USER MOD reduce.3.24.130724 H: found=0, std=0, add=858, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 855 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 Single : A 1 MET CE :methyl -136:sc= -3.54! (180deg=-5.66!) USER MOD Single : A 1 MET N :NH3+ -127:sc= -1.45 (180deg=-5.46!) USER MOD Single : A 7 SER OG : rot -170:sc= -0.386 USER MOD Single : A 23 GLN : amide:sc= -0.863 K(o=-0.86,f=-1.4!) USER MOD Single : A 30 LYS NZ :NH3+ 154:sc= -0.154 (180deg=-0.591) USER MOD Single : A 31 THR OG1 : rot 84:sc= 0.381 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 33:sc= 0.264 USER MOD Single : A 45 THR OG1 : rot 59:sc= 1.22 USER MOD Single : A 47 GLN : amide:sc= -0.0598 K(o=-0.06,f=-1.4!) USER MOD Single : A 48 ASN : amide:sc= -4.44 K(o=-4.4,f=-8.3!) USER MOD Single : A 51 THR OG1 : rot -173:sc= -1.61! USER MOD Single : A 52 GLN : amide:sc= -4.97! K(o=-5!,f=-2) USER MOD Single : A 55 LYS NZ :NH3+ -149:sc= 0.146 (180deg=-0.462) USER MOD Single : A 57 GLN : amide:sc= -7.83! C(o=-7.8!,f=-5.7!) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 SER OG : rot 71:sc= -0.0831 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 87:sc= 0.28 USER MOD Single : A 72 THR OG1 : rot -85:sc= 0.113 USER MOD Single : A 73 ASN : amide:sc= -1.28 K(o=-1.3,f=-2.9!) USER MOD Single : A 75 THR OG1 : rot 70:sc= -1.79 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 MET CE :methyl -165:sc= -0.166 (180deg=-0.694) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 80:sc= 1.23 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -0.629 X(o=-0.63,f=-0.82) USER MOD Single : A 104 HIS : no HD1:sc= -0.0763 X(o=-0.076,f=-0.44) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.247 3.910 6.529 1.00 25.32 N ATOM 2 CA MET A 1 7.571 3.917 5.917 1.00 2.32 C ATOM 3 C MET A 1 8.656 4.112 6.971 1.00 3.43 C ATOM 4 O MET A 1 9.626 4.838 6.751 1.00 0.43 O ATOM 5 CB MET A 1 7.663 5.023 4.863 1.00 31.34 C ATOM 6 CG MET A 1 7.035 4.646 3.531 1.00 14.15 C ATOM 7 SD MET A 1 5.361 5.291 3.346 1.00 31.31 S ATOM 8 CE MET A 1 4.412 4.008 4.160 1.00 1.02 C ATOM 0 H1 MET A 1 5.735 3.053 6.238 1.00 25.32 H new ATOM 0 H2 MET A 1 6.343 3.921 7.564 1.00 25.32 H new ATOM 0 H3 MET A 1 5.718 4.751 6.221 1.00 25.32 H new ATOM 0 HA MET A 1 7.726 2.952 5.435 1.00 2.32 H new ATOM 0 HB2 MET A 1 7.175 5.919 5.245 1.00 31.34 H new ATOM 0 HB3 MET A 1 8.711 5.275 4.703 1.00 31.34 H new ATOM 0 HG2 MET A 1 7.658 5.024 2.720 1.00 14.15 H new ATOM 0 HG3 MET A 1 7.014 3.560 3.438 1.00 14.15 H new ATOM 0 HE1 MET A 1 3.531 3.772 3.563 1.00 1.02 H new ATOM 0 HE2 MET A 1 5.027 3.114 4.269 1.00 1.02 H new ATOM 0 HE3 MET A 1 4.100 4.356 5.145 1.00 1.02 H new ATOM 18 N PHE A 2 8.487 3.460 8.117 1.00 54.14 N ATOM 19 CA PHE A 2 9.451 3.563 9.205 1.00 2.24 C ATOM 20 C PHE A 2 9.911 2.180 9.658 1.00 54.23 C ATOM 21 O PHE A 2 11.099 1.952 9.882 1.00 64.31 O ATOM 22 CB PHE A 2 8.841 4.322 10.386 1.00 72.42 C ATOM 23 CG PHE A 2 7.667 5.178 10.006 1.00 74.44 C ATOM 24 CD1 PHE A 2 7.809 6.201 9.083 1.00 53.14 C ATOM 25 CD2 PHE A 2 6.421 4.958 10.571 1.00 53.42 C ATOM 26 CE1 PHE A 2 6.730 6.991 8.732 1.00 71.33 C ATOM 27 CE2 PHE A 2 5.338 5.744 10.224 1.00 41.55 C ATOM 28 CZ PHE A 2 5.493 6.761 9.302 1.00 51.31 C ATOM 0 H PHE A 2 7.691 2.854 8.316 1.00 54.14 H new ATOM 0 HA PHE A 2 10.318 4.112 8.837 1.00 2.24 H new ATOM 0 HB2 PHE A 2 8.527 3.605 11.145 1.00 72.42 H new ATOM 0 HB3 PHE A 2 9.608 4.951 10.839 1.00 72.42 H new ATOM 0 HD1 PHE A 2 8.773 6.384 8.632 1.00 53.14 H new ATOM 0 HD2 PHE A 2 6.294 4.163 11.291 1.00 53.42 H new ATOM 0 HE1 PHE A 2 6.854 7.787 8.013 1.00 71.33 H new ATOM 0 HE2 PHE A 2 4.372 5.563 10.673 1.00 41.55 H new ATOM 0 HZ PHE A 2 4.648 7.375 9.027 1.00 51.31 H new ATOM 38 N ASP A 3 8.960 1.262 9.790 1.00 30.21 N ATOM 39 CA ASP A 3 9.266 -0.099 10.215 1.00 33.32 C ATOM 40 C ASP A 3 7.994 -0.937 10.312 1.00 3.35 C ATOM 41 O ASP A 3 7.796 -1.874 9.539 1.00 42.02 O ATOM 42 CB ASP A 3 9.987 -0.085 11.564 1.00 35.41 C ATOM 43 CG ASP A 3 11.476 -0.335 11.427 1.00 35.34 C ATOM 44 OD1 ASP A 3 11.853 -1.418 10.932 1.00 52.12 O ATOM 45 OD2 ASP A 3 12.264 0.552 11.815 1.00 13.12 O ATOM 0 H ASP A 3 7.971 1.435 9.609 1.00 30.21 H new ATOM 0 HA ASP A 3 9.920 -0.549 9.468 1.00 33.32 H new ATOM 0 HB2 ASP A 3 9.826 0.878 12.049 1.00 35.41 H new ATOM 0 HB3 ASP A 3 9.552 -0.845 12.213 1.00 35.41 H new ATOM 50 N ILE A 4 7.137 -0.593 11.268 1.00 42.11 N ATOM 51 CA ILE A 4 5.885 -1.313 11.466 1.00 65.12 C ATOM 52 C ILE A 4 6.142 -2.747 11.916 1.00 33.21 C ATOM 53 O ILE A 4 5.212 -3.541 12.053 1.00 22.42 O ATOM 54 CB ILE A 4 5.039 -1.334 10.180 1.00 73.35 C ATOM 55 CG1 ILE A 4 4.585 0.082 9.818 1.00 33.54 C ATOM 56 CG2 ILE A 4 3.839 -2.254 10.351 1.00 52.35 C ATOM 57 CD1 ILE A 4 3.756 0.744 10.896 1.00 34.34 C ATOM 0 H ILE A 4 7.287 0.179 11.917 1.00 42.11 H new ATOM 0 HA ILE A 4 5.335 -0.783 12.244 1.00 65.12 H new ATOM 0 HB ILE A 4 5.653 -1.717 9.365 1.00 73.35 H new ATOM 0 HG12 ILE A 4 5.463 0.696 9.617 1.00 33.54 H new ATOM 0 HG13 ILE A 4 4.005 0.044 8.896 1.00 33.54 H new ATOM 0 HG21 ILE A 4 3.250 -2.259 9.434 1.00 52.35 H new ATOM 0 HG22 ILE A 4 4.184 -3.265 10.566 1.00 52.35 H new ATOM 0 HG23 ILE A 4 3.222 -1.898 11.176 1.00 52.35 H new ATOM 0 HD11 ILE A 4 3.469 1.744 10.572 1.00 34.34 H new ATOM 0 HD12 ILE A 4 2.860 0.152 11.081 1.00 34.34 H new ATOM 0 HD13 ILE A 4 4.341 0.814 11.813 1.00 34.34 H new ATOM 69 N GLY A 5 7.410 -3.072 12.147 1.00 44.21 N ATOM 70 CA GLY A 5 7.767 -4.410 12.581 1.00 15.13 C ATOM 71 C GLY A 5 7.772 -4.547 14.091 1.00 74.21 C ATOM 72 O GLY A 5 8.277 -5.532 14.630 1.00 2.33 O ATOM 0 H GLY A 5 8.197 -2.432 12.041 1.00 44.21 H new ATOM 0 HA2 GLY A 5 7.064 -5.126 12.156 1.00 15.13 H new ATOM 0 HA3 GLY A 5 8.753 -4.664 12.193 1.00 15.13 H new ATOM 76 N PHE A 6 7.209 -3.557 14.775 1.00 11.24 N ATOM 77 CA PHE A 6 7.153 -3.570 16.233 1.00 71.04 C ATOM 78 C PHE A 6 6.079 -2.614 16.744 1.00 30.32 C ATOM 79 O PHE A 6 5.367 -2.918 17.701 1.00 21.43 O ATOM 80 CB PHE A 6 8.513 -3.188 16.820 1.00 62.21 C ATOM 81 CG PHE A 6 8.884 -1.751 16.588 1.00 21.32 C ATOM 82 CD1 PHE A 6 9.104 -1.277 15.305 1.00 12.10 C ATOM 83 CD2 PHE A 6 9.014 -0.875 17.654 1.00 73.03 C ATOM 84 CE1 PHE A 6 9.445 0.045 15.088 1.00 31.12 C ATOM 85 CE2 PHE A 6 9.354 0.448 17.443 1.00 21.20 C ATOM 86 CZ PHE A 6 9.571 0.908 16.159 1.00 42.11 C ATOM 0 H PHE A 6 6.785 -2.736 14.344 1.00 11.24 H new ATOM 0 HA PHE A 6 6.898 -4.580 16.553 1.00 71.04 H new ATOM 0 HB2 PHE A 6 8.505 -3.384 17.892 1.00 62.21 H new ATOM 0 HB3 PHE A 6 9.280 -3.828 16.384 1.00 62.21 H new ATOM 0 HD1 PHE A 6 9.008 -1.948 14.464 1.00 12.10 H new ATOM 0 HD2 PHE A 6 8.848 -1.230 18.660 1.00 73.03 H new ATOM 0 HE1 PHE A 6 9.613 0.402 14.083 1.00 31.12 H new ATOM 0 HE2 PHE A 6 9.450 1.122 18.282 1.00 21.20 H new ATOM 0 HZ PHE A 6 9.839 1.941 15.993 1.00 42.11 H new ATOM 96 N SER A 7 5.969 -1.457 16.099 1.00 22.24 N ATOM 97 CA SER A 7 4.986 -0.454 16.491 1.00 72.20 C ATOM 98 C SER A 7 3.570 -1.013 16.389 1.00 52.11 C ATOM 99 O SER A 7 2.862 -1.125 17.389 1.00 23.14 O ATOM 100 CB SER A 7 5.119 0.792 15.613 1.00 62.50 C ATOM 101 OG SER A 7 5.090 0.452 14.238 1.00 62.44 O ATOM 0 H SER A 7 6.548 -1.191 15.303 1.00 22.24 H new ATOM 0 HA SER A 7 5.176 -0.180 17.529 1.00 72.20 H new ATOM 0 HB2 SER A 7 4.309 1.486 15.836 1.00 62.50 H new ATOM 0 HB3 SER A 7 6.052 1.306 15.844 1.00 62.50 H new ATOM 0 HG SER A 7 5.333 1.236 13.702 1.00 62.44 H new ATOM 107 N GLU A 8 3.164 -1.361 15.172 1.00 61.42 N ATOM 108 CA GLU A 8 1.832 -1.908 14.938 1.00 4.44 C ATOM 109 C GLU A 8 1.704 -3.304 15.539 1.00 22.45 C ATOM 110 O GLU A 8 0.638 -3.690 16.021 1.00 21.11 O ATOM 111 CB GLU A 8 1.532 -1.956 13.439 1.00 65.32 C ATOM 112 CG GLU A 8 1.106 -0.618 12.860 1.00 55.13 C ATOM 113 CD GLU A 8 0.564 -0.739 11.448 1.00 2.14 C ATOM 114 OE1 GLU A 8 0.840 -1.766 10.794 1.00 64.12 O ATOM 115 OE2 GLU A 8 -0.135 0.193 10.999 1.00 62.25 O ATOM 0 H GLU A 8 3.738 -1.274 14.333 1.00 61.42 H new ATOM 0 HA GLU A 8 1.108 -1.254 15.425 1.00 4.44 H new ATOM 0 HB2 GLU A 8 2.419 -2.305 12.911 1.00 65.32 H new ATOM 0 HB3 GLU A 8 0.745 -2.688 13.258 1.00 65.32 H new ATOM 0 HG2 GLU A 8 0.344 -0.175 13.501 1.00 55.13 H new ATOM 0 HG3 GLU A 8 1.958 0.062 12.861 1.00 55.13 H new ATOM 122 N LEU A 9 2.797 -4.058 15.507 1.00 25.32 N ATOM 123 CA LEU A 9 2.809 -5.413 16.048 1.00 32.10 C ATOM 124 C LEU A 9 2.529 -5.403 17.547 1.00 35.33 C ATOM 125 O LEU A 9 1.592 -6.050 18.019 1.00 24.11 O ATOM 126 CB LEU A 9 4.157 -6.081 15.774 1.00 22.50 C ATOM 127 CG LEU A 9 4.142 -7.607 15.672 1.00 74.13 C ATOM 128 CD1 LEU A 9 3.157 -8.060 14.605 1.00 33.53 C ATOM 129 CD2 LEU A 9 5.537 -8.136 15.371 1.00 14.32 C ATOM 0 H LEU A 9 3.687 -3.754 15.112 1.00 25.32 H new ATOM 0 HA LEU A 9 2.022 -5.982 15.554 1.00 32.10 H new ATOM 0 HB2 LEU A 9 4.557 -5.679 14.843 1.00 22.50 H new ATOM 0 HB3 LEU A 9 4.849 -5.797 16.567 1.00 22.50 H new ATOM 0 HG LEU A 9 3.821 -8.013 16.631 1.00 74.13 H new ATOM 0 HD11 LEU A 9 3.159 -9.148 14.546 1.00 33.53 H new ATOM 0 HD12 LEU A 9 2.156 -7.713 14.863 1.00 33.53 H new ATOM 0 HD13 LEU A 9 3.448 -7.644 13.641 1.00 33.53 H new ATOM 0 HD21 LEU A 9 5.507 -9.223 15.302 1.00 14.32 H new ATOM 0 HD22 LEU A 9 5.887 -7.722 14.425 1.00 14.32 H new ATOM 0 HD23 LEU A 9 6.218 -7.842 16.170 1.00 14.32 H new ATOM 141 N LEU A 10 3.344 -4.664 18.291 1.00 30.34 N ATOM 142 CA LEU A 10 3.183 -4.568 19.738 1.00 12.21 C ATOM 143 C LEU A 10 1.821 -3.981 20.096 1.00 2.14 C ATOM 144 O LEU A 10 1.073 -4.557 20.887 1.00 24.44 O ATOM 145 CB LEU A 10 4.296 -3.707 20.339 1.00 72.33 C ATOM 146 CG LEU A 10 5.692 -4.331 20.354 1.00 40.53 C ATOM 147 CD1 LEU A 10 6.759 -3.248 20.391 1.00 4.12 C ATOM 148 CD2 LEU A 10 5.843 -5.272 21.540 1.00 70.25 C ATOM 0 H LEU A 10 4.123 -4.122 17.917 1.00 30.34 H new ATOM 0 HA LEU A 10 3.246 -5.574 20.154 1.00 12.21 H new ATOM 0 HB2 LEU A 10 4.344 -2.771 19.783 1.00 72.33 H new ATOM 0 HB3 LEU A 10 4.021 -3.456 21.363 1.00 72.33 H new ATOM 0 HG LEU A 10 5.821 -4.909 19.439 1.00 40.53 H new ATOM 0 HD11 LEU A 10 7.746 -3.710 20.401 1.00 4.12 H new ATOM 0 HD12 LEU A 10 6.664 -2.614 19.510 1.00 4.12 H new ATOM 0 HD13 LEU A 10 6.632 -2.643 21.289 1.00 4.12 H new ATOM 0 HD21 LEU A 10 6.842 -5.707 21.535 1.00 70.25 H new ATOM 0 HD22 LEU A 10 5.694 -4.717 22.466 1.00 70.25 H new ATOM 0 HD23 LEU A 10 5.101 -6.067 21.470 1.00 70.25 H new ATOM 160 N LEU A 11 1.504 -2.833 19.508 1.00 5.21 N ATOM 161 CA LEU A 11 0.231 -2.168 19.763 1.00 21.21 C ATOM 162 C LEU A 11 -0.932 -3.145 19.617 1.00 44.42 C ATOM 163 O LEU A 11 -1.626 -3.449 20.587 1.00 72.15 O ATOM 164 CB LEU A 11 0.047 -0.991 18.804 1.00 11.44 C ATOM 165 CG LEU A 11 -1.304 -0.278 18.869 1.00 52.51 C ATOM 166 CD1 LEU A 11 -1.172 1.053 19.594 1.00 65.22 C ATOM 167 CD2 LEU A 11 -1.866 -0.071 17.470 1.00 44.13 C ATOM 0 H LEU A 11 2.111 -2.343 18.851 1.00 5.21 H new ATOM 0 HA LEU A 11 0.242 -1.795 20.787 1.00 21.21 H new ATOM 0 HB2 LEU A 11 0.831 -0.260 19.003 1.00 11.44 H new ATOM 0 HB3 LEU A 11 0.197 -1.351 17.786 1.00 11.44 H new ATOM 0 HG LEU A 11 -1.997 -0.906 19.429 1.00 52.51 H new ATOM 0 HD11 LEU A 11 -2.144 1.546 19.630 1.00 65.22 H new ATOM 0 HD12 LEU A 11 -0.815 0.880 20.609 1.00 65.22 H new ATOM 0 HD13 LEU A 11 -0.463 1.688 19.063 1.00 65.22 H new ATOM 0 HD21 LEU A 11 -2.828 0.438 17.536 1.00 44.13 H new ATOM 0 HD22 LEU A 11 -1.174 0.536 16.886 1.00 44.13 H new ATOM 0 HD23 LEU A 11 -2.000 -1.038 16.985 1.00 44.13 H new ATOM 179 N VAL A 12 -1.137 -3.634 18.398 1.00 22.11 N ATOM 180 CA VAL A 12 -2.213 -4.579 18.125 1.00 71.00 C ATOM 181 C VAL A 12 -2.172 -5.755 19.095 1.00 44.43 C ATOM 182 O VAL A 12 -3.208 -6.215 19.573 1.00 31.45 O ATOM 183 CB VAL A 12 -2.137 -5.114 16.683 1.00 74.42 C ATOM 184 CG1 VAL A 12 -3.237 -6.135 16.434 1.00 71.43 C ATOM 185 CG2 VAL A 12 -2.225 -3.970 15.685 1.00 52.23 C ATOM 0 H VAL A 12 -0.572 -3.391 17.584 1.00 22.11 H new ATOM 0 HA VAL A 12 -3.150 -4.038 18.255 1.00 71.00 H new ATOM 0 HB VAL A 12 -1.176 -5.610 16.548 1.00 74.42 H new ATOM 0 HG11 VAL A 12 -3.168 -6.502 15.410 1.00 71.43 H new ATOM 0 HG12 VAL A 12 -3.123 -6.969 17.127 1.00 71.43 H new ATOM 0 HG13 VAL A 12 -4.209 -5.667 16.586 1.00 71.43 H new ATOM 0 HG21 VAL A 12 -2.170 -4.367 14.671 1.00 52.23 H new ATOM 0 HG22 VAL A 12 -3.170 -3.443 15.818 1.00 52.23 H new ATOM 0 HG23 VAL A 12 -1.398 -3.279 15.850 1.00 52.23 H new ATOM 195 N PHE A 13 -0.966 -6.236 19.381 1.00 15.01 N ATOM 196 CA PHE A 13 -0.789 -7.359 20.294 1.00 30.11 C ATOM 197 C PHE A 13 -1.348 -7.030 21.676 1.00 65.44 C ATOM 198 O PHE A 13 -1.817 -7.914 22.393 1.00 74.11 O ATOM 199 CB PHE A 13 0.693 -7.725 20.404 1.00 14.14 C ATOM 200 CG PHE A 13 0.940 -9.009 21.144 1.00 14.53 C ATOM 201 CD1 PHE A 13 0.510 -10.218 20.623 1.00 60.04 C ATOM 202 CD2 PHE A 13 1.601 -9.005 22.362 1.00 60.41 C ATOM 203 CE1 PHE A 13 0.736 -11.401 21.301 1.00 61.13 C ATOM 204 CE2 PHE A 13 1.830 -10.185 23.044 1.00 22.22 C ATOM 205 CZ PHE A 13 1.396 -11.384 22.514 1.00 62.43 C ATOM 0 H PHE A 13 -0.098 -5.866 18.994 1.00 15.01 H new ATOM 0 HA PHE A 13 -1.338 -8.211 19.893 1.00 30.11 H new ATOM 0 HB2 PHE A 13 1.115 -7.806 19.402 1.00 14.14 H new ATOM 0 HB3 PHE A 13 1.222 -6.917 20.908 1.00 14.14 H new ATOM 0 HD1 PHE A 13 -0.008 -10.237 19.676 1.00 60.04 H new ATOM 0 HD2 PHE A 13 1.941 -8.070 22.783 1.00 60.41 H new ATOM 0 HE1 PHE A 13 0.397 -12.337 20.883 1.00 61.13 H new ATOM 0 HE2 PHE A 13 2.348 -10.169 23.991 1.00 22.22 H new ATOM 0 HZ PHE A 13 1.572 -12.307 23.047 1.00 62.43 H new ATOM 215 N ILE A 14 -1.292 -5.754 22.041 1.00 22.33 N ATOM 216 CA ILE A 14 -1.792 -5.309 23.336 1.00 51.42 C ATOM 217 C ILE A 14 -3.276 -4.965 23.263 1.00 40.21 C ATOM 218 O ILE A 14 -4.074 -5.439 24.072 1.00 23.22 O ATOM 219 CB ILE A 14 -1.017 -4.080 23.846 1.00 5.05 C ATOM 220 CG1 ILE A 14 0.279 -4.517 24.533 1.00 44.33 C ATOM 221 CG2 ILE A 14 -1.880 -3.268 24.800 1.00 4.43 C ATOM 222 CD1 ILE A 14 1.522 -4.220 23.722 1.00 31.24 C ATOM 0 H ILE A 14 -0.906 -5.011 21.459 1.00 22.33 H new ATOM 0 HA ILE A 14 -1.646 -6.135 24.032 1.00 51.42 H new ATOM 0 HB ILE A 14 -0.761 -3.451 22.994 1.00 5.05 H new ATOM 0 HG12 ILE A 14 0.356 -4.016 25.498 1.00 44.33 H new ATOM 0 HG13 ILE A 14 0.232 -5.588 24.732 1.00 44.33 H new ATOM 0 HG21 ILE A 14 -1.318 -2.403 25.152 1.00 4.43 H new ATOM 0 HG22 ILE A 14 -2.778 -2.931 24.282 1.00 4.43 H new ATOM 0 HG23 ILE A 14 -2.163 -3.887 25.651 1.00 4.43 H new ATOM 0 HD11 ILE A 14 2.403 -4.556 24.269 1.00 31.24 H new ATOM 0 HD12 ILE A 14 1.467 -4.743 22.767 1.00 31.24 H new ATOM 0 HD13 ILE A 14 1.593 -3.147 23.545 1.00 31.24 H new ATOM 234 N ILE A 15 -3.639 -4.139 22.287 1.00 11.04 N ATOM 235 CA ILE A 15 -5.028 -3.734 22.107 1.00 23.31 C ATOM 236 C ILE A 15 -5.960 -4.940 22.139 1.00 33.31 C ATOM 237 O ILE A 15 -6.977 -4.934 22.831 1.00 13.33 O ATOM 238 CB ILE A 15 -5.227 -2.981 20.779 1.00 45.23 C ATOM 239 CG1 ILE A 15 -4.355 -1.724 20.745 1.00 41.32 C ATOM 240 CG2 ILE A 15 -6.692 -2.621 20.588 1.00 14.11 C ATOM 241 CD1 ILE A 15 -4.602 -0.786 21.905 1.00 11.43 C ATOM 0 H ILE A 15 -2.991 -3.737 21.609 1.00 11.04 H new ATOM 0 HA ILE A 15 -5.272 -3.067 22.934 1.00 23.31 H new ATOM 0 HB ILE A 15 -4.924 -3.633 19.960 1.00 45.23 H new ATOM 0 HG12 ILE A 15 -3.306 -2.019 20.744 1.00 41.32 H new ATOM 0 HG13 ILE A 15 -4.537 -1.191 19.812 1.00 41.32 H new ATOM 0 HG21 ILE A 15 -6.816 -2.089 19.645 1.00 14.11 H new ATOM 0 HG22 ILE A 15 -7.291 -3.531 20.573 1.00 14.11 H new ATOM 0 HG23 ILE A 15 -7.020 -1.984 21.409 1.00 14.11 H new ATOM 0 HD11 ILE A 15 -3.950 0.083 21.816 1.00 11.43 H new ATOM 0 HD12 ILE A 15 -5.642 -0.461 21.895 1.00 11.43 H new ATOM 0 HD13 ILE A 15 -4.392 -1.303 22.842 1.00 11.43 H new ATOM 253 N GLY A 16 -5.605 -5.977 21.385 1.00 12.43 N ATOM 254 CA GLY A 16 -6.420 -7.177 21.343 1.00 41.32 C ATOM 255 C GLY A 16 -6.501 -7.870 22.688 1.00 31.32 C ATOM 256 O GLY A 16 -7.506 -8.507 23.008 1.00 53.54 O ATOM 0 H GLY A 16 -4.768 -6.007 20.803 1.00 12.43 H new ATOM 0 HA2 GLY A 16 -7.425 -6.918 21.010 1.00 41.32 H new ATOM 0 HA3 GLY A 16 -6.008 -7.867 20.607 1.00 41.32 H new ATOM 260 N LEU A 17 -5.440 -7.750 23.479 1.00 54.11 N ATOM 261 CA LEU A 17 -5.395 -8.372 24.798 1.00 64.04 C ATOM 262 C LEU A 17 -6.226 -7.581 25.802 1.00 15.01 C ATOM 263 O LEU A 17 -7.002 -8.152 26.569 1.00 62.52 O ATOM 264 CB LEU A 17 -3.948 -8.475 25.285 1.00 52.13 C ATOM 265 CG LEU A 17 -3.213 -9.770 24.936 1.00 12.35 C ATOM 266 CD1 LEU A 17 -3.396 -10.108 23.465 1.00 30.12 C ATOM 267 CD2 LEU A 17 -1.735 -9.653 25.279 1.00 11.50 C ATOM 0 H LEU A 17 -4.600 -7.228 23.230 1.00 54.11 H new ATOM 0 HA LEU A 17 -5.817 -9.374 24.715 1.00 64.04 H new ATOM 0 HB2 LEU A 17 -3.386 -7.638 24.870 1.00 52.13 H new ATOM 0 HB3 LEU A 17 -3.941 -8.358 26.369 1.00 52.13 H new ATOM 0 HG LEU A 17 -3.640 -10.579 25.529 1.00 12.35 H new ATOM 0 HD11 LEU A 17 -2.866 -11.032 23.235 1.00 30.12 H new ATOM 0 HD12 LEU A 17 -4.457 -10.235 23.250 1.00 30.12 H new ATOM 0 HD13 LEU A 17 -2.996 -9.299 22.853 1.00 30.12 H new ATOM 0 HD21 LEU A 17 -1.228 -10.583 25.024 1.00 11.50 H new ATOM 0 HD22 LEU A 17 -1.294 -8.832 24.713 1.00 11.50 H new ATOM 0 HD23 LEU A 17 -1.623 -9.459 26.346 1.00 11.50 H new ATOM 279 N VAL A 18 -6.061 -6.262 25.791 1.00 75.01 N ATOM 280 CA VAL A 18 -6.799 -5.392 26.698 1.00 14.44 C ATOM 281 C VAL A 18 -8.256 -5.258 26.269 1.00 71.30 C ATOM 282 O VAL A 18 -9.116 -4.872 27.062 1.00 64.45 O ATOM 283 CB VAL A 18 -6.166 -3.989 26.770 1.00 74.21 C ATOM 284 CG1 VAL A 18 -4.780 -4.060 27.391 1.00 63.21 C ATOM 285 CG2 VAL A 18 -6.108 -3.360 25.386 1.00 72.30 C ATOM 0 H VAL A 18 -5.423 -5.773 25.164 1.00 75.01 H new ATOM 0 HA VAL A 18 -6.755 -5.854 27.684 1.00 14.44 H new ATOM 0 HB VAL A 18 -6.790 -3.359 27.404 1.00 74.21 H new ATOM 0 HG11 VAL A 18 -4.349 -3.060 27.434 1.00 63.21 H new ATOM 0 HG12 VAL A 18 -4.854 -4.467 28.400 1.00 63.21 H new ATOM 0 HG13 VAL A 18 -4.143 -4.705 26.786 1.00 63.21 H new ATOM 0 HG21 VAL A 18 -5.658 -2.370 25.455 1.00 72.30 H new ATOM 0 HG22 VAL A 18 -5.507 -3.986 24.727 1.00 72.30 H new ATOM 0 HG23 VAL A 18 -7.117 -3.273 24.983 1.00 72.30 H new ATOM 295 N VAL A 19 -8.528 -5.581 25.008 1.00 4.33 N ATOM 296 CA VAL A 19 -9.881 -5.499 24.473 1.00 52.23 C ATOM 297 C VAL A 19 -10.567 -6.860 24.501 1.00 63.31 C ATOM 298 O VAL A 19 -11.538 -7.064 25.230 1.00 12.44 O ATOM 299 CB VAL A 19 -9.882 -4.966 23.028 1.00 42.24 C ATOM 300 CG1 VAL A 19 -11.257 -5.131 22.398 1.00 4.51 C ATOM 301 CG2 VAL A 19 -9.443 -3.509 22.997 1.00 34.52 C ATOM 0 H VAL A 19 -7.829 -5.902 24.338 1.00 4.33 H new ATOM 0 HA VAL A 19 -10.431 -4.805 25.109 1.00 52.23 H new ATOM 0 HB VAL A 19 -9.170 -5.549 22.444 1.00 42.24 H new ATOM 0 HG11 VAL A 19 -11.238 -4.749 21.377 1.00 4.51 H new ATOM 0 HG12 VAL A 19 -11.527 -6.187 22.385 1.00 4.51 H new ATOM 0 HG13 VAL A 19 -11.993 -4.576 22.980 1.00 4.51 H new ATOM 0 HG21 VAL A 19 -9.450 -3.149 21.968 1.00 34.52 H new ATOM 0 HG22 VAL A 19 -10.129 -2.910 23.596 1.00 34.52 H new ATOM 0 HG23 VAL A 19 -8.436 -3.424 23.405 1.00 34.52 H new ATOM 311 N LEU A 20 -10.055 -7.791 23.703 1.00 41.43 N ATOM 312 CA LEU A 20 -10.617 -9.135 23.636 1.00 72.11 C ATOM 313 C LEU A 20 -10.461 -9.858 24.970 1.00 10.42 C ATOM 314 O LEU A 20 -11.173 -10.820 25.254 1.00 53.31 O ATOM 315 CB LEU A 20 -9.938 -9.939 22.525 1.00 12.54 C ATOM 316 CG LEU A 20 -10.676 -11.194 22.058 1.00 25.14 C ATOM 317 CD1 LEU A 20 -12.168 -10.926 21.948 1.00 74.24 C ATOM 318 CD2 LEU A 20 -10.118 -11.676 20.727 1.00 50.21 C ATOM 0 H LEU A 20 -9.251 -7.639 23.093 1.00 41.43 H new ATOM 0 HA LEU A 20 -11.680 -9.046 23.414 1.00 72.11 H new ATOM 0 HB2 LEU A 20 -9.796 -9.284 21.665 1.00 12.54 H new ATOM 0 HB3 LEU A 20 -8.946 -10.232 22.870 1.00 12.54 H new ATOM 0 HG LEU A 20 -10.523 -11.979 22.799 1.00 25.14 H new ATOM 0 HD11 LEU A 20 -12.677 -11.831 21.614 1.00 74.24 H new ATOM 0 HD12 LEU A 20 -12.557 -10.629 22.922 1.00 74.24 H new ATOM 0 HD13 LEU A 20 -12.342 -10.126 21.229 1.00 74.24 H new ATOM 0 HD21 LEU A 20 -10.655 -12.570 20.410 1.00 50.21 H new ATOM 0 HD22 LEU A 20 -10.240 -10.894 19.977 1.00 50.21 H new ATOM 0 HD23 LEU A 20 -9.059 -11.909 20.839 1.00 50.21 H new ATOM 330 N GLY A 21 -9.525 -9.385 25.787 1.00 4.14 N ATOM 331 CA GLY A 21 -9.293 -9.996 27.083 1.00 34.41 C ATOM 332 C GLY A 21 -8.354 -11.184 27.005 1.00 52.45 C ATOM 333 O GLY A 21 -8.506 -12.068 26.162 1.00 74.13 O ATOM 0 H GLY A 21 -8.923 -8.589 25.575 1.00 4.14 H new ATOM 0 HA2 GLY A 21 -8.877 -9.252 27.763 1.00 34.41 H new ATOM 0 HA3 GLY A 21 -10.245 -10.317 27.506 1.00 34.41 H new ATOM 337 N PRO A 22 -7.355 -11.213 27.899 1.00 42.43 N ATOM 338 CA PRO A 22 -6.367 -12.294 27.947 1.00 63.43 C ATOM 339 C PRO A 22 -6.969 -13.609 28.431 1.00 52.20 C ATOM 340 O PRO A 22 -6.255 -14.589 28.640 1.00 50.03 O ATOM 341 CB PRO A 22 -5.328 -11.782 28.947 1.00 2.31 C ATOM 342 CG PRO A 22 -6.075 -10.829 29.815 1.00 52.24 C ATOM 343 CD PRO A 22 -7.113 -10.192 28.932 1.00 1.11 C ATOM 0 HA PRO A 22 -5.957 -12.515 26.961 1.00 63.43 H new ATOM 0 HB2 PRO A 22 -4.903 -12.599 29.530 1.00 2.31 H new ATOM 0 HB3 PRO A 22 -4.499 -11.289 28.439 1.00 2.31 H new ATOM 0 HG2 PRO A 22 -6.540 -11.347 30.653 1.00 52.24 H new ATOM 0 HG3 PRO A 22 -5.406 -10.078 30.236 1.00 52.24 H new ATOM 0 HD2 PRO A 22 -8.022 -9.957 29.486 1.00 1.11 H new ATOM 0 HD3 PRO A 22 -6.754 -9.259 28.498 1.00 1.11 H new ATOM 351 N GLN A 23 -8.287 -13.621 28.607 1.00 65.31 N ATOM 352 CA GLN A 23 -8.984 -14.816 29.067 1.00 21.30 C ATOM 353 C GLN A 23 -8.854 -15.947 28.052 1.00 21.20 C ATOM 354 O GLN A 23 -8.655 -17.105 28.420 1.00 32.03 O ATOM 355 CB GLN A 23 -10.461 -14.506 29.316 1.00 21.34 C ATOM 356 CG GLN A 23 -11.160 -13.877 28.123 1.00 54.44 C ATOM 357 CD GLN A 23 -12.051 -12.714 28.515 1.00 73.35 C ATOM 358 OE1 GLN A 23 -12.051 -11.669 27.863 1.00 24.40 O ATOM 359 NE2 GLN A 23 -12.818 -12.890 29.584 1.00 32.42 N ATOM 0 H GLN A 23 -8.892 -12.818 28.438 1.00 65.31 H new ATOM 0 HA GLN A 23 -8.524 -15.137 30.002 1.00 21.30 H new ATOM 0 HB2 GLN A 23 -10.977 -15.428 29.584 1.00 21.34 H new ATOM 0 HB3 GLN A 23 -10.544 -13.834 30.171 1.00 21.34 H new ATOM 0 HG2 GLN A 23 -10.412 -13.532 27.409 1.00 54.44 H new ATOM 0 HG3 GLN A 23 -11.759 -14.634 27.617 1.00 54.44 H new ATOM 0 HE21 GLN A 23 -12.786 -13.772 30.095 1.00 32.42 H new ATOM 0 HE22 GLN A 23 -13.439 -12.143 29.895 1.00 32.42 H new ATOM 368 N ARG A 24 -8.968 -15.604 26.773 1.00 4.12 N ATOM 369 CA ARG A 24 -8.864 -16.591 25.705 1.00 13.21 C ATOM 370 C ARG A 24 -8.012 -16.061 24.556 1.00 42.12 C ATOM 371 O ARG A 24 -8.324 -16.279 23.385 1.00 75.44 O ATOM 372 CB ARG A 24 -10.256 -16.965 25.192 1.00 63.45 C ATOM 373 CG ARG A 24 -11.177 -15.771 25.004 1.00 74.53 C ATOM 374 CD ARG A 24 -10.825 -14.987 23.750 1.00 64.25 C ATOM 375 NE ARG A 24 -9.884 -13.905 24.027 1.00 25.41 N ATOM 376 CZ ARG A 24 -8.955 -13.501 23.168 1.00 41.42 C ATOM 377 NH1 ARG A 24 -8.844 -14.085 21.983 1.00 40.43 N ATOM 378 NH2 ARG A 24 -8.135 -12.509 23.493 1.00 32.22 N ATOM 0 H ARG A 24 -9.132 -14.650 26.451 1.00 4.12 H new ATOM 0 HA ARG A 24 -8.382 -17.480 26.111 1.00 13.21 H new ATOM 0 HB2 ARG A 24 -10.155 -17.488 24.241 1.00 63.45 H new ATOM 0 HB3 ARG A 24 -10.717 -17.662 25.892 1.00 63.45 H new ATOM 0 HG2 ARG A 24 -12.210 -16.113 24.942 1.00 74.53 H new ATOM 0 HG3 ARG A 24 -11.109 -15.118 25.874 1.00 74.53 H new ATOM 0 HD2 ARG A 24 -10.394 -15.661 23.010 1.00 64.25 H new ATOM 0 HD3 ARG A 24 -11.734 -14.574 23.314 1.00 64.25 H new ATOM 0 HE ARG A 24 -9.943 -13.434 24.930 1.00 25.41 H new ATOM 0 HH11 ARG A 24 -9.473 -14.847 21.729 1.00 40.43 H new ATOM 0 HH12 ARG A 24 -8.130 -13.773 21.325 1.00 40.43 H new ATOM 0 HH21 ARG A 24 -8.218 -12.056 24.403 1.00 32.22 H new ATOM 0 HH22 ARG A 24 -7.422 -12.200 22.833 1.00 32.22 H new ATOM 392 N LEU A 25 -6.934 -15.363 24.898 1.00 35.22 N ATOM 393 CA LEU A 25 -6.036 -14.801 23.895 1.00 34.13 C ATOM 394 C LEU A 25 -5.324 -15.906 23.122 1.00 24.02 C ATOM 395 O LEU A 25 -5.343 -15.949 21.892 1.00 52.41 O ATOM 396 CB LEU A 25 -5.009 -13.883 24.560 1.00 62.24 C ATOM 397 CG LEU A 25 -3.880 -13.378 23.661 1.00 64.23 C ATOM 398 CD1 LEU A 25 -2.744 -14.389 23.611 1.00 13.20 C ATOM 399 CD2 LEU A 25 -4.401 -13.090 22.260 1.00 11.14 C ATOM 0 H LEU A 25 -6.661 -15.173 25.862 1.00 35.22 H new ATOM 0 HA LEU A 25 -6.633 -14.219 23.193 1.00 34.13 H new ATOM 0 HB2 LEU A 25 -5.534 -13.020 24.970 1.00 62.24 H new ATOM 0 HB3 LEU A 25 -4.566 -14.416 25.401 1.00 62.24 H new ATOM 0 HG LEU A 25 -3.495 -12.449 24.082 1.00 64.23 H new ATOM 0 HD11 LEU A 25 -1.950 -14.012 22.966 1.00 13.20 H new ATOM 0 HD12 LEU A 25 -2.352 -14.546 24.616 1.00 13.20 H new ATOM 0 HD13 LEU A 25 -3.115 -15.334 23.215 1.00 13.20 H new ATOM 0 HD21 LEU A 25 -3.584 -12.732 21.634 1.00 11.14 H new ATOM 0 HD22 LEU A 25 -4.813 -14.003 21.830 1.00 11.14 H new ATOM 0 HD23 LEU A 25 -5.180 -12.329 22.311 1.00 11.14 H new ATOM 411 N PRO A 26 -4.680 -16.824 23.859 1.00 12.31 N ATOM 412 CA PRO A 26 -3.951 -17.948 23.264 1.00 53.32 C ATOM 413 C PRO A 26 -4.885 -18.971 22.626 1.00 24.32 C ATOM 414 O PRO A 26 -4.437 -19.906 21.962 1.00 25.35 O ATOM 415 CB PRO A 26 -3.215 -18.565 24.456 1.00 55.51 C ATOM 416 CG PRO A 26 -4.032 -18.186 25.643 1.00 54.44 C ATOM 417 CD PRO A 26 -4.615 -16.835 25.330 1.00 31.11 C ATOM 0 HA PRO A 26 -3.290 -17.625 22.459 1.00 53.32 H new ATOM 0 HB2 PRO A 26 -3.139 -19.648 24.357 1.00 55.51 H new ATOM 0 HB3 PRO A 26 -2.198 -18.180 24.536 1.00 55.51 H new ATOM 0 HG2 PRO A 26 -4.819 -18.918 25.825 1.00 54.44 H new ATOM 0 HG3 PRO A 26 -3.418 -18.147 26.543 1.00 54.44 H new ATOM 0 HD2 PRO A 26 -5.601 -16.710 25.777 1.00 31.11 H new ATOM 0 HD3 PRO A 26 -3.988 -16.029 25.711 1.00 31.11 H new ATOM 425 N VAL A 27 -6.185 -18.788 22.832 1.00 72.24 N ATOM 426 CA VAL A 27 -7.182 -19.695 22.275 1.00 31.23 C ATOM 427 C VAL A 27 -7.243 -19.580 20.756 1.00 24.43 C ATOM 428 O VAL A 27 -7.210 -20.585 20.046 1.00 52.30 O ATOM 429 CB VAL A 27 -8.581 -19.416 22.856 1.00 21.34 C ATOM 430 CG1 VAL A 27 -9.625 -20.290 22.178 1.00 51.21 C ATOM 431 CG2 VAL A 27 -8.586 -19.637 24.362 1.00 62.05 C ATOM 0 H VAL A 27 -6.573 -18.020 23.380 1.00 72.24 H new ATOM 0 HA VAL A 27 -6.878 -20.705 22.548 1.00 31.23 H new ATOM 0 HB VAL A 27 -8.834 -18.373 22.663 1.00 21.34 H new ATOM 0 HG11 VAL A 27 -10.607 -20.079 22.602 1.00 51.21 H new ATOM 0 HG12 VAL A 27 -9.638 -20.078 21.109 1.00 51.21 H new ATOM 0 HG13 VAL A 27 -9.379 -21.340 22.337 1.00 51.21 H new ATOM 0 HG21 VAL A 27 -9.582 -19.435 24.756 1.00 62.05 H new ATOM 0 HG22 VAL A 27 -8.312 -20.669 24.579 1.00 62.05 H new ATOM 0 HG23 VAL A 27 -7.868 -18.965 24.831 1.00 62.05 H new ATOM 441 N ALA A 28 -7.330 -18.349 20.265 1.00 54.25 N ATOM 442 CA ALA A 28 -7.393 -18.102 18.829 1.00 21.03 C ATOM 443 C ALA A 28 -6.129 -18.594 18.132 1.00 2.52 C ATOM 444 O ALA A 28 -6.197 -19.278 17.111 1.00 0.21 O ATOM 445 CB ALA A 28 -7.606 -16.620 18.557 1.00 23.24 C ATOM 0 H ALA A 28 -7.359 -17.507 20.840 1.00 54.25 H new ATOM 0 HA ALA A 28 -8.239 -18.659 18.426 1.00 21.03 H new ATOM 0 HB1 ALA A 28 -7.651 -16.450 17.481 1.00 23.24 H new ATOM 0 HB2 ALA A 28 -8.541 -16.297 19.015 1.00 23.24 H new ATOM 0 HB3 ALA A 28 -6.779 -16.050 18.980 1.00 23.24 H new ATOM 451 N VAL A 29 -4.975 -18.240 18.690 1.00 52.41 N ATOM 452 CA VAL A 29 -3.695 -18.645 18.122 1.00 72.23 C ATOM 453 C VAL A 29 -3.576 -20.164 18.064 1.00 0.03 C ATOM 454 O VAL A 29 -3.332 -20.739 17.004 1.00 72.45 O ATOM 455 CB VAL A 29 -2.516 -18.079 18.935 1.00 43.05 C ATOM 456 CG1 VAL A 29 -1.200 -18.338 18.217 1.00 24.13 C ATOM 457 CG2 VAL A 29 -2.710 -16.592 19.189 1.00 1.21 C ATOM 0 H VAL A 29 -4.901 -17.673 19.535 1.00 52.41 H new ATOM 0 HA VAL A 29 -3.655 -18.241 17.110 1.00 72.23 H new ATOM 0 HB VAL A 29 -2.483 -18.588 19.898 1.00 43.05 H new ATOM 0 HG11 VAL A 29 -0.378 -17.931 18.806 1.00 24.13 H new ATOM 0 HG12 VAL A 29 -1.060 -19.412 18.091 1.00 24.13 H new ATOM 0 HG13 VAL A 29 -1.218 -17.857 17.239 1.00 24.13 H new ATOM 0 HG21 VAL A 29 -1.868 -16.208 19.765 1.00 1.21 H new ATOM 0 HG22 VAL A 29 -2.769 -16.065 18.237 1.00 1.21 H new ATOM 0 HG23 VAL A 29 -3.633 -16.436 19.748 1.00 1.21 H new ATOM 467 N LYS A 30 -3.750 -20.809 19.213 1.00 61.33 N ATOM 468 CA LYS A 30 -3.664 -22.263 19.295 1.00 50.42 C ATOM 469 C LYS A 30 -4.587 -22.921 18.274 1.00 44.31 C ATOM 470 O LYS A 30 -4.187 -23.845 17.565 1.00 32.43 O ATOM 471 CB LYS A 30 -4.025 -22.736 20.704 1.00 31.55 C ATOM 472 CG LYS A 30 -2.980 -22.388 21.750 1.00 65.13 C ATOM 473 CD LYS A 30 -2.148 -23.601 22.132 1.00 3.21 C ATOM 474 CE LYS A 30 -0.941 -23.759 21.220 1.00 61.11 C ATOM 475 NZ LYS A 30 0.009 -22.620 21.354 1.00 54.34 N ATOM 0 H LYS A 30 -3.951 -20.348 20.100 1.00 61.33 H new ATOM 0 HA LYS A 30 -2.638 -22.555 19.072 1.00 50.42 H new ATOM 0 HB2 LYS A 30 -4.978 -22.293 20.994 1.00 31.55 H new ATOM 0 HB3 LYS A 30 -4.167 -23.817 20.690 1.00 31.55 H new ATOM 0 HG2 LYS A 30 -2.327 -21.604 21.367 1.00 65.13 H new ATOM 0 HG3 LYS A 30 -3.471 -21.988 22.637 1.00 65.13 H new ATOM 0 HD2 LYS A 30 -1.814 -23.504 23.165 1.00 3.21 H new ATOM 0 HD3 LYS A 30 -2.765 -24.498 22.079 1.00 3.21 H new ATOM 0 HE2 LYS A 30 -0.427 -24.690 21.457 1.00 61.11 H new ATOM 0 HE3 LYS A 30 -1.275 -23.833 20.185 1.00 61.11 H new ATOM 0 HZ1 LYS A 30 0.966 -22.934 21.096 1.00 54.34 H new ATOM 0 HZ2 LYS A 30 -0.284 -21.847 20.722 1.00 54.34 H new ATOM 0 HZ3 LYS A 30 0.009 -22.282 22.338 1.00 54.34 H new ATOM 489 N THR A 31 -5.823 -22.438 18.202 1.00 12.43 N ATOM 490 CA THR A 31 -6.802 -22.979 17.268 1.00 51.40 C ATOM 491 C THR A 31 -6.302 -22.884 15.831 1.00 2.31 C ATOM 492 O THR A 31 -6.094 -23.899 15.167 1.00 32.30 O ATOM 493 CB THR A 31 -8.151 -22.243 17.379 1.00 31.44 C ATOM 494 OG1 THR A 31 -8.809 -22.608 18.598 1.00 62.51 O ATOM 495 CG2 THR A 31 -9.047 -22.574 16.195 1.00 1.31 C ATOM 0 H THR A 31 -6.170 -21.672 18.780 1.00 12.43 H new ATOM 0 HA THR A 31 -6.945 -24.027 17.532 1.00 51.40 H new ATOM 0 HB THR A 31 -7.956 -21.171 17.378 1.00 31.44 H new ATOM 0 HG1 THR A 31 -8.473 -22.051 19.331 1.00 62.51 H new ATOM 0 HG21 THR A 31 -9.994 -22.043 16.295 1.00 1.31 H new ATOM 0 HG22 THR A 31 -8.556 -22.269 15.271 1.00 1.31 H new ATOM 0 HG23 THR A 31 -9.234 -23.647 16.169 1.00 1.31 H new ATOM 503 N VAL A 32 -6.109 -21.657 15.356 1.00 31.22 N ATOM 504 CA VAL A 32 -5.631 -21.430 13.998 1.00 41.22 C ATOM 505 C VAL A 32 -4.446 -22.332 13.674 1.00 23.40 C ATOM 506 O VAL A 32 -4.529 -23.194 12.799 1.00 13.12 O ATOM 507 CB VAL A 32 -5.216 -19.961 13.787 1.00 34.41 C ATOM 508 CG1 VAL A 32 -4.848 -19.714 12.332 1.00 4.13 C ATOM 509 CG2 VAL A 32 -6.330 -19.025 14.230 1.00 14.01 C ATOM 0 H VAL A 32 -6.277 -20.806 15.892 1.00 31.22 H new ATOM 0 HA VAL A 32 -6.458 -21.667 13.328 1.00 41.22 H new ATOM 0 HB VAL A 32 -4.337 -19.758 14.398 1.00 34.41 H new ATOM 0 HG11 VAL A 32 -4.558 -18.671 12.202 1.00 4.13 H new ATOM 0 HG12 VAL A 32 -4.016 -20.360 12.052 1.00 4.13 H new ATOM 0 HG13 VAL A 32 -5.707 -19.933 11.697 1.00 4.13 H new ATOM 0 HG21 VAL A 32 -6.020 -17.992 14.074 1.00 14.01 H new ATOM 0 HG22 VAL A 32 -7.228 -19.227 13.646 1.00 14.01 H new ATOM 0 HG23 VAL A 32 -6.541 -19.185 15.287 1.00 14.01 H new ATOM 519 N ALA A 33 -3.342 -22.129 14.386 1.00 32.01 N ATOM 520 CA ALA A 33 -2.140 -22.926 14.177 1.00 71.24 C ATOM 521 C ALA A 33 -2.426 -24.412 14.368 1.00 52.21 C ATOM 522 O ALA A 33 -1.688 -25.264 13.877 1.00 24.51 O ATOM 523 CB ALA A 33 -1.036 -22.474 15.120 1.00 5.31 C ATOM 0 H ALA A 33 -3.256 -21.419 15.113 1.00 32.01 H new ATOM 0 HA ALA A 33 -1.809 -22.776 13.149 1.00 71.24 H new ATOM 0 HB1 ALA A 33 -0.144 -23.078 14.953 1.00 5.31 H new ATOM 0 HB2 ALA A 33 -0.804 -21.426 14.933 1.00 5.31 H new ATOM 0 HB3 ALA A 33 -1.367 -22.594 16.152 1.00 5.31 H new ATOM 529 N GLY A 34 -3.504 -24.715 15.086 1.00 43.22 N ATOM 530 CA GLY A 34 -3.867 -26.098 15.330 1.00 75.31 C ATOM 531 C GLY A 34 -4.186 -26.848 14.052 1.00 60.23 C ATOM 532 O GLY A 34 -3.442 -27.741 13.646 1.00 22.13 O ATOM 0 H GLY A 34 -4.132 -24.027 15.502 1.00 43.22 H new ATOM 0 HA2 GLY A 34 -3.049 -26.599 15.847 1.00 75.31 H new ATOM 0 HA3 GLY A 34 -4.732 -26.132 15.993 1.00 75.31 H new ATOM 536 N TRP A 35 -5.295 -26.487 13.417 1.00 42.45 N ATOM 537 CA TRP A 35 -5.711 -27.133 12.177 1.00 20.52 C ATOM 538 C TRP A 35 -4.824 -26.704 11.014 1.00 3.42 C ATOM 539 O TRP A 35 -4.763 -27.378 9.986 1.00 54.03 O ATOM 540 CB TRP A 35 -7.172 -26.801 11.870 1.00 31.11 C ATOM 541 CG TRP A 35 -7.478 -25.336 11.953 1.00 71.33 C ATOM 542 CD1 TRP A 35 -7.848 -24.638 13.067 1.00 43.35 C ATOM 543 CD2 TRP A 35 -7.443 -24.391 10.878 1.00 65.54 C ATOM 544 NE1 TRP A 35 -8.044 -23.315 12.748 1.00 31.55 N ATOM 545 CE2 TRP A 35 -7.801 -23.138 11.412 1.00 31.41 C ATOM 546 CE3 TRP A 35 -7.141 -24.481 9.516 1.00 22.41 C ATOM 547 CZ2 TRP A 35 -7.867 -21.988 10.631 1.00 5.42 C ATOM 548 CZ3 TRP A 35 -7.206 -23.338 8.742 1.00 35.34 C ATOM 549 CH2 TRP A 35 -7.566 -22.105 9.301 1.00 11.33 C ATOM 0 H TRP A 35 -5.922 -25.751 13.740 1.00 42.45 H new ATOM 0 HA TRP A 35 -5.610 -28.210 12.307 1.00 20.52 H new ATOM 0 HB2 TRP A 35 -7.416 -27.160 10.870 1.00 31.11 H new ATOM 0 HB3 TRP A 35 -7.814 -27.339 12.568 1.00 31.11 H new ATOM 0 HD1 TRP A 35 -7.969 -25.062 14.053 1.00 43.35 H new ATOM 0 HE1 TRP A 35 -8.325 -22.584 13.401 1.00 31.55 H new ATOM 0 HE3 TRP A 35 -6.862 -25.427 9.076 1.00 22.41 H new ATOM 0 HZ2 TRP A 35 -8.146 -21.037 11.059 1.00 5.42 H new ATOM 0 HZ3 TRP A 35 -6.975 -23.396 7.689 1.00 35.34 H new ATOM 0 HH2 TRP A 35 -7.607 -21.229 8.670 1.00 11.33 H new ATOM 560 N ILE A 36 -4.137 -25.579 11.184 1.00 50.22 N ATOM 561 CA ILE A 36 -3.252 -25.061 10.148 1.00 71.02 C ATOM 562 C ILE A 36 -2.039 -25.965 9.959 1.00 62.21 C ATOM 563 O ILE A 36 -1.731 -26.383 8.842 1.00 2.44 O ATOM 564 CB ILE A 36 -2.770 -23.636 10.479 1.00 20.44 C ATOM 565 CG1 ILE A 36 -3.795 -22.604 10.005 1.00 61.21 C ATOM 566 CG2 ILE A 36 -1.413 -23.375 9.843 1.00 11.11 C ATOM 567 CD1 ILE A 36 -3.284 -21.181 10.049 1.00 32.11 C ATOM 0 H ILE A 36 -4.176 -25.009 12.029 1.00 50.22 H new ATOM 0 HA ILE A 36 -3.830 -25.034 9.224 1.00 71.02 H new ATOM 0 HB ILE A 36 -2.666 -23.545 11.560 1.00 20.44 H new ATOM 0 HG12 ILE A 36 -4.094 -22.843 8.984 1.00 61.21 H new ATOM 0 HG13 ILE A 36 -4.688 -22.680 10.625 1.00 61.21 H new ATOM 0 HG21 ILE A 36 -1.086 -22.364 10.086 1.00 11.11 H new ATOM 0 HG22 ILE A 36 -0.688 -24.093 10.226 1.00 11.11 H new ATOM 0 HG23 ILE A 36 -1.492 -23.481 8.761 1.00 11.11 H new ATOM 0 HD11 ILE A 36 -4.063 -20.504 9.699 1.00 32.11 H new ATOM 0 HD12 ILE A 36 -3.012 -20.924 11.073 1.00 32.11 H new ATOM 0 HD13 ILE A 36 -2.408 -21.089 9.407 1.00 32.11 H new ATOM 579 N ARG A 37 -1.354 -26.265 11.058 1.00 75.21 N ATOM 580 CA ARG A 37 -0.175 -27.121 11.014 1.00 41.23 C ATOM 581 C ARG A 37 -0.566 -28.574 10.760 1.00 12.32 C ATOM 582 O ARG A 37 0.152 -29.312 10.087 1.00 50.25 O ATOM 583 CB ARG A 37 0.608 -27.014 12.323 1.00 5.44 C ATOM 584 CG ARG A 37 2.076 -27.385 12.187 1.00 20.34 C ATOM 585 CD ARG A 37 2.829 -26.379 11.331 1.00 15.11 C ATOM 586 NE ARG A 37 4.276 -26.519 11.467 1.00 51.33 N ATOM 587 CZ ARG A 37 4.970 -27.521 10.940 1.00 31.51 C ATOM 588 NH1 ARG A 37 4.352 -28.467 10.246 1.00 60.11 N ATOM 589 NH2 ARG A 37 6.285 -27.579 11.107 1.00 60.41 N ATOM 0 H ARG A 37 -1.596 -25.928 11.990 1.00 75.21 H new ATOM 0 HA ARG A 37 0.457 -26.784 10.192 1.00 41.23 H new ATOM 0 HB2 ARG A 37 0.533 -25.994 12.699 1.00 5.44 H new ATOM 0 HB3 ARG A 37 0.146 -27.662 13.067 1.00 5.44 H new ATOM 0 HG2 ARG A 37 2.532 -27.437 13.176 1.00 20.34 H new ATOM 0 HG3 ARG A 37 2.162 -28.377 11.744 1.00 20.34 H new ATOM 0 HD2 ARG A 37 2.549 -26.511 10.286 1.00 15.11 H new ATOM 0 HD3 ARG A 37 2.534 -25.369 11.615 1.00 15.11 H new ATOM 0 HE ARG A 37 4.781 -25.808 11.996 1.00 51.33 H new ATOM 0 HH11 ARG A 37 3.341 -28.426 10.116 1.00 60.11 H new ATOM 0 HH12 ARG A 37 4.887 -29.236 9.842 1.00 60.11 H new ATOM 0 HH21 ARG A 37 6.764 -26.853 11.641 1.00 60.41 H new ATOM 0 HH22 ARG A 37 6.817 -28.349 10.702 1.00 60.41 H new ATOM 603 N ALA A 38 -1.709 -28.977 11.305 1.00 13.11 N ATOM 604 CA ALA A 38 -2.197 -30.340 11.137 1.00 62.32 C ATOM 605 C ALA A 38 -2.475 -30.647 9.669 1.00 3.31 C ATOM 606 O ALA A 38 -1.995 -31.646 9.131 1.00 15.22 O ATOM 607 CB ALA A 38 -3.451 -30.559 11.970 1.00 23.13 C ATOM 0 H ALA A 38 -2.314 -28.379 11.867 1.00 13.11 H new ATOM 0 HA ALA A 38 -1.420 -31.022 11.483 1.00 62.32 H new ATOM 0 HB1 ALA A 38 -3.804 -31.581 11.834 1.00 23.13 H new ATOM 0 HB2 ALA A 38 -3.223 -30.391 13.022 1.00 23.13 H new ATOM 0 HB3 ALA A 38 -4.226 -29.862 11.651 1.00 23.13 H new ATOM 613 N LEU A 39 -3.252 -29.782 9.026 1.00 21.21 N ATOM 614 CA LEU A 39 -3.595 -29.961 7.619 1.00 4.24 C ATOM 615 C LEU A 39 -2.371 -29.761 6.731 1.00 1.52 C ATOM 616 O LEU A 39 -2.188 -30.469 5.741 1.00 4.11 O ATOM 617 CB LEU A 39 -4.698 -28.982 7.215 1.00 74.12 C ATOM 618 CG LEU A 39 -4.254 -27.545 6.942 1.00 10.42 C ATOM 619 CD1 LEU A 39 -3.821 -27.385 5.493 1.00 74.41 C ATOM 620 CD2 LEU A 39 -5.372 -26.568 7.277 1.00 30.23 C ATOM 0 H LEU A 39 -3.656 -28.950 9.456 1.00 21.21 H new ATOM 0 HA LEU A 39 -3.956 -30.981 7.485 1.00 4.24 H new ATOM 0 HB2 LEU A 39 -5.187 -29.366 6.320 1.00 74.12 H new ATOM 0 HB3 LEU A 39 -5.448 -28.965 8.005 1.00 74.12 H new ATOM 0 HG LEU A 39 -3.400 -27.322 7.581 1.00 10.42 H new ATOM 0 HD11 LEU A 39 -3.509 -26.355 5.318 1.00 74.41 H new ATOM 0 HD12 LEU A 39 -2.988 -28.057 5.286 1.00 74.41 H new ATOM 0 HD13 LEU A 39 -4.655 -27.628 4.835 1.00 74.41 H new ATOM 0 HD21 LEU A 39 -5.038 -25.550 7.076 1.00 30.23 H new ATOM 0 HD22 LEU A 39 -6.245 -26.791 6.664 1.00 30.23 H new ATOM 0 HD23 LEU A 39 -5.634 -26.663 8.331 1.00 30.23 H new ATOM 632 N ARG A 40 -1.535 -28.793 7.093 1.00 14.53 N ATOM 633 CA ARG A 40 -0.328 -28.500 6.330 1.00 53.22 C ATOM 634 C ARG A 40 0.607 -29.706 6.307 1.00 15.43 C ATOM 635 O ARG A 40 0.984 -30.191 5.241 1.00 21.21 O ATOM 636 CB ARG A 40 0.396 -27.290 6.924 1.00 31.50 C ATOM 637 CG ARG A 40 1.551 -26.793 6.071 1.00 40.52 C ATOM 638 CD ARG A 40 1.093 -25.743 5.070 1.00 75.40 C ATOM 639 NE ARG A 40 1.805 -25.851 3.799 1.00 14.24 N ATOM 640 CZ ARG A 40 1.715 -24.949 2.828 1.00 1.03 C ATOM 641 NH1 ARG A 40 0.948 -23.878 2.982 1.00 63.31 N ATOM 642 NH2 ARG A 40 2.394 -25.117 1.701 1.00 51.14 N ATOM 0 H ARG A 40 -1.672 -28.198 7.910 1.00 14.53 H new ATOM 0 HA ARG A 40 -0.622 -28.271 5.306 1.00 53.22 H new ATOM 0 HB2 ARG A 40 -0.320 -26.479 7.059 1.00 31.50 H new ATOM 0 HB3 ARG A 40 0.772 -27.552 7.913 1.00 31.50 H new ATOM 0 HG2 ARG A 40 2.324 -26.372 6.713 1.00 40.52 H new ATOM 0 HG3 ARG A 40 2.000 -27.632 5.540 1.00 40.52 H new ATOM 0 HD2 ARG A 40 0.022 -25.851 4.896 1.00 75.40 H new ATOM 0 HD3 ARG A 40 1.249 -24.749 5.490 1.00 75.40 H new ATOM 0 HE ARG A 40 2.404 -26.663 3.649 1.00 14.24 H new ATOM 0 HH11 ARG A 40 0.425 -23.745 3.848 1.00 63.31 H new ATOM 0 HH12 ARG A 40 0.881 -23.187 2.235 1.00 63.31 H new ATOM 0 HH21 ARG A 40 2.986 -25.939 1.580 1.00 51.14 H new ATOM 0 HH22 ARG A 40 2.325 -24.424 0.956 1.00 51.14 H new ATOM 656 N SER A 41 0.976 -30.183 7.491 1.00 24.23 N ATOM 657 CA SER A 41 1.871 -31.329 7.608 1.00 75.32 C ATOM 658 C SER A 41 1.262 -32.562 6.946 1.00 23.23 C ATOM 659 O SER A 41 1.956 -33.327 6.274 1.00 1.25 O ATOM 660 CB SER A 41 2.170 -31.622 9.079 1.00 3.53 C ATOM 661 OG SER A 41 2.922 -32.815 9.219 1.00 0.44 O ATOM 0 H SER A 41 0.670 -29.794 8.383 1.00 24.23 H new ATOM 0 HA SER A 41 2.803 -31.085 7.097 1.00 75.32 H new ATOM 0 HB2 SER A 41 2.721 -30.788 9.514 1.00 3.53 H new ATOM 0 HB3 SER A 41 1.235 -31.711 9.633 1.00 3.53 H new ATOM 0 HG SER A 41 3.101 -32.979 10.168 1.00 0.44 H new ATOM 667 N LEU A 42 -0.038 -32.749 7.141 1.00 33.33 N ATOM 668 CA LEU A 42 -0.742 -33.889 6.564 1.00 33.32 C ATOM 669 C LEU A 42 -0.704 -33.838 5.040 1.00 22.52 C ATOM 670 O LEU A 42 -0.435 -34.843 4.382 1.00 21.15 O ATOM 671 CB LEU A 42 -2.193 -33.916 7.049 1.00 70.25 C ATOM 672 CG LEU A 42 -2.472 -34.770 8.286 1.00 3.33 C ATOM 673 CD1 LEU A 42 -3.765 -34.332 8.956 1.00 31.30 C ATOM 674 CD2 LEU A 42 -2.533 -36.244 7.915 1.00 74.14 C ATOM 0 H LEU A 42 -0.626 -32.126 7.694 1.00 33.33 H new ATOM 0 HA LEU A 42 -0.239 -34.799 6.891 1.00 33.32 H new ATOM 0 HB2 LEU A 42 -2.503 -32.893 7.261 1.00 70.25 H new ATOM 0 HB3 LEU A 42 -2.821 -34.277 6.234 1.00 70.25 H new ATOM 0 HG LEU A 42 -1.655 -34.629 8.993 1.00 3.33 H new ATOM 0 HD11 LEU A 42 -3.947 -34.951 9.834 1.00 31.30 H new ATOM 0 HD12 LEU A 42 -3.683 -33.288 9.258 1.00 31.30 H new ATOM 0 HD13 LEU A 42 -4.593 -34.443 8.256 1.00 31.30 H new ATOM 0 HD21 LEU A 42 -2.732 -36.836 8.808 1.00 74.14 H new ATOM 0 HD22 LEU A 42 -3.330 -36.404 7.188 1.00 74.14 H new ATOM 0 HD23 LEU A 42 -1.581 -36.550 7.482 1.00 74.14 H new ATOM 686 N ALA A 43 -0.972 -32.661 4.486 1.00 54.04 N ATOM 687 CA ALA A 43 -0.964 -32.478 3.040 1.00 72.04 C ATOM 688 C ALA A 43 0.403 -32.810 2.452 1.00 62.01 C ATOM 689 O ALA A 43 0.516 -33.628 1.538 1.00 25.13 O ATOM 690 CB ALA A 43 -1.361 -31.052 2.686 1.00 61.43 C ATOM 0 H ALA A 43 -1.197 -31.819 5.016 1.00 54.04 H new ATOM 0 HA ALA A 43 -1.692 -33.164 2.608 1.00 72.04 H new ATOM 0 HB1 ALA A 43 -1.351 -30.930 1.603 1.00 61.43 H new ATOM 0 HB2 ALA A 43 -2.363 -30.849 3.065 1.00 61.43 H new ATOM 0 HB3 ALA A 43 -0.654 -30.355 3.137 1.00 61.43 H new ATOM 696 N THR A 44 1.441 -32.170 2.981 1.00 1.52 N ATOM 697 CA THR A 44 2.801 -32.395 2.508 1.00 72.42 C ATOM 698 C THR A 44 3.237 -33.835 2.754 1.00 32.23 C ATOM 699 O THR A 44 4.047 -34.387 2.008 1.00 12.53 O ATOM 700 CB THR A 44 3.800 -31.444 3.193 1.00 33.14 C ATOM 701 OG1 THR A 44 3.465 -31.298 4.578 1.00 5.11 O ATOM 702 CG2 THR A 44 3.798 -30.080 2.519 1.00 31.34 C ATOM 0 H THR A 44 1.365 -31.491 3.738 1.00 1.52 H new ATOM 0 HA THR A 44 2.799 -32.196 1.436 1.00 72.42 H new ATOM 0 HB THR A 44 4.798 -31.874 3.104 1.00 33.14 H new ATOM 0 HG1 THR A 44 3.079 -32.135 4.911 1.00 5.11 H new ATOM 0 HG21 THR A 44 4.511 -29.426 3.020 1.00 31.34 H new ATOM 0 HG22 THR A 44 4.081 -30.191 1.472 1.00 31.34 H new ATOM 0 HG23 THR A 44 2.801 -29.645 2.581 1.00 31.34 H new ATOM 710 N THR A 45 2.694 -34.441 3.806 1.00 61.32 N ATOM 711 CA THR A 45 3.027 -35.817 4.151 1.00 64.51 C ATOM 712 C THR A 45 2.394 -36.799 3.171 1.00 12.25 C ATOM 713 O THR A 45 2.928 -37.881 2.928 1.00 44.44 O ATOM 714 CB THR A 45 2.567 -36.166 5.579 1.00 1.20 C ATOM 715 OG1 THR A 45 3.370 -35.467 6.537 1.00 63.13 O ATOM 716 CG2 THR A 45 2.661 -37.664 5.828 1.00 53.35 C ATOM 0 H THR A 45 2.022 -34.000 4.433 1.00 61.32 H new ATOM 0 HA THR A 45 4.112 -35.902 4.096 1.00 64.51 H new ATOM 0 HB THR A 45 1.526 -35.861 5.686 1.00 1.20 H new ATOM 0 HG1 THR A 45 3.293 -34.502 6.387 1.00 63.13 H new ATOM 0 HG21 THR A 45 2.331 -37.886 6.843 1.00 53.35 H new ATOM 0 HG22 THR A 45 2.026 -38.192 5.116 1.00 53.35 H new ATOM 0 HG23 THR A 45 3.694 -37.989 5.703 1.00 53.35 H new ATOM 724 N VAL A 46 1.251 -36.414 2.611 1.00 22.45 N ATOM 725 CA VAL A 46 0.545 -37.260 1.656 1.00 23.24 C ATOM 726 C VAL A 46 0.665 -36.708 0.240 1.00 32.24 C ATOM 727 O VAL A 46 -0.082 -37.103 -0.655 1.00 10.14 O ATOM 728 CB VAL A 46 -0.946 -37.394 2.020 1.00 44.54 C ATOM 729 CG1 VAL A 46 -1.105 -37.870 3.455 1.00 31.22 C ATOM 730 CG2 VAL A 46 -1.666 -36.071 1.805 1.00 31.00 C ATOM 0 H VAL A 46 0.795 -35.522 2.802 1.00 22.45 H new ATOM 0 HA VAL A 46 1.011 -38.244 1.699 1.00 23.24 H new ATOM 0 HB VAL A 46 -1.397 -38.139 1.364 1.00 44.54 H new ATOM 0 HG11 VAL A 46 -2.165 -37.959 3.694 1.00 31.22 H new ATOM 0 HG12 VAL A 46 -0.624 -38.841 3.571 1.00 31.22 H new ATOM 0 HG13 VAL A 46 -0.640 -37.152 4.130 1.00 31.22 H new ATOM 0 HG21 VAL A 46 -2.718 -36.183 2.067 1.00 31.00 H new ATOM 0 HG22 VAL A 46 -1.215 -35.305 2.435 1.00 31.00 H new ATOM 0 HG23 VAL A 46 -1.582 -35.777 0.759 1.00 31.00 H new ATOM 740 N GLN A 47 1.609 -35.794 0.045 1.00 3.34 N ATOM 741 CA GLN A 47 1.826 -35.187 -1.263 1.00 23.32 C ATOM 742 C GLN A 47 3.309 -35.183 -1.621 1.00 54.55 C ATOM 743 O GLN A 47 3.680 -34.910 -2.762 1.00 41.21 O ATOM 744 CB GLN A 47 1.280 -33.759 -1.283 1.00 50.40 C ATOM 745 CG GLN A 47 -0.235 -33.688 -1.381 1.00 74.11 C ATOM 746 CD GLN A 47 -0.727 -32.336 -1.858 1.00 50.15 C ATOM 747 OE1 GLN A 47 -0.052 -31.654 -2.630 1.00 2.11 O ATOM 748 NE2 GLN A 47 -1.909 -31.940 -1.401 1.00 74.44 N ATOM 0 H GLN A 47 2.236 -35.457 0.776 1.00 3.34 H new ATOM 0 HA GLN A 47 1.293 -35.782 -2.005 1.00 23.32 H new ATOM 0 HB2 GLN A 47 1.602 -33.243 -0.378 1.00 50.40 H new ATOM 0 HB3 GLN A 47 1.716 -33.224 -2.127 1.00 50.40 H new ATOM 0 HG2 GLN A 47 -0.587 -34.460 -2.065 1.00 74.11 H new ATOM 0 HG3 GLN A 47 -0.669 -33.904 -0.405 1.00 74.11 H new ATOM 0 HE21 GLN A 47 -2.435 -32.537 -0.763 1.00 74.44 H new ATOM 0 HE22 GLN A 47 -2.291 -31.039 -1.688 1.00 74.44 H new ATOM 757 N ASN A 48 4.151 -35.486 -0.639 1.00 41.13 N ATOM 758 CA ASN A 48 5.594 -35.516 -0.851 1.00 53.45 C ATOM 759 C ASN A 48 6.172 -36.875 -0.471 1.00 34.30 C ATOM 760 O ASN A 48 7.386 -37.032 -0.351 1.00 20.35 O ATOM 761 CB ASN A 48 6.273 -34.414 -0.036 1.00 11.24 C ATOM 762 CG ASN A 48 5.465 -33.131 -0.011 1.00 51.23 C ATOM 763 OD1 ASN A 48 5.408 -32.439 1.005 1.00 4.23 O ATOM 764 ND2 ASN A 48 4.834 -32.808 -1.134 1.00 42.44 N ATOM 0 H ASN A 48 3.860 -35.714 0.311 1.00 41.13 H new ATOM 0 HA ASN A 48 5.784 -35.344 -1.911 1.00 53.45 H new ATOM 0 HB2 ASN A 48 6.426 -34.763 0.985 1.00 11.24 H new ATOM 0 HB3 ASN A 48 7.259 -34.211 -0.455 1.00 11.24 H new ATOM 0 HD21 ASN A 48 4.274 -31.956 -1.178 1.00 42.44 H new ATOM 0 HD22 ASN A 48 4.909 -33.411 -1.953 1.00 42.44 H new ATOM 771 N GLU A 49 5.292 -37.855 -0.284 1.00 3.30 N ATOM 772 CA GLU A 49 5.716 -39.201 0.083 1.00 51.10 C ATOM 773 C GLU A 49 4.697 -40.238 -0.382 1.00 1.51 C ATOM 774 O GLU A 49 5.036 -41.180 -1.099 1.00 1.11 O ATOM 775 CB GLU A 49 5.910 -39.304 1.597 1.00 13.43 C ATOM 776 CG GLU A 49 6.579 -38.084 2.209 1.00 31.43 C ATOM 777 CD GLU A 49 6.750 -38.205 3.711 1.00 21.21 C ATOM 778 OE1 GLU A 49 7.224 -39.266 4.170 1.00 10.32 O ATOM 779 OE2 GLU A 49 6.410 -37.240 4.427 1.00 22.41 O ATOM 0 H GLU A 49 4.283 -37.742 -0.381 1.00 3.30 H new ATOM 0 HA GLU A 49 6.666 -39.403 -0.412 1.00 51.10 H new ATOM 0 HB2 GLU A 49 4.939 -39.451 2.070 1.00 13.43 H new ATOM 0 HB3 GLU A 49 6.510 -40.187 1.819 1.00 13.43 H new ATOM 0 HG2 GLU A 49 7.555 -37.939 1.746 1.00 31.43 H new ATOM 0 HG3 GLU A 49 5.985 -37.198 1.985 1.00 31.43 H new ATOM 786 N LEU A 50 3.448 -40.057 0.032 1.00 73.12 N ATOM 787 CA LEU A 50 2.378 -40.976 -0.341 1.00 20.30 C ATOM 788 C LEU A 50 1.690 -40.520 -1.623 1.00 51.34 C ATOM 789 O LEU A 50 0.624 -41.021 -1.982 1.00 32.20 O ATOM 790 CB LEU A 50 1.354 -41.084 0.790 1.00 10.13 C ATOM 791 CG LEU A 50 -0.045 -41.553 0.387 1.00 5.13 C ATOM 792 CD1 LEU A 50 -0.616 -42.492 1.438 1.00 12.44 C ATOM 793 CD2 LEU A 50 -0.967 -40.361 0.176 1.00 45.10 C ATOM 0 H LEU A 50 3.151 -39.283 0.626 1.00 73.12 H new ATOM 0 HA LEU A 50 2.820 -41.956 -0.517 1.00 20.30 H new ATOM 0 HB2 LEU A 50 1.743 -41.771 1.541 1.00 10.13 H new ATOM 0 HB3 LEU A 50 1.265 -40.108 1.267 1.00 10.13 H new ATOM 0 HG LEU A 50 0.032 -42.098 -0.554 1.00 5.13 H new ATOM 0 HD11 LEU A 50 -1.612 -42.815 1.134 1.00 12.44 H new ATOM 0 HD12 LEU A 50 0.033 -43.362 1.540 1.00 12.44 H new ATOM 0 HD13 LEU A 50 -0.679 -41.973 2.394 1.00 12.44 H new ATOM 0 HD21 LEU A 50 -1.958 -40.714 -0.110 1.00 45.10 H new ATOM 0 HD22 LEU A 50 -1.039 -39.788 1.101 1.00 45.10 H new ATOM 0 HD23 LEU A 50 -0.566 -39.726 -0.614 1.00 45.10 H new ATOM 805 N THR A 51 2.308 -39.566 -2.313 1.00 52.32 N ATOM 806 CA THR A 51 1.756 -39.042 -3.556 1.00 61.03 C ATOM 807 C THR A 51 2.308 -39.793 -4.762 1.00 71.44 C ATOM 808 O THR A 51 1.613 -39.977 -5.761 1.00 51.33 O ATOM 809 CB THR A 51 2.061 -37.541 -3.718 1.00 13.23 C ATOM 810 OG1 THR A 51 0.839 -36.799 -3.798 1.00 13.32 O ATOM 811 CG2 THR A 51 2.895 -37.289 -4.964 1.00 45.12 C ATOM 0 H THR A 51 3.191 -39.141 -2.032 1.00 52.32 H new ATOM 0 HA THR A 51 0.676 -39.183 -3.506 1.00 61.03 H new ATOM 0 HB THR A 51 2.629 -37.213 -2.848 1.00 13.23 H new ATOM 0 HG1 THR A 51 1.038 -35.863 -4.010 1.00 13.32 H new ATOM 0 HG21 THR A 51 3.097 -36.222 -5.057 1.00 45.12 H new ATOM 0 HG22 THR A 51 3.837 -37.832 -4.887 1.00 45.12 H new ATOM 0 HG23 THR A 51 2.349 -37.632 -5.843 1.00 45.12 H new ATOM 819 N GLN A 52 3.560 -40.226 -4.662 1.00 25.44 N ATOM 820 CA GLN A 52 4.205 -40.958 -5.746 1.00 33.43 C ATOM 821 C GLN A 52 4.716 -42.311 -5.261 1.00 1.12 C ATOM 822 O GLN A 52 5.771 -42.776 -5.691 1.00 74.44 O ATOM 823 CB GLN A 52 5.360 -40.141 -6.325 1.00 44.22 C ATOM 824 CG GLN A 52 6.494 -39.906 -5.340 1.00 31.32 C ATOM 825 CD GLN A 52 6.156 -38.855 -4.301 1.00 43.13 C ATOM 826 OE1 GLN A 52 6.195 -37.656 -4.579 1.00 45.04 O ATOM 827 NE2 GLN A 52 5.822 -39.299 -3.096 1.00 33.45 N ATOM 0 H GLN A 52 4.149 -40.083 -3.841 1.00 25.44 H new ATOM 0 HA GLN A 52 3.464 -41.129 -6.527 1.00 33.43 H new ATOM 0 HB2 GLN A 52 5.753 -40.654 -7.203 1.00 44.22 H new ATOM 0 HB3 GLN A 52 4.979 -39.178 -6.663 1.00 44.22 H new ATOM 0 HG2 GLN A 52 6.734 -40.843 -4.838 1.00 31.32 H new ATOM 0 HG3 GLN A 52 7.386 -39.598 -5.886 1.00 31.32 H new ATOM 0 HE21 GLN A 52 5.803 -40.302 -2.909 1.00 33.45 H new ATOM 0 HE22 GLN A 52 5.585 -38.638 -2.357 1.00 33.45 H new ATOM 836 N GLU A 53 3.962 -42.936 -4.362 1.00 54.22 N ATOM 837 CA GLU A 53 4.340 -44.235 -3.818 1.00 44.33 C ATOM 838 C GLU A 53 3.106 -45.037 -3.415 1.00 4.51 C ATOM 839 O GLU A 53 3.098 -46.266 -3.494 1.00 15.24 O ATOM 840 CB GLU A 53 5.264 -44.057 -2.611 1.00 71.33 C ATOM 841 CG GLU A 53 6.681 -43.655 -2.983 1.00 62.31 C ATOM 842 CD GLU A 53 7.714 -44.193 -2.012 1.00 0.23 C ATOM 843 OE1 GLU A 53 7.916 -43.562 -0.953 1.00 24.02 O ATOM 844 OE2 GLU A 53 8.320 -45.243 -2.310 1.00 33.22 O ATOM 0 H GLU A 53 3.086 -42.564 -3.995 1.00 54.22 H new ATOM 0 HA GLU A 53 4.871 -44.785 -4.595 1.00 44.33 H new ATOM 0 HB2 GLU A 53 4.842 -43.300 -1.950 1.00 71.33 H new ATOM 0 HB3 GLU A 53 5.296 -44.990 -2.048 1.00 71.33 H new ATOM 0 HG2 GLU A 53 6.906 -44.018 -3.986 1.00 62.31 H new ATOM 0 HG3 GLU A 53 6.750 -42.568 -3.015 1.00 62.31 H new ATOM 851 N LEU A 54 2.066 -44.332 -2.982 1.00 63.52 N ATOM 852 CA LEU A 54 0.826 -44.977 -2.565 1.00 71.44 C ATOM 853 C LEU A 54 -0.366 -44.412 -3.331 1.00 41.12 C ATOM 854 O LEU A 54 -1.443 -45.007 -3.352 1.00 75.13 O ATOM 855 CB LEU A 54 0.613 -44.795 -1.062 1.00 5.24 C ATOM 856 CG LEU A 54 -0.693 -45.353 -0.496 1.00 0.43 C ATOM 857 CD1 LEU A 54 -1.844 -44.398 -0.770 1.00 53.32 C ATOM 858 CD2 LEU A 54 -0.985 -46.726 -1.083 1.00 11.14 C ATOM 0 H LEU A 54 2.057 -43.315 -2.911 1.00 63.52 H new ATOM 0 HA LEU A 54 0.907 -46.041 -2.788 1.00 71.44 H new ATOM 0 HB2 LEU A 54 1.444 -45.268 -0.538 1.00 5.24 H new ATOM 0 HB3 LEU A 54 0.658 -43.730 -0.836 1.00 5.24 H new ATOM 0 HG LEU A 54 -0.584 -45.458 0.583 1.00 0.43 H new ATOM 0 HD11 LEU A 54 -2.765 -44.812 -0.360 1.00 53.32 H new ATOM 0 HD12 LEU A 54 -1.638 -43.436 -0.301 1.00 53.32 H new ATOM 0 HD13 LEU A 54 -1.955 -44.261 -1.846 1.00 53.32 H new ATOM 0 HD21 LEU A 54 -1.918 -47.108 -0.669 1.00 11.14 H new ATOM 0 HD22 LEU A 54 -1.074 -46.647 -2.166 1.00 11.14 H new ATOM 0 HD23 LEU A 54 -0.172 -47.408 -0.835 1.00 11.14 H new ATOM 870 N LYS A 55 -0.165 -43.260 -3.962 1.00 3.34 N ATOM 871 CA LYS A 55 -1.221 -42.614 -4.732 1.00 63.25 C ATOM 872 C LYS A 55 -0.692 -42.127 -6.078 1.00 31.31 C ATOM 873 O LYS A 55 -1.384 -41.417 -6.808 1.00 54.21 O ATOM 874 CB LYS A 55 -1.808 -41.439 -3.948 1.00 2.04 C ATOM 875 CG LYS A 55 -1.496 -40.084 -4.558 1.00 55.43 C ATOM 876 CD LYS A 55 -1.769 -38.955 -3.579 1.00 1.45 C ATOM 877 CE LYS A 55 -3.192 -39.012 -3.044 1.00 4.13 C ATOM 878 NZ LYS A 55 -3.485 -37.877 -2.125 1.00 50.14 N ATOM 0 H LYS A 55 0.721 -42.754 -3.955 1.00 3.34 H new ATOM 0 HA LYS A 55 -2.005 -43.349 -4.913 1.00 63.25 H new ATOM 0 HB2 LYS A 55 -2.890 -41.559 -3.885 1.00 2.04 H new ATOM 0 HB3 LYS A 55 -1.424 -41.466 -2.928 1.00 2.04 H new ATOM 0 HG2 LYS A 55 -0.451 -40.055 -4.866 1.00 55.43 H new ATOM 0 HG3 LYS A 55 -2.097 -39.941 -5.456 1.00 55.43 H new ATOM 0 HD2 LYS A 55 -1.065 -39.014 -2.749 1.00 1.45 H new ATOM 0 HD3 LYS A 55 -1.603 -37.997 -4.071 1.00 1.45 H new ATOM 0 HE2 LYS A 55 -3.894 -38.995 -3.877 1.00 4.13 H new ATOM 0 HE3 LYS A 55 -3.345 -39.954 -2.518 1.00 4.13 H new ATOM 0 HZ1 LYS A 55 -4.175 -38.180 -1.409 1.00 50.14 H new ATOM 0 HZ2 LYS A 55 -2.608 -37.576 -1.655 1.00 50.14 H new ATOM 0 HZ3 LYS A 55 -3.877 -37.082 -2.669 1.00 50.14 H new ATOM 892 N LEU A 56 0.537 -42.515 -6.401 1.00 11.54 N ATOM 893 CA LEU A 56 1.158 -42.119 -7.660 1.00 10.41 C ATOM 894 C LEU A 56 0.294 -42.532 -8.847 1.00 21.51 C ATOM 895 O LEU A 56 0.437 -41.998 -9.946 1.00 63.43 O ATOM 896 CB LEU A 56 2.549 -42.744 -7.784 1.00 54.51 C ATOM 897 CG LEU A 56 2.659 -43.956 -8.709 1.00 23.44 C ATOM 898 CD1 LEU A 56 2.876 -43.513 -10.147 1.00 71.11 C ATOM 899 CD2 LEU A 56 3.787 -44.872 -8.255 1.00 43.40 C ATOM 0 H LEU A 56 1.123 -43.103 -5.809 1.00 11.54 H new ATOM 0 HA LEU A 56 1.253 -41.033 -7.664 1.00 10.41 H new ATOM 0 HB2 LEU A 56 3.239 -41.978 -8.138 1.00 54.51 H new ATOM 0 HB3 LEU A 56 2.883 -43.040 -6.789 1.00 54.51 H new ATOM 0 HG LEU A 56 1.723 -44.512 -8.660 1.00 23.44 H new ATOM 0 HD11 LEU A 56 2.952 -44.390 -10.790 1.00 71.11 H new ATOM 0 HD12 LEU A 56 2.036 -42.898 -10.469 1.00 71.11 H new ATOM 0 HD13 LEU A 56 3.796 -42.933 -10.214 1.00 71.11 H new ATOM 0 HD21 LEU A 56 3.851 -45.730 -8.925 1.00 43.40 H new ATOM 0 HD22 LEU A 56 4.730 -44.325 -8.274 1.00 43.40 H new ATOM 0 HD23 LEU A 56 3.589 -45.218 -7.240 1.00 43.40 H new ATOM 911 N GLN A 57 -0.603 -43.485 -8.615 1.00 72.35 N ATOM 912 CA GLN A 57 -1.491 -43.969 -9.666 1.00 32.11 C ATOM 913 C GLN A 57 -2.937 -43.579 -9.379 1.00 13.31 C ATOM 914 O GLN A 57 -3.680 -43.206 -10.286 1.00 15.21 O ATOM 915 CB GLN A 57 -1.377 -45.489 -9.799 1.00 55.32 C ATOM 916 CG GLN A 57 -1.743 -46.240 -8.529 1.00 52.13 C ATOM 917 CD GLN A 57 -0.769 -45.981 -7.397 1.00 0.10 C ATOM 918 OE1 GLN A 57 -1.168 -45.831 -6.242 1.00 23.04 O ATOM 919 NE2 GLN A 57 0.517 -45.927 -7.723 1.00 21.00 N ATOM 0 H GLN A 57 -0.734 -43.937 -7.710 1.00 72.35 H new ATOM 0 HA GLN A 57 -1.188 -43.505 -10.605 1.00 32.11 H new ATOM 0 HB2 GLN A 57 -2.025 -45.824 -10.609 1.00 55.32 H new ATOM 0 HB3 GLN A 57 -0.356 -45.745 -10.081 1.00 55.32 H new ATOM 0 HG2 GLN A 57 -2.745 -45.948 -8.215 1.00 52.13 H new ATOM 0 HG3 GLN A 57 -1.774 -47.309 -8.740 1.00 52.13 H new ATOM 0 HE21 GLN A 57 0.803 -46.057 -8.693 1.00 21.00 H new ATOM 0 HE22 GLN A 57 1.219 -45.755 -7.003 1.00 21.00 H new ATOM 928 N GLU A 58 -3.329 -43.668 -8.112 1.00 1.14 N ATOM 929 CA GLU A 58 -4.687 -43.325 -7.707 1.00 0.25 C ATOM 930 C GLU A 58 -5.117 -41.993 -8.316 1.00 24.40 C ATOM 931 O GLU A 58 -6.210 -41.875 -8.869 1.00 35.14 O ATOM 932 CB GLU A 58 -4.786 -43.256 -6.181 1.00 42.52 C ATOM 933 CG GLU A 58 -6.190 -42.972 -5.674 1.00 71.55 C ATOM 934 CD GLU A 58 -6.997 -44.237 -5.455 1.00 71.41 C ATOM 935 OE1 GLU A 58 -7.241 -44.965 -6.440 1.00 43.23 O ATOM 936 OE2 GLU A 58 -7.385 -44.500 -4.297 1.00 41.42 O ATOM 0 H GLU A 58 -2.726 -43.975 -7.349 1.00 1.14 H new ATOM 0 HA GLU A 58 -5.355 -44.105 -8.073 1.00 0.25 H new ATOM 0 HB2 GLU A 58 -4.441 -44.200 -5.760 1.00 42.52 H new ATOM 0 HB3 GLU A 58 -4.113 -42.480 -5.816 1.00 42.52 H new ATOM 0 HG2 GLU A 58 -6.129 -42.417 -4.738 1.00 71.55 H new ATOM 0 HG3 GLU A 58 -6.709 -42.334 -6.389 1.00 71.55 H new ATOM 943 N PHE A 59 -4.248 -40.993 -8.210 1.00 62.45 N ATOM 944 CA PHE A 59 -4.537 -39.670 -8.749 1.00 41.53 C ATOM 945 C PHE A 59 -4.620 -39.708 -10.272 1.00 65.55 C ATOM 946 O PHE A 59 -5.594 -39.244 -10.863 1.00 12.11 O ATOM 947 CB PHE A 59 -3.463 -38.672 -8.311 1.00 11.41 C ATOM 948 CG PHE A 59 -3.923 -37.730 -7.235 1.00 32.33 C ATOM 949 CD1 PHE A 59 -5.101 -37.015 -7.379 1.00 2.50 C ATOM 950 CD2 PHE A 59 -3.178 -37.562 -6.079 1.00 14.44 C ATOM 951 CE1 PHE A 59 -5.526 -36.147 -6.391 1.00 22.15 C ATOM 952 CE2 PHE A 59 -3.599 -36.696 -5.086 1.00 43.14 C ATOM 953 CZ PHE A 59 -4.775 -35.989 -5.242 1.00 44.53 C ATOM 0 H PHE A 59 -3.338 -41.074 -7.756 1.00 62.45 H new ATOM 0 HA PHE A 59 -5.503 -39.350 -8.358 1.00 41.53 H new ATOM 0 HB2 PHE A 59 -2.592 -39.221 -7.954 1.00 11.41 H new ATOM 0 HB3 PHE A 59 -3.142 -38.093 -9.177 1.00 11.41 H new ATOM 0 HD1 PHE A 59 -5.694 -37.137 -8.273 1.00 2.50 H new ATOM 0 HD2 PHE A 59 -2.258 -38.113 -5.952 1.00 14.44 H new ATOM 0 HE1 PHE A 59 -6.444 -35.593 -6.517 1.00 22.15 H new ATOM 0 HE2 PHE A 59 -3.009 -36.573 -4.190 1.00 43.14 H new ATOM 0 HZ PHE A 59 -5.107 -35.314 -4.467 1.00 44.53 H new ATOM 963 N GLN A 60 -3.589 -40.265 -10.901 1.00 33.41 N ATOM 964 CA GLN A 60 -3.545 -40.364 -12.355 1.00 44.21 C ATOM 965 C GLN A 60 -4.796 -41.051 -12.893 1.00 3.42 C ATOM 966 O GLN A 60 -5.343 -40.649 -13.920 1.00 33.02 O ATOM 967 CB GLN A 60 -2.297 -41.131 -12.797 1.00 53.23 C ATOM 968 CG GLN A 60 -1.713 -40.636 -14.111 1.00 21.52 C ATOM 969 CD GLN A 60 -0.317 -41.169 -14.366 1.00 21.53 C ATOM 970 OE1 GLN A 60 -0.146 -42.258 -14.916 1.00 52.30 O ATOM 971 NE2 GLN A 60 0.692 -40.404 -13.966 1.00 54.42 N ATOM 0 H GLN A 60 -2.774 -40.654 -10.427 1.00 33.41 H new ATOM 0 HA GLN A 60 -3.505 -39.353 -12.762 1.00 44.21 H new ATOM 0 HB2 GLN A 60 -1.538 -41.053 -12.019 1.00 53.23 H new ATOM 0 HB3 GLN A 60 -2.546 -42.188 -12.894 1.00 53.23 H new ATOM 0 HG2 GLN A 60 -2.367 -40.934 -14.930 1.00 21.52 H new ATOM 0 HG3 GLN A 60 -1.686 -39.546 -14.105 1.00 21.52 H new ATOM 0 HE21 GLN A 60 0.505 -39.509 -13.514 1.00 54.42 H new ATOM 0 HE22 GLN A 60 1.654 -40.712 -14.110 1.00 54.42 H new ATOM 980 N ASP A 61 -5.242 -42.088 -12.193 1.00 52.40 N ATOM 981 CA ASP A 61 -6.429 -42.830 -12.600 1.00 35.32 C ATOM 982 C ASP A 61 -7.674 -41.951 -12.521 1.00 62.31 C ATOM 983 O ASP A 61 -8.478 -41.911 -13.453 1.00 25.24 O ATOM 984 CB ASP A 61 -6.608 -44.069 -11.721 1.00 15.15 C ATOM 985 CG ASP A 61 -7.155 -45.253 -12.493 1.00 74.20 C ATOM 986 OD1 ASP A 61 -8.146 -45.073 -13.233 1.00 25.30 O ATOM 987 OD2 ASP A 61 -6.593 -46.360 -12.358 1.00 41.34 O ATOM 0 H ASP A 61 -4.800 -42.434 -11.341 1.00 52.40 H new ATOM 0 HA ASP A 61 -6.293 -43.144 -13.635 1.00 35.32 H new ATOM 0 HB2 ASP A 61 -5.649 -44.339 -11.279 1.00 15.15 H new ATOM 0 HB3 ASP A 61 -7.283 -43.833 -10.898 1.00 15.15 H new ATOM 992 N SER A 62 -7.826 -41.249 -11.403 1.00 34.22 N ATOM 993 CA SER A 62 -8.975 -40.374 -11.200 1.00 74.52 C ATOM 994 C SER A 62 -9.088 -39.355 -12.330 1.00 4.25 C ATOM 995 O SER A 62 -10.119 -39.261 -12.997 1.00 44.10 O ATOM 996 CB SER A 62 -8.863 -39.653 -9.856 1.00 32.12 C ATOM 997 OG SER A 62 -7.554 -39.764 -9.325 1.00 62.02 O ATOM 0 H SER A 62 -7.168 -41.269 -10.624 1.00 34.22 H new ATOM 0 HA SER A 62 -9.874 -40.990 -11.199 1.00 74.52 H new ATOM 0 HB2 SER A 62 -9.120 -38.601 -9.982 1.00 32.12 H new ATOM 0 HB3 SER A 62 -9.581 -40.075 -9.153 1.00 32.12 H new ATOM 0 HG SER A 62 -6.939 -39.212 -9.852 1.00 62.02 H new ATOM 1003 N LEU A 63 -8.020 -38.592 -12.538 1.00 22.43 N ATOM 1004 CA LEU A 63 -7.996 -37.578 -13.586 1.00 74.43 C ATOM 1005 C LEU A 63 -8.230 -38.206 -14.956 1.00 75.45 C ATOM 1006 O LEU A 63 -8.837 -37.595 -15.836 1.00 74.33 O ATOM 1007 CB LEU A 63 -6.659 -36.835 -13.575 1.00 33.52 C ATOM 1008 CG LEU A 63 -6.199 -36.303 -12.217 1.00 40.14 C ATOM 1009 CD1 LEU A 63 -5.183 -35.186 -12.399 1.00 24.32 C ATOM 1010 CD2 LEU A 63 -7.389 -35.816 -11.404 1.00 34.11 C ATOM 0 H LEU A 63 -7.159 -38.657 -11.994 1.00 22.43 H new ATOM 0 HA LEU A 63 -8.800 -36.869 -13.389 1.00 74.43 H new ATOM 0 HB2 LEU A 63 -5.890 -37.505 -13.960 1.00 33.52 H new ATOM 0 HB3 LEU A 63 -6.726 -35.996 -14.268 1.00 33.52 H new ATOM 0 HG LEU A 63 -5.721 -37.117 -11.672 1.00 40.14 H new ATOM 0 HD11 LEU A 63 -4.867 -34.819 -11.423 1.00 24.32 H new ATOM 0 HD12 LEU A 63 -4.318 -35.566 -12.942 1.00 24.32 H new ATOM 0 HD13 LEU A 63 -5.636 -34.371 -12.963 1.00 24.32 H new ATOM 0 HD21 LEU A 63 -7.043 -35.441 -10.441 1.00 34.11 H new ATOM 0 HD22 LEU A 63 -7.896 -35.016 -11.944 1.00 34.11 H new ATOM 0 HD23 LEU A 63 -8.083 -36.642 -11.244 1.00 34.11 H new ATOM 1022 N LYS A 64 -7.747 -39.432 -15.130 1.00 41.33 N ATOM 1023 CA LYS A 64 -7.906 -40.146 -16.392 1.00 4.43 C ATOM 1024 C LYS A 64 -9.362 -40.542 -16.613 1.00 41.10 C ATOM 1025 O LYS A 64 -9.915 -40.335 -17.693 1.00 72.23 O ATOM 1026 CB LYS A 64 -7.018 -41.392 -16.411 1.00 72.21 C ATOM 1027 CG LYS A 64 -6.902 -42.035 -17.783 1.00 4.54 C ATOM 1028 CD LYS A 64 -6.858 -43.550 -17.686 1.00 64.34 C ATOM 1029 CE LYS A 64 -8.247 -44.157 -17.812 1.00 25.31 C ATOM 1030 NZ LYS A 64 -8.425 -44.872 -19.106 1.00 42.12 N ATOM 0 H LYS A 64 -7.242 -39.952 -14.412 1.00 41.33 H new ATOM 0 HA LYS A 64 -7.603 -39.479 -17.199 1.00 4.43 H new ATOM 0 HB2 LYS A 64 -6.022 -41.123 -16.059 1.00 72.21 H new ATOM 0 HB3 LYS A 64 -7.418 -42.124 -15.709 1.00 72.21 H new ATOM 0 HG2 LYS A 64 -7.748 -41.733 -18.400 1.00 4.54 H new ATOM 0 HG3 LYS A 64 -6.001 -41.675 -18.280 1.00 4.54 H new ATOM 0 HD2 LYS A 64 -6.214 -43.947 -18.470 1.00 64.34 H new ATOM 0 HD3 LYS A 64 -6.417 -43.842 -16.733 1.00 64.34 H new ATOM 0 HE2 LYS A 64 -8.416 -44.850 -16.988 1.00 25.31 H new ATOM 0 HE3 LYS A 64 -8.996 -43.370 -17.726 1.00 25.31 H new ATOM 0 HZ1 LYS A 64 -9.384 -45.271 -19.153 1.00 42.12 H new ATOM 0 HZ2 LYS A 64 -8.288 -44.205 -19.893 1.00 42.12 H new ATOM 0 HZ3 LYS A 64 -7.727 -45.639 -19.177 1.00 42.12 H new ATOM 1044 N LYS A 65 -9.978 -41.111 -15.583 1.00 35.21 N ATOM 1045 CA LYS A 65 -11.372 -41.534 -15.663 1.00 25.11 C ATOM 1046 C LYS A 65 -12.277 -40.360 -16.019 1.00 52.42 C ATOM 1047 O LYS A 65 -13.113 -40.457 -16.918 1.00 30.53 O ATOM 1048 CB LYS A 65 -11.816 -42.150 -14.334 1.00 51.04 C ATOM 1049 CG LYS A 65 -13.151 -42.871 -14.414 1.00 42.54 C ATOM 1050 CD LYS A 65 -13.064 -44.109 -15.291 1.00 13.14 C ATOM 1051 CE LYS A 65 -13.519 -43.818 -16.713 1.00 32.54 C ATOM 1052 NZ LYS A 65 -14.969 -44.101 -16.900 1.00 32.42 N ATOM 0 H LYS A 65 -9.534 -41.290 -14.682 1.00 35.21 H new ATOM 0 HA LYS A 65 -11.454 -42.284 -16.450 1.00 25.11 H new ATOM 0 HB2 LYS A 65 -11.053 -42.851 -13.995 1.00 51.04 H new ATOM 0 HB3 LYS A 65 -11.882 -41.363 -13.582 1.00 51.04 H new ATOM 0 HG2 LYS A 65 -13.473 -43.156 -13.412 1.00 42.54 H new ATOM 0 HG3 LYS A 65 -13.908 -42.195 -14.812 1.00 42.54 H new ATOM 0 HD2 LYS A 65 -12.038 -44.475 -15.304 1.00 13.14 H new ATOM 0 HD3 LYS A 65 -13.680 -44.901 -14.866 1.00 13.14 H new ATOM 0 HE2 LYS A 65 -13.319 -42.773 -16.952 1.00 32.54 H new ATOM 0 HE3 LYS A 65 -12.938 -44.421 -17.411 1.00 32.54 H new ATOM 0 HZ1 LYS A 65 -15.240 -43.890 -17.882 1.00 32.42 H new ATOM 0 HZ2 LYS A 65 -15.156 -45.104 -16.697 1.00 32.42 H new ATOM 0 HZ3 LYS A 65 -15.525 -43.507 -16.252 1.00 32.42 H new ATOM 1066 N VAL A 66 -12.105 -39.249 -15.310 1.00 45.41 N ATOM 1067 CA VAL A 66 -12.904 -38.054 -15.554 1.00 35.25 C ATOM 1068 C VAL A 66 -12.611 -37.467 -16.929 1.00 62.15 C ATOM 1069 O VAL A 66 -13.524 -37.070 -17.653 1.00 4.44 O ATOM 1070 CB VAL A 66 -12.646 -36.978 -14.482 1.00 53.25 C ATOM 1071 CG1 VAL A 66 -11.169 -36.617 -14.433 1.00 34.11 C ATOM 1072 CG2 VAL A 66 -13.496 -35.745 -14.751 1.00 40.00 C ATOM 0 H VAL A 66 -11.419 -39.152 -14.561 1.00 45.41 H new ATOM 0 HA VAL A 66 -13.950 -38.358 -15.509 1.00 35.25 H new ATOM 0 HB VAL A 66 -12.929 -37.382 -13.510 1.00 53.25 H new ATOM 0 HG11 VAL A 66 -11.006 -35.856 -13.670 1.00 34.11 H new ATOM 0 HG12 VAL A 66 -10.585 -37.505 -14.190 1.00 34.11 H new ATOM 0 HG13 VAL A 66 -10.856 -36.231 -15.403 1.00 34.11 H new ATOM 0 HG21 VAL A 66 -13.302 -34.995 -13.985 1.00 40.00 H new ATOM 0 HG22 VAL A 66 -13.245 -35.337 -15.730 1.00 40.00 H new ATOM 0 HG23 VAL A 66 -14.551 -36.019 -14.731 1.00 40.00 H new ATOM 1082 N GLU A 67 -11.331 -37.417 -17.284 1.00 43.44 N ATOM 1083 CA GLU A 67 -10.917 -36.877 -18.575 1.00 32.44 C ATOM 1084 C GLU A 67 -11.615 -37.608 -19.718 1.00 44.05 C ATOM 1085 O GLU A 67 -12.044 -36.992 -20.694 1.00 52.20 O ATOM 1086 CB GLU A 67 -9.399 -36.987 -18.735 1.00 54.32 C ATOM 1087 CG GLU A 67 -8.640 -35.798 -18.170 1.00 53.01 C ATOM 1088 CD GLU A 67 -7.817 -35.079 -19.221 1.00 5.03 C ATOM 1089 OE1 GLU A 67 -6.868 -35.693 -19.752 1.00 45.11 O ATOM 1090 OE2 GLU A 67 -8.120 -33.903 -19.511 1.00 71.22 O ATOM 0 H GLU A 67 -10.563 -37.743 -16.697 1.00 43.44 H new ATOM 0 HA GLU A 67 -11.203 -35.826 -18.610 1.00 32.44 H new ATOM 0 HB2 GLU A 67 -9.055 -37.895 -18.241 1.00 54.32 H new ATOM 0 HB3 GLU A 67 -9.160 -37.090 -19.793 1.00 54.32 H new ATOM 0 HG2 GLU A 67 -9.347 -35.098 -17.726 1.00 53.01 H new ATOM 0 HG3 GLU A 67 -7.983 -36.138 -17.369 1.00 53.01 H new ATOM 1097 N LYS A 68 -11.723 -38.926 -19.592 1.00 33.14 N ATOM 1098 CA LYS A 68 -12.369 -39.743 -20.613 1.00 5.13 C ATOM 1099 C LYS A 68 -13.876 -39.513 -20.620 1.00 75.33 C ATOM 1100 O LYS A 68 -14.478 -39.314 -21.675 1.00 41.02 O ATOM 1101 CB LYS A 68 -12.069 -41.225 -20.374 1.00 43.44 C ATOM 1102 CG LYS A 68 -11.647 -41.969 -21.629 1.00 71.32 C ATOM 1103 CD LYS A 68 -11.964 -43.452 -21.531 1.00 21.13 C ATOM 1104 CE LYS A 68 -13.385 -43.750 -21.984 1.00 41.22 C ATOM 1105 NZ LYS A 68 -14.221 -44.285 -20.874 1.00 41.40 N ATOM 0 H LYS A 68 -11.371 -39.452 -18.792 1.00 33.14 H new ATOM 0 HA LYS A 68 -11.970 -39.450 -21.584 1.00 5.13 H new ATOM 0 HB2 LYS A 68 -11.280 -41.312 -19.627 1.00 43.44 H new ATOM 0 HB3 LYS A 68 -12.955 -41.704 -19.958 1.00 43.44 H new ATOM 0 HG2 LYS A 68 -12.156 -41.544 -22.494 1.00 71.32 H new ATOM 0 HG3 LYS A 68 -10.577 -41.834 -21.791 1.00 71.32 H new ATOM 0 HD2 LYS A 68 -11.260 -44.017 -22.143 1.00 21.13 H new ATOM 0 HD3 LYS A 68 -11.832 -43.786 -20.502 1.00 21.13 H new ATOM 0 HE2 LYS A 68 -13.840 -42.840 -22.375 1.00 41.22 H new ATOM 0 HE3 LYS A 68 -13.362 -44.471 -22.801 1.00 41.22 H new ATOM 0 HZ1 LYS A 68 -15.182 -44.475 -21.224 1.00 41.40 H new ATOM 0 HZ2 LYS A 68 -13.801 -45.167 -20.517 1.00 41.40 H new ATOM 0 HZ3 LYS A 68 -14.265 -43.587 -20.105 1.00 41.40 H new ATOM 1119 N ALA A 69 -14.481 -39.541 -19.437 1.00 22.40 N ATOM 1120 CA ALA A 69 -15.918 -39.333 -19.308 1.00 4.22 C ATOM 1121 C ALA A 69 -16.288 -37.880 -19.584 1.00 13.30 C ATOM 1122 O ALA A 69 -17.467 -37.537 -19.680 1.00 22.24 O ATOM 1123 CB ALA A 69 -16.388 -39.745 -17.921 1.00 32.21 C ATOM 0 H ALA A 69 -13.998 -39.706 -18.554 1.00 22.40 H new ATOM 0 HA ALA A 69 -16.419 -39.956 -20.049 1.00 4.22 H new ATOM 0 HB1 ALA A 69 -17.463 -39.584 -17.838 1.00 32.21 H new ATOM 0 HB2 ALA A 69 -16.165 -40.800 -17.760 1.00 32.21 H new ATOM 0 HB3 ALA A 69 -15.873 -39.146 -17.170 1.00 32.21 H new ATOM 1129 N SER A 70 -15.275 -37.029 -19.710 1.00 41.15 N ATOM 1130 CA SER A 70 -15.495 -35.611 -19.971 1.00 60.21 C ATOM 1131 C SER A 70 -15.065 -35.246 -21.389 1.00 32.41 C ATOM 1132 O SER A 70 -15.467 -34.213 -21.926 1.00 30.14 O ATOM 1133 CB SER A 70 -14.727 -34.760 -18.958 1.00 52.43 C ATOM 1134 OG SER A 70 -15.326 -34.828 -17.676 1.00 32.51 O ATOM 0 H SER A 70 -14.294 -37.297 -19.636 1.00 41.15 H new ATOM 0 HA SER A 70 -16.561 -35.409 -19.871 1.00 60.21 H new ATOM 0 HB2 SER A 70 -13.694 -35.103 -18.899 1.00 52.43 H new ATOM 0 HB3 SER A 70 -14.700 -33.724 -19.295 1.00 52.43 H new ATOM 0 HG SER A 70 -14.972 -35.602 -17.190 1.00 32.51 H new ATOM 1140 N LEU A 71 -14.246 -36.102 -21.990 1.00 41.23 N ATOM 1141 CA LEU A 71 -13.760 -35.871 -23.346 1.00 72.34 C ATOM 1142 C LEU A 71 -14.325 -36.909 -24.311 1.00 31.21 C ATOM 1143 O LEU A 71 -14.020 -36.896 -25.504 1.00 51.30 O ATOM 1144 CB LEU A 71 -12.231 -35.910 -23.375 1.00 73.43 C ATOM 1145 CG LEU A 71 -11.517 -34.800 -22.605 1.00 2.51 C ATOM 1146 CD1 LEU A 71 -10.346 -34.258 -23.411 1.00 73.51 C ATOM 1147 CD2 LEU A 71 -12.489 -33.682 -22.257 1.00 1.34 C ATOM 0 H LEU A 71 -13.905 -36.962 -21.560 1.00 41.23 H new ATOM 0 HA LEU A 71 -14.098 -34.885 -23.663 1.00 72.34 H new ATOM 0 HB2 LEU A 71 -11.904 -36.870 -22.975 1.00 73.43 H new ATOM 0 HB3 LEU A 71 -11.906 -35.870 -24.415 1.00 73.43 H new ATOM 0 HG LEU A 71 -11.129 -35.220 -21.677 1.00 2.51 H new ATOM 0 HD11 LEU A 71 -9.850 -33.469 -22.846 1.00 73.51 H new ATOM 0 HD12 LEU A 71 -9.638 -35.062 -23.609 1.00 73.51 H new ATOM 0 HD13 LEU A 71 -10.710 -33.854 -24.356 1.00 73.51 H new ATOM 0 HD21 LEU A 71 -11.963 -32.900 -21.709 1.00 1.34 H new ATOM 0 HD22 LEU A 71 -12.907 -33.265 -23.173 1.00 1.34 H new ATOM 0 HD23 LEU A 71 -13.294 -34.079 -21.639 1.00 1.34 H new ATOM 1159 N THR A 72 -15.153 -37.808 -23.787 1.00 23.11 N ATOM 1160 CA THR A 72 -15.762 -38.853 -24.601 1.00 5.52 C ATOM 1161 C THR A 72 -16.338 -38.279 -25.890 1.00 41.12 C ATOM 1162 O THR A 72 -16.375 -38.953 -26.918 1.00 63.24 O ATOM 1163 CB THR A 72 -16.879 -39.583 -23.833 1.00 20.51 C ATOM 1164 OG1 THR A 72 -17.295 -38.799 -22.710 1.00 34.24 O ATOM 1165 CG2 THR A 72 -16.405 -40.948 -23.357 1.00 70.41 C ATOM 0 H THR A 72 -15.417 -37.833 -22.802 1.00 23.11 H new ATOM 0 HA THR A 72 -14.973 -39.565 -24.844 1.00 5.52 H new ATOM 0 HB THR A 72 -17.722 -39.724 -24.509 1.00 20.51 H new ATOM 0 HG1 THR A 72 -16.707 -38.982 -21.947 1.00 34.24 H new ATOM 0 HG21 THR A 72 -17.211 -41.445 -22.817 1.00 70.41 H new ATOM 0 HG22 THR A 72 -16.117 -41.553 -24.217 1.00 70.41 H new ATOM 0 HG23 THR A 72 -15.547 -40.825 -22.696 1.00 70.41 H new ATOM 1173 N ASN A 73 -16.787 -37.029 -25.828 1.00 25.31 N ATOM 1174 CA ASN A 73 -17.361 -36.365 -26.992 1.00 14.21 C ATOM 1175 C ASN A 73 -17.247 -34.849 -26.864 1.00 53.32 C ATOM 1176 O ASN A 73 -18.011 -34.104 -27.479 1.00 52.45 O ATOM 1177 CB ASN A 73 -18.829 -36.765 -27.161 1.00 4.34 C ATOM 1178 CG ASN A 73 -19.364 -37.519 -25.959 1.00 12.43 C ATOM 1179 OD1 ASN A 73 -19.234 -38.740 -25.869 1.00 43.53 O ATOM 1180 ND2 ASN A 73 -19.971 -36.792 -25.027 1.00 72.33 N ATOM 0 H ASN A 73 -16.764 -36.456 -24.984 1.00 25.31 H new ATOM 0 HA ASN A 73 -16.802 -36.681 -27.873 1.00 14.21 H new ATOM 0 HB2 ASN A 73 -19.430 -35.870 -27.323 1.00 4.34 H new ATOM 0 HB3 ASN A 73 -18.934 -37.385 -28.052 1.00 4.34 H new ATOM 0 HD21 ASN A 73 -20.352 -37.244 -24.196 1.00 72.33 H new ATOM 0 HD22 ASN A 73 -20.056 -35.782 -25.143 1.00 72.33 H new ATOM 1187 N LEU A 74 -16.289 -34.399 -26.062 1.00 44.34 N ATOM 1188 CA LEU A 74 -16.073 -32.971 -25.854 1.00 31.02 C ATOM 1189 C LEU A 74 -14.719 -32.538 -26.408 1.00 34.14 C ATOM 1190 O LEU A 74 -14.064 -31.654 -25.855 1.00 24.31 O ATOM 1191 CB LEU A 74 -16.159 -32.634 -24.364 1.00 63.51 C ATOM 1192 CG LEU A 74 -17.409 -33.128 -23.635 1.00 71.13 C ATOM 1193 CD1 LEU A 74 -17.644 -32.318 -22.370 1.00 22.23 C ATOM 1194 CD2 LEU A 74 -18.623 -33.056 -24.550 1.00 11.41 C ATOM 0 H LEU A 74 -15.649 -35.002 -25.545 1.00 44.34 H new ATOM 0 HA LEU A 74 -16.853 -32.429 -26.389 1.00 31.02 H new ATOM 0 HB2 LEU A 74 -15.284 -33.052 -23.866 1.00 63.51 H new ATOM 0 HB3 LEU A 74 -16.102 -31.551 -24.253 1.00 63.51 H new ATOM 0 HG LEU A 74 -17.254 -34.169 -23.352 1.00 71.13 H new ATOM 0 HD11 LEU A 74 -18.538 -32.684 -21.865 1.00 22.23 H new ATOM 0 HD12 LEU A 74 -16.785 -32.421 -21.707 1.00 22.23 H new ATOM 0 HD13 LEU A 74 -17.778 -31.268 -22.630 1.00 22.23 H new ATOM 0 HD21 LEU A 74 -19.504 -33.411 -24.015 1.00 11.41 H new ATOM 0 HD22 LEU A 74 -18.781 -32.024 -24.864 1.00 11.41 H new ATOM 0 HD23 LEU A 74 -18.455 -33.681 -25.427 1.00 11.41 H new ATOM 1206 N THR A 75 -14.307 -33.165 -27.505 1.00 24.11 N ATOM 1207 CA THR A 75 -13.032 -32.844 -28.135 1.00 30.43 C ATOM 1208 C THR A 75 -12.765 -33.753 -29.329 1.00 62.20 C ATOM 1209 O THR A 75 -13.041 -34.953 -29.301 1.00 4.21 O ATOM 1210 CB THR A 75 -11.865 -32.970 -27.137 1.00 71.31 C ATOM 1211 OG1 THR A 75 -12.295 -33.674 -25.966 1.00 52.43 O ATOM 1212 CG2 THR A 75 -11.338 -31.598 -26.746 1.00 24.25 C ATOM 0 H THR A 75 -14.838 -33.898 -27.976 1.00 24.11 H new ATOM 0 HA THR A 75 -13.099 -31.811 -28.476 1.00 30.43 H new ATOM 0 HB THR A 75 -11.061 -33.526 -27.619 1.00 71.31 H new ATOM 0 HG1 THR A 75 -12.451 -34.615 -26.189 1.00 52.43 H new ATOM 0 HG21 THR A 75 -10.515 -31.712 -26.041 1.00 24.25 H new ATOM 0 HG22 THR A 75 -10.984 -31.077 -27.636 1.00 24.25 H new ATOM 0 HG23 THR A 75 -12.137 -31.020 -26.281 1.00 24.25 H new ATOM 1220 N PRO A 76 -12.214 -33.171 -30.405 1.00 32.32 N ATOM 1221 CA PRO A 76 -11.896 -33.912 -31.630 1.00 14.45 C ATOM 1222 C PRO A 76 -10.734 -34.880 -31.437 1.00 12.34 C ATOM 1223 O PRO A 76 -10.695 -35.946 -32.049 1.00 35.30 O ATOM 1224 CB PRO A 76 -11.515 -32.810 -32.621 1.00 55.33 C ATOM 1225 CG PRO A 76 -11.045 -31.681 -31.771 1.00 1.31 C ATOM 1226 CD PRO A 76 -11.859 -31.746 -30.508 1.00 60.03 C ATOM 0 HA PRO A 76 -12.730 -34.532 -31.960 1.00 14.45 H new ATOM 0 HB2 PRO A 76 -10.733 -33.144 -33.303 1.00 55.33 H new ATOM 0 HB3 PRO A 76 -12.368 -32.516 -33.233 1.00 55.33 H new ATOM 0 HG2 PRO A 76 -9.981 -31.773 -31.554 1.00 1.31 H new ATOM 0 HG3 PRO A 76 -11.186 -30.726 -32.277 1.00 1.31 H new ATOM 0 HD2 PRO A 76 -11.287 -31.411 -29.643 1.00 60.03 H new ATOM 0 HD3 PRO A 76 -12.745 -31.114 -30.568 1.00 60.03 H new ATOM 1234 N GLU A 77 -9.790 -34.500 -30.582 1.00 24.45 N ATOM 1235 CA GLU A 77 -8.626 -35.336 -30.309 1.00 73.43 C ATOM 1236 C GLU A 77 -9.048 -36.766 -29.981 1.00 12.44 C ATOM 1237 O GLU A 77 -8.635 -37.716 -30.647 1.00 0.23 O ATOM 1238 CB GLU A 77 -7.812 -34.754 -29.152 1.00 20.52 C ATOM 1239 CG GLU A 77 -6.537 -34.057 -29.595 1.00 1.11 C ATOM 1240 CD GLU A 77 -5.299 -34.901 -29.362 1.00 1.15 C ATOM 1241 OE1 GLU A 77 -5.017 -35.786 -30.196 1.00 52.44 O ATOM 1242 OE2 GLU A 77 -4.612 -34.676 -28.343 1.00 44.23 O ATOM 0 H GLU A 77 -9.808 -33.620 -30.067 1.00 24.45 H new ATOM 0 HA GLU A 77 -8.006 -35.355 -31.205 1.00 73.43 H new ATOM 0 HB2 GLU A 77 -8.432 -34.045 -28.603 1.00 20.52 H new ATOM 0 HB3 GLU A 77 -7.556 -35.556 -28.460 1.00 20.52 H new ATOM 0 HG2 GLU A 77 -6.611 -33.812 -30.655 1.00 1.11 H new ATOM 0 HG3 GLU A 77 -6.436 -33.115 -29.056 1.00 1.11 H new ATOM 1249 N LEU A 78 -9.873 -36.910 -28.949 1.00 60.24 N ATOM 1250 CA LEU A 78 -10.352 -38.223 -28.531 1.00 25.14 C ATOM 1251 C LEU A 78 -10.950 -38.986 -29.708 1.00 45.25 C ATOM 1252 O LEU A 78 -10.517 -40.093 -30.030 1.00 1.15 O ATOM 1253 CB LEU A 78 -11.394 -38.078 -27.421 1.00 2.45 C ATOM 1254 CG LEU A 78 -10.846 -37.885 -26.006 1.00 44.22 C ATOM 1255 CD1 LEU A 78 -10.040 -39.101 -25.576 1.00 1.33 C ATOM 1256 CD2 LEU A 78 -9.995 -36.625 -25.931 1.00 31.21 C ATOM 0 H LEU A 78 -10.224 -36.134 -28.387 1.00 60.24 H new ATOM 0 HA LEU A 78 -9.501 -38.788 -28.151 1.00 25.14 H new ATOM 0 HB2 LEU A 78 -12.034 -37.229 -27.660 1.00 2.45 H new ATOM 0 HB3 LEU A 78 -12.027 -38.966 -27.426 1.00 2.45 H new ATOM 0 HG LEU A 78 -11.688 -37.772 -25.323 1.00 44.22 H new ATOM 0 HD11 LEU A 78 -9.658 -38.946 -24.567 1.00 1.33 H new ATOM 0 HD12 LEU A 78 -10.678 -39.984 -25.591 1.00 1.33 H new ATOM 0 HD13 LEU A 78 -9.205 -39.245 -26.262 1.00 1.33 H new ATOM 0 HD21 LEU A 78 -9.613 -36.503 -24.917 1.00 31.21 H new ATOM 0 HD22 LEU A 78 -9.159 -36.709 -26.626 1.00 31.21 H new ATOM 0 HD23 LEU A 78 -10.602 -35.760 -26.196 1.00 31.21 H new ATOM 1268 N LYS A 79 -11.946 -38.386 -30.351 1.00 3.51 N ATOM 1269 CA LYS A 79 -12.602 -39.005 -31.496 1.00 21.30 C ATOM 1270 C LYS A 79 -11.575 -39.593 -32.459 1.00 52.42 C ATOM 1271 O LYS A 79 -11.774 -40.676 -33.008 1.00 21.00 O ATOM 1272 CB LYS A 79 -13.474 -37.981 -32.226 1.00 33.52 C ATOM 1273 CG LYS A 79 -14.908 -37.938 -31.726 1.00 2.52 C ATOM 1274 CD LYS A 79 -15.819 -37.218 -32.707 1.00 23.34 C ATOM 1275 CE LYS A 79 -15.567 -35.718 -32.704 1.00 21.31 C ATOM 1276 NZ LYS A 79 -15.114 -35.229 -34.036 1.00 21.54 N ATOM 0 H LYS A 79 -12.317 -37.470 -30.098 1.00 3.51 H new ATOM 0 HA LYS A 79 -13.234 -39.814 -31.128 1.00 21.30 H new ATOM 0 HB2 LYS A 79 -13.029 -36.992 -32.115 1.00 33.52 H new ATOM 0 HB3 LYS A 79 -13.476 -38.211 -33.291 1.00 33.52 H new ATOM 0 HG2 LYS A 79 -15.271 -38.954 -31.570 1.00 2.52 H new ATOM 0 HG3 LYS A 79 -14.942 -37.435 -30.760 1.00 2.52 H new ATOM 0 HD2 LYS A 79 -15.659 -37.613 -33.710 1.00 23.34 H new ATOM 0 HD3 LYS A 79 -16.860 -37.414 -32.449 1.00 23.34 H new ATOM 0 HE2 LYS A 79 -16.480 -35.197 -32.417 1.00 21.31 H new ATOM 0 HE3 LYS A 79 -14.814 -35.478 -31.954 1.00 21.31 H new ATOM 0 HZ1 LYS A 79 -14.953 -34.202 -33.993 1.00 21.54 H new ATOM 0 HZ2 LYS A 79 -14.229 -35.707 -34.299 1.00 21.54 H new ATOM 0 HZ3 LYS A 79 -15.843 -35.435 -34.748 1.00 21.54 H new ATOM 1290 N ALA A 80 -10.477 -38.871 -32.659 1.00 31.14 N ATOM 1291 CA ALA A 80 -9.418 -39.323 -33.553 1.00 11.24 C ATOM 1292 C ALA A 80 -8.717 -40.557 -32.994 1.00 55.32 C ATOM 1293 O ALA A 80 -8.504 -41.537 -33.707 1.00 60.03 O ATOM 1294 CB ALA A 80 -8.414 -38.204 -33.788 1.00 63.53 C ATOM 0 H ALA A 80 -10.298 -37.971 -32.214 1.00 31.14 H new ATOM 0 HA ALA A 80 -9.872 -39.596 -34.506 1.00 11.24 H new ATOM 0 HB1 ALA A 80 -7.628 -38.555 -34.457 1.00 63.53 H new ATOM 0 HB2 ALA A 80 -8.920 -37.350 -34.238 1.00 63.53 H new ATOM 0 HB3 ALA A 80 -7.974 -37.905 -32.837 1.00 63.53 H new ATOM 1300 N SER A 81 -8.361 -40.501 -31.715 1.00 32.12 N ATOM 1301 CA SER A 81 -7.680 -41.613 -31.062 1.00 31.00 C ATOM 1302 C SER A 81 -8.562 -42.858 -31.049 1.00 62.13 C ATOM 1303 O SER A 81 -8.124 -43.946 -31.424 1.00 10.53 O ATOM 1304 CB SER A 81 -7.294 -41.233 -29.631 1.00 51.02 C ATOM 1305 OG SER A 81 -6.156 -40.389 -29.617 1.00 50.11 O ATOM 0 H SER A 81 -8.533 -39.698 -31.110 1.00 32.12 H new ATOM 0 HA SER A 81 -6.775 -41.835 -31.628 1.00 31.00 H new ATOM 0 HB2 SER A 81 -8.131 -40.729 -29.147 1.00 51.02 H new ATOM 0 HB3 SER A 81 -7.089 -42.135 -29.055 1.00 51.02 H new ATOM 0 HG SER A 81 -5.931 -40.159 -28.691 1.00 50.11 H new ATOM 1311 N MET A 82 -9.807 -42.689 -30.616 1.00 24.54 N ATOM 1312 CA MET A 82 -10.751 -43.799 -30.555 1.00 12.11 C ATOM 1313 C MET A 82 -11.010 -44.369 -31.946 1.00 14.02 C ATOM 1314 O MET A 82 -11.091 -45.585 -32.124 1.00 3.45 O ATOM 1315 CB MET A 82 -12.068 -43.342 -29.925 1.00 12.52 C ATOM 1316 CG MET A 82 -11.883 -42.510 -28.666 1.00 51.31 C ATOM 1317 SD MET A 82 -12.826 -43.147 -27.268 1.00 21.15 S ATOM 1318 CE MET A 82 -11.675 -44.347 -26.602 1.00 4.24 C ATOM 0 H MET A 82 -10.185 -41.795 -30.303 1.00 24.54 H new ATOM 0 HA MET A 82 -10.313 -44.582 -29.936 1.00 12.11 H new ATOM 0 HB2 MET A 82 -12.628 -42.760 -30.656 1.00 12.52 H new ATOM 0 HB3 MET A 82 -12.670 -44.218 -29.686 1.00 12.52 H new ATOM 0 HG2 MET A 82 -10.825 -42.484 -28.404 1.00 51.31 H new ATOM 0 HG3 MET A 82 -12.187 -41.483 -28.866 1.00 51.31 H new ATOM 0 HE1 MET A 82 -12.116 -44.828 -25.729 1.00 4.24 H new ATOM 0 HE2 MET A 82 -11.456 -45.100 -27.359 1.00 4.24 H new ATOM 0 HE3 MET A 82 -10.752 -43.844 -26.312 1.00 4.24 H new ATOM 1328 N ASP A 83 -11.141 -43.484 -32.928 1.00 24.10 N ATOM 1329 CA ASP A 83 -11.390 -43.900 -34.303 1.00 50.34 C ATOM 1330 C ASP A 83 -10.256 -44.781 -34.819 1.00 14.21 C ATOM 1331 O ASP A 83 -10.496 -45.822 -35.429 1.00 20.20 O ATOM 1332 CB ASP A 83 -11.553 -42.676 -35.207 1.00 20.32 C ATOM 1333 CG ASP A 83 -11.875 -43.053 -36.639 1.00 73.34 C ATOM 1334 OD1 ASP A 83 -13.032 -43.442 -36.905 1.00 31.40 O ATOM 1335 OD2 ASP A 83 -10.971 -42.959 -37.495 1.00 50.52 O ATOM 0 H ASP A 83 -11.079 -42.474 -32.797 1.00 24.10 H new ATOM 0 HA ASP A 83 -12.313 -44.480 -34.319 1.00 50.34 H new ATOM 0 HB2 ASP A 83 -12.347 -42.041 -34.814 1.00 20.32 H new ATOM 0 HB3 ASP A 83 -10.635 -42.088 -35.187 1.00 20.32 H new ATOM 1340 N GLU A 84 -9.022 -44.354 -34.570 1.00 31.51 N ATOM 1341 CA GLU A 84 -7.852 -45.104 -35.011 1.00 70.51 C ATOM 1342 C GLU A 84 -7.743 -46.431 -34.265 1.00 21.02 C ATOM 1343 O GLU A 84 -7.326 -47.442 -34.831 1.00 24.43 O ATOM 1344 CB GLU A 84 -6.580 -44.281 -34.798 1.00 14.42 C ATOM 1345 CG GLU A 84 -6.233 -43.382 -35.973 1.00 31.11 C ATOM 1346 CD GLU A 84 -4.779 -43.499 -36.387 1.00 1.23 C ATOM 1347 OE1 GLU A 84 -3.899 -43.361 -35.511 1.00 54.33 O ATOM 1348 OE2 GLU A 84 -4.521 -43.729 -37.587 1.00 10.21 O ATOM 0 H GLU A 84 -8.807 -43.494 -34.066 1.00 31.51 H new ATOM 0 HA GLU A 84 -7.967 -45.313 -36.075 1.00 70.51 H new ATOM 0 HB2 GLU A 84 -6.699 -43.668 -33.905 1.00 14.42 H new ATOM 0 HB3 GLU A 84 -5.746 -44.958 -34.611 1.00 14.42 H new ATOM 0 HG2 GLU A 84 -6.870 -43.636 -36.820 1.00 31.11 H new ATOM 0 HG3 GLU A 84 -6.450 -42.347 -35.710 1.00 31.11 H new ATOM 1355 N LEU A 85 -8.120 -46.419 -32.991 1.00 72.11 N ATOM 1356 CA LEU A 85 -8.065 -47.621 -32.165 1.00 42.55 C ATOM 1357 C LEU A 85 -9.165 -48.602 -32.558 1.00 4.03 C ATOM 1358 O LEU A 85 -8.987 -49.817 -32.469 1.00 5.10 O ATOM 1359 CB LEU A 85 -8.197 -47.253 -30.686 1.00 60.34 C ATOM 1360 CG LEU A 85 -6.888 -47.132 -29.905 1.00 70.13 C ATOM 1361 CD1 LEU A 85 -6.329 -45.722 -30.016 1.00 21.20 C ATOM 1362 CD2 LEU A 85 -7.100 -47.511 -28.447 1.00 13.32 C ATOM 0 H LEU A 85 -8.467 -45.591 -32.507 1.00 72.11 H new ATOM 0 HA LEU A 85 -7.100 -48.102 -32.328 1.00 42.55 H new ATOM 0 HB2 LEU A 85 -8.729 -46.304 -30.614 1.00 60.34 H new ATOM 0 HB3 LEU A 85 -8.819 -48.004 -30.199 1.00 60.34 H new ATOM 0 HG LEU A 85 -6.164 -47.823 -30.337 1.00 70.13 H new ATOM 0 HD11 LEU A 85 -5.397 -45.655 -29.454 1.00 21.20 H new ATOM 0 HD12 LEU A 85 -6.139 -45.487 -31.063 1.00 21.20 H new ATOM 0 HD13 LEU A 85 -7.050 -45.012 -29.610 1.00 21.20 H new ATOM 0 HD21 LEU A 85 -6.158 -47.419 -27.906 1.00 13.32 H new ATOM 0 HD22 LEU A 85 -7.840 -46.846 -28.002 1.00 13.32 H new ATOM 0 HD23 LEU A 85 -7.454 -48.540 -28.386 1.00 13.32 H new ATOM 1374 N ARG A 86 -10.300 -48.067 -32.994 1.00 13.25 N ATOM 1375 CA ARG A 86 -11.429 -48.895 -33.401 1.00 24.54 C ATOM 1376 C ARG A 86 -11.146 -49.582 -34.733 1.00 63.45 C ATOM 1377 O ARG A 86 -11.298 -50.797 -34.860 1.00 43.05 O ATOM 1378 CB ARG A 86 -12.698 -48.048 -33.511 1.00 24.24 C ATOM 1379 CG ARG A 86 -13.944 -48.748 -32.994 1.00 61.31 C ATOM 1380 CD ARG A 86 -14.515 -48.041 -31.775 1.00 31.31 C ATOM 1381 NE ARG A 86 -13.724 -48.295 -30.574 1.00 64.31 N ATOM 1382 CZ ARG A 86 -14.191 -48.145 -29.340 1.00 54.10 C ATOM 1383 NH1 ARG A 86 -15.440 -47.744 -29.145 1.00 72.32 N ATOM 1384 NH2 ARG A 86 -13.410 -48.396 -28.298 1.00 3.24 N ATOM 0 H ARG A 86 -10.463 -47.063 -33.075 1.00 13.25 H new ATOM 0 HA ARG A 86 -11.578 -49.661 -32.640 1.00 24.54 H new ATOM 0 HB2 ARG A 86 -12.555 -47.121 -32.955 1.00 24.24 H new ATOM 0 HB3 ARG A 86 -12.852 -47.774 -34.555 1.00 24.24 H new ATOM 0 HG2 ARG A 86 -14.697 -48.782 -33.782 1.00 61.31 H new ATOM 0 HG3 ARG A 86 -13.703 -49.780 -32.738 1.00 61.31 H new ATOM 0 HD2 ARG A 86 -14.554 -46.968 -31.963 1.00 31.31 H new ATOM 0 HD3 ARG A 86 -15.540 -48.373 -31.611 1.00 31.31 H new ATOM 0 HE ARG A 86 -12.759 -48.605 -30.689 1.00 64.31 H new ATOM 0 HH11 ARG A 86 -16.044 -47.550 -29.944 1.00 72.32 H new ATOM 0 HH12 ARG A 86 -15.797 -47.629 -28.196 1.00 72.32 H new ATOM 0 HH21 ARG A 86 -12.449 -48.705 -28.444 1.00 3.24 H new ATOM 0 HH22 ARG A 86 -13.770 -48.280 -27.351 1.00 3.24 H new ATOM 1398 N GLN A 87 -10.734 -48.796 -35.723 1.00 34.10 N ATOM 1399 CA GLN A 87 -10.432 -49.329 -37.046 1.00 62.01 C ATOM 1400 C GLN A 87 -9.261 -50.305 -36.985 1.00 52.33 C ATOM 1401 O GLN A 87 -9.288 -51.361 -37.616 1.00 22.22 O ATOM 1402 CB GLN A 87 -10.113 -48.191 -38.017 1.00 5.23 C ATOM 1403 CG GLN A 87 -11.222 -47.157 -38.129 1.00 22.45 C ATOM 1404 CD GLN A 87 -11.745 -47.014 -39.544 1.00 34.00 C ATOM 1405 OE1 GLN A 87 -12.361 -47.932 -40.086 1.00 70.14 O ATOM 1406 NE2 GLN A 87 -11.503 -45.858 -40.151 1.00 13.12 N ATOM 0 H GLN A 87 -10.602 -47.789 -35.634 1.00 34.10 H new ATOM 0 HA GLN A 87 -11.311 -49.866 -37.403 1.00 62.01 H new ATOM 0 HB2 GLN A 87 -9.197 -47.696 -37.695 1.00 5.23 H new ATOM 0 HB3 GLN A 87 -9.918 -48.611 -39.004 1.00 5.23 H new ATOM 0 HG2 GLN A 87 -12.043 -47.437 -37.469 1.00 22.45 H new ATOM 0 HG3 GLN A 87 -10.850 -46.192 -37.784 1.00 22.45 H new ATOM 0 HE21 GLN A 87 -10.988 -45.124 -39.664 1.00 13.12 H new ATOM 0 HE22 GLN A 87 -11.832 -45.704 -41.104 1.00 13.12 H new ATOM 1415 N ALA A 88 -8.235 -49.943 -36.222 1.00 42.15 N ATOM 1416 CA ALA A 88 -7.055 -50.787 -36.078 1.00 74.22 C ATOM 1417 C ALA A 88 -7.392 -52.080 -35.343 1.00 12.11 C ATOM 1418 O ALA A 88 -6.978 -53.164 -35.752 1.00 45.10 O ATOM 1419 CB ALA A 88 -5.953 -50.034 -35.348 1.00 33.01 C ATOM 0 H ALA A 88 -8.197 -49.071 -35.694 1.00 42.15 H new ATOM 0 HA ALA A 88 -6.701 -51.048 -37.075 1.00 74.22 H new ATOM 0 HB1 ALA A 88 -5.078 -50.676 -35.248 1.00 33.01 H new ATOM 0 HB2 ALA A 88 -5.685 -49.142 -35.914 1.00 33.01 H new ATOM 0 HB3 ALA A 88 -6.305 -49.743 -34.358 1.00 33.01 H new ATOM 1425 N ALA A 89 -8.146 -51.957 -34.255 1.00 61.32 N ATOM 1426 CA ALA A 89 -8.539 -53.116 -33.464 1.00 32.53 C ATOM 1427 C ALA A 89 -9.501 -54.010 -34.239 1.00 53.13 C ATOM 1428 O ALA A 89 -9.374 -55.234 -34.225 1.00 1.33 O ATOM 1429 CB ALA A 89 -9.170 -52.671 -32.153 1.00 10.03 C ATOM 0 H ALA A 89 -8.496 -51.067 -33.902 1.00 61.32 H new ATOM 0 HA ALA A 89 -7.642 -53.696 -33.245 1.00 32.53 H new ATOM 0 HB1 ALA A 89 -9.459 -53.547 -31.572 1.00 10.03 H new ATOM 0 HB2 ALA A 89 -8.451 -52.080 -31.585 1.00 10.03 H new ATOM 0 HB3 ALA A 89 -10.053 -52.066 -32.361 1.00 10.03 H new ATOM 1435 N GLU A 90 -10.464 -53.390 -34.915 1.00 2.54 N ATOM 1436 CA GLU A 90 -11.448 -54.130 -35.695 1.00 32.44 C ATOM 1437 C GLU A 90 -10.797 -54.789 -36.907 1.00 73.34 C ATOM 1438 O GLU A 90 -10.986 -55.980 -37.156 1.00 51.03 O ATOM 1439 CB GLU A 90 -12.576 -53.201 -36.149 1.00 63.21 C ATOM 1440 CG GLU A 90 -13.656 -52.996 -35.100 1.00 63.32 C ATOM 1441 CD GLU A 90 -14.565 -51.826 -35.420 1.00 73.12 C ATOM 1442 OE1 GLU A 90 -14.192 -51.002 -36.281 1.00 75.33 O ATOM 1443 OE2 GLU A 90 -15.651 -51.735 -34.809 1.00 44.30 O ATOM 0 H GLU A 90 -10.583 -52.377 -34.938 1.00 2.54 H new ATOM 0 HA GLU A 90 -11.865 -54.911 -35.059 1.00 32.44 H new ATOM 0 HB2 GLU A 90 -12.152 -52.233 -36.416 1.00 63.21 H new ATOM 0 HB3 GLU A 90 -13.031 -53.610 -37.051 1.00 63.21 H new ATOM 0 HG2 GLU A 90 -14.254 -53.904 -35.017 1.00 63.32 H new ATOM 0 HG3 GLU A 90 -13.188 -52.833 -34.129 1.00 63.32 H new ATOM 1450 N SER A 91 -10.031 -54.006 -37.659 1.00 4.41 N ATOM 1451 CA SER A 91 -9.355 -54.511 -38.848 1.00 41.33 C ATOM 1452 C SER A 91 -8.467 -55.702 -38.504 1.00 23.43 C ATOM 1453 O SER A 91 -8.463 -56.712 -39.208 1.00 1.50 O ATOM 1454 CB SER A 91 -8.517 -53.405 -39.493 1.00 3.02 C ATOM 1455 OG SER A 91 -7.749 -53.910 -40.572 1.00 13.12 O ATOM 0 H SER A 91 -9.863 -53.019 -37.466 1.00 4.41 H new ATOM 0 HA SER A 91 -10.116 -54.840 -39.556 1.00 41.33 H new ATOM 0 HB2 SER A 91 -9.172 -52.610 -39.849 1.00 3.02 H new ATOM 0 HB3 SER A 91 -7.856 -52.964 -38.747 1.00 3.02 H new ATOM 0 HG SER A 91 -7.224 -53.183 -40.968 1.00 13.12 H new ATOM 1461 N MET A 92 -7.715 -55.577 -37.415 1.00 10.31 N ATOM 1462 CA MET A 92 -6.823 -56.643 -36.975 1.00 71.43 C ATOM 1463 C MET A 92 -7.616 -57.876 -36.554 1.00 73.43 C ATOM 1464 O MET A 92 -7.287 -59.000 -36.936 1.00 4.33 O ATOM 1465 CB MET A 92 -5.952 -56.162 -35.814 1.00 25.23 C ATOM 1466 CG MET A 92 -4.581 -55.666 -36.247 1.00 35.12 C ATOM 1467 SD MET A 92 -3.452 -55.446 -34.859 1.00 22.02 S ATOM 1468 CE MET A 92 -4.472 -54.489 -33.740 1.00 72.31 C ATOM 0 H MET A 92 -7.706 -54.748 -36.821 1.00 10.31 H new ATOM 0 HA MET A 92 -6.181 -56.914 -37.813 1.00 71.43 H new ATOM 0 HB2 MET A 92 -6.471 -55.359 -35.290 1.00 25.23 H new ATOM 0 HB3 MET A 92 -5.826 -56.978 -35.103 1.00 25.23 H new ATOM 0 HG2 MET A 92 -4.149 -56.375 -36.953 1.00 35.12 H new ATOM 0 HG3 MET A 92 -4.692 -54.718 -36.774 1.00 35.12 H new ATOM 0 HE1 MET A 92 -3.846 -54.049 -32.964 1.00 72.31 H new ATOM 0 HE2 MET A 92 -4.975 -53.696 -34.294 1.00 72.31 H new ATOM 0 HE3 MET A 92 -5.217 -55.139 -33.281 1.00 72.31 H new ATOM 1478 N LYS A 93 -8.663 -57.660 -35.766 1.00 14.15 N ATOM 1479 CA LYS A 93 -9.505 -58.753 -35.293 1.00 1.10 C ATOM 1480 C LYS A 93 -10.242 -59.413 -36.454 1.00 24.42 C ATOM 1481 O LYS A 93 -10.650 -60.571 -36.364 1.00 31.34 O ATOM 1482 CB LYS A 93 -10.512 -58.239 -34.262 1.00 33.11 C ATOM 1483 CG LYS A 93 -11.880 -57.935 -34.847 1.00 54.14 C ATOM 1484 CD LYS A 93 -12.790 -59.151 -34.799 1.00 55.24 C ATOM 1485 CE LYS A 93 -14.235 -58.756 -34.534 1.00 0.45 C ATOM 1486 NZ LYS A 93 -15.193 -59.624 -35.273 1.00 44.42 N ATOM 0 H LYS A 93 -8.950 -56.737 -35.441 1.00 14.15 H new ATOM 0 HA LYS A 93 -8.862 -59.497 -34.824 1.00 1.10 H new ATOM 0 HB2 LYS A 93 -10.621 -58.982 -33.472 1.00 33.11 H new ATOM 0 HB3 LYS A 93 -10.116 -57.336 -33.798 1.00 33.11 H new ATOM 0 HG2 LYS A 93 -12.338 -57.114 -34.295 1.00 54.14 H new ATOM 0 HG3 LYS A 93 -11.770 -57.603 -35.879 1.00 54.14 H new ATOM 0 HD2 LYS A 93 -12.727 -59.691 -35.743 1.00 55.24 H new ATOM 0 HD3 LYS A 93 -12.449 -59.832 -34.019 1.00 55.24 H new ATOM 0 HE2 LYS A 93 -14.438 -58.819 -33.465 1.00 0.45 H new ATOM 0 HE3 LYS A 93 -14.387 -57.717 -34.826 1.00 0.45 H new ATOM 0 HZ1 LYS A 93 -16.166 -59.322 -35.065 1.00 44.42 H new ATOM 0 HZ2 LYS A 93 -15.016 -59.545 -36.295 1.00 44.42 H new ATOM 0 HZ3 LYS A 93 -15.066 -60.612 -34.976 1.00 44.42 H new ATOM 1500 N ARG A 94 -10.407 -58.671 -37.543 1.00 43.54 N ATOM 1501 CA ARG A 94 -11.094 -59.185 -38.722 1.00 1.22 C ATOM 1502 C ARG A 94 -10.155 -60.037 -39.570 1.00 22.50 C ATOM 1503 O ARG A 94 -10.566 -61.043 -40.149 1.00 41.22 O ATOM 1504 CB ARG A 94 -11.648 -58.031 -39.559 1.00 54.13 C ATOM 1505 CG ARG A 94 -12.374 -58.484 -40.816 1.00 11.14 C ATOM 1506 CD ARG A 94 -13.455 -57.494 -41.222 1.00 62.31 C ATOM 1507 NE ARG A 94 -13.195 -56.908 -42.534 1.00 62.22 N ATOM 1508 CZ ARG A 94 -13.476 -57.518 -43.680 1.00 62.23 C ATOM 1509 NH1 ARG A 94 -14.023 -58.726 -43.676 1.00 13.34 N ATOM 1510 NH2 ARG A 94 -13.210 -56.920 -44.834 1.00 43.14 N ATOM 0 H ARG A 94 -10.074 -57.711 -37.634 1.00 43.54 H new ATOM 0 HA ARG A 94 -11.921 -59.811 -38.386 1.00 1.22 H new ATOM 0 HB2 ARG A 94 -12.332 -57.444 -38.946 1.00 54.13 H new ATOM 0 HB3 ARG A 94 -10.827 -57.371 -39.841 1.00 54.13 H new ATOM 0 HG2 ARG A 94 -11.658 -58.597 -41.630 1.00 11.14 H new ATOM 0 HG3 ARG A 94 -12.821 -59.463 -40.646 1.00 11.14 H new ATOM 0 HD2 ARG A 94 -14.422 -57.998 -41.235 1.00 62.31 H new ATOM 0 HD3 ARG A 94 -13.519 -56.701 -40.477 1.00 62.31 H new ATOM 0 HE ARG A 94 -12.775 -55.979 -42.573 1.00 62.22 H new ATOM 0 HH11 ARG A 94 -14.229 -59.190 -42.791 1.00 13.34 H new ATOM 0 HH12 ARG A 94 -14.238 -59.192 -44.558 1.00 13.34 H new ATOM 0 HH21 ARG A 94 -12.789 -55.991 -44.842 1.00 43.14 H new ATOM 0 HH22 ARG A 94 -13.426 -57.389 -45.713 1.00 43.14 H new ATOM 1524 N SER A 95 -8.892 -59.628 -39.639 1.00 20.34 N ATOM 1525 CA SER A 95 -7.895 -60.352 -40.419 1.00 53.12 C ATOM 1526 C SER A 95 -7.185 -61.394 -39.561 1.00 21.21 C ATOM 1527 O SER A 95 -6.358 -62.162 -40.054 1.00 41.40 O ATOM 1528 CB SER A 95 -6.873 -59.378 -41.009 1.00 74.11 C ATOM 1529 OG SER A 95 -7.428 -58.082 -41.152 1.00 4.34 O ATOM 0 H SER A 95 -8.535 -58.799 -39.164 1.00 20.34 H new ATOM 0 HA SER A 95 -8.409 -60.866 -41.232 1.00 53.12 H new ATOM 0 HB2 SER A 95 -5.995 -59.332 -40.364 1.00 74.11 H new ATOM 0 HB3 SER A 95 -6.537 -59.742 -41.980 1.00 74.11 H new ATOM 0 HG SER A 95 -7.418 -57.625 -40.285 1.00 4.34 H new ATOM 1535 N TYR A 96 -7.514 -61.415 -38.274 1.00 44.11 N ATOM 1536 CA TYR A 96 -6.906 -62.361 -37.345 1.00 51.43 C ATOM 1537 C TYR A 96 -7.944 -63.343 -36.811 1.00 71.05 C ATOM 1538 O TYR A 96 -7.814 -64.555 -36.982 1.00 72.31 O ATOM 1539 CB TYR A 96 -6.248 -61.615 -36.183 1.00 12.10 C ATOM 1540 CG TYR A 96 -5.804 -62.520 -35.057 1.00 21.53 C ATOM 1541 CD1 TYR A 96 -5.554 -63.869 -35.280 1.00 13.20 C ATOM 1542 CD2 TYR A 96 -5.633 -62.027 -33.769 1.00 24.10 C ATOM 1543 CE1 TYR A 96 -5.149 -64.700 -34.254 1.00 0.24 C ATOM 1544 CE2 TYR A 96 -5.226 -62.850 -32.737 1.00 30.42 C ATOM 1545 CZ TYR A 96 -4.986 -64.186 -32.984 1.00 50.00 C ATOM 1546 OH TYR A 96 -4.581 -65.010 -31.959 1.00 60.22 O ATOM 0 H TYR A 96 -8.198 -60.788 -37.850 1.00 44.11 H new ATOM 0 HA TYR A 96 -6.144 -62.923 -37.885 1.00 51.43 H new ATOM 0 HB2 TYR A 96 -5.385 -61.065 -36.558 1.00 12.10 H new ATOM 0 HB3 TYR A 96 -6.950 -60.879 -35.791 1.00 12.10 H new ATOM 0 HD1 TYR A 96 -5.679 -64.274 -36.273 1.00 13.20 H new ATOM 0 HD2 TYR A 96 -5.822 -60.982 -33.571 1.00 24.10 H new ATOM 0 HE1 TYR A 96 -4.961 -65.746 -34.445 1.00 0.24 H new ATOM 0 HE2 TYR A 96 -5.096 -62.450 -31.742 1.00 30.42 H new ATOM 0 HH TYR A 96 -4.514 -64.492 -31.130 1.00 60.22 H new ATOM 1556 N VAL A 97 -8.976 -62.810 -36.164 1.00 63.33 N ATOM 1557 CA VAL A 97 -10.038 -63.638 -35.606 1.00 72.22 C ATOM 1558 C VAL A 97 -10.961 -64.160 -36.702 1.00 22.52 C ATOM 1559 O VAL A 97 -11.900 -64.909 -36.432 1.00 42.22 O ATOM 1560 CB VAL A 97 -10.875 -62.858 -34.575 1.00 4.13 C ATOM 1561 CG1 VAL A 97 -11.712 -63.811 -33.735 1.00 42.21 C ATOM 1562 CG2 VAL A 97 -9.973 -62.008 -33.692 1.00 53.10 C ATOM 0 H VAL A 97 -9.099 -61.809 -36.014 1.00 63.33 H new ATOM 0 HA VAL A 97 -9.555 -64.480 -35.109 1.00 72.22 H new ATOM 0 HB VAL A 97 -11.553 -62.194 -35.111 1.00 4.13 H new ATOM 0 HG11 VAL A 97 -12.296 -63.242 -33.012 1.00 42.21 H new ATOM 0 HG12 VAL A 97 -12.384 -64.373 -34.383 1.00 42.21 H new ATOM 0 HG13 VAL A 97 -11.056 -64.502 -33.207 1.00 42.21 H new ATOM 0 HG21 VAL A 97 -10.580 -61.463 -32.969 1.00 53.10 H new ATOM 0 HG22 VAL A 97 -9.270 -62.652 -33.164 1.00 53.10 H new ATOM 0 HG23 VAL A 97 -9.422 -61.299 -34.310 1.00 53.10 H new ATOM 1572 N ALA A 98 -10.686 -63.761 -37.939 1.00 53.12 N ATOM 1573 CA ALA A 98 -11.490 -64.191 -39.077 1.00 10.43 C ATOM 1574 C ALA A 98 -10.625 -64.388 -40.317 1.00 22.42 C ATOM 1575 O ALA A 98 -11.091 -64.222 -41.443 1.00 42.00 O ATOM 1576 CB ALA A 98 -12.593 -63.180 -39.356 1.00 4.12 C ATOM 0 H ALA A 98 -9.913 -63.141 -38.179 1.00 53.12 H new ATOM 0 HA ALA A 98 -11.945 -65.149 -38.827 1.00 10.43 H new ATOM 0 HB1 ALA A 98 -13.185 -63.514 -40.208 1.00 4.12 H new ATOM 0 HB2 ALA A 98 -13.235 -63.091 -38.480 1.00 4.12 H new ATOM 0 HB3 ALA A 98 -12.149 -62.210 -39.580 1.00 4.12 H new ATOM 1582 N ASN A 99 -9.362 -64.744 -40.101 1.00 54.33 N ATOM 1583 CA ASN A 99 -8.431 -64.963 -41.202 1.00 55.24 C ATOM 1584 C ASN A 99 -7.071 -65.416 -40.682 1.00 62.43 C ATOM 1585 O ASN A 99 -6.058 -64.751 -40.901 1.00 32.05 O ATOM 1586 CB ASN A 99 -8.274 -63.684 -42.027 1.00 53.40 C ATOM 1587 CG ASN A 99 -7.232 -63.824 -43.119 1.00 62.43 C ATOM 1588 OD1 ASN A 99 -6.209 -63.139 -43.109 1.00 12.02 O ATOM 1589 ND2 ASN A 99 -7.487 -64.716 -44.069 1.00 73.25 N ATOM 0 H ASN A 99 -8.961 -64.887 -39.174 1.00 54.33 H new ATOM 0 HA ASN A 99 -8.838 -65.750 -41.838 1.00 55.24 H new ATOM 0 HB2 ASN A 99 -9.233 -63.424 -42.475 1.00 53.40 H new ATOM 0 HB3 ASN A 99 -7.997 -62.861 -41.368 1.00 53.40 H new ATOM 0 HD21 ASN A 99 -6.822 -64.855 -44.830 1.00 73.25 H new ATOM 0 HD22 ASN A 99 -8.348 -65.262 -44.038 1.00 73.25 H new ATOM 1596 N ASP A 100 -7.055 -66.553 -39.994 1.00 54.34 N ATOM 1597 CA ASP A 100 -5.819 -67.097 -39.444 1.00 53.24 C ATOM 1598 C ASP A 100 -6.060 -68.466 -38.817 1.00 33.23 C ATOM 1599 O ASP A 100 -5.649 -69.499 -39.345 1.00 23.43 O ATOM 1600 CB ASP A 100 -5.235 -66.141 -38.404 1.00 2.35 C ATOM 1601 CG ASP A 100 -4.102 -65.301 -38.960 1.00 51.14 C ATOM 1602 OD1 ASP A 100 -3.271 -65.850 -39.714 1.00 52.24 O ATOM 1603 OD2 ASP A 100 -4.047 -64.095 -38.643 1.00 1.40 O ATOM 0 H ASP A 100 -7.884 -67.116 -39.804 1.00 54.34 H new ATOM 0 HA ASP A 100 -5.106 -67.212 -40.261 1.00 53.24 H new ATOM 0 HB2 ASP A 100 -6.023 -65.484 -38.036 1.00 2.35 H new ATOM 0 HB3 ASP A 100 -4.873 -66.714 -37.551 1.00 2.35 H new ATOM 1608 N PRO A 101 -6.742 -68.476 -37.662 1.00 34.32 N ATOM 1609 CA PRO A 101 -7.053 -69.712 -36.937 1.00 10.12 C ATOM 1610 C PRO A 101 -8.083 -70.569 -37.666 1.00 4.53 C ATOM 1611 O PRO A 101 -8.414 -71.669 -37.224 1.00 31.52 O ATOM 1612 CB PRO A 101 -7.620 -69.210 -35.607 1.00 15.32 C ATOM 1613 CG PRO A 101 -8.160 -67.855 -35.913 1.00 20.15 C ATOM 1614 CD PRO A 101 -7.263 -67.282 -36.975 1.00 73.41 C ATOM 0 HA PRO A 101 -6.177 -70.352 -36.828 1.00 10.12 H new ATOM 0 HB2 PRO A 101 -8.401 -69.873 -35.234 1.00 15.32 H new ATOM 0 HB3 PRO A 101 -6.848 -69.164 -34.839 1.00 15.32 H new ATOM 0 HG2 PRO A 101 -9.190 -67.916 -36.263 1.00 20.15 H new ATOM 0 HG3 PRO A 101 -8.162 -67.226 -35.023 1.00 20.15 H new ATOM 0 HD2 PRO A 101 -7.812 -66.633 -37.657 1.00 73.41 H new ATOM 0 HD3 PRO A 101 -6.460 -66.684 -36.543 1.00 73.41 H new ATOM 1622 N LEU A 102 -8.585 -70.057 -38.784 1.00 72.51 N ATOM 1623 CA LEU A 102 -9.578 -70.777 -39.575 1.00 44.55 C ATOM 1624 C LEU A 102 -8.923 -71.481 -40.760 1.00 15.40 C ATOM 1625 O LEU A 102 -9.521 -72.361 -41.377 1.00 71.33 O ATOM 1626 CB LEU A 102 -10.657 -69.814 -40.073 1.00 13.34 C ATOM 1627 CG LEU A 102 -10.550 -68.371 -39.577 1.00 32.23 C ATOM 1628 CD1 LEU A 102 -11.417 -67.450 -40.422 1.00 24.51 C ATOM 1629 CD2 LEU A 102 -10.946 -68.281 -38.110 1.00 5.20 C ATOM 0 H LEU A 102 -8.322 -69.148 -39.163 1.00 72.51 H new ATOM 0 HA LEU A 102 -10.039 -71.531 -38.937 1.00 44.55 H new ATOM 0 HB2 LEU A 102 -10.633 -69.805 -41.163 1.00 13.34 H new ATOM 0 HB3 LEU A 102 -11.630 -70.207 -39.779 1.00 13.34 H new ATOM 0 HG LEU A 102 -9.513 -68.050 -39.674 1.00 32.23 H new ATOM 0 HD11 LEU A 102 -11.328 -66.428 -40.054 1.00 24.51 H new ATOM 0 HD12 LEU A 102 -11.088 -67.492 -41.460 1.00 24.51 H new ATOM 0 HD13 LEU A 102 -12.457 -67.769 -40.358 1.00 24.51 H new ATOM 0 HD21 LEU A 102 -10.864 -67.247 -37.774 1.00 5.20 H new ATOM 0 HD22 LEU A 102 -11.974 -68.621 -37.989 1.00 5.20 H new ATOM 0 HD23 LEU A 102 -10.284 -68.910 -37.515 1.00 5.20 H new ATOM 1641 N GLU A 103 -7.692 -71.087 -41.069 1.00 50.15 N ATOM 1642 CA GLU A 103 -6.957 -71.682 -42.179 1.00 42.03 C ATOM 1643 C GLU A 103 -6.256 -72.965 -41.742 1.00 32.20 C ATOM 1644 O GLU A 103 -5.925 -73.817 -42.567 1.00 75.41 O ATOM 1645 CB GLU A 103 -5.930 -70.690 -42.730 1.00 55.04 C ATOM 1646 CG GLU A 103 -4.675 -70.578 -41.881 1.00 73.04 C ATOM 1647 CD GLU A 103 -3.496 -71.318 -42.483 1.00 12.30 C ATOM 1648 OE1 GLU A 103 -3.475 -72.564 -42.406 1.00 50.23 O ATOM 1649 OE2 GLU A 103 -2.594 -70.649 -43.031 1.00 35.51 O ATOM 0 H GLU A 103 -7.183 -70.359 -40.567 1.00 50.15 H new ATOM 0 HA GLU A 103 -7.672 -71.928 -42.964 1.00 42.03 H new ATOM 0 HB2 GLU A 103 -5.650 -70.993 -43.739 1.00 55.04 H new ATOM 0 HB3 GLU A 103 -6.394 -69.707 -42.809 1.00 55.04 H new ATOM 0 HG2 GLU A 103 -4.416 -69.526 -41.760 1.00 73.04 H new ATOM 0 HG3 GLU A 103 -4.878 -70.973 -40.886 1.00 73.04 H new ATOM 1656 N HIS A 104 -6.033 -73.096 -40.438 1.00 44.51 N ATOM 1657 CA HIS A 104 -5.371 -74.274 -39.890 1.00 72.40 C ATOM 1658 C HIS A 104 -6.357 -75.429 -39.738 1.00 11.11 C ATOM 1659 O HIS A 104 -7.560 -75.260 -39.938 1.00 74.42 O ATOM 1660 CB HIS A 104 -4.738 -73.947 -38.537 1.00 72.42 C ATOM 1661 CG HIS A 104 -4.170 -75.143 -37.837 1.00 63.22 C ATOM 1662 ND1 HIS A 104 -3.602 -76.207 -38.506 1.00 24.04 N ATOM 1663 CD2 HIS A 104 -4.082 -75.439 -36.519 1.00 55.12 C ATOM 1664 CE1 HIS A 104 -3.191 -77.106 -37.629 1.00 71.22 C ATOM 1665 NE2 HIS A 104 -3.471 -76.664 -36.416 1.00 63.04 N ATOM 0 H HIS A 104 -6.301 -72.401 -39.741 1.00 44.51 H new ATOM 0 HA HIS A 104 -4.588 -74.577 -40.585 1.00 72.40 H new ATOM 0 HB2 HIS A 104 -3.946 -73.212 -38.684 1.00 72.42 H new ATOM 0 HB3 HIS A 104 -5.488 -73.484 -37.896 1.00 72.42 H new ATOM 0 HD2 HIS A 104 -4.428 -74.825 -35.700 1.00 55.12 H new ATOM 0 HE1 HIS A 104 -2.708 -78.043 -37.864 1.00 71.22 H new ATOM 0 HE2 HIS A 104 -3.266 -77.153 -35.545 1.00 63.04 H new TER 1673 HIS A 104