12.465 1.00 0.00 H new ATOM 0 HG1 THR B 13 -5.089 -2.753 -14.062 1.00 0.00 H new ATOM 0 HG21 THR B 13 -4.105 -0.785 -14.743 1.00 0.00 H new ATOM 0 HG22 THR B 13 -3.204 0.158 -13.532 1.00 0.00 H new ATOM 0 HG23 THR B 13 -2.540 -1.378 -14.138 1.00 0.00 H new ATOM 1481 N LEU B 14 -2.108 0.231 -10.782 1.00 0.00 N ATOM 1482 CA LEU B 14 -1.937 1.532 -10.169 1.00 0.00 C ATOM 1483 C LEU B 14 -1.915 2.594 -11.252 1.00 0.00 C ATOM 1484 O LEU B 14 -1.994 2.270 -12.436 1.00 0.00 O ATOM 1485 CB LEU B 14 -0.645 1.575 -9.348 1.00 0.00 C ATOM 1486 CG LEU B 14 -0.836 1.805 -7.851 1.00 0.00 C ATOM 1487 CD1 LEU B 14 -1.345 3.213 -7.590 1.00 0.00 C ATOM 1488 CD2 LEU B 14 -1.794 0.777 -7.269 1.00 0.00 C ATOM 0 H LEU B 14 -1.258 -0.159 -11.188 1.00 0.00 H new ATOM 0 HA LEU B 14 -2.770 1.723 -9.493 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -0.111 0.635 -9.490 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -0.008 2.366 -9.743 1.00 0.00 H new ATOM 0 HG LEU B 14 0.131 1.690 -7.360 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -1.476 3.360 -6.518 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -0.624 3.937 -7.970 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -2.301 3.354 -8.095 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -1.917 0.958 -6.201 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -2.761 0.859 -7.765 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -1.391 -0.224 -7.423 1.00 0.00 H new ATOM 1500 N ALA B 15 -1.812 3.856 -10.860 1.00 0.00 N ATOM 1501 CA ALA B 15 -1.782 4.932 -11.836 1.00 0.00 C ATOM 1502 C ALA B 15 -0.767 6.001 -11.454 1.00 0.00 C ATOM 1503 O ALA B 15 -1.124 7.055 -10.933 1.00 0.00 O ATOM 1504 CB ALA B 15 -3.166 5.539 -12.005 1.00 0.00 C ATOM 0 H ALA B 15 -1.749 4.156 -9.887 1.00 0.00 H new ATOM 0 HA ALA B 15 -1.471 4.508 -12.791 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -3.123 6.343 -12.740 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -3.861 4.772 -12.347 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -3.507 5.938 -11.050 1.00 0.00 H new ATOM 1510 N PHE B 16 0.497 5.710 -11.731 1.00 0.00 N ATOM 1511 CA PHE B 16 1.607 6.612 -11.438 1.00 0.00 C ATOM 1512 C PHE B 16 2.886 6.006 -11.963 1.00 0.00 C ATOM 1513 O PHE B 16 2.892 4.892 -12.462 1.00 0.00 O ATOM 1514 CB PHE B 16 1.758 6.885 -9.937 1.00 0.00 C ATOM 1515 CG PHE B 16 0.817 7.929 -9.403 1.00 0.00 C ATOM 1516 CD1 PHE B 16 0.929 9.250 -9.805 1.00 0.00 C ATOM 1517 CD2 PHE B 16 -0.176 7.589 -8.499 1.00 0.00 C ATOM 1518 CE1 PHE B 16 0.067 10.212 -9.314 1.00 0.00 C ATOM 1519 CE2 PHE B 16 -1.041 8.547 -8.005 1.00 0.00 C ATOM 1520 CZ PHE B 16 -0.918 9.861 -8.414 1.00 0.00 C ATOM 0 H PHE B 16 0.785 4.835 -12.169 1.00 0.00 H new ATOM 0 HA PHE B 16 1.397 7.564 -11.925 1.00 0.00 H new ATOM 0 HB2 PHE B 16 1.598 5.955 -9.392 1.00 0.00 H new ATOM 0 HB3 PHE B 16 2.783 7.199 -9.737 1.00 0.00 H new ATOM 0 HD1 PHE B 16 1.698 9.531 -10.509 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -0.275 6.563 -8.176 1.00 0.00 H new ATOM 0 HE1 PHE B 16 0.164 11.239 -9.635 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -1.811 8.269 -7.301 1.00 0.00 H new ATOM 0 HZ PHE B 16 -1.592 10.612 -8.030 1.00 0.00 H new ATOM 1530 N ASP B 17 3.959 6.752 -11.866 1.00 0.00 N ATOM 1531 CA ASP B 17 5.255 6.296 -12.334 1.00 0.00 C ATOM 1532 C ASP B 17 6.178 7.472 -12.438 1.00 0.00 C ATOM 1533 O ASP B 17 7.370 7.368 -12.176 1.00 0.00 O ATOM 1534 CB ASP B 17 5.154 5.600 -13.686 1.00 0.00 C ATOM 1535 CG ASP B 17 5.210 4.088 -13.570 1.00 0.00 C ATOM 1536 OD1 ASP B 17 5.274 3.415 -14.619 1.00 0.00 O ATOM 1537 OD2 ASP B 17 5.191 3.577 -12.430 1.00 0.00 O ATOM 0 H ASP B 17 3.964 7.689 -11.463 1.00 0.00 H new ATOM 0 HA ASP B 17 5.643 5.571 -11.618 1.00 0.00 H new ATOM 0 HB2 ASP B 17 4.221 5.889 -14.170 1.00 0.00 H new ATOM 0 HB3 ASP B 17 5.966 5.942 -14.328 1.00 0.00 H new ATOM 1542 N GLU B 18 5.629 8.609 -12.807 1.00 0.00 N ATOM 1543 CA GLU B 18 6.448 9.790 -12.921 1.00 0.00 C ATOM 1544 C GLU B 18 7.304 9.934 -11.660 1.00 0.00 C ATOM 1545 O GLU B 18 8.537 9.839 -11.704 1.00 0.00 O ATOM 1546 CB GLU B 18 5.588 11.041 -13.133 1.00 0.00 C ATOM 1547 CG GLU B 18 6.322 12.350 -12.876 1.00 0.00 C ATOM 1548 CD GLU B 18 6.237 12.791 -11.428 1.00 0.00 C ATOM 1549 OE1 GLU B 18 7.193 13.434 -10.947 1.00 0.00 O ATOM 1550 OE2 GLU B 18 5.215 12.495 -10.775 1.00 0.00 O ATOM 0 H GLU B 18 4.642 8.738 -13.028 1.00 0.00 H new ATOM 0 HA GLU B 18 7.097 9.686 -13.791 1.00 0.00 H new ATOM 0 HB2 GLU B 18 5.213 11.042 -14.156 1.00 0.00 H new ATOM 0 HB3 GLU B 18 4.720 10.988 -12.476 1.00 0.00 H new ATOM 0 HG2 GLU B 18 7.369 12.236 -13.157 1.00 0.00 H new ATOM 0 HG3 GLU B 18 5.904 13.128 -13.514 1.00 0.00 H new ATOM 1557 N ASP B 19 6.632 10.127 -10.529 1.00 0.00 N ATOM 1558 CA ASP B 19 7.318 10.270 -9.252 1.00 0.00 C ATOM 1559 C ASP B 19 7.611 8.920 -8.616 1.00 0.00 C ATOM 1560 O ASP B 19 8.720 8.685 -8.138 1.00 0.00 O ATOM 1561 CB ASP B 19 6.489 11.130 -8.296 1.00 0.00 C ATOM 1562 CG ASP B 19 7.224 11.432 -7.005 1.00 0.00 C ATOM 1563 OD1 ASP B 19 7.008 10.702 -6.015 1.00 0.00 O ATOM 1564 OD2 ASP B 19 8.015 12.398 -6.983 1.00 0.00 O ATOM 0 H ASP B 19 5.615 10.188 -10.472 1.00 0.00 H new ATOM 0 HA ASP B 19 8.271 10.762 -9.445 1.00 0.00 H new ATOM 0 HB2 ASP B 19 6.226 12.066 -8.789 1.00 0.00 H new ATOM 0 HB3 ASP B 19 5.555 10.617 -8.068 1.00 0.00 H new ATOM 1569 N VAL B 20 6.623 8.032 -8.600 1.00 0.00 N ATOM 1570 CA VAL B 20 6.822 6.721 -8.007 1.00 0.00 C ATOM 1571 C VAL B 20 7.896 5.943 -8.763 1.00 0.00 C ATOM 1572 O VAL B 20 8.773 5.348 -8.148 1.00 0.00 O ATOM 1573 CB VAL B 20 5.515 5.902 -7.936 1.00 0.00 C ATOM 1574 CG1 VAL B 20 4.423 6.706 -7.250 1.00 0.00 C ATOM 1575 CG2 VAL B 20 5.065 5.467 -9.315 1.00 0.00 C ATOM 0 H VAL B 20 5.692 8.194 -8.985 1.00 0.00 H new ATOM 0 HA VAL B 20 7.156 6.885 -6.983 1.00 0.00 H new ATOM 0 HB VAL B 20 5.712 5.005 -7.349 1.00 0.00 H new ATOM 0 HG11 VAL B 20 3.508 6.115 -7.208 1.00 0.00 H new ATOM 0 HG12 VAL B 20 4.739 6.959 -6.238 1.00 0.00 H new ATOM 0 HG13 VAL B 20 4.238 7.622 -7.812 1.00 0.00 H new ATOM 0 HG21 VAL B 20 4.142 4.892 -9.232 1.00 0.00 H new ATOM 0 HG22 VAL B 20 4.890 6.346 -9.935 1.00 0.00 H new ATOM 0 HG23 VAL B 20 5.838 4.849 -9.772 1.00 0.00 H new ATOM 1585 N TYR B 21 7.848 5.964 -10.097 1.00 0.00 N ATOM 1586 CA TYR B 21 8.857 5.261 -10.886 1.00 0.00 C ATOM 1587 C TYR B 21 10.229 5.880 -10.651 1.00 0.00 C ATOM 1588 O TYR B 21 11.205 5.163 -10.436 1.00 0.00 O ATOM 1589 CB TYR B 21 8.527 5.263 -12.388 1.00 0.00 C ATOM 1590 CG TYR B 21 9.175 4.130 -13.153 1.00 0.00 C ATOM 1591 CD1 TYR B 21 10.083 4.388 -14.174 1.00 0.00 C ATOM 1592 CD2 TYR B 21 8.883 2.805 -12.856 1.00 0.00 C ATOM 1593 CE1 TYR B 21 10.679 3.358 -14.876 1.00 0.00 C ATOM 1594 CE2 TYR B 21 9.476 1.770 -13.553 1.00 0.00 C ATOM 1595 CZ TYR B 21 10.373 2.051 -14.562 1.00 0.00 C ATOM 1596 OH TYR B 21 10.965 1.023 -15.259 1.00 0.00 O ATOM 0 H TYR B 21 7.136 6.450 -10.643 1.00 0.00 H new ATOM 0 HA TYR B 21 8.862 4.222 -10.556 1.00 0.00 H new ATOM 0 HB2 TYR B 21 7.446 5.203 -12.514 1.00 0.00 H new ATOM 0 HB3 TYR B 21 8.846 6.211 -12.820 1.00 0.00 H new ATOM 0 HD1 TYR B 21 10.326 5.410 -14.422 1.00 0.00 H new ATOM 0 HD2 TYR B 21 8.181 2.580 -12.067 1.00 0.00 H new ATOM 0 HE1 TYR B 21 11.381 3.576 -15.667 1.00 0.00 H new ATOM 0 HE2 TYR B 21 9.238 0.745 -13.309 1.00 0.00 H new ATOM 0 HH TYR B 21 10.642 0.165 -14.913 1.00 0.00 H new ATOM 1606 N HIS B 22 10.310 7.215 -10.678 1.00 0.00 N ATOM 1607 CA HIS B 22 11.586 7.877 -10.445 1.00 0.00 C ATOM 1608 C HIS B 22 12.046 7.652 -9.011 1.00 0.00 C ATOM 1609 O HIS B 22 13.209 7.326 -8.771 1.00 0.00 O ATOM 1610 CB HIS B 22 11.484 9.373 -10.744 1.00 0.00 C ATOM 1611 CG HIS B 22 11.870 9.731 -12.145 1.00 0.00 C ATOM 1612 ND1 HIS B 22 13.086 9.393 -12.702 1.00 0.00 N ATOM 1613 CD2 HIS B 22 11.192 10.401 -13.107 1.00 0.00 C ATOM 1614 CE1 HIS B 22 13.139 9.842 -13.944 1.00 0.00 C ATOM 1615 NE2 HIS B 22 12.003 10.456 -14.214 1.00 0.00 N ATOM 0 H HIS B 22 9.524 7.841 -10.855 1.00 0.00 H new ATOM 0 HA HIS B 22 12.324 7.444 -11.120 1.00 0.00 H new ATOM 0 HB2 HIS B 22 10.461 9.703 -10.562 1.00 0.00 H new ATOM 0 HB3 HIS B 22 12.123 9.918 -10.049 1.00 0.00 H new ATOM 0 HD2 HIS B 22 10.198 10.815 -13.020 1.00 0.00 H new ATOM 0 HE1 HIS B 22 13.971 9.726 -14.623 1.00 0.00 H new ATOM 0 HE2 HIS B 22 11.765 10.900 -15.101 1.00 0.00 H new ATOM 1624 N THR B 23 11.133 7.808 -8.058 1.00 0.00 N ATOM 1625 CA THR B 23 11.474 7.596 -6.657 1.00 0.00 C ATOM 1626 C THR B 23 11.839 6.136 -6.424 1.00 0.00 C ATOM 1627 O THR B 23 12.814 5.825 -5.736 1.00 0.00 O ATOM 1628 CB THR B 23 10.322 7.986 -5.742 1.00 0.00 C ATOM 1629 OG1 THR B 23 9.147 7.269 -6.075 1.00 0.00 O ATOM 1630 CG2 THR B 23 9.992 9.462 -5.783 1.00 0.00 C ATOM 0 H THR B 23 10.164 8.077 -8.227 1.00 0.00 H new ATOM 0 HA THR B 23 12.329 8.230 -6.421 1.00 0.00 H new ATOM 0 HB THR B 23 10.661 7.738 -4.736 1.00 0.00 H new ATOM 0 HG1 THR B 23 8.756 7.643 -6.893 1.00 0.00 H new ATOM 0 HG21 THR B 23 9.162 9.668 -5.107 1.00 0.00 H new ATOM 0 HG22 THR B 23 10.864 10.038 -5.474 1.00 0.00 H new ATOM 0 HG23 THR B 23 9.712 9.744 -6.798 1.00 0.00 H new ATOM 1638 N LEU B 24 11.064 5.236 -7.024 1.00 0.00 N ATOM 1639 CA LEU B 24 11.332 3.812 -6.897 1.00 0.00 C ATOM 1640 C LEU B 24 12.741 3.506 -7.391 1.00 0.00 C ATOM 1641 O LEU B 24 13.305 2.460 -7.077 1.00 0.00 O ATOM 1642 CB LEU B 24 10.305 2.987 -7.676 1.00 0.00 C ATOM 1643 CG LEU B 24 9.185 2.388 -6.823 1.00 0.00 C ATOM 1644 CD1 LEU B 24 9.765 1.630 -5.641 1.00 0.00 C ATOM 1645 CD2 LEU B 24 8.238 3.476 -6.338 1.00 0.00 C ATOM 0 H LEU B 24 10.253 5.468 -7.597 1.00 0.00 H new ATOM 0 HA LEU B 24 11.253 3.539 -5.845 1.00 0.00 H new ATOM 0 HB2 LEU B 24 9.859 3.619 -8.444 1.00 0.00 H new ATOM 0 HB3 LEU B 24 10.824 2.178 -8.190 1.00 0.00 H new ATOM 0 HG LEU B 24 8.621 1.691 -7.442 1.00 0.00 H new ATOM 0 HD11 LEU B 24 8.955 1.210 -5.045 1.00 0.00 H new ATOM 0 HD12 LEU B 24 10.404 0.824 -6.003 1.00 0.00 H new ATOM 0 HD13 LEU B 24 10.353 2.311 -5.026 1.00 0.00 H new ATOM 0 HD21 LEU B 24 7.449 3.029 -5.733 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.791 4.198 -5.737 1.00 0.00 H new ATOM 0 HD23 LEU B 24 7.795 3.982 -7.196 1.00 0.00 H new ATOM 1657 N LYS B 25 13.300 4.430 -8.171 1.00 0.00 N ATOM 1658 CA LYS B 25 14.634 4.258 -8.712 1.00 0.00 C ATOM 1659 C LYS B 25 15.697 4.260 -7.621 1.00 0.00 C ATOM 1660 O LYS B 25 16.574 3.397 -7.610 1.00 0.00 O ATOM 1661 CB LYS B 25 14.946 5.344 -9.742 1.00 0.00 C ATOM 1662 CG LYS B 25 16.215 5.077 -10.536 1.00 0.00 C ATOM 1663 CD LYS B 25 17.409 5.801 -9.936 1.00 0.00 C ATOM 1664 CE LYS B 25 18.722 5.222 -10.439 1.00 0.00 C ATOM 1665 NZ LYS B 25 19.312 6.047 -11.529 1.00 0.00 N ATOM 0 H LYS B 25 12.845 5.303 -8.438 1.00 0.00 H new ATOM 0 HA LYS B 25 14.655 3.284 -9.200 1.00 0.00 H new ATOM 0 HB2 LYS B 25 14.107 5.432 -10.432 1.00 0.00 H new ATOM 0 HB3 LYS B 25 15.041 6.302 -9.231 1.00 0.00 H new ATOM 0 HG2 LYS B 25 16.412 4.005 -10.560 1.00 0.00 H new ATOM 0 HG3 LYS B 25 16.074 5.398 -11.568 1.00 0.00 H new ATOM 0 HD2 LYS B 25 17.357 6.860 -10.187 1.00 0.00 H new ATOM 0 HD3 LYS B 25 17.371 5.729 -8.849 1.00 0.00 H new ATOM 0 HE2 LYS B 25 19.429 5.154 -9.612 1.00 0.00 H new ATOM 0 HE3 LYS B 25 18.556 4.207 -10.801 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 20.206 5.618 -11.844 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 18.649 6.091 -12.329 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 19.494 7.008 -11.177 1.00 0.00 H new ATOM 1679 N LEU B 26 15.628 5.218 -6.694 1.00 0.00 N ATOM 1680 CA LEU B 26 16.617 5.263 -5.622 1.00 0.00 C ATOM 1681 C LEU B 26 16.377 4.117 -4.660 1.00 0.00 C ATOM 1682 O LEU B 26 17.301 3.405 -4.282 1.00 0.00 O ATOM 1683 CB LEU B 26 16.610 6.594 -4.864 1.00 0.00 C ATOM 1684 CG LEU B 26 16.057 7.785 -5.633 1.00 0.00 C ATOM 1685 CD1 LEU B 26 14.556 7.842 -5.461 1.00 0.00 C ATOM 1686 CD2 LEU B 26 16.709 9.077 -5.164 1.00 0.00 C ATOM 0 H LEU B 26 14.920 5.951 -6.664 1.00 0.00 H new ATOM 0 HA LEU B 26 17.600 5.167 -6.084 1.00 0.00 H new ATOM 0 HB2 LEU B 26 16.025 6.470 -3.953 1.00 0.00 H new ATOM 0 HB3 LEU B 26 17.631 6.823 -4.559 1.00 0.00 H new ATOM 0 HG LEU B 26 16.286 7.666 -6.692 1.00 0.00 H new ATOM 0 HD11 LEU B 26 14.159 8.695 -6.011 1.00 0.00 H new ATOM 0 HD12 LEU B 26 14.111 6.924 -5.844 1.00 0.00 H new ATOM 0 HD13 LEU B 26 14.315 7.949 -4.403 1.00 0.00 H new ATOM 0 HD21 LEU B 26 16.300 9.916 -5.726 1.00 0.00 H new ATOM 0 HD22 LEU B 26 16.510 9.220 -4.102 1.00 0.00 H new ATOM 0 HD23 LEU B 26 17.785 9.021 -5.327 1.00 0.00 H new ATOM 1698 N VAL B 27 15.121 3.937 -4.283 1.00 0.00 N ATOM 1699 CA VAL B 27 14.747 2.861 -3.375 1.00 0.00 C ATOM 1700 C VAL B 27 15.061 1.509 -3.977 1.00 0.00 C ATOM 1701 O VAL B 27 15.547 0.615 -3.292 1.00 0.00 O ATOM 1702 CB VAL B 27 13.252 2.880 -3.013 1.00 0.00 C ATOM 1703 CG1 VAL B 27 13.034 3.426 -1.617 1.00 0.00 C ATOM 1704 CG2 VAL B 27 12.475 3.671 -4.016 1.00 0.00 C ATOM 0 H VAL B 27 14.343 4.521 -4.591 1.00 0.00 H new ATOM 0 HA VAL B 27 15.332 3.025 -2.470 1.00 0.00 H new ATOM 0 HB VAL B 27 12.891 1.852 -3.031 1.00 0.00 H new ATOM 0 HG11 VAL B 27 11.968 3.427 -1.389 1.00 0.00 H new ATOM 0 HG12 VAL B 27 13.559 2.800 -0.895 1.00 0.00 H new ATOM 0 HG13 VAL B 27 13.418 4.444 -1.561 1.00 0.00 H new ATOM 0 HG21 VAL B 27 11.420 3.671 -3.741 1.00 0.00 H new ATOM 0 HG22 VAL B 27 12.845 4.696 -4.037 1.00 0.00 H new ATOM 0 HG23 VAL B 27 12.592 3.223 -5.003 1.00 0.00 H new ATOM 1714 N SER B 28 14.763 1.343 -5.255 1.00 0.00 N ATOM 1715 CA SER B 28 15.009 0.067 -5.894 1.00 0.00 C ATOM 1716 C SER B 28 16.498 -0.246 -5.941 1.00 0.00 C ATOM 1717 O SER B 28 16.903 -1.397 -5.769 1.00 0.00 O ATOM 1718 CB SER B 28 14.412 0.029 -7.302 1.00 0.00 C ATOM 1719 OG SER B 28 12.996 -0.003 -7.254 1.00 0.00 O ATOM 0 H SER B 28 14.359 2.060 -5.857 1.00 0.00 H new ATOM 0 HA SER B 28 14.517 -0.699 -5.294 1.00 0.00 H new ATOM 0 HB2 SER B 28 14.740 0.904 -7.864 1.00 0.00 H new ATOM 0 HB3 SER B 28 14.781 -0.848 -7.834 1.00 0.00 H new ATOM 0 HG SER B 28 12.640 0.870 -7.521 1.00 0.00 H new ATOM 1725 N VAL B 29 17.306 0.782 -6.164 1.00 0.00 N ATOM 1726 CA VAL B 29 18.747 0.623 -6.225 1.00 0.00 C ATOM 1727 C VAL B 29 19.332 0.561 -4.821 1.00 0.00 C ATOM 1728 O VAL B 29 20.172 -0.283 -4.514 1.00 0.00 O ATOM 1729 CB VAL B 29 19.379 1.790 -7.019 1.00 0.00 C ATOM 1730 CG1 VAL B 29 20.296 2.640 -6.152 1.00 0.00 C ATOM 1731 CG2 VAL B 29 20.118 1.271 -8.243 1.00 0.00 C ATOM 0 H VAL B 29 16.982 1.739 -6.306 1.00 0.00 H new ATOM 0 HA VAL B 29 18.974 -0.312 -6.737 1.00 0.00 H new ATOM 0 HB VAL B 29 18.565 2.433 -7.353 1.00 0.00 H new ATOM 0 HG11 VAL B 29 20.718 3.447 -6.751 1.00 0.00 H new ATOM 0 HG12 VAL B 29 19.726 3.062 -5.324 1.00 0.00 H new ATOM 0 HG13 VAL B 29 21.102 2.021 -5.759 1.00 0.00 H new ATOM 0 HG21 VAL B 29 20.555 2.109 -8.787 1.00 0.00 H new ATOM 0 HG22 VAL B 29 20.909 0.590 -7.929 1.00 0.00 H new ATOM 0 HG23 VAL B 29 19.420 0.741 -8.892 1.00 0.00 H new ATOM 1741 N TYR B 30 18.878 1.479 -3.980 1.00 0.00 N ATOM 1742 CA TYR B 30 19.347 1.559 -2.604 1.00 0.00 C ATOM 1743 C TYR B 30 18.783 0.426 -1.753 1.00 0.00 C ATOM 1744 O TYR B 30 19.383 0.045 -0.749 1.00 0.00 O ATOM 1745 CB TYR B 30 18.972 2.906 -1.986 1.00 0.00 C ATOM 1746 CG TYR B 30 19.833 4.054 -2.466 1.00 0.00 C ATOM 1747 CD1 TYR B 30 21.210 4.036 -2.283 1.00 0.00 C ATOM 1748 CD2 TYR B 30 19.269 5.152 -3.104 1.00 0.00 C ATOM 1749 CE1 TYR B 30 22.001 5.082 -2.721 1.00 0.00 C ATOM 1750 CE2 TYR B 30 20.054 6.200 -3.545 1.00 0.00 C ATOM 1751 CZ TYR B 30 21.418 6.160 -3.351 1.00 0.00 C ATOM 1752 OH TYR B 30 22.203 7.203 -3.789 1.00 0.00 O ATOM 0 H TYR B 30 18.182 2.182 -4.228 1.00 0.00 H new ATOM 0 HA TYR B 30 20.433 1.463 -2.624 1.00 0.00 H new ATOM 0 HB2 TYR B 30 17.929 3.124 -2.216 1.00 0.00 H new ATOM 0 HB3 TYR B 30 19.050 2.833 -0.901 1.00 0.00 H new ATOM 0 HD1 TYR B 30 21.670 3.192 -1.791 1.00 0.00 H new ATOM 0 HD2 TYR B 30 18.201 5.187 -3.258 1.00 0.00 H new ATOM 0 HE1 TYR B 30 23.070 5.054 -2.570 1.00 0.00 H new ATOM 0 HE2 TYR B 30 19.601 7.047 -4.039 1.00 0.00 H new ATOM 0 HH TYR B 30 21.638 7.882 -4.212 1.00 0.00 H new ATOM 1762 N LEU B 31 17.630 -0.118 -2.148 1.00 0.00 N ATOM 1763 CA LEU B 31 17.025 -1.204 -1.390 1.00 0.00 C ATOM 1764 C LEU B 31 17.114 -2.519 -2.162 1.00 0.00 C ATOM 1765 O LEU B 31 16.710 -3.567 -1.661 1.00 0.00 O ATOM 1766 CB LEU B 31 15.554 -0.899 -1.060 1.00 0.00 C ATOM 1767 CG LEU B 31 15.225 0.523 -0.557 1.00 0.00 C ATOM 1768 CD1 LEU B 31 14.205 0.461 0.569 1.00 0.00 C ATOM 1769 CD2 LEU B 31 16.468 1.271 -0.092 1.00 0.00 C ATOM 0 H LEU B 31 17.107 0.172 -2.974 1.00 0.00 H new ATOM 0 HA LEU B 31 17.580 -1.300 -0.457 1.00 0.00 H new ATOM 0 HB2 LEU B 31 14.961 -1.087 -1.955 1.00 0.00 H new ATOM 0 HB3 LEU B 31 15.223 -1.610 -0.303 1.00 0.00 H new ATOM 0 HG LEU B 31 14.806 1.074 -1.399 1.00 0.00 H new ATOM 0 HD11 LEU B 31 13.982 1.471 0.914 1.00 0.00 H new ATOM 0 HD12 LEU B 31 13.291 -0.008 0.206 1.00 0.00 H new ATOM 0 HD13 LEU B 31 14.610 -0.124 1.395 1.00 0.00 H new ATOM 0 HD21 LEU B 31 16.186 2.266 0.253 1.00 0.00 H new ATOM 0 HD22 LEU B 31 16.938 0.723 0.725 1.00 0.00 H new ATOM 0 HD23 LEU B 31 17.171 1.360 -0.921 1.00 0.00 H new ATOM 1781 N ASN B 32 17.633 -2.459 -3.389 1.00 0.00 N ATOM 1782 CA ASN B 32 17.754 -3.649 -4.222 1.00 0.00 C ATOM 1783 C ASN B 32 16.407 -4.351 -4.317 1.00 0.00 C ATOM 1784 O ASN B 32 16.329 -5.579 -4.334 1.00 0.00 O ATOM 1785 CB ASN B 32 18.804 -4.600 -3.646 1.00 0.00 C ATOM 1786 CG ASN B 32 19.664 -5.232 -4.723 1.00 0.00 C ATOM 1787 OD1 ASN B 32 19.408 -5.066 -5.916 1.00 0.00 O ATOM 1788 ND2 ASN B 32 20.691 -5.965 -4.308 1.00 0.00 N ATOM 0 H ASN B 32 17.974 -1.602 -3.824 1.00 0.00 H new ATOM 0 HA ASN B 32 18.071 -3.348 -5.220 1.00 0.00 H new ATOM 0 HB2 ASN B 32 19.441 -4.055 -2.950 1.00 0.00 H new ATOM 0 HB3 ASN B 32 18.306 -5.384 -3.076 1.00 0.00 H new ATOM 0 HD21 ASN B 32 21.303 -6.416 -4.988 1.00 0.00 H new ATOM 0 HD22 ASN B 32 20.867 -6.077 -3.310 1.00 0.00 H new ATOM 1795 N ARG B 33 15.347 -3.551 -4.359 1.00 0.00 N ATOM 1796 CA ARG B 33 13.992 -4.084 -4.429 1.00 0.00 C ATOM 1797 C ARG B 33 13.215 -3.486 -5.592 1.00 0.00 C ATOM 1798 O ARG B 33 13.177 -2.269 -5.765 1.00 0.00 O ATOM 1799 CB ARG B 33 13.253 -3.797 -3.120 1.00 0.00 C ATOM 1800 CG ARG B 33 13.768 -4.605 -1.940 1.00 0.00 C ATOM 1801 CD ARG B 33 12.664 -4.891 -0.935 1.00 0.00 C ATOM 1802 NE ARG B 33 12.958 -6.064 -0.116 1.00 0.00 N ATOM 1803 CZ ARG B 33 12.782 -7.318 -0.528 1.00 0.00 C ATOM 1804 NH1 ARG B 33 12.318 -7.566 -1.747 1.00 0.00 N ATOM 1805 NH2 ARG B 33 13.073 -8.328 0.281 1.00 0.00 N ATOM 0 H ARG B 33 15.400 -2.532 -4.346 1.00 0.00 H new ATOM 0 HA ARG B 33 14.065 -5.160 -4.587 1.00 0.00 H new ATOM 0 HB2 ARG B 33 13.341 -2.735 -2.888 1.00 0.00 H new ATOM 0 HB3 ARG B 33 12.192 -4.007 -3.258 1.00 0.00 H new ATOM 0 HG2 ARG B 33 14.188 -5.545 -2.297 1.00 0.00 H new ATOM 0 HG3 ARG B 33 14.575 -4.061 -1.450 1.00 0.00 H new ATOM 0 HD2 ARG B 33 12.528 -4.023 -0.289 1.00 0.00 H new ATOM 0 HD3 ARG B 33 11.724 -5.045 -1.464 1.00 0.00 H new ATOM 0 HE ARG B 33 13.319 -5.914 0.826 1.00 0.00 H new ATOM 0 HH11 ARG B 33 12.094 -6.794 -2.374 1.00 0.00 H new ATOM 0 HH12 ARG B 33 12.186 -8.529 -2.056 1.00 0.00 H new ATOM 0 HH21 ARG B 33 13.431 -8.144 1.218 1.00 0.00 H new ATOM 0 HH22 ARG B 33 12.938 -9.289 -0.034 1.00 0.00 H new ATOM 1819 N ASP B 34 12.574 -4.344 -6.379 1.00 0.00 N ATOM 1820 CA ASP B 34 11.777 -3.885 -7.510 1.00 0.00 C ATOM 1821 C ASP B 34 10.802 -2.810 -7.048 1.00 0.00 C ATOM 1822 O ASP B 34 10.559 -2.663 -5.851 1.00 0.00 O ATOM 1823 CB ASP B 34 11.019 -5.054 -8.142 1.00 0.00 C ATOM 1824 CG ASP B 34 11.040 -5.004 -9.657 1.00 0.00 C ATOM 1825 OD1 ASP B 34 10.454 -4.060 -10.228 1.00 0.00 O ATOM 1826 OD2 ASP B 34 11.642 -5.908 -10.273 1.00 0.00 O ATOM 0 H ASP B 34 12.591 -5.356 -6.255 1.00 0.00 H new ATOM 0 HA ASP B 34 12.443 -3.463 -8.263 1.00 0.00 H new ATOM 0 HB2 ASP B 34 11.459 -5.993 -7.806 1.00 0.00 H new ATOM 0 HB3 ASP B 34 9.986 -5.044 -7.795 1.00 0.00 H new ATOM 1831 N MET B 35 10.248 -2.054 -7.986 1.00 0.00 N ATOM 1832 CA MET B 35 9.316 -1.002 -7.638 1.00 0.00 C ATOM 1833 C MET B 35 8.117 -1.579 -6.884 1.00 0.00 C ATOM 1834 O MET B 35 7.614 -0.972 -5.939 1.00 0.00 O ATOM 1835 CB MET B 35 8.865 -0.262 -8.900 1.00 0.00 C ATOM 1836 CG MET B 35 7.388 0.064 -8.910 1.00 0.00 C ATOM 1837 SD MET B 35 6.940 1.284 -10.160 1.00 0.00 S ATOM 1838 CE MET B 35 6.963 0.278 -11.640 1.00 0.00 C ATOM 0 H MET B 35 10.429 -2.152 -8.985 1.00 0.00 H new ATOM 0 HA MET B 35 9.815 -0.289 -6.981 1.00 0.00 H new ATOM 0 HB2 MET B 35 9.434 0.663 -8.993 1.00 0.00 H new ATOM 0 HB3 MET B 35 9.101 -0.871 -9.773 1.00 0.00 H new ATOM 0 HG2 MET B 35 6.822 -0.851 -9.085 1.00 0.00 H new ATOM 0 HG3 MET B 35 7.098 0.436 -7.927 1.00 0.00 H new ATOM 0 HE1 MET B 35 6.636 0.875 -12.491 1.00 0.00 H new ATOM 0 HE2 MET B 35 7.976 -0.084 -11.818 1.00 0.00 H new ATOM 0 HE3 MET B 35 6.291 -0.571 -11.513 1.00 0.00 H new ATOM 1848 N THR B 36 7.670 -2.756 -7.310 1.00 0.00 N ATOM 1849 CA THR B 36 6.536 -3.417 -6.676 1.00 0.00 C ATOM 1850 C THR B 36 6.890 -3.841 -5.255 1.00 0.00 C ATOM 1851 O THR B 36 6.109 -3.646 -4.325 1.00 0.00 O ATOM 1852 CB THR B 36 6.105 -4.643 -7.494 1.00 0.00 C ATOM 1853 OG1 THR B 36 7.156 -5.070 -8.344 1.00 0.00 O ATOM 1854 CG2 THR B 36 4.886 -4.407 -8.365 1.00 0.00 C ATOM 0 H THR B 36 8.076 -3.271 -8.091 1.00 0.00 H new ATOM 0 HA THR B 36 5.708 -2.710 -6.636 1.00 0.00 H new ATOM 0 HB THR B 36 5.852 -5.399 -6.751 1.00 0.00 H new ATOM 0 HG1 THR B 36 6.865 -5.853 -8.856 1.00 0.00 H new ATOM 0 HG21 THR B 36 4.646 -5.320 -8.910 1.00 0.00 H new ATOM 0 HG22 THR B 36 4.040 -4.126 -7.738 1.00 0.00 H new ATOM 0 HG23 THR B 36 5.095 -3.606 -9.074 1.00 0.00 H new ATOM 1862 N GLU B 37 8.071 -4.421 -5.095 1.00 0.00 N ATOM 1863 CA GLU B 37 8.527 -4.872 -3.787 1.00 0.00 C ATOM 1864 C GLU B 37 8.685 -3.694 -2.831 1.00 0.00 C ATOM 1865 O GLU B 37 8.446 -3.822 -1.633 1.00 0.00 O ATOM 1866 CB GLU B 37 9.852 -5.625 -3.917 1.00 0.00 C ATOM 1867 CG GLU B 37 9.692 -7.137 -3.938 1.00 0.00 C ATOM 1868 CD GLU B 37 10.755 -7.824 -4.773 1.00 0.00 C ATOM 1869 OE1 GLU B 37 10.596 -7.875 -6.011 1.00 0.00 O ATOM 1870 OE2 GLU B 37 11.745 -8.311 -4.189 1.00 0.00 O ATOM 0 H GLU B 37 8.731 -4.591 -5.854 1.00 0.00 H new ATOM 0 HA GLU B 37 7.775 -5.547 -3.379 1.00 0.00 H new ATOM 0 HB2 GLU B 37 10.352 -5.308 -4.832 1.00 0.00 H new ATOM 0 HB3 GLU B 37 10.501 -5.348 -3.086 1.00 0.00 H new ATOM 0 HG2 GLU B 37 9.735 -7.517 -2.917 1.00 0.00 H new ATOM 0 HG3 GLU B 37 8.707 -7.389 -4.331 1.00 0.00 H new ATOM 1877 N ILE B 38 9.097 -2.551 -3.369 1.00 0.00 N ATOM 1878 CA ILE B 38 9.294 -1.353 -2.560 1.00 0.00 C ATOM 1879 C ILE B 38 7.979 -0.618 -2.313 1.00 0.00 C ATOM 1880 O ILE B 38 7.669 -0.264 -1.177 1.00 0.00 O ATOM 1881 CB ILE B 38 10.292 -0.382 -3.234 1.00 0.00 C ATOM 1882 CG1 ILE B 38 11.744 -0.822 -3.009 1.00 0.00 C ATOM 1883 CG2 ILE B 38 10.107 1.037 -2.721 1.00 0.00 C ATOM 1884 CD1 ILE B 38 12.055 -1.168 -1.567 1.00 0.00 C ATOM 0 H ILE B 38 9.301 -2.429 -4.361 1.00 0.00 H new ATOM 0 HA ILE B 38 9.699 -1.685 -1.604 1.00 0.00 H new ATOM 0 HB ILE B 38 10.083 -0.404 -4.304 1.00 0.00 H new ATOM 0 HG12 ILE B 38 11.954 -1.689 -3.636 1.00 0.00 H new ATOM 0 HG13 ILE B 38 12.412 -0.024 -3.335 1.00 0.00 H new ATOM 0 HG21 ILE B 38 10.822 1.697 -3.212 1.00 0.00 H new ATOM 0 HG22 ILE B 38 9.093 1.373 -2.939 1.00 0.00 H new ATOM 0 HG23 ILE B 38 10.273 1.059 -1.644 1.00 0.00 H new ATOM 0 HD11 ILE B 38 13.099 -1.470 -1.482 1.00 0.00 H new ATOM 0 HD12 ILE B 38 11.878 -0.296 -0.937 1.00 0.00 H new ATOM 0 HD13 ILE B 38 11.413 -1.987 -1.243 1.00 0.00 H new ATOM 1896 N ILE B 39 7.206 -0.378 -3.372 1.00 0.00 N ATOM 1897 CA ILE B 39 5.939 0.328 -3.221 1.00 0.00 C ATOM 1898 C ILE B 39 5.014 -0.438 -2.292 1.00 0.00 C ATOM 1899 O ILE B 39 4.246 0.152 -1.532 1.00 0.00 O ATOM 1900 CB ILE B 39 5.229 0.549 -4.571 1.00 0.00 C ATOM 1901 CG1 ILE B 39 4.838 -0.789 -5.198 1.00 0.00 C ATOM 1902 CG2 ILE B 39 6.112 1.346 -5.515 1.00 0.00 C ATOM 1903 CD1 ILE B 39 3.344 -1.016 -5.238 1.00 0.00 C ATOM 0 H ILE B 39 7.431 -0.657 -4.327 1.00 0.00 H new ATOM 0 HA ILE B 39 6.171 1.305 -2.796 1.00 0.00 H new ATOM 0 HB ILE B 39 4.319 1.121 -4.390 1.00 0.00 H new ATOM 0 HG12 ILE B 39 5.233 -0.836 -6.213 1.00 0.00 H new ATOM 0 HG13 ILE B 39 5.306 -1.597 -4.636 1.00 0.00 H new ATOM 0 HG21 ILE B 39 5.593 1.492 -6.463 1.00 0.00 H new ATOM 0 HG22 ILE B 39 6.336 2.316 -5.071 1.00 0.00 H new ATOM 0 HG23 ILE B 39 7.041 0.803 -5.690 1.00 0.00 H new ATOM 0 HD11 ILE B 39 3.135 -1.983 -5.695 1.00 0.00 H new ATOM 0 HD12 ILE B 39 2.946 -1.000 -4.223 1.00 0.00 H new ATOM 0 HD13 ILE B 39 2.872 -0.228 -5.825 1.00 0.00 H new ATOM 1915 N GLU B 40 5.098 -1.759 -2.357 1.00 0.00 N ATOM 1916 CA GLU B 40 4.275 -2.611 -1.523 1.00 0.00 C ATOM 1917 C GLU B 40 4.913 -2.809 -0.157 1.00 0.00 C ATOM 1918 O GLU B 40 4.220 -3.080 0.824 1.00 0.00 O ATOM 1919 CB GLU B 40 4.045 -3.960 -2.199 1.00 0.00 C ATOM 1920 CG GLU B 40 3.453 -3.841 -3.591 1.00 0.00 C ATOM 1921 CD GLU B 40 1.985 -3.461 -3.573 1.00 0.00 C ATOM 1922 OE1 GLU B 40 1.617 -2.551 -2.800 1.00 0.00 O ATOM 1923 OE2 GLU B 40 1.204 -4.073 -4.331 1.00 0.00 O ATOM 0 H GLU B 40 5.730 -2.261 -2.981 1.00 0.00 H new ATOM 0 HA GLU B 40 3.311 -2.121 -1.385 1.00 0.00 H new ATOM 0 HB2 GLU B 40 4.993 -4.495 -2.259 1.00 0.00 H new ATOM 0 HB3 GLU B 40 3.379 -4.560 -1.579 1.00 0.00 H new ATOM 0 HG2 GLU B 40 4.010 -3.094 -4.156 1.00 0.00 H new ATOM 0 HG3 GLU B 40 3.572 -4.790 -4.114 1.00 0.00 H new ATOM 1930 N GLU B 41 6.235 -2.661 -0.083 1.00 0.00 N ATOM 1931 CA GLU B 41 6.921 -2.814 1.194 1.00 0.00 C ATOM 1932 C GLU B 41 6.867 -1.506 1.969 1.00 0.00 C ATOM 1933 O GLU B 41 6.812 -1.499 3.199 1.00 0.00 O ATOM 1934 CB GLU B 41 8.374 -3.251 0.986 1.00 0.00 C ATOM 1935 CG GLU B 41 9.173 -3.342 2.277 1.00 0.00 C ATOM 1936 CD GLU B 41 10.630 -3.680 2.036 1.00 0.00 C ATOM 1937 OE1 GLU B 41 11.496 -3.102 2.726 1.00 0.00 O ATOM 1938 OE2 GLU B 41 10.907 -4.527 1.160 1.00 0.00 O ATOM 0 H GLU B 41 6.839 -2.440 -0.875 1.00 0.00 H new ATOM 0 HA GLU B 41 6.415 -3.590 1.768 1.00 0.00 H new ATOM 0 HB2 GLU B 41 8.385 -4.223 0.492 1.00 0.00 H new ATOM 0 HB3 GLU B 41 8.864 -2.546 0.314 1.00 0.00 H new ATOM 0 HG2 GLU B 41 9.107 -2.393 2.809 1.00 0.00 H new ATOM 0 HG3 GLU B 41 8.729 -4.100 2.922 1.00 0.00 H new ATOM 1945 N ALA B 42 6.869 -0.399 1.235 1.00 0.00 N ATOM 1946 CA ALA B 42 6.811 0.921 1.847 1.00 0.00 C ATOM 1947 C ALA B 42 5.404 1.216 2.351 1.00 0.00 C ATOM 1948 O ALA B 42 5.223 1.806 3.416 1.00 0.00 O ATOM 1949 CB ALA B 42 7.252 1.981 0.851 1.00 0.00 C ATOM 0 H ALA B 42 6.910 -0.390 0.216 1.00 0.00 H new ATOM 0 HA ALA B 42 7.490 0.939 2.699 1.00 0.00 H new ATOM 0 HB1 ALA B 42 7.204 2.964 1.320 1.00 0.00 H new ATOM 0 HB2 ALA B 42 8.275 1.779 0.534 1.00 0.00 H new ATOM 0 HB3 ALA B 42 6.593 1.961 -0.017 1.00 0.00 H new ATOM 1955 N VAL B 43 4.412 0.801 1.571 1.00 0.00 N ATOM 1956 CA VAL B 43 3.014 1.018 1.926 1.00 0.00 C ATOM 1957 C VAL B 43 2.672 0.388 3.262 1.00 0.00 C ATOM 1958 O VAL B 43 2.289 1.071 4.211 1.00 0.00 O ATOM 1959 CB VAL B 43 2.055 0.428 0.860 1.00 0.00 C ATOM 1960 CG1 VAL B 43 2.445 -0.979 0.471 1.00 0.00 C ATOM 1961 CG2 VAL B 43 0.623 0.431 1.358 1.00 0.00 C ATOM 0 H VAL B 43 4.550 0.311 0.687 1.00 0.00 H new ATOM 0 HA VAL B 43 2.883 2.099 1.983 1.00 0.00 H new ATOM 0 HB VAL B 43 2.134 1.065 -0.021 1.00 0.00 H new ATOM 0 HG11 VAL B 43 1.748 -1.356 -0.278 1.00 0.00 H new ATOM 0 HG12 VAL B 43 3.454 -0.976 0.059 1.00 0.00 H new ATOM 0 HG13 VAL B 43 2.415 -1.621 1.351 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -0.030 0.012 0.592 1.00 0.00 H new ATOM 0 HG22 VAL B 43 0.552 -0.171 2.264 1.00 0.00 H new ATOM 0 HG23 VAL B 43 0.316 1.454 1.577 1.00 0.00 H new ATOM 1971 N VAL B 44 2.798 -0.920 3.309 1.00 0.00 N ATOM 1972 CA VAL B 44 2.490 -1.678 4.502 1.00 0.00 C ATOM 1973 C VAL B 44 3.295 -1.173 5.686 1.00 0.00 C ATOM 1974 O VAL B 44 2.754 -0.931 6.762 1.00 0.00 O ATOM 1975 CB VAL B 44 2.755 -3.180 4.267 1.00 0.00 C ATOM 1976 CG1 VAL B 44 3.330 -3.861 5.506 1.00 0.00 C ATOM 1977 CG2 VAL B 44 1.488 -3.880 3.804 1.00 0.00 C ATOM 0 H VAL B 44 3.116 -1.487 2.523 1.00 0.00 H new ATOM 0 HA VAL B 44 1.433 -1.543 4.730 1.00 0.00 H new ATOM 0 HB VAL B 44 3.505 -3.259 3.480 1.00 0.00 H new ATOM 0 HG11 VAL B 44 3.501 -4.917 5.295 1.00 0.00 H new ATOM 0 HG12 VAL B 44 4.274 -3.388 5.776 1.00 0.00 H new ATOM 0 HG13 VAL B 44 2.627 -3.766 6.333 1.00 0.00 H new ATOM 0 HG21 VAL B 44 1.695 -4.938 3.644 1.00 0.00 H new ATOM 0 HG22 VAL B 44 0.714 -3.773 4.564 1.00 0.00 H new ATOM 0 HG23 VAL B 44 1.145 -3.432 2.872 1.00 0.00 H new ATOM 1987 N MET B 45 4.591 -1.011 5.484 1.00 0.00 N ATOM 1988 CA MET B 45 5.458 -0.532 6.543 1.00 0.00 C ATOM 1989 C MET B 45 5.026 0.850 7.018 1.00 0.00 C ATOM 1990 O MET B 45 5.206 1.191 8.188 1.00 0.00 O ATOM 1991 CB MET B 45 6.910 -0.503 6.072 1.00 0.00 C ATOM 1992 CG MET B 45 7.918 -0.649 7.197 1.00 0.00 C ATOM 1993 SD MET B 45 7.715 -2.182 8.124 1.00 0.00 S ATOM 1994 CE MET B 45 7.387 -1.542 9.765 1.00 0.00 C ATOM 0 H MET B 45 5.063 -1.203 4.601 1.00 0.00 H new ATOM 0 HA MET B 45 5.377 -1.221 7.384 1.00 0.00 H new ATOM 0 HB2 MET B 45 7.065 -1.305 5.350 1.00 0.00 H new ATOM 0 HB3 MET B 45 7.095 0.436 5.550 1.00 0.00 H new ATOM 0 HG2 MET B 45 8.926 -0.611 6.783 1.00 0.00 H new ATOM 0 HG3 MET B 45 7.821 0.197 7.877 1.00 0.00 H new ATOM 0 HE1 MET B 45 6.931 -2.322 10.375 1.00 0.00 H new ATOM 0 HE2 MET B 45 8.322 -1.222 10.224 1.00 0.00 H new ATOM 0 HE3 MET B 45 6.707 -0.693 9.695 1.00 0.00 H new ATOM 2004 N TRP B 46 4.440 1.643 6.122 1.00 0.00 N ATOM 2005 CA TRP B 46 3.981 2.971 6.499 1.00 0.00 C ATOM 2006 C TRP B 46 2.754 2.859 7.391 1.00 0.00 C ATOM 2007 O TRP B 46 2.722 3.412 8.490 1.00 0.00 O ATOM 2008 CB TRP B 46 3.663 3.814 5.261 1.00 0.00 C ATOM 2009 CG TRP B 46 3.091 5.160 5.592 1.00 0.00 C ATOM 2010 CD1 TRP B 46 1.959 5.721 5.073 1.00 0.00 C ATOM 2011 CD2 TRP B 46 3.621 6.114 6.520 1.00 0.00 C ATOM 2012 NE1 TRP B 46 1.755 6.964 5.618 1.00 0.00 N ATOM 2013 CE2 TRP B 46 2.761 7.229 6.510 1.00 0.00 C ATOM 2014 CE3 TRP B 46 4.741 6.136 7.358 1.00 0.00 C ATOM 2015 CZ2 TRP B 46 2.985 8.350 7.305 1.00 0.00 C ATOM 2016 CZ3 TRP B 46 4.961 7.250 8.147 1.00 0.00 C ATOM 2017 CH2 TRP B 46 4.087 8.343 8.116 1.00 0.00 C ATOM 0 H TRP B 46 4.276 1.392 5.147 1.00 0.00 H new ATOM 0 HA TRP B 46 4.780 3.469 7.049 1.00 0.00 H new ATOM 0 HB2 TRP B 46 4.574 3.947 4.677 1.00 0.00 H new ATOM 0 HB3 TRP B 46 2.957 3.272 4.632 1.00 0.00 H new ATOM 0 HD1 TRP B 46 1.318 5.254 4.340 1.00 0.00 H new ATOM 0 HE1 TRP B 46 0.980 7.589 5.395 1.00 0.00 H new ATOM 0 HE3 TRP B 46 5.422 5.298 7.388 1.00 0.00 H new ATOM 0 HZ2 TRP B 46 2.313 9.195 7.282 1.00 0.00 H new ATOM 0 HZ3 TRP B 46 5.822 7.277 8.798 1.00 0.00 H new ATOM 0 HH2 TRP B 46 4.287 9.198 8.745 1.00 0.00 H new ATOM 2028 N LEU B 47 1.751 2.126 6.920 1.00 0.00 N ATOM 2029 CA LEU B 47 0.535 1.935 7.699 1.00 0.00 C ATOM 2030 C LEU B 47 0.860 1.286 9.024 1.00 0.00 C ATOM 2031 O LEU B 47 0.348 1.673 10.070 1.00 0.00 O ATOM 2032 CB LEU B 47 -0.474 1.040 6.979 1.00 0.00 C ATOM 2033 CG LEU B 47 0.105 -0.042 6.069 1.00 0.00 C ATOM 2034 CD1 LEU B 47 0.080 -1.383 6.782 1.00 0.00 C ATOM 2035 CD2 LEU B 47 -0.672 -0.118 4.762 1.00 0.00 C ATOM 0 H LEU B 47 1.755 1.659 6.013 1.00 0.00 H new ATOM 0 HA LEU B 47 0.099 2.924 7.843 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -1.098 0.556 7.730 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.128 1.675 6.381 1.00 0.00 H new ATOM 0 HG LEU B 47 1.138 0.214 5.833 1.00 0.00 H new ATOM 0 HD11 LEU B 47 0.494 -2.151 6.128 1.00 0.00 H new ATOM 0 HD12 LEU B 47 0.676 -1.322 7.693 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.948 -1.640 7.038 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -0.243 -0.895 4.129 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.715 -0.356 4.972 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -0.615 0.842 4.248 1.00 0.00 H new ATOM 2047 N ILE B 48 1.698 0.273 8.960 1.00 0.00 N ATOM 2048 CA ILE B 48 2.080 -0.465 10.135 1.00 0.00 C ATOM 2049 C ILE B 48 2.746 0.426 11.168 1.00 0.00 C ATOM 2050 O ILE B 48 2.431 0.349 12.356 1.00 0.00 O ATOM 2051 CB ILE B 48 3.001 -1.631 9.738 1.00 0.00 C ATOM 2052 CG1 ILE B 48 2.278 -2.944 9.971 1.00 0.00 C ATOM 2053 CG2 ILE B 48 4.318 -1.593 10.497 1.00 0.00 C ATOM 2054 CD1 ILE B 48 0.960 -3.059 9.232 1.00 0.00 C ATOM 0 H ILE B 48 2.129 -0.057 8.096 1.00 0.00 H new ATOM 0 HA ILE B 48 1.177 -0.865 10.596 1.00 0.00 H new ATOM 0 HB ILE B 48 3.244 -1.535 8.680 1.00 0.00 H new ATOM 0 HG12 ILE B 48 2.927 -3.764 9.665 1.00 0.00 H new ATOM 0 HG13 ILE B 48 2.096 -3.063 11.039 1.00 0.00 H new ATOM 0 HG21 ILE B 48 4.940 -2.433 10.188 1.00 0.00 H new ATOM 0 HG22 ILE B 48 4.836 -0.659 10.280 1.00 0.00 H new ATOM 0 HG23 ILE B 48 4.123 -1.660 11.567 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.504 -4.025 9.449 1.00 0.00 H new ATOM 0 HD12 ILE B 48 0.291 -2.261 9.555 1.00 0.00 H new ATOM 0 HD13 ILE B 48 1.136 -2.974 8.160 1.00 0.00 H new ATOM 2066 N GLN B 49 3.668 1.265 10.724 1.00 0.00 N ATOM 2067 CA GLN B 49 4.360 2.146 11.643 1.00 0.00 C ATOM 2068 C GLN B 49 3.547 3.412 11.920 1.00 0.00 C ATOM 2069 O GLN B 49 3.819 4.134 12.878 1.00 0.00 O ATOM 2070 CB GLN B 49 5.741 2.517 11.092 1.00 0.00 C ATOM 2071 CG GLN B 49 5.702 3.548 9.973 1.00 0.00 C ATOM 2072 CD GLN B 49 7.072 3.817 9.381 1.00 0.00 C ATOM 2073 OE1 GLN B 49 7.922 4.444 10.014 1.00 0.00 O ATOM 2074 NE2 GLN B 49 7.292 3.344 8.160 1.00 0.00 N ATOM 0 H GLN B 49 3.950 1.353 9.748 1.00 0.00 H new ATOM 0 HA GLN B 49 4.485 1.611 12.585 1.00 0.00 H new ATOM 0 HB2 GLN B 49 6.355 2.902 11.906 1.00 0.00 H new ATOM 0 HB3 GLN B 49 6.229 1.614 10.724 1.00 0.00 H new ATOM 0 HG2 GLN B 49 5.032 3.200 9.187 1.00 0.00 H new ATOM 0 HG3 GLN B 49 5.287 4.480 10.357 1.00 0.00 H new ATOM 0 HE21 GLN B 49 6.558 2.830 7.672 1.00 0.00 H new ATOM 0 HE22 GLN B 49 8.195 3.495 7.710 1.00 0.00 H new ATOM 2083 N ASN B 50 2.563 3.688 11.065 1.00 0.00 N ATOM 2084 CA ASN B 50 1.736 4.883 11.215 1.00 0.00 C ATOM 2085 C ASN B 50 0.414 4.595 11.922 1.00 0.00 C ATOM 2086 O ASN B 50 0.096 5.206 12.942 1.00 0.00 O ATOM 2087 CB ASN B 50 1.462 5.504 9.845 1.00 0.00 C ATOM 2088 CG ASN B 50 0.852 6.888 9.947 1.00 0.00 C ATOM 2089 OD1 ASN B 50 0.747 7.454 11.035 1.00 0.00 O ATOM 2090 ND2 ASN B 50 0.446 7.440 8.811 1.00 0.00 N ATOM 0 H ASN B 50 2.320 3.103 10.265 1.00 0.00 H new ATOM 0 HA ASN B 50 2.294 5.582 11.838 1.00 0.00 H new ATOM 0 HB2 ASN B 50 2.394 5.562 9.283 1.00 0.00 H new ATOM 0 HB3 ASN B 50 0.790 4.855 9.283 1.00 0.00 H new ATOM 0 HD21 ASN B 50 0.027 8.370 8.817 1.00 0.00 H new ATOM 0 HD22 ASN B 50 0.553 6.934 7.932 1.00 0.00 H new ATOM 2097 N LYS B 51 -0.361 3.682 11.357 1.00 0.00 N ATOM 2098 CA LYS B 51 -1.665 3.328 11.909 1.00 0.00 C ATOM 2099 C LYS B 51 -1.537 2.683 13.282 1.00 0.00 C ATOM 2100 O LYS B 51 -2.219 3.080 14.227 1.00 0.00 O ATOM 2101 CB LYS B 51 -2.421 2.401 10.957 1.00 0.00 C ATOM 2102 CG LYS B 51 -3.082 3.135 9.802 1.00 0.00 C ATOM 2103 CD LYS B 51 -2.065 3.563 8.756 1.00 0.00 C ATOM 2104 CE LYS B 51 -2.487 4.842 8.058 1.00 0.00 C ATOM 2105 NZ LYS B 51 -1.461 5.314 7.087 1.00 0.00 N ATOM 0 H LYS B 51 -0.110 3.169 10.512 1.00 0.00 H new ATOM 0 HA LYS B 51 -2.232 4.252 12.025 1.00 0.00 H new ATOM 0 HB2 LYS B 51 -1.730 1.659 10.558 1.00 0.00 H new ATOM 0 HB3 LYS B 51 -3.183 1.859 11.517 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -3.830 2.490 9.341 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -3.607 4.012 10.180 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -1.094 3.710 9.230 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -1.943 2.769 8.019 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -3.430 4.676 7.537 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -2.666 5.618 8.802 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -1.489 6.352 7.030 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -0.518 5.010 7.403 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -1.659 4.910 6.149 1.00 0.00 H new ATOM 2119 N GLU B 52 -0.655 1.693 13.399 1.00 0.00 N ATOM 2120 CA GLU B 52 -0.442 1.013 14.675 1.00 0.00 C ATOM 2121 C GLU B 52 -0.243 2.035 15.792 1.00 0.00 C ATOM 2122 O GLU B 52 -0.547 1.771 16.956 1.00 0.00 O ATOM 2123 CB GLU B 52 0.770 0.085 14.590 1.00 0.00 C ATOM 2124 CG GLU B 52 0.803 -0.974 15.680 1.00 0.00 C ATOM 2125 CD GLU B 52 1.527 -0.504 16.927 1.00 0.00 C ATOM 2126 OE1 GLU B 52 2.734 -0.199 16.833 1.00 0.00 O ATOM 2127 OE2 GLU B 52 0.886 -0.442 17.998 1.00 0.00 O ATOM 0 H GLU B 52 -0.080 1.345 12.632 1.00 0.00 H new ATOM 0 HA GLU B 52 -1.325 0.414 14.899 1.00 0.00 H new ATOM 0 HB2 GLU B 52 0.773 -0.407 13.617 1.00 0.00 H new ATOM 0 HB3 GLU B 52 1.680 0.683 14.648 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -0.218 -1.254 15.941 1.00 0.00 H new ATOM 0 HG3 GLU B 52 1.291 -1.870 15.297 1.00 0.00 H new ATOM 2134 N LYS B 53 0.262 3.205 15.416 1.00 0.00 N ATOM 2135 CA LYS B 53 0.503 4.286 16.359 1.00 0.00 C ATOM 2136 C LYS B 53 -0.201 5.560 15.898 1.00 0.00 C ATOM 2137 O LYS B 53 0.260 6.666 16.174 1.00 0.00 O ATOM 2138 CB LYS B 53 2.003 4.538 16.515 1.00 0.00 C ATOM 2139 CG LYS B 53 2.674 5.031 15.242 1.00 0.00 C ATOM 2140 CD LYS B 53 3.060 6.499 15.346 1.00 0.00 C ATOM 2141 CE LYS B 53 2.707 7.261 14.079 1.00 0.00 C ATOM 2142 NZ LYS B 53 3.258 8.643 14.091 1.00 0.00 N ATOM 0 H LYS B 53 0.514 3.428 14.453 1.00 0.00 H new ATOM 0 HA LYS B 53 0.098 3.993 17.328 1.00 0.00 H new ATOM 0 HB2 LYS B 53 2.159 5.272 17.306 1.00 0.00 H new ATOM 0 HB3 LYS B 53 2.486 3.615 16.837 1.00 0.00 H new ATOM 0 HG2 LYS B 53 3.564 4.433 15.044 1.00 0.00 H new ATOM 0 HG3 LYS B 53 2.000 4.890 14.397 1.00 0.00 H new ATOM 0 HD2 LYS B 53 2.550 6.951 16.197 1.00 0.00 H new ATOM 0 HD3 LYS B 53 4.130 6.582 15.535 1.00 0.00 H new ATOM 0 HE2 LYS B 53 3.093 6.724 13.213 1.00 0.00 H new ATOM 0 HE3 LYS B 53 1.623 7.303 13.971 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 3.237 9.033 13.127 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 2.683 9.240 14.719 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 4.239 8.623 14.435 1.00 0.00 H new ATOM 2156 N LEU B 54 -1.319 5.393 15.184 1.00 0.00 N ATOM 2157 CA LEU B 54 -2.088 6.525 14.666 1.00 0.00 C ATOM 2158 C LEU B 54 -2.429 7.506 15.787 1.00 0.00 C ATOM 2159 O LEU B 54 -3.354 7.273 16.565 1.00 0.00 O ATOM 2160 CB LEU B 54 -3.383 6.024 14.021 1.00 0.00 C ATOM 2161 CG LEU B 54 -4.122 7.056 13.163 1.00 0.00 C ATOM 2162 CD1 LEU B 54 -4.161 6.615 11.708 1.00 0.00 C ATOM 2163 CD2 LEU B 54 -5.531 7.280 13.692 1.00 0.00 C ATOM 0 H LEU B 54 -1.711 4.480 14.952 1.00 0.00 H new ATOM 0 HA LEU B 54 -1.480 7.038 13.921 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -3.151 5.158 13.401 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -4.054 5.681 14.809 1.00 0.00 H new ATOM 0 HG LEU B 54 -3.579 8.000 13.220 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -4.690 7.361 11.116 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -3.143 6.509 11.333 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -4.678 5.658 11.631 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -6.040 8.016 13.070 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -6.083 6.340 13.668 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -5.481 7.645 14.718 1.00 0.00 H new ATOM 2175 N PRO B 55 -1.676 8.618 15.892 1.00 0.00 N ATOM 2176 CA PRO B 55 -1.889 9.630 16.925 1.00 0.00 C ATOM 2177 C PRO B 55 -3.046 10.566 16.595 1.00 0.00 C ATOM 2178 O PRO B 55 -3.455 10.680 15.439 1.00 0.00 O ATOM 2179 CB PRO B 55 -0.562 10.413 16.952 1.00 0.00 C ATOM 2180 CG PRO B 55 0.341 9.730 15.972 1.00 0.00 C ATOM 2181 CD PRO B 55 -0.551 8.983 15.027 1.00 0.00 C ATOM 0 HA PRO B 55 -2.151 9.176 17.881 1.00 0.00 H new ATOM 0 HB2 PRO B 55 -0.719 11.456 16.677 1.00 0.00 H new ATOM 0 HB3 PRO B 55 -0.127 10.409 17.951 1.00 0.00 H new ATOM 0 HG2 PRO B 55 0.954 10.456 15.437 1.00 0.00 H new ATOM 0 HG3 PRO B 55 1.024 9.050 16.481 1.00 0.00 H new ATOM 0 HD2 PRO B 55 -0.866 9.603 14.188 1.00 0.00 H new ATOM 0 HD3 PRO B 55 -0.058 8.106 14.608 1.00 0.00 H new ATOM 2189 N ASN B 56 -3.563 11.241 17.616 1.00 0.00 N ATOM 2190 CA ASN B 56 -4.665 12.176 17.433 1.00 0.00 C ATOM 2191 C ASN B 56 -4.169 13.467 16.790 1.00 0.00 C ATOM 2192 O ASN B 56 -4.905 14.138 16.066 1.00 0.00 O ATOM 2193 CB ASN B 56 -5.332 12.484 18.776 1.00 0.00 C ATOM 2194 CG ASN B 56 -6.505 11.565 19.062 1.00 0.00 C ATOM 2195 OD1 ASN B 56 -6.391 10.617 19.838 1.00 0.00 O ATOM 2196 ND2 ASN B 56 -7.642 11.844 18.435 1.00 0.00 N ATOM 0 H ASN B 56 -3.236 11.157 18.579 1.00 0.00 H new ATOM 0 HA ASN B 56 -5.399 11.715 16.772 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -4.596 12.389 19.575 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -5.675 13.519 18.780 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -8.465 11.262 18.589 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -7.692 12.640 17.800 1.00 0.00 H new ATOM 2203 N GLU B 57 -2.910 13.806 17.058 1.00 0.00 N ATOM 2204 CA GLU B 57 -2.306 15.013 16.506 1.00 0.00 C ATOM 2205 C GLU B 57 -1.898 14.799 15.052 1.00 0.00 C ATOM 2206 O GLU B 57 -1.900 15.735 14.253 1.00 0.00 O ATOM 2207 CB GLU B 57 -1.087 15.421 17.336 1.00 0.00 C ATOM 2208 CG GLU B 57 0.008 14.367 17.364 1.00 0.00 C ATOM 2209 CD GLU B 57 1.191 14.779 18.218 1.00 0.00 C ATOM 2210 OE1 GLU B 57 2.227 15.178 17.646 1.00 0.00 O ATOM 2211 OE2 GLU B 57 1.081 14.700 19.461 1.00 0.00 O ATOM 0 H GLU B 57 -2.289 13.260 17.655 1.00 0.00 H new ATOM 0 HA GLU B 57 -3.046 15.812 16.543 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -0.678 16.348 16.934 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -1.406 15.629 18.357 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -0.402 13.432 17.745 1.00 0.00 H new ATOM 0 HG3 GLU B 57 0.348 14.175 16.347 1.00 0.00 H new ATOM 2218 N LEU B 58 -1.549 13.560 14.716 1.00 0.00 N ATOM 2219 CA LEU B 58 -1.143 13.223 13.356 1.00 0.00 C ATOM 2220 C LEU B 58 -2.356 13.110 12.442 1.00 0.00 C ATOM 2221 O LEU B 58 -2.248 13.305 11.233 1.00 0.00 O ATOM 2222 CB LEU B 58 -0.361 11.907 13.341 1.00 0.00 C ATOM 2223 CG LEU B 58 1.078 12.013 12.828 1.00 0.00 C ATOM 2224 CD1 LEU B 58 2.050 12.150 13.988 1.00 0.00 C ATOM 2225 CD2 LEU B 58 1.429 10.802 11.975 1.00 0.00 C ATOM 0 H LEU B 58 -1.539 12.774 15.366 1.00 0.00 H new ATOM 0 HA LEU B 58 -0.501 14.023 12.989 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -0.341 11.503 14.353 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -0.899 11.189 12.722 1.00 0.00 H new ATOM 0 HG LEU B 58 1.158 12.906 12.208 1.00 0.00 H new ATOM 0 HD11 LEU B 58 3.067 12.224 13.604 1.00 0.00 H new ATOM 0 HD12 LEU B 58 1.812 13.048 14.558 1.00 0.00 H new ATOM 0 HD13 LEU B 58 1.969 11.277 14.635 1.00 0.00 H new ATOM 0 HD21 LEU B 58 2.455 10.893 11.618 1.00 0.00 H new ATOM 0 HD22 LEU B 58 1.332 9.896 12.573 1.00 0.00 H new ATOM 0 HD23 LEU B 58 0.752 10.749 11.122 1.00 0.00 H new ATOM 2237 N LYS B 59 -3.509 12.786 13.030 1.00 0.00 N ATOM 2238 CA LYS B 59 -4.758 12.636 12.281 1.00 0.00 C ATOM 2239 C LYS B 59 -4.859 13.642 11.134 1.00 0.00 C ATOM 2240 O LYS B 59 -5.044 13.256 9.981 1.00 0.00 O ATOM 2241 CB LYS B 59 -5.956 12.794 13.220 1.00 0.00 C ATOM 2242 CG LYS B 59 -7.054 11.769 12.981 1.00 0.00 C ATOM 2243 CD LYS B 59 -8.428 12.349 13.269 1.00 0.00 C ATOM 2244 CE LYS B 59 -8.879 13.292 12.166 1.00 0.00 C ATOM 2245 NZ LYS B 59 -9.811 12.628 11.213 1.00 0.00 N ATOM 0 H LYS B 59 -3.603 12.621 14.032 1.00 0.00 H new ATOM 0 HA LYS B 59 -4.763 11.636 11.847 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -5.612 12.713 14.251 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -6.372 13.795 13.100 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -7.013 11.424 11.948 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -6.885 10.898 13.615 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -9.150 11.540 13.375 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -8.406 12.883 14.219 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -9.369 14.159 12.608 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -8.008 13.660 11.624 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -10.095 13.305 10.476 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -9.335 11.815 10.772 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -10.655 12.299 11.725 1.00 0.00 H new ATOM 2259 N PRO B 60 -4.743 14.948 11.430 1.00 0.00 N ATOM 2260 CA PRO B 60 -4.827 15.990 10.404 1.00 0.00 C ATOM 2261 C PRO B 60 -3.679 15.922 9.406 1.00 0.00 C ATOM 2262 O PRO B 60 -3.825 16.326 8.252 1.00 0.00 O ATOM 2263 CB PRO B 60 -4.771 17.295 11.202 1.00 0.00 C ATOM 2264 CG PRO B 60 -4.118 16.930 12.490 1.00 0.00 C ATOM 2265 CD PRO B 60 -4.528 15.513 12.775 1.00 0.00 C ATOM 0 HA PRO B 60 -5.729 15.887 9.801 1.00 0.00 H new ATOM 0 HB2 PRO B 60 -4.200 18.058 10.672 1.00 0.00 H new ATOM 0 HB3 PRO B 60 -5.769 17.701 11.366 1.00 0.00 H new ATOM 0 HG2 PRO B 60 -3.034 17.015 12.416 1.00 0.00 H new ATOM 0 HG3 PRO B 60 -4.436 17.597 13.291 1.00 0.00 H new ATOM 0 HD2 PRO B 60 -3.755 14.972 13.320 1.00 0.00 H new ATOM 0 HD3 PRO B 60 -5.434 15.470 13.380 1.00 0.00 H new ATOM 2273 N LYS B 61 -2.537 15.404 9.846 1.00 0.00 N ATOM 2274 CA LYS B 61 -1.379 15.285 8.971 1.00 0.00 C ATOM 2275 C LYS B 61 -1.623 14.228 7.899 1.00 0.00 C ATOM 2276 O LYS B 61 -1.057 14.296 6.810 1.00 0.00 O ATOM 2277 CB LYS B 61 -0.120 14.943 9.767 1.00 0.00 C ATOM 2278 CG LYS B 61 1.166 15.308 9.040 1.00 0.00 C ATOM 2279 CD LYS B 61 1.719 14.127 8.259 1.00 0.00 C ATOM 2280 CE LYS B 61 2.980 13.573 8.904 1.00 0.00 C ATOM 2281 NZ LYS B 61 4.139 14.493 8.737 1.00 0.00 N ATOM 0 H LYS B 61 -2.390 15.063 10.796 1.00 0.00 H new ATOM 0 HA LYS B 61 -1.227 16.250 8.487 1.00 0.00 H new ATOM 0 HB2 LYS B 61 -0.150 15.465 10.724 1.00 0.00 H new ATOM 0 HB3 LYS B 61 -0.115 13.875 9.986 1.00 0.00 H new ATOM 0 HG2 LYS B 61 0.978 16.139 8.360 1.00 0.00 H new ATOM 0 HG3 LYS B 61 1.909 15.648 9.761 1.00 0.00 H new ATOM 0 HD2 LYS B 61 0.964 13.343 8.201 1.00 0.00 H new ATOM 0 HD3 LYS B 61 1.938 14.436 7.237 1.00 0.00 H new ATOM 0 HE2 LYS B 61 2.801 13.404 9.966 1.00 0.00 H new ATOM 0 HE3 LYS B 61 3.218 12.605 8.463 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 5.013 14.006 9.021 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 4.212 14.782 7.741 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 4.003 15.334 9.333 1.00 0.00 H new ATOM 2295 N ILE B 62 -2.483 13.256 8.204 1.00 0.00 N ATOM 2296 CA ILE B 62 -2.805 12.207 7.245 1.00 0.00 C ATOM 2297 C ILE B 62 -3.234 12.837 5.924 1.00 0.00 C ATOM 2298 O ILE B 62 -2.953 12.309 4.847 1.00 0.00 O ATOM 2299 CB ILE B 62 -3.911 11.265 7.784 1.00 0.00 C ATOM 2300 CG1 ILE B 62 -3.290 10.178 8.664 1.00 0.00 C ATOM 2301 CG2 ILE B 62 -4.707 10.632 6.648 1.00 0.00 C ATOM 2302 CD1 ILE B 62 -2.288 10.710 9.664 1.00 0.00 C ATOM 0 H ILE B 62 -2.964 13.176 9.100 1.00 0.00 H new ATOM 0 HA ILE B 62 -1.913 11.602 7.084 1.00 0.00 H new ATOM 0 HB ILE B 62 -4.600 11.862 8.381 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -4.084 9.657 9.199 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -2.800 9.442 8.027 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -5.474 9.977 7.062 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -5.179 11.415 6.055 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -4.037 10.051 6.014 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -1.889 9.885 10.253 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -1.474 11.205 9.135 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -2.778 11.424 10.326 1.00 0.00 H new ATOM 2314 N ASP B 63 -3.878 13.997 6.020 1.00 0.00 N ATOM 2315 CA ASP B 63 -4.300 14.724 4.842 1.00 0.00 C ATOM 2316 C ASP B 63 -3.060 15.235 4.131 1.00 0.00 C ATOM 2317 O ASP B 63 -2.951 15.160 2.907 1.00 0.00 O ATOM 2318 CB ASP B 63 -5.219 15.887 5.227 1.00 0.00 C ATOM 2319 CG ASP B 63 -6.536 15.856 4.478 1.00 0.00 C ATOM 2320 OD1 ASP B 63 -6.628 16.499 3.412 1.00 0.00 O ATOM 2321 OD2 ASP B 63 -7.476 15.186 4.958 1.00 0.00 O ATOM 0 H ASP B 63 -4.116 14.448 6.904 1.00 0.00 H new ATOM 0 HA ASP B 63 -4.863 14.066 4.180 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -5.413 15.853 6.299 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -4.711 16.830 5.024 1.00 0.00 H new ATOM 2326 N GLU B 64 -2.108 15.724 4.926 1.00 0.00 N ATOM 2327 CA GLU B 64 -0.847 16.219 4.399 1.00 0.00 C ATOM 2328 C GLU B 64 -0.147 15.111 3.625 1.00 0.00 C ATOM 2329 O GLU B 64 0.270 15.301 2.487 1.00 0.00 O ATOM 2330 CB GLU B 64 0.047 16.724 5.536 1.00 0.00 C ATOM 2331 CG GLU B 64 0.085 18.240 5.654 1.00 0.00 C ATOM 2332 CD GLU B 64 -0.383 18.732 7.009 1.00 0.00 C ATOM 2333 OE1 GLU B 64 0.423 18.699 7.964 1.00 0.00 O ATOM 2334 OE2 GLU B 64 -1.554 19.153 7.117 1.00 0.00 O ATOM 0 H GLU B 64 -2.192 15.786 5.941 1.00 0.00 H new ATOM 0 HA GLU B 64 -1.046 17.053 3.726 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -0.305 16.303 6.478 1.00 0.00 H new ATOM 0 HB3 GLU B 64 1.061 16.355 5.381 1.00 0.00 H new ATOM 0 HG2 GLU B 64 1.102 18.589 5.477 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -0.542 18.677 4.877 1.00 0.00 H new ATOM 2341 N ILE B 65 -0.051 13.938 4.246 1.00 0.00 N ATOM 2342 CA ILE B 65 0.569 12.777 3.616 1.00 0.00 C ATOM 2343 C ILE B 65 -0.029 12.543 2.232 1.00 0.00 C ATOM 2344 O ILE B 65 0.679 12.201 1.287 1.00 0.00 O ATOM 2345 CB ILE B 65 0.363 11.508 4.472 1.00 0.00 C ATOM 2346 CG1 ILE B 65 0.938 11.715 5.875 1.00 0.00 C ATOM 2347 CG2 ILE B 65 1.003 10.295 3.808 1.00 0.00 C ATOM 2348 CD1 ILE B 65 2.438 11.903 5.882 1.00 0.00 C ATOM 0 H ILE B 65 -0.397 13.767 5.190 1.00 0.00 H new ATOM 0 HA ILE B 65 1.637 12.978 3.527 1.00 0.00 H new ATOM 0 HB ILE B 65 -0.708 11.323 4.556 1.00 0.00 H new ATOM 0 HG12 ILE B 65 0.467 12.587 6.329 1.00 0.00 H new ATOM 0 HG13 ILE B 65 0.683 10.856 6.496 1.00 0.00 H new ATOM 0 HG21 ILE B 65 0.844 9.414 4.430 1.00 0.00 H new ATOM 0 HG22 ILE B 65 0.550 10.135 2.829 1.00 0.00 H new ATOM 0 HG23 ILE B 65 2.073 10.467 3.689 1.00 0.00 H new ATOM 0 HD11 ILE B 65 2.782 12.045 6.906 1.00 0.00 H new ATOM 0 HD12 ILE B 65 2.917 11.021 5.457 1.00 0.00 H new ATOM 0 HD13 ILE B 65 2.698 12.779 5.288 1.00 0.00 H new ATOM 2360 N SER B 66 -1.342 12.726 2.129 1.00 0.00 N ATOM 2361 CA SER B 66 -2.049 12.527 0.869 1.00 0.00 C ATOM 2362 C SER B 66 -1.870 13.716 -0.073 1.00 0.00 C ATOM 2363 O SER B 66 -1.429 13.553 -1.211 1.00 0.00 O ATOM 2364 CB SER B 66 -3.538 12.295 1.132 1.00 0.00 C ATOM 2365 OG SER B 66 -4.132 11.552 0.081 1.00 0.00 O ATOM 0 H SER B 66 -1.939 13.012 2.905 1.00 0.00 H new ATOM 0 HA SER B 66 -1.621 11.648 0.386 1.00 0.00 H new ATOM 0 HB2 SER B 66 -3.665 11.763 2.075 1.00 0.00 H new ATOM 0 HB3 SER B 66 -4.046 13.254 1.236 1.00 0.00 H new ATOM 0 HG SER B 66 -4.737 12.131 -0.427 1.00 0.00 H new ATOM 2371 N LYS B 67 -2.226 14.908 0.397 1.00 0.00 N ATOM 2372 CA LYS B 67 -2.113 16.112 -0.419 1.00 0.00 C ATOM 2373 C LYS B 67 -0.655 16.434 -0.747 1.00 0.00 C ATOM 2374 O LYS B 67 -0.376 17.163 -1.699 1.00 0.00 O ATOM 2375 CB LYS B 67 -2.770 17.302 0.286 1.00 0.00 C ATOM 2376 CG LYS B 67 -2.333 17.472 1.731 1.00 0.00 C ATOM 2377 CD LYS B 67 -1.804 18.873 1.995 1.00 0.00 C ATOM 2378 CE LYS B 67 -2.934 19.854 2.257 1.00 0.00 C ATOM 2379 NZ LYS B 67 -3.791 19.422 3.396 1.00 0.00 N ATOM 0 H LYS B 67 -2.594 15.066 1.335 1.00 0.00 H new ATOM 0 HA LYS B 67 -2.634 15.923 -1.357 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -2.537 18.213 -0.265 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -3.853 17.179 0.255 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -3.175 17.270 2.393 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -1.560 16.740 1.966 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -1.131 18.854 2.852 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -1.219 19.210 1.139 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -2.518 20.839 2.469 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -3.545 19.952 1.360 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -3.966 20.231 4.025 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -4.697 19.064 3.032 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -3.309 18.669 3.927 1.00 0.00 H new ATOM 2393 N ARG B 68 0.271 15.890 0.038 1.00 0.00 N ATOM 2394 CA ARG B 68 1.692 16.130 -0.191 1.00 0.00 C ATOM 2395 C ARG B 68 2.254 15.134 -1.195 1.00 0.00 C ATOM 2396 O ARG B 68 3.086 15.489 -2.029 1.00 0.00 O ATOM 2397 CB ARG B 68 2.475 16.055 1.120 1.00 0.00 C ATOM 2398 CG ARG B 68 2.178 17.211 2.061 1.00 0.00 C ATOM 2399 CD ARG B 68 2.619 16.903 3.485 1.00 0.00 C ATOM 2400 NE ARG B 68 4.044 17.156 3.683 1.00 0.00 N ATOM 2401 CZ ARG B 68 4.561 18.366 3.890 1.00 0.00 C ATOM 2402 NH1 ARG B 68 3.773 19.433 3.929 1.00 0.00 N ATOM 2403 NH2 ARG B 68 5.868 18.508 4.058 1.00 0.00 N ATOM 0 H ARG B 68 0.065 15.284 0.833 1.00 0.00 H new ATOM 0 HA ARG B 68 1.799 17.134 -0.601 1.00 0.00 H new ATOM 0 HB2 ARG B 68 2.241 15.116 1.622 1.00 0.00 H new ATOM 0 HB3 ARG B 68 3.542 16.040 0.898 1.00 0.00 H new ATOM 0 HG2 ARG B 68 2.687 18.108 1.708 1.00 0.00 H new ATOM 0 HG3 ARG B 68 1.109 17.425 2.049 1.00 0.00 H new ATOM 0 HD2 ARG B 68 2.043 17.511 4.183 1.00 0.00 H new ATOM 0 HD3 ARG B 68 2.401 15.860 3.715 1.00 0.00 H new ATOM 0 HE ARG B 68 4.681 16.359 3.661 1.00 0.00 H new ATOM 0 HH11 ARG B 68 2.767 19.329 3.800 1.00 0.00 H new ATOM 0 HH12 ARG B 68 4.174 20.357 4.088 1.00 0.00 H new ATOM 0 HH21 ARG B 68 6.478 17.691 4.029 1.00 0.00 H new ATOM 0 HH22 ARG B 68 6.264 19.434 4.217 1.00 0.00 H new ATOM 2417 N PHE B 69 1.790 13.889 -1.126 1.00 0.00 N ATOM 2418 CA PHE B 69 2.251 12.866 -2.053 1.00 0.00 C ATOM 2419 C PHE B 69 1.790 13.219 -3.463 1.00 0.00 C ATOM 2420 O PHE B 69 2.520 13.036 -4.437 1.00 0.00 O ATOM 2421 CB PHE B 69 1.742 11.478 -1.628 1.00 0.00 C ATOM 2422 CG PHE B 69 0.762 10.855 -2.586 1.00 0.00 C ATOM 2423 CD1 PHE B 69 -0.592 10.829 -2.294 1.00 0.00 C ATOM 2424 CD2 PHE B 69 1.197 10.302 -3.779 1.00 0.00 C ATOM 2425 CE1 PHE B 69 -1.494 10.262 -3.174 1.00 0.00 C ATOM 2426 CE2 PHE B 69 0.301 9.733 -4.663 1.00 0.00 C ATOM 2427 CZ PHE B 69 -1.047 9.714 -4.360 1.00 0.00 C ATOM 0 H PHE B 69 1.102 13.569 -0.444 1.00 0.00 H new ATOM 0 HA PHE B 69 3.340 12.829 -2.040 1.00 0.00 H new ATOM 0 HB2 PHE B 69 2.596 10.810 -1.515 1.00 0.00 H new ATOM 0 HB3 PHE B 69 1.271 11.561 -0.649 1.00 0.00 H new ATOM 0 HD1 PHE B 69 -0.947 11.257 -1.368 1.00 0.00 H new ATOM 0 HD2 PHE B 69 2.249 10.316 -4.021 1.00 0.00 H new ATOM 0 HE1 PHE B 69 -2.547 10.247 -2.935 1.00 0.00 H new ATOM 0 HE2 PHE B 69 0.653 9.304 -5.589 1.00 0.00 H new ATOM 0 HZ PHE B 69 -1.750 9.271 -5.050 1.00 0.00 H new ATOM 2437 N PHE B 70 0.578 13.752 -3.548 1.00 0.00 N ATOM 2438 CA PHE B 70 0.004 14.171 -4.818 1.00 0.00 C ATOM 2439 C PHE B 70 -0.093 15.693 -4.849 1.00 0.00 C ATOM 2440 O PHE B 70 -1.179 16.259 -4.733 1.00 0.00 O ATOM 2441 CB PHE B 70 -1.379 13.547 -5.014 1.00 0.00 C ATOM 2442 CG PHE B 70 -1.989 13.844 -6.353 1.00 0.00 C ATOM 2443 CD1 PHE B 70 -3.077 14.696 -6.460 1.00 0.00 C ATOM 2444 CD2 PHE B 70 -1.475 13.274 -7.507 1.00 0.00 C ATOM 2445 CE1 PHE B 70 -3.641 14.973 -7.690 1.00 0.00 C ATOM 2446 CE2 PHE B 70 -2.035 13.547 -8.741 1.00 0.00 C ATOM 2447 CZ PHE B 70 -3.119 14.398 -8.833 1.00 0.00 C ATOM 0 H PHE B 70 -0.031 13.905 -2.744 1.00 0.00 H new ATOM 0 HA PHE B 70 0.647 13.832 -5.630 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -1.301 12.467 -4.891 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -2.046 13.910 -4.232 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.489 15.149 -5.570 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.627 12.609 -7.441 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -4.489 15.638 -7.758 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -1.625 13.095 -9.632 1.00 0.00 H new ATOM 0 HZ PHE B 70 -3.558 14.614 -9.796 1.00 0.00 H new ATOM 2457 N PRO B 71 1.057 16.375 -4.988 1.00 0.00 N ATOM 2458 CA PRO B 71 1.110 17.841 -5.014 1.00 0.00 C ATOM 2459 C PRO B 71 0.476 18.424 -6.272 1.00 0.00 C ATOM 2460 O PRO B 71 0.324 17.734 -7.280 1.00 0.00 O ATOM 2461 CB PRO B 71 2.612 18.139 -4.977 1.00 0.00 C ATOM 2462 CG PRO B 71 3.250 16.928 -5.559 1.00 0.00 C ATOM 2463 CD PRO B 71 2.396 15.772 -5.121 1.00 0.00 C ATOM 0 HA PRO B 71 0.553 18.286 -4.189 1.00 0.00 H new ATOM 0 HB2 PRO B 71 2.853 19.031 -5.555 1.00 0.00 H new ATOM 0 HB3 PRO B 71 2.956 18.317 -3.958 1.00 0.00 H new ATOM 0 HG2 PRO B 71 3.295 16.993 -6.646 1.00 0.00 H new ATOM 0 HG3 PRO B 71 4.274 16.815 -5.204 1.00 0.00 H new ATOM 0 HD2 PRO B 71 2.403 14.965 -5.854 1.00 0.00 H new ATOM 0 HD3 PRO B 71 2.743 15.349 -4.178 1.00 0.00 H new ATOM 2471 N ALA B 72 0.107 19.699 -6.206 1.00 0.00 N ATOM 2472 CA ALA B 72 -0.511 20.377 -7.339 1.00 0.00 C ATOM 2473 C ALA B 72 -1.838 19.725 -7.712 1.00 0.00 C ATOM 2474 O ALA B 72 -1.881 18.555 -8.093 1.00 0.00 O ATOM 2475 CB ALA B 72 0.431 20.380 -8.534 1.00 0.00 C ATOM 0 H ALA B 72 0.226 20.284 -5.379 1.00 0.00 H new ATOM 0 HA ALA B 72 -0.711 21.408 -7.046 1.00 0.00 H new ATOM 0 HB1 ALA B 72 -0.045 20.890 -9.371 1.00 0.00 H new ATOM 0 HB2 ALA B 72 1.352 20.899 -8.270 1.00 0.00 H new ATOM 0 HB3 ALA B 72 0.662 19.353 -8.818 1.00 0.00 H new ATOM 2481 N LYS B 73 -2.920 20.488 -7.599 1.00 0.00 N ATOM 2482 CA LYS B 73 -4.249 19.984 -7.925 1.00 0.00 C ATOM 2483 C LYS B 73 -4.436 19.882 -9.435 1.00 0.00 C ATOM 2484 O LYS B 73 -4.310 20.919 -10.118 1.00 0.00 O ATOM 2485 CB LYS B 73 -5.323 20.895 -7.326 1.00 0.00 C ATOM 2486 CG LYS B 73 -6.682 20.227 -7.198 1.00 0.00 C ATOM 2487 CD LYS B 73 -6.718 19.257 -6.028 1.00 0.00 C ATOM 2488 CE LYS B 73 -7.501 17.999 -6.372 1.00 0.00 C ATOM 2489 NZ LYS B 73 -7.169 16.872 -5.457 1.00 0.00 N ATOM 2490 OXT LYS B 73 -4.708 18.764 -9.922 1.00 0.00 O ATOM 0 H LYS B 73 -2.903 21.458 -7.284 1.00 0.00 H new ATOM 0 HA LYS B 73 -4.348 18.987 -7.497 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -4.997 21.229 -6.341 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -5.421 21.785 -7.948 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -7.451 20.988 -7.065 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -6.915 19.695 -8.120 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -5.700 18.988 -5.746 1.00 0.00 H new ATOM 0 HD3 LYS B 73 -7.170 19.744 -5.164 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -8.569 18.209 -6.316 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -7.287 17.707 -7.400 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -7.723 16.033 -5.724 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -6.155 16.654 -5.528 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 -7.397 17.140 -4.479 1.00 0.00 H new TER 2504 LYS B 73