USER MOD reduce.3.24.130724 H: found=0, std=0, add=1037, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1034 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 12 GLN : amide:sc= -2.64 K(o=-5.1,f=-9.3!) USER MOD Set 1.2: A 32 GLN : amide:sc= -2.47 K(o=-5.1,f=-11!) USER MOD Set 2.1: A 20 ASN : amide:sc= 0.275 K(o=-2.6,f=-4.2) USER MOD Set 2.2: A 28 TYR OH : rot 28:sc= -2.83! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 ASN : amide:sc= -0.325 K(o=-0.33,f=-2.8!) USER MOD Single : A 5 LYS NZ :NH3+ -122:sc= -1.51 (180deg=-4.4!) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.0101 X(o=-0.01,f=-0.022) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -0.0684 K(o=-0.068,f=-1.4!) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -3.47! C(o=-3.5!,f=-6.1!) USER MOD Single : A 38 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.9 USER MOD Single : A 45 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0882) USER MOD Single : A 55 MET CE :methyl 145:sc= -17.9! (180deg=-22.5!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl 150:sc= -3.04! (180deg=-3.63!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl 177:sc= 0 (180deg=-0.0163) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -0.154 K(o=-0.15,f=-1.2!) USER MOD Single : A 81 MET CE :methyl -166:sc= -14.1! (180deg=-15.1!) USER MOD Single : A 82 THR OG1 : rot 152:sc= 0.508 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl 166:sc= -6.95! (180deg=-7.35!) USER MOD Single : A 91 GLN : amide:sc= -5.76! C(o=-5.8!,f=-14!) USER MOD Single : A 93 SER OG : rot -83:sc= -0.913 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 THR OG1 : rot 180:sc= -0.362 USER MOD Single : A 101 HIS :FLIP no HE2:sc= -8.96! C(o=-9.6!,f=-9!) USER MOD Single : A 104 LYS NZ :NH3+ -131:sc= 0 (180deg=-0.226) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot 130:sc= -0.758 USER MOD Single : A 122 LYS NZ :NH3+ -158:sc= -0.0167 (180deg=-0.208) USER MOD Single : A 123 SER OG : rot 30:sc= 1.06 USER MOD Single : A 124 ASN : amide:sc= -0.408 X(o=-0.41,f=-0.57) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.911 -15.605 18.053 1.00 0.00 N ATOM 2 CA MET A 1 -6.115 -16.231 17.533 1.00 0.00 C ATOM 3 C MET A 1 -6.429 -15.727 16.123 1.00 0.00 C ATOM 4 O MET A 1 -6.545 -16.518 15.188 1.00 0.00 O ATOM 5 CB MET A 1 -7.292 -15.923 18.460 1.00 0.00 C ATOM 6 CG MET A 1 -7.348 -16.916 19.623 1.00 0.00 C ATOM 7 SD MET A 1 -8.756 -16.561 20.661 1.00 0.00 S ATOM 8 CE MET A 1 -8.537 -17.810 21.917 1.00 0.00 C ATOM 0 H1 MET A 1 -4.719 -15.963 19.010 1.00 0.00 H new ATOM 0 H2 MET A 1 -4.107 -15.829 17.432 1.00 0.00 H new ATOM 0 H3 MET A 1 -5.044 -14.574 18.089 1.00 0.00 H new ATOM 0 HA MET A 1 -5.951 -17.308 17.486 1.00 0.00 H new ATOM 0 HB2 MET A 1 -7.199 -14.908 18.847 1.00 0.00 H new ATOM 0 HB3 MET A 1 -8.224 -15.964 17.896 1.00 0.00 H new ATOM 0 HG2 MET A 1 -7.416 -17.934 19.240 1.00 0.00 H new ATOM 0 HG3 MET A 1 -6.430 -16.856 20.208 1.00 0.00 H new ATOM 0 HE1 MET A 1 -9.337 -17.731 22.653 1.00 0.00 H new ATOM 0 HE2 MET A 1 -8.564 -18.798 21.457 1.00 0.00 H new ATOM 0 HE3 MET A 1 -7.576 -17.666 22.410 1.00 0.00 H new ATOM 18 N MET A 2 -6.559 -14.412 16.014 1.00 0.00 N ATOM 19 CA MET A 2 -6.858 -13.793 14.734 1.00 0.00 C ATOM 20 C MET A 2 -6.424 -12.326 14.721 1.00 0.00 C ATOM 21 O MET A 2 -6.463 -11.654 15.750 1.00 0.00 O ATOM 22 CB MET A 2 -8.361 -13.884 14.462 1.00 0.00 C ATOM 23 CG MET A 2 -8.660 -13.702 12.972 1.00 0.00 C ATOM 24 SD MET A 2 -10.047 -12.599 12.759 1.00 0.00 S ATOM 25 CE MET A 2 -10.612 -13.121 11.148 1.00 0.00 C ATOM 0 H MET A 2 -6.463 -13.759 16.791 1.00 0.00 H new ATOM 0 HA MET A 2 -6.307 -14.322 13.957 1.00 0.00 H new ATOM 0 HB2 MET A 2 -8.737 -14.851 14.797 1.00 0.00 H new ATOM 0 HB3 MET A 2 -8.885 -13.121 15.038 1.00 0.00 H new ATOM 0 HG2 MET A 2 -7.784 -13.300 12.463 1.00 0.00 H new ATOM 0 HG3 MET A 2 -8.879 -14.667 12.516 1.00 0.00 H new ATOM 0 HE1 MET A 2 -11.481 -12.530 10.858 1.00 0.00 H new ATOM 0 HE2 MET A 2 -9.815 -12.977 10.419 1.00 0.00 H new ATOM 0 HE3 MET A 2 -10.886 -14.176 11.182 1.00 0.00 H new ATOM 35 N ASN A 3 -6.021 -11.872 13.543 1.00 0.00 N ATOM 36 CA ASN A 3 -5.581 -10.497 13.382 1.00 0.00 C ATOM 37 C ASN A 3 -5.172 -10.264 11.926 1.00 0.00 C ATOM 38 O ASN A 3 -5.334 -11.146 11.084 1.00 0.00 O ATOM 39 CB ASN A 3 -4.368 -10.199 14.266 1.00 0.00 C ATOM 40 CG ASN A 3 -4.637 -9.002 15.181 1.00 0.00 C ATOM 41 OD1 ASN A 3 -5.669 -8.355 15.111 1.00 0.00 O ATOM 42 ND2 ASN A 3 -3.654 -8.746 16.038 1.00 0.00 N ATOM 0 H ASN A 3 -5.990 -12.432 12.691 1.00 0.00 H new ATOM 0 HA ASN A 3 -6.405 -9.844 13.668 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -4.129 -11.075 14.868 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -3.499 -9.995 13.640 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -3.737 -7.967 16.691 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -2.817 -9.329 16.043 1.00 0.00 H new ATOM 49 N GLU A 4 -4.651 -9.072 11.674 1.00 0.00 N ATOM 50 CA GLU A 4 -4.218 -8.713 10.335 1.00 0.00 C ATOM 51 C GLU A 4 -2.904 -7.931 10.393 1.00 0.00 C ATOM 52 O GLU A 4 -2.338 -7.741 11.469 1.00 0.00 O ATOM 53 CB GLU A 4 -5.300 -7.913 9.605 1.00 0.00 C ATOM 54 CG GLU A 4 -5.899 -8.724 8.455 1.00 0.00 C ATOM 55 CD GLU A 4 -7.372 -8.368 8.242 1.00 0.00 C ATOM 56 OE1 GLU A 4 -8.197 -8.866 9.037 1.00 0.00 O ATOM 57 OE2 GLU A 4 -7.639 -7.605 7.288 1.00 0.00 O ATOM 0 H GLU A 4 -4.519 -8.343 12.375 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.047 -9.630 9.772 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -6.086 -7.634 10.306 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -4.874 -6.987 9.219 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -5.339 -8.532 7.540 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.806 -9.789 8.669 1.00 0.00 H new ATOM 64 N LYS A 5 -2.457 -7.499 9.223 1.00 0.00 N ATOM 65 CA LYS A 5 -1.220 -6.742 9.128 1.00 0.00 C ATOM 66 C LYS A 5 -1.303 -5.785 7.937 1.00 0.00 C ATOM 67 O LYS A 5 -2.034 -6.040 6.982 1.00 0.00 O ATOM 68 CB LYS A 5 -0.017 -7.686 9.076 1.00 0.00 C ATOM 69 CG LYS A 5 0.319 -8.223 10.468 1.00 0.00 C ATOM 70 CD LYS A 5 -0.126 -9.679 10.617 1.00 0.00 C ATOM 71 CE LYS A 5 0.833 -10.623 9.888 1.00 0.00 C ATOM 72 NZ LYS A 5 0.231 -11.968 9.751 1.00 0.00 N ATOM 0 H LYS A 5 -2.929 -7.659 8.333 1.00 0.00 H new ATOM 0 HA LYS A 5 -1.078 -6.131 10.019 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -0.231 -8.517 8.404 1.00 0.00 H new ATOM 0 HB3 LYS A 5 0.846 -7.159 8.667 1.00 0.00 H new ATOM 0 HG2 LYS A 5 1.393 -8.148 10.641 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -0.170 -7.610 11.226 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -0.169 -9.943 11.674 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -1.133 -9.798 10.217 1.00 0.00 H new ATOM 0 HE2 LYS A 5 1.069 -10.222 8.902 1.00 0.00 H new ATOM 0 HE3 LYS A 5 1.772 -10.692 10.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 0.850 -12.673 10.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -0.701 -11.980 10.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 0.120 -12.198 8.743 1.00 0.00 H new ATOM 86 N ILE A 6 -0.543 -4.704 8.034 1.00 0.00 N ATOM 87 CA ILE A 6 -0.522 -3.708 6.976 1.00 0.00 C ATOM 88 C ILE A 6 0.739 -2.852 7.113 1.00 0.00 C ATOM 89 O ILE A 6 1.267 -2.690 8.213 1.00 0.00 O ATOM 90 CB ILE A 6 -1.819 -2.896 6.978 1.00 0.00 C ATOM 91 CG1 ILE A 6 -2.853 -3.514 6.035 1.00 0.00 C ATOM 92 CG2 ILE A 6 -1.547 -1.427 6.648 1.00 0.00 C ATOM 93 CD1 ILE A 6 -4.147 -3.846 6.781 1.00 0.00 C ATOM 0 H ILE A 6 0.062 -4.496 8.828 1.00 0.00 H new ATOM 0 HA ILE A 6 -0.477 -4.190 6.000 1.00 0.00 H new ATOM 0 HB ILE A 6 -2.240 -2.927 7.983 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -3.066 -2.822 5.220 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -2.445 -4.420 5.586 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -2.485 -0.872 6.656 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -0.870 -1.006 7.392 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -1.091 -1.354 5.661 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -4.865 -4.284 6.087 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -3.934 -4.557 7.580 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -4.565 -2.934 7.208 1.00 0.00 H new ATOM 105 N LEU A 7 1.185 -2.326 5.982 1.00 0.00 N ATOM 106 CA LEU A 7 2.373 -1.491 5.962 1.00 0.00 C ATOM 107 C LEU A 7 2.086 -0.222 5.157 1.00 0.00 C ATOM 108 O LEU A 7 1.354 -0.261 4.170 1.00 0.00 O ATOM 109 CB LEU A 7 3.577 -2.284 5.450 1.00 0.00 C ATOM 110 CG LEU A 7 4.810 -2.292 6.357 1.00 0.00 C ATOM 111 CD1 LEU A 7 4.730 -3.426 7.381 1.00 0.00 C ATOM 112 CD2 LEU A 7 6.097 -2.355 5.532 1.00 0.00 C ATOM 0 H LEU A 7 0.744 -2.462 5.072 1.00 0.00 H new ATOM 0 HA LEU A 7 2.634 -1.176 6.972 1.00 0.00 H new ATOM 0 HB2 LEU A 7 3.265 -3.315 5.286 1.00 0.00 H new ATOM 0 HB3 LEU A 7 3.867 -1.880 4.480 1.00 0.00 H new ATOM 0 HG LEU A 7 4.830 -1.355 6.914 1.00 0.00 H new ATOM 0 HD11 LEU A 7 5.618 -3.409 8.013 1.00 0.00 H new ATOM 0 HD12 LEU A 7 3.842 -3.296 8.000 1.00 0.00 H new ATOM 0 HD13 LEU A 7 4.673 -4.382 6.861 1.00 0.00 H new ATOM 0 HD21 LEU A 7 6.958 -2.359 6.201 1.00 0.00 H new ATOM 0 HD22 LEU A 7 6.100 -3.264 4.931 1.00 0.00 H new ATOM 0 HD23 LEU A 7 6.152 -1.486 4.876 1.00 0.00 H new ATOM 124 N ILE A 8 2.678 0.874 5.610 1.00 0.00 N ATOM 125 CA ILE A 8 2.495 2.153 4.944 1.00 0.00 C ATOM 126 C ILE A 8 3.852 2.671 4.462 1.00 0.00 C ATOM 127 O ILE A 8 4.788 2.795 5.249 1.00 0.00 O ATOM 128 CB ILE A 8 1.752 3.131 5.857 1.00 0.00 C ATOM 129 CG1 ILE A 8 0.327 2.648 6.133 1.00 0.00 C ATOM 130 CG2 ILE A 8 1.776 4.547 5.278 1.00 0.00 C ATOM 131 CD1 ILE A 8 -0.211 3.244 7.435 1.00 0.00 C ATOM 0 H ILE A 8 3.284 0.903 6.430 1.00 0.00 H new ATOM 0 HA ILE A 8 1.866 2.037 4.061 1.00 0.00 H new ATOM 0 HB ILE A 8 2.271 3.166 6.815 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -0.323 2.929 5.304 1.00 0.00 H new ATOM 0 HG13 ILE A 8 0.313 1.560 6.194 1.00 0.00 H new ATOM 0 HG21 ILE A 8 1.241 5.222 5.946 1.00 0.00 H new ATOM 0 HG22 ILE A 8 2.809 4.881 5.175 1.00 0.00 H new ATOM 0 HG23 ILE A 8 1.295 4.548 4.300 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -1.225 2.885 7.608 1.00 0.00 H new ATOM 0 HD12 ILE A 8 0.427 2.941 8.265 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -0.219 4.331 7.361 1.00 0.00 H new ATOM 143 N VAL A 9 3.914 2.959 3.170 1.00 0.00 N ATOM 144 CA VAL A 9 5.140 3.461 2.574 1.00 0.00 C ATOM 145 C VAL A 9 4.866 4.815 1.917 1.00 0.00 C ATOM 146 O VAL A 9 3.954 4.940 1.101 1.00 0.00 O ATOM 147 CB VAL A 9 5.709 2.427 1.599 1.00 0.00 C ATOM 148 CG1 VAL A 9 7.150 2.770 1.217 1.00 0.00 C ATOM 149 CG2 VAL A 9 5.617 1.016 2.181 1.00 0.00 C ATOM 0 H VAL A 9 3.135 2.854 2.520 1.00 0.00 H new ATOM 0 HA VAL A 9 5.900 3.619 3.339 1.00 0.00 H new ATOM 0 HB VAL A 9 5.106 2.454 0.691 1.00 0.00 H new ATOM 0 HG11 VAL A 9 7.531 2.020 0.524 1.00 0.00 H new ATOM 0 HG12 VAL A 9 7.177 3.751 0.742 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.770 2.784 2.113 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.028 0.301 1.468 1.00 0.00 H new ATOM 0 HG22 VAL A 9 6.184 0.968 3.111 1.00 0.00 H new ATOM 0 HG23 VAL A 9 4.573 0.772 2.379 1.00 0.00 H new ATOM 159 N ASP A 10 5.672 5.795 2.296 1.00 0.00 N ATOM 160 CA ASP A 10 5.528 7.135 1.754 1.00 0.00 C ATOM 161 C ASP A 10 4.049 7.527 1.762 1.00 0.00 C ATOM 162 O ASP A 10 3.216 6.810 2.314 1.00 0.00 O ATOM 163 CB ASP A 10 6.027 7.202 0.310 1.00 0.00 C ATOM 164 CG ASP A 10 7.243 8.104 0.086 1.00 0.00 C ATOM 165 OD1 ASP A 10 8.242 7.899 0.809 1.00 0.00 O ATOM 166 OD2 ASP A 10 7.146 8.978 -0.802 1.00 0.00 O ATOM 0 H ASP A 10 6.428 5.688 2.973 1.00 0.00 H new ATOM 0 HA ASP A 10 6.118 7.813 2.371 1.00 0.00 H new ATOM 0 HB2 ASP A 10 6.276 6.193 -0.019 1.00 0.00 H new ATOM 0 HB3 ASP A 10 5.212 7.552 -0.324 1.00 0.00 H new ATOM 171 N ASP A 11 3.768 8.664 1.142 1.00 0.00 N ATOM 172 CA ASP A 11 2.404 9.160 1.070 1.00 0.00 C ATOM 173 C ASP A 11 1.908 9.482 2.482 1.00 0.00 C ATOM 174 O ASP A 11 0.722 9.739 2.683 1.00 0.00 O ATOM 175 CB ASP A 11 1.468 8.111 0.468 1.00 0.00 C ATOM 176 CG ASP A 11 0.142 8.657 -0.065 1.00 0.00 C ATOM 177 OD1 ASP A 11 0.124 9.047 -1.253 1.00 0.00 O ATOM 178 OD2 ASP A 11 -0.825 8.673 0.727 1.00 0.00 O ATOM 0 H ASP A 11 4.462 9.256 0.685 1.00 0.00 H new ATOM 0 HA ASP A 11 2.401 10.050 0.440 1.00 0.00 H new ATOM 0 HB2 ASP A 11 1.989 7.605 -0.345 1.00 0.00 H new ATOM 0 HB3 ASP A 11 1.255 7.358 1.227 1.00 0.00 H new ATOM 183 N GLN A 12 2.841 9.457 3.422 1.00 0.00 N ATOM 184 CA GLN A 12 2.513 9.742 4.809 1.00 0.00 C ATOM 185 C GLN A 12 2.382 11.252 5.023 1.00 0.00 C ATOM 186 O GLN A 12 3.385 11.956 5.130 1.00 0.00 O ATOM 187 CB GLN A 12 3.556 9.143 5.753 1.00 0.00 C ATOM 188 CG GLN A 12 4.974 9.401 5.240 1.00 0.00 C ATOM 189 CD GLN A 12 5.937 9.668 6.399 1.00 0.00 C ATOM 190 OE1 GLN A 12 6.866 8.919 6.652 1.00 0.00 O ATOM 191 NE2 GLN A 12 5.664 10.774 7.085 1.00 0.00 N ATOM 0 H GLN A 12 3.824 9.244 3.251 1.00 0.00 H new ATOM 0 HA GLN A 12 1.554 9.277 5.039 1.00 0.00 H new ATOM 0 HB2 GLN A 12 3.441 9.574 6.748 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.390 8.070 5.850 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.319 8.541 4.667 1.00 0.00 H new ATOM 0 HG3 GLN A 12 4.970 10.255 4.562 1.00 0.00 H new ATOM 0 HE21 GLN A 12 4.870 11.356 6.819 1.00 0.00 H new ATOM 0 HE22 GLN A 12 6.249 11.040 7.877 1.00 0.00 H new ATOM 200 N TYR A 13 1.138 11.704 5.080 1.00 0.00 N ATOM 201 CA TYR A 13 0.864 13.116 5.280 1.00 0.00 C ATOM 202 C TYR A 13 -0.249 13.318 6.310 1.00 0.00 C ATOM 203 O TYR A 13 -0.968 14.315 6.265 1.00 0.00 O ATOM 204 CB TYR A 13 0.392 13.650 3.925 1.00 0.00 C ATOM 205 CG TYR A 13 1.032 14.980 3.523 1.00 0.00 C ATOM 206 CD1 TYR A 13 2.350 15.017 3.117 1.00 0.00 C ATOM 207 CD2 TYR A 13 0.291 16.144 3.567 1.00 0.00 C ATOM 208 CE1 TYR A 13 2.953 16.269 2.739 1.00 0.00 C ATOM 209 CE2 TYR A 13 0.893 17.396 3.189 1.00 0.00 C ATOM 210 CZ TYR A 13 2.194 17.396 2.793 1.00 0.00 C ATOM 211 OH TYR A 13 2.763 18.579 2.436 1.00 0.00 O ATOM 0 H TYR A 13 0.309 11.117 4.991 1.00 0.00 H new ATOM 0 HA TYR A 13 1.752 13.631 5.646 1.00 0.00 H new ATOM 0 HB2 TYR A 13 0.610 12.907 3.158 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -0.691 13.773 3.952 1.00 0.00 H new ATOM 0 HD1 TYR A 13 2.930 14.107 3.083 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -0.741 16.115 3.885 1.00 0.00 H new ATOM 0 HE1 TYR A 13 3.984 16.312 2.420 1.00 0.00 H new ATOM 0 HE2 TYR A 13 0.325 18.314 3.219 1.00 0.00 H new ATOM 0 HH TYR A 13 2.103 19.299 2.522 1.00 0.00 H new ATOM 221 N GLY A 14 -0.357 12.356 7.214 1.00 0.00 N ATOM 222 CA GLY A 14 -1.370 12.415 8.253 1.00 0.00 C ATOM 223 C GLY A 14 -2.540 11.482 7.933 1.00 0.00 C ATOM 224 O GLY A 14 -3.416 11.269 8.770 1.00 0.00 O ATOM 0 H GLY A 14 0.241 11.530 7.248 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -0.930 12.137 9.211 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -1.733 13.438 8.354 1.00 0.00 H new ATOM 228 N ILE A 15 -2.516 10.950 6.720 1.00 0.00 N ATOM 229 CA ILE A 15 -3.563 10.044 6.279 1.00 0.00 C ATOM 230 C ILE A 15 -3.259 8.634 6.788 1.00 0.00 C ATOM 231 O ILE A 15 -4.166 7.907 7.191 1.00 0.00 O ATOM 232 CB ILE A 15 -3.738 10.126 4.761 1.00 0.00 C ATOM 233 CG1 ILE A 15 -4.294 11.490 4.346 1.00 0.00 C ATOM 234 CG2 ILE A 15 -4.602 8.974 4.246 1.00 0.00 C ATOM 235 CD1 ILE A 15 -3.237 12.311 3.606 1.00 0.00 C ATOM 0 H ILE A 15 -1.788 11.129 6.029 1.00 0.00 H new ATOM 0 HA ILE A 15 -4.524 10.336 6.704 1.00 0.00 H new ATOM 0 HB ILE A 15 -2.757 10.024 4.298 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -5.166 11.352 3.706 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.629 12.034 5.229 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -4.711 9.056 3.165 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.127 8.024 4.492 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -5.585 9.019 4.714 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.658 13.275 3.322 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.377 12.468 4.257 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.922 11.776 2.711 1.00 0.00 H new ATOM 247 N ARG A 16 -1.980 8.289 6.753 1.00 0.00 N ATOM 248 CA ARG A 16 -1.546 6.979 7.205 1.00 0.00 C ATOM 249 C ARG A 16 -2.176 6.649 8.560 1.00 0.00 C ATOM 250 O ARG A 16 -2.585 5.514 8.798 1.00 0.00 O ATOM 251 CB ARG A 16 -0.022 6.917 7.331 1.00 0.00 C ATOM 252 CG ARG A 16 0.518 8.146 8.064 1.00 0.00 C ATOM 253 CD ARG A 16 1.997 7.969 8.415 1.00 0.00 C ATOM 254 NE ARG A 16 2.129 7.367 9.760 1.00 0.00 N ATOM 255 CZ ARG A 16 3.264 7.365 10.474 1.00 0.00 C ATOM 256 NH1 ARG A 16 4.370 7.933 9.975 1.00 0.00 N ATOM 257 NH2 ARG A 16 3.291 6.796 11.687 1.00 0.00 N ATOM 0 H ARG A 16 -1.231 8.895 6.418 1.00 0.00 H new ATOM 0 HA ARG A 16 -1.868 6.249 6.463 1.00 0.00 H new ATOM 0 HB2 ARG A 16 0.266 6.013 7.868 1.00 0.00 H new ATOM 0 HB3 ARG A 16 0.426 6.855 6.339 1.00 0.00 H new ATOM 0 HG2 ARG A 16 0.392 9.031 7.440 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -0.058 8.313 8.974 1.00 0.00 H new ATOM 0 HD2 ARG A 16 2.482 7.333 7.674 1.00 0.00 H new ATOM 0 HD3 ARG A 16 2.504 8.934 8.388 1.00 0.00 H new ATOM 0 HE ARG A 16 1.305 6.926 10.170 1.00 0.00 H new ATOM 0 HH11 ARG A 16 4.349 8.367 9.052 1.00 0.00 H new ATOM 0 HH12 ARG A 16 5.233 7.932 10.518 1.00 0.00 H new ATOM 0 HH21 ARG A 16 2.448 6.365 12.067 1.00 0.00 H new ATOM 0 HH22 ARG A 16 4.154 6.794 12.230 1.00 0.00 H new ATOM 271 N ILE A 17 -2.234 7.662 9.412 1.00 0.00 N ATOM 272 CA ILE A 17 -2.808 7.494 10.736 1.00 0.00 C ATOM 273 C ILE A 17 -4.317 7.277 10.610 1.00 0.00 C ATOM 274 O ILE A 17 -4.866 6.347 11.198 1.00 0.00 O ATOM 275 CB ILE A 17 -2.428 8.671 11.637 1.00 0.00 C ATOM 276 CG1 ILE A 17 -0.910 8.769 11.801 1.00 0.00 C ATOM 277 CG2 ILE A 17 -3.146 8.582 12.986 1.00 0.00 C ATOM 278 CD1 ILE A 17 -0.477 10.218 12.031 1.00 0.00 C ATOM 0 H ILE A 17 -1.893 8.602 9.211 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.398 6.607 11.219 1.00 0.00 H new ATOM 0 HB ILE A 17 -2.759 9.591 11.155 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -0.591 8.152 12.641 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -0.418 8.375 10.912 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -2.859 9.430 13.608 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -4.224 8.598 12.826 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -2.867 7.655 13.486 1.00 0.00 H new ATOM 0 HD11 ILE A 17 0.606 10.260 12.145 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -0.777 10.827 11.178 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -0.952 10.601 12.935 1.00 0.00 H new ATOM 290 N LEU A 18 -4.946 8.153 9.839 1.00 0.00 N ATOM 291 CA LEU A 18 -6.381 8.069 9.628 1.00 0.00 C ATOM 292 C LEU A 18 -6.775 6.607 9.408 1.00 0.00 C ATOM 293 O LEU A 18 -7.658 6.089 10.090 1.00 0.00 O ATOM 294 CB LEU A 18 -6.811 8.999 8.492 1.00 0.00 C ATOM 295 CG LEU A 18 -8.276 9.438 8.502 1.00 0.00 C ATOM 296 CD1 LEU A 18 -8.435 10.803 9.175 1.00 0.00 C ATOM 297 CD2 LEU A 18 -8.863 9.423 7.089 1.00 0.00 C ATOM 0 H LEU A 18 -4.488 8.924 9.353 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.917 8.415 10.512 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.185 9.891 8.523 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -6.609 8.500 7.544 1.00 0.00 H new ATOM 0 HG LEU A 18 -8.844 8.720 9.094 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -9.486 11.092 9.169 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -8.081 10.745 10.204 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.851 11.547 8.632 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -9.906 9.739 7.125 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -8.298 10.105 6.453 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -8.804 8.414 6.681 1.00 0.00 H new ATOM 309 N LEU A 19 -6.102 5.983 8.453 1.00 0.00 N ATOM 310 CA LEU A 19 -6.371 4.591 8.135 1.00 0.00 C ATOM 311 C LEU A 19 -5.779 3.699 9.228 1.00 0.00 C ATOM 312 O LEU A 19 -6.239 2.577 9.436 1.00 0.00 O ATOM 313 CB LEU A 19 -5.869 4.256 6.729 1.00 0.00 C ATOM 314 CG LEU A 19 -4.353 4.306 6.528 1.00 0.00 C ATOM 315 CD1 LEU A 19 -3.673 3.099 7.178 1.00 0.00 C ATOM 316 CD2 LEU A 19 -4.000 4.433 5.045 1.00 0.00 C ATOM 0 H LEU A 19 -5.371 6.416 7.889 1.00 0.00 H new ATOM 0 HA LEU A 19 -7.445 4.405 8.118 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -6.217 3.256 6.469 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -6.332 4.948 6.025 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.972 5.197 7.027 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.596 3.159 7.020 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -3.883 3.095 8.247 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -4.054 2.181 6.730 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.917 4.466 4.930 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.396 3.575 4.502 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.436 5.348 4.644 1.00 0.00 H new ATOM 328 N ASN A 20 -4.767 4.230 9.898 1.00 0.00 N ATOM 329 CA ASN A 20 -4.107 3.496 10.965 1.00 0.00 C ATOM 330 C ASN A 20 -5.117 3.205 12.077 1.00 0.00 C ATOM 331 O ASN A 20 -5.389 2.045 12.385 1.00 0.00 O ATOM 332 CB ASN A 20 -2.962 4.312 11.568 1.00 0.00 C ATOM 333 CG ASN A 20 -2.143 3.466 12.545 1.00 0.00 C ATOM 334 OD1 ASN A 20 -2.374 2.282 12.727 1.00 0.00 O ATOM 335 ND2 ASN A 20 -1.175 4.139 13.162 1.00 0.00 N ATOM 0 H ASN A 20 -4.388 5.160 9.723 1.00 0.00 H new ATOM 0 HA ASN A 20 -3.709 2.573 10.544 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -2.316 4.683 10.772 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -3.364 5.184 12.084 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -0.572 3.664 13.834 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -1.036 5.130 12.963 1.00 0.00 H new ATOM 342 N GLU A 21 -5.644 4.277 12.650 1.00 0.00 N ATOM 343 CA GLU A 21 -6.617 4.150 13.721 1.00 0.00 C ATOM 344 C GLU A 21 -7.822 3.334 13.250 1.00 0.00 C ATOM 345 O GLU A 21 -8.493 2.690 14.055 1.00 0.00 O ATOM 346 CB GLU A 21 -7.053 5.526 14.231 1.00 0.00 C ATOM 347 CG GLU A 21 -8.209 5.401 15.226 1.00 0.00 C ATOM 348 CD GLU A 21 -8.610 6.771 15.775 1.00 0.00 C ATOM 349 OE1 GLU A 21 -7.699 7.614 15.921 1.00 0.00 O ATOM 350 OE2 GLU A 21 -9.820 6.946 16.036 1.00 0.00 O ATOM 0 H GLU A 21 -5.415 5.237 12.393 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.148 3.622 14.551 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.210 6.025 14.709 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.358 6.150 13.390 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -9.065 4.936 14.737 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.917 4.747 16.048 1.00 0.00 H new ATOM 357 N VAL A 22 -8.060 3.387 11.948 1.00 0.00 N ATOM 358 CA VAL A 22 -9.173 2.660 11.360 1.00 0.00 C ATOM 359 C VAL A 22 -8.930 1.157 11.509 1.00 0.00 C ATOM 360 O VAL A 22 -9.827 0.416 11.908 1.00 0.00 O ATOM 361 CB VAL A 22 -9.371 3.093 9.906 1.00 0.00 C ATOM 362 CG1 VAL A 22 -10.125 2.023 9.114 1.00 0.00 C ATOM 363 CG2 VAL A 22 -10.089 4.441 9.828 1.00 0.00 C ATOM 0 H VAL A 22 -7.501 3.922 11.283 1.00 0.00 H new ATOM 0 HA VAL A 22 -10.101 2.893 11.883 1.00 0.00 H new ATOM 0 HB VAL A 22 -8.386 3.212 9.455 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -10.253 2.355 8.084 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -9.557 1.093 9.127 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -11.103 1.858 9.566 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -10.217 4.725 8.784 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -11.066 4.361 10.305 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -9.497 5.199 10.340 1.00 0.00 H new ATOM 373 N PHE A 23 -7.712 0.751 11.180 1.00 0.00 N ATOM 374 CA PHE A 23 -7.340 -0.650 11.272 1.00 0.00 C ATOM 375 C PHE A 23 -6.847 -0.995 12.679 1.00 0.00 C ATOM 376 O PHE A 23 -7.140 -2.072 13.197 1.00 0.00 O ATOM 377 CB PHE A 23 -6.201 -0.877 10.276 1.00 0.00 C ATOM 378 CG PHE A 23 -6.666 -1.050 8.828 1.00 0.00 C ATOM 379 CD1 PHE A 23 -7.395 -2.142 8.474 1.00 0.00 C ATOM 380 CD2 PHE A 23 -6.351 -0.111 7.896 1.00 0.00 C ATOM 381 CE1 PHE A 23 -7.826 -2.303 7.131 1.00 0.00 C ATOM 382 CE2 PHE A 23 -6.783 -0.271 6.553 1.00 0.00 C ATOM 383 CZ PHE A 23 -7.511 -1.364 6.198 1.00 0.00 C ATOM 0 H PHE A 23 -6.970 1.368 10.849 1.00 0.00 H new ATOM 0 HA PHE A 23 -8.203 -1.279 11.054 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -5.513 -0.033 10.328 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -5.641 -1.763 10.575 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -7.646 -2.887 9.215 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -5.772 0.756 8.177 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -8.404 -3.171 6.850 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -6.534 0.475 5.813 1.00 0.00 H new ATOM 0 HZ PHE A 23 -7.839 -1.486 5.176 1.00 0.00 H new ATOM 393 N ASN A 24 -6.106 -0.061 13.257 1.00 0.00 N ATOM 394 CA ASN A 24 -5.569 -0.253 14.594 1.00 0.00 C ATOM 395 C ASN A 24 -6.673 -0.785 15.510 1.00 0.00 C ATOM 396 O ASN A 24 -6.401 -1.540 16.442 1.00 0.00 O ATOM 397 CB ASN A 24 -5.064 1.067 15.179 1.00 0.00 C ATOM 398 CG ASN A 24 -3.934 0.825 16.182 1.00 0.00 C ATOM 399 OD1 ASN A 24 -2.852 0.377 15.840 1.00 0.00 O ATOM 400 ND2 ASN A 24 -4.244 1.146 17.434 1.00 0.00 N ATOM 0 H ASN A 24 -5.865 0.831 12.824 1.00 0.00 H new ATOM 0 HA ASN A 24 -4.740 -0.958 14.527 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -4.710 1.713 14.376 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -5.885 1.589 15.670 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -3.557 1.022 18.177 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -5.169 1.517 17.651 1.00 0.00 H new ATOM 407 N LYS A 25 -7.896 -0.369 15.214 1.00 0.00 N ATOM 408 CA LYS A 25 -9.042 -0.793 16.000 1.00 0.00 C ATOM 409 C LYS A 25 -9.042 -2.319 16.110 1.00 0.00 C ATOM 410 O LYS A 25 -9.661 -2.880 17.013 1.00 0.00 O ATOM 411 CB LYS A 25 -10.334 -0.219 15.416 1.00 0.00 C ATOM 412 CG LYS A 25 -10.554 1.222 15.882 1.00 0.00 C ATOM 413 CD LYS A 25 -11.710 1.874 15.121 1.00 0.00 C ATOM 414 CE LYS A 25 -12.839 2.270 16.075 1.00 0.00 C ATOM 415 NZ LYS A 25 -13.925 2.953 15.337 1.00 0.00 N ATOM 0 H LYS A 25 -8.118 0.258 14.440 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.975 -0.399 17.014 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -10.290 -0.250 14.327 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.180 -0.836 15.719 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.765 1.234 16.951 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.642 1.800 15.731 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.350 2.756 14.591 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.090 1.183 14.368 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -13.231 1.383 16.572 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.452 2.927 16.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -14.683 3.215 15.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.550 3.810 14.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -14.306 2.314 14.610 1.00 0.00 H new ATOM 429 N GLU A 26 -8.340 -2.948 15.179 1.00 0.00 N ATOM 430 CA GLU A 26 -8.251 -4.398 15.161 1.00 0.00 C ATOM 431 C GLU A 26 -7.051 -4.867 15.986 1.00 0.00 C ATOM 432 O GLU A 26 -7.012 -6.012 16.436 1.00 0.00 O ATOM 433 CB GLU A 26 -8.168 -4.924 13.726 1.00 0.00 C ATOM 434 CG GLU A 26 -9.562 -5.055 13.109 1.00 0.00 C ATOM 435 CD GLU A 26 -9.598 -6.178 12.070 1.00 0.00 C ATOM 436 OE1 GLU A 26 -9.067 -5.943 10.963 1.00 0.00 O ATOM 437 OE2 GLU A 26 -10.157 -7.244 12.405 1.00 0.00 O ATOM 0 H GLU A 26 -7.827 -2.480 14.432 1.00 0.00 H new ATOM 0 HA GLU A 26 -9.157 -4.804 15.611 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -7.561 -4.250 13.122 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -7.670 -5.894 13.718 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.293 -5.256 13.892 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -9.847 -4.113 12.641 1.00 0.00 H new ATOM 444 N GLY A 27 -6.103 -3.959 16.161 1.00 0.00 N ATOM 445 CA GLY A 27 -4.905 -4.265 16.925 1.00 0.00 C ATOM 446 C GLY A 27 -3.802 -4.815 16.019 1.00 0.00 C ATOM 447 O GLY A 27 -2.809 -5.358 16.502 1.00 0.00 O ATOM 0 H GLY A 27 -6.140 -3.011 15.787 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -4.551 -3.366 17.429 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -5.140 -4.994 17.701 1.00 0.00 H new ATOM 451 N TYR A 28 -4.014 -4.657 14.720 1.00 0.00 N ATOM 452 CA TYR A 28 -3.050 -5.131 13.742 1.00 0.00 C ATOM 453 C TYR A 28 -1.752 -4.325 13.815 1.00 0.00 C ATOM 454 O TYR A 28 -1.768 -3.146 14.167 1.00 0.00 O ATOM 455 CB TYR A 28 -3.696 -4.911 12.373 1.00 0.00 C ATOM 456 CG TYR A 28 -3.616 -3.468 11.871 1.00 0.00 C ATOM 457 CD1 TYR A 28 -3.711 -2.421 12.765 1.00 0.00 C ATOM 458 CD2 TYR A 28 -3.448 -3.213 10.525 1.00 0.00 C ATOM 459 CE1 TYR A 28 -3.636 -1.062 12.293 1.00 0.00 C ATOM 460 CE2 TYR A 28 -3.373 -1.855 10.054 1.00 0.00 C ATOM 461 CZ TYR A 28 -3.470 -0.846 10.961 1.00 0.00 C ATOM 462 OH TYR A 28 -3.399 0.437 10.515 1.00 0.00 O ATOM 0 H TYR A 28 -4.839 -4.208 14.323 1.00 0.00 H new ATOM 0 HA TYR A 28 -2.801 -6.176 13.924 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -3.214 -5.565 11.646 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -4.743 -5.209 12.425 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -3.842 -2.620 13.818 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -3.373 -4.032 9.825 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -3.710 -0.233 12.982 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -3.243 -1.642 9.003 1.00 0.00 H new ATOM 0 HH TYR A 28 -3.042 1.011 11.225 1.00 0.00 H new ATOM 472 N GLN A 29 -0.658 -4.992 13.478 1.00 0.00 N ATOM 473 CA GLN A 29 0.646 -4.352 13.502 1.00 0.00 C ATOM 474 C GLN A 29 0.906 -3.627 12.179 1.00 0.00 C ATOM 475 O GLN A 29 0.666 -4.180 11.107 1.00 0.00 O ATOM 476 CB GLN A 29 1.751 -5.369 13.795 1.00 0.00 C ATOM 477 CG GLN A 29 2.535 -4.980 15.050 1.00 0.00 C ATOM 478 CD GLN A 29 3.294 -6.182 15.616 1.00 0.00 C ATOM 479 OE1 GLN A 29 2.898 -7.326 15.465 1.00 0.00 O ATOM 480 NE2 GLN A 29 4.403 -5.860 16.276 1.00 0.00 N ATOM 0 H GLN A 29 -0.648 -5.969 13.187 1.00 0.00 H new ATOM 0 HA GLN A 29 0.652 -3.616 14.306 1.00 0.00 H new ATOM 0 HB2 GLN A 29 1.314 -6.359 13.927 1.00 0.00 H new ATOM 0 HB3 GLN A 29 2.428 -5.431 12.943 1.00 0.00 H new ATOM 0 HG2 GLN A 29 3.237 -4.181 14.812 1.00 0.00 H new ATOM 0 HG3 GLN A 29 1.851 -4.589 15.804 1.00 0.00 H new ATOM 0 HE21 GLN A 29 4.677 -4.882 16.365 1.00 0.00 H new ATOM 0 HE22 GLN A 29 4.979 -6.591 16.693 1.00 0.00 H new ATOM 489 N THR A 30 1.391 -2.400 12.300 1.00 0.00 N ATOM 490 CA THR A 30 1.686 -1.594 11.127 1.00 0.00 C ATOM 491 C THR A 30 3.142 -1.126 11.154 1.00 0.00 C ATOM 492 O THR A 30 3.772 -1.106 12.210 1.00 0.00 O ATOM 493 CB THR A 30 0.678 -0.443 11.080 1.00 0.00 C ATOM 494 OG1 THR A 30 0.795 0.173 12.360 1.00 0.00 O ATOM 495 CG2 THR A 30 -0.770 -0.934 11.033 1.00 0.00 C ATOM 0 H THR A 30 1.587 -1.944 13.191 1.00 0.00 H new ATOM 0 HA THR A 30 1.582 -2.175 10.211 1.00 0.00 H new ATOM 0 HB THR A 30 0.878 0.179 10.208 1.00 0.00 H new ATOM 0 HG1 THR A 30 0.177 0.931 12.416 1.00 0.00 H new ATOM 0 HG21 THR A 30 -1.444 -0.078 11.001 1.00 0.00 H new ATOM 0 HG22 THR A 30 -0.918 -1.546 10.143 1.00 0.00 H new ATOM 0 HG23 THR A 30 -0.982 -1.529 11.922 1.00 0.00 H new ATOM 503 N PHE A 31 3.634 -0.760 9.979 1.00 0.00 N ATOM 504 CA PHE A 31 5.005 -0.293 9.855 1.00 0.00 C ATOM 505 C PHE A 31 5.138 0.718 8.714 1.00 0.00 C ATOM 506 O PHE A 31 4.411 0.642 7.725 1.00 0.00 O ATOM 507 CB PHE A 31 5.867 -1.517 9.538 1.00 0.00 C ATOM 508 CG PHE A 31 7.173 -1.580 10.333 1.00 0.00 C ATOM 509 CD1 PHE A 31 8.106 -0.602 10.185 1.00 0.00 C ATOM 510 CD2 PHE A 31 7.401 -2.614 11.186 1.00 0.00 C ATOM 511 CE1 PHE A 31 9.319 -0.660 10.922 1.00 0.00 C ATOM 512 CE2 PHE A 31 8.613 -2.673 11.923 1.00 0.00 C ATOM 513 CZ PHE A 31 9.546 -1.695 11.776 1.00 0.00 C ATOM 0 H PHE A 31 3.108 -0.777 9.105 1.00 0.00 H new ATOM 0 HA PHE A 31 5.317 0.197 10.778 1.00 0.00 H new ATOM 0 HB2 PHE A 31 5.288 -2.418 9.738 1.00 0.00 H new ATOM 0 HB3 PHE A 31 6.101 -1.518 8.473 1.00 0.00 H new ATOM 0 HD1 PHE A 31 7.925 0.219 9.507 1.00 0.00 H new ATOM 0 HD2 PHE A 31 6.660 -3.391 11.303 1.00 0.00 H new ATOM 0 HE1 PHE A 31 10.060 0.117 10.805 1.00 0.00 H new ATOM 0 HE2 PHE A 31 8.794 -3.495 12.600 1.00 0.00 H new ATOM 0 HZ PHE A 31 10.468 -1.740 12.337 1.00 0.00 H new ATOM 523 N GLN A 32 6.071 1.642 8.891 1.00 0.00 N ATOM 524 CA GLN A 32 6.309 2.667 7.890 1.00 0.00 C ATOM 525 C GLN A 32 7.694 2.489 7.266 1.00 0.00 C ATOM 526 O GLN A 32 8.643 2.110 7.951 1.00 0.00 O ATOM 527 CB GLN A 32 6.153 4.066 8.489 1.00 0.00 C ATOM 528 CG GLN A 32 7.066 5.070 7.782 1.00 0.00 C ATOM 529 CD GLN A 32 6.552 6.500 7.963 1.00 0.00 C ATOM 530 OE1 GLN A 32 5.639 6.950 7.289 1.00 0.00 O ATOM 531 NE2 GLN A 32 7.186 7.187 8.909 1.00 0.00 N ATOM 0 H GLN A 32 6.671 1.702 9.713 1.00 0.00 H new ATOM 0 HA GLN A 32 5.562 2.559 7.104 1.00 0.00 H new ATOM 0 HB2 GLN A 32 5.116 4.389 8.403 1.00 0.00 H new ATOM 0 HB3 GLN A 32 6.391 4.039 9.552 1.00 0.00 H new ATOM 0 HG2 GLN A 32 8.078 4.990 8.180 1.00 0.00 H new ATOM 0 HG3 GLN A 32 7.122 4.831 6.720 1.00 0.00 H new ATOM 0 HE21 GLN A 32 7.942 6.750 9.436 1.00 0.00 H new ATOM 0 HE22 GLN A 32 6.916 8.151 9.107 1.00 0.00 H new ATOM 540 N ALA A 33 7.767 2.770 5.973 1.00 0.00 N ATOM 541 CA ALA A 33 9.021 2.646 5.250 1.00 0.00 C ATOM 542 C ALA A 33 9.146 3.799 4.252 1.00 0.00 C ATOM 543 O ALA A 33 8.246 4.027 3.445 1.00 0.00 O ATOM 544 CB ALA A 33 9.084 1.277 4.569 1.00 0.00 C ATOM 0 H ALA A 33 6.978 3.083 5.408 1.00 0.00 H new ATOM 0 HA ALA A 33 9.867 2.710 5.935 1.00 0.00 H new ATOM 0 HB1 ALA A 33 10.025 1.183 4.026 1.00 0.00 H new ATOM 0 HB2 ALA A 33 9.020 0.492 5.323 1.00 0.00 H new ATOM 0 HB3 ALA A 33 8.252 1.179 3.872 1.00 0.00 H new ATOM 550 N ALA A 34 10.269 4.497 4.340 1.00 0.00 N ATOM 551 CA ALA A 34 10.523 5.621 3.455 1.00 0.00 C ATOM 552 C ALA A 34 11.387 5.155 2.282 1.00 0.00 C ATOM 553 O ALA A 34 12.061 5.963 1.644 1.00 0.00 O ATOM 554 CB ALA A 34 11.176 6.756 4.247 1.00 0.00 C ATOM 0 H ALA A 34 11.013 4.306 5.011 1.00 0.00 H new ATOM 0 HA ALA A 34 9.590 6.006 3.044 1.00 0.00 H new ATOM 0 HB1 ALA A 34 11.367 7.600 3.584 1.00 0.00 H new ATOM 0 HB2 ALA A 34 10.509 7.070 5.050 1.00 0.00 H new ATOM 0 HB3 ALA A 34 12.118 6.408 4.672 1.00 0.00 H new ATOM 560 N ASN A 35 11.340 3.855 2.033 1.00 0.00 N ATOM 561 CA ASN A 35 12.110 3.272 0.947 1.00 0.00 C ATOM 562 C ASN A 35 11.514 1.913 0.576 1.00 0.00 C ATOM 563 O ASN A 35 10.921 1.241 1.419 1.00 0.00 O ATOM 564 CB ASN A 35 13.567 3.052 1.362 1.00 0.00 C ATOM 565 CG ASN A 35 13.783 3.433 2.828 1.00 0.00 C ATOM 566 OD1 ASN A 35 13.007 3.093 3.705 1.00 0.00 O ATOM 567 ND2 ASN A 35 14.878 4.157 3.042 1.00 0.00 N ATOM 0 H ASN A 35 10.780 3.188 2.565 1.00 0.00 H new ATOM 0 HA ASN A 35 12.075 3.959 0.102 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.838 2.007 1.210 1.00 0.00 H new ATOM 0 HB3 ASN A 35 14.224 3.647 0.727 1.00 0.00 H new ATOM 0 HD21 ASN A 35 15.111 4.462 3.987 1.00 0.00 H new ATOM 0 HD22 ASN A 35 15.485 4.407 2.261 1.00 0.00 H new ATOM 574 N GLY A 36 11.691 1.549 -0.685 1.00 0.00 N ATOM 575 CA GLY A 36 11.178 0.282 -1.178 1.00 0.00 C ATOM 576 C GLY A 36 11.922 -0.895 -0.544 1.00 0.00 C ATOM 577 O GLY A 36 11.302 -1.787 0.033 1.00 0.00 O ATOM 0 H GLY A 36 12.183 2.110 -1.381 1.00 0.00 H new ATOM 0 HA2 GLY A 36 10.113 0.206 -0.956 1.00 0.00 H new ATOM 0 HA3 GLY A 36 11.282 0.241 -2.262 1.00 0.00 H new ATOM 581 N LEU A 37 13.240 -0.858 -0.671 1.00 0.00 N ATOM 582 CA LEU A 37 14.075 -1.910 -0.117 1.00 0.00 C ATOM 583 C LEU A 37 13.662 -2.174 1.333 1.00 0.00 C ATOM 584 O LEU A 37 13.477 -3.323 1.730 1.00 0.00 O ATOM 585 CB LEU A 37 15.555 -1.562 -0.281 1.00 0.00 C ATOM 586 CG LEU A 37 16.414 -2.604 -1.000 1.00 0.00 C ATOM 587 CD1 LEU A 37 17.533 -1.935 -1.800 1.00 0.00 C ATOM 588 CD2 LEU A 37 16.956 -3.642 -0.015 1.00 0.00 C ATOM 0 H LEU A 37 13.750 -0.116 -1.150 1.00 0.00 H new ATOM 0 HA LEU A 37 13.928 -2.841 -0.665 1.00 0.00 H new ATOM 0 HB2 LEU A 37 15.628 -0.621 -0.826 1.00 0.00 H new ATOM 0 HB3 LEU A 37 15.979 -1.391 0.708 1.00 0.00 H new ATOM 0 HG LEU A 37 15.782 -3.135 -1.712 1.00 0.00 H new ATOM 0 HD11 LEU A 37 18.128 -2.698 -2.301 1.00 0.00 H new ATOM 0 HD12 LEU A 37 17.099 -1.267 -2.544 1.00 0.00 H new ATOM 0 HD13 LEU A 37 18.170 -1.363 -1.126 1.00 0.00 H new ATOM 0 HD21 LEU A 37 17.563 -4.371 -0.552 1.00 0.00 H new ATOM 0 HD22 LEU A 37 17.567 -3.145 0.738 1.00 0.00 H new ATOM 0 HD23 LEU A 37 16.124 -4.151 0.472 1.00 0.00 H new ATOM 600 N GLN A 38 13.529 -1.089 2.083 1.00 0.00 N ATOM 601 CA GLN A 38 13.141 -1.189 3.479 1.00 0.00 C ATOM 602 C GLN A 38 11.761 -1.836 3.602 1.00 0.00 C ATOM 603 O GLN A 38 11.469 -2.501 4.595 1.00 0.00 O ATOM 604 CB GLN A 38 13.165 0.184 4.154 1.00 0.00 C ATOM 605 CG GLN A 38 14.227 0.237 5.254 1.00 0.00 C ATOM 606 CD GLN A 38 13.731 1.043 6.456 1.00 0.00 C ATOM 607 OE1 GLN A 38 12.823 0.649 7.169 1.00 0.00 O ATOM 608 NE2 GLN A 38 14.377 2.191 6.641 1.00 0.00 N ATOM 0 H GLN A 38 13.683 -0.137 1.750 1.00 0.00 H new ATOM 0 HA GLN A 38 13.864 -1.823 3.992 1.00 0.00 H new ATOM 0 HB2 GLN A 38 13.368 0.955 3.411 1.00 0.00 H new ATOM 0 HB3 GLN A 38 12.185 0.401 4.579 1.00 0.00 H new ATOM 0 HG2 GLN A 38 14.480 -0.775 5.570 1.00 0.00 H new ATOM 0 HG3 GLN A 38 15.140 0.686 4.862 1.00 0.00 H new ATOM 0 HE21 GLN A 38 15.128 2.461 6.006 1.00 0.00 H new ATOM 0 HE22 GLN A 38 14.121 2.801 7.417 1.00 0.00 H new ATOM 617 N ALA A 39 10.948 -1.620 2.579 1.00 0.00 N ATOM 618 CA ALA A 39 9.605 -2.174 2.560 1.00 0.00 C ATOM 619 C ALA A 39 9.661 -3.620 2.061 1.00 0.00 C ATOM 620 O ALA A 39 8.751 -4.406 2.321 1.00 0.00 O ATOM 621 CB ALA A 39 8.701 -1.294 1.694 1.00 0.00 C ATOM 0 H ALA A 39 11.193 -1.069 1.757 1.00 0.00 H new ATOM 0 HA ALA A 39 9.182 -2.187 3.564 1.00 0.00 H new ATOM 0 HB1 ALA A 39 7.694 -1.710 1.680 1.00 0.00 H new ATOM 0 HB2 ALA A 39 8.671 -0.286 2.107 1.00 0.00 H new ATOM 0 HB3 ALA A 39 9.093 -1.259 0.678 1.00 0.00 H new ATOM 627 N LEU A 40 10.740 -3.927 1.355 1.00 0.00 N ATOM 628 CA LEU A 40 10.927 -5.264 0.818 1.00 0.00 C ATOM 629 C LEU A 40 11.161 -6.243 1.970 1.00 0.00 C ATOM 630 O LEU A 40 10.640 -7.357 1.959 1.00 0.00 O ATOM 631 CB LEU A 40 12.041 -5.269 -0.230 1.00 0.00 C ATOM 632 CG LEU A 40 11.626 -4.888 -1.652 1.00 0.00 C ATOM 633 CD1 LEU A 40 12.775 -5.111 -2.637 1.00 0.00 C ATOM 634 CD2 LEU A 40 10.358 -5.634 -2.072 1.00 0.00 C ATOM 0 H LEU A 40 11.493 -3.273 1.143 1.00 0.00 H new ATOM 0 HA LEU A 40 10.029 -5.595 0.296 1.00 0.00 H new ATOM 0 HB2 LEU A 40 12.822 -4.582 0.096 1.00 0.00 H new ATOM 0 HB3 LEU A 40 12.483 -6.265 -0.256 1.00 0.00 H new ATOM 0 HG LEU A 40 11.392 -3.823 -1.666 1.00 0.00 H new ATOM 0 HD11 LEU A 40 12.453 -4.832 -3.640 1.00 0.00 H new ATOM 0 HD12 LEU A 40 13.628 -4.498 -2.346 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.064 -6.162 -2.627 1.00 0.00 H new ATOM 0 HD21 LEU A 40 10.085 -5.345 -3.087 1.00 0.00 H new ATOM 0 HD22 LEU A 40 10.539 -6.708 -2.037 1.00 0.00 H new ATOM 0 HD23 LEU A 40 9.545 -5.381 -1.392 1.00 0.00 H new ATOM 646 N ASP A 41 11.947 -5.792 2.938 1.00 0.00 N ATOM 647 CA ASP A 41 12.257 -6.614 4.095 1.00 0.00 C ATOM 648 C ASP A 41 11.038 -6.668 5.018 1.00 0.00 C ATOM 649 O ASP A 41 10.544 -7.749 5.338 1.00 0.00 O ATOM 650 CB ASP A 41 13.426 -6.029 4.889 1.00 0.00 C ATOM 651 CG ASP A 41 14.032 -6.968 5.934 1.00 0.00 C ATOM 652 OD1 ASP A 41 13.524 -8.105 6.038 1.00 0.00 O ATOM 653 OD2 ASP A 41 14.990 -6.527 6.605 1.00 0.00 O ATOM 0 H ASP A 41 12.378 -4.868 2.944 1.00 0.00 H new ATOM 0 HA ASP A 41 12.525 -7.609 3.740 1.00 0.00 H new ATOM 0 HB2 ASP A 41 14.209 -5.734 4.190 1.00 0.00 H new ATOM 0 HB3 ASP A 41 13.088 -5.122 5.390 1.00 0.00 H new ATOM 658 N ILE A 42 10.587 -5.489 5.420 1.00 0.00 N ATOM 659 CA ILE A 42 9.435 -5.389 6.300 1.00 0.00 C ATOM 660 C ILE A 42 8.237 -6.078 5.645 1.00 0.00 C ATOM 661 O ILE A 42 7.326 -6.536 6.334 1.00 0.00 O ATOM 662 CB ILE A 42 9.175 -3.929 6.677 1.00 0.00 C ATOM 663 CG1 ILE A 42 10.393 -3.316 7.370 1.00 0.00 C ATOM 664 CG2 ILE A 42 7.908 -3.799 7.525 1.00 0.00 C ATOM 665 CD1 ILE A 42 9.986 -2.590 8.654 1.00 0.00 C ATOM 0 H ILE A 42 10.998 -4.595 5.153 1.00 0.00 H new ATOM 0 HA ILE A 42 9.626 -5.908 7.239 1.00 0.00 H new ATOM 0 HB ILE A 42 9.008 -3.364 5.760 1.00 0.00 H new ATOM 0 HG12 ILE A 42 11.115 -4.099 7.604 1.00 0.00 H new ATOM 0 HG13 ILE A 42 10.887 -2.618 6.694 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.746 -2.751 7.779 1.00 0.00 H new ATOM 0 HG22 ILE A 42 7.053 -4.172 6.961 1.00 0.00 H new ATOM 0 HG23 ILE A 42 8.021 -4.381 8.440 1.00 0.00 H new ATOM 0 HD11 ILE A 42 10.871 -2.164 9.127 1.00 0.00 H new ATOM 0 HD12 ILE A 42 9.283 -1.793 8.414 1.00 0.00 H new ATOM 0 HD13 ILE A 42 9.514 -3.296 9.337 1.00 0.00 H new ATOM 677 N VAL A 43 8.275 -6.130 4.322 1.00 0.00 N ATOM 678 CA VAL A 43 7.203 -6.755 3.566 1.00 0.00 C ATOM 679 C VAL A 43 6.923 -8.145 4.142 1.00 0.00 C ATOM 680 O VAL A 43 5.788 -8.453 4.503 1.00 0.00 O ATOM 681 CB VAL A 43 7.560 -6.785 2.078 1.00 0.00 C ATOM 682 CG1 VAL A 43 7.336 -8.179 1.489 1.00 0.00 C ATOM 683 CG2 VAL A 43 6.771 -5.729 1.303 1.00 0.00 C ATOM 0 H VAL A 43 9.032 -5.749 3.754 1.00 0.00 H new ATOM 0 HA VAL A 43 6.284 -6.175 3.654 1.00 0.00 H new ATOM 0 HB VAL A 43 8.619 -6.547 1.983 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.597 -8.173 0.431 1.00 0.00 H new ATOM 0 HG12 VAL A 43 7.963 -8.901 2.013 1.00 0.00 H new ATOM 0 HG13 VAL A 43 6.288 -8.458 1.603 1.00 0.00 H new ATOM 0 HG21 VAL A 43 7.044 -5.772 0.249 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.703 -5.921 1.410 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.003 -4.740 1.698 1.00 0.00 H new ATOM 693 N THR A 44 7.976 -8.946 4.209 1.00 0.00 N ATOM 694 CA THR A 44 7.857 -10.295 4.735 1.00 0.00 C ATOM 695 C THR A 44 7.975 -10.285 6.261 1.00 0.00 C ATOM 696 O THR A 44 7.308 -11.062 6.943 1.00 0.00 O ATOM 697 CB THR A 44 8.913 -11.164 4.050 1.00 0.00 C ATOM 698 OG1 THR A 44 8.716 -10.919 2.660 1.00 0.00 O ATOM 699 CG2 THR A 44 8.633 -12.660 4.208 1.00 0.00 C ATOM 0 H THR A 44 8.915 -8.687 3.908 1.00 0.00 H new ATOM 0 HA THR A 44 6.876 -10.719 4.519 1.00 0.00 H new ATOM 0 HB THR A 44 9.895 -10.933 4.462 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.362 -11.442 2.141 1.00 0.00 H new ATOM 0 HG21 THR A 44 9.412 -13.231 3.703 1.00 0.00 H new ATOM 0 HG22 THR A 44 8.622 -12.918 5.267 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.665 -12.898 3.766 1.00 0.00 H new ATOM 707 N LYS A 45 8.827 -9.398 6.751 1.00 0.00 N ATOM 708 CA LYS A 45 9.041 -9.277 8.183 1.00 0.00 C ATOM 709 C LYS A 45 7.703 -9.005 8.873 1.00 0.00 C ATOM 710 O LYS A 45 7.434 -9.541 9.947 1.00 0.00 O ATOM 711 CB LYS A 45 10.110 -8.223 8.478 1.00 0.00 C ATOM 712 CG LYS A 45 11.223 -8.801 9.355 1.00 0.00 C ATOM 713 CD LYS A 45 11.490 -7.903 10.564 1.00 0.00 C ATOM 714 CE LYS A 45 12.990 -7.673 10.756 1.00 0.00 C ATOM 715 NZ LYS A 45 13.680 -8.955 11.024 1.00 0.00 N ATOM 0 H LYS A 45 9.378 -8.755 6.182 1.00 0.00 H new ATOM 0 HA LYS A 45 9.427 -10.212 8.591 1.00 0.00 H new ATOM 0 HB2 LYS A 45 10.533 -7.857 7.542 1.00 0.00 H new ATOM 0 HB3 LYS A 45 9.655 -7.368 8.978 1.00 0.00 H new ATOM 0 HG2 LYS A 45 10.943 -9.799 9.693 1.00 0.00 H new ATOM 0 HG3 LYS A 45 12.135 -8.907 8.768 1.00 0.00 H new ATOM 0 HD2 LYS A 45 10.986 -6.946 10.429 1.00 0.00 H new ATOM 0 HD3 LYS A 45 11.071 -8.360 11.460 1.00 0.00 H new ATOM 0 HE2 LYS A 45 13.410 -7.207 9.865 1.00 0.00 H new ATOM 0 HE3 LYS A 45 13.155 -6.984 11.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 14.674 -8.770 11.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 13.213 -9.442 11.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 13.639 -9.555 10.176 1.00 0.00 H new ATOM 729 N GLU A 46 6.898 -8.174 8.227 1.00 0.00 N ATOM 730 CA GLU A 46 5.595 -7.825 8.765 1.00 0.00 C ATOM 731 C GLU A 46 4.493 -8.585 8.022 1.00 0.00 C ATOM 732 O GLU A 46 3.328 -8.536 8.413 1.00 0.00 O ATOM 733 CB GLU A 46 5.360 -6.315 8.697 1.00 0.00 C ATOM 734 CG GLU A 46 5.606 -5.660 10.058 1.00 0.00 C ATOM 735 CD GLU A 46 4.337 -4.979 10.576 1.00 0.00 C ATOM 736 OE1 GLU A 46 3.244 -5.442 10.183 1.00 0.00 O ATOM 737 OE2 GLU A 46 4.489 -4.012 11.352 1.00 0.00 O ATOM 0 H GLU A 46 7.124 -7.732 7.336 1.00 0.00 H new ATOM 0 HA GLU A 46 5.567 -8.117 9.815 1.00 0.00 H new ATOM 0 HB2 GLU A 46 6.022 -5.874 7.952 1.00 0.00 H new ATOM 0 HB3 GLU A 46 4.338 -6.117 8.373 1.00 0.00 H new ATOM 0 HG2 GLU A 46 5.937 -6.413 10.773 1.00 0.00 H new ATOM 0 HG3 GLU A 46 6.408 -4.927 9.973 1.00 0.00 H new ATOM 744 N ARG A 47 4.901 -9.270 6.964 1.00 0.00 N ATOM 745 CA ARG A 47 3.964 -10.039 6.164 1.00 0.00 C ATOM 746 C ARG A 47 2.551 -9.470 6.308 1.00 0.00 C ATOM 747 O ARG A 47 1.655 -10.144 6.814 1.00 0.00 O ATOM 748 CB ARG A 47 3.959 -11.510 6.583 1.00 0.00 C ATOM 749 CG ARG A 47 3.794 -11.648 8.098 1.00 0.00 C ATOM 750 CD ARG A 47 2.831 -12.786 8.443 1.00 0.00 C ATOM 751 NE ARG A 47 3.401 -14.081 8.007 1.00 0.00 N ATOM 752 CZ ARG A 47 2.677 -15.189 7.802 1.00 0.00 C ATOM 753 NH1 ARG A 47 1.351 -15.168 7.992 1.00 0.00 N ATOM 754 NH2 ARG A 47 3.280 -16.319 7.407 1.00 0.00 N ATOM 0 H ARG A 47 5.868 -9.308 6.642 1.00 0.00 H new ATOM 0 HA ARG A 47 4.283 -9.971 5.124 1.00 0.00 H new ATOM 0 HB2 ARG A 47 3.148 -12.033 6.076 1.00 0.00 H new ATOM 0 HB3 ARG A 47 4.889 -11.984 6.270 1.00 0.00 H new ATOM 0 HG2 ARG A 47 4.764 -11.836 8.558 1.00 0.00 H new ATOM 0 HG3 ARG A 47 3.420 -10.712 8.514 1.00 0.00 H new ATOM 0 HD2 ARG A 47 2.646 -12.804 9.517 1.00 0.00 H new ATOM 0 HD3 ARG A 47 1.870 -12.620 7.957 1.00 0.00 H new ATOM 0 HE ARG A 47 4.408 -14.133 7.853 1.00 0.00 H new ATOM 0 HH11 ARG A 47 0.892 -14.308 8.293 1.00 0.00 H new ATOM 0 HH12 ARG A 47 0.800 -16.012 7.836 1.00 0.00 H new ATOM 0 HH21 ARG A 47 4.290 -16.335 7.263 1.00 0.00 H new ATOM 0 HH22 ARG A 47 2.729 -17.163 7.251 1.00 0.00 H new ATOM 768 N PRO A 48 2.392 -8.202 5.842 1.00 0.00 N ATOM 769 CA PRO A 48 1.103 -7.535 5.914 1.00 0.00 C ATOM 770 C PRO A 48 0.142 -8.082 4.856 1.00 0.00 C ATOM 771 O PRO A 48 0.571 -8.509 3.785 1.00 0.00 O ATOM 772 CB PRO A 48 1.414 -6.059 5.728 1.00 0.00 C ATOM 773 CG PRO A 48 2.796 -6.000 5.098 1.00 0.00 C ATOM 774 CD PRO A 48 3.430 -7.374 5.236 1.00 0.00 C ATOM 0 HA PRO A 48 0.593 -7.705 6.862 1.00 0.00 H new ATOM 0 HB2 PRO A 48 0.672 -5.581 5.088 1.00 0.00 H new ATOM 0 HB3 PRO A 48 1.397 -5.533 6.683 1.00 0.00 H new ATOM 0 HG2 PRO A 48 2.725 -5.716 4.048 1.00 0.00 H new ATOM 0 HG3 PRO A 48 3.409 -5.246 5.592 1.00 0.00 H new ATOM 0 HD2 PRO A 48 3.735 -7.768 4.267 1.00 0.00 H new ATOM 0 HD3 PRO A 48 4.322 -7.337 5.861 1.00 0.00 H new ATOM 782 N ASP A 49 -1.139 -8.050 5.193 1.00 0.00 N ATOM 783 CA ASP A 49 -2.163 -8.537 4.286 1.00 0.00 C ATOM 784 C ASP A 49 -2.578 -7.409 3.339 1.00 0.00 C ATOM 785 O ASP A 49 -3.405 -7.612 2.451 1.00 0.00 O ATOM 786 CB ASP A 49 -3.407 -8.992 5.052 1.00 0.00 C ATOM 787 CG ASP A 49 -3.125 -9.729 6.363 1.00 0.00 C ATOM 788 OD1 ASP A 49 -1.939 -9.755 6.756 1.00 0.00 O ATOM 789 OD2 ASP A 49 -4.103 -10.251 6.942 1.00 0.00 O ATOM 0 H ASP A 49 -1.491 -7.694 6.082 1.00 0.00 H new ATOM 0 HA ASP A 49 -1.750 -9.382 3.734 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -4.022 -8.118 5.269 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -3.995 -9.643 4.406 1.00 0.00 H new ATOM 794 N LEU A 50 -1.983 -6.246 3.560 1.00 0.00 N ATOM 795 CA LEU A 50 -2.280 -5.086 2.737 1.00 0.00 C ATOM 796 C LEU A 50 -1.248 -3.991 3.015 1.00 0.00 C ATOM 797 O LEU A 50 -1.166 -3.480 4.131 1.00 0.00 O ATOM 798 CB LEU A 50 -3.727 -4.635 2.949 1.00 0.00 C ATOM 799 CG LEU A 50 -4.400 -3.958 1.753 1.00 0.00 C ATOM 800 CD1 LEU A 50 -3.697 -2.645 1.400 1.00 0.00 C ATOM 801 CD2 LEU A 50 -4.477 -4.907 0.556 1.00 0.00 C ATOM 0 H LEU A 50 -1.297 -6.082 4.297 1.00 0.00 H new ATOM 0 HA LEU A 50 -2.201 -5.339 1.680 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.320 -5.505 3.230 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.752 -3.946 3.793 1.00 0.00 H new ATOM 0 HG LEU A 50 -5.424 -3.711 2.033 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.195 -2.184 0.547 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -3.739 -1.969 2.254 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -2.656 -2.846 1.148 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -4.960 -4.400 -0.280 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -3.471 -5.208 0.265 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.056 -5.790 0.828 1.00 0.00 H new ATOM 813 N VAL A 51 -0.486 -3.664 1.982 1.00 0.00 N ATOM 814 CA VAL A 51 0.537 -2.640 2.101 1.00 0.00 C ATOM 815 C VAL A 51 0.244 -1.514 1.106 1.00 0.00 C ATOM 816 O VAL A 51 -0.181 -1.771 -0.019 1.00 0.00 O ATOM 817 CB VAL A 51 1.923 -3.260 1.911 1.00 0.00 C ATOM 818 CG1 VAL A 51 1.888 -4.369 0.857 1.00 0.00 C ATOM 819 CG2 VAL A 51 2.956 -2.191 1.548 1.00 0.00 C ATOM 0 H VAL A 51 -0.557 -4.091 1.058 1.00 0.00 H new ATOM 0 HA VAL A 51 0.525 -2.203 3.099 1.00 0.00 H new ATOM 0 HB VAL A 51 2.223 -3.708 2.858 1.00 0.00 H new ATOM 0 HG11 VAL A 51 2.886 -4.793 0.741 1.00 0.00 H new ATOM 0 HG12 VAL A 51 1.196 -5.150 1.173 1.00 0.00 H new ATOM 0 HG13 VAL A 51 1.557 -3.955 -0.096 1.00 0.00 H new ATOM 0 HG21 VAL A 51 3.932 -2.658 1.418 1.00 0.00 H new ATOM 0 HG22 VAL A 51 2.662 -1.701 0.620 1.00 0.00 H new ATOM 0 HG23 VAL A 51 3.010 -1.451 2.347 1.00 0.00 H new ATOM 829 N LEU A 52 0.483 -0.292 1.558 1.00 0.00 N ATOM 830 CA LEU A 52 0.250 0.874 0.722 1.00 0.00 C ATOM 831 C LEU A 52 1.574 1.607 0.496 1.00 0.00 C ATOM 832 O LEU A 52 2.271 1.945 1.452 1.00 0.00 O ATOM 833 CB LEU A 52 -0.846 1.755 1.324 1.00 0.00 C ATOM 834 CG LEU A 52 -0.642 3.265 1.190 1.00 0.00 C ATOM 835 CD1 LEU A 52 -1.962 4.015 1.376 1.00 0.00 C ATOM 836 CD2 LEU A 52 0.439 3.760 2.153 1.00 0.00 C ATOM 0 H LEU A 52 0.836 -0.084 2.492 1.00 0.00 H new ATOM 0 HA LEU A 52 -0.119 0.572 -0.258 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -1.794 1.493 0.854 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -0.938 1.513 2.383 1.00 0.00 H new ATOM 0 HG LEU A 52 -0.293 3.474 0.179 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.789 5.087 1.276 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -2.675 3.690 0.618 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -2.364 3.803 2.367 1.00 0.00 H new ATOM 0 HD21 LEU A 52 0.564 4.837 2.037 1.00 0.00 H new ATOM 0 HD22 LEU A 52 0.143 3.537 3.178 1.00 0.00 H new ATOM 0 HD23 LEU A 52 1.381 3.259 1.931 1.00 0.00 H new ATOM 848 N LEU A 53 1.881 1.832 -0.773 1.00 0.00 N ATOM 849 CA LEU A 53 3.108 2.518 -1.136 1.00 0.00 C ATOM 850 C LEU A 53 2.810 3.541 -2.234 1.00 0.00 C ATOM 851 O LEU A 53 1.952 3.311 -3.085 1.00 0.00 O ATOM 852 CB LEU A 53 4.195 1.510 -1.514 1.00 0.00 C ATOM 853 CG LEU A 53 5.546 2.101 -1.923 1.00 0.00 C ATOM 854 CD1 LEU A 53 6.681 1.111 -1.657 1.00 0.00 C ATOM 855 CD2 LEU A 53 5.521 2.567 -3.380 1.00 0.00 C ATOM 0 H LEU A 53 1.300 1.551 -1.563 1.00 0.00 H new ATOM 0 HA LEU A 53 3.501 3.071 -0.283 1.00 0.00 H new ATOM 0 HB2 LEU A 53 4.354 0.843 -0.667 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.825 0.898 -2.336 1.00 0.00 H new ATOM 0 HG LEU A 53 5.735 2.980 -1.307 1.00 0.00 H new ATOM 0 HD11 LEU A 53 7.630 1.556 -1.957 1.00 0.00 H new ATOM 0 HD12 LEU A 53 6.712 0.871 -0.594 1.00 0.00 H new ATOM 0 HD13 LEU A 53 6.511 0.200 -2.230 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.493 2.983 -3.646 1.00 0.00 H new ATOM 0 HD22 LEU A 53 5.299 1.720 -4.029 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.753 3.331 -3.505 1.00 0.00 H new ATOM 867 N ASP A 54 3.534 4.649 -2.179 1.00 0.00 N ATOM 868 CA ASP A 54 3.358 5.708 -3.159 1.00 0.00 C ATOM 869 C ASP A 54 4.559 5.725 -4.107 1.00 0.00 C ATOM 870 O ASP A 54 5.703 5.812 -3.664 1.00 0.00 O ATOM 871 CB ASP A 54 3.271 7.076 -2.481 1.00 0.00 C ATOM 872 CG ASP A 54 3.974 8.213 -3.226 1.00 0.00 C ATOM 873 OD1 ASP A 54 3.836 8.248 -4.468 1.00 0.00 O ATOM 874 OD2 ASP A 54 4.633 9.021 -2.537 1.00 0.00 O ATOM 0 H ASP A 54 4.244 4.837 -1.471 1.00 0.00 H new ATOM 0 HA ASP A 54 2.433 5.515 -3.702 1.00 0.00 H new ATOM 0 HB2 ASP A 54 2.220 7.338 -2.358 1.00 0.00 H new ATOM 0 HB3 ASP A 54 3.699 6.997 -1.482 1.00 0.00 H new ATOM 879 N MET A 55 4.257 5.640 -5.394 1.00 0.00 N ATOM 880 CA MET A 55 5.297 5.645 -6.408 1.00 0.00 C ATOM 881 C MET A 55 6.236 6.840 -6.226 1.00 0.00 C ATOM 882 O MET A 55 7.441 6.666 -6.057 1.00 0.00 O ATOM 883 CB MET A 55 4.657 5.705 -7.797 1.00 0.00 C ATOM 884 CG MET A 55 3.542 4.666 -7.932 1.00 0.00 C ATOM 885 SD MET A 55 4.065 3.114 -7.224 1.00 0.00 S ATOM 886 CE MET A 55 3.208 3.182 -5.660 1.00 0.00 C ATOM 0 H MET A 55 3.307 5.567 -5.758 1.00 0.00 H new ATOM 0 HA MET A 55 5.881 4.730 -6.307 1.00 0.00 H new ATOM 0 HB2 MET A 55 4.253 6.702 -7.972 1.00 0.00 H new ATOM 0 HB3 MET A 55 5.416 5.530 -8.559 1.00 0.00 H new ATOM 0 HG2 MET A 55 2.642 5.019 -7.429 1.00 0.00 H new ATOM 0 HG3 MET A 55 3.287 4.528 -8.983 1.00 0.00 H new ATOM 0 HE1 MET A 55 2.890 2.179 -5.375 1.00 0.00 H new ATOM 0 HE2 MET A 55 3.876 3.581 -4.896 1.00 0.00 H new ATOM 0 HE3 MET A 55 2.334 3.827 -5.752 1.00 0.00 H new ATOM 896 N LYS A 56 5.646 8.026 -6.267 1.00 0.00 N ATOM 897 CA LYS A 56 6.414 9.249 -6.109 1.00 0.00 C ATOM 898 C LYS A 56 7.257 9.155 -4.835 1.00 0.00 C ATOM 899 O LYS A 56 6.734 9.287 -3.730 1.00 0.00 O ATOM 900 CB LYS A 56 5.492 10.469 -6.149 1.00 0.00 C ATOM 901 CG LYS A 56 5.917 11.442 -7.250 1.00 0.00 C ATOM 902 CD LYS A 56 5.172 12.773 -7.124 1.00 0.00 C ATOM 903 CE LYS A 56 5.551 13.723 -8.261 1.00 0.00 C ATOM 904 NZ LYS A 56 5.402 15.131 -7.831 1.00 0.00 N ATOM 0 H LYS A 56 4.645 8.166 -6.407 1.00 0.00 H new ATOM 0 HA LYS A 56 7.107 9.375 -6.941 1.00 0.00 H new ATOM 0 HB2 LYS A 56 4.465 10.147 -6.320 1.00 0.00 H new ATOM 0 HB3 LYS A 56 5.511 10.975 -5.184 1.00 0.00 H new ATOM 0 HG2 LYS A 56 6.991 11.616 -7.192 1.00 0.00 H new ATOM 0 HG3 LYS A 56 5.718 11.001 -8.227 1.00 0.00 H new ATOM 0 HD2 LYS A 56 4.097 12.595 -7.137 1.00 0.00 H new ATOM 0 HD3 LYS A 56 5.406 13.236 -6.165 1.00 0.00 H new ATOM 0 HE2 LYS A 56 6.580 13.538 -8.570 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.919 13.532 -9.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 5.663 15.763 -8.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 4.414 15.308 -7.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 6.024 15.313 -7.017 1.00 0.00 H new ATOM 918 N ILE A 57 8.547 8.929 -5.033 1.00 0.00 N ATOM 919 CA ILE A 57 9.467 8.817 -3.914 1.00 0.00 C ATOM 920 C ILE A 57 10.765 9.553 -4.250 1.00 0.00 C ATOM 921 O ILE A 57 11.216 9.532 -5.395 1.00 0.00 O ATOM 922 CB ILE A 57 9.673 7.349 -3.535 1.00 0.00 C ATOM 923 CG1 ILE A 57 8.366 6.719 -3.048 1.00 0.00 C ATOM 924 CG2 ILE A 57 10.798 7.200 -2.509 1.00 0.00 C ATOM 925 CD1 ILE A 57 8.490 5.197 -2.962 1.00 0.00 C ATOM 0 H ILE A 57 8.977 8.820 -5.951 1.00 0.00 H new ATOM 0 HA ILE A 57 9.049 9.296 -3.028 1.00 0.00 H new ATOM 0 HB ILE A 57 9.979 6.806 -4.429 1.00 0.00 H new ATOM 0 HG12 ILE A 57 8.106 7.122 -2.069 1.00 0.00 H new ATOM 0 HG13 ILE A 57 7.555 6.984 -3.727 1.00 0.00 H new ATOM 0 HG21 ILE A 57 10.924 6.147 -2.257 1.00 0.00 H new ATOM 0 HG22 ILE A 57 11.727 7.586 -2.929 1.00 0.00 H new ATOM 0 HG23 ILE A 57 10.546 7.761 -1.609 1.00 0.00 H new ATOM 0 HD11 ILE A 57 7.548 4.774 -2.613 1.00 0.00 H new ATOM 0 HD12 ILE A 57 8.726 4.795 -3.947 1.00 0.00 H new ATOM 0 HD13 ILE A 57 9.285 4.936 -2.264 1.00 0.00 H new ATOM 937 N PRO A 58 11.344 10.204 -3.206 1.00 0.00 N ATOM 938 CA PRO A 58 12.582 10.946 -3.380 1.00 0.00 C ATOM 939 C PRO A 58 13.777 9.998 -3.497 1.00 0.00 C ATOM 940 O PRO A 58 13.988 9.148 -2.633 1.00 0.00 O ATOM 941 CB PRO A 58 12.666 11.860 -2.168 1.00 0.00 C ATOM 942 CG PRO A 58 11.720 11.270 -1.135 1.00 0.00 C ATOM 943 CD PRO A 58 10.839 10.250 -1.837 1.00 0.00 C ATOM 0 HA PRO A 58 12.599 11.526 -4.302 1.00 0.00 H new ATOM 0 HB2 PRO A 58 13.685 11.906 -1.783 1.00 0.00 H new ATOM 0 HB3 PRO A 58 12.376 12.879 -2.426 1.00 0.00 H new ATOM 0 HG2 PRO A 58 12.282 10.798 -0.329 1.00 0.00 H new ATOM 0 HG3 PRO A 58 11.111 12.053 -0.684 1.00 0.00 H new ATOM 0 HD2 PRO A 58 10.905 9.273 -1.358 1.00 0.00 H new ATOM 0 HD3 PRO A 58 9.791 10.548 -1.811 1.00 0.00 H new ATOM 951 N GLY A 59 14.529 10.176 -4.574 1.00 0.00 N ATOM 952 CA GLY A 59 15.698 9.347 -4.815 1.00 0.00 C ATOM 953 C GLY A 59 15.290 7.940 -5.257 1.00 0.00 C ATOM 954 O GLY A 59 14.980 7.089 -4.425 1.00 0.00 O ATOM 0 H GLY A 59 14.351 10.882 -5.289 1.00 0.00 H new ATOM 0 HA2 GLY A 59 16.322 9.806 -5.581 1.00 0.00 H new ATOM 0 HA3 GLY A 59 16.299 9.287 -3.908 1.00 0.00 H new ATOM 958 N MET A 60 15.305 7.738 -6.567 1.00 0.00 N ATOM 959 CA MET A 60 14.941 6.449 -7.129 1.00 0.00 C ATOM 960 C MET A 60 13.447 6.173 -6.947 1.00 0.00 C ATOM 961 O MET A 60 13.043 5.545 -5.969 1.00 0.00 O ATOM 962 CB MET A 60 15.751 5.346 -6.446 1.00 0.00 C ATOM 963 CG MET A 60 16.220 4.301 -7.460 1.00 0.00 C ATOM 964 SD MET A 60 16.329 2.699 -6.680 1.00 0.00 S ATOM 965 CE MET A 60 14.594 2.334 -6.478 1.00 0.00 C ATOM 0 H MET A 60 15.564 8.446 -7.255 1.00 0.00 H new ATOM 0 HA MET A 60 15.161 6.465 -8.196 1.00 0.00 H new ATOM 0 HB2 MET A 60 16.614 5.782 -5.943 1.00 0.00 H new ATOM 0 HB3 MET A 60 15.144 4.866 -5.679 1.00 0.00 H new ATOM 0 HG2 MET A 60 15.526 4.259 -8.299 1.00 0.00 H new ATOM 0 HG3 MET A 60 17.192 4.585 -7.864 1.00 0.00 H new ATOM 0 HE1 MET A 60 14.442 1.256 -6.521 1.00 0.00 H new ATOM 0 HE2 MET A 60 14.253 2.710 -5.513 1.00 0.00 H new ATOM 0 HE3 MET A 60 14.026 2.813 -7.276 1.00 0.00 H new ATOM 975 N ASP A 61 12.667 6.656 -7.903 1.00 0.00 N ATOM 976 CA ASP A 61 11.227 6.469 -7.860 1.00 0.00 C ATOM 977 C ASP A 61 10.916 5.007 -7.532 1.00 0.00 C ATOM 978 O ASP A 61 11.817 4.170 -7.498 1.00 0.00 O ATOM 979 CB ASP A 61 10.588 6.797 -9.211 1.00 0.00 C ATOM 980 CG ASP A 61 11.540 6.738 -10.407 1.00 0.00 C ATOM 981 OD1 ASP A 61 12.197 5.686 -10.558 1.00 0.00 O ATOM 982 OD2 ASP A 61 11.588 7.747 -11.144 1.00 0.00 O ATOM 0 H ASP A 61 13.005 7.177 -8.712 1.00 0.00 H new ATOM 0 HA ASP A 61 10.823 7.137 -7.099 1.00 0.00 H new ATOM 0 HB2 ASP A 61 9.766 6.103 -9.385 1.00 0.00 H new ATOM 0 HB3 ASP A 61 10.156 7.796 -9.159 1.00 0.00 H new ATOM 987 N GLY A 62 9.638 4.745 -7.299 1.00 0.00 N ATOM 988 CA GLY A 62 9.198 3.399 -6.975 1.00 0.00 C ATOM 989 C GLY A 62 8.847 2.617 -8.243 1.00 0.00 C ATOM 990 O GLY A 62 8.397 1.475 -8.168 1.00 0.00 O ATOM 0 H GLY A 62 8.894 5.442 -7.328 1.00 0.00 H new ATOM 0 HA2 GLY A 62 9.983 2.878 -6.428 1.00 0.00 H new ATOM 0 HA3 GLY A 62 8.329 3.445 -6.319 1.00 0.00 H new ATOM 994 N ILE A 63 9.067 3.264 -9.379 1.00 0.00 N ATOM 995 CA ILE A 63 8.780 2.644 -10.661 1.00 0.00 C ATOM 996 C ILE A 63 9.470 1.280 -10.728 1.00 0.00 C ATOM 997 O ILE A 63 8.898 0.315 -11.233 1.00 0.00 O ATOM 998 CB ILE A 63 9.160 3.583 -11.807 1.00 0.00 C ATOM 999 CG1 ILE A 63 8.440 4.926 -11.678 1.00 0.00 C ATOM 1000 CG2 ILE A 63 8.904 2.923 -13.164 1.00 0.00 C ATOM 1001 CD1 ILE A 63 9.313 6.069 -12.197 1.00 0.00 C ATOM 0 H ILE A 63 9.441 4.211 -9.438 1.00 0.00 H new ATOM 0 HA ILE A 63 7.710 2.466 -10.768 1.00 0.00 H new ATOM 0 HB ILE A 63 10.229 3.784 -11.743 1.00 0.00 H new ATOM 0 HG12 ILE A 63 7.504 4.896 -12.237 1.00 0.00 H new ATOM 0 HG13 ILE A 63 8.182 5.106 -10.634 1.00 0.00 H new ATOM 0 HG21 ILE A 63 9.182 3.612 -13.962 1.00 0.00 H new ATOM 0 HG22 ILE A 63 9.500 2.014 -13.245 1.00 0.00 H new ATOM 0 HG23 ILE A 63 7.847 2.673 -13.253 1.00 0.00 H new ATOM 0 HD11 ILE A 63 8.777 7.012 -12.093 1.00 0.00 H new ATOM 0 HD12 ILE A 63 10.237 6.112 -11.620 1.00 0.00 H new ATOM 0 HD13 ILE A 63 9.548 5.899 -13.248 1.00 0.00 H new ATOM 1013 N GLU A 64 10.690 1.243 -10.213 1.00 0.00 N ATOM 1014 CA GLU A 64 11.464 0.014 -10.208 1.00 0.00 C ATOM 1015 C GLU A 64 11.132 -0.818 -8.968 1.00 0.00 C ATOM 1016 O GLU A 64 10.882 -2.018 -9.069 1.00 0.00 O ATOM 1017 CB GLU A 64 12.963 0.309 -10.285 1.00 0.00 C ATOM 1018 CG GLU A 64 13.279 1.247 -11.452 1.00 0.00 C ATOM 1019 CD GLU A 64 13.634 0.454 -12.712 1.00 0.00 C ATOM 1020 OE1 GLU A 64 14.785 -0.029 -12.772 1.00 0.00 O ATOM 1021 OE2 GLU A 64 12.746 0.349 -13.585 1.00 0.00 O ATOM 0 H GLU A 64 11.162 2.045 -9.796 1.00 0.00 H new ATOM 0 HA GLU A 64 11.195 -0.564 -11.092 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.297 0.760 -9.351 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.515 -0.623 -10.404 1.00 0.00 H new ATOM 0 HG2 GLU A 64 12.420 1.888 -11.651 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.109 1.901 -11.183 1.00 0.00 H new ATOM 1028 N ILE A 65 11.140 -0.147 -7.825 1.00 0.00 N ATOM 1029 CA ILE A 65 10.843 -0.809 -6.566 1.00 0.00 C ATOM 1030 C ILE A 65 9.591 -1.673 -6.733 1.00 0.00 C ATOM 1031 O ILE A 65 9.651 -2.894 -6.590 1.00 0.00 O ATOM 1032 CB ILE A 65 10.737 0.214 -5.434 1.00 0.00 C ATOM 1033 CG1 ILE A 65 12.106 0.814 -5.108 1.00 0.00 C ATOM 1034 CG2 ILE A 65 10.072 -0.399 -4.201 1.00 0.00 C ATOM 1035 CD1 ILE A 65 11.983 1.927 -4.066 1.00 0.00 C ATOM 0 H ILE A 65 11.348 0.848 -7.745 1.00 0.00 H new ATOM 0 HA ILE A 65 11.658 -1.477 -6.285 1.00 0.00 H new ATOM 0 HB ILE A 65 10.099 1.031 -5.771 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.769 0.034 -4.735 1.00 0.00 H new ATOM 0 HG13 ILE A 65 12.559 1.210 -6.017 1.00 0.00 H new ATOM 0 HG21 ILE A 65 10.009 0.350 -3.411 1.00 0.00 H new ATOM 0 HG22 ILE A 65 9.069 -0.739 -4.460 1.00 0.00 H new ATOM 0 HG23 ILE A 65 10.663 -1.246 -3.852 1.00 0.00 H new ATOM 0 HD11 ILE A 65 12.970 2.336 -3.852 1.00 0.00 H new ATOM 0 HD12 ILE A 65 11.338 2.717 -4.452 1.00 0.00 H new ATOM 0 HD13 ILE A 65 11.552 1.522 -3.150 1.00 0.00 H new ATOM 1047 N LEU A 66 8.486 -1.007 -7.033 1.00 0.00 N ATOM 1048 CA LEU A 66 7.222 -1.698 -7.221 1.00 0.00 C ATOM 1049 C LEU A 66 7.392 -2.782 -8.287 1.00 0.00 C ATOM 1050 O LEU A 66 6.794 -3.853 -8.190 1.00 0.00 O ATOM 1051 CB LEU A 66 6.106 -0.699 -7.531 1.00 0.00 C ATOM 1052 CG LEU A 66 5.691 0.222 -6.382 1.00 0.00 C ATOM 1053 CD1 LEU A 66 5.861 -0.476 -5.031 1.00 0.00 C ATOM 1054 CD2 LEU A 66 6.452 1.548 -6.441 1.00 0.00 C ATOM 0 H LEU A 66 8.440 0.005 -7.151 1.00 0.00 H new ATOM 0 HA LEU A 66 6.922 -2.200 -6.301 1.00 0.00 H new ATOM 0 HB2 LEU A 66 6.423 -0.080 -8.370 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.228 -1.256 -7.859 1.00 0.00 H new ATOM 0 HG LEU A 66 4.632 0.453 -6.494 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.559 0.200 -4.231 1.00 0.00 H new ATOM 0 HD12 LEU A 66 5.240 -1.371 -5.003 1.00 0.00 H new ATOM 0 HD13 LEU A 66 6.906 -0.755 -4.895 1.00 0.00 H new ATOM 0 HD21 LEU A 66 6.139 2.184 -5.613 1.00 0.00 H new ATOM 0 HD22 LEU A 66 7.523 1.357 -6.367 1.00 0.00 H new ATOM 0 HD23 LEU A 66 6.238 2.049 -7.385 1.00 0.00 H new ATOM 1066 N LYS A 67 8.210 -2.466 -9.281 1.00 0.00 N ATOM 1067 CA LYS A 67 8.466 -3.400 -10.364 1.00 0.00 C ATOM 1068 C LYS A 67 9.132 -4.657 -9.802 1.00 0.00 C ATOM 1069 O LYS A 67 8.561 -5.745 -9.860 1.00 0.00 O ATOM 1070 CB LYS A 67 9.270 -2.723 -11.476 1.00 0.00 C ATOM 1071 CG LYS A 67 8.440 -2.598 -12.755 1.00 0.00 C ATOM 1072 CD LYS A 67 9.337 -2.339 -13.968 1.00 0.00 C ATOM 1073 CE LYS A 67 9.595 -3.631 -14.745 1.00 0.00 C ATOM 1074 NZ LYS A 67 9.658 -3.358 -16.198 1.00 0.00 N ATOM 0 H LYS A 67 8.704 -1.577 -9.359 1.00 0.00 H new ATOM 0 HA LYS A 67 7.530 -3.714 -10.825 1.00 0.00 H new ATOM 0 HB2 LYS A 67 9.590 -1.734 -11.148 1.00 0.00 H new ATOM 0 HB3 LYS A 67 10.173 -3.299 -11.679 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.866 -3.511 -12.911 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.722 -1.785 -12.649 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.867 -1.605 -14.622 1.00 0.00 H new ATOM 0 HD3 LYS A 67 10.285 -1.913 -13.639 1.00 0.00 H new ATOM 0 HE2 LYS A 67 10.530 -4.082 -14.413 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.803 -4.351 -14.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.834 -4.246 -16.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 8.756 -2.949 -16.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 10.429 -2.688 -16.392 1.00 0.00 H new ATOM 1088 N ARG A 68 10.330 -4.466 -9.271 1.00 0.00 N ATOM 1089 CA ARG A 68 11.080 -5.571 -8.699 1.00 0.00 C ATOM 1090 C ARG A 68 10.227 -6.315 -7.669 1.00 0.00 C ATOM 1091 O ARG A 68 10.327 -7.533 -7.538 1.00 0.00 O ATOM 1092 CB ARG A 68 12.363 -5.078 -8.027 1.00 0.00 C ATOM 1093 CG ARG A 68 13.558 -5.191 -8.977 1.00 0.00 C ATOM 1094 CD ARG A 68 14.798 -4.522 -8.380 1.00 0.00 C ATOM 1095 NE ARG A 68 15.513 -5.474 -7.501 1.00 0.00 N ATOM 1096 CZ ARG A 68 16.668 -5.200 -6.880 1.00 0.00 C ATOM 1097 NH1 ARG A 68 17.246 -4.001 -7.038 1.00 0.00 N ATOM 1098 NH2 ARG A 68 17.246 -6.125 -6.102 1.00 0.00 N ATOM 0 H ARG A 68 10.800 -3.562 -9.225 1.00 0.00 H new ATOM 0 HA ARG A 68 11.346 -6.246 -9.512 1.00 0.00 H new ATOM 0 HB2 ARG A 68 12.239 -4.041 -7.715 1.00 0.00 H new ATOM 0 HB3 ARG A 68 12.553 -5.662 -7.126 1.00 0.00 H new ATOM 0 HG2 ARG A 68 13.769 -6.241 -9.179 1.00 0.00 H new ATOM 0 HG3 ARG A 68 13.313 -4.726 -9.932 1.00 0.00 H new ATOM 0 HD2 ARG A 68 15.459 -4.184 -9.178 1.00 0.00 H new ATOM 0 HD3 ARG A 68 14.507 -3.638 -7.812 1.00 0.00 H new ATOM 0 HE ARG A 68 15.101 -6.396 -7.359 1.00 0.00 H new ATOM 0 HH11 ARG A 68 16.806 -3.297 -7.631 1.00 0.00 H new ATOM 0 HH12 ARG A 68 18.125 -3.792 -6.565 1.00 0.00 H new ATOM 0 HH21 ARG A 68 16.807 -7.038 -5.983 1.00 0.00 H new ATOM 0 HH22 ARG A 68 18.125 -5.916 -5.629 1.00 0.00 H new ATOM 1112 N MET A 69 9.407 -5.549 -6.964 1.00 0.00 N ATOM 1113 CA MET A 69 8.537 -6.120 -5.950 1.00 0.00 C ATOM 1114 C MET A 69 7.687 -7.252 -6.530 1.00 0.00 C ATOM 1115 O MET A 69 7.747 -8.385 -6.055 1.00 0.00 O ATOM 1116 CB MET A 69 7.622 -5.029 -5.390 1.00 0.00 C ATOM 1117 CG MET A 69 7.804 -4.883 -3.877 1.00 0.00 C ATOM 1118 SD MET A 69 8.627 -3.343 -3.508 1.00 0.00 S ATOM 1119 CE MET A 69 7.466 -2.642 -2.347 1.00 0.00 C ATOM 0 H MET A 69 9.327 -4.538 -7.075 1.00 0.00 H new ATOM 0 HA MET A 69 9.158 -6.530 -5.154 1.00 0.00 H new ATOM 0 HB2 MET A 69 7.840 -4.080 -5.879 1.00 0.00 H new ATOM 0 HB3 MET A 69 6.583 -5.271 -5.613 1.00 0.00 H new ATOM 0 HG2 MET A 69 6.834 -4.915 -3.381 1.00 0.00 H new ATOM 0 HG3 MET A 69 8.387 -5.719 -3.490 1.00 0.00 H new ATOM 0 HE1 MET A 69 7.854 -1.695 -1.972 1.00 0.00 H new ATOM 0 HE2 MET A 69 6.511 -2.472 -2.845 1.00 0.00 H new ATOM 0 HE3 MET A 69 7.323 -3.331 -1.514 1.00 0.00 H new ATOM 1129 N LYS A 70 6.914 -6.905 -7.549 1.00 0.00 N ATOM 1130 CA LYS A 70 6.053 -7.878 -8.200 1.00 0.00 C ATOM 1131 C LYS A 70 6.915 -8.892 -8.955 1.00 0.00 C ATOM 1132 O LYS A 70 6.641 -10.091 -8.923 1.00 0.00 O ATOM 1133 CB LYS A 70 5.018 -7.174 -9.080 1.00 0.00 C ATOM 1134 CG LYS A 70 5.579 -6.907 -10.478 1.00 0.00 C ATOM 1135 CD LYS A 70 5.633 -8.195 -11.302 1.00 0.00 C ATOM 1136 CE LYS A 70 4.903 -8.023 -12.636 1.00 0.00 C ATOM 1137 NZ LYS A 70 5.348 -9.049 -13.606 1.00 0.00 N ATOM 0 H LYS A 70 6.866 -5.964 -7.940 1.00 0.00 H new ATOM 0 HA LYS A 70 5.480 -8.436 -7.459 1.00 0.00 H new ATOM 0 HB2 LYS A 70 4.121 -7.789 -9.155 1.00 0.00 H new ATOM 0 HB3 LYS A 70 4.722 -6.233 -8.617 1.00 0.00 H new ATOM 0 HG2 LYS A 70 4.958 -6.170 -10.988 1.00 0.00 H new ATOM 0 HG3 LYS A 70 6.579 -6.480 -10.397 1.00 0.00 H new ATOM 0 HD2 LYS A 70 6.672 -8.471 -11.485 1.00 0.00 H new ATOM 0 HD3 LYS A 70 5.181 -9.011 -10.738 1.00 0.00 H new ATOM 0 HE2 LYS A 70 3.827 -8.103 -12.481 1.00 0.00 H new ATOM 0 HE3 LYS A 70 5.095 -7.028 -13.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 4.843 -8.918 -14.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 6.371 -8.955 -13.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 5.143 -9.996 -13.228 1.00 0.00 H new ATOM 1151 N VAL A 71 7.939 -8.373 -9.616 1.00 0.00 N ATOM 1152 CA VAL A 71 8.843 -9.218 -10.378 1.00 0.00 C ATOM 1153 C VAL A 71 9.484 -10.245 -9.443 1.00 0.00 C ATOM 1154 O VAL A 71 9.792 -11.361 -9.858 1.00 0.00 O ATOM 1155 CB VAL A 71 9.870 -8.355 -11.114 1.00 0.00 C ATOM 1156 CG1 VAL A 71 10.729 -9.206 -12.052 1.00 0.00 C ATOM 1157 CG2 VAL A 71 9.186 -7.219 -11.877 1.00 0.00 C ATOM 0 H VAL A 71 8.163 -7.378 -9.640 1.00 0.00 H new ATOM 0 HA VAL A 71 8.297 -9.771 -11.142 1.00 0.00 H new ATOM 0 HB VAL A 71 10.528 -7.909 -10.369 1.00 0.00 H new ATOM 0 HG11 VAL A 71 11.451 -8.569 -12.563 1.00 0.00 H new ATOM 0 HG12 VAL A 71 11.259 -9.963 -11.474 1.00 0.00 H new ATOM 0 HG13 VAL A 71 10.090 -9.693 -12.788 1.00 0.00 H new ATOM 0 HG21 VAL A 71 9.939 -6.621 -12.391 1.00 0.00 H new ATOM 0 HG22 VAL A 71 8.493 -7.637 -12.608 1.00 0.00 H new ATOM 0 HG23 VAL A 71 8.638 -6.589 -11.177 1.00 0.00 H new ATOM 1167 N ILE A 72 9.667 -9.831 -8.198 1.00 0.00 N ATOM 1168 CA ILE A 72 10.266 -10.701 -7.200 1.00 0.00 C ATOM 1169 C ILE A 72 9.219 -11.701 -6.706 1.00 0.00 C ATOM 1170 O ILE A 72 9.466 -12.906 -6.688 1.00 0.00 O ATOM 1171 CB ILE A 72 10.903 -9.874 -6.081 1.00 0.00 C ATOM 1172 CG1 ILE A 72 12.284 -9.362 -6.496 1.00 0.00 C ATOM 1173 CG2 ILE A 72 10.955 -10.668 -4.775 1.00 0.00 C ATOM 1174 CD1 ILE A 72 13.345 -10.452 -6.331 1.00 0.00 C ATOM 0 H ILE A 72 9.411 -8.904 -7.857 1.00 0.00 H new ATOM 0 HA ILE A 72 11.078 -11.281 -7.639 1.00 0.00 H new ATOM 0 HB ILE A 72 10.276 -9.000 -5.902 1.00 0.00 H new ATOM 0 HG12 ILE A 72 12.256 -9.031 -7.534 1.00 0.00 H new ATOM 0 HG13 ILE A 72 12.551 -8.495 -5.892 1.00 0.00 H new ATOM 0 HG21 ILE A 72 11.412 -10.058 -3.996 1.00 0.00 H new ATOM 0 HG22 ILE A 72 9.943 -10.941 -4.475 1.00 0.00 H new ATOM 0 HG23 ILE A 72 11.547 -11.572 -4.922 1.00 0.00 H new ATOM 0 HD11 ILE A 72 14.317 -10.062 -6.633 1.00 0.00 H new ATOM 0 HD12 ILE A 72 13.387 -10.764 -5.287 1.00 0.00 H new ATOM 0 HD13 ILE A 72 13.088 -11.308 -6.955 1.00 0.00 H new ATOM 1186 N ASP A 73 8.071 -11.164 -6.319 1.00 0.00 N ATOM 1187 CA ASP A 73 6.985 -11.994 -5.826 1.00 0.00 C ATOM 1188 C ASP A 73 5.681 -11.577 -6.508 1.00 0.00 C ATOM 1189 O ASP A 73 5.236 -10.440 -6.362 1.00 0.00 O ATOM 1190 CB ASP A 73 6.805 -11.826 -4.316 1.00 0.00 C ATOM 1191 CG ASP A 73 7.728 -10.794 -3.665 1.00 0.00 C ATOM 1192 OD1 ASP A 73 7.579 -9.602 -4.011 1.00 0.00 O ATOM 1193 OD2 ASP A 73 8.561 -11.220 -2.837 1.00 0.00 O ATOM 0 H ASP A 73 7.869 -10.164 -6.337 1.00 0.00 H new ATOM 0 HA ASP A 73 7.228 -13.034 -6.046 1.00 0.00 H new ATOM 0 HB2 ASP A 73 5.771 -11.543 -4.118 1.00 0.00 H new ATOM 0 HB3 ASP A 73 6.968 -12.791 -3.836 1.00 0.00 H new ATOM 1198 N GLU A 74 5.104 -12.521 -7.238 1.00 0.00 N ATOM 1199 CA GLU A 74 3.859 -12.265 -7.942 1.00 0.00 C ATOM 1200 C GLU A 74 2.670 -12.424 -6.993 1.00 0.00 C ATOM 1201 O GLU A 74 1.521 -12.248 -7.397 1.00 0.00 O ATOM 1202 CB GLU A 74 3.718 -13.186 -9.157 1.00 0.00 C ATOM 1203 CG GLU A 74 3.172 -14.555 -8.746 1.00 0.00 C ATOM 1204 CD GLU A 74 3.125 -15.507 -9.943 1.00 0.00 C ATOM 1205 OE1 GLU A 74 4.195 -16.065 -10.267 1.00 0.00 O ATOM 1206 OE2 GLU A 74 2.019 -15.655 -10.507 1.00 0.00 O ATOM 0 H GLU A 74 5.476 -13.463 -7.357 1.00 0.00 H new ATOM 0 HA GLU A 74 3.874 -11.237 -8.305 1.00 0.00 H new ATOM 0 HB2 GLU A 74 3.052 -12.729 -9.889 1.00 0.00 H new ATOM 0 HB3 GLU A 74 4.687 -13.307 -9.641 1.00 0.00 H new ATOM 0 HG2 GLU A 74 3.799 -14.981 -7.962 1.00 0.00 H new ATOM 0 HG3 GLU A 74 2.172 -14.441 -8.327 1.00 0.00 H new ATOM 1213 N ASN A 75 2.986 -12.754 -5.749 1.00 0.00 N ATOM 1214 CA ASN A 75 1.957 -12.938 -4.740 1.00 0.00 C ATOM 1215 C ASN A 75 1.907 -11.703 -3.838 1.00 0.00 C ATOM 1216 O ASN A 75 1.016 -11.578 -2.999 1.00 0.00 O ATOM 1217 CB ASN A 75 2.260 -14.153 -3.860 1.00 0.00 C ATOM 1218 CG ASN A 75 0.969 -14.850 -3.425 1.00 0.00 C ATOM 1219 OD1 ASN A 75 -0.004 -14.925 -4.157 1.00 0.00 O ATOM 1220 ND2 ASN A 75 1.015 -15.354 -2.195 1.00 0.00 N ATOM 0 H ASN A 75 3.940 -12.899 -5.417 1.00 0.00 H new ATOM 0 HA ASN A 75 1.007 -13.090 -5.251 1.00 0.00 H new ATOM 0 HB2 ASN A 75 2.890 -14.855 -4.407 1.00 0.00 H new ATOM 0 HB3 ASN A 75 2.822 -13.839 -2.981 1.00 0.00 H new ATOM 0 HD21 ASN A 75 0.203 -15.839 -1.812 1.00 0.00 H new ATOM 0 HD22 ASN A 75 1.862 -15.256 -1.635 1.00 0.00 H new ATOM 1227 N ILE A 76 2.875 -10.821 -4.041 1.00 0.00 N ATOM 1228 CA ILE A 76 2.952 -9.601 -3.257 1.00 0.00 C ATOM 1229 C ILE A 76 1.706 -8.752 -3.518 1.00 0.00 C ATOM 1230 O ILE A 76 1.259 -8.635 -4.658 1.00 0.00 O ATOM 1231 CB ILE A 76 4.266 -8.867 -3.537 1.00 0.00 C ATOM 1232 CG1 ILE A 76 4.595 -7.884 -2.411 1.00 0.00 C ATOM 1233 CG2 ILE A 76 4.231 -8.181 -4.904 1.00 0.00 C ATOM 1234 CD1 ILE A 76 5.739 -6.952 -2.814 1.00 0.00 C ATOM 0 H ILE A 76 3.613 -10.928 -4.737 1.00 0.00 H new ATOM 0 HA ILE A 76 2.963 -9.833 -2.192 1.00 0.00 H new ATOM 0 HB ILE A 76 5.069 -9.604 -3.567 1.00 0.00 H new ATOM 0 HG12 ILE A 76 3.710 -7.296 -2.167 1.00 0.00 H new ATOM 0 HG13 ILE A 76 4.870 -8.435 -1.511 1.00 0.00 H new ATOM 0 HG21 ILE A 76 5.176 -7.667 -5.078 1.00 0.00 H new ATOM 0 HG22 ILE A 76 4.076 -8.928 -5.682 1.00 0.00 H new ATOM 0 HG23 ILE A 76 3.416 -7.458 -4.928 1.00 0.00 H new ATOM 0 HD11 ILE A 76 5.953 -6.264 -1.996 1.00 0.00 H new ATOM 0 HD12 ILE A 76 6.629 -7.542 -3.034 1.00 0.00 H new ATOM 0 HD13 ILE A 76 5.452 -6.385 -3.700 1.00 0.00 H new ATOM 1246 N ARG A 77 1.182 -8.182 -2.444 1.00 0.00 N ATOM 1247 CA ARG A 77 -0.004 -7.348 -2.542 1.00 0.00 C ATOM 1248 C ARG A 77 0.291 -5.943 -2.015 1.00 0.00 C ATOM 1249 O ARG A 77 0.476 -5.752 -0.814 1.00 0.00 O ATOM 1250 CB ARG A 77 -1.167 -7.949 -1.750 1.00 0.00 C ATOM 1251 CG ARG A 77 -2.165 -6.866 -1.335 1.00 0.00 C ATOM 1252 CD ARG A 77 -3.559 -7.458 -1.119 1.00 0.00 C ATOM 1253 NE ARG A 77 -3.562 -8.320 0.084 1.00 0.00 N ATOM 1254 CZ ARG A 77 -3.412 -9.651 0.056 1.00 0.00 C ATOM 1255 NH1 ARG A 77 -3.246 -10.281 -1.115 1.00 0.00 N ATOM 1256 NH2 ARG A 77 -3.427 -10.352 1.198 1.00 0.00 N ATOM 0 H ARG A 77 1.557 -8.281 -1.501 1.00 0.00 H new ATOM 0 HA ARG A 77 -0.286 -7.294 -3.594 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -1.673 -8.702 -2.354 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -0.785 -8.455 -0.864 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -1.824 -6.385 -0.418 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -2.209 -6.094 -2.103 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -4.289 -6.657 -1.004 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -3.856 -8.038 -1.993 1.00 0.00 H new ATOM 0 HE ARG A 77 -3.686 -7.872 0.992 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -3.234 -9.747 -1.984 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -3.132 -11.294 -1.137 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -3.553 -9.872 2.089 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -3.313 -11.365 1.176 1.00 0.00 H new ATOM 1270 N VAL A 78 0.325 -4.994 -2.939 1.00 0.00 N ATOM 1271 CA VAL A 78 0.594 -3.611 -2.583 1.00 0.00 C ATOM 1272 C VAL A 78 -0.249 -2.688 -3.465 1.00 0.00 C ATOM 1273 O VAL A 78 -0.613 -3.053 -4.582 1.00 0.00 O ATOM 1274 CB VAL A 78 2.094 -3.328 -2.683 1.00 0.00 C ATOM 1275 CG1 VAL A 78 2.456 -2.768 -4.060 1.00 0.00 C ATOM 1276 CG2 VAL A 78 2.549 -2.381 -1.570 1.00 0.00 C ATOM 0 H VAL A 78 0.171 -5.156 -3.934 1.00 0.00 H new ATOM 0 HA VAL A 78 0.309 -3.420 -1.548 1.00 0.00 H new ATOM 0 HB VAL A 78 2.622 -4.273 -2.556 1.00 0.00 H new ATOM 0 HG11 VAL A 78 3.528 -2.576 -4.104 1.00 0.00 H new ATOM 0 HG12 VAL A 78 2.185 -3.491 -4.829 1.00 0.00 H new ATOM 0 HG13 VAL A 78 1.913 -1.838 -4.229 1.00 0.00 H new ATOM 0 HG21 VAL A 78 3.619 -2.196 -1.664 1.00 0.00 H new ATOM 0 HG22 VAL A 78 2.009 -1.437 -1.652 1.00 0.00 H new ATOM 0 HG23 VAL A 78 2.343 -2.834 -0.600 1.00 0.00 H new ATOM 1286 N ILE A 79 -0.534 -1.510 -2.931 1.00 0.00 N ATOM 1287 CA ILE A 79 -1.328 -0.532 -3.655 1.00 0.00 C ATOM 1288 C ILE A 79 -0.446 0.665 -4.019 1.00 0.00 C ATOM 1289 O ILE A 79 0.413 1.067 -3.237 1.00 0.00 O ATOM 1290 CB ILE A 79 -2.576 -0.156 -2.855 1.00 0.00 C ATOM 1291 CG1 ILE A 79 -3.717 -1.139 -3.125 1.00 0.00 C ATOM 1292 CG2 ILE A 79 -2.989 1.291 -3.132 1.00 0.00 C ATOM 1293 CD1 ILE A 79 -3.949 -1.311 -4.628 1.00 0.00 C ATOM 0 H ILE A 79 -0.229 -1.210 -2.005 1.00 0.00 H new ATOM 0 HA ILE A 79 -1.694 -0.955 -4.590 1.00 0.00 H new ATOM 0 HB ILE A 79 -2.336 -0.225 -1.794 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -3.483 -2.105 -2.677 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -4.631 -0.780 -2.651 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.879 1.533 -2.551 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -2.177 1.961 -2.849 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -3.205 1.411 -4.194 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -4.765 -2.015 -4.792 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -4.206 -0.348 -5.069 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -3.041 -1.693 -5.095 1.00 0.00 H new ATOM 1305 N ILE A 80 -0.691 1.200 -5.206 1.00 0.00 N ATOM 1306 CA ILE A 80 0.070 2.343 -5.683 1.00 0.00 C ATOM 1307 C ILE A 80 -0.833 3.578 -5.704 1.00 0.00 C ATOM 1308 O ILE A 80 -2.045 3.462 -5.881 1.00 0.00 O ATOM 1309 CB ILE A 80 0.717 2.030 -7.033 1.00 0.00 C ATOM 1310 CG1 ILE A 80 -0.314 2.090 -8.162 1.00 0.00 C ATOM 1311 CG2 ILE A 80 1.446 0.685 -6.994 1.00 0.00 C ATOM 1312 CD1 ILE A 80 -0.714 3.536 -8.463 1.00 0.00 C ATOM 0 H ILE A 80 -1.405 0.864 -5.852 1.00 0.00 H new ATOM 0 HA ILE A 80 0.894 2.562 -5.005 1.00 0.00 H new ATOM 0 HB ILE A 80 1.465 2.796 -7.238 1.00 0.00 H new ATOM 0 HG12 ILE A 80 0.097 1.628 -9.060 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.197 1.515 -7.884 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.897 0.487 -7.966 1.00 0.00 H new ATOM 0 HG22 ILE A 80 2.225 0.715 -6.232 1.00 0.00 H new ATOM 0 HG23 ILE A 80 0.736 -0.107 -6.755 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -1.448 3.550 -9.269 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -1.147 3.987 -7.570 1.00 0.00 H new ATOM 0 HD13 ILE A 80 0.167 4.102 -8.764 1.00 0.00 H new ATOM 1324 N MET A 81 -0.208 4.732 -5.523 1.00 0.00 N ATOM 1325 CA MET A 81 -0.940 5.987 -5.519 1.00 0.00 C ATOM 1326 C MET A 81 -0.140 7.090 -6.215 1.00 0.00 C ATOM 1327 O MET A 81 1.005 7.355 -5.851 1.00 0.00 O ATOM 1328 CB MET A 81 -1.235 6.402 -4.077 1.00 0.00 C ATOM 1329 CG MET A 81 -0.636 5.403 -3.085 1.00 0.00 C ATOM 1330 SD MET A 81 -0.617 6.107 -1.445 1.00 0.00 S ATOM 1331 CE MET A 81 0.842 5.317 -0.785 1.00 0.00 C ATOM 0 H MET A 81 0.797 4.824 -5.378 1.00 0.00 H new ATOM 0 HA MET A 81 -1.874 5.843 -6.063 1.00 0.00 H new ATOM 0 HB2 MET A 81 -0.826 7.395 -3.890 1.00 0.00 H new ATOM 0 HB3 MET A 81 -2.313 6.467 -3.927 1.00 0.00 H new ATOM 0 HG2 MET A 81 -1.219 4.482 -3.087 1.00 0.00 H new ATOM 0 HG3 MET A 81 0.377 5.140 -3.388 1.00 0.00 H new ATOM 0 HE1 MET A 81 0.867 5.445 0.297 1.00 0.00 H new ATOM 0 HE2 MET A 81 0.820 4.254 -1.025 1.00 0.00 H new ATOM 0 HE3 MET A 81 1.731 5.770 -1.224 1.00 0.00 H new ATOM 1341 N THR A 82 -0.774 7.703 -7.204 1.00 0.00 N ATOM 1342 CA THR A 82 -0.136 8.771 -7.954 1.00 0.00 C ATOM 1343 C THR A 82 -1.147 9.450 -8.881 1.00 0.00 C ATOM 1344 O THR A 82 -2.118 8.828 -9.307 1.00 0.00 O ATOM 1345 CB THR A 82 1.064 8.177 -8.695 1.00 0.00 C ATOM 1346 OG1 THR A 82 1.192 8.991 -9.858 1.00 0.00 O ATOM 1347 CG2 THR A 82 0.778 6.779 -9.247 1.00 0.00 C ATOM 0 H THR A 82 -1.723 7.480 -7.503 1.00 0.00 H new ATOM 0 HA THR A 82 0.229 9.556 -7.292 1.00 0.00 H new ATOM 0 HB THR A 82 1.920 8.133 -8.022 1.00 0.00 H new ATOM 0 HG1 THR A 82 2.129 9.006 -10.145 1.00 0.00 H new ATOM 0 HG21 THR A 82 1.662 6.404 -9.763 1.00 0.00 H new ATOM 0 HG22 THR A 82 0.525 6.108 -8.426 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.057 6.828 -9.946 1.00 0.00 H new ATOM 1355 N ALA A 83 -0.883 10.717 -9.164 1.00 0.00 N ATOM 1356 CA ALA A 83 -1.757 11.487 -10.033 1.00 0.00 C ATOM 1357 C ALA A 83 -1.917 10.755 -11.367 1.00 0.00 C ATOM 1358 O ALA A 83 -1.072 9.942 -11.738 1.00 0.00 O ATOM 1359 CB ALA A 83 -1.192 12.898 -10.205 1.00 0.00 C ATOM 0 H ALA A 83 -0.077 11.230 -8.807 1.00 0.00 H new ATOM 0 HA ALA A 83 -2.748 11.585 -9.591 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -1.848 13.475 -10.857 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.127 13.385 -9.232 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.198 12.840 -10.649 1.00 0.00 H new ATOM 1365 N TYR A 84 -3.007 11.071 -12.051 1.00 0.00 N ATOM 1366 CA TYR A 84 -3.288 10.454 -13.336 1.00 0.00 C ATOM 1367 C TYR A 84 -2.554 11.180 -14.466 1.00 0.00 C ATOM 1368 O TYR A 84 -3.068 11.285 -15.578 1.00 0.00 O ATOM 1369 CB TYR A 84 -4.796 10.596 -13.551 1.00 0.00 C ATOM 1370 CG TYR A 84 -5.314 12.028 -13.404 1.00 0.00 C ATOM 1371 CD1 TYR A 84 -5.266 12.893 -14.478 1.00 0.00 C ATOM 1372 CD2 TYR A 84 -5.829 12.455 -12.197 1.00 0.00 C ATOM 1373 CE1 TYR A 84 -5.753 14.241 -14.340 1.00 0.00 C ATOM 1374 CE2 TYR A 84 -6.317 13.803 -12.058 1.00 0.00 C ATOM 1375 CZ TYR A 84 -6.254 14.629 -13.137 1.00 0.00 C ATOM 1376 OH TYR A 84 -6.714 15.902 -13.006 1.00 0.00 O ATOM 0 H TYR A 84 -3.706 11.746 -11.740 1.00 0.00 H new ATOM 0 HA TYR A 84 -2.960 9.414 -13.342 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -5.047 10.231 -14.547 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -5.316 9.957 -12.837 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -4.863 12.559 -15.423 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -5.866 11.778 -11.356 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -5.721 14.928 -15.173 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -6.723 14.150 -11.119 1.00 0.00 H new ATOM 0 HH TYR A 84 -7.043 16.038 -12.093 1.00 0.00 H new ATOM 1386 N GLY A 85 -1.363 11.661 -14.140 1.00 0.00 N ATOM 1387 CA GLY A 85 -0.553 12.374 -15.114 1.00 0.00 C ATOM 1388 C GLY A 85 0.474 11.442 -15.760 1.00 0.00 C ATOM 1389 O GLY A 85 0.710 11.513 -16.965 1.00 0.00 O ATOM 0 H GLY A 85 -0.940 11.571 -13.216 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -1.196 12.802 -15.883 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -0.041 13.205 -14.628 1.00 0.00 H new ATOM 1393 N GLU A 86 1.057 10.590 -14.930 1.00 0.00 N ATOM 1394 CA GLU A 86 2.053 9.645 -15.405 1.00 0.00 C ATOM 1395 C GLU A 86 1.437 8.252 -15.550 1.00 0.00 C ATOM 1396 O GLU A 86 2.010 7.266 -15.090 1.00 0.00 O ATOM 1397 CB GLU A 86 3.267 9.614 -14.475 1.00 0.00 C ATOM 1398 CG GLU A 86 2.839 9.401 -13.022 1.00 0.00 C ATOM 1399 CD GLU A 86 4.025 8.965 -12.159 1.00 0.00 C ATOM 1400 OE1 GLU A 86 4.979 8.410 -12.745 1.00 0.00 O ATOM 1401 OE2 GLU A 86 3.950 9.196 -10.933 1.00 0.00 O ATOM 0 H GLU A 86 0.859 10.534 -13.931 1.00 0.00 H new ATOM 0 HA GLU A 86 2.397 9.972 -16.386 1.00 0.00 H new ATOM 0 HB2 GLU A 86 3.943 8.815 -14.780 1.00 0.00 H new ATOM 0 HB3 GLU A 86 3.820 10.549 -14.562 1.00 0.00 H new ATOM 0 HG2 GLU A 86 2.416 10.324 -12.625 1.00 0.00 H new ATOM 0 HG3 GLU A 86 2.055 8.645 -12.977 1.00 0.00 H new ATOM 1408 N LEU A 87 0.278 8.216 -16.191 1.00 0.00 N ATOM 1409 CA LEU A 87 -0.422 6.961 -16.402 1.00 0.00 C ATOM 1410 C LEU A 87 0.572 5.903 -16.888 1.00 0.00 C ATOM 1411 O LEU A 87 0.481 4.738 -16.504 1.00 0.00 O ATOM 1412 CB LEU A 87 -1.614 7.162 -17.340 1.00 0.00 C ATOM 1413 CG LEU A 87 -2.673 8.163 -16.873 1.00 0.00 C ATOM 1414 CD1 LEU A 87 -3.277 8.915 -18.061 1.00 0.00 C ATOM 1415 CD2 LEU A 87 -3.744 7.473 -16.026 1.00 0.00 C ATOM 0 H LEU A 87 -0.194 9.037 -16.571 1.00 0.00 H new ATOM 0 HA LEU A 87 -0.843 6.598 -15.464 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.237 7.488 -18.310 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.097 6.197 -17.493 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.188 8.903 -16.237 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.027 9.620 -17.702 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.491 9.457 -18.586 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -3.744 8.204 -18.742 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.484 8.207 -15.707 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.232 6.698 -16.617 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.280 7.022 -15.149 1.00 0.00 H new ATOM 1427 N ASP A 88 1.497 6.348 -17.726 1.00 0.00 N ATOM 1428 CA ASP A 88 2.506 5.454 -18.269 1.00 0.00 C ATOM 1429 C ASP A 88 3.079 4.594 -17.141 1.00 0.00 C ATOM 1430 O ASP A 88 3.568 3.492 -17.383 1.00 0.00 O ATOM 1431 CB ASP A 88 3.658 6.242 -18.895 1.00 0.00 C ATOM 1432 CG ASP A 88 3.903 5.959 -20.379 1.00 0.00 C ATOM 1433 OD1 ASP A 88 3.144 6.522 -21.197 1.00 0.00 O ATOM 1434 OD2 ASP A 88 4.844 5.186 -20.662 1.00 0.00 O ATOM 0 H ASP A 88 1.569 7.315 -18.042 1.00 0.00 H new ATOM 0 HA ASP A 88 2.034 4.836 -19.033 1.00 0.00 H new ATOM 0 HB2 ASP A 88 3.460 7.307 -18.771 1.00 0.00 H new ATOM 0 HB3 ASP A 88 4.572 6.022 -18.343 1.00 0.00 H new ATOM 1439 N MET A 89 3.000 5.131 -15.932 1.00 0.00 N ATOM 1440 CA MET A 89 3.505 4.426 -14.766 1.00 0.00 C ATOM 1441 C MET A 89 2.410 3.569 -14.127 1.00 0.00 C ATOM 1442 O MET A 89 2.593 2.369 -13.927 1.00 0.00 O ATOM 1443 CB MET A 89 4.024 5.438 -13.743 1.00 0.00 C ATOM 1444 CG MET A 89 5.030 4.788 -12.791 1.00 0.00 C ATOM 1445 SD MET A 89 4.172 3.794 -11.582 1.00 0.00 S ATOM 1446 CE MET A 89 5.511 3.460 -10.449 1.00 0.00 C ATOM 0 H MET A 89 2.594 6.046 -15.735 1.00 0.00 H new ATOM 0 HA MET A 89 4.315 3.769 -15.084 1.00 0.00 H new ATOM 0 HB2 MET A 89 4.495 6.274 -14.260 1.00 0.00 H new ATOM 0 HB3 MET A 89 3.189 5.845 -13.173 1.00 0.00 H new ATOM 0 HG2 MET A 89 5.728 4.168 -13.354 1.00 0.00 H new ATOM 0 HG3 MET A 89 5.619 5.557 -12.290 1.00 0.00 H new ATOM 0 HE1 MET A 89 5.108 3.066 -9.516 1.00 0.00 H new ATOM 0 HE2 MET A 89 6.187 2.727 -10.890 1.00 0.00 H new ATOM 0 HE3 MET A 89 6.056 4.382 -10.248 1.00 0.00 H new ATOM 1456 N ILE A 90 1.297 4.219 -13.823 1.00 0.00 N ATOM 1457 CA ILE A 90 0.172 3.532 -13.210 1.00 0.00 C ATOM 1458 C ILE A 90 -0.164 2.284 -14.029 1.00 0.00 C ATOM 1459 O ILE A 90 -0.503 1.242 -13.468 1.00 0.00 O ATOM 1460 CB ILE A 90 -1.009 4.488 -13.033 1.00 0.00 C ATOM 1461 CG1 ILE A 90 -0.638 5.653 -12.112 1.00 0.00 C ATOM 1462 CG2 ILE A 90 -2.250 3.741 -12.542 1.00 0.00 C ATOM 1463 CD1 ILE A 90 -0.799 6.993 -12.832 1.00 0.00 C ATOM 0 H ILE A 90 1.149 5.214 -13.990 1.00 0.00 H new ATOM 0 HA ILE A 90 0.432 3.196 -12.206 1.00 0.00 H new ATOM 0 HB ILE A 90 -1.254 4.913 -14.006 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.270 5.635 -11.224 1.00 0.00 H new ATOM 0 HG13 ILE A 90 0.392 5.540 -11.773 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -3.075 4.444 -12.424 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -2.525 2.976 -13.268 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.035 3.270 -11.583 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -0.529 7.804 -12.156 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -0.148 7.017 -13.706 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -1.835 7.114 -13.148 1.00 0.00 H new ATOM 1475 N GLN A 91 -0.058 2.429 -15.341 1.00 0.00 N ATOM 1476 CA GLN A 91 -0.347 1.327 -16.242 1.00 0.00 C ATOM 1477 C GLN A 91 0.446 0.084 -15.832 1.00 0.00 C ATOM 1478 O GLN A 91 -0.131 -0.903 -15.379 1.00 0.00 O ATOM 1479 CB GLN A 91 -0.052 1.712 -17.693 1.00 0.00 C ATOM 1480 CG GLN A 91 1.279 2.459 -17.801 1.00 0.00 C ATOM 1481 CD GLN A 91 2.296 1.653 -18.611 1.00 0.00 C ATOM 1482 OE1 GLN A 91 2.636 0.528 -18.285 1.00 0.00 O ATOM 1483 NE2 GLN A 91 2.761 2.290 -19.683 1.00 0.00 N ATOM 0 H GLN A 91 0.224 3.294 -15.802 1.00 0.00 H new ATOM 0 HA GLN A 91 -1.410 1.096 -16.172 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -0.021 0.815 -18.312 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -0.857 2.338 -18.078 1.00 0.00 H new ATOM 0 HG2 GLN A 91 1.119 3.428 -18.273 1.00 0.00 H new ATOM 0 HG3 GLN A 91 1.674 2.652 -16.804 1.00 0.00 H new ATOM 0 HE21 GLN A 91 2.434 3.232 -19.898 1.00 0.00 H new ATOM 0 HE22 GLN A 91 3.445 1.836 -20.289 1.00 0.00 H new ATOM 1492 N GLU A 92 1.756 0.174 -16.007 1.00 0.00 N ATOM 1493 CA GLU A 92 2.635 -0.930 -15.661 1.00 0.00 C ATOM 1494 C GLU A 92 2.317 -1.441 -14.254 1.00 0.00 C ATOM 1495 O GLU A 92 2.391 -2.641 -13.993 1.00 0.00 O ATOM 1496 CB GLU A 92 4.104 -0.519 -15.776 1.00 0.00 C ATOM 1497 CG GLU A 92 4.806 -1.300 -16.888 1.00 0.00 C ATOM 1498 CD GLU A 92 6.305 -1.429 -16.606 1.00 0.00 C ATOM 1499 OE1 GLU A 92 6.638 -1.743 -15.443 1.00 0.00 O ATOM 1500 OE2 GLU A 92 7.083 -1.211 -17.559 1.00 0.00 O ATOM 0 H GLU A 92 2.230 0.995 -16.384 1.00 0.00 H new ATOM 0 HA GLU A 92 2.463 -1.741 -16.369 1.00 0.00 H new ATOM 0 HB2 GLU A 92 4.172 0.550 -15.979 1.00 0.00 H new ATOM 0 HB3 GLU A 92 4.610 -0.696 -14.827 1.00 0.00 H new ATOM 0 HG2 GLU A 92 4.362 -2.292 -16.977 1.00 0.00 H new ATOM 0 HG3 GLU A 92 4.654 -0.796 -17.843 1.00 0.00 H new ATOM 1507 N SER A 93 1.968 -0.504 -13.384 1.00 0.00 N ATOM 1508 CA SER A 93 1.639 -0.844 -12.010 1.00 0.00 C ATOM 1509 C SER A 93 0.531 -1.899 -11.984 1.00 0.00 C ATOM 1510 O SER A 93 0.586 -2.843 -11.196 1.00 0.00 O ATOM 1511 CB SER A 93 1.209 0.396 -11.224 1.00 0.00 C ATOM 1512 OG SER A 93 -0.142 0.306 -10.781 1.00 0.00 O ATOM 0 H SER A 93 1.906 0.490 -13.604 1.00 0.00 H new ATOM 0 HA SER A 93 2.532 -1.251 -11.535 1.00 0.00 H new ATOM 0 HB2 SER A 93 1.865 0.525 -10.363 1.00 0.00 H new ATOM 0 HB3 SER A 93 1.327 1.281 -11.850 1.00 0.00 H new ATOM 0 HG SER A 93 -0.743 0.583 -11.504 1.00 0.00 H new ATOM 1518 N LYS A 94 -0.449 -1.704 -12.854 1.00 0.00 N ATOM 1519 CA LYS A 94 -1.568 -2.627 -12.940 1.00 0.00 C ATOM 1520 C LYS A 94 -1.068 -3.981 -13.446 1.00 0.00 C ATOM 1521 O LYS A 94 -1.289 -5.008 -12.805 1.00 0.00 O ATOM 1522 CB LYS A 94 -2.692 -2.029 -13.789 1.00 0.00 C ATOM 1523 CG LYS A 94 -4.045 -2.179 -13.091 1.00 0.00 C ATOM 1524 CD LYS A 94 -4.960 -3.128 -13.868 1.00 0.00 C ATOM 1525 CE LYS A 94 -6.393 -2.593 -13.914 1.00 0.00 C ATOM 1526 NZ LYS A 94 -7.260 -3.503 -14.695 1.00 0.00 N ATOM 0 H LYS A 94 -0.491 -0.920 -13.506 1.00 0.00 H new ATOM 0 HA LYS A 94 -2.001 -2.795 -11.954 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.490 -0.974 -13.976 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -2.722 -2.524 -14.760 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -3.897 -2.558 -12.080 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -4.521 -1.203 -12.999 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -4.582 -3.254 -14.883 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -4.950 -4.112 -13.400 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -6.782 -2.490 -12.901 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -6.402 -1.599 -14.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -8.229 -3.126 -14.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -6.897 -3.580 -15.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -7.265 -4.444 -14.252 1.00 0.00 H new ATOM 1540 N GLU A 95 -0.405 -3.941 -14.593 1.00 0.00 N ATOM 1541 CA GLU A 95 0.128 -5.152 -15.193 1.00 0.00 C ATOM 1542 C GLU A 95 1.231 -5.740 -14.311 1.00 0.00 C ATOM 1543 O GLU A 95 1.647 -6.881 -14.509 1.00 0.00 O ATOM 1544 CB GLU A 95 0.642 -4.882 -16.608 1.00 0.00 C ATOM 1545 CG GLU A 95 2.137 -4.560 -16.596 1.00 0.00 C ATOM 1546 CD GLU A 95 2.974 -5.840 -16.664 1.00 0.00 C ATOM 1547 OE1 GLU A 95 2.632 -6.697 -17.506 1.00 0.00 O ATOM 1548 OE2 GLU A 95 3.937 -5.930 -15.873 1.00 0.00 O ATOM 0 H GLU A 95 -0.225 -3.088 -15.123 1.00 0.00 H new ATOM 0 HA GLU A 95 -0.678 -5.882 -15.268 1.00 0.00 H new ATOM 0 HB2 GLU A 95 0.459 -5.753 -17.238 1.00 0.00 H new ATOM 0 HB3 GLU A 95 0.091 -4.050 -17.046 1.00 0.00 H new ATOM 0 HG2 GLU A 95 2.381 -3.916 -17.441 1.00 0.00 H new ATOM 0 HG3 GLU A 95 2.386 -4.006 -15.691 1.00 0.00 H new ATOM 1555 N LEU A 96 1.675 -4.935 -13.357 1.00 0.00 N ATOM 1556 CA LEU A 96 2.722 -5.361 -12.445 1.00 0.00 C ATOM 1557 C LEU A 96 2.142 -6.358 -11.439 1.00 0.00 C ATOM 1558 O LEU A 96 2.884 -7.101 -10.799 1.00 0.00 O ATOM 1559 CB LEU A 96 3.391 -4.149 -11.793 1.00 0.00 C ATOM 1560 CG LEU A 96 4.790 -3.800 -12.303 1.00 0.00 C ATOM 1561 CD1 LEU A 96 4.891 -4.010 -13.815 1.00 0.00 C ATOM 1562 CD2 LEU A 96 5.184 -2.379 -11.894 1.00 0.00 C ATOM 0 H LEU A 96 1.328 -3.989 -13.196 1.00 0.00 H new ATOM 0 HA LEU A 96 3.513 -5.879 -12.988 1.00 0.00 H new ATOM 0 HB2 LEU A 96 2.747 -3.282 -11.937 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.451 -4.326 -10.719 1.00 0.00 H new ATOM 0 HG LEU A 96 5.503 -4.479 -11.836 1.00 0.00 H new ATOM 0 HD11 LEU A 96 5.896 -3.755 -14.151 1.00 0.00 H new ATOM 0 HD12 LEU A 96 4.683 -5.053 -14.052 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.166 -3.372 -14.320 1.00 0.00 H new ATOM 0 HD21 LEU A 96 6.183 -2.156 -12.269 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.472 -1.669 -12.314 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.178 -2.298 -10.807 1.00 0.00 H new ATOM 1574 N GLY A 97 0.821 -6.342 -11.333 1.00 0.00 N ATOM 1575 CA GLY A 97 0.134 -7.235 -10.416 1.00 0.00 C ATOM 1576 C GLY A 97 -0.424 -6.467 -9.217 1.00 0.00 C ATOM 1577 O GLY A 97 -0.718 -7.058 -8.179 1.00 0.00 O ATOM 0 H GLY A 97 0.209 -5.725 -11.867 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -0.678 -7.743 -10.937 1.00 0.00 H new ATOM 0 HA3 GLY A 97 0.822 -8.006 -10.070 1.00 0.00 H new ATOM 1581 N ALA A 98 -0.553 -5.161 -9.399 1.00 0.00 N ATOM 1582 CA ALA A 98 -1.071 -4.305 -8.344 1.00 0.00 C ATOM 1583 C ALA A 98 -2.589 -4.476 -8.254 1.00 0.00 C ATOM 1584 O ALA A 98 -3.275 -4.511 -9.274 1.00 0.00 O ATOM 1585 CB ALA A 98 -0.662 -2.856 -8.616 1.00 0.00 C ATOM 0 H ALA A 98 -0.308 -4.674 -10.261 1.00 0.00 H new ATOM 0 HA ALA A 98 -0.650 -4.587 -7.379 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -1.050 -2.214 -7.825 1.00 0.00 H new ATOM 0 HB2 ALA A 98 0.425 -2.783 -8.641 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -1.069 -2.537 -9.575 1.00 0.00 H new ATOM 1591 N LEU A 99 -3.068 -4.578 -7.023 1.00 0.00 N ATOM 1592 CA LEU A 99 -4.492 -4.744 -6.786 1.00 0.00 C ATOM 1593 C LEU A 99 -5.261 -3.666 -7.551 1.00 0.00 C ATOM 1594 O LEU A 99 -6.194 -3.972 -8.293 1.00 0.00 O ATOM 1595 CB LEU A 99 -4.787 -4.761 -5.285 1.00 0.00 C ATOM 1596 CG LEU A 99 -3.801 -5.546 -4.416 1.00 0.00 C ATOM 1597 CD1 LEU A 99 -3.192 -6.713 -5.196 1.00 0.00 C ATOM 1598 CD2 LEU A 99 -2.728 -4.623 -3.835 1.00 0.00 C ATOM 0 H LEU A 99 -2.496 -4.549 -6.179 1.00 0.00 H new ATOM 0 HA LEU A 99 -4.831 -5.708 -7.165 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -4.815 -3.731 -4.929 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -5.783 -5.177 -5.135 1.00 0.00 H new ATOM 0 HG LEU A 99 -4.349 -5.972 -3.576 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.495 -7.254 -4.556 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.985 -7.387 -5.521 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -2.661 -6.330 -6.068 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -2.040 -5.205 -3.222 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.177 -4.149 -4.647 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -3.201 -3.856 -3.221 1.00 0.00 H new ATOM 1610 N THR A 100 -4.842 -2.426 -7.345 1.00 0.00 N ATOM 1611 CA THR A 100 -5.480 -1.301 -8.007 1.00 0.00 C ATOM 1612 C THR A 100 -4.573 -0.070 -7.960 1.00 0.00 C ATOM 1613 O THR A 100 -3.572 -0.059 -7.245 1.00 0.00 O ATOM 1614 CB THR A 100 -6.843 -1.076 -7.349 1.00 0.00 C ATOM 1615 OG1 THR A 100 -7.308 0.143 -7.922 1.00 0.00 O ATOM 1616 CG2 THR A 100 -6.728 -0.767 -5.855 1.00 0.00 C ATOM 0 H THR A 100 -4.068 -2.176 -6.729 1.00 0.00 H new ATOM 0 HA THR A 100 -5.643 -1.506 -9.065 1.00 0.00 H new ATOM 0 HB THR A 100 -7.464 -1.960 -7.489 1.00 0.00 H new ATOM 0 HG1 THR A 100 -8.188 0.364 -7.552 1.00 0.00 H new ATOM 0 HG21 THR A 100 -7.723 -0.616 -5.437 1.00 0.00 H new ATOM 0 HG22 THR A 100 -6.244 -1.601 -5.347 1.00 0.00 H new ATOM 0 HG23 THR A 100 -6.135 0.137 -5.715 1.00 0.00 H new ATOM 1624 N HIS A 101 -4.955 0.938 -8.731 1.00 0.00 N ATOM 1625 CA HIS A 101 -4.188 2.171 -8.786 1.00 0.00 C ATOM 1626 C HIS A 101 -5.107 3.359 -8.497 1.00 0.00 C ATOM 1627 O HIS A 101 -6.133 3.530 -9.154 1.00 0.00 O ATOM 1628 CB HIS A 101 -3.458 2.297 -10.124 1.00 0.00 C ATOM 1629 CG HIS A 101 -4.277 1.857 -11.315 1.00 0.00 C ATOM 1630 ND1 HIS A 101 -5.628 1.792 -11.492 1.00 0.00 N flip ATOM 1631 CD2 HIS A 101 -3.706 1.419 -12.497 1.00 0.00 C flip ATOM 1632 CE1 HIS A 101 -5.869 1.341 -12.716 1.00 0.00 C flip ATOM 1633 NE2 HIS A 101 -4.679 1.108 -13.341 1.00 0.00 N flip ATOM 0 H HIS A 101 -5.786 0.926 -9.323 1.00 0.00 H new ATOM 0 HA HIS A 101 -3.415 2.158 -8.017 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -3.158 3.335 -10.266 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -2.545 1.704 -10.085 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -6.333 2.047 -10.801 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -2.647 1.343 -12.697 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -6.847 1.184 -13.147 1.00 0.00 H new ATOM 1641 N PHE A 102 -4.705 4.151 -7.514 1.00 0.00 N ATOM 1642 CA PHE A 102 -5.479 5.319 -7.130 1.00 0.00 C ATOM 1643 C PHE A 102 -4.808 6.606 -7.615 1.00 0.00 C ATOM 1644 O PHE A 102 -3.598 6.634 -7.837 1.00 0.00 O ATOM 1645 CB PHE A 102 -5.538 5.334 -5.601 1.00 0.00 C ATOM 1646 CG PHE A 102 -6.218 4.106 -4.992 1.00 0.00 C ATOM 1647 CD1 PHE A 102 -7.399 3.661 -5.500 1.00 0.00 C ATOM 1648 CD2 PHE A 102 -5.641 3.459 -3.944 1.00 0.00 C ATOM 1649 CE1 PHE A 102 -8.030 2.521 -4.935 1.00 0.00 C ATOM 1650 CE2 PHE A 102 -6.272 2.319 -3.379 1.00 0.00 C ATOM 1651 CZ PHE A 102 -7.453 1.874 -3.887 1.00 0.00 C ATOM 0 H PHE A 102 -3.853 4.007 -6.972 1.00 0.00 H new ATOM 0 HA PHE A 102 -6.473 5.269 -7.575 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -4.523 5.406 -5.209 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -6.069 6.229 -5.277 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -7.857 4.175 -6.333 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -4.703 3.812 -3.542 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -8.968 2.168 -5.337 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -5.814 1.805 -2.546 1.00 0.00 H new ATOM 0 HZ PHE A 102 -7.933 1.007 -3.458 1.00 0.00 H new ATOM 1661 N ALA A 103 -5.623 7.640 -7.766 1.00 0.00 N ATOM 1662 CA ALA A 103 -5.123 8.926 -8.220 1.00 0.00 C ATOM 1663 C ALA A 103 -4.931 9.849 -7.015 1.00 0.00 C ATOM 1664 O ALA A 103 -5.674 9.762 -6.038 1.00 0.00 O ATOM 1665 CB ALA A 103 -6.086 9.511 -9.256 1.00 0.00 C ATOM 0 H ALA A 103 -6.626 7.613 -7.582 1.00 0.00 H new ATOM 0 HA ALA A 103 -4.153 8.811 -8.704 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -5.711 10.476 -9.597 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -6.164 8.832 -10.105 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -7.070 9.643 -8.805 1.00 0.00 H new ATOM 1671 N LYS A 104 -3.932 10.712 -7.124 1.00 0.00 N ATOM 1672 CA LYS A 104 -3.634 11.650 -6.055 1.00 0.00 C ATOM 1673 C LYS A 104 -4.897 11.890 -5.225 1.00 0.00 C ATOM 1674 O LYS A 104 -4.914 11.625 -4.024 1.00 0.00 O ATOM 1675 CB LYS A 104 -3.019 12.932 -6.623 1.00 0.00 C ATOM 1676 CG LYS A 104 -1.576 13.105 -6.147 1.00 0.00 C ATOM 1677 CD LYS A 104 -0.922 14.320 -6.808 1.00 0.00 C ATOM 1678 CE LYS A 104 0.579 14.363 -6.515 1.00 0.00 C ATOM 1679 NZ LYS A 104 1.316 13.494 -7.459 1.00 0.00 N ATOM 0 H LYS A 104 -3.319 10.782 -7.936 1.00 0.00 H new ATOM 0 HA LYS A 104 -2.884 11.234 -5.382 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -3.045 12.901 -7.712 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -3.613 13.792 -6.315 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -1.558 13.223 -5.064 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -1.003 12.208 -6.379 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -1.085 14.284 -7.885 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -1.393 15.233 -6.445 1.00 0.00 H new ATOM 0 HE2 LYS A 104 0.942 15.388 -6.595 1.00 0.00 H new ATOM 0 HE3 LYS A 104 0.765 14.038 -5.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 1.968 12.881 -6.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 0.641 12.906 -7.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 1.857 14.083 -8.123 1.00 0.00 H new ATOM 1693 N PRO A 105 -5.950 12.401 -5.917 1.00 0.00 N ATOM 1694 CA PRO A 105 -7.215 12.679 -5.256 1.00 0.00 C ATOM 1695 C PRO A 105 -7.982 11.385 -4.975 1.00 0.00 C ATOM 1696 O PRO A 105 -8.786 10.945 -5.795 1.00 0.00 O ATOM 1697 CB PRO A 105 -7.953 13.615 -6.199 1.00 0.00 C ATOM 1698 CG PRO A 105 -7.282 13.457 -7.553 1.00 0.00 C ATOM 1699 CD PRO A 105 -5.966 12.727 -7.340 1.00 0.00 C ATOM 0 HA PRO A 105 -7.087 13.141 -4.277 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -9.011 13.358 -6.255 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -7.893 14.646 -5.851 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -7.923 12.897 -8.233 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -7.108 14.432 -8.009 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -5.908 11.828 -7.953 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -5.117 13.354 -7.612 1.00 0.00 H new ATOM 1707 N PHE A 106 -7.707 10.812 -3.812 1.00 0.00 N ATOM 1708 CA PHE A 106 -8.361 9.578 -3.412 1.00 0.00 C ATOM 1709 C PHE A 106 -8.987 9.715 -2.023 1.00 0.00 C ATOM 1710 O PHE A 106 -8.552 10.540 -1.221 1.00 0.00 O ATOM 1711 CB PHE A 106 -7.283 8.494 -3.368 1.00 0.00 C ATOM 1712 CG PHE A 106 -5.878 9.025 -3.072 1.00 0.00 C ATOM 1713 CD1 PHE A 106 -5.661 9.799 -1.975 1.00 0.00 C ATOM 1714 CD2 PHE A 106 -4.847 8.723 -3.906 1.00 0.00 C ATOM 1715 CE1 PHE A 106 -4.358 10.291 -1.700 1.00 0.00 C ATOM 1716 CE2 PHE A 106 -3.544 9.215 -3.631 1.00 0.00 C ATOM 1717 CZ PHE A 106 -3.327 9.989 -2.534 1.00 0.00 C ATOM 0 H PHE A 106 -7.040 11.180 -3.134 1.00 0.00 H new ATOM 0 HA PHE A 106 -9.156 9.333 -4.117 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -7.551 7.760 -2.608 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -7.269 7.971 -4.324 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -6.480 10.039 -1.313 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -5.020 8.109 -4.777 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -4.185 10.905 -0.829 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -2.725 8.975 -4.293 1.00 0.00 H new ATOM 0 HZ PHE A 106 -2.336 10.364 -2.325 1.00 0.00 H new ATOM 1727 N ASP A 107 -9.999 8.894 -1.782 1.00 0.00 N ATOM 1728 CA ASP A 107 -10.689 8.913 -0.503 1.00 0.00 C ATOM 1729 C ASP A 107 -10.437 7.592 0.227 1.00 0.00 C ATOM 1730 O ASP A 107 -10.362 6.536 -0.400 1.00 0.00 O ATOM 1731 CB ASP A 107 -12.199 9.066 -0.695 1.00 0.00 C ATOM 1732 CG ASP A 107 -12.865 10.098 0.218 1.00 0.00 C ATOM 1733 OD1 ASP A 107 -12.786 9.900 1.450 1.00 0.00 O ATOM 1734 OD2 ASP A 107 -13.438 11.060 -0.337 1.00 0.00 O ATOM 0 H ASP A 107 -10.357 8.212 -2.450 1.00 0.00 H new ATOM 0 HA ASP A 107 -10.311 9.758 0.072 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -12.392 9.342 -1.732 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -12.671 8.098 -0.529 1.00 0.00 H new ATOM 1739 N ILE A 108 -10.313 7.694 1.542 1.00 0.00 N ATOM 1740 CA ILE A 108 -10.071 6.521 2.364 1.00 0.00 C ATOM 1741 C ILE A 108 -11.326 5.645 2.378 1.00 0.00 C ATOM 1742 O ILE A 108 -11.232 4.420 2.324 1.00 0.00 O ATOM 1743 CB ILE A 108 -9.594 6.933 3.758 1.00 0.00 C ATOM 1744 CG1 ILE A 108 -8.166 6.445 4.015 1.00 0.00 C ATOM 1745 CG2 ILE A 108 -10.567 6.450 4.836 1.00 0.00 C ATOM 1746 CD1 ILE A 108 -8.030 4.955 3.700 1.00 0.00 C ATOM 0 H ILE A 108 -10.376 8.571 2.059 1.00 0.00 H new ATOM 0 HA ILE A 108 -9.266 5.919 1.941 1.00 0.00 H new ATOM 0 HB ILE A 108 -9.576 8.022 3.805 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -7.468 7.015 3.402 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -7.898 6.626 5.056 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -10.204 6.756 5.817 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -11.550 6.886 4.660 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -10.640 5.363 4.799 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -7.006 4.635 3.891 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -8.712 4.386 4.332 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -8.275 4.781 2.652 1.00 0.00 H new ATOM 1758 N ASP A 109 -12.471 6.308 2.449 1.00 0.00 N ATOM 1759 CA ASP A 109 -13.742 5.606 2.470 1.00 0.00 C ATOM 1760 C ASP A 109 -13.843 4.706 1.237 1.00 0.00 C ATOM 1761 O ASP A 109 -14.246 3.548 1.340 1.00 0.00 O ATOM 1762 CB ASP A 109 -14.915 6.588 2.436 1.00 0.00 C ATOM 1763 CG ASP A 109 -16.295 5.943 2.296 1.00 0.00 C ATOM 1764 OD1 ASP A 109 -16.708 5.731 1.136 1.00 0.00 O ATOM 1765 OD2 ASP A 109 -16.906 5.676 3.353 1.00 0.00 O ATOM 0 H ASP A 109 -12.544 7.324 2.493 1.00 0.00 H new ATOM 0 HA ASP A 109 -13.788 5.021 3.388 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -14.899 7.181 3.350 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -14.767 7.278 1.605 1.00 0.00 H new ATOM 1770 N GLU A 110 -13.471 5.272 0.099 1.00 0.00 N ATOM 1771 CA GLU A 110 -13.514 4.535 -1.153 1.00 0.00 C ATOM 1772 C GLU A 110 -12.435 3.451 -1.169 1.00 0.00 C ATOM 1773 O GLU A 110 -12.558 2.458 -1.885 1.00 0.00 O ATOM 1774 CB GLU A 110 -13.362 5.477 -2.349 1.00 0.00 C ATOM 1775 CG GLU A 110 -11.930 6.006 -2.452 1.00 0.00 C ATOM 1776 CD GLU A 110 -11.515 6.183 -3.914 1.00 0.00 C ATOM 1777 OE1 GLU A 110 -12.295 6.823 -4.652 1.00 0.00 O ATOM 1778 OE2 GLU A 110 -10.427 5.674 -4.260 1.00 0.00 O ATOM 0 H GLU A 110 -13.138 6.233 0.017 1.00 0.00 H new ATOM 0 HA GLU A 110 -14.488 4.052 -1.234 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -13.626 4.951 -3.266 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -14.056 6.312 -2.249 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -11.852 6.960 -1.930 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -11.247 5.316 -1.957 1.00 0.00 H new ATOM 1785 N ILE A 111 -11.402 3.677 -0.370 1.00 0.00 N ATOM 1786 CA ILE A 111 -10.303 2.732 -0.283 1.00 0.00 C ATOM 1787 C ILE A 111 -10.707 1.568 0.624 1.00 0.00 C ATOM 1788 O ILE A 111 -10.119 0.489 0.556 1.00 0.00 O ATOM 1789 CB ILE A 111 -9.021 3.440 0.160 1.00 0.00 C ATOM 1790 CG1 ILE A 111 -8.310 4.084 -1.032 1.00 0.00 C ATOM 1791 CG2 ILE A 111 -8.103 2.485 0.927 1.00 0.00 C ATOM 1792 CD1 ILE A 111 -7.304 5.138 -0.566 1.00 0.00 C ATOM 0 H ILE A 111 -11.304 4.501 0.223 1.00 0.00 H new ATOM 0 HA ILE A 111 -10.085 2.311 -1.264 1.00 0.00 H new ATOM 0 HB ILE A 111 -9.294 4.243 0.845 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -7.796 3.317 -1.611 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -9.045 4.544 -1.693 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -7.199 3.014 1.230 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -8.621 2.115 1.812 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -7.834 1.645 0.286 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -6.813 5.580 -1.433 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -7.825 5.916 -0.008 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -6.557 4.670 0.075 1.00 0.00 H new ATOM 1804 N ARG A 112 -11.708 1.825 1.453 1.00 0.00 N ATOM 1805 CA ARG A 112 -12.198 0.812 2.372 1.00 0.00 C ATOM 1806 C ARG A 112 -12.998 -0.250 1.615 1.00 0.00 C ATOM 1807 O ARG A 112 -13.197 -1.356 2.115 1.00 0.00 O ATOM 1808 CB ARG A 112 -13.084 1.433 3.454 1.00 0.00 C ATOM 1809 CG ARG A 112 -12.335 2.532 4.212 1.00 0.00 C ATOM 1810 CD ARG A 112 -12.743 2.556 5.687 1.00 0.00 C ATOM 1811 NE ARG A 112 -13.543 3.768 5.971 1.00 0.00 N ATOM 1812 CZ ARG A 112 -14.391 3.883 7.002 1.00 0.00 C ATOM 1813 NH1 ARG A 112 -14.554 2.861 7.853 1.00 0.00 N ATOM 1814 NH2 ARG A 112 -15.075 5.021 7.183 1.00 0.00 N ATOM 0 H ARG A 112 -12.193 2.721 1.507 1.00 0.00 H new ATOM 0 HA ARG A 112 -11.333 0.349 2.847 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -13.983 1.848 2.999 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -13.408 0.661 4.152 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -11.261 2.367 4.131 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -12.544 3.500 3.757 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -13.321 1.664 5.927 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -11.855 2.540 6.319 1.00 0.00 H new ATOM 0 HE ARG A 112 -13.443 4.565 5.343 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -14.032 1.995 7.716 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -15.200 2.949 8.638 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -14.950 5.800 6.536 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -15.721 5.109 7.968 1.00 0.00 H new ATOM 1828 N ASP A 113 -13.435 0.124 0.422 1.00 0.00 N ATOM 1829 CA ASP A 113 -14.209 -0.783 -0.409 1.00 0.00 C ATOM 1830 C ASP A 113 -13.270 -1.807 -1.050 1.00 0.00 C ATOM 1831 O ASP A 113 -13.571 -2.999 -1.078 1.00 0.00 O ATOM 1832 CB ASP A 113 -14.922 -0.028 -1.533 1.00 0.00 C ATOM 1833 CG ASP A 113 -16.436 -0.239 -1.594 1.00 0.00 C ATOM 1834 OD1 ASP A 113 -17.016 -0.509 -0.520 1.00 0.00 O ATOM 1835 OD2 ASP A 113 -16.979 -0.128 -2.715 1.00 0.00 O ATOM 0 H ASP A 113 -13.268 1.042 0.011 1.00 0.00 H new ATOM 0 HA ASP A 113 -14.950 -1.271 0.224 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -14.723 1.037 -1.418 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -14.489 -0.332 -2.486 1.00 0.00 H new ATOM 1840 N ALA A 114 -12.150 -1.304 -1.550 1.00 0.00 N ATOM 1841 CA ALA A 114 -11.166 -2.161 -2.189 1.00 0.00 C ATOM 1842 C ALA A 114 -10.510 -3.053 -1.133 1.00 0.00 C ATOM 1843 O ALA A 114 -10.258 -4.231 -1.380 1.00 0.00 O ATOM 1844 CB ALA A 114 -10.147 -1.298 -2.937 1.00 0.00 C ATOM 0 H ALA A 114 -11.903 -0.315 -1.525 1.00 0.00 H new ATOM 0 HA ALA A 114 -11.643 -2.813 -2.921 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -9.408 -1.940 -3.417 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -10.659 -0.705 -3.695 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -9.647 -0.633 -2.233 1.00 0.00 H new ATOM 1850 N VAL A 115 -10.252 -2.456 0.022 1.00 0.00 N ATOM 1851 CA VAL A 115 -9.630 -3.182 1.116 1.00 0.00 C ATOM 1852 C VAL A 115 -10.647 -4.153 1.721 1.00 0.00 C ATOM 1853 O VAL A 115 -10.282 -5.238 2.171 1.00 0.00 O ATOM 1854 CB VAL A 115 -9.061 -2.198 2.140 1.00 0.00 C ATOM 1855 CG1 VAL A 115 -8.327 -2.937 3.261 1.00 0.00 C ATOM 1856 CG2 VAL A 115 -8.144 -1.175 1.466 1.00 0.00 C ATOM 0 H VAL A 115 -10.462 -1.478 0.223 1.00 0.00 H new ATOM 0 HA VAL A 115 -8.790 -3.775 0.753 1.00 0.00 H new ATOM 0 HB VAL A 115 -9.896 -1.657 2.586 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -7.932 -2.215 3.975 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -9.020 -3.608 3.769 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -7.505 -3.515 2.838 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -7.753 -0.487 2.216 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -7.316 -1.692 0.981 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -8.709 -0.616 0.720 1.00 0.00 H new ATOM 1866 N LYS A 116 -11.901 -3.726 1.713 1.00 0.00 N ATOM 1867 CA LYS A 116 -12.973 -4.544 2.256 1.00 0.00 C ATOM 1868 C LYS A 116 -13.348 -5.625 1.240 1.00 0.00 C ATOM 1869 O LYS A 116 -13.965 -6.628 1.595 1.00 0.00 O ATOM 1870 CB LYS A 116 -14.151 -3.668 2.685 1.00 0.00 C ATOM 1871 CG LYS A 116 -15.291 -4.519 3.247 1.00 0.00 C ATOM 1872 CD LYS A 116 -16.587 -4.283 2.468 1.00 0.00 C ATOM 1873 CE LYS A 116 -16.740 -5.303 1.338 1.00 0.00 C ATOM 1874 NZ LYS A 116 -17.612 -4.766 0.269 1.00 0.00 N ATOM 0 H LYS A 116 -12.199 -2.825 1.339 1.00 0.00 H new ATOM 0 HA LYS A 116 -12.641 -5.056 3.159 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -13.821 -2.952 3.438 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -14.509 -3.091 1.832 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -15.020 -5.574 3.198 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -15.446 -4.278 4.299 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -17.440 -4.353 3.144 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -16.589 -3.274 2.055 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -15.761 -5.549 0.927 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -17.163 -6.228 1.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -17.705 -5.471 -0.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -18.551 -4.553 0.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -17.193 -3.896 -0.116 1.00 0.00 H new ATOM 1888 N LYS A 117 -12.961 -5.382 -0.004 1.00 0.00 N ATOM 1889 CA LYS A 117 -13.250 -6.322 -1.074 1.00 0.00 C ATOM 1890 C LYS A 117 -12.089 -7.310 -1.206 1.00 0.00 C ATOM 1891 O LYS A 117 -12.295 -8.474 -1.547 1.00 0.00 O ATOM 1892 CB LYS A 117 -13.573 -5.576 -2.370 1.00 0.00 C ATOM 1893 CG LYS A 117 -15.069 -5.272 -2.470 1.00 0.00 C ATOM 1894 CD LYS A 117 -15.385 -4.488 -3.745 1.00 0.00 C ATOM 1895 CE LYS A 117 -16.037 -3.144 -3.415 1.00 0.00 C ATOM 1896 NZ LYS A 117 -17.498 -3.206 -3.643 1.00 0.00 N ATOM 0 H LYS A 117 -12.450 -4.548 -0.295 1.00 0.00 H new ATOM 0 HA LYS A 117 -14.140 -6.905 -0.839 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -13.006 -4.646 -2.409 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -13.262 -6.175 -3.226 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -15.634 -6.204 -2.462 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -15.386 -4.699 -1.599 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -14.468 -4.322 -4.311 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -16.050 -5.073 -4.380 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -15.836 -2.881 -2.376 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -15.600 -2.360 -4.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -17.924 -2.285 -3.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -17.684 -3.436 -4.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -17.913 -3.941 -3.035 1.00 0.00 H new ATOM 1910 N TYR A 118 -10.893 -6.809 -0.929 1.00 0.00 N ATOM 1911 CA TYR A 118 -9.700 -7.633 -1.013 1.00 0.00 C ATOM 1912 C TYR A 118 -9.348 -8.230 0.351 1.00 0.00 C ATOM 1913 O TYR A 118 -9.033 -9.414 0.453 1.00 0.00 O ATOM 1914 CB TYR A 118 -8.572 -6.698 -1.453 1.00 0.00 C ATOM 1915 CG TYR A 118 -7.455 -7.394 -2.234 1.00 0.00 C ATOM 1916 CD1 TYR A 118 -6.863 -8.532 -1.725 1.00 0.00 C ATOM 1917 CD2 TYR A 118 -7.040 -6.884 -3.447 1.00 0.00 C ATOM 1918 CE1 TYR A 118 -5.812 -9.187 -2.459 1.00 0.00 C ATOM 1919 CE2 TYR A 118 -5.989 -7.539 -4.182 1.00 0.00 C ATOM 1920 CZ TYR A 118 -5.427 -8.658 -3.652 1.00 0.00 C ATOM 1921 OH TYR A 118 -4.434 -9.277 -4.346 1.00 0.00 O ATOM 0 H TYR A 118 -10.726 -5.843 -0.646 1.00 0.00 H new ATOM 0 HA TYR A 118 -9.853 -8.460 -1.707 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -8.992 -5.904 -2.070 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -8.143 -6.223 -0.571 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -7.188 -8.931 -0.776 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -7.503 -5.993 -3.845 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -5.340 -10.078 -2.072 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -5.655 -7.150 -5.133 1.00 0.00 H new ATOM 0 HH TYR A 118 -4.720 -9.416 -5.273 1.00 0.00 H new ATOM 1931 N LEU A 119 -9.414 -7.382 1.367 1.00 0.00 N ATOM 1932 CA LEU A 119 -9.107 -7.810 2.721 1.00 0.00 C ATOM 1933 C LEU A 119 -10.379 -7.756 3.569 1.00 0.00 C ATOM 1934 O LEU A 119 -11.350 -7.098 3.198 1.00 0.00 O ATOM 1935 CB LEU A 119 -7.951 -6.988 3.294 1.00 0.00 C ATOM 1936 CG LEU A 119 -6.544 -7.487 2.961 1.00 0.00 C ATOM 1937 CD1 LEU A 119 -6.275 -8.845 3.612 1.00 0.00 C ATOM 1938 CD2 LEU A 119 -6.318 -7.522 1.448 1.00 0.00 C ATOM 0 H LEU A 119 -9.676 -6.400 1.279 1.00 0.00 H new ATOM 0 HA LEU A 119 -8.764 -8.845 2.725 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -8.046 -5.964 2.934 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.057 -6.956 4.378 1.00 0.00 H new ATOM 0 HG LEU A 119 -5.825 -6.782 3.378 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -5.268 -9.177 3.359 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -6.366 -8.754 4.694 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -6.999 -9.573 3.247 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -5.310 -7.880 1.239 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -7.044 -8.192 0.987 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -6.439 -6.519 1.039 1.00 0.00 H new ATOM 1950 N PRO A 120 -10.332 -8.476 4.722 1.00 0.00 N ATOM 1951 CA PRO A 120 -11.469 -8.516 5.626 1.00 0.00 C ATOM 1952 C PRO A 120 -11.595 -7.207 6.408 1.00 0.00 C ATOM 1953 O PRO A 120 -11.553 -7.207 7.637 1.00 0.00 O ATOM 1954 CB PRO A 120 -11.219 -9.720 6.520 1.00 0.00 C ATOM 1955 CG PRO A 120 -9.736 -10.031 6.394 1.00 0.00 C ATOM 1956 CD PRO A 120 -9.200 -9.267 5.194 1.00 0.00 C ATOM 0 HA PRO A 120 -12.419 -8.616 5.102 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -11.486 -9.501 7.554 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -11.825 -10.571 6.208 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -9.206 -9.738 7.301 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -9.580 -11.102 6.265 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -8.361 -8.630 5.473 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -8.841 -9.946 4.420 1.00 0.00 H new ATOM 1964 N LEU A 121 -11.746 -6.122 5.663 1.00 0.00 N ATOM 1965 CA LEU A 121 -11.878 -4.809 6.270 1.00 0.00 C ATOM 1966 C LEU A 121 -13.354 -4.536 6.570 1.00 0.00 C ATOM 1967 O LEU A 121 -14.232 -5.237 6.070 1.00 0.00 O ATOM 1968 CB LEU A 121 -11.222 -3.743 5.391 1.00 0.00 C ATOM 1969 CG LEU A 121 -11.536 -2.289 5.751 1.00 0.00 C ATOM 1970 CD1 LEU A 121 -10.891 -1.904 7.084 1.00 0.00 C ATOM 1971 CD2 LEU A 121 -11.126 -1.343 4.621 1.00 0.00 C ATOM 0 H LEU A 121 -11.780 -6.126 4.644 1.00 0.00 H new ATOM 0 HA LEU A 121 -11.347 -4.775 7.221 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -10.142 -3.881 5.432 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -11.526 -3.914 4.358 1.00 0.00 H new ATOM 0 HG LEU A 121 -12.615 -2.193 5.875 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -11.129 -0.866 7.317 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -11.274 -2.550 7.874 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -9.810 -2.021 7.012 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -11.360 -0.316 4.903 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -10.055 -1.434 4.441 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -11.670 -1.603 3.713 1.00 0.00 H new ATOM 1983 N LYS A 122 -13.581 -3.516 7.384 1.00 0.00 N ATOM 1984 CA LYS A 122 -14.935 -3.142 7.756 1.00 0.00 C ATOM 1985 C LYS A 122 -15.777 -4.407 7.934 1.00 0.00 C ATOM 1986 O LYS A 122 -16.493 -4.814 7.020 1.00 0.00 O ATOM 1987 CB LYS A 122 -15.515 -2.154 6.743 1.00 0.00 C ATOM 1988 CG LYS A 122 -17.041 -2.257 6.688 1.00 0.00 C ATOM 1989 CD LYS A 122 -17.668 -0.913 6.313 1.00 0.00 C ATOM 1990 CE LYS A 122 -18.915 -1.112 5.449 1.00 0.00 C ATOM 1991 NZ LYS A 122 -18.538 -1.569 4.093 1.00 0.00 N ATOM 0 H LYS A 122 -12.850 -2.937 7.797 1.00 0.00 H new ATOM 0 HA LYS A 122 -14.938 -2.619 8.713 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -15.225 -1.139 7.013 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -15.098 -2.353 5.756 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -17.332 -3.014 5.960 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -17.422 -2.583 7.656 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -17.932 -0.366 7.218 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -16.941 -0.306 5.774 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -19.575 -1.844 5.915 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -19.472 -0.177 5.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -19.305 -1.348 3.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -17.668 -1.084 3.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -18.375 -2.596 4.106 1.00 0.00 H new ATOM 2005 N SER A 123 -15.665 -4.993 9.117 1.00 0.00 N ATOM 2006 CA SER A 123 -16.408 -6.202 9.427 1.00 0.00 C ATOM 2007 C SER A 123 -17.911 -5.919 9.383 1.00 0.00 C ATOM 2008 O SER A 123 -18.461 -5.325 10.308 1.00 0.00 O ATOM 2009 CB SER A 123 -16.012 -6.756 10.797 1.00 0.00 C ATOM 2010 OG SER A 123 -16.391 -5.882 11.856 1.00 0.00 O ATOM 0 H SER A 123 -15.070 -4.653 9.873 1.00 0.00 H new ATOM 0 HA SER A 123 -16.165 -6.954 8.677 1.00 0.00 H new ATOM 0 HB2 SER A 123 -16.481 -7.729 10.944 1.00 0.00 H new ATOM 0 HB3 SER A 123 -14.934 -6.915 10.826 1.00 0.00 H new ATOM 0 HG SER A 123 -17.193 -5.382 11.596 1.00 0.00 H new ATOM 2016 N ASN A 124 -18.532 -6.358 8.298 1.00 0.00 N ATOM 2017 CA ASN A 124 -19.960 -6.159 8.121 1.00 0.00 C ATOM 2018 C ASN A 124 -20.704 -7.422 8.559 1.00 0.00 C ATOM 2019 O ASN A 124 -21.796 -7.705 8.068 1.00 0.00 O ATOM 2020 CB ASN A 124 -20.302 -5.894 6.653 1.00 0.00 C ATOM 2021 CG ASN A 124 -21.123 -4.612 6.504 1.00 0.00 C ATOM 2022 OD1 ASN A 124 -21.920 -4.252 7.355 1.00 0.00 O ATOM 2023 ND2 ASN A 124 -20.886 -3.946 5.378 1.00 0.00 N ATOM 0 H ASN A 124 -18.072 -6.851 7.533 1.00 0.00 H new ATOM 0 HA ASN A 124 -20.258 -5.299 8.721 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -19.384 -5.812 6.071 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -20.861 -6.737 6.248 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -21.385 -3.078 5.184 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -20.205 -4.303 4.708 1.00 0.00 H new TER 2030 ASN A 124